A0A087YD08_POEFO Loading...

PHD finger protein 20, a

AlphaFold DB , UniProt , Accession A0A087YD08, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,001 aa.

						>A0A087YD08_POEFO|A0A087YD08
MSKTPPNRRGITFEVGAQLEARDSLKNWYAANIEKIDYDDEKVLIHYRQWSHRYDEWFDWTSPYLRPVERIQLRRQGLHDDSSPGFHVNDKVLASWSDCRFYPAKVISVNKDASYTVKFYDGVIQTVKGMHVKPYIKERGGAGGRSRSSDKNAVRRAPNRRERRPQENGCPKNKRARRSTSDQDEDSNSDDEEQEQGAVNDKNPKLNGVSEAEHATTKQESETSEPNDPADAEKGTGLTNGVKVEKDDEEETEGERRVNGDVKKEEEESEQSVTKPYTEPPKPYAEMQSELSAQTERDSVTTTTAESSGDAEQKPNVQSESAQPAADAPPPQLVKPVRKQGFHNPNRFSREPLYRVIKNQPPPVLSINLDHNPFKCGAPGCTKSFRKAKLLHYHMKYYHGEELPVEGPHSPTRSVQTRASDKQPAAAPGLDSSKRRRTISASMHSVGAAAAPRGDIKAAGRRTSAPPAVSTHSHQQRALLREKSKENQLDRNLCQLQDKDTDKICFDIGKPKEKPKQKDFLRIKLKKKKKKKKAKSENTGSEENIDISVLGLHSKLNLPLKFPLSHNHKPEAYPSRPGHSYTEQILVDDEDSISDWSTDSCGWSDDDFDMDLDVTTPPLSVDSGALDSTDQEIVRCICEVEEENDFMIQCEDCLCWQHGTCMGLMEDNVPDRYTCYICRDPPGQRQSLRYWYDREWLTNGHMYGLSFLEDNYSHQNAKKITTTHQLLGDVHHVVEILNGLQLKMSVLQSSTHPDLRLWQQPWKHFDRPRLGSDSCRGSNTAPSPLTPDEDMSRGEILMSNALEKLSRAATAAASAASSSSSSSSPFPSFQDSYITSEHCYQKPRTYYPAVEQRLVVETRQGSELEDSMRSTEELLEREQRFGSLLDMDRPKSTGNSNKALMGVSWLHAESREDDGRDLADNGQYQQWQINLLDHIDAVQDEVSHRMDFIERELDVLESWLDYTGELEPPEPLARLPQLKHRMKRLLTQLGKVQQISLYSST
					

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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	48.2	Very low	75.5	Confident	226 Å²	226	103.3 Å²	103.3	100%	1.113	55%	0.545	S	S	*	.				0	114.1	0	-68.4	-65.1	-168.5	0	0	106	K3	M1-K3 PolarHBondContact O-N 2.68Å
2	S	53	Low	76.6	Confident	100 Å²	100	101.4 Å²	101.4	70%	0.699	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-67	124.3	176.2	43.5	0	0	0	0	109.2
3	K	75.3	Confident	77.7	Confident	88 Å²	88	95.3 Å²	95.3	38%	0.383	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-74	138.9	-177.4	-55.3	171.4	-177.3	170.4	0	109.1	M1 Y38 D39 E41 W60	M1-K3 PolarHBondContact O-N 2.68Å; K3-Y38 WeakPolarHBondContact CB-O 3.46Å; K3-Y38 PolarHBondContact N-O 3Å; K3-Y38 WeakPolarHBondContact O-CD1 3.37Å; K3-D39 PolarHBondContact NZ-O 2.74Å; K3-E41 VanDerWaalsContact CD-CD 3.5Å; K3-E41 HydrophobicContact CD-CG 3.42Å; K3-E41 VanDerWaalsContact CD-CG 3.42Å; K3-E41 VanDerWaalsContact CD-OE1 3.24Å; K3-E41 WeakPolarHBondContact CD-OE1 3.27Å; K3-E41 WeakPolarHBondContact CE-OE1 3.07Å; K3-E41 IonicContact NZ-OE1 2.75Å; K3-E41 PolarHBondContact NZ-OE1 2.9Å; K3-W60 HydrophobicContact CB-CH2 4.01Å; K3-W60 HydrophobicContact CB-CZ2 3.89Å
4	T	79.5	Confident	78.6	Confident	125 Å²	125	97.9 Å²	97.9	77%	0.767	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-89.7	134.8	177	51.1	0	0	0	0	110.5
5	P	81.9	Confident	79.4	Confident	38 Å²	38	98.1 Å²	98.1	25%	0.247	52%	0.521	C	S	.	.	P	Polyproline II helix	trans	-57.3	146.4	179.1	-25.4	33.6	0	0	0	113.2	F13 Y38 W60	P5-F13 HydrophobicContact CB-CB 3.49Å; P5-F13 VanDerWaalsContact CB-CB 3.49Å; P5-F13 HydrophobicContact CB-CD2 4.12Å; P5-F13 HydrophobicContact CB-CG 3.89Å; P5-F13 HydrophobicContact CG-CB 4.08Å; P5-Y38 HydrophobicContact CG-CD1 4.16Å; P5-Y38 HydrophobicContact CG-CE1 3.64Å; P5-W60 HydrophobicContact CB-CD2 4.45Å; P5-W60 HydrophobicContact CB-CE3 4.04Å; P5-W60 HydrophobicContact CB-CZ3 4.22Å; P5-W60 HydrophobicContact CG-CE3 4.07Å; P5-W60 HydrophobicContact CG-CH2 4.38Å; P5-W60 HydrophobicContact CG-CZ3 3.8Å
6	P	81.4	Confident	80.1	Confident	35 Å²	35	94.7 Å²	94.7	23%	0.227	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-70.2	136.7	-175.1	28.1	-35.3	0	0	0	112	R8 F13 W60 T61	P6-R8 HydrophobicContact CB-CG 4.24Å; P6-R8 HydrophobicContact CG-CG 4.3Å; P6-R8 PolarHBondContact O-N 2.98Å; P6-F13 HydrophobicContact CG-CE2 4.02Å; P6-F13 HydrophobicContact CG-CZ 4.42Å; P6-F13 VanDerWaalsContact O-CD2 3.26Å; P6-F13 WeakPolarHBondContact O-CD2 3.45Å; P6-F13 VanDerWaalsContact O-CE2 3.24Å; P6-F13 WeakPolarHBondContact O-CE2 3.31Å; P6-W60 VanDerWaalsContact CD-CD1 3.49Å; P6-W60 VanDerWaalsContact CD-CG 3.42Å; P6-W60 HydrophobicContact CG-CB 4.19Å; P6-W60 HydrophobicContact CG-CG 3.95Å; P6-T61 HydrophobicContact CG-CG2 4.25Å
7	N	80.2	Confident	80.8	Confident	164 Å²	164	89.8 Å²	89.8	88%	0.877	49%	0.492	S	S	*	.			trans	-75.5	70	178.7	-171.7	-1	0	0	0	112
8	R	83.9	Confident	81.5	Confident	69 Å²	69	90.4 Å²	90.4	26%	0.26	49%	0.49	S	S	.	.			trans	-83.3	116.2	178.4	-64.1	180	67.8	-166.7	-1.8	110	P6 G10 I11 F13 W60 T61 S62 L65	P6-R8 HydrophobicContact CB-CG 4.24Å; P6-R8 HydrophobicContact CG-CG 4.3Å; P6-R8 PolarHBondContact O-N 2.98Å; R8-G10 PolarHBondContact O-N 2.84Å; R8-I11 HydrophobicContact CB-CB 4.39Å; R8-I11 HydrophobicContact CB-CD1 4.34Å; R8-I11 HydrophobicContact CB-CG1 4.48Å; R8-I11 PolarHBondContact O-N 2.82Å; R8-F13 HydrophobicContact CB-CE2 4.1Å; R8-F13 HydrophobicContact CG-CE2 4.18Å; R8-W60 WeakPolarHBondContact CD-O 3.26Å; R8-W60 PolarHBondContact NH1-O 3.33Å; R8-T61 VanDerWaalsContact NH1-C 3.34Å; R8-T61 PolarHBondContact NH1-O 3.32Å; R8-S62 PolarHBondContact NH1-O 3.16Å; R8-S62 PolarHBondContact NH2-O 2.84Å; R8-L65 PolarHBondContact NH2-O 3.17Å
9	R	78.5	Confident	82.2	Confident	232 Å²	232	85.7 Å²	85.7	88%	0.875	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	114.1	-176.2	-66.4	-173	-179.4	-154.5	2.3	111.9	P67	R9-P67 WeakPolarHBondContact O-CG 3.42Å
10	G	80.3	Confident	82.8	Confident	46 Å²	46	82.5 Å²	82.5	47%	0.474	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	-9.1	177.2	0	0	0	0	0	115.7	R8 P67	R8-G10 PolarHBondContact O-N 2.84Å; G10-P67 WeakPolarHBondContact O-CB 3.37Å
11	I	88.5	Confident	83.4	Confident	13 Å²	13	78.6 Å²	78.6	7%	0.067	43%	0.426	C	S	.	.			trans	-102.2	118.2	169.2	-49.4	179.9	0	0	0	108.2	R8 F13 L19 L65 P67	R8-I11 HydrophobicContact CB-CB 4.39Å; R8-I11 HydrophobicContact CB-CD1 4.34Å; R8-I11 HydrophobicContact CB-CG1 4.48Å; R8-I11 PolarHBondContact O-N 2.82Å; I11-F13 HydrophobicContact CB-CE2 4.08Å; I11-F13 HydrophobicContact CB-CZ 4.16Å; I11-F13 HydrophobicContact CD1-CZ 4.39Å; I11-F13 HydrophobicContact CG2-CD1 4.29Å; I11-F13 HydrophobicContact CG2-CD2 4.29Å; I11-F13 HydrophobicContact CG2-CE1 3.85Å; I11-F13 HydrophobicContact CG2-CE2 3.85Å; I11-F13 HydrophobicContact CG2-CG 4.49Å; I11-F13 HydrophobicContact CG2-CZ 3.59Å; I11-L19 HydrophobicContact CG2-CD2 4.13Å; I11-L65 HydrophobicContact CD1-CB 4.35Å; I11-P67 HydrophobicContact CG1-CG 3.86Å
12	T	88.8	Confident	85.5	Confident	81 Å²	81	71.6 Å²	71.6	50%	0.497	39%	0.387	S	S	.	.			trans	-92.2	113.3	169.5	48.1	0	0	0	0	108.5	E14 A17	T12-E14 VanDerWaalsContact C-N 3.25Å; T12-E14 PolarHBondContact O-N 2.64Å; T12-A17 WeakPolarHBondContact O-CB 3.44Å; T12-A17 WeakPolarHBondContact OG1-CB 3.49Å
13	F	90.4	Very high	87.3	Confident	22 Å²	22	68 Å²	68	10%	0.096	36%	0.36	C	S	.	.			trans	-81.7	72.9	177.7	-71.1	-74.1	0	0	0	111	P5 P6 R8 I11 I33 I36 V43 W60	P5-F13 HydrophobicContact CB-CB 3.49Å; P5-F13 VanDerWaalsContact CB-CB 3.49Å; P5-F13 HydrophobicContact CB-CD2 4.12Å; P5-F13 HydrophobicContact CB-CG 3.89Å; P5-F13 HydrophobicContact CG-CB 4.08Å; P6-F13 HydrophobicContact CG-CE2 4.02Å; P6-F13 HydrophobicContact CG-CZ 4.42Å; P6-F13 VanDerWaalsContact O-CD2 3.26Å; P6-F13 WeakPolarHBondContact O-CD2 3.45Å; P6-F13 VanDerWaalsContact O-CE2 3.24Å; P6-F13 WeakPolarHBondContact O-CE2 3.31Å; R8-F13 HydrophobicContact CB-CE2 4.1Å; R8-F13 HydrophobicContact CG-CE2 4.18Å; I11-F13 HydrophobicContact CB-CE2 4.08Å; I11-F13 HydrophobicContact CB-CZ 4.16Å; I11-F13 HydrophobicContact CD1-CZ 4.39Å; I11-F13 HydrophobicContact CG2-CD1 4.29Å; I11-F13 HydrophobicContact CG2-CD2 4.29Å; I11-F13 HydrophobicContact CG2-CE1 3.85Å; I11-F13 HydrophobicContact CG2-CE2 3.85Å; I11-F13 HydrophobicContact CG2-CG 4.49Å; I11-F13 HydrophobicContact CG2-CZ 3.59Å; F13-I33 HydrophobicContact CD1-CD1 4Å; F13-I36 VanDerWaalsContact C-CD1 3.49Å; F13-I36 HydrophobicContact CB-CD1 4.43Å; F13-I36 VanDerWaalsContact O-CD1 3.26Å; F13-I36 WeakPolarHBondContact O-CD1 3.06Å; F13-V43 HydrophobicContact CD1-CG1 4.08Å; F13-V43 HydrophobicContact CE1-CG1 4.45Å; F13-W60 HydrophobicContact CD1-CB 4.11Å; F13-W60 HydrophobicContact CE1-CB 3.73Å; F13-W60 HydrophobicContact CZ-CB 4.15Å; F13-W60 WeakPolarHBondContact CZ-O 3.48Å
14	E	89.9	Confident	87.7	Confident	131 Å²	131	68.7 Å²	68.7	61%	0.612	38%	0.375	S	S	*	.	S	Bend	trans	-129.6	146.4	177.2	-63.8	177.5	-175.7	0	0	109.8	T12 G16 A17	T12-E14 VanDerWaalsContact C-N 3.25Å; T12-E14 PolarHBondContact O-N 2.64Å; E14-G16 PolarHBondContact O-N 2.97Å; E14-A17 HydrophobicContact CB-CB 4.31Å; E14-A17 WeakPolarHBondContact O-CB 3.39Å; E14-A17 PolarHBondContact O-N 3.43Å
15	V	91.6	Very high	87.8	Confident	101 Å²	101	68.8 Å²	68.8	61%	0.612	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	127.3	174	169.4	0	0	0	0	109.8	E34 I36	V15-E34 VanDerWaalsContact CG1-O 3.24Å; V15-E34 WeakPolarHBondContact CG1-O 3.4Å; V15-I36 HydrophobicContact CG2-CD1 4.47Å; V15-I36 HydrophobicContact CG2-CG1 4.1Å
16	G	90.2	Very high	88	Confident	44 Å²	44	73 Å²	73	45%	0.454	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-7.7	-172.6	0	0	0	0	0	114.6	E14 N32 I33	E14-G16 PolarHBondContact O-N 2.97Å; G16-N32 PolarHBondContact O-ND2 2.9Å; G16-I33 WeakPolarHBondContact CA-O 3.14Å; G16-I33 PolarHBondContact N-O 3.47Å
17	A	92.5	Very high	88.4	Confident	12 Å²	12	75.1 Å²	75.1	10%	0.099	39%	0.394	C	S	.	.			trans	-62.3	151.5	175.8	0	0	0	0	0	112.3	T12 E14 N32 I33	T12-A17 WeakPolarHBondContact O-CB 3.44Å; T12-A17 WeakPolarHBondContact OG1-CB 3.49Å; E14-A17 HydrophobicContact CB-CB 4.31Å; E14-A17 WeakPolarHBondContact O-CB 3.39Å; E14-A17 PolarHBondContact O-N 3.43Å; A17-N32 CarbonylContact O-C 3.57Å; A17-N32 VanDerWaalsContact O-CA 3.27Å; A17-N32 WeakPolarHBondContact O-CA 3.39Å; A17-I33 HydrophobicContact CB-CD1 4.28Å; A17-I33 PolarHBondContact O-N 2.82Å
18	Q	93.3	Very high	89.1	Confident	100 Å²	100	71.4 Å²	71.4	47%	0.467	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.2	-177.8	-56.2	176	41.8	0	0	109.6	A31 V68	Q18-A31 WeakPolarHBondContact CA-O 3.11Å; Q18-V68 HydrophobicContact CB-CG2 3.79Å
19	L	94.1	Very high	89.5	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	179.4	174	57.7	73	0	0	0	109.6	I11 A21 A31 I33 I45 L65 R66	I11-L19 HydrophobicContact CG2-CD2 4.13Å; L19-A21 HydrophobicContact CD1-CB 4.01Å; L19-A31 HydrophobicContact CD1-CB 4.13Å; L19-A31 PolarHBondContact N-O 2.61Å; L19-A31 PolarHBondContact O-N 2.78Å; L19-I33 HydrophobicContact CD2-CD1 4.01Å; L19-I33 HydrophobicContact CD2-CG1 3.76Å; L19-I33 HydrophobicContact CG-CG1 4.41Å; L19-I45 HydrophobicContact CD1-CD1 4.18Å; L19-I45 HydrophobicContact CD1-CG2 4.31Å; L19-I45 HydrophobicContact CD2-CD1 3.95Å; L19-I45 HydrophobicContact CG-CD1 4.44Å; L19-L65 HydrophobicContact CD1-CD2 3.95Å; L19-L65 HydrophobicContact CD2-CD1 4.48Å; L19-L65 HydrophobicContact CD2-CD2 4.27Å; L19-R66 WeakPolarHBondContact CB-O 3.36Å
20	E	94.8	Very high	90.3	Very high	22 Å²	22	62.5 Å²	62.5	10%	0.103	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.5	164.8	-78.7	165	-144.7	0	0	109.1	W28 Y29 A30 R66 V68 E69	E20-W28 HydrophobicContact CB-CE3 4.24Å; E20-W28 WeakPolarHBondContact O-CZ3 3.34Å; E20-Y29 VanDerWaalsContact CA-O 3.31Å; E20-Y29 WeakPolarHBondContact CA-O 3.33Å; E20-A30 HydrophobicContact CG-CB 4.43Å; E20-R66 HydrophobicContact CB-CG 3.69Å; E20-R66 PolarHBondContact N-O 3.47Å; E20-R66 PolarHBondContact O-N 3.46Å; E20-R66 IonicContact OE2-CZ 3.28Å; E20-R66 IonicContact OE2-NE 2.67Å; E20-R66 PolarHBondContact OE2-NE 2.8Å; E20-R66 IonicContact OE2-NH2 3.15Å; E20-R66 PolarHBondContact OE2-NH2 3.26Å; E20-V68 WeakPolarHBondContact OE1-CA 3.34Å; E20-E69 PolarHBondContact OE1-N 3.01Å
21	A	95.1	Very high	91	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	149	179.3	0	0	0	0	0	110.2	L19 Y29 A31 I45 Y47 F58 Y64 L65	L19-A21 HydrophobicContact CD1-CB 4.01Å; A21-Y29 PolarHBondContact N-O 3.26Å; A21-Y29 PolarHBondContact O-N 3.25Å; A21-A31 HydrophobicContact CB-CB 4.16Å; A21-I45 HydrophobicContact CB-CG2 3.74Å; A21-Y47 HydrophobicContact CB-CE1 3.9Å; A21-F58 HydrophobicContact CB-CE2 4.47Å; A21-F58 HydrophobicContact CB-CZ 4.46Å; A21-Y64 CarbonylContact C-O 3.54Å; A21-Y64 VanDerWaalsContact CA-O 3.3Å; A21-Y64 WeakPolarHBondContact CA-O 3.48Å; A21-L65 HydrophobicContact CB-CD2 3.98Å
22	R	93	Very high	91.3	Very high	80 Å²	80	61.4 Å²	61.4	30%	0.302	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116.9	-179.2	-158.1	-172.6	-166.4	-179.4	4.7	110.7	K26 N27 W28 Y64	R22-K26 PolarHBondContact NE-O 2.89Å; R22-K26 PolarHBondContact NH2-O 2.86Å; R22-N27 CarbonylContact C-O 3.51Å; R22-N27 VanDerWaalsContact CA-O 3.3Å; R22-N27 WeakPolarHBondContact CA-O 3.18Å; R22-N27 WeakPolarHBondContact CG-O 3.26Å; R22-W28 HydrophobicContact CB-CD2 4.01Å; R22-W28 HydrophobicContact CB-CE3 3.82Å; R22-W28 HydrophobicContact CB-CH2 4.01Å; R22-W28 HydrophobicContact CB-CZ2 4.17Å; R22-W28 HydrophobicContact CB-CZ3 3.83Å; R22-W28 HydrophobicContact CG-CD2 4.09Å; R22-W28 HydrophobicContact CG-CE3 4.42Å; R22-W28 HydrophobicContact CG-CZ2 4.3Å; R22-Y64 HydrophobicContact CB-CD1 4.19Å; R22-Y64 HydrophobicContact CB-CG 4.42Å; R22-Y64 PolarHBondContact N-O 3.41Å
23	D	89.4	Confident	91.7	Very high	25 Å²	25	57.6 Å²	57.6	13%	0.134	30%	0.304	C	S	.	.			trans	-68.8	157.8	172.7	165.2	38.2	0	0	0	111.2	L25 K26 N27 Y29	D23-L25 PolarHBondContact O-N 2.81Å; D23-L25 VanDerWaalsContact O-N 3.11Å; D23-L25 WeakPolarHBondContact OD2-CB 3.26Å; D23-K26 WeakPolarHBondContact O-CA 3.44Å; D23-K26 PolarHBondContact O-N 2.92Å; D23-N27 PolarHBondContact N-O 2.89Å; D23-Y29 HydrophobicContact CB-CD2 3.79Å; D23-Y29 HydrophobicContact CB-CE2 3.6Å
24	S	83.6	Confident	91.9	Very high	101 Å²	101	59.5 Å²	59.5	71%	0.706	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40	-40.5	168.9	63.8	0	0	0	0	114.2	K26	S24-K26 PolarHBondContact O-N 2.79Å
25	L	82.6	Confident	92	Very high	128 Å²	128	58 Å²	58	67%	0.67	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	17.8	176.2	-59.1	178.3	0	0	0	113.7	D23 N27	D23-L25 PolarHBondContact O-N 2.81Å; D23-L25 VanDerWaalsContact O-N 3.11Å; D23-L25 WeakPolarHBondContact OD2-CB 3.26Å; L25-N27 PolarHBondContact O-N 3.39Å; L25-N27 VanDerWaalsContact O-N 3.07Å; L25-N27 PolarHBondContact O-ND2 3.31Å
26	K	86.2	Confident	92.1	Very high	127 Å²	127	54.2 Å²	54.2	55%	0.552	28%	0.281	S	S	*	.	S	Bend	trans	61.8	8.6	179.3	-65.6	179.1	-178.3	176.6	0	115.2	R22 D23 S24	R22-K26 PolarHBondContact NE-O 2.89Å; R22-K26 PolarHBondContact NH2-O 2.86Å; D23-K26 WeakPolarHBondContact O-CA 3.44Å; D23-K26 PolarHBondContact O-N 2.92Å; S24-K26 PolarHBondContact O-N 2.79Å
27	N	90.5	Very high	92.2	Very high	78 Å²	78	54.7 Å²	54.7	42%	0.417	27%	0.273	S	S	.	.			trans	-83.7	145	178.4	-68.1	-57.8	0	0	0	112.2	R22 D23 L25 Y29	R22-N27 CarbonylContact C-O 3.51Å; R22-N27 VanDerWaalsContact CA-O 3.3Å; R22-N27 WeakPolarHBondContact CA-O 3.18Å; R22-N27 WeakPolarHBondContact CG-O 3.26Å; D23-N27 PolarHBondContact N-O 2.89Å; L25-N27 PolarHBondContact O-N 3.39Å; L25-N27 VanDerWaalsContact O-N 3.07Å; L25-N27 PolarHBondContact O-ND2 3.31Å; N27-Y29 HydrophobicContact CB-CE2 3.8Å
28	W	93.4	Very high	92.1	Very high	86 Å²	86	58.9 Å²	58.9	33%	0.326	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	129.7	175.1	-69.2	99.6	0	0	0	111.2	E20 R22 P63 Y64 R66	E20-W28 HydrophobicContact CB-CE3 4.24Å; E20-W28 WeakPolarHBondContact O-CZ3 3.34Å; R22-W28 HydrophobicContact CB-CD2 4.01Å; R22-W28 HydrophobicContact CB-CE3 3.82Å; R22-W28 HydrophobicContact CB-CH2 4.01Å; R22-W28 HydrophobicContact CB-CZ2 4.17Å; R22-W28 HydrophobicContact CB-CZ3 3.83Å; R22-W28 HydrophobicContact CG-CD2 4.09Å; R22-W28 HydrophobicContact CG-CE3 4.42Å; R22-W28 HydrophobicContact CG-CZ2 4.3Å; W28-P63 WeakPolarHBondContact CH2-O 3.35Å; W28-Y64 WeakPolarHBondContact CZ3-O 3.37Å; W28-R66 HydrophobicContact CD2-CG 4.36Å; W28-R66 HydrophobicContact CE3-CG 3.7Å; W28-R66 HydrophobicContact CH2-CB 4Å; W28-R66 HydrophobicContact CH2-CG 3.96Å; W28-R66 HydrophobicContact CZ3-CB 3.87Å; W28-R66 HydrophobicContact CZ3-CG 3.47Å; W28-R66 VanDerWaalsContact CZ3-CG 3.47Å
29	Y	93.3	Very high	91.8	Very high	73 Å²	73	59.6 Å²	59.6	29%	0.286	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.8	178.7	-63.7	-63.5	0	0	0	111	E20 A21 D23 N27 A31 Y47 W50	E20-Y29 VanDerWaalsContact CA-O 3.31Å; E20-Y29 WeakPolarHBondContact CA-O 3.33Å; A21-Y29 PolarHBondContact N-O 3.26Å; A21-Y29 PolarHBondContact O-N 3.25Å; D23-Y29 HydrophobicContact CB-CD2 3.79Å; D23-Y29 HydrophobicContact CB-CE2 3.6Å; N27-Y29 HydrophobicContact CB-CE2 3.8Å; Y29-A31 PolarHBondContact O-N 2.83Å; Y29-Y47 HydrophobicContact CD2-CD1 4.32Å; Y29-Y47 HydrophobicContact CD2-CE1 4.32Å; Y29-Y47 HydrophobicContact CG-CD1 4.49Å; Y29-W50 HydrophobicContact CD1-CZ2 4.31Å; Y29-W50 HydrophobicContact CD2-CH2 4.22Å; Y29-W50 AromaticContact CD2-CZ2 3.96Å; Y29-W50 HydrophobicContact CD2-CZ2 3.96Å; Y29-W50 HydrophobicContact CE1-CZ2 4.05Å; Y29-W50 AromaticContact CE2-CH2 3.78Å; Y29-W50 HydrophobicContact CE2-CH2 3.78Å; Y29-W50 AromaticContact CE2-CZ2 3.66Å; Y29-W50 HydrophobicContact CE2-CZ2 3.66Å; Y29-W50 HydrophobicContact CG-CZ2 4.28Å; Y29-W50 AromaticContact CZ-CZ2 3.72Å
30	A	94.4	Very high	91.5	Very high	41 Å²	41	64.7 Å²	64.7	34%	0.339	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	129.1	173	0	0	0	0	0	109.8	E20 R48	E20-A30 HydrophobicContact CG-CB 4.43Å; A30-R48 WeakPolarHBondContact O-CB 3.2Å; A30-R48 VanDerWaalsContact O-CG 3.27Å; A30-R48 WeakPolarHBondContact O-CG 3.35Å; A30-R48 PolarHBondContact O-N 2.99Å
31	A	95.6	Very high	91.3	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	169.6	-172.3	0	0	0	0	0	111.7	Q18 L19 A21 Y29 I45 H46 Y47	Q18-A31 WeakPolarHBondContact CA-O 3.11Å; L19-A31 HydrophobicContact CD1-CB 4.13Å; L19-A31 PolarHBondContact N-O 2.61Å; L19-A31 PolarHBondContact O-N 2.78Å; A21-A31 HydrophobicContact CB-CB 4.16Å; Y29-A31 PolarHBondContact O-N 2.83Å; A31-I45 HydrophobicContact CB-CG2 3.45Å; A31-I45 VanDerWaalsContact CB-CG2 3.45Å; A31-H46 CarbonylContact C-O 3.57Å; A31-H46 VanDerWaalsContact CA-O 3.29Å; A31-H46 WeakPolarHBondContact CA-O 3.46Å; A31-H46 WeakPolarHBondContact CB-O 3.4Å; A31-Y47 HydrophobicContact CB-CD1 4.39Å
32	N	95.4	Very high	91.3	Very high	36 Å²	36	70 Å²	70	19%	0.193	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142	178	-89	74.6	0	0	0	109.7	G16 A17 E34 H46 R48	G16-N32 PolarHBondContact O-ND2 2.9Å; A17-N32 CarbonylContact O-C 3.57Å; A17-N32 VanDerWaalsContact O-CA 3.27Å; A17-N32 WeakPolarHBondContact O-CA 3.39Å; N32-E34 PolarHBondContact O-N 2.99Å; N32-H46 PolarHBondContact N-O 2.87Å; N32-H46 PolarHBondContact O-N 3.25Å; N32-R48 PolarHBondContact OD1-NE 3.06Å; N32-R48 PolarHBondContact OD1-NH2 3.38Å
33	I	95.5	Very high	91.4	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	120	164.9	-59.8	179.9	0	0	0	107.8	F13 G16 A17 L19 K35 I36 V43 I45	F13-I33 HydrophobicContact CD1-CD1 4Å; G16-I33 WeakPolarHBondContact CA-O 3.14Å; G16-I33 PolarHBondContact N-O 3.47Å; A17-I33 HydrophobicContact CB-CD1 4.28Å; A17-I33 PolarHBondContact O-N 2.82Å; L19-I33 HydrophobicContact CD2-CD1 4.01Å; L19-I33 HydrophobicContact CD2-CG1 3.76Å; L19-I33 HydrophobicContact CG-CG1 4.41Å; I33-K35 WeakPolarHBondContact CG2-O 3.39Å; I33-I36 HydrophobicContact CG2-CD1 4.26Å; I33-I36 HydrophobicContact CG2-CG1 3.71Å; I33-V43 HydrophobicContact CG2-CB 4.34Å; I33-V43 HydrophobicContact CG2-CG1 4.46Å; I33-I45 HydrophobicContact CG1-CD1 3.87Å
34	E	94.9	Very high	91.7	Very high	63 Å²	63	65.7 Å²	65.7	29%	0.294	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-39.5	173	-163.8	-168.4	102	0	0	112	V15 N32 L44 H52	V15-E34 VanDerWaalsContact CG1-O 3.24Å; V15-E34 WeakPolarHBondContact CG1-O 3.4Å; N32-E34 PolarHBondContact O-N 2.99Å; E34-L44 HydrophobicContact CB-CD2 4.33Å; E34-L44 HydrophobicContact CB-CG 4.39Å; E34-L44 PolarHBondContact N-O 2.87Å; E34-H52 IonicContact OE2-CE1 2.71Å; E34-H52 PolarHBondContact OE2-CE1 3.15Å; E34-H52 IonicContact OE2-ND1 3.85Å; E34-H52 PolarHBondContact OE2-ND1 2.75Å; E34-H52 VanDerWaalsContact OE2-ND1 3.14Å
35	K	93	Very high	92.3	Very high	100 Å²	100	60.9 Å²	60.9	44%	0.435	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	157.3	179.1	-57.4	-172	-175.1	75.4	0	110.8	I33 V43 L44 W57	I33-K35 WeakPolarHBondContact CG2-O 3.39Å; K35-V43 CarbonylContact O-C 3.6Å; K35-V43 WeakPolarHBondContact O-CA 3.44Å; K35-L44 HydrophobicContact CB-CB 3.93Å; K35-L44 HydrophobicContact CB-CD2 4.37Å; K35-L44 HydrophobicContact CD-CD2 4.13Å; K35-L44 HydrophobicContact CG-CD2 4.1Å; K35-L44 PolarHBondContact O-N 3.39Å; K35-W57 HydrophobicContact CB-CH2 3.99Å
36	I	94.3	Very high	92.9	Very high	21 Å²	21	56.6 Å²	56.6	11%	0.108	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.5	173.3	-52.9	-176.8	0	0	0	106.8	F13 V15 I33 Y38 V43 W60	F13-I36 VanDerWaalsContact C-CD1 3.49Å; F13-I36 HydrophobicContact CB-CD1 4.43Å; F13-I36 VanDerWaalsContact O-CD1 3.26Å; F13-I36 WeakPolarHBondContact O-CD1 3.06Å; V15-I36 HydrophobicContact CG2-CD1 4.47Å; V15-I36 HydrophobicContact CG2-CG1 4.1Å; I33-I36 HydrophobicContact CG2-CD1 4.26Å; I33-I36 HydrophobicContact CG2-CG1 3.71Å; I36-Y38 HydrophobicContact CB-CE2 3.96Å; I36-Y38 HydrophobicContact CG2-CD1 4.24Å; I36-Y38 HydrophobicContact CG2-CD2 4.18Å; I36-Y38 HydrophobicContact CG2-CE1 3.93Å; I36-Y38 HydrophobicContact CG2-CE2 3.84Å; I36-Y38 HydrophobicContact CG2-CG 4.37Å; I36-V43 HydrophobicContact CB-CG1 4.4Å; I36-V43 HydrophobicContact CG1-CG1 4.03Å; I36-V43 HydrophobicContact CG2-CG1 4.13Å; I36-W60 HydrophobicContact CG2-CE3 4Å; I36-W60 HydrophobicContact CG2-CZ3 3.88Å
37	D	92.3	Very high	93.3	Very high	53 Å²	53	50.8 Å²	50.8	28%	0.283	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	120.9	168.8	-161.4	-58.1	0	0	0	108.9	D39 D40 E41 K42 W57 W60	D37-D39 PolarHBondContact OD1-N 3.38Å; D37-D40 HydrophobicContact CB-CB 4.36Å; D37-D40 PolarHBondContact OD1-N 3.24Å; D37-E41 PolarHBondContact O-N 2.85Å; D37-K42 PolarHBondContact N-O 3.21Å; D37-K42 PolarHBondContact O-N 2.81Å; D37-W57 HydrophobicContact CB-CH2 4.29Å; D37-W57 HydrophobicContact CB-CZ3 4.02Å; D37-W60 WeakPolarHBondContact O-CZ3 3.28Å
38	Y	90.3	Very high	93.4	Very high	100 Å²	100	51.4 Å²	51.4	39%	0.392	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.8	-173.9	-64.4	-90.7	0	0	0	113.3	K3 P5 I36 W60	K3-Y38 WeakPolarHBondContact CB-O 3.46Å; K3-Y38 PolarHBondContact N-O 3Å; K3-Y38 WeakPolarHBondContact O-CD1 3.37Å; P5-Y38 HydrophobicContact CG-CD1 4.16Å; P5-Y38 HydrophobicContact CG-CE1 3.64Å; I36-Y38 HydrophobicContact CB-CE2 3.96Å; I36-Y38 HydrophobicContact CG2-CD1 4.24Å; I36-Y38 HydrophobicContact CG2-CD2 4.18Å; I36-Y38 HydrophobicContact CG2-CE1 3.93Å; I36-Y38 HydrophobicContact CG2-CE2 3.84Å; I36-Y38 HydrophobicContact CG2-CG 4.37Å; Y38-W60 HydrophobicContact CD1-CH2 4.11Å; Y38-W60 AromaticContact CD1-CZ3 3.85Å; Y38-W60 HydrophobicContact CD1-CZ3 3.85Å; Y38-W60 HydrophobicContact CE1-CZ3 4.43Å; Y38-W60 HydrophobicContact CG-CZ3 4.39Å
39	D	87.2	Confident	93.3	Very high	116 Å²	116	57 Å²	57	62%	0.62	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-47.8	177.2	-65.7	-45.3	0	0	0	109.2	K3 D37	K3-D39 PolarHBondContact NZ-O 2.74Å; D37-D39 PolarHBondContact OD1-N 3.38Å
40	D	87	Confident	93.2	Very high	108 Å²	108	57.9 Å²	57.9	58%	0.578	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-5.2	178.5	-92.4	10.5	0	0	0	114.8	D37 K42	D37-D40 HydrophobicContact CB-CB 4.36Å; D37-D40 PolarHBondContact OD1-N 3.24Å; D40-K42 HydrophobicContact CB-CD 4.17Å; D40-K42 WeakPolarHBondContact O-CE 3.25Å; D40-K42 WeakPolarHBondContact O-CG 3.37Å
41	E	91.4	Very high	93.1	Very high	68 Å²	68	58.1 Å²	58.1	32%	0.318	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	29.4	178.3	-60.8	-162.1	-129.8	0	0	116	K3 D37 D59 W60	K3-E41 VanDerWaalsContact CD-CD 3.5Å; K3-E41 HydrophobicContact CD-CG 3.42Å; K3-E41 VanDerWaalsContact CD-CG 3.42Å; K3-E41 VanDerWaalsContact CD-OE1 3.24Å; K3-E41 WeakPolarHBondContact CD-OE1 3.27Å; K3-E41 WeakPolarHBondContact CE-OE1 3.07Å; K3-E41 IonicContact NZ-OE1 2.75Å; K3-E41 PolarHBondContact NZ-OE1 2.9Å; D37-E41 PolarHBondContact O-N 2.85Å; E41-D59 WeakPolarHBondContact O-CA 3.34Å; E41-W60 HydrophobicContact CB-CD2 4.23Å; E41-W60 HydrophobicContact CB-CZ2 3.87Å; E41-W60 HydrophobicContact CG-CH2 4.39Å; E41-W60 HydrophobicContact CG-CZ2 3.56Å; E41-W60 VanDerWaalsContact O-CG 3.31Å; E41-W60 PolarHBondContact O-N 3.42Å; E41-W60 PolarHBondContact OE2-NE1 3.26Å
42	K	93.3	Very high	92.9	Very high	64 Å²	64	64 Å²	64	28%	0.278	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	156.9	-169.8	-67.7	166.1	-154	-61.5	0	113.1	D37 D40 W57 F58 D59	D37-K42 PolarHBondContact N-O 3.21Å; D37-K42 PolarHBondContact O-N 2.81Å; D40-K42 HydrophobicContact CB-CD 4.17Å; D40-K42 WeakPolarHBondContact O-CE 3.25Å; D40-K42 WeakPolarHBondContact O-CG 3.37Å; K42-W57 HydrophobicContact CB-CE3 3.75Å; K42-W57 HydrophobicContact CB-CZ3 4.26Å; K42-F58 CarbonylContact C-O 3.48Å; K42-F58 VanDerWaalsContact CA-O 3.27Å; K42-F58 WeakPolarHBondContact CA-O 3.39Å; K42-D59 IonicContact NZ-OD1 3.39Å; K42-D59 PolarHBondContact NZ-OD1 3.41Å
43	V	95.1	Very high	92.6	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.5	174	-68.3	0	0	0	0	109.9	F13 I33 K35 I36 I45 W57 F58 W60 L65	F13-V43 HydrophobicContact CD1-CG1 4.08Å; F13-V43 HydrophobicContact CE1-CG1 4.45Å; I33-V43 HydrophobicContact CG2-CB 4.34Å; I33-V43 HydrophobicContact CG2-CG1 4.46Å; K35-V43 CarbonylContact O-C 3.6Å; K35-V43 WeakPolarHBondContact O-CA 3.44Å; I36-V43 HydrophobicContact CB-CG1 4.4Å; I36-V43 HydrophobicContact CG1-CG1 4.03Å; I36-V43 HydrophobicContact CG2-CG1 4.13Å; V43-I45 HydrophobicContact CB-CD1 4.11Å; V43-I45 HydrophobicContact CG2-CD1 3.72Å; V43-I45 HydrophobicContact CG2-CG1 4.2Å; V43-W57 VanDerWaalsContact C-CE3 3.43Å; V43-W57 WeakPolarHBondContact O-CA 3.44Å; V43-F58 HydrophobicContact CG2-CB 4.3Å; V43-F58 WeakPolarHBondContact CG2-O 3.37Å; V43-F58 PolarHBondContact N-O 2.89Å; V43-F58 PolarHBondContact O-N 3.05Å; V43-W60 HydrophobicContact CG1-CB 4.28Å; V43-L65 HydrophobicContact CG2-CD1 3.59Å
44	L	96.2	Very high	92.4	Very high	16 Å²	16	77.8 Å²	77.8	8%	0.084	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119.8	173.8	-178.8	62.2	0	0	0	108	E34 K35 D55 W57	E34-L44 HydrophobicContact CB-CD2 4.33Å; E34-L44 HydrophobicContact CB-CG 4.39Å; E34-L44 PolarHBondContact N-O 2.87Å; K35-L44 HydrophobicContact CB-CB 3.93Å; K35-L44 HydrophobicContact CB-CD2 4.37Å; K35-L44 HydrophobicContact CD-CD2 4.13Å; K35-L44 HydrophobicContact CG-CD2 4.1Å; K35-L44 PolarHBondContact O-N 3.39Å; L44-D55 HydrophobicContact CD1-CB 3.94Å; L44-D55 HydrophobicContact CG-CB 4.39Å; L44-W57 HydrophobicContact CB-CD2 3.9Å; L44-W57 HydrophobicContact CB-CE3 3.79Å; L44-W57 HydrophobicContact CB-CH2 3.95Å; L44-W57 HydrophobicContact CB-CZ2 4.01Å; L44-W57 HydrophobicContact CB-CZ3 3.83Å; L44-W57 HydrophobicContact CD1-CD2 4.09Å; L44-W57 HydrophobicContact CD1-CG 4.12Å; L44-W57 HydrophobicContact CD2-CZ2 4.38Å; L44-W57 VanDerWaalsContact N-CE3 3.27Å
45	I	96.7	Very high	92.3	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.1	-174.7	-59.5	-52.5	0	0	0	110.2	L19 A21 A31 I33 V43 D55 E56 F58 L65	L19-I45 HydrophobicContact CD1-CD1 4.18Å; L19-I45 HydrophobicContact CD1-CG2 4.31Å; L19-I45 HydrophobicContact CD2-CD1 3.95Å; L19-I45 HydrophobicContact CG-CD1 4.44Å; A21-I45 HydrophobicContact CB-CG2 3.74Å; A31-I45 HydrophobicContact CB-CG2 3.45Å; A31-I45 VanDerWaalsContact CB-CG2 3.45Å; I33-I45 HydrophobicContact CG1-CD1 3.87Å; V43-I45 HydrophobicContact CB-CD1 4.11Å; V43-I45 HydrophobicContact CG2-CD1 3.72Å; V43-I45 HydrophobicContact CG2-CG1 4.2Å; I45-D55 VanDerWaalsContact O-CA 3.27Å; I45-D55 WeakPolarHBondContact O-CA 3.38Å; I45-E56 PolarHBondContact N-O 3.36Å; I45-E56 PolarHBondContact O-N 3.14Å; I45-E56 VanDerWaalsContact O-N 3.08Å; I45-F58 HydrophobicContact CB-CD2 3.88Å; I45-F58 HydrophobicContact CB-CE2 4.1Å; I45-F58 HydrophobicContact CG1-CB 4.39Å; I45-F58 HydrophobicContact CG1-CD2 3.52Å; I45-F58 HydrophobicContact CG1-CE2 4.17Å; I45-F58 HydrophobicContact CG1-CG 4.27Å; I45-L65 HydrophobicContact CD1-CD2 4.22Å; I45-L65 HydrophobicContact CG1-CD2 3.93Å
46	H	95.8	Very high	92.4	Very high	38 Å²	38	75.5 Å²	75.5	18%	0.176	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	114.8	173.8	174.5	65.5	0	0	0	110.8	A31 N32 W50 H52 D55	A31-H46 CarbonylContact C-O 3.57Å; A31-H46 VanDerWaalsContact CA-O 3.29Å; A31-H46 WeakPolarHBondContact CA-O 3.46Å; A31-H46 WeakPolarHBondContact CB-O 3.4Å; N32-H46 PolarHBondContact N-O 2.87Å; N32-H46 PolarHBondContact O-N 3.25Å; H46-W50 PolarHBondContact CE1-O 3.24Å; H46-H52 AromaticContact CE1-CE1 3.97Å; H46-H52 AromaticContact CE1-ND1 3.95Å; H46-H52 AromaticContact ND1-CE1 3.82Å; H46-H52 AromaticContact ND1-ND1 3.55Å; H46-D55 WeakPolarHBondContact CA-OD1 3.4Å; H46-D55 IonicContact CE1-OD1 2.67Å; H46-D55 IonicContact CG-OD1 3.05Å; H46-D55 IonicContact ND1-OD1 3.33Å; H46-D55 PolarHBondContact ND1-OD1 2.79Å; H46-D55 IonicContact ND1-OD2 2.69Å; H46-D55 PolarHBondContact ND1-OD2 2.64Å
47	Y	94.3	Very high	92.4	Very high	4 Å²	4	80.6 Å²	80.6	2%	0.016	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	126.2	177.9	-65.7	-81.8	0	0	0	111.5	A21 Y29 A31 Q49 W50 Y54 E56 F58	A21-Y47 HydrophobicContact CB-CE1 3.9Å; Y29-Y47 HydrophobicContact CD2-CD1 4.32Å; Y29-Y47 HydrophobicContact CD2-CE1 4.32Å; Y29-Y47 HydrophobicContact CG-CD1 4.49Å; A31-Y47 HydrophobicContact CB-CD1 4.39Å; Y47-Q49 PolarHBondContact O-N 2.93Å; Y47-W50 WeakPolarHBondContact O-CB 3.46Å; Y47-W50 PolarHBondContact O-N 3.02Å; Y47-W50 VanDerWaalsContact O-N 3.15Å; Y47-Y54 WeakPolarHBondContact CD2-O 3.44Å; Y47-Y54 VanDerWaalsContact CE2-O 3.31Å; Y47-Y54 WeakPolarHBondContact CE2-O 3.32Å; Y47-E56 HydrophobicContact CE2-CB 4.33Å; Y47-E56 PolarHBondContact OH-OE2 3.3Å; Y47-F58 WeakPolarHBondContact OH-CZ 3.36Å
48	R	91.6	Very high	92.5	Very high	92 Å²	92	78.8 Å²	78.8	35%	0.347	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	134.6	-174	-71.4	174.8	148.7	-168.3	-15	112	A30 N32 W50	A30-R48 WeakPolarHBondContact O-CB 3.2Å; A30-R48 VanDerWaalsContact O-CG 3.27Å; A30-R48 WeakPolarHBondContact O-CG 3.35Å; A30-R48 PolarHBondContact O-N 2.99Å; N32-R48 PolarHBondContact OD1-NE 3.06Å; N32-R48 PolarHBondContact OD1-NH2 3.38Å; R48-W50 VanDerWaalsContact O-CD1 3.27Å; R48-W50 PolarHBondContact O-N 3.49Å
49	Q	91	Very high	92.6	Very high	202 Å²	202	77.2 Å²	77.2	94%	0.944	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	4.4	-177.5	-44.7	174.7	22	0	0	114.2	Y47	Y47-Q49 PolarHBondContact O-N 2.93Å
50	W	91.6	Very high	92.8	Very high	92 Å²	92	71.9 Å²	71.9	35%	0.348	32%	0.32	S	S	.	.	S	Bend	trans	-97.8	170.2	174.6	-64.1	36.9	0	0	0	109.6	Y29 H46 Y47 R48 Y54	Y29-W50 HydrophobicContact CD1-CZ2 4.31Å; Y29-W50 HydrophobicContact CD2-CH2 4.22Å; Y29-W50 AromaticContact CD2-CZ2 3.96Å; Y29-W50 HydrophobicContact CD2-CZ2 3.96Å; Y29-W50 HydrophobicContact CE1-CZ2 4.05Å; Y29-W50 AromaticContact CE2-CH2 3.78Å; Y29-W50 HydrophobicContact CE2-CH2 3.78Å; Y29-W50 AromaticContact CE2-CZ2 3.66Å; Y29-W50 HydrophobicContact CE2-CZ2 3.66Å; Y29-W50 HydrophobicContact CG-CZ2 4.28Å; Y29-W50 AromaticContact CZ-CZ2 3.72Å; H46-W50 PolarHBondContact CE1-O 3.24Å; Y47-W50 WeakPolarHBondContact O-CB 3.46Å; Y47-W50 PolarHBondContact O-N 3.02Å; Y47-W50 VanDerWaalsContact O-N 3.15Å; R48-W50 VanDerWaalsContact O-CD1 3.27Å; R48-W50 PolarHBondContact O-N 3.49Å; W50-Y54 HydrophobicContact CB-CD2 4.18Å; W50-Y54 HydrophobicContact CE3-CD1 4.25Å; W50-Y54 AromaticContact CE3-CD2 3.97Å; W50-Y54 HydrophobicContact CE3-CD2 3.97Å; W50-Y54 AromaticContact CE3-CG 3.78Å; W50-Y54 HydrophobicContact CE3-CG 3.78Å; W50-Y54 HydrophobicContact CZ3-CD1 4.44Å; W50-Y54 HydrophobicContact CZ3-CG 4.4Å
51	S	92.7	Very high	92.8	Very high	47 Å²	47	70.9 Å²	70.9	33%	0.329	32%	0.318	S	S	.	.			trans	-85.2	148.6	174.3	76	0	0	0	0	111.4	R53 Y54	S51-R53 PolarHBondContact O-N 2.86Å; S51-Y54 VanDerWaalsContact O-CD2 3.31Å; S51-Y54 WeakPolarHBondContact O-CD2 3.45Å; S51-Y54 PolarHBondContact O-N 3.24Å; S51-Y54 WeakPolarHBondContact OG-CD2 3.34Å; S51-Y54 WeakPolarHBondContact OG-CE2 3.24Å
52	H	91	Very high	92.8	Very high	122 Å²	122	68.1 Å²	68.1	57%	0.565	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-52.4	-10	175.1	-72.4	-76.4	0	0	0	116.4	E34 H46 Y54 D55	E34-H52 IonicContact OE2-CE1 2.71Å; E34-H52 PolarHBondContact OE2-CE1 3.15Å; E34-H52 IonicContact OE2-ND1 3.85Å; E34-H52 PolarHBondContact OE2-ND1 2.75Å; E34-H52 VanDerWaalsContact OE2-ND1 3.14Å; H46-H52 AromaticContact CE1-CE1 3.97Å; H46-H52 AromaticContact CE1-ND1 3.95Å; H46-H52 AromaticContact ND1-CE1 3.82Å; H46-H52 AromaticContact ND1-ND1 3.55Å; H52-Y54 PolarHBondContact O-N 2.89Å; H52-D55 WeakPolarHBondContact CA-OD1 3.2Å; H52-D55 VanDerWaalsContact CA-OD2 3.29Å; H52-D55 WeakPolarHBondContact CA-OD2 3.33Å; H52-D55 WeakPolarHBondContact CB-OD2 3.48Å; H52-D55 IonicContact CE1-OD2 3.47Å; H52-D55 IonicContact CG-OD2 2.64Å; H52-D55 IonicContact ND1-OD2 3.4Å; H52-D55 PolarHBondContact ND1-OD2 2.59Å; H52-D55 VanDerWaalsContact O-CG 3.31Å; H52-D55 PolarHBondContact O-N 2.87Å
53	R	90.1	Very high	92.6	Very high	209 Å²	209	69.7 Å²	69.7	79%	0.789	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-73.8	-6.2	171.3	-54	-175	-57.6	170.5	9	114.1	S51	S51-R53 PolarHBondContact O-N 2.86Å
54	Y	90.3	Very high	92.4	Very high	119 Å²	119	75.2 Å²	75.2	47%	0.467	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-107.8	10	174.4	-58.1	-73.8	0	0	0	111.7	Y47 W50 S51 H52	Y47-Y54 WeakPolarHBondContact CD2-O 3.44Å; Y47-Y54 VanDerWaalsContact CE2-O 3.31Å; Y47-Y54 WeakPolarHBondContact CE2-O 3.32Å; W50-Y54 HydrophobicContact CB-CD2 4.18Å; W50-Y54 HydrophobicContact CE3-CD1 4.25Å; W50-Y54 AromaticContact CE3-CD2 3.97Å; W50-Y54 HydrophobicContact CE3-CD2 3.97Å; W50-Y54 AromaticContact CE3-CG 3.78Å; W50-Y54 HydrophobicContact CE3-CG 3.78Å; W50-Y54 HydrophobicContact CZ3-CD1 4.44Å; W50-Y54 HydrophobicContact CZ3-CG 4.4Å; S51-Y54 VanDerWaalsContact O-CD2 3.31Å; S51-Y54 WeakPolarHBondContact O-CD2 3.45Å; S51-Y54 PolarHBondContact O-N 3.24Å; S51-Y54 WeakPolarHBondContact OG-CD2 3.34Å; S51-Y54 WeakPolarHBondContact OG-CE2 3.24Å; H52-Y54 PolarHBondContact O-N 2.89Å
55	D	93.7	Very high	92.3	Very high	34 Å²	34	74.5 Å²	74.5	18%	0.182	34%	0.341	C	S	.	.			trans	-76.2	130.6	-179.1	-60.4	-8.1	0	0	0	109.9	L44 I45 H46 H52	L44-D55 HydrophobicContact CD1-CB 3.94Å; L44-D55 HydrophobicContact CG-CB 4.39Å; I45-D55 VanDerWaalsContact O-CA 3.27Å; I45-D55 WeakPolarHBondContact O-CA 3.38Å; H46-D55 WeakPolarHBondContact CA-OD1 3.4Å; H46-D55 IonicContact CE1-OD1 2.67Å; H46-D55 IonicContact CG-OD1 3.05Å; H46-D55 IonicContact ND1-OD1 3.33Å; H46-D55 PolarHBondContact ND1-OD1 2.79Å; H46-D55 IonicContact ND1-OD2 2.69Å; H46-D55 PolarHBondContact ND1-OD2 2.64Å; H52-D55 WeakPolarHBondContact CA-OD1 3.2Å; H52-D55 VanDerWaalsContact CA-OD2 3.29Å; H52-D55 WeakPolarHBondContact CA-OD2 3.33Å; H52-D55 WeakPolarHBondContact CB-OD2 3.48Å; H52-D55 IonicContact CE1-OD2 3.47Å; H52-D55 IonicContact CG-OD2 2.64Å; H52-D55 IonicContact ND1-OD2 3.4Å; H52-D55 PolarHBondContact ND1-OD2 2.59Å; H52-D55 VanDerWaalsContact O-CG 3.31Å; H52-D55 PolarHBondContact O-N 2.87Å
56	E	94.3	Very high	92	Very high	81 Å²	81	78.2 Å²	78.2	38%	0.379	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.4	-161.3	-179.5	173.3	-151.3	0	0	110.7	I45 Y47 F58	I45-E56 PolarHBondContact N-O 3.36Å; I45-E56 PolarHBondContact O-N 3.14Å; I45-E56 VanDerWaalsContact O-N 3.08Å; Y47-E56 HydrophobicContact CE2-CB 4.33Å; Y47-E56 PolarHBondContact OH-OE2 3.3Å; E56-F58 HydrophobicContact CB-CD2 4.35Å; E56-F58 HydrophobicContact CB-CE2 3.82Å; E56-F58 HydrophobicContact CG-CD2 4.11Å; E56-F58 HydrophobicContact CG-CE2 3.6Å; E56-F58 HydrophobicContact CG-CZ 4.11Å; E56-F58 WeakPolarHBondContact OE2-CE2 3.22Å; E56-F58 VanDerWaalsContact OE2-CZ 3.29Å; E56-F58 WeakPolarHBondContact OE2-CZ 3.47Å
57	W	95.1	Very high	91.8	Very high	128 Å²	128	78.6 Å²	78.6	49%	0.485	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	117.4	178.3	-74.8	104.6	0	0	0	110.5	K35 D37 K42 V43 L44	K35-W57 HydrophobicContact CB-CH2 3.99Å; D37-W57 HydrophobicContact CB-CH2 4.29Å; D37-W57 HydrophobicContact CB-CZ3 4.02Å; K42-W57 HydrophobicContact CB-CE3 3.75Å; K42-W57 HydrophobicContact CB-CZ3 4.26Å; V43-W57 VanDerWaalsContact C-CE3 3.43Å; V43-W57 WeakPolarHBondContact O-CA 3.44Å; L44-W57 HydrophobicContact CB-CD2 3.9Å; L44-W57 HydrophobicContact CB-CE3 3.79Å; L44-W57 HydrophobicContact CB-CH2 3.95Å; L44-W57 HydrophobicContact CB-CZ2 4.01Å; L44-W57 HydrophobicContact CB-CZ3 3.83Å; L44-W57 HydrophobicContact CD1-CD2 4.09Å; L44-W57 HydrophobicContact CD1-CG 4.12Å; L44-W57 HydrophobicContact CD2-CZ2 4.38Å; L44-W57 VanDerWaalsContact N-CE3 3.27Å
58	F	94.4	Very high	91.4	Very high	14 Å²	14	80.5 Å²	80.5	6%	0.061	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	146.2	174.1	-72	-98.3	0	0	0	110.3	A21 K42 V43 I45 Y47 E56 L65	A21-F58 HydrophobicContact CB-CE2 4.47Å; A21-F58 HydrophobicContact CB-CZ 4.46Å; K42-F58 CarbonylContact C-O 3.48Å; K42-F58 VanDerWaalsContact CA-O 3.27Å; K42-F58 WeakPolarHBondContact CA-O 3.39Å; V43-F58 HydrophobicContact CG2-CB 4.3Å; V43-F58 WeakPolarHBondContact CG2-O 3.37Å; V43-F58 PolarHBondContact N-O 2.89Å; V43-F58 PolarHBondContact O-N 3.05Å; I45-F58 HydrophobicContact CB-CD2 3.88Å; I45-F58 HydrophobicContact CB-CE2 4.1Å; I45-F58 HydrophobicContact CG1-CB 4.39Å; I45-F58 HydrophobicContact CG1-CD2 3.52Å; I45-F58 HydrophobicContact CG1-CE2 4.17Å; I45-F58 HydrophobicContact CG1-CG 4.27Å; Y47-F58 WeakPolarHBondContact OH-CZ 3.36Å; E56-F58 HydrophobicContact CB-CD2 4.35Å; E56-F58 HydrophobicContact CB-CE2 3.82Å; E56-F58 HydrophobicContact CG-CD2 4.11Å; E56-F58 HydrophobicContact CG-CE2 3.6Å; E56-F58 HydrophobicContact CG-CZ 4.11Å; E56-F58 WeakPolarHBondContact OE2-CE2 3.22Å; E56-F58 VanDerWaalsContact OE2-CZ 3.29Å; E56-F58 WeakPolarHBondContact OE2-CZ 3.47Å; F58-L65 HydrophobicContact CB-CD1 3.89Å; F58-L65 HydrophobicContact CB-CD2 4.02Å; F58-L65 HydrophobicContact CB-CG 4.09Å; F58-L65 HydrophobicContact CD1-CD2 4.08Å; F58-L65 HydrophobicContact CD1-CG 4.38Å; F58-L65 HydrophobicContact CD2-CD2 4.2Å; F58-L65 HydrophobicContact CG-CD2 3.85Å; F58-L65 HydrophobicContact CG-CG 4.31Å
59	D	92.7	Very high	90.4	Very high	68 Å²	68	80.2 Å²	80.2	36%	0.364	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	141.4	166.3	-50.7	-60.3	0	0	0	110.2	E41 K42 T61 S62	E41-D59 WeakPolarHBondContact O-CA 3.34Å; K42-D59 IonicContact NZ-OD1 3.39Å; K42-D59 PolarHBondContact NZ-OD1 3.41Å; D59-T61 PolarHBondContact O-N 3.22Å; D59-T61 VanDerWaalsContact O-N 3.15Å; D59-S62 WeakPolarHBondContact O-CB 3.47Å; D59-S62 PolarHBondContact O-N 3.23Å
60	W	90.1	Very high	88.4	Confident	3 Å²	3	79.9 Å²	79.9	1%	0.011	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20.8	-178.3	53.1	26.5	0	0	0	113.8	K3 P5 P6 R8 F13 I36 D37 Y38 E41 V43	K3-W60 HydrophobicContact CB-CH2 4.01Å; K3-W60 HydrophobicContact CB-CZ2 3.89Å; P5-W60 HydrophobicContact CB-CD2 4.45Å; P5-W60 HydrophobicContact CB-CE3 4.04Å; P5-W60 HydrophobicContact CB-CZ3 4.22Å; P5-W60 HydrophobicContact CG-CE3 4.07Å; P5-W60 HydrophobicContact CG-CH2 4.38Å; P5-W60 HydrophobicContact CG-CZ3 3.8Å; P6-W60 VanDerWaalsContact CD-CD1 3.49Å; P6-W60 VanDerWaalsContact CD-CG 3.42Å; P6-W60 HydrophobicContact CG-CB 4.19Å; P6-W60 HydrophobicContact CG-CG 3.95Å; R8-W60 WeakPolarHBondContact CD-O 3.26Å; R8-W60 PolarHBondContact NH1-O 3.33Å; F13-W60 HydrophobicContact CD1-CB 4.11Å; F13-W60 HydrophobicContact CE1-CB 3.73Å; F13-W60 HydrophobicContact CZ-CB 4.15Å; F13-W60 WeakPolarHBondContact CZ-O 3.48Å; I36-W60 HydrophobicContact CG2-CE3 4Å; I36-W60 HydrophobicContact CG2-CZ3 3.88Å; D37-W60 WeakPolarHBondContact O-CZ3 3.28Å; Y38-W60 HydrophobicContact CD1-CH2 4.11Å; Y38-W60 AromaticContact CD1-CZ3 3.85Å; Y38-W60 HydrophobicContact CD1-CZ3 3.85Å; Y38-W60 HydrophobicContact CE1-CZ3 4.43Å; Y38-W60 HydrophobicContact CG-CZ3 4.39Å; E41-W60 HydrophobicContact CB-CD2 4.23Å; E41-W60 HydrophobicContact CB-CZ2 3.87Å; E41-W60 HydrophobicContact CG-CH2 4.39Å; E41-W60 HydrophobicContact CG-CZ2 3.56Å; E41-W60 VanDerWaalsContact O-CG 3.31Å; E41-W60 PolarHBondContact O-N 3.42Å; E41-W60 PolarHBondContact OE2-NE1 3.26Å; V43-W60 HydrophobicContact CG1-CB 4.28Å
61	T	88.1	Confident	86.2	Confident	87 Å²	87	82 Å²	82	53%	0.534	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-11.3	171.5	41.8	0	0	0	0	113.5	P6 R8 D59	P6-T61 HydrophobicContact CG-CG2 4.25Å; R8-T61 VanDerWaalsContact NH1-C 3.34Å; R8-T61 PolarHBondContact NH1-O 3.32Å; D59-T61 PolarHBondContact O-N 3.22Å; D59-T61 VanDerWaalsContact O-N 3.15Å
62	S	90.5	Very high	83.6	Confident	11 Å²	11	86.4 Å²	86.4	8%	0.077	40%	0.398	C	S	.	.			trans	-53.9	133.9	-168.1	-179.8	0	0	0	0	113.4	R8 D59 Y64 L65	R8-S62 PolarHBondContact NH1-O 3.16Å; R8-S62 PolarHBondContact NH2-O 2.84Å; D59-S62 WeakPolarHBondContact O-CB 3.47Å; D59-S62 PolarHBondContact O-N 3.23Å; S62-Y64 PolarHBondContact O-N 2.99Å; S62-Y64 PolarHBondContact OG-N 3.33Å; S62-L65 PolarHBondContact O-N 2.94Å; S62-L65 VanDerWaalsContact O-N 3.16Å
63	P	88.9	Confident	81.1	Confident	97 Å²	97	89.3 Å²	89.3	63%	0.63	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.3	175.2	30.6	-36.6	0	0	0	112.4	W28 L65	W28-P63 WeakPolarHBondContact CH2-O 3.35Å; P63-L65 VanDerWaalsContact C-N 3.25Å; P63-L65 PolarHBondContact O-N 3.23Å
64	Y	92.1	Very high	78.6	Confident	116 Å²	116	90.5 Å²	90.5	46%	0.455	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	2.6	175.7	-53.2	-45.4	0	0	0	113.5	A21 R22 W28 S62	A21-Y64 CarbonylContact C-O 3.54Å; A21-Y64 VanDerWaalsContact CA-O 3.3Å; A21-Y64 WeakPolarHBondContact CA-O 3.48Å; R22-Y64 HydrophobicContact CB-CD1 4.19Å; R22-Y64 HydrophobicContact CB-CG 4.42Å; R22-Y64 PolarHBondContact N-O 3.41Å; W28-Y64 WeakPolarHBondContact CZ3-O 3.37Å; S62-Y64 PolarHBondContact O-N 2.99Å; S62-Y64 PolarHBondContact OG-N 3.33Å
65	L	92.8	Very high	76.2	Confident	1 Å²	1	95.4 Å²	95.4	1%	0.005	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.4	168.4	-56	179	0	0	0	109.8	R8 I11 L19 A21 V43 I45 F58 S62 P63	R8-L65 PolarHBondContact NH2-O 3.17Å; I11-L65 HydrophobicContact CD1-CB 4.35Å; L19-L65 HydrophobicContact CD1-CD2 3.95Å; L19-L65 HydrophobicContact CD2-CD1 4.48Å; L19-L65 HydrophobicContact CD2-CD2 4.27Å; A21-L65 HydrophobicContact CB-CD2 3.98Å; V43-L65 HydrophobicContact CG2-CD1 3.59Å; I45-L65 HydrophobicContact CD1-CD2 4.22Å; I45-L65 HydrophobicContact CG1-CD2 3.93Å; F58-L65 HydrophobicContact CB-CD1 3.89Å; F58-L65 HydrophobicContact CB-CD2 4.02Å; F58-L65 HydrophobicContact CB-CG 4.09Å; F58-L65 HydrophobicContact CD1-CD2 4.08Å; F58-L65 HydrophobicContact CD1-CG 4.38Å; F58-L65 HydrophobicContact CD2-CD2 4.2Å; F58-L65 HydrophobicContact CG-CD2 3.85Å; F58-L65 HydrophobicContact CG-CG 4.31Å; S62-L65 PolarHBondContact O-N 2.94Å; S62-L65 VanDerWaalsContact O-N 3.16Å; P63-L65 VanDerWaalsContact C-N 3.25Å; P63-L65 PolarHBondContact O-N 3.23Å
66	R	92.3	Very high	73.3	Confident	77 Å²	77	102.6 Å²	102.6	29%	0.291	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	157.1	175.1	76.3	-176.3	-164.9	154.7	16.6	111.5	L19 E20 W28 E69	L19-R66 WeakPolarHBondContact CB-O 3.36Å; E20-R66 HydrophobicContact CB-CG 3.69Å; E20-R66 PolarHBondContact N-O 3.47Å; E20-R66 PolarHBondContact O-N 3.46Å; E20-R66 IonicContact OE2-CZ 3.28Å; E20-R66 IonicContact OE2-NE 2.67Å; E20-R66 PolarHBondContact OE2-NE 2.8Å; E20-R66 IonicContact OE2-NH2 3.15Å; E20-R66 PolarHBondContact OE2-NH2 3.26Å; W28-R66 HydrophobicContact CD2-CG 4.36Å; W28-R66 HydrophobicContact CE3-CG 3.7Å; W28-R66 HydrophobicContact CH2-CB 4Å; W28-R66 HydrophobicContact CH2-CG 3.96Å; W28-R66 HydrophobicContact CZ3-CB 3.87Å; W28-R66 HydrophobicContact CZ3-CG 3.47Å; W28-R66 VanDerWaalsContact CZ3-CG 3.47Å; R66-E69 IonicContact CZ-OE2 3.76Å; R66-E69 IonicContact NH1-OE2 3.31Å; R66-E69 IonicContact NH2-OE2 3.49Å; R66-E69 PolarHBondContact NH2-OE2 3.3Å
67	P	90.3	Very high	70.3	Confident	47 Å²	47	102.3 Å²	102.3	31%	0.305	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	147.2	169.6	-24.6	34.3	0	0	0	111.4	R9 G10 I11 E69	R9-P67 WeakPolarHBondContact O-CG 3.42Å; G10-P67 WeakPolarHBondContact O-CB 3.37Å; I11-P67 HydrophobicContact CG1-CG 3.86Å; P67-E69 PolarHBondContact O-N 3.02Å
68	V	86.6	Confident	67.3	Low	44 Å²	44	102.3 Å²	102.3	27%	0.267	50%	0.499	S	S	.	.			trans	-56.9	125.6	165.8	-179.9	0	0	0	0	108.4	Q18 E20 R70	Q18-V68 HydrophobicContact CB-CG2 3.79Å; E20-V68 WeakPolarHBondContact OE1-CA 3.34Å; V68-R70 PolarHBondContact O-N 3.12Å
69	E	69.2	Low	64.3	Low	85 Å²	85	110 Å²	110	40%	0.397	53%	0.534	S	S	.	.			trans	-66.4	112	-177.9	-166.5	170.9	160.8	0	0	108.6	E20 R66 P67 I71	E20-E69 PolarHBondContact OE1-N 3.01Å; R66-E69 IonicContact CZ-OE2 3.76Å; R66-E69 IonicContact NH1-OE2 3.31Å; R66-E69 IonicContact NH2-OE2 3.49Å; R66-E69 PolarHBondContact NH2-OE2 3.3Å; P67-E69 PolarHBondContact O-N 3.02Å; E69-I71 HydrophobicContact CG-CG1 4.44Å; E69-I71 PolarHBondContact O-N 2.9Å
70	R	50	Low	61.7	Low	195 Å²	195	113.5 Å²	113.5	74%	0.736	55%	0.553	S	S	*	*			trans	-74.5	70.7	-173.2	-88.2	-168	170.2	92.6	-6.2	112.2	V68 Q72	V68-R70 PolarHBondContact O-N 3.12Å; R70-Q72 PolarHBondContact O-N 3.12Å
71	I	46.2	Very low	58.8	Low	137 Å²	137	119.6 Å²	119.6	70%	0.703	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	54.3	161.2	-46.5	-179.3	0	0	0	109.3	E69	E69-I71 HydrophobicContact CG-CG1 4.44Å; E69-I71 PolarHBondContact O-N 2.9Å
72	Q	37.8	Very low	56.3	Low	140 Å²	140	120 Å²	120	65%	0.654	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	-0.9	-179.9	-73.2	-165.9	-15.2	0	0	113.9	R70 R74	R70-Q72 PolarHBondContact O-N 3.12Å; Q72-R74 PolarHBondContact O-N 2.94Å
73	L	37.3	Very low	53.9	Low	182 Å²	182	124.1 Å²	124.1	95%	0.953	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	14.7	166.1	-77.6	172.5	0	0	0	114.1
74	R	38.3	Very low	52.3	Low	235 Å²	235	124.8 Å²	124.8	89%	0.887	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.1	3.5	179.3	-139.8	-179	-174.1	89.1	-0.4	116.6	Q72	Q72-R74 PolarHBondContact O-N 2.94Å
75	R	39	Very low	51.4	Low	222 Å²	222	120.5 Å²	120.5	84%	0.838	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.5	10	-177.7	-126.4	174.5	-157.7	-117.4	0.6	120.5
76	Q	33.8	Very low	51.1	Low	184 Å²	184	122.5 Å²	122.5	86%	0.86	63%	0.625	S	S	*	*	S	Bend	trans	-147.7	99.5	161	-137.3	82.2	58.3	0	0	108.9
77	G	31.2	Very low	51	Low	75 Å²	75	124.5 Å²	124.5	77%	0.773	64%	0.638	S	S	*	*	S	Bend	trans	167.2	35.5	-170.9	0	0	0	0	0	116.4
78	L	31.1	Very low	51.1	Low	129 Å²	129	125.8 Å²	125.8	68%	0.675	65%	0.645	S	S	*	*			trans	-179.1	102	149.5	-101.7	163.1	0	0	0	108.6	D81	L78-D81 HydrophobicContact CD2-CB 3.73Å
79	H	32.2	Very low	51.2	Low	174 Å²	174	128.2 Å²	128.2	81%	0.806	66%	0.656	S	S	*	*	S	Bend	trans	-76.5	124.1	141.6	167	-68.4	0	0	0	105.4	D81	H79-D81 PolarHBondContact O-N 2.97Å
80	D	38.5	Very low	52.4	Low	142 Å²	142	127 Å²	127	76%	0.759	65%	0.652	S	S	*	*	S	Bend	trans	18.2	90.8	164.5	-160.4	32.7	0	0	0	116.2
81	D	29.2	Very low	54.5	Low	132 Å²	132	123.5 Å²	123.5	71%	0.706	64%	0.642	S	S	*	*			trans	-144	139.3	152.6	-142.6	-25.7	0	0	0	108.2	L78 H79 S83	L78-D81 HydrophobicContact CD2-CB 3.73Å; H79-D81 PolarHBondContact O-N 2.97Å; D81-S83 PolarHBondContact O-N 3.05Å
82	S	35	Very low	56.8	Low	95 Å²	95	117 Å²	117	66%	0.664	61%	0.609	S	S	*	*			trans	-83.7	112.8	-159.8	-164.2	0	0	0	0	111.6
83	S	40.6	Very low	59.6	Low	97 Å²	97	112.5 Å²	112.5	68%	0.678	59%	0.589	S	S	*	*			trans	-50.2	127.2	143.9	-61.4	0	0	0	0	107.1	D81 G85	D81-S83 PolarHBondContact O-N 3.05Å; S83-G85 PolarHBondContact O-N 2.79Å
84	P	55	Low	62.3	Low	112 Å²	112	103.9 Å²	103.9	73%	0.727	54%	0.544	S	S	*	.			trans	-63	112.7	-179.9	23.9	-32.6	0	0	0	108.5
85	G	73.4	Confident	64.9	Low	26 Å²	26	93.1 Å²	93.1	27%	0.268	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-63.1	149.4	177.1	0	0	0	0	0	110.6	S83 H87 Y115	S83-G85 PolarHBondContact O-N 2.79Å; G85-H87 PolarHBondContact O-CE1 3.15Å; G85-H87 VanDerWaalsContact O-CE1 3.26Å; G85-H87 PolarHBondContact O-N 3.22Å; G85-H87 PolarHBondContact O-ND1 3.02Å; G85-H87 VanDerWaalsContact O-ND1 3.15Å; G85-Y115 VanDerWaalsContact CA-OH 3.22Å; G85-Y115 WeakPolarHBondContact CA-OH 3.41Å
86	F	87.1	Confident	67.4	Low	42 Å²	42	86.5 Å²	86.5	18%	0.184	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-61	124	177.5	-60	-70.8	0	0	0	109.8	D90 V92 V106 V109 Y115 V132 P134	F86-D90 WeakPolarHBondContact CA-OD2 3.32Å; F86-D90 HydrophobicContact CB-CB 4.25Å; F86-V92 HydrophobicContact CB-CG1 4.15Å; F86-V92 HydrophobicContact CD1-CG1 3.59Å; F86-V92 HydrophobicContact CD2-CG1 4.2Å; F86-V92 HydrophobicContact CE1-CG1 3.98Å; F86-V92 HydrophobicContact CG-CG1 3.72Å; F86-V92 HydrophobicContact CZ-CG1 4.44Å; F86-V106 HydrophobicContact CB-CG2 3.83Å; F86-V109 WeakPolarHBondContact O-CG2 3.34Å; F86-Y115 HydrophobicContact CB-CD1 4.18Å; F86-Y115 HydrophobicContact CB-CE1 3.8Å; F86-Y115 HydrophobicContact CD2-CD2 4.48Å; F86-Y115 HydrophobicContact CD2-CE1 4.27Å; F86-Y115 AromaticContact CD2-CE2 3.99Å; F86-Y115 HydrophobicContact CD2-CE2 3.99Å; F86-Y115 AromaticContact CD2-CZ 3.86Å; F86-Y115 PolarHBondContact N-OH 3.3Å; F86-Y115 VanDerWaalsContact O-CE1 3.27Å; F86-Y115 WeakPolarHBondContact O-CE1 3.4Å; F86-V132 HydrophobicContact CD2-CB 4.2Å; F86-V132 HydrophobicContact CD2-CG1 3.57Å; F86-V132 HydrophobicContact CE2-CB 3.96Å; F86-V132 HydrophobicContact CE2-CG1 3.54Å; F86-V132 HydrophobicContact CG-CG1 4.37Å; F86-V132 HydrophobicContact CZ-CG1 4.31Å; F86-P134 HydrophobicContact CE1-CB 4.11Å; F86-P134 HydrophobicContact CZ-CB 4.49Å
87	H	89.4	Confident	69.9	Low	119 Å²	119	82.6 Å²	82.6	55%	0.551	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-78.7	161.1	-176.7	-62.8	80.3	0	0	0	110.8	G85 N89 D90 V106	G85-H87 PolarHBondContact O-CE1 3.15Å; G85-H87 VanDerWaalsContact O-CE1 3.26Å; G85-H87 PolarHBondContact O-N 3.22Å; G85-H87 PolarHBondContact O-ND1 3.02Å; G85-H87 VanDerWaalsContact O-ND1 3.15Å; H87-N89 PolarHBondContact O-N 2.66Å; H87-D90 VanDerWaalsContact N-CG 3.32Å; H87-D90 PolarHBondContact N-OD2 3.04Å; H87-D90 IonicContact ND1-OD2 3.34Å; H87-D90 WeakPolarHBondContact O-CB 3.31Å; H87-D90 PolarHBondContact O-N 3.33Å; H87-V106 WeakPolarHBondContact O-CB 3.43Å
88	V	91.3	Very high	72.5	Confident	74 Å²	74	82.2 Å²	82.2	45%	0.448	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	126.2	173.3	176.7	0	0	0	0	109.6	I107 V109	V88-I107 WeakPolarHBondContact CG1-O 3.45Å; V88-I107 WeakPolarHBondContact CG2-O 3.48Å; V88-V109 HydrophobicContact CG2-CG2 4.23Å
89	N	90.4	Very high	75.1	Confident	96 Å²	96	81 Å²	81	51%	0.513	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-2.4	-168.4	-58.8	-80.4	0	0	0	117.7	H87 K91 K105 V106	H87-N89 PolarHBondContact O-N 2.66Å; N89-K91 PolarHBondContact O-N 3.16Å; N89-K105 WeakPolarHBondContact O-CE 3.17Å; N89-K105 WeakPolarHBondContact O-CG 3.4Å; N89-K105 WeakPolarHBondContact OD1-CE 3.4Å; N89-K105 PolarHBondContact OD1-NZ 3.41Å; N89-V106 WeakPolarHBondContact CA-O 3.29Å; N89-V106 PolarHBondContact N-O 3Å
90	D	94	Very high	77.8	Confident	58 Å²	58	80.9 Å²	80.9	31%	0.31	45%	0.447	S	S	.	.			trans	-62.3	136.8	174.8	-76.6	-0.2	0	0	0	111.3	F86 H87 V92 K105 V106	F86-D90 WeakPolarHBondContact CA-OD2 3.32Å; F86-D90 HydrophobicContact CB-CB 4.25Å; H87-D90 VanDerWaalsContact N-CG 3.32Å; H87-D90 PolarHBondContact N-OD2 3.04Å; H87-D90 IonicContact ND1-OD2 3.34Å; H87-D90 WeakPolarHBondContact O-CB 3.31Å; H87-D90 PolarHBondContact O-N 3.33Å; D90-V92 HydrophobicContact CB-CG1 4.44Å; D90-K105 CarbonylContact O-C 3.6Å; D90-K105 WeakPolarHBondContact O-CA 3.44Å; D90-V106 HydrophobicContact CB-CG2 4.43Å; D90-V106 PolarHBondContact O-N 3.44Å
91	K	94.1	Very high	80.4	Confident	122 Å²	122	77.4 Å²	77.4	53%	0.53	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	129.1	168.7	-71.7	-172.3	173.2	-169.8	0	108.9	N89 Y135	N89-K91 PolarHBondContact O-N 3.16Å; K91-Y135 VanDerWaalsContact C-CB 3.44Å; K91-Y135 HydrophobicContact CB-CD1 4.13Å; K91-Y135 HydrophobicContact CB-CG 4.11Å; K91-Y135 HydrophobicContact CD-CD1 4.35Å; K91-Y135 VanDerWaalsContact O-CB 3.25Å; K91-Y135 WeakPolarHBondContact O-CB 3.33Å; K91-Y135 PolarHBondContact O-N 3.41Å
92	V	94.7	Very high	83.6	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	160.2	-175.7	-66.9	0	0	0	0	110.6	F86 D90 A104 V106 V117 V132 K133	F86-V92 HydrophobicContact CB-CG1 4.15Å; F86-V92 HydrophobicContact CD1-CG1 3.59Å; F86-V92 HydrophobicContact CD2-CG1 4.2Å; F86-V92 HydrophobicContact CE1-CG1 3.98Å; F86-V92 HydrophobicContact CG-CG1 3.72Å; F86-V92 HydrophobicContact CZ-CG1 4.44Å; D90-V92 HydrophobicContact CB-CG1 4.44Å; V92-A104 HydrophobicContact CG2-CB 4.18Å; V92-A104 PolarHBondContact N-O 2.82Å; V92-A104 PolarHBondContact O-N 2.95Å; V92-V106 HydrophobicContact CG1-CG2 3.89Å; V92-V106 HydrophobicContact CG2-CG2 3.93Å; V92-V117 HydrophobicContact CG2-CG1 4.16Å; V92-V132 HydrophobicContact CB-CG1 3.57Å; V92-V132 HydrophobicContact CG1-CG1 3.69Å; V92-V132 HydrophobicContact CG2-CG1 3.83Å; V92-K133 CarbonylContact C-O 3.05Å; V92-K133 WeakPolarHBondContact CA-O 3.27Å; V92-K133 WeakPolarHBondContact CB-O 3.42Å
93	L	95.1	Very high	86.5	Confident	47 Å²	47	72.7 Å²	72.7	25%	0.246	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.5	162.6	-71.7	172.2	0	0	0	107.3	F101 Y102 P103 K133 Y135	L93-F101 HydrophobicContact CB-CB 4.3Å; L93-F101 HydrophobicContact CB-CD1 4.32Å; L93-Y102 WeakPolarHBondContact CA-O 3.5Å; L93-P103 HydrophobicContact CD2-CG 4.28Å; L93-K133 HydrophobicContact CB-CB 4.19Å; L93-K133 PolarHBondContact N-O 3.32Å; L93-K133 PolarHBondContact O-N 3.49Å; L93-Y135 HydrophobicContact CD2-CD2 3.88Å; L93-Y135 HydrophobicContact CD2-CE2 4.29Å; L93-Y135 HydrophobicContact CG-CD2 4Å
94	A	95.4	Very high	89.1	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	142.5	-179.9	0	0	0	0	0	110.5	F101 Y102 A104 V117 F119 V127 H131	A94-F101 WeakPolarHBondContact O-CA 3.26Å; A94-Y102 PolarHBondContact N-O 3.24Å; A94-Y102 PolarHBondContact O-N 2.68Å; A94-A104 HydrophobicContact CB-CB 4.06Å; A94-V117 HydrophobicContact CB-CG2 3.88Å; A94-F119 HydrophobicContact CB-CE1 3.72Å; A94-F119 HydrophobicContact CB-CE2 4.49Å; A94-F119 HydrophobicContact CB-CZ 3.54Å; A94-F119 WeakPolarHBondContact O-CE1 3.45Å; A94-V127 HydrophobicContact CB-CG2 4.28Å; A94-H131 CarbonylContact C-O 3.58Å; A94-H131 WeakPolarHBondContact CA-O 3.29Å
95	S	93.3	Very high	91	Very high	10 Å²	10	66.9 Å²	66.9	7%	0.07	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.1	179.6	69.8	0	0	0	0	112.4	R100 H131	S95-R100 CarbonylContact C-O 3.43Å; S95-R100 WeakPolarHBondContact CA-O 3.3Å; S95-H131 PolarHBondContact N-O 3Å; S95-H131 VanDerWaalsContact OG-CB 3.24Å; S95-H131 WeakPolarHBondContact OG-CB 3.49Å
96	W	90.3	Very high	92.1	Very high	82 Å²	82	65.7 Å²	65.7	31%	0.311	33%	0.328	S	S	.	.			trans	-85.1	-176.8	173.4	-164.6	-111.9	0	0	0	111.6	D98 C99 R100 Y102 F119 V123 Q125	W96-D98 PolarHBondContact O-N 3.07Å; W96-C99 PolarHBondContact O-N 3.1Å; W96-R100 PolarHBondContact N-O 3Å; W96-Y102 HydrophobicContact CB-CD2 3.76Å; W96-Y102 HydrophobicContact CB-CE2 3.79Å; W96-F119 AromaticContact CE3-CD2 3.98Å; W96-F119 HydrophobicContact CE3-CD2 3.98Å; W96-F119 HydrophobicContact CE3-CE1 4.44Å; W96-F119 AromaticContact CE3-CE2 3.5Å; W96-F119 HydrophobicContact CE3-CE2 3.5Å; W96-F119 VanDerWaalsContact CE3-CE2 3.5Å; W96-F119 AromaticContact CE3-CZ 3.76Å; W96-F119 HydrophobicContact CE3-CZ 3.76Å; W96-F119 AromaticContact CZ3-CD2 3.8Å; W96-F119 HydrophobicContact CZ3-CD2 3.8Å; W96-F119 AromaticContact CZ3-CE2 3.59Å; W96-F119 HydrophobicContact CZ3-CE2 3.59Å; W96-F119 HydrophobicContact CZ3-CZ 4.32Å; W96-V123 HydrophobicContact CH2-CG1 3.65Å; W96-V123 HydrophobicContact CZ3-CG1 4.16Å; W96-Q125 HydrophobicContact CZ3-CB 3.94Å; W96-Q125 VanDerWaalsContact CZ3-CD 3.41Å; W96-Q125 HydrophobicContact CZ3-CG 4.17Å; W96-Q125 VanDerWaalsContact CZ3-NE2 3.31Å
97	S	86.5	Confident	92.5	Very high	102 Å²	102	67 Å²	67	71%	0.713	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.5	-176.9	55.9	0	0	0	0	114.6	C99	S97-C99 PolarHBondContact O-N 3.47Å
98	D	86.7	Confident	92.6	Very high	68 Å²	68	63.3 Å²	63.3	36%	0.364	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	2.1	172	66.4	-7.5	0	0	0	113.3	W96 R100 Y102	W96-D98 PolarHBondContact O-N 3.07Å; D98-R100 PolarHBondContact O-N 3.18Å; D98-R100 WeakPolarHBondContact OD1-CB 3.38Å; D98-R100 PolarHBondContact OD1-N 3.13Å; D98-R100 WeakPolarHBondContact OD2-CB 3.49Å; D98-R100 WeakPolarHBondContact OD2-CD 3.49Å; D98-R100 WeakPolarHBondContact OD2-CG 3.41Å; D98-Y102 WeakPolarHBondContact OD2-CE2 3.32Å; D98-Y102 PolarHBondContact OD2-OH 2.72Å
99	C	84.1	Confident	92.6	Very high	103 Å²	103	63.2 Å²	63.2	70%	0.696	32%	0.323	S	S	*	.	S	Bend	trans	62.8	10.1	-172.6	-59	0	0	0	0	115.5	W96 S97	W96-C99 PolarHBondContact O-N 3.1Å; S97-C99 PolarHBondContact O-N 3.47Å
100	R	89.7	Confident	92.5	Very high	171 Å²	171	61 Å²	61	65%	0.645	31%	0.311	S	S	*	.			trans	-86.5	152.7	172	-60.3	-178.6	174.9	-179.8	-2.7	110.3	S95 W96 D98 Y102	S95-R100 CarbonylContact C-O 3.43Å; S95-R100 WeakPolarHBondContact CA-O 3.3Å; W96-R100 PolarHBondContact N-O 3Å; D98-R100 PolarHBondContact O-N 3.18Å; D98-R100 WeakPolarHBondContact OD1-CB 3.38Å; D98-R100 PolarHBondContact OD1-N 3.13Å; D98-R100 WeakPolarHBondContact OD2-CB 3.49Å; D98-R100 WeakPolarHBondContact OD2-CD 3.49Å; D98-R100 WeakPolarHBondContact OD2-CG 3.41Å; R100-Y102 HydrophobicContact CB-CD2 4.46Å; R100-Y102 HydrophobicContact CB-CE2 3.64Å; R100-Y102 WeakPolarHBondContact CD-OH 3.47Å
101	F	94	Very high	91.9	Very high	69 Å²	69	69 Å²	69	30%	0.303	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118	-175.4	-79.6	-94.9	0	0	0	110.9	L93 A94 K133	L93-F101 HydrophobicContact CB-CB 4.3Å; L93-F101 HydrophobicContact CB-CD1 4.32Å; A94-F101 WeakPolarHBondContact O-CA 3.26Å; F101-K133 HydrophobicContact CD1-CD 3.74Å; F101-K133 HydrophobicContact CD1-CG 4.19Å; F101-K133 HydrophobicContact CE1-CB 4.49Å; F101-K133 HydrophobicContact CE1-CD 3.57Å; F101-K133 HydrophobicContact CE1-CG 3.78Å; F101-K133 HydrophobicContact CE2-CD 4.44Å; F101-K133 HydrophobicContact CG-CD 4.26Å; F101-K133 HydrophobicContact CZ-CD 3.95Å; F101-K133 HydrophobicContact CZ-CG 4.41Å; F101-K133 VanDerWaalsContact CZ-NZ 3.35Å
102	Y	94.8	Very high	91.4	Very high	86 Å²	86	68.6 Å²	68.6	34%	0.337	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	152.9	-177.2	-61.2	-84.8	0	0	0	112	L93 A94 W96 D98 R100 A104	L93-Y102 WeakPolarHBondContact CA-O 3.5Å; A94-Y102 PolarHBondContact N-O 3.24Å; A94-Y102 PolarHBondContact O-N 2.68Å; W96-Y102 HydrophobicContact CB-CD2 3.76Å; W96-Y102 HydrophobicContact CB-CE2 3.79Å; D98-Y102 WeakPolarHBondContact OD2-CE2 3.32Å; D98-Y102 PolarHBondContact OD2-OH 2.72Å; R100-Y102 HydrophobicContact CB-CD2 4.46Å; R100-Y102 HydrophobicContact CB-CE2 3.64Å; R100-Y102 WeakPolarHBondContact CD-OH 3.47Å; Y102-A104 PolarHBondContact O-N 3.28Å
103	P	95.6	Very high	90.7	Very high	43 Å²	43	71.5 Å²	71.5	28%	0.279	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	127.8	175.5	-23.5	35	0	0	0	112.6	L93 Y120 Y135	L93-P103 HydrophobicContact CD2-CG 4.28Å; P103-Y120 HydrophobicContact CB-CD1 3.82Å; P103-Y120 HydrophobicContact CB-CD2 3.84Å; P103-Y120 HydrophobicContact CB-CE1 3.77Å; P103-Y120 HydrophobicContact CB-CE2 3.77Å; P103-Y120 HydrophobicContact CB-CG 3.86Å; P103-Y120 VanDerWaalsContact O-CD1 3.26Å; P103-Y120 WeakPolarHBondContact O-CD1 3.48Å; P103-Y120 PolarHBondContact O-N 3Å; P103-Y120 VanDerWaalsContact O-N 3.16Å; P103-Y135 HydrophobicContact CB-CD2 4.48Å; P103-Y135 HydrophobicContact CB-CE2 4.02Å; P103-Y135 HydrophobicContact CG-CE2 4.17Å
104	A	95.6	Very high	90.5	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	170.6	179.2	0	0	0	0	0	111.8	V92 A94 Y102 V117 K118 F119	V92-A104 HydrophobicContact CG2-CB 4.18Å; V92-A104 PolarHBondContact N-O 2.82Å; V92-A104 PolarHBondContact O-N 2.95Å; A94-A104 HydrophobicContact CB-CB 4.06Å; Y102-A104 PolarHBondContact O-N 3.28Å; A104-V117 HydrophobicContact CB-CB 4.03Å; A104-V117 HydrophobicContact CB-CG2 4.08Å; A104-K118 CarbonylContact C-O 3.58Å; A104-K118 WeakPolarHBondContact CA-O 3.47Å; A104-K118 WeakPolarHBondContact CB-O 3.37Å; A104-F119 HydrophobicContact CB-CD1 3.81Å; A104-F119 HydrophobicContact CB-CE1 4.07Å; A104-F119 HydrophobicContact CB-CG 4.13Å
105	K	96.5	Very high	90.4	Very high	87 Å²	87	70.5 Å²	70.5	38%	0.378	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.7	177.5	-160.7	-167.2	-165	-160.7	0	109.9	N89 D90 I107 V117 K118	N89-K105 WeakPolarHBondContact O-CE 3.17Å; N89-K105 WeakPolarHBondContact O-CG 3.4Å; N89-K105 WeakPolarHBondContact OD1-CE 3.4Å; N89-K105 PolarHBondContact OD1-NZ 3.41Å; D90-K105 CarbonylContact O-C 3.6Å; D90-K105 WeakPolarHBondContact O-CA 3.44Å; K105-I107 PolarHBondContact O-N 3.14Å; K105-V117 CarbonylContact O-C 3.54Å; K105-V117 WeakPolarHBondContact O-CA 3.37Å; K105-K118 PolarHBondContact N-O 3.34Å; K105-K118 PolarHBondContact O-N 3.35Å
106	V	95.8	Very high	90.5	Very high	1 Å²	1	71 Å²	71	1%	0.006	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	131.2	178	-179.5	0	0	0	0	110.3	F86 H87 N89 D90 V92 V109 Y115 V117	F86-V106 HydrophobicContact CB-CG2 3.83Å; H87-V106 WeakPolarHBondContact O-CB 3.43Å; N89-V106 WeakPolarHBondContact CA-O 3.29Å; N89-V106 PolarHBondContact N-O 3Å; D90-V106 HydrophobicContact CB-CG2 4.43Å; D90-V106 PolarHBondContact O-N 3.44Å; V92-V106 HydrophobicContact CG1-CG2 3.89Å; V92-V106 HydrophobicContact CG2-CG2 3.93Å; V106-V109 HydrophobicContact CG1-CG2 4.25Å; V106-Y115 HydrophobicContact CG1-CD1 4.06Å; V106-Y115 HydrophobicContact CG2-CD1 4.46Å; V106-V117 HydrophobicContact CG2-CG1 4.21Å
107	I	94.8	Very high	90.8	Very high	68 Å²	68	67 Å²	67	35%	0.349	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-39	178.1	-33.2	174.4	0	0	0	111.2	V88 K105 T116 K118 I124	V88-I107 WeakPolarHBondContact CG1-O 3.45Å; V88-I107 WeakPolarHBondContact CG2-O 3.48Å; K105-I107 PolarHBondContact O-N 3.14Å; I107-T116 HydrophobicContact CD1-CG2 4.36Å; I107-T116 PolarHBondContact N-O 3.24Å; I107-K118 HydrophobicContact CD1-CB 3.68Å; I107-K118 HydrophobicContact CG1-CB 3.9Å; I107-I124 HydrophobicContact CD1-CB 4.21Å; I107-I124 HydrophobicContact CD1-CD1 3.74Å; I107-I124 HydrophobicContact CD1-CG1 3.72Å; I107-I124 HydrophobicContact CD1-CG2 3.54Å
108	S	91.7	Very high	91.2	Very high	43 Å²	43	67 Å²	67	30%	0.301	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	143.7	174.4	55	0	0	0	0	111.7	T116	S108-T116 PolarHBondContact N-O 3.02Å; S108-T116 PolarHBondContact O-N 3.3Å; S108-T116 VanDerWaalsContact OG-CB 3.26Å; S108-T116 WeakPolarHBondContact OG-CB 3.49Å; S108-T116 PolarHBondContact OG-OG1 3.42Å
109	V	92.1	Very high	91.6	Very high	71 Å²	71	64 Å²	64	43%	0.43	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.8	171.5	-171.2	0	0	0	0	107.8	F86 V88 V106 Y115	F86-V109 WeakPolarHBondContact O-CG2 3.34Å; V88-V109 HydrophobicContact CG2-CG2 4.23Å; V106-V109 HydrophobicContact CG1-CG2 4.25Å; V109-Y115 HydrophobicContact CB-CD1 4.4Å; V109-Y115 HydrophobicContact CB-CE1 4.43Å; V109-Y115 HydrophobicContact CG1-CD1 4.09Å; V109-Y115 HydrophobicContact CG1-CE1 3.76Å; V109-Y115 HydrophobicContact CG2-CD1 4.04Å; V109-Y115 HydrophobicContact CG2-CE1 4.06Å
110	N	88.8	Confident	92	Very high	51 Å²	51	65 Å²	65	27%	0.273	31%	0.313	S	S	.	.			trans	-93.9	155.3	-177.3	-58.8	-37	0	0	0	110.7	D112 A113 S114 T116 T126	N110-D112 WeakPolarHBondContact CB-OD1 3.34Å; N110-D112 PolarHBondContact O-N 3.3Å; N110-A113 PolarHBondContact O-N 3.47Å; N110-A113 VanDerWaalsContact O-N 3.14Å; N110-S114 WeakPolarHBondContact CB-O 3.43Å; N110-S114 VanDerWaalsContact CB-OG 3.32Å; N110-S114 WeakPolarHBondContact CB-OG 3.28Å; N110-S114 PolarHBondContact N-O 2.95Å; N110-S114 PolarHBondContact ND2-OG 3.44Å; N110-T116 PolarHBondContact ND2-OG1 2.91Å; N110-T126 WeakPolarHBondContact ND2-CG2 3.48Å
111	K	81.1	Confident	92	Very high	225 Å²	225	62.5 Å²	62.5	98%	0.978	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-6.4	-173.7	-62.3	-178.5	-179.1	177.9	0	114.6
112	D	82.9	Confident	91.7	Very high	113 Å²	113	60.6 Å²	60.6	60%	0.604	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	10.9	178.4	70.7	-30.6	0	0	0	113.1	N110 S114	N110-D112 WeakPolarHBondContact CB-OD1 3.34Å; N110-D112 PolarHBondContact O-N 3.3Å; D112-S114 PolarHBondContact O-N 3.07Å; D112-S114 WeakPolarHBondContact OD1-CB 3.49Å; D112-S114 PolarHBondContact OD1-N 3.26Å; D112-S114 PolarHBondContact OD1-OG 3.07Å; D112-S114 PolarHBondContact OD2-OG 3.31Å
113	A	79.6	Confident	91.6	Very high	61 Å²	61	59.6 Å²	59.6	50%	0.504	32%	0.315	S	S	.	.	S	Bend	trans	59.4	29.3	-171	0	0	0	0	0	114.2	N110 G129	N110-A113 PolarHBondContact O-N 3.47Å; N110-A113 VanDerWaalsContact O-N 3.14Å; A113-G129 PolarHBondContact O-N 3.07Å
114	S	90.9	Very high	91.6	Very high	6 Å²	6	62.3 Å²	62.3	4%	0.042	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	154.3	155.8	71.2	0	0	0	0	111.3	N110 D112 T126 V127	N110-S114 WeakPolarHBondContact CB-O 3.43Å; N110-S114 VanDerWaalsContact CB-OG 3.32Å; N110-S114 WeakPolarHBondContact CB-OG 3.28Å; N110-S114 PolarHBondContact N-O 2.95Å; N110-S114 PolarHBondContact ND2-OG 3.44Å; D112-S114 PolarHBondContact O-N 3.07Å; D112-S114 WeakPolarHBondContact OD1-CB 3.49Å; D112-S114 PolarHBondContact OD1-N 3.26Å; D112-S114 PolarHBondContact OD1-OG 3.07Å; D112-S114 PolarHBondContact OD2-OG 3.31Å; S114-T126 WeakPolarHBondContact OG-CG2 3.24Å; S114-V127 CarbonylContact C-O 3.54Å; S114-V127 WeakPolarHBondContact CA-O 3.48Å; S114-V127 WeakPolarHBondContact CB-O 3.42Å
115	Y	94.5	Very high	91.4	Very high	20 Å²	20	65 Å²	65	8%	0.078	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.3	178.1	-59.5	-83.8	0	0	0	108.3	G85 F86 V106 V109 T126 V127 V132	G85-Y115 VanDerWaalsContact CA-OH 3.22Å; G85-Y115 WeakPolarHBondContact CA-OH 3.41Å; F86-Y115 HydrophobicContact CB-CD1 4.18Å; F86-Y115 HydrophobicContact CB-CE1 3.8Å; F86-Y115 HydrophobicContact CD2-CD2 4.48Å; F86-Y115 HydrophobicContact CD2-CE1 4.27Å; F86-Y115 AromaticContact CD2-CE2 3.99Å; F86-Y115 HydrophobicContact CD2-CE2 3.99Å; F86-Y115 AromaticContact CD2-CZ 3.86Å; F86-Y115 PolarHBondContact N-OH 3.3Å; F86-Y115 VanDerWaalsContact O-CE1 3.27Å; F86-Y115 WeakPolarHBondContact O-CE1 3.4Å; V106-Y115 HydrophobicContact CG1-CD1 4.06Å; V106-Y115 HydrophobicContact CG2-CD1 4.46Å; V109-Y115 HydrophobicContact CB-CD1 4.4Å; V109-Y115 HydrophobicContact CB-CE1 4.43Å; V109-Y115 HydrophobicContact CG1-CD1 4.09Å; V109-Y115 HydrophobicContact CG1-CE1 3.76Å; V109-Y115 HydrophobicContact CG2-CD1 4.04Å; V109-Y115 HydrophobicContact CG2-CE1 4.06Å; Y115-T126 WeakPolarHBondContact O-CA 3.44Å; Y115-V127 PolarHBondContact N-O 3.48Å; Y115-V127 WeakPolarHBondContact O-CG2 3.22Å; Y115-V127 PolarHBondContact O-N 2.98Å; Y115-V132 HydrophobicContact CD2-CB 4.3Å; Y115-V132 HydrophobicContact CD2-CG2 3.89Å; Y115-V132 HydrophobicContact CG-CG2 4.45Å
116	T	94.4	Very high	91.3	Very high	20 Å²	20	64.7 Å²	64.7	12%	0.123	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	118.1	166.3	-51.9	0	0	0	0	107.4	I107 S108 N110 I124 Q125 T126	I107-T116 HydrophobicContact CD1-CG2 4.36Å; I107-T116 PolarHBondContact N-O 3.24Å; S108-T116 PolarHBondContact N-O 3.02Å; S108-T116 PolarHBondContact O-N 3.3Å; S108-T116 VanDerWaalsContact OG-CB 3.26Å; S108-T116 WeakPolarHBondContact OG-CB 3.49Å; S108-T116 PolarHBondContact OG-OG1 3.42Å; N110-T116 PolarHBondContact ND2-OG1 2.91Å; T116-I124 HydrophobicContact CG2-CG2 3.59Å; T116-Q125 CarbonylContact C-O 3.58Å; T116-Q125 WeakPolarHBondContact CA-O 3.48Å; T116-T126 PolarHBondContact OG1-OG1 3.42Å
117	V	96	Very high	91.2	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	146.8	-174.1	-55.8	0	0	0	0	110.5	V92 A94 A104 K105 V106 F119 I124 Q125 V127	V92-V117 HydrophobicContact CG2-CG1 4.16Å; A94-V117 HydrophobicContact CB-CG2 3.88Å; A104-V117 HydrophobicContact CB-CB 4.03Å; A104-V117 HydrophobicContact CB-CG2 4.08Å; K105-V117 CarbonylContact O-C 3.54Å; K105-V117 WeakPolarHBondContact O-CA 3.37Å; V106-V117 HydrophobicContact CG2-CG1 4.21Å; V117-F119 HydrophobicContact CG2-CD2 4.16Å; V117-F119 HydrophobicContact CG2-CE2 3.65Å; V117-F119 HydrophobicContact CG2-CZ 4.06Å; V117-I124 WeakPolarHBondContact O-CA 3.36Å; V117-Q125 PolarHBondContact N-O 3.09Å; V117-Q125 PolarHBondContact O-N 3.45Å; V117-V127 HydrophobicContact CG1-CG2 3.9Å; V117-V127 HydrophobicContact CG2-CG2 3.87Å
118	K	95.9	Very high	91	Very high	100 Å²	100	68 Å²	68	44%	0.435	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	115.1	167.9	-175.2	163.9	-179	173.2	0	108.7	A104 K105 I107 G122 V123 I124	A104-K118 CarbonylContact C-O 3.58Å; A104-K118 WeakPolarHBondContact CA-O 3.47Å; A104-K118 WeakPolarHBondContact CB-O 3.37Å; K105-K118 PolarHBondContact N-O 3.34Å; K105-K118 PolarHBondContact O-N 3.35Å; I107-K118 HydrophobicContact CD1-CB 3.68Å; I107-K118 HydrophobicContact CG1-CB 3.9Å; K118-G122 VanDerWaalsContact CE-CA 3.41Å; K118-G122 VanDerWaalsContact CE-O 3.26Å; K118-G122 WeakPolarHBondContact CE-O 3.36Å; K118-V123 CarbonylContact C-O 3.55Å; K118-V123 WeakPolarHBondContact CA-O 3.46Å; K118-I124 HydrophobicContact CB-CG1 4.24Å; K118-I124 HydrophobicContact CD-CG1 4.39Å; K118-I124 HydrophobicContact CG-CG1 4.17Å
119	F	94.9	Very high	90.8	Very high	5 Å²	5	67.3 Å²	67.3	2%	0.022	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	159.5	170.3	-71.5	-86.5	0	0	0	110.4	A94 W96 A104 V117 D121 G122 V123 Q125	A94-F119 HydrophobicContact CB-CE1 3.72Å; A94-F119 HydrophobicContact CB-CE2 4.49Å; A94-F119 HydrophobicContact CB-CZ 3.54Å; A94-F119 WeakPolarHBondContact O-CE1 3.45Å; W96-F119 AromaticContact CE3-CD2 3.98Å; W96-F119 HydrophobicContact CE3-CD2 3.98Å; W96-F119 HydrophobicContact CE3-CE1 4.44Å; W96-F119 AromaticContact CE3-CE2 3.5Å; W96-F119 HydrophobicContact CE3-CE2 3.5Å; W96-F119 VanDerWaalsContact CE3-CE2 3.5Å; W96-F119 AromaticContact CE3-CZ 3.76Å; W96-F119 HydrophobicContact CE3-CZ 3.76Å; W96-F119 AromaticContact CZ3-CD2 3.8Å; W96-F119 HydrophobicContact CZ3-CD2 3.8Å; W96-F119 AromaticContact CZ3-CE2 3.59Å; W96-F119 HydrophobicContact CZ3-CE2 3.59Å; W96-F119 HydrophobicContact CZ3-CZ 4.32Å; A104-F119 HydrophobicContact CB-CD1 3.81Å; A104-F119 HydrophobicContact CB-CE1 4.07Å; A104-F119 HydrophobicContact CB-CG 4.13Å; V117-F119 HydrophobicContact CG2-CD2 4.16Å; V117-F119 HydrophobicContact CG2-CE2 3.65Å; V117-F119 HydrophobicContact CG2-CZ 4.06Å; F119-D121 WeakPolarHBondContact CB-OD1 3.45Å; F119-D121 PolarHBondContact O-N 2.83Å; F119-G122 PolarHBondContact O-N 3.33Å; F119-V123 PolarHBondContact N-O 2.94Å; F119-Q125 HydrophobicContact CE2-CB 4.03Å
120	Y	91.6	Very high	90.7	Very high	125 Å²	125	71 Å²	71	49%	0.49	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.6	-173.2	-81.4	26.9	0	0	0	113.3	P103 G122	P103-Y120 HydrophobicContact CB-CD1 3.82Å; P103-Y120 HydrophobicContact CB-CD2 3.84Å; P103-Y120 HydrophobicContact CB-CE1 3.77Å; P103-Y120 HydrophobicContact CB-CE2 3.77Å; P103-Y120 HydrophobicContact CB-CG 3.86Å; P103-Y120 VanDerWaalsContact O-CD1 3.26Å; P103-Y120 WeakPolarHBondContact O-CD1 3.48Å; P103-Y120 PolarHBondContact O-N 3Å; P103-Y120 VanDerWaalsContact O-N 3.16Å; Y120-G122 PolarHBondContact O-N 2.88Å
121	D	90.4	Very high	90.8	Very high	118 Å²	118	72.6 Å²	72.6	63%	0.631	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-13.7	167.7	59	6.8	0	0	0	113.9	F119 V123	F119-D121 WeakPolarHBondContact CB-OD1 3.45Å; F119-D121 PolarHBondContact O-N 2.83Å; D121-V123 WeakPolarHBondContact OD1-CB 3.49Å; D121-V123 PolarHBondContact OD1-N 3.01Å
122	G	88.3	Confident	91.2	Very high	30 Å²	30	62.4 Å²	62.4	31%	0.309	33%	0.333	S	S	.	.	S	Bend	trans	104	-10.9	-178.1	0	0	0	0	0	115.2	K118 F119 Y120	K118-G122 VanDerWaalsContact CE-CA 3.41Å; K118-G122 VanDerWaalsContact CE-O 3.26Å; K118-G122 WeakPolarHBondContact CE-O 3.36Å; F119-G122 PolarHBondContact O-N 3.33Å; Y120-G122 PolarHBondContact O-N 2.88Å
123	V	93	Very high	91.6	Very high	64 Å²	64	61.8 Å²	61.8	39%	0.388	33%	0.325	S	S	.	.			trans	-74.7	139.4	-172.3	-176.7	0	0	0	0	111	W96 K118 F119 D121	W96-V123 HydrophobicContact CH2-CG1 3.65Å; W96-V123 HydrophobicContact CZ3-CG1 4.16Å; K118-V123 CarbonylContact C-O 3.55Å; K118-V123 WeakPolarHBondContact CA-O 3.46Å; F119-V123 PolarHBondContact N-O 2.94Å; D121-V123 WeakPolarHBondContact OD1-CB 3.49Å; D121-V123 PolarHBondContact OD1-N 3.01Å
124	I	94.6	Very high	92.2	Very high	101 Å²	101	62.4 Å²	62.4	52%	0.518	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.8	-176.9	-60.6	177.4	0	0	0	110	I107 T116 V117 K118	I107-I124 HydrophobicContact CD1-CB 4.21Å; I107-I124 HydrophobicContact CD1-CD1 3.74Å; I107-I124 HydrophobicContact CD1-CG1 3.72Å; I107-I124 HydrophobicContact CD1-CG2 3.54Å; T116-I124 HydrophobicContact CG2-CG2 3.59Å; V117-I124 WeakPolarHBondContact O-CA 3.36Å; K118-I124 HydrophobicContact CB-CG1 4.24Å; K118-I124 HydrophobicContact CD-CG1 4.39Å; K118-I124 HydrophobicContact CG-CG1 4.17Å
125	Q	92.4	Very high	92	Very high	57 Å²	57	66 Å²	66	27%	0.266	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	150.5	-179.5	-161.8	-175.9	58.7	0	0	111	W96 T116 V117 F119 V127	W96-Q125 HydrophobicContact CZ3-CB 3.94Å; W96-Q125 VanDerWaalsContact CZ3-CD 3.41Å; W96-Q125 HydrophobicContact CZ3-CG 4.17Å; W96-Q125 VanDerWaalsContact CZ3-NE2 3.31Å; T116-Q125 CarbonylContact C-O 3.58Å; T116-Q125 WeakPolarHBondContact CA-O 3.48Å; V117-Q125 PolarHBondContact N-O 3.09Å; V117-Q125 PolarHBondContact O-N 3.45Å; F119-Q125 HydrophobicContact CE2-CB 4.03Å; Q125-V127 HydrophobicContact CG-CG1 4.45Å
126	T	94.2	Very high	91.4	Very high	79 Å²	79	70.9 Å²	70.9	49%	0.485	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118.4	172	-60.2	0	0	0	0	110.5	N110 S114 Y115 T116	N110-T126 WeakPolarHBondContact ND2-CG2 3.48Å; S114-T126 WeakPolarHBondContact OG-CG2 3.24Å; Y115-T126 WeakPolarHBondContact O-CA 3.44Å; T116-T126 PolarHBondContact OG1-OG1 3.42Å
127	V	92.1	Very high	90.1	Very high	8 Å²	8	77.5 Å²	77.5	5%	0.048	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.1	-174.3	-73.4	0	0	0	0	110.5	A94 S114 Y115 V117 Q125 H131 V132	A94-V127 HydrophobicContact CB-CG2 4.28Å; S114-V127 CarbonylContact C-O 3.54Å; S114-V127 WeakPolarHBondContact CA-O 3.48Å; S114-V127 WeakPolarHBondContact CB-O 3.42Å; Y115-V127 PolarHBondContact N-O 3.48Å; Y115-V127 WeakPolarHBondContact O-CG2 3.22Å; Y115-V127 PolarHBondContact O-N 2.98Å; V117-V127 HydrophobicContact CG1-CG2 3.9Å; V117-V127 HydrophobicContact CG2-CG2 3.87Å; Q125-V127 HydrophobicContact CG-CG1 4.45Å; V127-H131 HydrophobicContact CB-CB 4.23Å; V127-V132 HydrophobicContact CB-CG2 4.28Å; V127-V132 HydrophobicContact CG2-CG2 3.44Å; V127-V132 VanDerWaalsContact CG2-CG2 3.44Å
128	K	92.3	Very high	87.7	Confident	132 Å²	132	85.3 Å²	85.3	57%	0.574	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	152.6	177.6	-64.9	179.6	-178.7	175.6	0	110.3	M130 H131	K128-M130 HydrophobicContact CB-CG 3.87Å; K128-M130 PolarHBondContact O-N 3.01Å; K128-H131 WeakPolarHBondContact O-CA 3.42Å; K128-H131 WeakPolarHBondContact O-CB 3.47Å; K128-H131 PolarHBondContact O-N 2.97Å
129	G	87.4	Confident	85.2	Confident	27 Å²	27	91.2 Å²	91.2	28%	0.278	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-54.6	-29.5	180	0	0	0	0	0	115.8	A113 H131 V132	A113-G129 PolarHBondContact O-N 3.07Å; G129-H131 PolarHBondContact O-N 2.64Å; G129-V132 PolarHBondContact O-N 3.5Å; G129-V132 VanDerWaalsContact O-N 3.17Å
130	M	88.4	Confident	82.2	Confident	150 Å²	150	94.7 Å²	94.7	74%	0.739	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-63.8	-18	171.8	55	175.2	58.3	0	0	114.8	K128	K128-M130 HydrophobicContact CB-CG 3.87Å; K128-M130 PolarHBondContact O-N 3.01Å
131	H	90.8	Very high	79.5	Confident	84 Å²	84	92.3 Å²	92.3	39%	0.389	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-102.7	10.4	179.2	-67.9	-176.8	0	0	0	111.9	A94 S95 V127 K128 G129	A94-H131 CarbonylContact C-O 3.58Å; A94-H131 WeakPolarHBondContact CA-O 3.29Å; S95-H131 PolarHBondContact N-O 3Å; S95-H131 VanDerWaalsContact OG-CB 3.24Å; S95-H131 WeakPolarHBondContact OG-CB 3.49Å; V127-H131 HydrophobicContact CB-CB 4.23Å; K128-H131 WeakPolarHBondContact O-CA 3.42Å; K128-H131 WeakPolarHBondContact O-CB 3.47Å; K128-H131 PolarHBondContact O-N 2.97Å; G129-H131 PolarHBondContact O-N 2.64Å
132	V	90.4	Very high	76.7	Confident	11 Å²	11	92 Å²	92	7%	0.067	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.4	178.9	-171.2	0	0	0	0	109.6	F86 V92 Y115 V127 G129	F86-V132 HydrophobicContact CD2-CB 4.2Å; F86-V132 HydrophobicContact CD2-CG1 3.57Å; F86-V132 HydrophobicContact CE2-CB 3.96Å; F86-V132 HydrophobicContact CE2-CG1 3.54Å; F86-V132 HydrophobicContact CG-CG1 4.37Å; F86-V132 HydrophobicContact CZ-CG1 4.31Å; V92-V132 HydrophobicContact CB-CG1 3.57Å; V92-V132 HydrophobicContact CG1-CG1 3.69Å; V92-V132 HydrophobicContact CG2-CG1 3.83Å; Y115-V132 HydrophobicContact CD2-CB 4.3Å; Y115-V132 HydrophobicContact CD2-CG2 3.89Å; Y115-V132 HydrophobicContact CG-CG2 4.45Å; V127-V132 HydrophobicContact CB-CG2 4.28Å; V127-V132 HydrophobicContact CG2-CG2 3.44Å; V127-V132 VanDerWaalsContact CG2-CG2 3.44Å; G129-V132 PolarHBondContact O-N 3.5Å; G129-V132 VanDerWaalsContact O-N 3.17Å
133	K	92	Very high	74	Confident	99 Å²	99	94.7 Å²	94.7	43%	0.43	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	153.7	178	-71.2	172.9	-177.7	163.1	0	109.8	V92 L93 F101	V92-K133 CarbonylContact C-O 3.05Å; V92-K133 WeakPolarHBondContact CA-O 3.27Å; V92-K133 WeakPolarHBondContact CB-O 3.42Å; L93-K133 HydrophobicContact CB-CB 4.19Å; L93-K133 PolarHBondContact N-O 3.32Å; L93-K133 PolarHBondContact O-N 3.49Å; F101-K133 HydrophobicContact CD1-CD 3.74Å; F101-K133 HydrophobicContact CD1-CG 4.19Å; F101-K133 HydrophobicContact CE1-CB 4.49Å; F101-K133 HydrophobicContact CE1-CD 3.57Å; F101-K133 HydrophobicContact CE1-CG 3.78Å; F101-K133 HydrophobicContact CE2-CD 4.44Å; F101-K133 HydrophobicContact CG-CD 4.26Å; F101-K133 HydrophobicContact CZ-CD 3.95Å; F101-K133 HydrophobicContact CZ-CG 4.41Å; F101-K133 VanDerWaalsContact CZ-NZ 3.35Å
134	P	90.8	Very high	70.9	Confident	75 Å²	75	95.4 Å²	95.4	49%	0.487	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-61.2	140	172.1	27.5	-34.5	0	0	0	110.5	F86 I136	F86-P134 HydrophobicContact CE1-CB 4.11Å; F86-P134 HydrophobicContact CZ-CB 4.49Å; P134-I136 PolarHBondContact O-N 3.33Å
135	Y	87.8	Confident	68	Low	81 Å²	81	102.6 Å²	102.6	32%	0.318	58%	0.579	S	S	.	*			trans	-81.1	96.2	171.3	-176.1	-92.6	0	0	0	109.3	K91 L93 P103 K137	K91-Y135 VanDerWaalsContact C-CB 3.44Å; K91-Y135 HydrophobicContact CB-CD1 4.13Å; K91-Y135 HydrophobicContact CB-CG 4.11Å; K91-Y135 HydrophobicContact CD-CD1 4.35Å; K91-Y135 VanDerWaalsContact O-CB 3.25Å; K91-Y135 WeakPolarHBondContact O-CB 3.33Å; K91-Y135 PolarHBondContact O-N 3.41Å; L93-Y135 HydrophobicContact CD2-CD2 3.88Å; L93-Y135 HydrophobicContact CD2-CE2 4.29Å; L93-Y135 HydrophobicContact CG-CD2 4Å; P103-Y135 HydrophobicContact CB-CD2 4.48Å; P103-Y135 HydrophobicContact CB-CE2 4.02Å; P103-Y135 HydrophobicContact CG-CE2 4.17Å; Y135-K137 HydrophobicContact CE1-CB 4.07Å; Y135-K137 PolarHBondContact O-N 3.19Å
136	I	81.2	Confident	65.1	Low	123 Å²	123	105.9 Å²	105.9	63%	0.631	61%	0.608	S	S	*	*			trans	-78.7	113.8	170.3	-57.8	176.4	0	0	0	106.9	P134 E138	P134-I136 PolarHBondContact O-N 3.33Å; I136-E138 PolarHBondContact O-N 3.31Å
137	K	68.1	Low	62.2	Low	159 Å²	159	114.2 Å²	114.2	69%	0.691	63%	0.631	S	S	*	*			trans	-82.3	106.3	167	-177	179.5	177.9	-178.9	0	107.7	Y135 R139	Y135-K137 HydrophobicContact CE1-CB 4.07Å; Y135-K137 PolarHBondContact O-N 3.19Å; K137-R139 PolarHBondContact O-N 2.94Å
138	E	44.7	Very low	59.2	Low	163 Å²	163	119.6 Å²	119.6	76%	0.762	67%	0.669	S	S	*	*			trans	-54.6	130.9	165.4	-71.7	-57.6	150.5	0	0	109.8	I136	I136-E138 PolarHBondContact O-N 3.31Å
139	R	42.8	Very low	56.2	Low	225 Å²	225	118.1 Å²	118.1	85%	0.849	68%	0.675	S	S	*	*			trans	-139.1	104.8	178.7	-168	-177.7	-160.8	-149.3	3	106.2	K137	K137-R139 PolarHBondContact O-N 2.94Å
140	G	33.5	Very low	53.4	Low	77 Å²	77	121.9 Å²	121.9	79%	0.794	69%	0.689	S	S	*	*			trans	-63.9	155.6	-172.4	0	0	0	0	0	113.4
141	G	34.8	Very low	50.9	Low	75 Å²	75	122.1 Å²	122.1	77%	0.773	69%	0.686	S	S	*	*	S	Bend	trans	90.5	114.2	163.5	0	0	0	0	0	116.5
142	A	30.4	Very low	47.9	Very low	112 Å²	112	125.4 Å²	125.4	93%	0.926	71%	0.706	S	S	*	*			trans	62.2	143.9	161.5	0	0	0	0	0	119.1
143	G	31.5	Very low	45	Very low	87 Å²	87	129.1 Å²	129.1	90%	0.897	74%	0.738	S	S	*	*			trans	-96.3	138.1	-173.8	0	0	0	0	0	114.3
144	G	28.4	Very low	42	Very low	78 Å²	78	129.8 Å²	129.8	80%	0.804	75%	0.75	S	S	*	*			trans	-145.7	101.1	172.6	0	0	0	0	0	112.2
145	R	35.1	Very low	39.1	Very low	253 Å²	253	136.8 Å²	136.8	96%	0.955	77%	0.767	S	S	*	*			trans	-76.6	130.8	170.6	-76.8	-177.4	169.5	-164.7	-3.6	110.1
146	S	29.8	Very low	36.1	Very low	126 Å²	126	144 Å²	144	88%	0.881	79%	0.793	S	S	*	*			trans	-129.9	152	162.9	-88.6	0	0	0	0	111.5
147	R	33.7	Very low	33.5	Very low	253 Å²	253	142.3 Å²	142.3	96%	0.955	80%	0.798	S	S	*	*			trans	-102.8	165.6	-164.9	-65.8	169.5	165.3	149.9	-8.1	112.4
148	S	29.8	Very low	32.5	Very low	122 Å²	122	140.1 Å²	140.1	85%	0.853	80%	0.8	S	S	*	*			trans	-131.7	153	150.9	55.6	0	0	0	0	111.3
149	S	29.5	Very low	31.8	Very low	100 Å²	100	138.7 Å²	138.7	70%	0.699	80%	0.798	S	S	*	*			trans	-34.2	161.6	173.1	-87.2	0	0	0	0	119.5
150	D	28.6	Very low	31.2	Very low	106 Å²	106	138.3 Å²	138.3	57%	0.567	80%	0.796	S	S	*	*			cis	-162.3	150.5	13.1	-119	-11.4	0	0	0	117.1
151	K	35.7	Very low	31	Very low	156 Å²	156	145.3 Å²	145.3	68%	0.678	80%	0.799	S	S	*	*			trans	62.3	125	138.9	-70.8	158.6	-170.3	151.7	0	125
152	N	27.8	Very low	30.7	Very low	153 Å²	153	147.7 Å²	147.7	82%	0.818	79%	0.79	S	S	*	*			trans	74.5	146.5	140.7	-61.7	-8.6	0	0	0	119.3
153	A	28.6	Very low	30.7	Very low	88 Å²	88	152 Å²	152	73%	0.727	78%	0.782	S	S	*	*			cis	-146.7	134.3	6.1	0	0	0	0	0	112
154	V	29	Very low	30.7	Very low	114 Å²	114	158.8 Å²	158.8	69%	0.691	78%	0.781	S	S	*	*				88.3	111	93.8	175.1	0	0	0	0	117.7
155	R	30.5	Very low	31.3	Very low	222 Å²	222	160.7 Å²	160.7	84%	0.838	78%	0.779	S	S	*	*			trans	69.8	152.5	158.2	-67.4	164.7	-171.1	179.1	1.5	117.1
156	R	25.6	Very low	31.1	Very low	231 Å²	231	156.4 Å²	156.4	87%	0.872	77%	0.77	S	S	*	*			cis	-152.2	160.2	10.2	-138.1	172.9	-167.3	163.1	-0.1	111.3
157	A	25.7	Very low	30.9	Very low	88 Å²	88	157.5 Å²	157.5	73%	0.727	76%	0.761	S	S	*	*			trans	-123.8	-171.1	173.4	0	0	0	0	0	109.6
158	P	47	Very low	30.7	Very low	113 Å²	113	152.1 Å²	152.1	73%	0.734	75%	0.751	S	S	*	*			cis	-110.8	-136.2	7.5	28.1	-3.3	0	0	0	111.6
159	N	30.6	Very low	30.5	Very low	134 Å²	134	150 Å²	150	72%	0.717	75%	0.748	S	S	*	*			cis	-171.3	164.5	9.7	-130.6	-2	0	0	0	107.1
160	R	30.1	Very low	30.3	Very low	216 Å²	216	151 Å²	151	82%	0.815	75%	0.754	S	S	*	*			cis	-169.5	175.1	-15.3	-149.2	179.2	171	-175.9	-3.3	108.8
161	R	28.9	Very low	31.2	Very low	224 Å²	224	151.4 Å²	151.4	85%	0.845	76%	0.762	S	S	*	*			trans	74	162.9	165.7	-68.7	-179.2	172.4	174.3	-1.8	117.7
162	E	27.6	Very low	31.2	Very low	126 Å²	126	153 Å²	153	59%	0.589	77%	0.769	S	S	*	*			cis	-173.1	151.5	-49.2	-126.9	-173.8	144.8	0	0	111.7
163	R	30.5	Very low	31.3	Very low	202 Å²	202	152.3 Å²	152.3	76%	0.762	77%	0.766	S	S	*	*			trans	74.3	146.6	162.4	-66.7	-173.9	-178.3	64.5	27.7	121.9
164	R	32.2	Very low	31.5	Very low	230 Å²	230	156.8 Å²	156.8	87%	0.868	77%	0.769	S	S	*	*			trans	-109.4	170.5	162.3	-78.3	179.6	170.8	166.1	-6.6	109.6
165	P	40.9	Very low	31.6	Very low	117 Å²	117	162.7 Å²	162.7	76%	0.76	78%	0.779	S	S	*	*				-114.2	158.5	113.9	-9	29	0	0	0	112.4
166	Q	31.6	Very low	31.6	Very low	164 Å²	164	156.1 Å²	156.1	77%	0.766	77%	0.772	S	S	*	*				76.8	136.7	54.1	-118.4	-178.3	-83.5	0	0	112.2
167	E	25.9	Very low	32	Very low	149 Å²	149	155.9 Å²	155.9	70%	0.696	77%	0.771	S	S	*	*			cis	-147.5	161.1	31.5	-75.5	-169.1	79.6	0	0	117.3
168	N	27.7	Very low	32.5	Very low	139 Å²	139	161.6 Å²	161.6	74%	0.743	77%	0.774	S	S	*	*			trans	34.6	148.3	135.3	-54.9	-30.2	0	0	0	122.9
169	G	26.7	Very low	31.7	Very low	78 Å²	78	161 Å²	161	80%	0.804	77%	0.772	S	S	*	*			cis	-176.6	-169.4	5.5	0	0	0	0	0	114.4
170	C	26.1	Very low	31.8	Very low	122 Å²	122	160.7 Å²	160.7	82%	0.824	78%	0.775	S	S	*	*			trans	-156.3	151.1	-173	172.4	0	0	0	0	112.9
171	P	46.6	Very low	31.6	Very low	113 Å²	113	155.4 Å²	155.4	73%	0.734	77%	0.771	S	S	*	*			trans	-150.8	119.8	143.5	34.7	-14.7	0	0	0	120.1
172	K	35.4	Very low	32.1	Very low	189 Å²	189	152.2 Å²	152.2	82%	0.822	77%	0.771	S	S	*	*				58.4	132.1	122.9	-58.4	173.4	-179.5	177.3	0	124.2
173	N	31.1	Very low	32.1	Very low	139 Å²	139	154.3 Å²	154.3	74%	0.743	78%	0.781	S	S	*	*			trans	-176.2	167.1	148.6	-105.8	-83.7	0	0	0	109.4
174	K	32.6	Very low	32.2	Very low	182 Å²	182	150.5 Å²	150.5	79%	0.791	78%	0.776	S	S	*	*			cis	-145.9	-113.7	-19.2	-150.3	-175.8	-148.7	85.4	0	114.3
175	R	31.3	Very low	32.1	Very low	239 Å²	239	147.2 Å²	147.2	90%	0.902	77%	0.77	S	S	*	*			trans	-167.3	175.1	-171.1	-89.8	-171.5	175.9	-174.6	-0.9	112.1
176	A	29.6	Very low	31.4	Very low	84 Å²	84	148.6 Å²	148.6	69%	0.694	77%	0.771	S	S	*	*			cis	166.1	135.5	-44.9	0	0	0	0	0	114.2
177	R	33.5	Very low	31.5	Very low	226 Å²	226	144.9 Å²	144.9	85%	0.853	76%	0.763	S	S	*	*			trans	72.7	161.8	165.4	-62.3	-177.5	169.6	-177.7	-3.8	117.6
178	R	35.9	Very low	31.3	Very low	208 Å²	208	145.6 Å²	145.6	79%	0.785	77%	0.772	S	S	*	*			cis	-166.8	-180	10.3	-140.2	179.8	-173.6	-172.4	-2	113.6
179	S	30.8	Very low	31.3	Very low	99 Å²	99	143.3 Å²	143.3	69%	0.692	77%	0.767	S	S	*	*			trans	82.9	149.8	153.4	-61.4	0	0	0	0	118
180	T	32.7	Very low	31.3	Very low	129 Å²	129	146.8 Å²	146.8	79%	0.791	77%	0.767	S	S	*	*			cis	-162.6	179.7	-3.5	13.2	0	0	0	0	108.2
181	S	25.1	Very low	31.5	Very low	105 Å²	105	148.3 Å²	148.3	73%	0.734	77%	0.767	S	S	*	*			cis	-159.1	175.9	9.7	-142.7	0	0	0	0	111.6
182	D	39.8	Very low	30.8	Very low	156 Å²	156	150.9 Å²	150.9	83%	0.834	77%	0.769	S	S	*	*			trans	-121.6	165.1	171	-46.9	-83.5	0	0	0	112.1
183	Q	28.6	Very low	30.5	Very low	171 Å²	171	148.9 Å²	148.9	80%	0.799	76%	0.762	S	S	*	*			trans	-170.2	150.5	166.5	-84.6	-169.9	-111.2	0	0	106.8
184	D	31.2	Very low	30.3	Very low	122 Å²	122	149.2 Å²	149.2	65%	0.652	76%	0.76	S	S	*	*			cis	-157.8	147	-6.9	-85.8	-23	0	0	0	110.9
185	E	31.5	Very low	30.1	Very low	161 Å²	161	146.9 Å²	146.9	75%	0.752	75%	0.751	S	S	*	*			trans	34.6	129.9	142.7	-42.2	-57.1	73.4	0	0	126.1
186	D	25.8	Very low	29.8	Very low	146 Å²	146	143.3 Å²	143.3	78%	0.781	75%	0.745	S	S	*	*				45.7	163.9	129.1	-80.3	-21.6	0	0	0	125.2
187	S	33.3	Very low	29.7	Very low	85 Å²	85	142.9 Å²	142.9	59%	0.594	75%	0.749	S	S	*	*			cis	172.4	160.7	-30.7	-90.9	0	0	0	0	109.5
188	N	22.8	Very low	29.4	Very low	164 Å²	164	136.7 Å²	136.7	88%	0.877	75%	0.746	S	S	*	*			trans	83.6	151.2	179.3	-55	-48.9	0	0	0	116.9
189	S	26.5	Very low	29.5	Very low	91 Å²	91	133 Å²	133	64%	0.636	75%	0.746	S	S	*	*			cis	-168.5	170.6	-17.3	59.7	0	0	0	0	108.4
190	D	27	Very low	29.2	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	75%	0.753	S	S	*	*			cis	-122.2	-93.4	12.5	-77.9	-89	0	0	0	115.4
191	D	29.5	Very low	29.1	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	75%	0.745	S	S	*	*			cis	-159	177.5	5.1	-161	-2.8	0	0	0	110.8
192	E	32.6	Very low	29.6	Very low	167 Å²	167	138.1 Å²	138.1	78%	0.78	75%	0.745	S	S	*	*			trans	-106.8	176.1	-170.9	-66.7	-170.5	159.8	0	0	114.5
193	E	29.2	Very low	29.1	Very low	146 Å²	146	138.2 Å²	138.2	68%	0.682	75%	0.746	S	S	*	*			cis	-162.6	162.1	-34.3	-103.2	-150.4	136	0	0	108.9
194	Q	27.5	Very low	30.1	Very low	147 Å²	147	134.9 Å²	134.9	69%	0.687	74%	0.739	S	S	*	*			trans	45.6	164.2	148.9	-73.9	-156.6	-57.5	0	0	123.4
195	E	27.8	Very low	30.2	Very low	132 Å²	132	138 Å²	138	62%	0.617	75%	0.747	S	S	*	*			cis	-164.8	170	-44.5	-132.3	-165	123.6	0	0	110.5
196	Q	26.1	Very low	30.2	Very low	164 Å²	164	137.8 Å²	137.8	77%	0.766	75%	0.75	S	S	*	*			trans	50.3	127.2	153.6	-63.2	175.2	43.1	0	0	123.7
197	G	26.1	Very low	30.2	Very low	75 Å²	75	137.9 Å²	137.9	77%	0.773	75%	0.75	S	S	*	*				113.8	100.9	102.9	0	0	0	0	0	123.6
198	A	28.5	Very low	30	Very low	97 Å²	97	136.8 Å²	136.8	80%	0.802	75%	0.752	S	S	*	*				74.1	117	126.1	0	0	0	0	0	126.3
199	V	36.7	Very low	30.2	Very low	129 Å²	129	136 Å²	136	78%	0.782	75%	0.753	S	S	*	*				60.5	125.5	125.1	-173.5	0	0	0	0	123.5
200	N	24.2	Very low	30.2	Very low	155 Å²	155	136.5 Å²	136.5	83%	0.829	76%	0.756	S	S	*	*			trans	170.5	174.6	137.1	-91	-29	0	0	0	111.5
201	D	30.8	Very low	29.9	Very low	119 Å²	119	138.2 Å²	138.2	64%	0.636	76%	0.76	S	S	*	*				-151.9	-178.5	-59.2	-158.9	5.6	0	0	0	110.6
202	K	36.6	Very low	29.9	Very low	167 Å²	167	135.1 Å²	135.1	73%	0.726	76%	0.756	S	S	*	*			trans	-72.1	156.3	-167.7	-38.9	129.9	-168	86.3	0	116.9
203	N	28.9	Very low	29.6	Very low	159 Å²	159	135 Å²	135	85%	0.85	76%	0.755	S	S	*	*				-172.5	-172.2	129.5	-124	-7.4	0	0	0	116
204	P	50.6	Low	29.4	Very low	101 Å²	101	136.5 Å²	136.5	66%	0.656	76%	0.762	S	S	*	*			trans	-144.2	168	-130.3	48.2	-26.5	0	0	0	122.2
205	K	32.2	Very low	29.3	Very low	187 Å²	187	132.9 Å²	132.9	81%	0.813	76%	0.757	S	S	*	*			trans	54.3	136.1	131.4	-168.6	174.5	-171.5	175.3	0	124.5
206	L	32.3	Very low	29.1	Very low	156 Å²	156	132.9 Å²	132.9	82%	0.817	77%	0.766	S	S	*	*			trans	161.3	157.3	138.3	-86.9	163.6	0	0	0	109.2
207	N	25.8	Very low	29	Very low	149 Å²	149	130.1 Å²	130.1	80%	0.797	76%	0.76	S	S	*	*			cis	-165.5	166.7	-21.2	-164.8	28	0	0	0	111.9
208	G	29.3	Very low	29	Very low	62 Å²	62	134.8 Å²	134.8	64%	0.639	76%	0.759	S	S	*	*			trans	91.6	172.2	164.4	0	0	0	0	0	117.3
209	V	26.6	Very low	28.7	Very low	148 Å²	148	136.3 Å²	136.3	90%	0.897	75%	0.75	S	S	*	*			cis	-141.5	-142.8	-10.8	-157.1	0	0	0	0	109.4
210	S	25.8	Very low	28	Very low	100 Å²	100	136.6 Å²	136.6	70%	0.699	74%	0.743	S	S	*	*			trans	-159.5	170.2	-168.6	57.9	0	0	0	0	117.6
211	E	21.5	Very low	28	Very low	188 Å²	188	133.8 Å²	133.8	88%	0.879	74%	0.736	S	S	*	*			trans	86.8	160.7	172.8	-56.6	-169.9	160.1	0	0	117.3
212	A	28.6	Very low	27.5	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	74%	0.741	S	S	*	*			cis	-177	170.1	-41.9	0	0	0	0	0	108.5
213	E	26	Very low	26.8	Very low	164 Å²	164	133.1 Å²	133.1	77%	0.766	74%	0.739	S	S	*	*			cis	-163.1	172.5	-48.2	-175.5	158.6	-174.8	0	0	108.3
214	H	25.1	Very low	26.4	Very low	178 Å²	178	130.1 Å²	130.1	82%	0.824	73%	0.73	S	S	*	*			trans	68.2	163.2	173.8	-75.6	-53.1	0	0	0	117.3
215	A	25.2	Very low	25.2	Very low	71 Å²	71	133.9 Å²	133.9	59%	0.587	74%	0.739	S	S	*	*			cis	-168	-178	-21.1	0	0	0	0	0	110.3
216	T	24.2	Very low	25.1	Very low	131 Å²	131	129.7 Å²	129.7	80%	0.804	73%	0.731	S	S	*	*			trans	64.5	139.7	166.3	43.2	0	0	0	0	117.1
217	T	23.8	Very low	24.7	Very low	106 Å²	106	129 Å²	129	65%	0.65	73%	0.728	S	S	*	*			cis	74.8	82.1	33	-47.9	0	0	0	0	114.4
218	K	26.9	Very low	24.8	Very low	173 Å²	173	129.3 Å²	129.3	75%	0.752	73%	0.73	S	S	*	*				-159.6	143.4	106.4	-102.3	151.7	175.2	-169.2	0	111.5
219	Q	21.6	Very low	25	Very low	130 Å²	130	131.7 Å²	131.7	61%	0.607	73%	0.734	S	S	*	*			cis	76	139.6	40.9	-128	174.1	-37.9	0	0	113.3
220	E	21.9	Very low	24.9	Very low	134 Å²	134	128.3 Å²	128.3	63%	0.626	72%	0.722	S	S	*	*			trans	70.1	147.4	155.2	-76.7	140.3	-163.9	0	0	118.4
221	S	24.9	Very low	24.7	Very low	97 Å²	97	130.8 Å²	130.8	68%	0.678	73%	0.727	S	S	*	*			cis	-135.6	165.5	-0.2	53.9	0	0	0	0	109.1
222	E	20.9	Very low	25.1	Very low	159 Å²	159	125.8 Å²	125.8	74%	0.743	72%	0.718	S	S	*	*				40.7	146.3	66.6	-35.6	-171.6	119.8	0	0	112.7
223	T	20.1	Very low	25.1	Very low	113 Å²	113	128.3 Å²	128.3	69%	0.693	71%	0.714	S	S	*	*			cis	-156.9	170.5	16.1	-30.1	0	0	0	0	108
224	S	21.7	Very low	25.1	Very low	95 Å²	95	128.7 Å²	128.7	66%	0.664	71%	0.713	S	S	*	*			trans	59.8	132.6	147.5	63.8	0	0	0	0	118.5
225	E	25.9	Very low	25.2	Very low	180 Å²	180	123.3 Å²	123.3	84%	0.841	71%	0.706	S	S	*	*				53.9	154	56.9	-60.7	-163	148.1	0	0	114.6
226	P	29.4	Very low	25.4	Very low	100 Å²	100	127.6 Å²	127.6	65%	0.649	73%	0.725	S	S	*	*			cis	-118.1	-169.1	-32	32.5	-14.7	0	0	0	109.8
227	N	23.1	Very low	25.7	Very low	141 Å²	141	124.4 Å²	124.4	75%	0.754	72%	0.718	S	S	*	*				161.4	97.2	128.3	-79.6	-34.3	0	0	0	110.8
228	D	29.4	Very low	25.8	Very low	156 Å²	156	127.4 Å²	127.4	83%	0.834	73%	0.729	S	S	*	*				-57.4	138	128.7	-89.7	-61.3	0	0	0	107.2
229	P	31.7	Very low	25.8	Very low	112 Å²	112	124.8 Å²	124.8	73%	0.727	73%	0.728	S	S	*	*				-139.7	155.9	82.5	38.7	-25.2	0	0	0	116.3
230	A	24.6	Very low	25.9	Very low	77 Å²	77	126.4 Å²	126.4	64%	0.636	74%	0.741	S	S	*	*				0.9	153.8	123.7	0	0	0	0	0	118
231	D	23.2	Very low	26.3	Very low	152 Å²	152	123 Å²	123	81%	0.813	74%	0.742	S	S	*	*			cis	-163.5	174.4	11.1	-144.3	-42.2	0	0	0	109.7
232	A	28.5	Very low	26.5	Very low	82 Å²	82	124.8 Å²	124.8	68%	0.678	75%	0.749	S	S	*	*			trans	63.4	156.4	159.6	0	0	0	0	0	118.1
233	E	28.2	Very low	26.8	Very low	143 Å²	143	124.2 Å²	124.2	67%	0.668	74%	0.743	S	S	*	*			cis	-153.8	160.5	-17.3	-119.9	-165.5	170.5	0	0	110.7
234	K	27.8	Very low	27.3	Very low	173 Å²	173	124.5 Å²	124.5	75%	0.752	75%	0.745	S	S	*	*			trans	30.1	110.7	150.8	-58.8	166.6	-170.4	143.7	0	117.8
235	G	26	Very low	27.7	Very low	65 Å²	65	125.1 Å²	125.1	67%	0.67	74%	0.737	S	S	*	*				112.8	174.2	67.2	0	0	0	0	0	112.7
236	T	30.5	Very low	28	Very low	161 Å²	161	123.2 Å²	123.2	99%	0.988	73%	0.726	S	S	*	*			trans	67.7	144.4	-170.8	76.7	0	0	0	0	114.4
237	G	28.9	Very low	28	Very low	63 Å²	63	124.1 Å²	124.1	65%	0.649	73%	0.725	S	S	*	*			cis	-146.9	162.9	-10.4	0	0	0	0	0	108.6
238	L	25.8	Very low	28.2	Very low	169 Å²	169	123.9 Å²	123.9	89%	0.885	72%	0.724	S	S	*	*				46.9	122.4	70.4	-59.9	-174.1	0	0	0	112.1
239	T	28.2	Very low	28.1	Very low	119 Å²	119	125.2 Å²	125.2	73%	0.73	73%	0.726	S	S	*	*			cis	-156	151.8	8.4	20.9	0	0	0	0	108.1
240	N	23.2	Very low	27.9	Very low	163 Å²	163	128.2 Å²	128.2	87%	0.872	73%	0.73	S	S	*	*				68	127	62.4	-152.9	20.5	0	0	0	115.2
241	G	30.4	Very low	28.2	Very low	64 Å²	64	131.8 Å²	131.8	66%	0.66	73%	0.733	S	S	*	*			trans	104.6	156.8	173.6	0	0	0	0	0	116
242	V	28.8	Very low	28.4	Very low	134 Å²	134	129.7 Å²	129.7	81%	0.812	73%	0.726	S	S	*	*			cis	-160.5	128.9	-0.1	115.4	0	0	0	0	108.3
243	K	28.1	Very low	28.5	Very low	146 Å²	146	134.9 Å²	134.9	64%	0.635	74%	0.736	S	S	*	*				68.3	117.2	100.9	-115.1	-130.1	167.5	-167.1	0	114.2	E245	K243-E245 IonicContact NZ-OE1 2.68Å; K243-E245 PolarHBondContact NZ-OE1 2.71Å
244	V	28.8	Very low	28.4	Very low	119 Å²	119	131.1 Å²	131.1	72%	0.721	74%	0.736	S	S	*	*				90.2	-172.7	69.8	164.6	0	0	0	0	111.7
245	E	32.1	Very low	28.4	Very low	108 Å²	108	130 Å²	130	51%	0.505	73%	0.733	S	S	.	*			trans	90.1	131.4	175.6	-45.6	-65.7	112.9	0	0	113.7	K243	K243-E245 IonicContact NZ-OE1 2.68Å; K243-E245 PolarHBondContact NZ-OE1 2.71Å
246	K	32	Very low	28.5	Very low	141 Å²	141	134.7 Å²	134.7	61%	0.613	73%	0.731	S	S	*	*			cis	-162	144.6	-0.5	-111.8	-149.2	158.1	79.2	0	109.6
247	D	28.1	Very low	28.2	Very low	118 Å²	118	136.5 Å²	136.5	63%	0.631	72%	0.719	S	S	*	*				64.3	162.8	97.1	-62	30.5	0	0	0	115
248	D	28.3	Very low	28.1	Very low	137 Å²	137	139.5 Å²	139.5	73%	0.733	73%	0.725	S	S	*	*			cis	-174.9	166.2	-37.4	-94.3	-45	0	0	0	107.6
249	E	26.8	Very low	28.1	Very low	184 Å²	184	138.9 Å²	138.9	86%	0.86	72%	0.723	S	S	*	*			trans	166.9	117.5	150.7	-94.8	164.8	-164.3	0	0	107.2
250	E	28.5	Very low	27.9	Very low	174 Å²	174	136.3 Å²	136.3	81%	0.813	72%	0.72	S	S	*	*				58.6	140.4	54.8	-77.7	-172.3	174.2	0	0	113.5
251	E	30.2	Very low	28	Very low	152 Å²	152	135.8 Å²	135.8	71%	0.71	72%	0.717	S	S	*	*			cis	-169.1	160.6	-12.9	-161.9	-170.8	-148.2	0	0	105.9
252	T	27.9	Very low	27.8	Very low	108 Å²	108	138 Å²	138	66%	0.663	72%	0.717	S	S	*	*				158.7	151.7	97.6	35.3	0	0	0	0	113.5
253	E	28.8	Very low	27.7	Very low	192 Å²	192	140.5 Å²	140.5	90%	0.897	72%	0.717	S	S	*	*			trans	56.5	151.2	147.9	-66.3	-175.9	179.7	0	0	122.8
254	G	28.1	Very low	27.5	Very low	64 Å²	64	140.6 Å²	140.6	66%	0.66	72%	0.718	S	S	*	*			cis	170.2	179.8	-5.8	0	0	0	0	0	115.6
255	E	27.6	Very low	27.2	Very low	148 Å²	148	140.8 Å²	140.8	69%	0.692	71%	0.711	S	S	*	*			trans	72.4	152.9	163.9	-65.9	-149.4	119.3	0	0	119.6
256	R	26.9	Very low	26.8	Very low	165 Å²	165	143.3 Å²	143.3	62%	0.623	72%	0.723	S	S	*	*			cis	-165.1	152.1	8.2	-129.4	173.9	-166.1	159.4	31	116.2
257	R	25.5	Very low	26.3	Very low	198 Å²	198	144.5 Å²	144.5	75%	0.747	73%	0.73	S	S	*	*			trans	73.4	128.6	150.6	-56.1	-136.1	176.5	-162.3	-4.4	119.5
258	V	26.3	Very low	26	Very low	126 Å²	126	147 Å²	147	76%	0.764	74%	0.738	S	S	*	*				90.8	130.7	52.6	161	0	0	0	0	111.6
259	N	24.7	Very low	25.7	Very low	156 Å²	156	144.3 Å²	144.3	83%	0.834	73%	0.73	S	S	*	*			cis	-162.3	156.4	32.8	-145	9.9	0	0	0	115.8
260	G	25.4	Very low	25.6	Very low	65 Å²	65	142.6 Å²	142.6	67%	0.67	72%	0.722	S	S	*	*			trans	66.2	165.1	151	0	0	0	0	0	122.1
261	D	25.4	Very low	25.4	Very low	152 Å²	152	141.3 Å²	141.3	81%	0.813	72%	0.716	S	S	*	*			cis	-168.7	162.7	-21	-135.5	-30.5	0	0	0	114.2
262	V	25.4	Very low	25	Very low	110 Å²	110	139.3 Å²	139.3	67%	0.667	72%	0.719	S	S	*	*			trans	60	120.6	153.3	170.2	0	0	0	0	124.2
263	K	25.6	Very low	24.9	Very low	188 Å²	188	140 Å²	140	82%	0.817	72%	0.722	S	S	*	*			trans	57.9	168.9	148.8	-74	177.2	-177.2	-178.5	0	121.3
264	K	25.1	Very low	24.7	Very low	147 Å²	147	137.2 Å²	137.2	64%	0.639	72%	0.719	S	S	*	*			cis	145	139.1	-27.3	-172.5	-176.8	178.8	-120.3	0	109.7
265	E	23.1	Very low	24.7	Very low	124 Å²	124	143.3 Å²	143.3	58%	0.579	73%	0.727	S	S	*	*			trans	68.9	152	166.8	-81.3	154.5	166.6	0	0	116.3
266	E	22.4	Very low	25.5	Very low	161 Å²	161	141.3 Å²	141.3	75%	0.752	73%	0.727	S	S	*	*			cis	-158.1	-141.7	-16.2	-132	164.8	-169.9	0	0	111.6
267	E	22.9	Very low	25.5	Very low	166 Å²	166	143.6 Å²	143.6	78%	0.776	74%	0.737	S	S	*	*			trans	-63.6	-172.8	-177.7	-54.9	173.1	125.3	0	0	113.9
268	E	21.5	Very low	25.5	Very low	170 Å²	170	139.9 Å²	139.9	79%	0.794	74%	0.737	S	S	*	*			cis	-160.2	-106.5	22.8	-154.4	-154	128.7	0	0	114.4
269	S	22	Very low	25.4	Very low	80 Å²	80	142.3 Å²	142.3	56%	0.559	74%	0.74	S	S	*	*			trans	-131.8	170.8	-140	56.6	0	0	0	0	115.4
270	E	23.6	Very low	26.7	Very low	149 Å²	149	140.5 Å²	140.5	70%	0.696	74%	0.737	S	S	*	*			cis	-159.8	178.1	-11.6	-114.6	-82.9	52.6	0	0	110.8
271	Q	25.2	Very low	27.3	Very low	146 Å²	146	142.9 Å²	142.9	68%	0.682	74%	0.74	S	S	*	*			trans	-32.1	145.4	162.4	-72	155.2	62.4	0	0	118.5
272	S	22.2	Very low	27.7	Very low	111 Å²	111	145 Å²	145	78%	0.776	74%	0.742	S	S	*	*				-157.3	117.9	127.3	51.5	0	0	0	0	109.9
273	V	24.5	Very low	28.3	Very low	121 Å²	121	145.5 Å²	145.5	73%	0.733	75%	0.748	S	S	*	*				63.1	117.5	89.2	178.9	0	0	0	0	111.5
274	T	25.6	Very low	28.2	Very low	135 Å²	135	147.1 Å²	147.1	83%	0.828	75%	0.751	S	S	*	*				-156.2	157.9	73.5	-42.9	0	0	0	0	114.5
275	K	27.4	Very low	28.3	Very low	191 Å²	191	143.6 Å²	143.6	83%	0.83	75%	0.749	S	S	*	*			trans	-87.5	-176.5	173.6	-100.7	175	-176.2	178.3	0	111
276	P	44.6	Very low	28.4	Very low	106 Å²	106	146 Å²	146	69%	0.688	76%	0.76	S	S	*	*			cis	-156.3	164.4	36.2	43.2	-20.5	0	0	0	122.1
277	Y	26.2	Very low	28.6	Very low	213 Å²	213	144.6 Å²	144.6	84%	0.835	76%	0.755	S	S	*	*			trans	63.8	151.2	142.8	-87.7	-119.4	0	0	0	119.8
278	T	25.5	Very low	28.8	Very low	120 Å²	120	144.3 Å²	144.3	74%	0.736	75%	0.754	S	S	*	*			cis	-153.2	165	-2.8	-22.5	0	0	0	0	110.9
279	E	24.6	Very low	29	Very low	177 Å²	177	140.5 Å²	140.5	83%	0.827	75%	0.746	S	S	*	*			trans	-74.4	170.9	156	-70.5	-171.9	128.8	0	0	111.5
280	P	52.5	Low	29.1	Very low	119 Å²	119	145 Å²	145	77%	0.773	76%	0.758	S	S	*	*			cis	-125.5	-140	11.2	32.8	-6.8	0	0	0	110.5
281	P	37.9	Very low	29.2	Very low	114 Å²	114	145.6 Å²	145.6	74%	0.74	77%	0.765	S	S	*	*			cis	-141.8	-158.3	-6	45.8	-24.8	0	0	0	116.4
282	K	34.2	Very low	29.1	Very low	196 Å²	196	143.8 Å²	143.8	85%	0.852	77%	0.768	S	S	*	*			trans	-111.5	157.5	156	-64.1	-177.6	179.2	-177.6	0	107.2
283	P	36.7	Very low	29.3	Very low	122 Å²	122	142.3 Å²	142.3	79%	0.792	76%	0.763	S	S	*	*				-161.2	-172.1	55.4	45.9	-23.8	0	0	0	119.1
284	Y	23.5	Very low	29.4	Very low	222 Å²	222	144.3 Å²	144.3	87%	0.871	76%	0.764	S	S	*	*			trans	67	176.7	149.8	-141.7	-108.4	0	0	0	119.7
285	A	28.7	Very low	29.3	Very low	73 Å²	73	144 Å²	144	60%	0.603	76%	0.763	S	S	*	*			trans	-139.8	165.4	-161.7	0	0	0	0	0	112.5
286	E	24.9	Very low	29.3	Very low	174 Å²	174	143 Å²	143	81%	0.813	76%	0.761	S	S	*	*			trans	-169.5	177.4	144.7	-121	174.7	-172	0	0	114.1
287	M	25.8	Very low	28.5	Very low	131 Å²	131	148 Å²	148	65%	0.645	77%	0.766	S	S	*	*			trans	99.9	106.3	157.9	-146.3	98.6	-59	0	0	119.5
288	Q	27.2	Very low	28.4	Very low	161 Å²	161	144.5 Å²	144.5	75%	0.752	76%	0.762	S	S	*	*			trans	45.8	156.1	132.8	-61.2	169.2	-6.4	0	0	121.5
289	S	25.4	Very low	28.5	Very low	89 Å²	89	143.4 Å²	143.4	62%	0.622	76%	0.759	S	S	*	*			cis	-164.6	160.3	-18.1	-100.5	0	0	0	0	109.8
290	E	24	Very low	28.7	Very low	174 Å²	174	140.7 Å²	140.7	81%	0.813	75%	0.754	S	S	*	*			trans	46	107.5	147.5	-64	175.9	135.1	0	0	122
291	L	25.7	Very low	27.3	Very low	163 Å²	163	140.7 Å²	140.7	85%	0.853	75%	0.752	S	S	*	*				43.7	132.4	123.5	-98.9	71.8	0	0	0	123.1
292	S	24.9	Very low	26.8	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	75%	0.751	S	S	*	*			trans	70.4	130.1	139.7	-131	0	0	0	0	117.5
293	A	25.6	Very low	26.3	Very low	81 Å²	81	136.9 Å²	136.9	67%	0.669	74%	0.744	S	S	*	*			cis	54.6	123.3	49.9	0	0	0	0	0	112.3
294	Q	27.3	Very low	25.7	Very low	162 Å²	162	137.3 Å²	137.3	76%	0.757	74%	0.744	S	S	*	*			cis	-139.5	177.6	24.9	-62.1	164.8	-82.8	0	0	111.7
295	T	22.5	Very low	25.9	Very low	129 Å²	129	130.4 Å²	130.4	79%	0.791	73%	0.733	S	S	*	*			trans	-128.8	101.3	155.1	-56.9	0	0	0	0	109.1
296	E	26.9	Very low	25.8	Very low	171 Å²	171	136 Å²	136	80%	0.799	75%	0.747	S	S	*	*			trans	-116.9	160.4	160.1	-78.1	-161.1	123.6	0	0	110.2
297	R	27.9	Very low	25.9	Very low	210 Å²	210	132.7 Å²	132.7	79%	0.792	74%	0.743	S	S	*	*			trans	-113.7	136.9	172.4	-61.8	175.9	173.8	87.6	-2.5	106.8
298	D	23.9	Very low	26	Very low	140 Å²	140	132.3 Å²	132.3	75%	0.749	75%	0.753	S	S	*	*				-172.2	142.6	96.2	-105.5	-43.2	0	0	0	114.8
299	S	27.8	Very low	25.9	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	75%	0.754	S	S	*	*				21.6	136.1	122.7	-46	0	0	0	0	118.9
300	V	28.9	Very low	26	Very low	120 Å²	120	132.1 Å²	132.1	73%	0.727	77%	0.768	S	S	*	*			cis	-170	177.5	1.1	107.8	0	0	0	0	110
301	T	23.4	Very low	26.5	Very low	119 Å²	119	127.2 Å²	127.2	73%	0.73	76%	0.757	S	S	*	*			trans	66.7	145.7	170.2	47.6	0	0	0	0	119.6
302	T	26.9	Very low	26.6	Very low	115 Å²	115	127.4 Å²	127.4	71%	0.706	75%	0.754	S	S	*	*			cis	-165.9	163.8	-43.1	12.4	0	0	0	0	110.4
303	T	24.3	Very low	26.7	Very low	115 Å²	115	130 Å²	130	71%	0.706	75%	0.754	S	S	*	*			trans	68.3	113.7	149.8	44.4	0	0	0	0	122
304	T	25.2	Very low	26.9	Very low	130 Å²	130	135.3 Å²	135.3	80%	0.798	76%	0.762	S	S	*	*			trans	77.1	110.7	131.3	52.7	0	0	0	0	123.2
305	A	27.3	Very low	28	Very low	78 Å²	78	133 Å²	133	65%	0.645	76%	0.761	S	S	*	*				103.3	121.3	112	0	0	0	0	0	120.8
306	E	26.5	Very low	28.2	Very low	190 Å²	190	132.7 Å²	132.7	89%	0.888	75%	0.754	S	S	*	*			trans	54.2	129.4	134.4	-56.2	177.5	175.1	0	0	118.7
307	S	26.3	Very low	28.2	Very low	105 Å²	105	129.9 Å²	129.9	73%	0.734	75%	0.749	S	S	*	*				178.2	158.7	52	-165.4	0	0	0	0	111.9
308	S	27.2	Very low	28.3	Very low	122 Å²	122	127.5 Å²	127.5	85%	0.853	75%	0.747	S	S	*	*			trans	24.7	158.8	155.8	60.8	0	0	0	0	124.1
309	G	26.7	Very low	28.9	Very low	75 Å²	75	124.9 Å²	124.9	77%	0.773	74%	0.739	S	S	*	*			trans	-164.1	-55.2	178.4	0	0	0	0	0	119
310	D	27.6	Very low	29.1	Very low	171 Å²	171	128.8 Å²	128.8	91%	0.914	75%	0.747	S	S	*	*			trans	70.1	166	169.6	-146	1	0	0	0	120.7
311	A	32.7	Very low	29.1	Very low	71 Å²	71	128.8 Å²	128.8	59%	0.587	75%	0.752	S	S	*	*			trans	78.6	101.1	152.9	0	0	0	0	0	123.8
312	E	29.1	Very low	29.4	Very low	167 Å²	167	127.7 Å²	127.7	78%	0.78	76%	0.755	S	S	*	*			trans	65.2	156.6	131.9	-59.3	-161.4	77.5	0	0	121.2
313	Q	27.7	Very low	29.6	Very low	161 Å²	161	131.1 Å²	131.1	75%	0.752	76%	0.763	S	S	*	*			cis	-149.2	171.1	13.8	-144.1	155.2	59.1	0	0	113.4
314	K	29.3	Very low	30.7	Very low	194 Å²	194	130.9 Å²	130.9	84%	0.843	76%	0.763	S	S	*	*			trans	-138.4	-167.8	-178.9	-118.4	-174	-176	179.4	0	109.6
315	P	49.1	Very low	30.8	Very low	112 Å²	112	129.2 Å²	129.2	73%	0.727	76%	0.763	S	S	*	*			cis	-115.4	-124.2	8.5	24.4	2.6	0	0	0	113.2
316	N	26.9	Very low	30.8	Very low	123 Å²	123	130.3 Å²	130.3	66%	0.658	77%	0.772	S	S	*	*			cis	-164.9	175.2	2.5	-159.2	10.5	0	0	0	113.6
317	V	27.5	Very low	30.9	Very low	112 Å²	112	129.1 Å²	129.1	68%	0.679	77%	0.772	S	S	*	*			trans	69.6	105.4	168.2	-165.2	0	0	0	0	115.7
318	Q	30.8	Very low	30.9	Very low	161 Å²	161	127.9 Å²	127.9	75%	0.752	77%	0.768	S	S	*	*			cis	80.8	147.5	48.1	-64.1	-179.8	-25.2	0	0	114.6
319	S	35.3	Very low	31.4	Very low	85 Å²	85	127.9 Å²	127.9	59%	0.594	77%	0.765	S	S	*	*			cis	-179.7	162.5	-16.7	-82.5	0	0	0	0	107.8
320	E	33	Very low	32	Very low	178 Å²	178	129.5 Å²	129.5	83%	0.832	76%	0.762	S	S	*	*			cis	-174.4	-179.5	-23.4	-105.4	163.5	87.1	0	0	110.2
321	S	28.1	Very low	32.4	Very low	120 Å²	120	127.2 Å²	127.2	84%	0.839	76%	0.757	S	S	*	*			trans	110.5	125.4	150.2	-156	0	0	0	0	123.2
322	A	31	Very low	32.1	Very low	96 Å²	96	133.3 Å²	133.3	79%	0.793	77%	0.773	S	S	*	*			trans	70.6	160.3	145.9	0	0	0	0	0	124.9
323	Q	30.3	Very low	32.2	Very low	187 Å²	187	132.9 Å²	132.9	87%	0.874	78%	0.775	S	S	*	*			trans	-126.3	-166	-178.2	-48	-173.1	-35.4	0	0	110.8
324	P	46.4	Very low	32.2	Very low	110 Å²	110	131.6 Å²	131.6	71%	0.714	78%	0.778	S	S	*	*			cis	-140.6	-178.6	-9.1	42.2	-23.2	0	0	0	117.8
325	A	28.1	Very low	32.4	Very low	96 Å²	96	131.2 Å²	131.2	79%	0.793	78%	0.776	S	S	*	*			trans	82.9	124.9	144.4	0	0	0	0	0	124.8
326	A	28	Very low	32	Very low	100 Å²	100	131.3 Å²	131.3	83%	0.826	78%	0.777	S	S	*	*			trans	48.4	120.8	141.5	0	0	0	0	0	124.4
327	D	27.1	Very low	32.1	Very low	165 Å²	165	131.6 Å²	131.6	88%	0.882	78%	0.783	S	S	*	*				-168	-178.3	108.1	-143.4	-26.7	0	0	0	112
328	A	26.4	Very low	32.4	Very low	80 Å²	80	135.1 Å²	135.1	66%	0.661	78%	0.784	S	S	*	*			trans	-141.1	-175	179.2	0	0	0	0	0	111.8
329	P	37.4	Very low	32.9	Very low	121 Å²	121	135.8 Å²	135.8	79%	0.786	78%	0.784	S	S	*	*			cis	-123.4	-121.2	-10.2	25.1	0.9	0	0	0	113.5
330	P	40.8	Very low	32.9	Very low	110 Å²	110	140.1 Å²	140.1	71%	0.714	80%	0.795	S	S	*	*				-111.1	170.6	-98.7	38.5	-26.4	0	0	0	116.5
331	P	35.6	Very low	32.8	Very low	123 Å²	123	134.7 Å²	134.7	80%	0.799	79%	0.787	S	S	*	*			trans	-90.9	161.7	177	36.3	-35.9	0	0	0	115.2
332	Q	27.2	Very low	32.8	Very low	198 Å²	198	137.7 Å²	137.7	93%	0.925	79%	0.785	S	S	*	*			trans	-131.5	172.9	165.5	-76.4	-160.1	3.3	0	0	112.4
333	L	31.1	Very low	32.9	Very low	159 Å²	159	141.1 Å²	141.1	83%	0.832	78%	0.784	S	S	*	*			trans	-60.4	165.9	175	-64.5	145.5	0	0	0	111.2
334	V	26.8	Very low	33.1	Very low	134 Å²	134	138.1 Å²	138.1	81%	0.812	77%	0.774	S	S	*	*			cis	-156.7	161.3	45.7	-161.7	0	0	0	0	112.6
335	K	33.9	Very low	33.5	Very low	185 Å²	185	138.7 Å²	138.7	80%	0.804	78%	0.778	S	S	*	*			trans	-53.8	157.2	165.1	-42.2	169	-175.4	174	0	111.5
336	P	40.4	Very low	33.5	Very low	114 Å²	114	141.5 Å²	141.5	74%	0.74	78%	0.779	S	S	*	*				-164.4	177	79.5	46	-25.3	0	0	0	119.1
337	V	29.3	Very low	33.7	Very low	129 Å²	129	147.4 Å²	147.4	78%	0.782	78%	0.78	S	S	*	*			trans	56.5	144.2	132.6	158.2	0	0	0	0	122
338	R	34.3	Very low	33.8	Very low	187 Å²	187	149.2 Å²	149.2	71%	0.706	78%	0.781	S	S	*	*			cis	174.5	126	-9	172.5	-174.5	174.1	109.1	-12.8	114.3
339	K	41.3	Very low	34.1	Very low	174 Å²	174	149.7 Å²	149.7	76%	0.757	78%	0.779	S	S	*	*			trans	65.7	171.9	155.3	-63.3	-178.4	179.9	-162.4	0	116.9
340	Q	34.8	Very low	34.1	Very low	177 Å²	177	155.5 Å²	155.5	83%	0.827	79%	0.786	S	S	*	*			cis	-138.5	177	18	-54.3	174.2	5.9	0	0	111.1
341	G	30	Very low	34	Very low	63 Å²	63	159.2 Å²	159.2	65%	0.649	79%	0.793	S	S	*	*			cis	-150.2	-157	-2	0	0	0	0	0	108.4
342	F	28.2	Very low	34.3	Very low	184 Å²	184	158.9 Å²	158.9	81%	0.807	79%	0.791	S	S	*	*			cis	-146.7	140.2	-7	-81	-92	0	0	0	107
343	H	33.9	Very low	34.5	Very low	167 Å²	167	156.6 Å²	156.6	77%	0.773	79%	0.785	S	S	*	*				54.9	119.1	92.4	-90.8	-90.9	0	0	0	117.8
344	N	34.8	Very low	34.3	Very low	124 Å²	124	160.1 Å²	160.1	66%	0.663	79%	0.788	S	S	*	*			cis	84.9	119.3	22.3	-169.8	29.6	0	0	0	116.5
345	P	53	Low	34.9	Very low	123 Å²	123	165.1 Å²	165.1	80%	0.799	79%	0.793	S	S	*	*				-153.2	136.9	113.6	37.2	-18.9	0	0	0	118.6
346	N	28.7	Very low	35.3	Very low	154 Å²	154	161.7 Å²	161.7	82%	0.824	79%	0.787	S	S	*	*				-163.2	153.2	127.9	-147.4	-27.6	0	0	0	111.9
347	R	32.2	Very low	35.4	Very low	224 Å²	224	164.3 Å²	164.3	85%	0.845	79%	0.793	S	S	*	*			trans	-166.5	102.6	-169.8	-173.6	-163.6	-173.5	-144.4	4.5	116.9
348	F	30.5	Very low	36	Very low	203 Å²	203	166 Å²	166	89%	0.89	79%	0.79	S	S	*	*			trans	-161.9	156	156	-77.7	-75.3	0	0	0	110.4
349	S	32.6	Very low	36.4	Very low	90 Å²	90	164 Å²	164	63%	0.629	79%	0.793	S	S	*	*				-168.9	152.5	-52.3	55.7	0	0	0	0	112.4
350	R	36.1	Very low	36.7	Very low	244 Å²	244	164.4 Å²	164.4	92%	0.921	80%	0.798	S	S	*	*			trans	99.9	144.5	162.3	-57.2	-175.5	177.9	-154.2	-2.7	119.2
351	E	39.6	Very low	37.1	Very low	188 Å²	188	161.2 Å²	161.2	88%	0.879	79%	0.793	S	S	*	*			trans	-116.1	166.6	-175.5	-56	153.5	106.5	0	0	111.5
352	P	41.5	Very low	38	Very low	116 Å²	116	163.4 Å²	163.4	75%	0.753	80%	0.795	S	S	*	*				-148.9	171.5	106.1	39.5	-24.6	0	0	0	113.6
353	L	31.7	Very low	39.1	Very low	150 Å²	150	160.3 Å²	160.3	79%	0.785	79%	0.794	S	S	*	*			cis	-163.7	124.9	-19.9	-109.1	169.7	0	0	0	107.1
354	Y	27.6	Very low	39.6	Very low	232 Å²	232	158.8 Å²	158.8	91%	0.91	80%	0.796	S	S	*	*			trans	-110.5	122.8	164.1	-92.4	-83.2	0	0	0	110.1
355	R	37.8	Very low	40.3	Very low	239 Å²	239	160.3 Å²	160.3	90%	0.902	80%	0.803	S	S	*	*			trans	-95.2	132.5	170.5	-88.5	-169.3	175	-99.2	-0.2	111.1
356	V	43	Very low	39.9	Very low	113 Å²	113	158.7 Å²	158.7	69%	0.685	80%	0.795	S	S	*	*			trans	-82.2	130.4	-176.4	172.1	0	0	0	0	111.9	K358	V356-K358 HydrophobicContact CG1-CB 3.75Å; V356-K358 HydrophobicContact CG1-CD 4.48Å; V356-K358 HydrophobicContact CG1-CG 3.71Å
357	I	42.3	Very low	41.2	Very low	170 Å²	170	158.2 Å²	158.2	87%	0.872	79%	0.79	S	S	*	*			trans	-133.2	74.7	146.3	-53.4	178.5	0	0	0	105.2
358	K	41.9	Very low	42	Very low	163 Å²	163	153.5 Å²	153.5	71%	0.709	78%	0.782	S	S	*	*				46.9	120.8	93.7	-113.6	-170	174.4	-178	0	114.5	V356	V356-K358 HydrophobicContact CG1-CB 3.75Å; V356-K358 HydrophobicContact CG1-CD 4.48Å; V356-K358 HydrophobicContact CG1-CG 3.71Å
359	N	42.7	Very low	43.5	Very low	146 Å²	146	151 Å²	151	78%	0.781	78%	0.777	S	S	*	*			trans	77.1	51.1	158.1	-55.7	7.3	0	0	0	118.5
360	Q	46.9	Very low	44.7	Very low	182 Å²	182	150.8 Å²	150.8	85%	0.85	77%	0.769	S	S	*	*			trans	-130.2	141.4	137	-71.1	-169.8	-1.1	0	0	109.3
361	P	45	Very low	46	Very low	111 Å²	111	145.2 Å²	145.2	72%	0.721	75%	0.753	S	S	*	*			trans	-68	156.8	163.9	31.7	-34.1	0	0	0	109.8
362	P	48.4	Very low	47.4	Very low	109 Å²	109	138.3 Å²	138.3	71%	0.708	72%	0.722	S	S	*	*			trans	-59.4	144.6	171.2	27.1	-34.5	0	0	0	110.2	V364	P362-V364 PolarHBondContact O-N 3.49Å; P362-V364 VanDerWaalsContact O-N 3.1Å
363	P	50.4	Low	49.3	Very low	119 Å²	119	136.5 Å²	136.5	77%	0.773	71%	0.711	S	S	*	*			trans	-64.4	115.8	-177.7	26	-33.7	0	0	0	110.2	L365	P363-L365 PolarHBondContact O-N 3.36Å
364	V	46	Very low	51.8	Low	134 Å²	134	133.1 Å²	133.1	81%	0.812	69%	0.69	S	S	*	*			trans	-63.3	118.6	171.8	177.6	0	0	0	0	108	P362 S366	P362-V364 PolarHBondContact O-N 3.49Å; P362-V364 VanDerWaalsContact O-N 3.1Å; V364-S366 VanDerWaalsContact C-N 3.29Å; V364-S366 PolarHBondContact O-N 3.37Å
365	L	47.6	Very low	54.5	Low	157 Å²	157	127.1 Å²	127.1	82%	0.822	67%	0.669	S	S	*	*			trans	-73.4	85	174.6	-67.4	177	0	0	0	109.4	P363 I367	P363-L365 PolarHBondContact O-N 3.36Å; L365-I367 PolarHBondContact O-N 2.8Å
366	S	44.6	Very low	57	Low	88 Å²	88	116.5 Å²	116.5	62%	0.615	63%	0.631	S	S	*	*			trans	-65.9	98.5	166.6	48.9	0	0	0	0	109.4	V364 N368	V364-S366 VanDerWaalsContact C-N 3.29Å; V364-S366 PolarHBondContact O-N 3.37Å; S366-N368 PolarHBondContact O-N 3.35Å; S366-N368 PolarHBondContact O-ND2 3.44Å
367	I	56.1	Low	59	Low	144 Å²	144	114.5 Å²	114.5	74%	0.738	63%	0.633	S	S	*	*			trans	-67.6	101	171.9	-55.3	177.3	0	0	0	107	L365 L369	L365-I367 PolarHBondContact O-N 2.8Å; I367-L369 HydrophobicContact CG2-CD1 4.11Å; I367-L369 WeakPolarHBondContact O-CD1 3.44Å; I367-L369 PolarHBondContact O-N 3.33Å
368	N	50.2	Low	60.9	Low	125 Å²	125	107.5 Å²	107.5	67%	0.668	60%	0.6	S	S	*	*			trans	-74.7	111	175.8	-74.7	-88.6	0	0	0	108.2	S366 D370	S366-N368 PolarHBondContact O-N 3.35Å; S366-N368 PolarHBondContact O-ND2 3.44Å; N368-D370 PolarHBondContact O-N 3.38Å
369	L	60.8	Low	62.7	Low	151 Å²	151	106.1 Å²	106.1	79%	0.791	61%	0.608	S	S	*	*			trans	-71	-12.2	-175.5	-99.2	67.1	0	0	0	114.1	I367 H371	I367-L369 HydrophobicContact CG2-CD1 4.11Å; I367-L369 WeakPolarHBondContact O-CD1 3.44Å; I367-L369 PolarHBondContact O-N 3.33Å; L369-H371 PolarHBondContact O-N 3.18Å
370	D	58.7	Low	64.3	Low	86 Å²	86	103.2 Å²	103.2	46%	0.46	61%	0.612	S	S	.	*			trans	-84.7	106.3	173.5	-172.1	-9.5	0	0	0	111	N368 N372 K375	N368-D370 PolarHBondContact O-N 3.38Å; D370-N372 PolarHBondContact O-N 2.87Å; D370-N372 WeakPolarHBondContact OD1-CA 3.06Å; D370-N372 PolarHBondContact OD1-N 3.45Å; D370-K375 IonicContact OD1-NZ 3.81Å; D370-K375 WeakPolarHBondContact OD2-CE 3.46Å; D370-K375 IonicContact OD2-NZ 3.73Å; D370-K375 PolarHBondContact OD2-NZ 3.31Å
371	H	63.3	Low	66.2	Low	127 Å²	127	95.5 Å²	95.5	59%	0.588	58%	0.578	S	S	*	*	S	Bend	trans	-74.6	-4.3	177.1	-66.6	-9.8	0	0	0	114.2	L369 P373 R386	L369-H371 PolarHBondContact O-N 3.18Å; H371-P373 VanDerWaalsContact O-CD 3.3Å; H371-P373 WeakPolarHBondContact O-CD 3.48Å; H371-R386 VanDerWaalsContact O-CG 3.24Å; H371-R386 WeakPolarHBondContact O-CG 3.49Å
372	N	69.9	Low	68.2	Low	42 Å²	42	96.7 Å²	96.7	23%	0.225	58%	0.584	C	S	.	*			trans	-121.9	61.1	-173.5	-119.5	13.2	0	0	0	112.4	D370 F374 K375 S384 F385 R386	D370-N372 PolarHBondContact O-N 2.87Å; D370-N372 WeakPolarHBondContact OD1-CA 3.06Å; D370-N372 PolarHBondContact OD1-N 3.45Å; N372-F374 VanDerWaalsContact C-N 3.32Å; N372-F374 PolarHBondContact O-N 2.97Å; N372-K375 PolarHBondContact O-NZ 2.77Å; N372-S384 VanDerWaalsContact CG-C 3.49Å; N372-S384 PolarHBondContact ND2-O 3.05Å; N372-S384 PolarHBondContact ND2-OG 3.11Å; N372-F385 VanDerWaalsContact OD1-CA 3.24Å; N372-F385 WeakPolarHBondContact OD1-CA 3.32Å; N372-F385 PolarHBondContact OD1-N 3.44Å; N372-R386 WeakPolarHBondContact OD1-CG 2.92Å; N372-R386 PolarHBondContact OD1-N 2.99Å
373	P	79.7	Confident	70	Confident	79 Å²	79	96.7 Å²	96.7	51%	0.513	57%	0.573	S	S	.	*			trans	-71.2	-17.3	-171.8	28.3	-36.5	0	0	0	115.2	H371	H371-P373 VanDerWaalsContact O-CD 3.3Å; H371-P373 WeakPolarHBondContact O-CD 3.48Å
374	F	84.1	Confident	71.9	Confident	79 Å²	79	92.9 Å²	92.9	35%	0.346	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	86.7	-179.3	-56.1	-76.8	0	0	0	110.1	N372 F385 K387 A388 L391	N372-F374 VanDerWaalsContact C-N 3.32Å; N372-F374 PolarHBondContact O-N 2.97Å; F374-F385 HydrophobicContact CB-CB 4.39Å; F374-F385 WeakPolarHBondContact CB-O 3.39Å; F374-F385 PolarHBondContact N-O 3.42Å; F374-F385 VanDerWaalsContact N-O 3.07Å; F374-F385 WeakPolarHBondContact O-CD2 3.27Å; F374-F385 PolarHBondContact O-N 3.02Å; F374-K387 VanDerWaalsContact CD2-C 3.49Å; F374-A388 HydrophobicContact CD1-CB 3.82Å; F374-A388 HydrophobicContact CD2-CB 4.41Å; F374-A388 VanDerWaalsContact CD2-N 3.28Å; F374-A388 HydrophobicContact CE1-CB 3.66Å; F374-A388 HydrophobicContact CE2-CB 4.26Å; F374-A388 HydrophobicContact CG-CB 4.2Å; F374-A388 HydrophobicContact CZ-CB 3.89Å; F374-L391 HydrophobicContact CB-CB 3.93Å; F374-L391 HydrophobicContact CB-CD2 3.81Å; F374-L391 HydrophobicContact CB-CG 4.49Å
375	K	86.1	Confident	73.9	Confident	106 Å²	106	88.1 Å²	88.1	46%	0.461	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	149.5	179.8	-44.7	-163	-169.7	-62.7	0	111.2	D370 N372 L391	D370-K375 IonicContact OD1-NZ 3.81Å; D370-K375 WeakPolarHBondContact OD2-CE 3.46Å; D370-K375 IonicContact OD2-NZ 3.73Å; D370-K375 PolarHBondContact OD2-NZ 3.31Å; N372-K375 PolarHBondContact O-NZ 2.77Å; K375-L391 WeakPolarHBondContact O-CD2 3.42Å
376	C	89.5	Confident	75.8	Confident	16 Å²	16	89 Å²	89	11%	0.108	51%	0.51	C	S	.	.			trans	-71.5	139.5	174.8	-159	0	0	0	0	110.7	C381 K383 L391 H394 H399	C376-C381 HydrophobicContact CB-CB 4.24Å; C376-K383 WeakPolarHBondContact CB-O 3.39Å; C376-K383 PolarHBondContact N-O 2.91Å; C376-L391 HydrophobicContact CB-CD1 4.15Å; C376-H394 VanDerWaalsContact SG-CD2 3.53Å; C376-H394 PolarHBondContact SG-NE2 3.02Å; C376-H399 PolarHBondContact SG-NE2 2.94Å; C376-H399 VanDerWaalsContact SG-NE2 3.38Å
377	G	83.9	Confident	77.8	Confident	71 Å²	71	92.2 Å²	92.2	73%	0.732	51%	0.512	S	S	*	.			trans	-99.6	0.9	-179.6	0	0	0	0	0	114.6
378	A	82.6	Confident	79.3	Confident	22 Å²	22	87.8 Å²	87.8	18%	0.182	50%	0.497	C	S	.	.	S	Bend	trans	-74.9	137.5	179.8	0	0	0	0	0	110.9	G380 C381 H399	A378-G380 PolarHBondContact O-N 3.47Å; A378-C381 HydrophobicContact CB-CB 3.96Å; A378-C381 WeakPolarHBondContact O-CB 3.43Å; A378-C381 PolarHBondContact O-N 3.43Å; A378-H399 HydrophobicContact CB-CB 4.43Å; A378-H399 VanDerWaalsContact CB-ND1 3.25Å; A378-H399 WeakPolarHBondContact CB-ND1 3.47Å
379	P	79.9	Confident	81.1	Confident	134 Å²	134	90.6 Å²	90.6	87%	0.87	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	131.5	-179.7	24.6	-33.5	0	0	0	110.7	C381	P379-C381 VanDerWaalsContact C-N 3.28Å; P379-C381 PolarHBondContact O-N 2.88Å
380	G	77.1	Confident	82.5	Confident	85 Å²	85	88.4 Å²	88.4	88%	0.876	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-6.9	-174.6	0	0	0	0	0	115.8	A378	A378-G380 PolarHBondContact O-N 3.47Å
381	C	86.8	Confident	84	Confident	20 Å²	20	85.5 Å²	85.5	14%	0.135	48%	0.476	C	S	.	.			trans	-97	99.4	-177	-160.8	0	0	0	0	113.5	C376 A378 P379 K383 H394 H399	C376-C381 HydrophobicContact CB-CB 4.24Å; A378-C381 HydrophobicContact CB-CB 3.96Å; A378-C381 WeakPolarHBondContact O-CB 3.43Å; A378-C381 PolarHBondContact O-N 3.43Å; P379-C381 VanDerWaalsContact C-N 3.28Å; P379-C381 PolarHBondContact O-N 2.88Å; C381-K383 VanDerWaalsContact C-N 3.29Å; C381-K383 PolarHBondContact O-N 3.21Å; C381-H394 PolarHBondContact SG-NE2 3.19Å; C381-H399 WeakPolarHBondContact CB-CE1 3.19Å; C381-H399 WeakPolarHBondContact CB-NE2 3.41Å; C381-H399 PolarHBondContact SG-CE1 3.19Å; C381-H399 PolarHBondContact SG-NE2 3.22Å
382	T	86.3	Confident	85	Confident	136 Å²	136	85.9 Å²	85.9	83%	0.834	48%	0.478	S	S	*	.			trans	-79.3	0.1	-178.7	55.5	0	0	0	0	115.2	S384	T382-S384 PolarHBondContact O-N 3.01Å
383	K	87.4	Confident	86	Confident	110 Å²	110	90.2 Å²	90.2	48%	0.478	49%	0.493	S	S	.	.			trans	-67.2	135.1	-172.8	-62.5	-165.6	-177.6	-175.2	0	111.8	C376 C381 F385	C376-K383 WeakPolarHBondContact CB-O 3.39Å; C376-K383 PolarHBondContact N-O 2.91Å; C381-K383 VanDerWaalsContact C-N 3.29Å; C381-K383 PolarHBondContact O-N 3.21Å; K383-F385 HydrophobicContact CB-CE2 3.95Å; K383-F385 HydrophobicContact CB-CZ 3.82Å
384	S	89.1	Confident	86.5	Confident	39 Å²	39	86.8 Å²	86.8	27%	0.273	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	152.1	178.6	52	0	0	0	0	112.3	N372 T382	N372-S384 VanDerWaalsContact CG-C 3.49Å; N372-S384 PolarHBondContact ND2-O 3.05Å; N372-S384 PolarHBondContact ND2-OG 3.11Å; T382-S384 PolarHBondContact O-N 3.01Å
385	F	87.3	Confident	86.6	Confident	33 Å²	33	87.2 Å²	87.2	15%	0.145	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.8	-165.1	-54.6	-83.4	0	0	0	112.5	N372 F374 K383 K387 L390 L391 H394	N372-F385 VanDerWaalsContact OD1-CA 3.24Å; N372-F385 WeakPolarHBondContact OD1-CA 3.32Å; N372-F385 PolarHBondContact OD1-N 3.44Å; F374-F385 HydrophobicContact CB-CB 4.39Å; F374-F385 WeakPolarHBondContact CB-O 3.39Å; F374-F385 PolarHBondContact N-O 3.42Å; F374-F385 VanDerWaalsContact N-O 3.07Å; F374-F385 WeakPolarHBondContact O-CD2 3.27Å; F374-F385 PolarHBondContact O-N 3.02Å; K383-F385 HydrophobicContact CB-CE2 3.95Å; K383-F385 HydrophobicContact CB-CZ 3.82Å; F385-K387 VanDerWaalsContact C-N 3.27Å; F385-K387 PolarHBondContact O-N 2.86Å; F385-L390 HydrophobicContact CB-CB 4.19Å; F385-L390 HydrophobicContact CD1-CB 3.98Å; F385-L390 HydrophobicContact CD1-CD2 4.13Å; F385-L390 HydrophobicContact CD1-CG 4.23Å; F385-L390 HydrophobicContact CG-CB 4.27Å; F385-L391 HydrophobicContact CB-CB 4.4Å; F385-L391 HydrophobicContact CD2-CB 3.8Å; F385-L391 HydrophobicContact CD2-CD1 3.93Å; F385-L391 HydrophobicContact CD2-CG 4.47Å; F385-L391 HydrophobicContact CE2-CD1 4.05Å; F385-L391 HydrophobicContact CG-CB 4.35Å; F385-H394 HydrophobicContact CE1-CB 4.25Å; F385-H394 HydrophobicContact CE2-CB 3.79Å; F385-H394 AromaticContact CE2-CD2 3.46Å; F385-H394 VanDerWaalsContact CE2-CD2 3.46Å; F385-H394 WeakPolarHBondContact CE2-CD2 3.34Å; F385-H394 AromaticContact CE2-CG 3.76Å; F385-H394 HydrophobicContact CZ-CB 3.49Å; F385-H394 VanDerWaalsContact CZ-CB 3.49Å; F385-H394 AromaticContact CZ-CD2 3.56Å; F385-H394 AromaticContact CZ-CG 3.45Å; F385-H394 VanDerWaalsContact CZ-CG 3.45Å
386	R	87.8	Confident	86.5	Confident	177 Å²	177	87.8 Å²	87.8	67%	0.668	48%	0.476	S	S	*	.	S	Bend	trans	-75.7	-12.8	178.2	-49.8	-159.8	176.4	173.2	0.3	113.6	H371 N372	H371-R386 VanDerWaalsContact O-CG 3.24Å; H371-R386 WeakPolarHBondContact O-CG 3.49Å; N372-R386 WeakPolarHBondContact OD1-CG 2.92Å; N372-R386 PolarHBondContact OD1-N 2.99Å
387	K	87.4	Confident	86.1	Confident	154 Å²	154	93.2 Å²	93.2	67%	0.67	50%	0.495	S	S	*	.	S	Bend	trans	-142.1	129.7	-173.6	-65.9	176.5	-178.4	170.8	0	111.3	F374 F385 K389 L390 L391	F374-K387 VanDerWaalsContact CD2-C 3.49Å; F385-K387 VanDerWaalsContact C-N 3.27Å; F385-K387 PolarHBondContact O-N 2.86Å; K387-K389 VanDerWaalsContact C-N 3.25Å; K387-K389 PolarHBondContact O-N 2.95Å; K387-K389 VanDerWaalsContact O-N 3.14Å; K387-L390 WeakPolarHBondContact O-CB 3.22Å; K387-L390 PolarHBondContact O-N 3.08Å; K387-L391 PolarHBondContact O-N 2.8Å
388	A	86.6	Confident	85.8	Confident	51 Å²	51	97 Å²	97	42%	0.421	49%	0.488	S	S	.	.	H	α-helix	trans	-53.1	-36	-178.8	0	0	0	0	0	114.5	F374 L390 L391 H392	F374-A388 HydrophobicContact CD1-CB 3.82Å; F374-A388 HydrophobicContact CD2-CB 4.41Å; F374-A388 VanDerWaalsContact CD2-N 3.28Å; F374-A388 HydrophobicContact CE1-CB 3.66Å; F374-A388 HydrophobicContact CE2-CB 4.26Å; F374-A388 HydrophobicContact CG-CB 4.2Å; F374-A388 HydrophobicContact CZ-CB 3.89Å; A388-L390 VanDerWaalsContact C-N 3.26Å; A388-L390 PolarHBondContact O-N 3.38Å; A388-L391 PolarHBondContact O-N 3.03Å; A388-H392 WeakPolarHBondContact O-CB 2.64Å; A388-H392 PolarHBondContact O-N 2.99Å
389	K	89.2	Confident	85.8	Confident	184 Å²	184	100.1 Å²	100.1	80%	0.8	50%	0.499	S	S	*	.	H	α-helix	trans	-61.9	-32.3	176.3	-74	-170.1	175.3	-173.9	0	113.3	K387 Y393	K387-K389 VanDerWaalsContact C-N 3.25Å; K387-K389 PolarHBondContact O-N 2.95Å; K387-K389 VanDerWaalsContact O-N 3.14Å; K389-Y393 WeakPolarHBondContact O-CB 3.45Å; K389-Y393 PolarHBondContact O-N 3.44Å
390	L	90.3	Very high	85	Confident	105 Å²	105	96.1 Å²	96.1	55%	0.55	48%	0.482	S	S	.	.	H	α-helix	trans	-76.9	-38.2	179.3	-129.9	66.4	0	0	0	111	F385 K387 A388 Y393 H394	F385-L390 HydrophobicContact CB-CB 4.19Å; F385-L390 HydrophobicContact CD1-CB 3.98Å; F385-L390 HydrophobicContact CD1-CD2 4.13Å; F385-L390 HydrophobicContact CD1-CG 4.23Å; F385-L390 HydrophobicContact CG-CB 4.27Å; K387-L390 WeakPolarHBondContact O-CB 3.22Å; K387-L390 PolarHBondContact O-N 3.08Å; A388-L390 VanDerWaalsContact C-N 3.26Å; A388-L390 PolarHBondContact O-N 3.38Å; L390-Y393 PolarHBondContact O-N 3.05Å; L390-H394 WeakPolarHBondContact O-CB 2.67Å; L390-H394 PolarHBondContact O-N 2.96Å
391	L	88.9	Confident	83.5	Confident	25 Å²	25	101.1 Å²	101.1	13%	0.131	48%	0.483	C	S	.	.	H	α-helix	trans	-60.7	-47.1	167.4	173.5	61.2	0	0	0	111.3	F374 K375 C376 F385 K387 A388 Y393 H394 M395	F374-L391 HydrophobicContact CB-CB 3.93Å; F374-L391 HydrophobicContact CB-CD2 3.81Å; F374-L391 HydrophobicContact CB-CG 4.49Å; K375-L391 WeakPolarHBondContact O-CD2 3.42Å; C376-L391 HydrophobicContact CB-CD1 4.15Å; F385-L391 HydrophobicContact CB-CB 4.4Å; F385-L391 HydrophobicContact CD2-CB 3.8Å; F385-L391 HydrophobicContact CD2-CD1 3.93Å; F385-L391 HydrophobicContact CD2-CG 4.47Å; F385-L391 HydrophobicContact CE2-CD1 4.05Å; F385-L391 HydrophobicContact CG-CB 4.35Å; K387-L391 PolarHBondContact O-N 2.8Å; A388-L391 PolarHBondContact O-N 3.03Å; L391-Y393 VanDerWaalsContact C-N 3.33Å; L391-Y393 PolarHBondContact O-N 2.96Å; L391-H394 CarbonylContact O-C 3.54Å; L391-H394 WeakPolarHBondContact O-CB 3.3Å; L391-H394 PolarHBondContact O-N 3.29Å; L391-H394 VanDerWaalsContact O-N 3.13Å; L391-M395 HydrophobicContact CD1-CG 3.82Å; L391-M395 HydrophobicContact CD1-SD 3.87Å; L391-M395 HydrophobicContact CD2-SD 4.39Å; L391-M395 HydrophobicContact CG-CG 4.31Å; L391-M395 HydrophobicContact CG-SD 3.94Å; L391-M395 WeakPolarHBondContact O-CG 2.79Å; L391-M395 PolarHBondContact O-N 3.42Å
392	H	85	Confident	81.2	Confident	135 Å²	135	109.6 Å²	109.6	63%	0.625	52%	0.52	S	S	*	.	H	α-helix	trans	-63.4	-37.6	179.5	-174.4	-68.8	0	0	0	112.3	A388 K396	A388-H392 WeakPolarHBondContact O-CB 2.64Å; A388-H392 PolarHBondContact O-N 2.99Å; H392-K396 VanDerWaalsContact O-CB 3.27Å; H392-K396 WeakPolarHBondContact O-CB 3.49Å; H392-K396 PolarHBondContact O-N 2.92Å
393	Y	90.9	Very high	78.8	Confident	134 Å²	134	110.6 Å²	110.6	53%	0.525	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-47.8	170.8	-172.7	-84.1	0	0	0	110.7	K389 L390 L391 M395 K396 Y397	K389-Y393 WeakPolarHBondContact O-CB 3.45Å; K389-Y393 PolarHBondContact O-N 3.44Å; L390-Y393 PolarHBondContact O-N 3.05Å; L391-Y393 VanDerWaalsContact C-N 3.33Å; L391-Y393 PolarHBondContact O-N 2.96Å; Y393-M395 PolarHBondContact O-N 2.98Å; Y393-K396 PolarHBondContact O-N 3.13Å; Y393-Y397 AromaticContact CD1-CD2 3.91Å; Y393-Y397 HydrophobicContact CD1-CD2 3.91Å; Y393-Y397 AromaticContact CD2-CD2 3.66Å; Y393-Y397 HydrophobicContact CD2-CD2 3.66Å; Y393-Y397 AromaticContact CD2-CE2 3.62Å; Y393-Y397 HydrophobicContact CD2-CE2 3.62Å; Y393-Y397 AromaticContact CE1-CD2 3.77Å; Y393-Y397 HydrophobicContact CE1-CD2 3.77Å; Y393-Y397 HydrophobicContact CE1-CE2 4.49Å; Y393-Y397 HydrophobicContact CE1-CG 4.26Å; Y393-Y397 AromaticContact CE2-CD2 3.52Å; Y393-Y397 HydrophobicContact CE2-CD2 3.52Å; Y393-Y397 AromaticContact CE2-CE2 3.4Å; Y393-Y397 HydrophobicContact CE2-CE2 3.4Å; Y393-Y397 AromaticContact CG-CD2 3.85Å; Y393-Y397 HydrophobicContact CG-CD2 3.85Å; Y393-Y397 HydrophobicContact CG-CE2 4.27Å; Y393-Y397 AromaticContact CZ-CD2 3.57Å; Y393-Y397 AromaticContact CZ-CE2 3.87Å; Y393-Y397 WeakPolarHBondContact O-CD2 3.32Å; Y393-Y397 PolarHBondContact O-N 3.02Å
394	H	89.6	Confident	76.7	Confident	7 Å²	7	111.1 Å²	111.1	3%	0.032	53%	0.534	C	S	.	.	H	α-helix	trans	-60.3	-45.6	178.5	175.4	52	0	0	0	112.7	C376 C381 F385 L390 L391 Y398 H399	C376-H394 VanDerWaalsContact SG-CD2 3.53Å; C376-H394 PolarHBondContact SG-NE2 3.02Å; C381-H394 PolarHBondContact SG-NE2 3.19Å; F385-H394 HydrophobicContact CE1-CB 4.25Å; F385-H394 HydrophobicContact CE2-CB 3.79Å; F385-H394 AromaticContact CE2-CD2 3.46Å; F385-H394 VanDerWaalsContact CE2-CD2 3.46Å; F385-H394 WeakPolarHBondContact CE2-CD2 3.34Å; F385-H394 AromaticContact CE2-CG 3.76Å; F385-H394 HydrophobicContact CZ-CB 3.49Å; F385-H394 VanDerWaalsContact CZ-CB 3.49Å; F385-H394 AromaticContact CZ-CD2 3.56Å; F385-H394 AromaticContact CZ-CG 3.45Å; F385-H394 VanDerWaalsContact CZ-CG 3.45Å; L390-H394 WeakPolarHBondContact O-CB 2.67Å; L390-H394 PolarHBondContact O-N 2.96Å; L391-H394 CarbonylContact O-C 3.54Å; L391-H394 WeakPolarHBondContact O-CB 3.3Å; L391-H394 PolarHBondContact O-N 3.29Å; L391-H394 VanDerWaalsContact O-N 3.13Å; H394-Y398 HydrophobicContact CB-CD2 4.5Å; H394-Y398 AromaticContact CE1-CD2 3.98Å; H394-Y398 AromaticContact CE1-CG 3.78Å; H394-Y398 AromaticContact ND1-CD2 3.2Å; H394-Y398 WeakPolarHBondContact ND1-CD2 3.42Å; H394-Y398 AromaticContact ND1-CE2 3.91Å; H394-Y398 AromaticContact ND1-CG 3.47Å; H394-Y398 WeakPolarHBondContact O-CB 3.47Å; H394-Y398 WeakPolarHBondContact O-CD2 3.37Å; H394-Y398 PolarHBondContact O-N 3.16Å; H394-H399 AromaticContact CD2-NE2 3.42Å; H394-H399 PolarHBondContact CD2-NE2 3.16Å; H394-H399 AromaticContact CE1-CD2 3.84Å; H394-H399 AromaticContact CE1-NE2 2.66Å; H394-H399 PolarHBondContact CE1-NE2 3.31Å; H394-H399 AromaticContact ND1-NE2 3.81Å; H394-H399 AromaticContact NE2-CD2 3.59Å; H394-H399 AromaticContact NE2-NE2 2.3Å; H394-H399 PolarHBondContact NE2-NE2 3.43Å
395	M	86.2	Confident	74.2	Confident	88 Å²	88	115.1 Å²	115.1	43%	0.433	56%	0.557	S	S	.	*	H	α-helix	trans	-62	-46	174.8	-68.8	179.6	72.8	0	0	111.3	L391 Y393 Y397 H399 G400	L391-M395 HydrophobicContact CD1-CG 3.82Å; L391-M395 HydrophobicContact CD1-SD 3.87Å; L391-M395 HydrophobicContact CD2-SD 4.39Å; L391-M395 HydrophobicContact CG-CG 4.31Å; L391-M395 HydrophobicContact CG-SD 3.94Å; L391-M395 WeakPolarHBondContact O-CG 2.79Å; L391-M395 PolarHBondContact O-N 3.42Å; Y393-M395 PolarHBondContact O-N 2.98Å; M395-Y397 PolarHBondContact O-N 3.28Å; M395-H399 CarbonylContact O-C 3.59Å; M395-H399 VanDerWaalsContact O-CA 3.3Å; M395-H399 WeakPolarHBondContact O-CA 3.42Å; M395-H399 WeakPolarHBondContact O-CB 3.45Å; M395-H399 PolarHBondContact O-N 3.33Å; M395-G400 PolarHBondContact O-N 3.14Å
396	K	84	Confident	71.8	Confident	118 Å²	118	122.5 Å²	122.5	51%	0.513	59%	0.592	S	S	.	*	H	α-helix	trans	-62.3	-39.7	-179.5	-172.7	-175.3	174.5	-155.1	0	113.5	H392 Y393 G400	H392-K396 VanDerWaalsContact O-CB 3.27Å; H392-K396 WeakPolarHBondContact O-CB 3.49Å; H392-K396 PolarHBondContact O-N 2.92Å; Y393-K396 PolarHBondContact O-N 3.13Å; K396-G400 WeakPolarHBondContact O-CA 3.48Å
397	Y	81.2	Confident	69.4	Low	130 Å²	130	117.5 Å²	117.5	51%	0.51	60%	0.595	S	S	.	*	H	α-helix	trans	-104	-9.5	-170.5	-69.9	-76.4	0	0	0	115.2	Y393 M395	Y393-Y397 AromaticContact CD1-CD2 3.91Å; Y393-Y397 HydrophobicContact CD1-CD2 3.91Å; Y393-Y397 AromaticContact CD2-CD2 3.66Å; Y393-Y397 HydrophobicContact CD2-CD2 3.66Å; Y393-Y397 AromaticContact CD2-CE2 3.62Å; Y393-Y397 HydrophobicContact CD2-CE2 3.62Å; Y393-Y397 AromaticContact CE1-CD2 3.77Å; Y393-Y397 HydrophobicContact CE1-CD2 3.77Å; Y393-Y397 HydrophobicContact CE1-CE2 4.49Å; Y393-Y397 HydrophobicContact CE1-CG 4.26Å; Y393-Y397 AromaticContact CE2-CD2 3.52Å; Y393-Y397 HydrophobicContact CE2-CD2 3.52Å; Y393-Y397 AromaticContact CE2-CE2 3.4Å; Y393-Y397 HydrophobicContact CE2-CE2 3.4Å; Y393-Y397 AromaticContact CG-CD2 3.85Å; Y393-Y397 HydrophobicContact CG-CD2 3.85Å; Y393-Y397 HydrophobicContact CG-CE2 4.27Å; Y393-Y397 AromaticContact CZ-CD2 3.57Å; Y393-Y397 AromaticContact CZ-CE2 3.87Å; Y393-Y397 WeakPolarHBondContact O-CD2 3.32Å; Y393-Y397 PolarHBondContact O-N 3.02Å; M395-Y397 PolarHBondContact O-N 3.28Å
398	Y	77.9	Confident	67.3	Low	149 Å²	149	115.5 Å²	115.5	58%	0.584	60%	0.598	S	S	*	*	H	α-helix	trans	-123.4	-11.3	176.2	-59.5	-98.5	0	0	0	113.5	H394	H394-Y398 HydrophobicContact CB-CD2 4.5Å; H394-Y398 AromaticContact CE1-CD2 3.98Å; H394-Y398 AromaticContact CE1-CG 3.78Å; H394-Y398 AromaticContact ND1-CD2 3.2Å; H394-Y398 WeakPolarHBondContact ND1-CD2 3.42Å; H394-Y398 AromaticContact ND1-CE2 3.91Å; H394-Y398 AromaticContact ND1-CG 3.47Å; H394-Y398 WeakPolarHBondContact O-CB 3.47Å; H394-Y398 WeakPolarHBondContact O-CD2 3.37Å; H394-Y398 PolarHBondContact O-N 3.16Å
399	H	82.4	Confident	64.6	Low	89 Å²	89	122.4 Å²	122.4	41%	0.412	62%	0.621	S	S	.	*	S	Bend	trans	-141.4	34.8	-179.1	-53.3	-74.3	0	0	0	111.1	C376 A378 C381 H394 M395	C376-H399 PolarHBondContact SG-NE2 2.94Å; C376-H399 VanDerWaalsContact SG-NE2 3.38Å; A378-H399 HydrophobicContact CB-CB 4.43Å; A378-H399 VanDerWaalsContact CB-ND1 3.25Å; A378-H399 WeakPolarHBondContact CB-ND1 3.47Å; C381-H399 WeakPolarHBondContact CB-CE1 3.19Å; C381-H399 WeakPolarHBondContact CB-NE2 3.41Å; C381-H399 PolarHBondContact SG-CE1 3.19Å; C381-H399 PolarHBondContact SG-NE2 3.22Å; H394-H399 AromaticContact CD2-NE2 3.42Å; H394-H399 PolarHBondContact CD2-NE2 3.16Å; H394-H399 AromaticContact CE1-CD2 3.84Å; H394-H399 AromaticContact CE1-NE2 2.66Å; H394-H399 PolarHBondContact CE1-NE2 3.31Å; H394-H399 AromaticContact ND1-NE2 3.81Å; H394-H399 AromaticContact NE2-CD2 3.59Å; H394-H399 AromaticContact NE2-NE2 2.3Å; H394-H399 PolarHBondContact NE2-NE2 3.43Å; M395-H399 CarbonylContact O-C 3.59Å; M395-H399 VanDerWaalsContact O-CA 3.3Å; M395-H399 WeakPolarHBondContact O-CA 3.42Å; M395-H399 WeakPolarHBondContact O-CB 3.45Å; M395-H399 PolarHBondContact O-N 3.33Å
400	G	63.1	Low	61.7	Low	49 Å²	49	118.9 Å²	118.9	51%	0.505	62%	0.62	S	S	.	*			trans	-79.3	121.7	-169	0	0	0	0	0	113.7	M395 K396	M395-G400 PolarHBondContact O-N 3.14Å; K396-G400 WeakPolarHBondContact O-CA 3.48Å
401	E	45.6	Very low	59.7	Low	191 Å²	191	119.2 Å²	119.2	89%	0.893	63%	0.628	S	S	*	*			trans	43.7	76.9	163.9	-64.6	-171.4	161.1	0	0	117.7
402	E	38.3	Very low	57	Low	197 Å²	197	124.1 Å²	124.1	92%	0.921	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-91.2	127.3	141.4	-72.1	-158.5	145.8	0	0	110
403	L	35.8	Very low	54.5	Low	158 Å²	158	128.6 Å²	128.6	83%	0.827	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-89	134.7	174	-98.7	157.8	0	0	0	109.9
404	P	45	Very low	51.6	Low	121 Å²	121	126.6 Å²	126.6	79%	0.786	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-67.8	137.9	-179	-18.2	31.1	0	0	0	112.8
405	V	35.4	Very low	48.8	Very low	122 Å²	122	131.9 Å²	131.9	74%	0.739	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-101.6	136.5	166.6	174.8	0	0	0	0	109.1
406	E	38.1	Very low	46.3	Very low	189 Å²	189	135.4 Å²	135.4	88%	0.883	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-89.5	129.1	-171.7	-67.1	-167.6	145.9	0	0	115.2
407	G	35.7	Very low	44	Very low	72 Å²	72	135.9 Å²	135.9	74%	0.742	74%	0.737	S	S	*	*			trans	73.3	-169.1	134.3	0	0	0	0	0	118.8
408	P	44.3	Very low	41.7	Very low	111 Å²	111	141.5 Å²	141.5	72%	0.721	76%	0.757	S	S	*	*			cis	-129.6	162.8	-3.1	40.8	-27.1	0	0	0	115
409	H	30	Very low	39.5	Very low	196 Å²	196	138.9 Å²	138.9	91%	0.907	77%	0.767	S	S	*	*			trans	-162.4	167.3	144.8	-93.9	-47.7	0	0	0	111.1
410	S	27.6	Very low	37	Very low	111 Å²	111	140.4 Å²	140.4	78%	0.776	79%	0.788	S	S	*	*			trans	-121.2	-156.5	-158.2	-51.1	0	0	0	0	113.4
411	P	48.7	Very low	35.6	Very low	111 Å²	111	144.2 Å²	144.2	72%	0.721	80%	0.796	S	S	*	*				-129.5	-166.1	-111.1	40.5	-20.9	0	0	0	115.8
412	T	33.2	Very low	34.8	Very low	128 Å²	128	144.2 Å²	144.2	79%	0.785	79%	0.793	S	S	*	*			trans	75.2	136	174.6	0.3	0	0	0	0	113.9
413	R	31.9	Very low	34.4	Very low	230 Å²	230	142.9 Å²	142.9	87%	0.868	79%	0.787	S	S	*	*			cis	-151.6	170.7	36.4	-80.1	-178.6	177.1	177.3	-1.4	111
414	S	29.7	Very low	34.8	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	78%	0.782	S	S	*	*			cis	177.6	-176.1	-24.1	62.9	0	0	0	0	110.8
415	V	30.3	Very low	33.9	Very low	118 Å²	118	139.4 Å²	139.4	72%	0.715	78%	0.782	S	S	*	*			trans	89.2	117.9	154.1	166.3	0	0	0	0	121
416	Q	34.8	Very low	33.5	Very low	162 Å²	162	138.3 Å²	138.3	76%	0.757	79%	0.785	S	S	*	*			trans	75.2	100.1	148	-80.9	169.9	7.6	0	0	125.1
417	T	35.2	Very low	33.1	Very low	129 Å²	129	133.7 Å²	133.7	79%	0.791	78%	0.78	S	S	*	*				64.2	153.3	122.4	59.3	0	0	0	0	121.5
418	R	32.9	Very low	33.3	Very low	247 Å²	247	136.7 Å²	136.7	93%	0.932	79%	0.786	S	S	*	*			cis	-142.9	161.9	6.5	-159.1	170.3	175.7	161.3	-2.4	110.4
419	A	32.4	Very low	32.5	Very low	95 Å²	95	134.9 Å²	134.9	79%	0.785	79%	0.787	S	S	*	*			trans	-100.4	160.4	-171.3	0	0	0	0	0	115.6
420	S	29.6	Very low	32.7	Very low	121 Å²	121	133.6 Å²	133.6	85%	0.846	79%	0.786	S	S	*	*			trans	-174.5	153.4	136.6	-168.7	0	0	0	0	110.5
421	D	33	Very low	32.7	Very low	129 Å²	129	133.5 Å²	133.5	69%	0.69	78%	0.777	S	S	*	*			cis	179.8	120	-49	175.8	11.1	0	0	0	107.5
422	K	29.5	Very low	31.8	Very low	190 Å²	190	133.6 Å²	133.6	83%	0.826	78%	0.78	S	S	*	*			trans	176.3	146	132.1	-95.9	169.4	-176.9	-177.1	0	115.5
423	Q	28.3	Very low	31.7	Very low	170 Å²	170	131.6 Å²	131.6	79%	0.794	77%	0.772	S	S	*	*			trans	-127.4	-163.2	179.8	-83.3	-78.6	-28.2	0	0	107.4
424	P	44.4	Very low	31.6	Very low	110 Å²	110	128.7 Å²	128.7	71%	0.714	77%	0.766	S	S	*	*			cis	-136.1	166.7	-7.2	20.2	5.5	0	0	0	117.6
425	A	27.6	Very low	31.9	Very low	96 Å²	96	134.9 Å²	134.9	79%	0.793	78%	0.775	S	S	*	*			trans	60	165.5	140.1	0	0	0	0	0	120.9
426	A	26.6	Very low	31.9	Very low	98 Å²	98	137.7 Å²	137.7	81%	0.81	77%	0.773	S	S	*	*			cis	-144.8	170	6.6	0	0	0	0	0	113.5
427	A	28.4	Very low	31.8	Very low	93 Å²	93	141 Å²	141	77%	0.769	78%	0.778	S	S	*	*			trans	-107.7	-162.9	169.6	0	0	0	0	0	110
428	P	41.9	Very low	31.6	Very low	135 Å²	135	138.6 Å²	138.6	88%	0.877	76%	0.763	S	S	*	*			cis	-145.4	-171.3	34	43.4	-21.7	0	0	0	117.5
429	G	26.8	Very low	31.3	Very low	72 Å²	72	133.8 Å²	133.8	74%	0.742	75%	0.754	S	S	*	*			trans	130.7	78.1	167.1	0	0	0	0	0	114.2
430	L	33.6	Very low	31.1	Very low	169 Å²	169	133.5 Å²	133.5	89%	0.885	75%	0.747	S	S	*	*				88.1	125.3	77.3	-171.4	75.4	0	0	0	113.2
431	D	26.9	Very low	31	Very low	109 Å²	109	132 Å²	132	58%	0.583	74%	0.742	S	S	*	*			cis	-103.7	-102.7	-1.2	174.5	40.6	0	0	0	114	S433	D431-S433 VanDerWaalsContact OD2-CB 3.31Å; D431-S433 WeakPolarHBondContact OD2-CB 3.37Å; D431-S433 PolarHBondContact OD2-N 3.26Å; D431-S433 PolarHBondContact OD2-OG 3.2Å
432	S	31	Very low	30.9	Very low	113 Å²	113	130.5 Å²	130.5	79%	0.79	74%	0.741	S	S	*	*			cis	-133.7	136.9	9.9	60.3	0	0	0	0	114
433	S	30.3	Very low	30.8	Very low	86 Å²	86	128 Å²	128	60%	0.601	73%	0.734	S	S	*	*			trans	-90.1	161.6	-175.2	-73.7	0	0	0	0	115.5	D431	D431-S433 VanDerWaalsContact OD2-CB 3.31Å; D431-S433 WeakPolarHBondContact OD2-CB 3.37Å; D431-S433 PolarHBondContact OD2-N 3.26Å; D431-S433 PolarHBondContact OD2-OG 3.2Å
434	K	31.2	Very low	30.8	Very low	170 Å²	170	127.2 Å²	127.2	74%	0.739	73%	0.73	S	S	*	*			cis	-179.8	135.7	-34.5	-116.9	167.3	-175.7	157.4	0	110.3
435	R	34.9	Very low	30	Very low	221 Å²	221	126.6 Å²	126.6	83%	0.834	73%	0.729	S	S	*	*			trans	64	164.1	153.9	-76	-166.8	167.7	-162.9	-2.9	118.3
436	R	29.3	Very low	30	Very low	177 Å²	177	129 Å²	129	67%	0.668	73%	0.734	S	S	*	*			cis	-176.8	140	-22.5	170.1	-176.1	-170	-121.5	7	110
437	R	33.5	Very low	30.1	Very low	232 Å²	232	128.4 Å²	128.4	88%	0.875	74%	0.736	S	S	*	*			trans	-171.5	115.9	146.1	-95.3	158.8	-142	-165.5	5.1	106.3
438	T	30.8	Very low	30.1	Very low	77 Å²	77	128.9 Å²	128.9	47%	0.472	74%	0.741	S	S	.	*				60.5	104.5	75.1	62.9	0	0	0	0	112.2
439	I	28	Very low	29.3	Very low	146 Å²	146	127.1 Å²	127.1	75%	0.749	74%	0.737	S	S	*	*				67	112.3	85.1	-65.3	162.9	0	0	0	109.8
440	S	27.8	Very low	29.4	Very low	89 Å²	89	128.6 Å²	128.6	62%	0.622	74%	0.742	S	S	*	*			cis	98.4	157.1	30.1	80.7	0	0	0	0	114.8
441	A	27.8	Very low	29.6	Very low	91 Å²	91	124.9 Å²	124.9	75%	0.752	74%	0.736	S	S	*	*			trans	75.4	139.1	-167.7	0	0	0	0	0	114.7
442	S	29.3	Very low	30.5	Very low	96 Å²	96	125.2 Å²	125.2	67%	0.671	74%	0.744	S	S	*	*			cis	89.7	149.3	32.7	-149.5	0	0	0	0	112.4
443	M	29.2	Very low	30.7	Very low	138 Å²	138	131.5 Å²	131.5	68%	0.68	75%	0.751	S	S	*	*			cis	-153.2	178.3	25.7	-61.3	-105.2	27	0	0	113.8
444	H	28.4	Very low	30.6	Very low	153 Å²	153	130.8 Å²	130.8	71%	0.708	76%	0.757	S	S	*	*			trans	70.7	110.7	140.9	-62.9	-35.9	0	0	0	124.4
445	S	27	Very low	30.7	Very low	98 Å²	98	129.5 Å²	129.5	69%	0.685	76%	0.758	S	S	*	*				64.6	145	120	74.3	0	0	0	0	124.9
446	V	28.3	Very low	30.8	Very low	147 Å²	147	124.8 Å²	124.8	89%	0.891	75%	0.748	S	S	*	*			trans	61.9	148.5	158.7	-63.5	0	0	0	0	120.6
447	G	27.1	Very low	31.2	Very low	84 Å²	84	125.6 Å²	125.6	87%	0.866	76%	0.757	S	S	*	*			trans	105.9	145	162.4	0	0	0	0	0	114.8
448	A	28.2	Very low	31.2	Very low	104 Å²	104	119 Å²	119	86%	0.86	75%	0.752	S	S	*	*			trans	-127.1	176.9	177.9	0	0	0	0	0	111.3
449	A	27	Very low	31.2	Very low	98 Å²	98	120.5 Å²	120.5	81%	0.81	77%	0.772	S	S	*	*			trans	91.6	144.3	163.8	0	0	0	0	0	120
450	A	28	Very low	31.3	Very low	102 Å²	102	116.8 Å²	116.8	84%	0.843	77%	0.77	S	S	*	*			trans	63.2	123.6	159.7	0	0	0	0	0	121.1
451	A	38.8	Very low	31.7	Very low	92 Å²	92	122.9 Å²	122.9	76%	0.76	78%	0.779	S	S	*	*			trans	-91.7	179.4	160.5	0	0	0	0	0	111.3
452	P	44.8	Very low	32.2	Very low	116 Å²	116	127.6 Å²	127.6	75%	0.753	78%	0.778	S	S	*	*				-148.8	138.9	116.5	29.8	-10.3	0	0	0	118.4
453	R	34.9	Very low	32.2	Very low	244 Å²	244	129 Å²	129	92%	0.921	78%	0.783	S	S	*	*			trans	76.5	129.9	137.2	-67.2	-179.3	-176.8	-71	-10.5	124
454	G	29.1	Very low	32.1	Very low	72 Å²	72	127.3 Å²	127.3	74%	0.742	78%	0.784	S	S	*	*			trans	123.6	137.1	137.2	0	0	0	0	0	117.1
455	D	33.4	Very low	32.1	Very low	143 Å²	143	124.8 Å²	124.8	77%	0.765	79%	0.79	S	S	*	*			cis	-166	161	-22	-134.7	-28	0	0	0	113.5
456	I	36.3	Very low	33.6	Very low	121 Å²	121	125.7 Å²	125.7	62%	0.621	79%	0.794	S	S	*	*			trans	65.3	109.3	152.2	-69.3	156.9	0	0	0	123.8
457	K	38	Very low	34.5	Very low	194 Å²	194	124.3 Å²	124.3	84%	0.843	79%	0.788	S	S	*	*				51.9	162.2	128.4	-44.5	175.3	-173.4	170.2	0	121.5
458	A	34.2	Very low	34.6	Very low	93 Å²	93	124.6 Å²	124.6	77%	0.769	78%	0.781	S	S	*	*			cis	-159	151.9	12.2	0	0	0	0	0	116.5
459	A	30.4	Very low	34.6	Very low	109 Å²	109	126.6 Å²	126.6	90%	0.901	78%	0.783	S	S	*	*			trans	64	121.6	139.2	0	0	0	0	0	125.2
460	G	30.4	Very low	34.5	Very low	69 Å²	69	126.7 Å²	126.7	71%	0.711	78%	0.777	S	S	*	*				137.7	105.2	99.9	0	0	0	0	0	123
461	R	35.2	Very low	34.6	Very low	216 Å²	216	128.1 Å²	128.1	82%	0.815	78%	0.776	S	S	*	*			trans	70.2	149.7	141.6	-72.2	-176.2	-176.7	-117.4	1.4	120.5
462	R	37.8	Very low	34.2	Very low	190 Å²	190	132.9 Å²	132.9	72%	0.717	78%	0.782	S	S	*	*			cis	-177.8	140.7	-23.4	-126.4	-173.8	-161.6	-158.2	2.6	112.3
463	T	29.5	Very low	33.3	Very low	126 Å²	126	131.7 Å²	131.7	77%	0.773	78%	0.777	S	S	*	*			trans	59.9	157.7	147.6	42.3	0	0	0	0	120.9
464	S	27.2	Very low	33	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	77%	0.766	S	S	*	*			cis	-172.6	142.4	-8.9	45	0	0	0	0	114.9
465	A	28.5	Very low	33.1	Very low	100 Å²	100	130.7 Å²	130.7	83%	0.826	76%	0.763	S	S	*	*			trans	49.4	155.4	132.9	0	0	0	0	0	125.5
466	P	59.8	Low	32.9	Very low	118 Å²	118	131.1 Å²	131.1	77%	0.766	76%	0.76	S	S	*	*			trans	-114.3	-176.3	-173.8	45.1	-35.7	0	0	0	116.1
467	P	46	Very low	32.3	Very low	118 Å²	118	136 Å²	136	77%	0.766	77%	0.771	S	S	*	*				-138.2	171.8	111.7	38.6	-25.6	0	0	0	112.7
468	A	28.8	Very low	31.7	Very low	89 Å²	89	130.8 Å²	130.8	74%	0.736	76%	0.764	S	S	*	*			cis	86.6	140.8	19.5	0	0	0	0	0	116.1
469	V	28.2	Very low	31.3	Very low	147 Å²	147	133.6 Å²	133.6	89%	0.891	77%	0.765	S	S	*	*			cis	-114.5	-117.7	4.7	-157.1	0	0	0	0	112.5
470	S	24.9	Very low	31.1	Very low	99 Å²	99	135.6 Å²	135.6	69%	0.692	76%	0.76	S	S	*	*			cis	-161.2	126.1	0.2	54.6	0	0	0	0	115
471	T	29.6	Very low	31	Very low	132 Å²	132	142.2 Å²	142.2	81%	0.81	76%	0.763	S	S	*	*			trans	37.5	118.4	148.7	59.4	0	0	0	0	124.2
472	H	30.5	Very low	30.5	Very low	193 Å²	193	141.2 Å²	141.2	89%	0.894	77%	0.768	S	S	*	*				-158.4	-178	99.2	-152.4	-104.4	0	0	0	111.1
473	S	26.3	Very low	30.1	Very low	91 Å²	91	140.4 Å²	140.4	64%	0.636	77%	0.77	S	S	*	*			trans	-121.9	171	-163.6	-172.1	0	0	0	0	115.5
474	H	29.4	Very low	30.1	Very low	151 Å²	151	140 Å²	140	70%	0.699	77%	0.771	S	S	*	*			trans	107.3	119.1	163.6	-78.2	-102.9	0	0	0	122
475	Q	30.2	Very low	30.2	Very low	144 Å²	144	144.6 Å²	144.6	67%	0.673	78%	0.779	S	S	*	*			trans	64.8	119.8	137.5	-78.1	171.5	-77.6	0	0	125.1
476	Q	29.7	Very low	30	Very low	151 Å²	151	147.9 Å²	147.9	71%	0.706	78%	0.777	S	S	*	*				55.4	131.5	123.9	-69.8	176.9	-42.1	0	0	123.7
477	R	24.6	Very low	28.3	Very low	224 Å²	224	148 Å²	148	85%	0.845	77%	0.771	S	S	*	*			trans	54.1	110.3	142.9	-82.3	-172.1	177.5	141.6	-1.3	121.2
478	A	24.8	Very low	27.5	Very low	84 Å²	84	149.6 Å²	149.6	69%	0.694	77%	0.768	S	S	*	*				66.7	143.9	103.9	0	0	0	0	0	122.6
479	L	25	Very low	27.4	Very low	153 Å²	153	152.8 Å²	152.8	80%	0.801	77%	0.772	S	S	*	*			trans	72.6	115.3	157.7	-63.9	172.2	0	0	0	120.5
480	L	26.1	Very low	27.3	Very low	150 Å²	150	152.7 Å²	152.7	79%	0.785	77%	0.767	S	S	*	*				59.7	119.1	128.8	-65.4	178	0	0	0	122
481	R	28.7	Very low	27.5	Very low	208 Å²	208	158.2 Å²	158.2	79%	0.785	77%	0.772	S	S	*	*				84.2	116.8	123.4	-169.1	-162	-150.4	-147.6	17	118.9
482	E	24.4	Very low	27.3	Very low	195 Å²	195	159.3 Å²	159.3	91%	0.911	77%	0.773	S	S	*	*			trans	-131.1	165.8	149.1	-83.8	-125.5	93	0	0	110.7
483	K	30.3	Very low	27	Very low	174 Å²	174	158.7 Å²	158.7	76%	0.757	78%	0.775	S	S	*	*			trans	-132.8	131.7	178.4	-84.4	-176.7	172.3	-177.9	0	110.8
484	S	29	Very low	27	Very low	116 Å²	116	159.5 Å²	159.5	81%	0.811	78%	0.78	S	S	*	*			trans	-150.9	125.7	154.2	39	0	0	0	0	107.4
485	K	29.5	Very low	26.8	Very low	199 Å²	199	160.3 Å²	160.3	87%	0.865	78%	0.784	S	S	*	*			cis	75.5	143.7	39.9	-90.5	-167	169.6	-172.1	0	115.3
486	E	24.7	Very low	26.6	Very low	170 Å²	170	159.3 Å²	159.3	79%	0.794	78%	0.783	S	S	*	*			trans	75.3	143.1	170.2	-85.7	-169.6	78	0	0	118
487	N	24.6	Very low	26.4	Very low	119 Å²	119	160 Å²	160	64%	0.636	79%	0.786	S	S	*	*			cis	-159.6	176.2	-6.9	-150.9	-23.7	0	0	0	112.6
488	Q	27.3	Very low	26.5	Very low	153 Å²	153	155.5 Å²	155.5	72%	0.715	78%	0.779	S	S	*	*			trans	86.1	110.7	151.7	-71.6	170.9	76.3	0	0	123
489	L	26.8	Very low	26.5	Very low	156 Å²	156	161.3 Å²	161.3	82%	0.817	79%	0.788	S	S	*	*				40.6	132	120.3	-52.4	174.7	0	0	0	121.6
490	D	27.4	Very low	26.7	Very low	144 Å²	144	160.7 Å²	160.7	77%	0.77	79%	0.786	S	S	*	*				-177	-160.9	90.7	-144.7	-48.8	0	0	0	112.1
491	R	27.8	Very low	26.9	Very low	215 Å²	215	158.7 Å²	158.7	81%	0.811	78%	0.78	S	S	*	*			trans	-98.7	158.8	-153.2	-72.2	151.7	70.4	158	4	118.9
492	N	26.7	Very low	26.8	Very low	156 Å²	156	154.2 Å²	154.2	83%	0.834	77%	0.772	S	S	*	*			trans	-26.3	144.6	158.8	-53.2	-85.8	0	0	0	118.8
493	L	23.8	Very low	27.1	Very low	179 Å²	179	152.5 Å²	152.5	94%	0.937	76%	0.761	S	S	*	*			trans	-146.9	163.1	139.4	-169	54	0	0	0	110.4
494	C	25.6	Very low	26.8	Very low	108 Å²	108	151.1 Å²	151.1	73%	0.73	76%	0.761	S	S	*	*			trans	-140.3	173.3	-173.1	-165.4	0	0	0	0	110.9
495	Q	26.8	Very low	26.5	Very low	169 Å²	169	150.3 Å²	150.3	79%	0.79	75%	0.754	S	S	*	*			trans	69	153	172.2	-75.3	-177.5	6.9	0	0	115.8
496	L	26.3	Very low	26.2	Very low	123 Å²	123	149.6 Å²	149.6	64%	0.644	75%	0.751	S	S	*	*			cis	-147	-180	1.3	-107.4	151.1	0	0	0	106.6
497	Q	24.6	Very low	26.1	Very low	166 Å²	166	147.3 Å²	147.3	78%	0.776	74%	0.744	S	S	*	*			cis	-156.6	155.5	24.3	-170	160.8	92	0	0	113.2
498	D	26.8	Very low	26	Very low	129 Å²	129	148.8 Å²	148.8	69%	0.69	75%	0.75	S	S	*	*			trans	-66	157.5	171.9	-62.2	-90.3	0	0	0	116.7
499	K	25.3	Very low	25.8	Very low	206 Å²	206	144.2 Å²	144.2	90%	0.896	74%	0.744	S	S	*	*				-166.3	155.9	106.9	-104.2	165	-174.7	170.2	0	115
500	D	28.6	Very low	25.7	Very low	139 Å²	139	146.7 Å²	146.7	74%	0.743	75%	0.749	S	S	*	*			trans	-132.9	-178	-163.9	-168.7	4.8	0	0	0	110.4
501	T	29.6	Very low	26.3	Very low	108 Å²	108	144.8 Å²	144.8	66%	0.663	74%	0.744	S	S	*	*			trans	73	145.6	163.3	64.4	0	0	0	0	117.5
502	D	27.3	Very low	26.3	Very low	115 Å²	115	142.3 Å²	142.3	62%	0.615	74%	0.739	S	S	*	*			cis	-166.4	164.7	2.3	-125.2	-37.8	0	0	0	117.6
503	K	30.4	Very low	26.5	Very low	158 Å²	158	141 Å²	141	69%	0.687	73%	0.728	S	S	*	*			trans	65.5	128.8	142.5	-81.8	160.9	-131.8	-100.7	0	127
504	I	24	Very low	26.7	Very low	146 Å²	146	140.8 Å²	140.8	75%	0.749	72%	0.719	S	S	*	*			trans	87.9	95.9	132.4	-62.8	163.5	0	0	0	122.3
505	C	23.9	Very low	27.6	Very low	99 Å²	99	141.8 Å²	141.8	67%	0.669	73%	0.725	S	S	*	*				46.4	153.7	109.9	-136.7	0	0	0	0	125.7
506	F	22.2	Very low	28.1	Very low	183 Å²	183	142.9 Å²	142.9	80%	0.803	73%	0.727	S	S	*	*			trans	69.9	151.4	164.5	-70.7	-64.2	0	0	0	118.6
507	D	22.6	Very low	28.6	Very low	122 Å²	122	144.3 Å²	144.3	65%	0.652	73%	0.73	S	S	*	*			cis	-165.2	169.8	-22.1	-158.4	-3	0	0	0	110.5
508	I	23.5	Very low	29	Very low	150 Å²	150	144.5 Å²	144.5	77%	0.769	73%	0.729	S	S	*	*			trans	56.2	146.6	157.6	-68.9	151.4	0	0	0	119.2
509	G	22.8	Very low	29.3	Very low	57 Å²	57	144.1 Å²	144.1	59%	0.588	73%	0.726	S	S	*	*			cis	149.3	91.2	-11.3	0	0	0	0	0	116.6
510	K	23.5	Very low	29.3	Very low	209 Å²	209	142.1 Å²	142.1	91%	0.909	72%	0.718	S	S	*	*			trans	69	-169	165.3	-50.3	177.6	179.9	167.5	0	113.9
511	P	40.3	Very low	29.5	Very low	103 Å²	103	142.5 Å²	142.5	67%	0.669	72%	0.719	S	S	*	*			cis	-146.5	169.6	-2.7	44.1	-25	0	0	0	120.4
512	K	28.4	Very low	29.4	Very low	164 Å²	164	147.5 Å²	147.5	71%	0.713	73%	0.726	S	S	*	*			trans	68.6	164.4	139.3	-82.7	167.1	161.1	-111.4	0	120.9
513	E	30	Very low	29.6	Very low	129 Å²	129	148.1 Å²	148.1	60%	0.603	73%	0.728	S	S	*	*			cis	-140.2	-135.7	-2.4	-156.8	106.6	-129.6	0	0	115.8
514	K	29.4	Very low	29.4	Very low	173 Å²	173	149.6 Å²	149.6	75%	0.752	73%	0.734	S	S	*	*			trans	-138.1	-175.9	-151.3	-80.7	170.7	-176.6	159.3	0	111.3
515	P	44.3	Very low	29.8	Very low	130 Å²	130	148.9 Å²	148.9	84%	0.844	73%	0.731	S	S	*	*			cis	-147.5	-147.5	31.7	42.7	-16.8	0	0	0	118.9
516	K	37.7	Very low	29.9	Very low	192 Å²	192	152.9 Å²	152.9	84%	0.835	74%	0.738	S	S	*	*			trans	-131.6	166.3	-155.9	-43.7	170.1	176.4	179.1	0	115.8
517	Q	35.3	Very low	30.4	Very low	153 Å²	153	153 Å²	153	72%	0.715	74%	0.737	S	S	*	*				177.6	144.6	124.5	-102.2	179.2	83.5	0	0	117.7
518	K	33.2	Very low	30.7	Very low	170 Å²	170	156.6 Å²	156.6	74%	0.739	75%	0.748	S	S	*	*			trans	51	158.9	139.6	-70.5	177.1	-174.3	157.2	0	123.8
519	D	32.4	Very low	30.8	Very low	120 Å²	120	159.2 Å²	159.2	64%	0.642	75%	0.753	S	S	*	*			cis	-171.7	161	-36.7	-128.4	-39.8	0	0	0	114.3
520	F	26.2	Very low	31	Very low	165 Å²	165	165.6 Å²	165.6	72%	0.724	77%	0.765	S	S	*	*			trans	67.9	124.5	156.2	-67.6	-53.5	0	0	0	128.3
521	L	32.5	Very low	31.4	Very low	147 Å²	147	164.1 Å²	164.1	77%	0.77	76%	0.758	S	S	*	*			trans	74.8	149.9	132.9	-65	178.1	0	0	0	123.1
522	R	28.4	Very low	30.9	Very low	213 Å²	213	168.4 Å²	168.4	80%	0.804	77%	0.766	S	S	*	*			cis	-175.7	159	-13.9	-162.2	-165.6	-174	-174.7	3.8	113.9
523	I	31.9	Very low	30.9	Very low	127 Å²	127	169.1 Å²	169.1	65%	0.651	77%	0.77	S	S	*	*			trans	93.9	101.1	155.4	-48.5	-171.9	0	0	0	123.5
524	K	26.1	Very low	30.8	Very low	189 Å²	189	167 Å²	167	82%	0.822	77%	0.774	S	S	*	*				52.1	167.4	127.5	-56.4	-173.6	176.1	177.6	0	123.3
525	L	31	Very low	30.8	Very low	131 Å²	131	166.5 Å²	166.5	69%	0.686	77%	0.772	S	S	*	*			cis	-166.8	138.7	22	-133.2	154.4	0	0	0	116.6
526	K	26.8	Very low	29.8	Very low	184 Å²	184	165.4 Å²	165.4	80%	0.8	77%	0.768	S	S	*	*			trans	74.9	124.7	145.1	-106.3	177.2	-155	164.1	0	127.4
527	K	31.4	Very low	29.2	Very low	184 Å²	184	163.2 Å²	163.2	80%	0.8	76%	0.76	S	S	*	*				109.4	85.5	113.3	-153	-179.8	-177.1	-170.9	0	125.5
528	K	28.8	Very low	28.6	Very low	199 Å²	199	162.5 Å²	162.5	87%	0.865	76%	0.761	S	S	*	*				54.7	118.7	121.4	-175.2	-175.7	-177.5	173.8	0	124.2
529	K	25.8	Very low	28.2	Very low	204 Å²	204	161.4 Å²	161.4	89%	0.887	77%	0.769	S	S	*	*			trans	-161.8	168.4	139.6	-138.1	173.7	179.1	178.7	0	116.1
530	K	28.3	Very low	27.7	Very low	191 Å²	191	158.4 Å²	158.4	83%	0.83	77%	0.766	S	S	*	*			trans	-53.2	175.8	179.9	-77.5	-179.1	177.7	177.1	0	117.4
531	K	30.4	Very low	27.9	Very low	179 Å²	179	155.6 Å²	155.6	78%	0.778	77%	0.767	S	S	*	*			cis	169.6	156.2	-20.9	179.8	-177.2	173.8	174.6	0	108.8
532	K	31.8	Very low	27.7	Very low	192 Å²	192	156.1 Å²	156.1	84%	0.835	77%	0.766	S	S	*	*			trans	93.8	159.9	164.6	-70.8	-170.1	176	-179.3	0	116.6
533	K	28	Very low	27.8	Very low	180 Å²	180	153.7 Å²	153.7	78%	0.783	76%	0.764	S	S	*	*			cis	-179.6	119.6	-28.3	176.2	-124.8	177.1	-170.8	0	111.4
534	A	26.5	Very low	27.5	Very low	85 Å²	85	154.5 Å²	154.5	70%	0.702	77%	0.769	S	S	*	*			trans	60.4	172	155.2	0	0	0	0	0	118.6
535	K	30.5	Very low	27.7	Very low	162 Å²	162	152.6 Å²	152.6	70%	0.704	77%	0.767	S	S	*	*			cis	-170.9	142.6	-40.2	178.9	170.6	-171.4	-92.3	0	106.9	E537	K535-E537 IonicContact NZ-OE1 2.65Å; K535-E537 PolarHBondContact NZ-OE1 3.1Å; K535-E537 IonicContact NZ-OE2 3.81Å; K535-E537 PolarHBondContact NZ-OE2 3.38Å
536	S	23.7	Very low	27.3	Very low	107 Å²	107	153.7 Å²	153.7	75%	0.748	77%	0.773	S	S	*	*			trans	-139.9	166.9	179.9	52.8	0	0	0	0	112.5
537	E	24	Very low	27.3	Very low	146 Å²	146	152 Å²	152	68%	0.682	77%	0.771	S	S	*	*			trans	-156.8	172.2	-170.3	-108.3	87.6	-148.8	0	0	105.4	K535	K535-E537 IonicContact NZ-OE1 2.65Å; K535-E537 PolarHBondContact NZ-OE1 3.1Å; K535-E537 IonicContact NZ-OE2 3.81Å; K535-E537 PolarHBondContact NZ-OE2 3.38Å
538	N	24	Very low	27.1	Very low	138 Å²	138	148.4 Å²	148.4	74%	0.738	77%	0.769	S	S	*	*			cis	-177.7	141.2	6.1	147	90.6	0	0	0	108.2
539	T	24	Very low	27.1	Very low	146 Å²	146	145.4 Å²	145.4	90%	0.896	77%	0.767	S	S	*	*			trans	-171.5	151	162.9	3.1	0	0	0	0	108.7
540	G	22.6	Very low	27.3	Very low	57 Å²	57	144 Å²	144	59%	0.588	77%	0.769	S	S	*	*			cis	160.9	123.7	-12.4	0	0	0	0	0	111.9
541	S	30	Very low	27.5	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	76%	0.763	S	S	*	*			trans	54.8	169.9	160.2	53	0	0	0	0	119.1
542	E	28	Very low	27.3	Very low	158 Å²	158	136.7 Å²	136.7	74%	0.738	76%	0.763	S	S	*	*			cis	-150.2	166.9	-8.1	29.5	-132.6	106.6	0	0	112.8
543	E	29.8	Very low	27.2	Very low	163 Å²	163	136 Å²	136	76%	0.762	76%	0.762	S	S	*	*			trans	19.2	130	162.2	66.3	-171	-158.3	0	0	125.6
544	N	26	Very low	27.1	Very low	144 Å²	144	132.4 Å²	132.4	77%	0.77	76%	0.759	S	S	*	*				-170.5	179	106.4	-108.5	-81.2	0	0	0	113.6
545	I	30	Very low	27.3	Very low	149 Å²	149	136.9 Å²	136.9	76%	0.764	76%	0.763	S	S	*	*			trans	-118.7	138.7	-157	-56	153.9	0	0	0	112.5
546	D	23.7	Very low	27.1	Very low	154 Å²	154	136.9 Å²	136.9	82%	0.824	77%	0.77	S	S	*	*			trans	-165.9	170.2	132.1	-134	-33.1	0	0	0	114.7
547	I	26.5	Very low	27.2	Very low	147 Å²	147	138.6 Å²	138.6	75%	0.754	77%	0.771	S	S	*	*			trans	-109	126.8	-172.6	-61.8	167	0	0	0	111.6
548	S	26.8	Very low	27.3	Very low	110 Å²	110	139 Å²	139	77%	0.769	78%	0.777	S	S	*	*			trans	-171.9	141.2	146.5	-93.7	0	0	0	0	116.4
549	V	29.8	Very low	27.4	Very low	135 Å²	135	138.1 Å²	138.1	82%	0.818	78%	0.779	S	S	*	*			trans	47.4	120.4	148.3	-172.9	0	0	0	0	119.8	G551	V549-G551 PolarHBondContact O-N 3.22Å
550	L	29.2	Very low	27.4	Very low	176 Å²	176	137.9 Å²	137.9	92%	0.921	77%	0.771	S	S	*	*			trans	-74.5	81.6	178.3	-70	168.8	0	0	0	114
551	G	32.2	Very low	27.7	Very low	69 Å²	69	144.8 Å²	144.8	71%	0.711	79%	0.785	S	S	*	*			trans	-96.4	51.3	174.8	0	0	0	0	0	115.5	V549	V549-G551 PolarHBondContact O-N 3.22Å
552	L	26.8	Very low	27.5	Very low	147 Å²	147	146.6 Å²	146.6	77%	0.77	78%	0.78	S	S	*	*			trans	-112.9	85.5	-166.6	-120	157.9	0	0	0	115.3	S554	L552-S554 PolarHBondContact O-N 3.4Å
553	H	28.8	Very low	27.5	Very low	177 Å²	177	144.6 Å²	144.6	82%	0.819	78%	0.781	S	S	*	*			trans	-63.9	92.6	169.5	-74.3	-87.1	0	0	0	112.7	K555	H553-K555 PolarHBondContact O-N 3.35Å
554	S	26.3	Very low	27.3	Very low	104 Å²	104	144.4 Å²	144.4	73%	0.727	78%	0.784	S	S	*	*			trans	-75.2	87.5	172.2	-74.4	0	0	0	0	112.4	L552 L556	L552-S554 PolarHBondContact O-N 3.4Å; S554-L556 PolarHBondContact O-N 2.82Å
555	K	31.7	Very low	27.2	Very low	179 Å²	179	142.7 Å²	142.7	78%	0.778	78%	0.783	S	S	*	*			trans	-69.9	88.3	176.2	-69.8	173.8	178.7	170	0	112.5	H553	H553-K555 PolarHBondContact O-N 3.35Å
556	L	24.8	Very low	27.1	Very low	162 Å²	162	142.7 Å²	142.7	85%	0.848	78%	0.78	S	S	*	*			trans	-101.4	78.4	165.3	-69.9	-177.9	0	0	0	111.7	S554 L558	S554-L556 PolarHBondContact O-N 2.82Å; L556-L558 PolarHBondContact O-N 3.21Å
557	N	25.8	Very low	27.1	Very low	144 Å²	144	141.5 Å²	141.5	77%	0.77	77%	0.773	S	S	*	*			trans	-82.7	101.1	170.1	-88.5	-91.5	0	0	0	110.8
558	L	25.9	Very low	27	Very low	153 Å²	153	142.8 Å²	142.8	80%	0.801	78%	0.776	S	S	*	*			trans	-107.5	117.9	153.1	-100.3	86.9	0	0	0	109.4	L556 L560	L556-L558 PolarHBondContact O-N 3.21Å; L558-L560 PolarHBondContact O-N 3.46Å
559	P	27.3	Very low	27	Very low	121 Å²	121	146 Å²	146	79%	0.786	78%	0.776	S	S	*	*			trans	-86	97.5	-176.9	32.5	-33.5	0	0	0	111.7
560	L	24.3	Very low	26.9	Very low	141 Å²	141	145.6 Å²	145.6	74%	0.738	78%	0.776	S	S	*	*			trans	-94.3	96.8	167.6	-82.5	168.7	0	0	0	110.8	L558 F562	L558-L560 PolarHBondContact O-N 3.46Å; L560-F562 HydrophobicContact CB-CE2 4.36Å; L560-F562 HydrophobicContact CD2-CE2 4.14Å
561	K	28.7	Very low	26.6	Very low	201 Å²	201	145.7 Å²	145.7	87%	0.874	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-78.4	121.5	161.1	-71.3	-172	173.6	-167.9	0	109
562	F	26.1	Very low	26.3	Very low	145 Å²	145	146.9 Å²	146.9	64%	0.636	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-103	160	157.2	-79.6	-77.9	0	0	0	110.1	L560	L560-F562 HydrophobicContact CB-CE2 4.36Å; L560-F562 HydrophobicContact CD2-CE2 4.14Å
563	P	26.1	Very low	26.3	Very low	116 Å²	116	150.7 Å²	150.7	75%	0.753	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-95.8	159.5	-147.6	-4.9	25.4	0	0	0	114.2
564	L	25.8	Very low	26.1	Very low	158 Å²	158	148 Å²	148	83%	0.827	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-75.8	129.7	166.6	-162.3	79.7	0	0	0	110.5
565	S	24.5	Very low	26.2	Very low	108 Å²	108	148.6 Å²	148.6	76%	0.755	78%	0.783	S	S	*	*			trans	-138.2	138.6	164.7	58.5	0	0	0	0	108.8
566	H	27.1	Very low	26.2	Very low	149 Å²	149	151.5 Å²	151.5	69%	0.69	79%	0.79	S	S	*	*			cis	-155.1	113	-13.2	173.8	-71.8	0	0	0	107.5	H568	H566-H568 PolarHBondContact O-N 3.09Å
567	N	23.7	Very low	26.2	Very low	130 Å²	130	150.2 Å²	150.2	70%	0.695	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-61.1	123.7	178.8	-82.4	-70.1	0	0	0	111.2
568	H	26.2	Very low	26.1	Very low	173 Å²	173	146.9 Å²	146.9	80%	0.801	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-73.6	129.9	156.6	-91.6	-109.6	0	0	0	108.6	H566	H566-H568 PolarHBondContact O-N 3.09Å
569	K	24.9	Very low	26.1	Very low	178 Å²	178	148.6 Å²	148.6	77%	0.774	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-101	124.8	170	-87.8	-170.1	168.7	-167.5	0	109.7
570	P	27.8	Very low	25.9	Very low	127 Å²	127	148 Å²	148	83%	0.825	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-76.5	139.2	150.5	31.6	-29.5	0	0	0	109.4
571	E	23.8	Very low	25.9	Very low	177 Å²	177	151.4 Å²	151.4	83%	0.827	80%	0.797	S	S	*	*			trans	-104.4	134.2	167.4	-77.8	-157.4	138.6	0	0	111.5
572	A	25	Very low	25.8	Very low	95 Å²	95	147.7 Å²	147.7	79%	0.785	79%	0.791	S	S	*	*			trans	46.4	105	151.4	0	0	0	0	0	119.8
573	Y	26.9	Very low	25.7	Very low	226 Å²	226	149.9 Å²	149.9	89%	0.886	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-56	136.6	148.4	-94.5	-93.1	0	0	0	111.6
574	P	26.2	Very low	25.7	Very low	122 Å²	122	152.4 Å²	152.4	79%	0.792	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-87.3	125	156.4	32.9	-28.9	0	0	0	110.5
575	S	27.1	Very low	25.7	Very low	116 Å²	116	152.1 Å²	152.1	81%	0.811	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.1	160.5	178.6	-74.1	0	0	0	0	114.1
576	R	31.5	Very low	25.8	Very low	240 Å²	240	154 Å²	154	91%	0.906	80%	0.803	S	S	*	*			trans	-44.6	147.3	176.9	-74.9	178	165.9	-170.8	-3.2	114.8
577	P	26.1	Very low	25.9	Very low	135 Å²	135	152.3 Å²	152.3	88%	0.877	80%	0.804	S	S	*	*			trans	-83.2	127.9	141.7	-3.5	22.9	0	0	0	110.5
578	G	23.7	Very low	26	Very low	73 Å²	73	152.7 Å²	152.7	75%	0.753	81%	0.806	S	S	*	*			trans	-147.1	136.7	164.7	0	0	0	0	0	107.5
579	H	25.3	Very low	26.2	Very low	190 Å²	190	151.2 Å²	151.2	88%	0.88	80%	0.804	S	S	*	*			trans	-135.7	153.7	-167.6	-138.9	-70	0	0	0	111.3
580	S	23.1	Very low	26.6	Very low	107 Å²	107	150.6 Å²	150.6	75%	0.748	80%	0.804	S	S	*	*			trans	69.9	143.9	-170.4	-100.6	0	0	0	0	114.7
581	Y	24.8	Very low	26.8	Very low	214 Å²	214	151.1 Å²	151.1	84%	0.839	80%	0.799	S	S	*	*			cis	-141.2	164.8	5.6	49.2	-87.6	0	0	0	111.8
582	T	25.6	Very low	27.3	Very low	123 Å²	123	146.2 Å²	146.2	76%	0.755	79%	0.785	S	S	*	*			trans	-87.3	132.9	176.9	-61.2	0	0	0	0	110.3
583	E	25.4	Very low	27.5	Very low	190 Å²	190	149 Å²	149	89%	0.888	79%	0.785	S	S	*	*				-157.2	172.8	125.4	-115.1	168.2	-177.3	0	0	111.1
584	Q	25.9	Very low	27.7	Very low	170 Å²	170	142.5 Å²	142.5	79%	0.794	77%	0.772	S	S	*	*			trans	-157.8	139.6	-155	173.8	-176.8	48	0	0	107.8
585	I	26.1	Very low	27.7	Very low	152 Å²	152	143 Å²	143	78%	0.779	77%	0.769	S	S	*	*			trans	161.4	136.1	147.4	-88.9	156.1	0	0	0	113.6
586	L	26.6	Very low	27.7	Very low	146 Å²	146	148 Å²	148	76%	0.764	77%	0.769	S	S	*	*			trans	67.2	120.9	157.5	-107	64.9	0	0	0	123.4
587	V	29.3	Very low	27.6	Very low	115 Å²	115	141 Å²	141	70%	0.697	76%	0.758	S	S	*	*				41.1	157.5	126.8	-52	0	0	0	0	122.5
588	D	24.5	Very low	27.6	Very low	138 Å²	138	140.5 Å²	140.5	74%	0.738	75%	0.752	S	S	*	*			cis	-150.1	179.5	11.2	-135.2	-171.9	0	0	0	113.5
589	D	31.7	Very low	27.6	Very low	142 Å²	142	143.6 Å²	143.6	76%	0.759	75%	0.751	S	S	*	*			trans	-50.5	167.3	-173.1	-63.4	-26.4	0	0	0	120.5
590	E	32	Very low	27.7	Very low	165 Å²	165	139.3 Å²	139.3	77%	0.771	74%	0.743	S	S	*	*			cis	-125.2	-82.7	-5.5	-134.3	-83.9	26.6	0	0	112.1
591	D	32.1	Very low	28.3	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	75%	0.75	S	S	*	*			cis	-172.9	149.7	-18.7	-171.4	67.5	0	0	0	108.2
592	S	35.2	Very low	28.5	Very low	74 Å²	74	133.9 Å²	133.9	52%	0.517	75%	0.746	S	S	.	*			cis	-157.9	146	-28.1	-104.1	0	0	0	0	110.3
593	I	28.4	Very low	28.5	Very low	153 Å²	153	139.8 Å²	139.8	79%	0.785	76%	0.755	S	S	*	*			trans	52.1	140.3	162.1	76.9	171.9	0	0	0	119.5
594	S	31.2	Very low	28.6	Very low	90 Å²	90	136.1 Å²	136.1	63%	0.629	75%	0.75	S	S	*	*			cis	70.8	138.5	31.4	85.3	0	0	0	0	114.8
595	D	27.1	Very low	28.8	Very low	133 Å²	133	134.3 Å²	134.3	71%	0.711	75%	0.746	S	S	*	*			cis	-158.9	144.4	4.5	-130.9	23.7	0	0	0	111.8
596	W	26.9	Very low	28.9	Very low	219 Å²	219	134.7 Å²	134.7	83%	0.83	75%	0.75	S	S	*	*			trans	38.8	124.3	141.9	-72.6	60.2	0	0	0	124
597	S	29.4	Very low	29.3	Very low	94 Å²	94	133.9 Å²	133.9	66%	0.657	75%	0.746	S	S	*	*			trans	71.1	143.6	137.9	-54.6	0	0	0	0	118.7
598	T	25.8	Very low	29.3	Very low	125 Å²	125	137.8 Å²	137.8	77%	0.767	75%	0.754	S	S	*	*				177.8	162.5	70.3	-52.6	0	0	0	0	110.5
599	D	22.4	Very low	29.8	Very low	137 Å²	137	137.8 Å²	137.8	73%	0.733	75%	0.754	S	S	*	*			trans	85	140.6	148.7	-117.9	51.5	0	0	0	124.5
600	S	27.4	Very low	30.2	Very low	101 Å²	101	138.5 Å²	138.5	71%	0.706	76%	0.755	S	S	*	*			trans	42.3	142.2	140.3	-64.4	0	0	0	0	124.5
601	C	36.3	Very low	30.1	Very low	133 Å²	133	138 Å²	138	90%	0.899	76%	0.758	S	S	*	*			trans	-71.7	142.1	173.1	-45.9	0	0	0	0	112.9
602	G	28.7	Very low	30.1	Very low	73 Å²	73	139 Å²	139	75%	0.753	76%	0.762	S	S	*	*			trans	-156.5	118	161.8	0	0	0	0	0	109.7
603	W	27.1	Very low	29.7	Very low	247 Å²	247	140.9 Å²	140.9	94%	0.936	77%	0.766	S	S	*	*			trans	-104.4	135	169.8	-78.6	70.6	0	0	0	108.8
604	S	27.2	Very low	29.9	Very low	113 Å²	113	140 Å²	140	79%	0.79	77%	0.768	S	S	*	*			trans	-151.2	129.3	160.2	56.3	0	0	0	0	107
605	D	28.9	Very low	30.2	Very low	133 Å²	133	141.2 Å²	141.2	71%	0.711	77%	0.771	S	S	*	*			trans	-64.5	153.1	-175.6	-50.4	-72.7	0	0	0	112.7
606	D	28.7	Very low	30.4	Very low	159 Å²	159	140.2 Å²	140.2	85%	0.85	77%	0.77	S	S	*	*				-157.8	150.7	102.8	-89	-31.9	0	0	0	109.3
607	D	34.8	Very low	30.9	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	76%	0.764	S	S	*	*			trans	-57	149	-162.4	-62.6	-76.6	0	0	0	117.1
608	F	28.7	Very low	31.2	Very low	197 Å²	197	136.3 Å²	136.3	86%	0.864	77%	0.771	S	S	*	*				179.4	124.9	94.2	-93.3	-66.3	0	0	0	115.3
609	D	35.8	Very low	31.8	Very low	139 Å²	139	138.7 Å²	138.7	74%	0.743	78%	0.778	S	S	*	*			trans	72.9	143.3	148.4	-152.9	25	0	0	0	121.4
610	M	41	Very low	32.4	Very low	157 Å²	157	137.8 Å²	137.8	77%	0.773	78%	0.782	S	S	*	*			trans	60.3	79.9	168.7	-137.8	65.6	54.8	0	0	119.2
611	D	29.2	Very low	32.8	Very low	155 Å²	155	138.9 Å²	138.9	83%	0.829	79%	0.785	S	S	*	*			trans	-88	128.4	167.2	-174	19.5	0	0	0	112.4
612	L	31	Very low	32.5	Very low	159 Å²	159	139 Å²	139	83%	0.832	78%	0.776	S	S	*	*			trans	-154.3	112.7	164.7	-161.5	75.6	0	0	0	111.4
613	D	27.6	Very low	32.8	Very low	112 Å²	112	141 Å²	141	60%	0.599	78%	0.778	S	S	*	*			trans	-64.9	129.2	-174.8	-173	-22	0	0	0	113.6	T615	D613-T615 PolarHBondContact O-N 3.27Å; D613-T615 WeakPolarHBondContact OD1-CB 3.41Å; D613-T615 WeakPolarHBondContact OD1-CG2 3.41Å; D613-T615 PolarHBondContact OD1-N 3.37Å; D613-T615 PolarHBondContact OD1-OG1 3.5Å; D613-T615 PolarHBondContact OD2-OG1 2.92Å
614	V	33.6	Very low	33	Very low	135 Å²	135	133 Å²	133	82%	0.818	77%	0.773	S	S	*	*			trans	-100.3	64.5	172.8	-170.4	0	0	0	0	111
615	T	35.7	Very low	33.2	Very low	115 Å²	115	132.3 Å²	132.3	71%	0.706	77%	0.774	S	S	*	*			trans	-115.4	36.6	164.7	48.1	0	0	0	0	112.8	D613	D613-T615 PolarHBondContact O-N 3.27Å; D613-T615 WeakPolarHBondContact OD1-CB 3.41Å; D613-T615 WeakPolarHBondContact OD1-CG2 3.41Å; D613-T615 PolarHBondContact OD1-N 3.37Å; D613-T615 PolarHBondContact OD1-OG1 3.5Å; D613-T615 PolarHBondContact OD2-OG1 2.92Å
616	T	32.9	Very low	33.8	Very low	113 Å²	113	134 Å²	134	69%	0.693	78%	0.782	S	S	*	*	S	Bend	trans	-119.8	138.7	174.5	-51.5	0	0	0	0	111.6
617	P	35.9	Very low	34.3	Very low	106 Å²	106	133.6 Å²	133.6	69%	0.688	78%	0.78	S	S	*	*			trans	-62.5	156.6	170.8	-21.6	34	0	0	0	113.1	L619	P617-L619 PolarHBondContact O-N 2.9Å
618	P	35.5	Very low	34.3	Very low	125 Å²	125	132.8 Å²	132.8	81%	0.812	79%	0.785	S	S	*	*			trans	-76.5	114.9	-171.9	29.8	-34.7	0	0	0	113.2
619	L	39.8	Very low	34.8	Very low	174 Å²	174	128.7 Å²	128.7	91%	0.911	78%	0.776	S	S	*	*			trans	-140.8	113.2	163.6	-72.6	178.8	0	0	0	111.2	P617	P617-L619 PolarHBondContact O-N 2.9Å
620	S	35	Very low	35.3	Very low	118 Å²	118	128.5 Å²	128.5	83%	0.825	78%	0.775	S	S	*	*			trans	-168.2	147	166.4	65.8	0	0	0	0	107.5
621	V	35.8	Very low	35.8	Very low	125 Å²	125	128.4 Å²	128.4	76%	0.758	77%	0.773	S	S	*	*			cis	-135.9	112.6	9.6	171	0	0	0	0	106.3
622	D	29.5	Very low	37.9	Very low	135 Å²	135	126.5 Å²	126.5	72%	0.722	76%	0.759	S	S	*	*				61.6	118.9	97.4	179.6	49.4	0	0	0	117.8
623	S	35.3	Very low	40.4	Very low	114 Å²	114	123.6 Å²	123.6	80%	0.797	74%	0.743	S	S	*	*			trans	-171.2	112.7	131.1	-82.9	0	0	0	0	110.4
624	G	31.1	Very low	43.2	Very low	79 Å²	79	119.7 Å²	119.7	81%	0.814	72%	0.723	S	S	*	*			trans	-60	147.7	-161.6	0	0	0	0	0	120.2
625	A	31.6	Very low	45.6	Very low	100 Å²	100	120.2 Å²	120.2	83%	0.826	71%	0.71	S	S	*	*			trans	-141.9	165.3	152	0	0	0	0	0	108.6
626	L	41.1	Very low	48	Very low	168 Å²	168	115.1 Å²	115.1	88%	0.88	68%	0.679	S	S	*	*	S	Bend	trans	-76.2	154.6	171.1	-95.5	76.1	0	0	0	111.2
627	D	39.5	Very low	50.4	Low	150 Å²	150	114.5 Å²	114.5	80%	0.802	67%	0.671	S	S	*	*			trans	68.3	111.4	154.6	-140.2	10.9	0	0	0	117.4
628	S	35.3	Very low	52.7	Low	112 Å²	112	111.8 Å²	111.8	78%	0.783	65%	0.654	S	S	*	*			trans	-164	108.4	161.8	-79.9	0	0	0	0	110.2
629	T	37.8	Very low	54.8	Low	111 Å²	111	114.7 Å²	114.7	68%	0.681	66%	0.657	S	S	*	*			trans	-43	157.9	175.4	-32.6	0	0	0	0	115.3	Q631	T629-Q631 PolarHBondContact O-NE2 3.42Å
630	D	46.3	Very low	56.7	Low	135 Å²	135	108.9 Å²	108.9	72%	0.722	63%	0.628	S	S	*	*			trans	-0.5	112.5	161.7	-57.1	-43.8	0	0	0	116.8	E632	D630-E632 PolarHBondContact O-N 3.05Å
631	Q	52	Low	58.6	Low	156 Å²	156	110.7 Å²	110.7	73%	0.729	62%	0.624	S	S	*	*			trans	-70.4	102	168	-78	78.4	80.6	0	0	109.7	T629 I633	T629-Q631 PolarHBondContact O-NE2 3.42Å; Q631-I633 WeakPolarHBondContact O-CG1 3.32Å; Q631-I633 PolarHBondContact O-N 3.15Å
632	E	73.8	Confident	60.6	Low	115 Å²	115	111.5 Å²	111.5	54%	0.537	62%	0.619	S	S	.	*			trans	-69.2	91.1	179.8	-63.3	-147.4	107.5	0	0	111.9	D630 V634 W656	D630-E632 PolarHBondContact O-N 3.05Å; E632-V634 PolarHBondContact O-N 2.92Å; E632-W656 PolarHBondContact OE1-NE1 3.42Å
633	I	82.9	Confident	62.3	Low	97 Å²	97	113.5 Å²	113.5	50%	0.497	62%	0.624	S	S	.	*			trans	-70.9	103.1	-175.4	-55.8	178.8	0	0	0	110.8	Q631 R635 C655 W656	Q631-I633 WeakPolarHBondContact O-CG1 3.32Å; Q631-I633 PolarHBondContact O-N 3.15Å; I633-R635 HydrophobicContact CG2-CB 4.46Å; I633-R635 PolarHBondContact O-N 3.46Å; I633-C655 CarbonylContact O-C 3.6Å; I633-C655 WeakPolarHBondContact O-CA 3.42Å; I633-C655 WeakPolarHBondContact O-CB 3.42Å; I633-W656 PolarHBondContact O-N 3.01Å
634	V	86.8	Confident	63.8	Low	30 Å²	30	111.4 Å²	111.4	18%	0.182	60%	0.604	C	S	.	*	B	Isolated β-bridge	trans	-68.9	121.7	164.8	-171.2	0	0	0	0	109	E632 E641 M647 W656	E632-V634 PolarHBondContact O-N 2.92Å; V634-E641 HydrophobicContact CB-CB 4.49Å; V634-M647 HydrophobicContact CG1-CE 3.82Å; V634-M647 HydrophobicContact CG2-CE 3.94Å; V634-W656 WeakPolarHBondContact CA-O 3.42Å; V634-W656 HydrophobicContact CG2-CB 4.29Å
635	R	83.2	Confident	65.9	Low	146 Å²	146	116.3 Å²	116.3	55%	0.551	61%	0.612	S	S	*	*			trans	-140.7	66.9	176.8	-172	176.7	-80.2	-176.6	-4.7	110.4	I633 C655 W656 Q657 I677	I633-R635 HydrophobicContact CG2-CB 4.46Å; I633-R635 PolarHBondContact O-N 3.46Å; R635-C655 HydrophobicContact CB-CB 4.38Å; R635-W656 PolarHBondContact N-O 3.48Å; R635-Q657 WeakPolarHBondContact O-CG 3.48Å; R635-Q657 PolarHBondContact O-NE2 2.95Å; R635-I677 HydrophobicContact CG-CD1 4Å
636	C	86.4	Confident	68.5	Low	8 Å²	8	113.2 Å²	113.2	5%	0.054	58%	0.579	C	S	.	*			trans	-89.3	156.5	179.6	-159.6	0	0	0	0	112.9	C638 E639 Q657 H658 C661	C636-C638 VanDerWaalsContact CB-SG 3.56Å; C636-C638 PolarHBondContact O-N 3.05Å; C636-E639 PolarHBondContact O-N 3.48Å; C636-E639 VanDerWaalsContact O-N 3.13Å; C636-Q657 HydrophobicContact CB-CB 4.33Å; C636-H658 PolarHBondContact SG-N 3.19Å; C636-H658 VanDerWaalsContact SG-N 3.37Å; C636-C661 WeakPolarHBondContact SG-CB 3.32Å
637	I	83.3	Confident	70.8	Confident	100 Å²	100	107.1 Å²	107.1	51%	0.513	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-9.3	-177.9	-161.3	167.1	0	0	0	114	E639 C661 M662 Y676	I637-E639 VanDerWaalsContact C-N 3.33Å; I637-C661 HydrophobicContact CG2-CB 4.24Å; I637-M662 HydrophobicContact CB-CE 3.95Å; I637-M662 HydrophobicContact CG2-CE 3.59Å; I637-Y676 HydrophobicContact CB-CE1 3.88Å; I637-Y676 HydrophobicContact CD1-CE1 4.33Å; I637-Y676 HydrophobicContact CD1-CE2 4.33Å; I637-Y676 HydrophobicContact CG1-CE1 4.34Å
638	C	84.7	Confident	73.3	Confident	50 Å²	50	100.7 Å²	100.7	34%	0.338	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-8.3	172.3	55.7	0	0	0	0	113.5	C636 V640 H658	C636-C638 VanDerWaalsContact CB-SG 3.56Å; C636-C638 PolarHBondContact O-N 3.05Å; C638-V640 HydrophobicContact CB-CB 4.5Å; C638-V640 HydrophobicContact CB-CG2 4.46Å; C638-V640 PolarHBondContact O-N 2.74Å; C638-V640 VanDerWaalsContact O-N 3.17Å; C638-H658 VanDerWaalsContact SG-CE1 3.52Å; C638-H658 PolarHBondContact SG-ND1 2.98Å
639	E	79.3	Confident	75.9	Confident	186 Å²	186	98.9 Å²	98.9	87%	0.869	49%	0.492	S	S	*	.			trans	59.3	18.2	-174.1	-58.1	175.3	179	0	0	113.7	C636 I637	C636-E639 PolarHBondContact O-N 3.48Å; C636-E639 VanDerWaalsContact O-N 3.13Å; I637-E639 VanDerWaalsContact C-N 3.33Å
640	V	79.7	Confident	78.4	Confident	52 Å²	52	93.6 Å²	93.6	32%	0.315	46%	0.459	S	S	.	.			trans	-101.3	125.3	174.6	174.4	0	0	0	0	109.1	C638 E642 H658	C638-V640 HydrophobicContact CB-CB 4.5Å; C638-V640 HydrophobicContact CB-CG2 4.46Å; C638-V640 PolarHBondContact O-N 2.74Å; C638-V640 VanDerWaalsContact O-N 3.17Å; V640-E642 HydrophobicContact CG1-CB 3.57Å; V640-E642 HydrophobicContact CG1-CG 3.7Å; V640-H658 PolarHBondContact O-CE1 2.87Å; V640-H658 VanDerWaalsContact O-CE1 3.28Å
641	E	75.4	Confident	80.4	Confident	155 Å²	155	90.6 Å²	90.6	72%	0.724	44%	0.441	S	S	*	.			trans	-92.1	-6.4	176.7	-65.1	174.4	167.8	0	0	112.5	V634	V634-E641 HydrophobicContact CB-CB 4.49Å
642	E	77.4	Confident	81.9	Confident	142 Å²	142	86.1 Å²	86.1	66%	0.664	42%	0.422	S	S	*	.	S	Bend	trans	-60.6	141.2	177.6	-57.8	173.1	163.5	0	0	112	V640 N644 H658	V640-E642 HydrophobicContact CG1-CB 3.57Å; V640-E642 HydrophobicContact CG1-CG 3.7Å; E642-N644 PolarHBondContact O-N 2.91Å; E642-H658 PolarHBondContact O-NE2 2.78Å
643	E	64.7	Low	82.4	Confident	177 Å²	177	83 Å²	83	83%	0.827	41%	0.412	S	S	*	.			trans	-70.9	108.2	175.9	-67.4	166.7	-167.4	0	0	110.5	M647	E643-M647 HydrophobicContact CB-SD 4.37Å; E643-M647 HydrophobicContact CG-SD 4.36Å
644	N	68.3	Low	82.7	Confident	71 Å²	71	83.5 Å²	83.5	38%	0.38	42%	0.416	S	S	.	.			trans	-89.2	146.1	167.8	-73.2	-27.1	0	0	0	109.6	E642 F646 M647 H658	E642-N644 PolarHBondContact O-N 2.91Å; N644-F646 CarbonylContact O-C 3.56Å; N644-F646 PolarHBondContact O-N 2.9Å; N644-M647 VanDerWaalsContact O-CG 3.24Å; N644-M647 WeakPolarHBondContact O-CG 3.27Å; N644-H658 HydrophobicContact CB-CB 4.48Å; N644-H658 PolarHBondContact ND2-CD2 3.21Å; N644-H658 VanDerWaalsContact ND2-CD2 3.28Å; N644-H658 PolarHBondContact ND2-CE1 3.24Å; N644-H658 PolarHBondContact ND2-ND1 2.85Å; N644-H658 PolarHBondContact ND2-NE2 2.97Å
645	D	73.7	Confident	82.8	Confident	181 Å²	181	82.5 Å²	82.5	97%	0.968	41%	0.41	S	S	*	.	S	Bend	trans	-45	-30.7	-176.4	-55.7	-45.5	0	0	0	115.5
646	F	87.9	Confident	83.2	Confident	35 Å²	35	78.5 Å²	78.5	15%	0.154	40%	0.395	C	S	.	.	S	Bend	trans	-122.4	108.2	173.2	178.5	-130.9	0	0	0	112.7	N644 G659 L664 E666 V669	N644-F646 CarbonylContact O-C 3.56Å; N644-F646 PolarHBondContact O-N 2.9Å; F646-G659 PolarHBondContact O-N 3.32Å; F646-L664 HydrophobicContact CE1-CB 4.06Å; F646-E666 HydrophobicContact CB-CG 4.45Å; F646-E666 HydrophobicContact CD1-CG 4.44Å; F646-E666 HydrophobicContact CD2-CG 4.05Å; F646-E666 HydrophobicContact CG-CG 4.05Å; F646-V669 HydrophobicContact CE1-CG2 4.38Å; F646-V669 HydrophobicContact CE2-CG2 4.03Å; F646-V669 HydrophobicContact CZ-CG2 3.49Å; F646-V669 VanDerWaalsContact CZ-CG2 3.49Å
647	M	89.1	Confident	83.4	Confident	40 Å²	40	78.1 Å²	78.1	20%	0.197	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	156.1	172.7	-52.1	-168.6	76.4	0	0	111.3	V634 E643 N644 W656 Q657	V634-M647 HydrophobicContact CG1-CE 3.82Å; V634-M647 HydrophobicContact CG2-CE 3.94Å; E643-M647 HydrophobicContact CB-SD 4.37Å; E643-M647 HydrophobicContact CG-SD 4.36Å; N644-M647 VanDerWaalsContact O-CG 3.24Å; N644-M647 WeakPolarHBondContact O-CG 3.27Å; M647-W656 HydrophobicContact CB-CE3 3.72Å; M647-W656 HydrophobicContact CB-CZ3 4.07Å; M647-W656 HydrophobicContact CE-CB 4.11Å; M647-Q657 CarbonylContact C-O 3.55Å; M647-Q657 WeakPolarHBondContact CA-O 3.36Å
648	I	90.6	Very high	83.7	Confident	15 Å²	15	73.4 Å²	73.4	8%	0.077	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	131.9	176.3	-167.9	168.4	0	0	0	110.7	Q657 L664 V669 Y673	I648-Q657 WeakPolarHBondContact CG2-O 3.2Å; I648-Q657 PolarHBondContact N-O 3.05Å; I648-Q657 PolarHBondContact O-N 3.23Å; I648-L664 HydrophobicContact CD1-CD1 3.56Å; I648-L664 HydrophobicContact CG2-CD1 4.41Å; I648-V669 HydrophobicContact CD1-CG1 3.79Å; I648-Y673 HydrophobicContact CD1-CD1 3.97Å; I648-Y673 HydrophobicContact CD1-CD2 3.79Å; I648-Y673 HydrophobicContact CD1-CG 3.48Å; I648-Y673 VanDerWaalsContact CD1-CG 3.48Å; I648-Y673 HydrophobicContact CG1-CD1 3.83Å; I648-Y673 HydrophobicContact CG1-CG 3.85Å; I648-Y673 HydrophobicContact CG2-CD1 4.01Å; I648-Y673 HydrophobicContact CG2-CE1 3.87Å; I648-Y673 HydrophobicContact CG2-CG 4.46Å
649	Q	91.6	Very high	83.9	Confident	74 Å²	74	71 Å²	71	35%	0.346	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	137.9	177.5	-161.1	-175.6	54.8	0	0	110.1	L654 W656 Y673	Q649-L654 WeakPolarHBondContact CG-O 3.45Å; Q649-L654 PolarHBondContact NE2-O 3.29Å; Q649-W656 HydrophobicContact CB-CD2 3.79Å; Q649-W656 HydrophobicContact CB-CE3 3.84Å; Q649-W656 HydrophobicContact CB-CG 4.5Å; Q649-W656 HydrophobicContact CB-CH2 3.96Å; Q649-W656 HydrophobicContact CB-CZ2 3.89Å; Q649-W656 HydrophobicContact CB-CZ3 3.93Å; Q649-W656 HydrophobicContact CG-CD2 4.07Å; Q649-W656 HydrophobicContact CG-CG 4.38Å; Q649-W656 HydrophobicContact CG-CZ2 4.23Å; Q649-W656 VanDerWaalsContact N-CE3 3.33Å; Q649-Y673 WeakPolarHBondContact O-CD1 3.44Å
650	C	90.1	Very high	84.3	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.342	C	S	.	.			trans	-92.5	122.9	174.5	162.3	0	0	0	0	111.9	D652 C653 L654 C655 Y673 C675	C650-D652 PolarHBondContact O-N 3.32Å; C650-D652 VanDerWaalsContact O-N 3.08Å; C650-D652 PolarHBondContact SG-N 3.19Å; C650-C653 WeakPolarHBondContact CB-SG 3.42Å; C650-C653 PolarHBondContact O-N 3.13Å; C650-C653 PolarHBondContact SG-SG 2.94Å; C650-L654 VanDerWaalsContact O-CA 3.22Å; C650-L654 WeakPolarHBondContact O-CA 3.49Å; C650-L654 PolarHBondContact O-N 3.36Å; C650-C655 PolarHBondContact N-O 3.36Å; C650-C655 VanDerWaalsContact N-O 3.13Å; C650-Y673 HydrophobicContact CB-CD1 3.98Å; C650-Y673 HydrophobicContact CB-CE1 3.98Å; C650-C675 HydrophobicContact CB-CB 3.73Å; C650-C675 PolarHBondContact SG-N 3.41Å; C650-C675 VanDerWaalsContact SG-SG 3.61Å
651	E	88.1	Confident	84.7	Confident	72 Å²	72	67.2 Å²	67.2	34%	0.336	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-31.9	-179.2	-63.3	178	-177.9	0	0	114.7	R672 Y673	E651-R672 WeakPolarHBondContact OE1-CA 3.35Å; E651-R672 WeakPolarHBondContact OE1-CB 3.31Å; E651-R672 WeakPolarHBondContact OE1-CG 3.45Å; E651-R672 IonicContact OE1-NE 3.11Å; E651-R672 PolarHBondContact OE1-NE 3.32Å; E651-R672 IonicContact OE2-CZ 3.5Å; E651-R672 IonicContact OE2-NE 2.75Å; E651-R672 PolarHBondContact OE2-NE 2.89Å; E651-R672 IonicContact OE2-NH2 3.14Å; E651-R672 PolarHBondContact OE2-NH2 3.49Å; E651-Y673 PolarHBondContact N-O 2.93Å
652	D	82.7	Confident	85.2	Confident	62 Å²	62	61.8 Å²	61.8	33%	0.332	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-26.5	-173.7	-76.4	30.7	0	0	0	114.1	C650 T674 C678 R694	C650-D652 PolarHBondContact O-N 3.32Å; C650-D652 VanDerWaalsContact O-N 3.08Å; C650-D652 PolarHBondContact SG-N 3.19Å; D652-T674 HydrophobicContact CB-CG2 3.91Å; D652-T674 WeakPolarHBondContact OD2-CG2 3.48Å; D652-C678 HydrophobicContact CB-CB 3.59Å; D652-C678 VanDerWaalsContact CB-SG 3.56Å; D652-R694 IonicContact OD1-CZ 3.17Å; D652-R694 IonicContact OD1-NE 2.88Å; D652-R694 IonicContact OD1-NH2 3.6Å; D652-R694 PolarHBondContact OD1-NH2 2.99Å; D652-R694 IonicContact OD2-NE 2.65Å; D652-R694 IonicContact OD2-NH2 2.67Å
653	C	85.3	Confident	85.6	Confident	49 Å²	49	58.2 Å²	58.2	33%	0.331	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-7.4	-177.3	60	0	0	0	0	113.5	C650 C655	C650-C653 WeakPolarHBondContact CB-SG 3.42Å; C650-C653 PolarHBondContact O-N 3.13Å; C650-C653 PolarHBondContact SG-SG 2.94Å; C653-C655 HydrophobicContact CB-CB 3.91Å; C653-C655 WeakPolarHBondContact CB-SG 3.3Å; C653-C655 PolarHBondContact O-N 2.99Å; C653-C655 WeakPolarHBondContact SG-CB 3.49Å; C653-C655 PolarHBondContact SG-N 3.06Å; C653-C655 CovalentContact SG-SG 2.05Å; C653-C655 PolarHBondContact SG-SG 2.72Å
654	L	88.4	Confident	86.6	Confident	109 Å²	109	51 Å²	51	57%	0.571	29%	0.287	S	S	*	.			trans	51.5	13.6	-164.2	-53.3	-178.4	0	0	0	114.4	Q649 C650	Q649-L654 WeakPolarHBondContact CG-O 3.45Å; Q649-L654 PolarHBondContact NE2-O 3.29Å; C650-L654 VanDerWaalsContact O-CA 3.22Å; C650-L654 WeakPolarHBondContact O-CA 3.49Å; C650-L654 PolarHBondContact O-N 3.36Å
655	C	89.3	Confident	87.3	Confident	9 Å²	9	53 Å²	53	6%	0.061	30%	0.295	C	S	.	.			trans	-88.5	132.1	-173.1	67.6	0	0	0	0	111.4	I633 R635 C650 C653	I633-C655 CarbonylContact O-C 3.6Å; I633-C655 WeakPolarHBondContact O-CA 3.42Å; I633-C655 WeakPolarHBondContact O-CB 3.42Å; R635-C655 HydrophobicContact CB-CB 4.38Å; C650-C655 PolarHBondContact N-O 3.36Å; C650-C655 VanDerWaalsContact N-O 3.13Å; C653-C655 HydrophobicContact CB-CB 3.91Å; C653-C655 WeakPolarHBondContact CB-SG 3.3Å; C653-C655 PolarHBondContact O-N 2.99Å; C653-C655 WeakPolarHBondContact SG-CB 3.49Å; C653-C655 PolarHBondContact SG-N 3.06Å; C653-C655 CovalentContact SG-SG 2.05Å; C653-C655 PolarHBondContact SG-SG 2.72Å
656	W	91.5	Very high	87.7	Confident	61 Å²	61	51.3 Å²	51.3	23%	0.231	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	141.9	-174.6	-74.6	96.9	0	0	0	112.1	E632 I633 V634 R635 M647 Q649	E632-W656 PolarHBondContact OE1-NE1 3.42Å; I633-W656 PolarHBondContact O-N 3.01Å; V634-W656 WeakPolarHBondContact CA-O 3.42Å; V634-W656 HydrophobicContact CG2-CB 4.29Å; R635-W656 PolarHBondContact N-O 3.48Å; M647-W656 HydrophobicContact CB-CE3 3.72Å; M647-W656 HydrophobicContact CB-CZ3 4.07Å; M647-W656 HydrophobicContact CE-CB 4.11Å; Q649-W656 HydrophobicContact CB-CD2 3.79Å; Q649-W656 HydrophobicContact CB-CE3 3.84Å; Q649-W656 HydrophobicContact CB-CG 4.5Å; Q649-W656 HydrophobicContact CB-CH2 3.96Å; Q649-W656 HydrophobicContact CB-CZ2 3.89Å; Q649-W656 HydrophobicContact CB-CZ3 3.93Å; Q649-W656 HydrophobicContact CG-CD2 4.07Å; Q649-W656 HydrophobicContact CG-CG 4.38Å; Q649-W656 HydrophobicContact CG-CZ2 4.23Å; Q649-W656 VanDerWaalsContact N-CE3 3.33Å
657	Q	90.1	Very high	87.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144.1	178.7	-57.6	-165.5	-24.8	0	0	109.6	R635 C636 M647 I648 G659 M662 Y673 C675	R635-Q657 WeakPolarHBondContact O-CG 3.48Å; R635-Q657 PolarHBondContact O-NE2 2.95Å; C636-Q657 HydrophobicContact CB-CB 4.33Å; M647-Q657 CarbonylContact C-O 3.55Å; M647-Q657 WeakPolarHBondContact CA-O 3.36Å; I648-Q657 WeakPolarHBondContact CG2-O 3.2Å; I648-Q657 PolarHBondContact N-O 3.05Å; I648-Q657 PolarHBondContact O-N 3.23Å; Q657-G659 PolarHBondContact O-N 3.45Å; Q657-M662 HydrophobicContact CB-CE 4.29Å; Q657-M662 HydrophobicContact CB-CG 4.07Å; Q657-M662 PolarHBondContact OE1-SD 2.9Å; Q657-Y673 PolarHBondContact OE1-OH 3.37Å; Q657-C675 VanDerWaalsContact OE1-CB 3.27Å
658	H	90.8	Very high	87.1	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.5	173.7	-47	127.8	0	0	0	110.2	C636 C638 V640 E642 N644 T660 C661 M662	C636-H658 PolarHBondContact SG-N 3.19Å; C636-H658 VanDerWaalsContact SG-N 3.37Å; C638-H658 VanDerWaalsContact SG-CE1 3.52Å; C638-H658 PolarHBondContact SG-ND1 2.98Å; V640-H658 PolarHBondContact O-CE1 2.87Å; V640-H658 VanDerWaalsContact O-CE1 3.28Å; E642-H658 PolarHBondContact O-NE2 2.78Å; N644-H658 HydrophobicContact CB-CB 4.48Å; N644-H658 PolarHBondContact ND2-CD2 3.21Å; N644-H658 VanDerWaalsContact ND2-CD2 3.28Å; N644-H658 PolarHBondContact ND2-CE1 3.24Å; N644-H658 PolarHBondContact ND2-ND1 2.85Å; N644-H658 PolarHBondContact ND2-NE2 2.97Å; H658-T660 VanDerWaalsContact C-N 3.3Å; H658-T660 PolarHBondContact O-N 3.49Å; H658-C661 HydrophobicContact CB-CB 4.13Å; H658-C661 PolarHBondContact O-N 3.45Å; H658-C661 VanDerWaalsContact O-N 3.13Å; H658-M662 PolarHBondContact O-N 2.93Å
659	G	88.6	Confident	86.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-42.3	-177.6	0	0	0	0	0	112.2	F646 Q657 C661 M662 G663 L664	F646-G659 PolarHBondContact O-N 3.32Å; Q657-G659 PolarHBondContact O-N 3.45Å; G659-C661 VanDerWaalsContact C-N 3.31Å; G659-C661 PolarHBondContact O-N 2.97Å; G659-M662 CarbonylContact O-C 3.56Å; G659-M662 WeakPolarHBondContact O-CA 3.25Å; G659-M662 WeakPolarHBondContact O-CB 3.23Å; G659-M662 PolarHBondContact O-N 3.13Å; G659-G663 PolarHBondContact O-N 3.26Å; G659-G663 VanDerWaalsContact O-N 3.11Å; G659-L664 CarbonylContact C-O 3.53Å; G659-L664 VanDerWaalsContact C-O 3.27Å; G659-L664 PolarHBondContact O-N 3.45Å
660	T	87.8	Confident	86.4	Confident	107 Å²	107	61 Å²	61	66%	0.656	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-57.3	-40.6	176.3	-44	0	0	0	0	112.8	H658 M662 G663 L664	H658-T660 VanDerWaalsContact C-N 3.3Å; H658-T660 PolarHBondContact O-N 3.49Å; T660-M662 PolarHBondContact O-N 3.25Å; T660-G663 PolarHBondContact O-N 3.46Å; T660-G663 VanDerWaalsContact O-N 3.15Å; T660-L664 PolarHBondContact N-O 3.07Å
661	C	86.9	Confident	85.9	Confident	51 Å²	51	69 Å²	69	35%	0.345	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-69.6	-19.7	176.8	-67.3	0	0	0	0	112.9	C636 I637 H658 G659	C636-C661 WeakPolarHBondContact SG-CB 3.32Å; I637-C661 HydrophobicContact CG2-CB 4.24Å; H658-C661 HydrophobicContact CB-CB 4.13Å; H658-C661 PolarHBondContact O-N 3.45Å; H658-C661 VanDerWaalsContact O-N 3.13Å; G659-C661 VanDerWaalsContact C-N 3.31Å; G659-C661 PolarHBondContact O-N 2.97Å
662	M	86.1	Confident	85.6	Confident	41 Å²	41	70.3 Å²	70.3	20%	0.202	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-97.5	4.9	175.1	-61.7	-60.9	136	0	0	113	I637 Q657 H658 G659 T660 L664 Y673 Y676	I637-M662 HydrophobicContact CB-CE 3.95Å; I637-M662 HydrophobicContact CG2-CE 3.59Å; Q657-M662 HydrophobicContact CB-CE 4.29Å; Q657-M662 HydrophobicContact CB-CG 4.07Å; Q657-M662 PolarHBondContact OE1-SD 2.9Å; H658-M662 PolarHBondContact O-N 2.93Å; G659-M662 CarbonylContact O-C 3.56Å; G659-M662 WeakPolarHBondContact O-CA 3.25Å; G659-M662 WeakPolarHBondContact O-CB 3.23Å; G659-M662 PolarHBondContact O-N 3.13Å; T660-M662 PolarHBondContact O-N 3.25Å; M662-L664 VanDerWaalsContact C-N 3.26Å; M662-L664 HydrophobicContact CB-CG 4.38Å; M662-L664 PolarHBondContact O-N 3.41Å; M662-Y673 WeakPolarHBondContact CG-OH 3.48Å; M662-Y673 PolarHBondContact SD-OH 2.97Å; M662-Y673 VanDerWaalsContact SD-OH 3.35Å; M662-Y676 HydrophobicContact CE-CD1 3.89Å; M662-Y676 HydrophobicContact CE-CE1 3.99Å; M662-Y676 HydrophobicContact SD-CD1 4.05Å
663	G	85.7	Confident	85.9	Confident	68 Å²	68	68.1 Å²	68.1	70%	0.701	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	15.2	-178.3	0	0	0	0	0	114.2	G659 T660	G659-G663 PolarHBondContact O-N 3.26Å; G659-G663 VanDerWaalsContact O-N 3.11Å; T660-G663 PolarHBondContact O-N 3.46Å; T660-G663 VanDerWaalsContact O-N 3.15Å
664	L	86.4	Confident	86	Confident	26 Å²	26	66.5 Å²	66.5	14%	0.136	36%	0.364	C	S	.	.			trans	-97.1	152.5	177.8	-56.9	-178.2	0	0	0	110.8	F646 I648 G659 T660 M662 P670 Y673	F646-L664 HydrophobicContact CE1-CB 4.06Å; I648-L664 HydrophobicContact CD1-CD1 3.56Å; I648-L664 HydrophobicContact CG2-CD1 4.41Å; G659-L664 CarbonylContact C-O 3.53Å; G659-L664 VanDerWaalsContact C-O 3.27Å; G659-L664 PolarHBondContact O-N 3.45Å; T660-L664 PolarHBondContact N-O 3.07Å; M662-L664 VanDerWaalsContact C-N 3.26Å; M662-L664 HydrophobicContact CB-CG 4.38Å; M662-L664 PolarHBondContact O-N 3.41Å; L664-P670 HydrophobicContact CD2-CG 4.39Å; L664-Y673 HydrophobicContact CD1-CD2 3.81Å; L664-Y673 HydrophobicContact CD1-CE2 3.82Å
665	M	83.3	Confident	85.9	Confident	113 Å²	113	61.3 Å²	61.3	56%	0.557	34%	0.337	S	S	*	.			trans	-130.2	160.5	171.4	-53.7	-177.2	-55.5	0	0	107.1	D667 N668 V669	M665-D667 PolarHBondContact O-N 3.46Å; M665-N668 CarbonylContact O-C 3.48Å; M665-N668 WeakPolarHBondContact O-CA 3.43Å; M665-N668 PolarHBondContact O-N 2.99Å; M665-V669 PolarHBondContact O-N 3.27Å
666	E	82.3	Confident	85.5	Confident	145 Å²	145	65.3 Å²	65.3	68%	0.678	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-51.4	-40.5	179.8	-67.8	160.7	-131.8	0	0	112.9	F646 N668	F646-E666 HydrophobicContact CB-CG 4.45Å; F646-E666 HydrophobicContact CD1-CG 4.44Å; F646-E666 HydrophobicContact CD2-CG 4.05Å; F646-E666 HydrophobicContact CG-CG 4.05Å; E666-N668 PolarHBondContact O-N 3.4Å
667	D	81	Confident	85.1	Confident	149 Å²	149	64.1 Å²	64.1	80%	0.797	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-69.9	-10.4	177.3	-60.8	-49.3	0	0	0	114.9	M665	M665-D667 PolarHBondContact O-N 3.46Å
668	N	82.5	Confident	84.6	Confident	98 Å²	98	66.3 Å²	66.3	52%	0.524	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-132.6	26.7	-167.6	-70.2	-102.2	0	0	0	112.6	M665 E666 P670	M665-N668 CarbonylContact O-C 3.48Å; M665-N668 WeakPolarHBondContact O-CA 3.43Å; M665-N668 PolarHBondContact O-N 2.99Å; E666-N668 PolarHBondContact O-N 3.4Å; N668-P670 WeakPolarHBondContact O-CD 3.46Å
669	V	86	Confident	83.9	Confident	64 Å²	64	72.7 Å²	72.7	39%	0.388	39%	0.388	S	S	.	.			trans	-72.4	125.1	175.1	-176.8	0	0	0	0	109.9	F646 I648 M665	F646-V669 HydrophobicContact CE1-CG2 4.38Å; F646-V669 HydrophobicContact CE2-CG2 4.03Å; F646-V669 HydrophobicContact CZ-CG2 3.49Å; F646-V669 VanDerWaalsContact CZ-CG2 3.49Å; I648-V669 HydrophobicContact CD1-CG1 3.79Å; M665-V669 PolarHBondContact O-N 3.27Å
670	P	82.6	Confident	83.3	Confident	57 Å²	57	76.2 Å²	76.2	37%	0.37	41%	0.407	S	S	.	.			trans	-70.6	143	172.1	-14.8	29.9	0	0	0	110.8	L664 N668 R672	L664-P670 HydrophobicContact CD2-CG 4.39Å; N668-P670 WeakPolarHBondContact O-CD 3.46Å; P670-R672 PolarHBondContact O-N 2.99Å
671	D	79.7	Confident	82.6	Confident	168 Å²	168	73.5 Å²	73.5	90%	0.898	39%	0.391	S	S	*	.	S	Bend	trans	-49.6	-27.9	175.8	-56.6	-28.4	0	0	0	113.7
672	R	81.3	Confident	81.8	Confident	99 Å²	99	76.4 Å²	76.4	37%	0.374	41%	0.409	S	S	.	.	S	Bend	trans	-136.6	120.3	178.2	-65.8	-165.6	53.6	-126.9	-16.2	111.3	E651 P670 E695	E651-R672 WeakPolarHBondContact OE1-CA 3.35Å; E651-R672 WeakPolarHBondContact OE1-CB 3.31Å; E651-R672 WeakPolarHBondContact OE1-CG 3.45Å; E651-R672 IonicContact OE1-NE 3.11Å; E651-R672 PolarHBondContact OE1-NE 3.32Å; E651-R672 IonicContact OE2-CZ 3.5Å; E651-R672 IonicContact OE2-NE 2.75Å; E651-R672 PolarHBondContact OE2-NE 2.89Å; E651-R672 IonicContact OE2-NH2 3.14Å; E651-R672 PolarHBondContact OE2-NH2 3.49Å; P670-R672 PolarHBondContact O-N 2.99Å; R672-E695 IonicContact CZ-OE1 2.67Å; R672-E695 VanDerWaalsContact CZ-OE1 3.31Å; R672-E695 IonicContact NH1-OE1 3.21Å; R672-E695 PolarHBondContact NH1-OE1 3.01Å; R672-E695 IonicContact NH2-OE1 3.56Å; R672-E695 PolarHBondContact NH2-OE1 3.3Å
673	Y	88.1	Confident	81.1	Confident	15 Å²	15	78.4 Å²	78.4	6%	0.059	44%	0.44	C	S	.	.			trans	-111.4	131.3	-176.6	-178	-102.8	0	0	0	113.2	I648 Q649 C650 E651 Q657 M662 L664 C675	I648-Y673 HydrophobicContact CD1-CD1 3.97Å; I648-Y673 HydrophobicContact CD1-CD2 3.79Å; I648-Y673 HydrophobicContact CD1-CG 3.48Å; I648-Y673 VanDerWaalsContact CD1-CG 3.48Å; I648-Y673 HydrophobicContact CG1-CD1 3.83Å; I648-Y673 HydrophobicContact CG1-CG 3.85Å; I648-Y673 HydrophobicContact CG2-CD1 4.01Å; I648-Y673 HydrophobicContact CG2-CE1 3.87Å; I648-Y673 HydrophobicContact CG2-CG 4.46Å; Q649-Y673 WeakPolarHBondContact O-CD1 3.44Å; C650-Y673 HydrophobicContact CB-CD1 3.98Å; C650-Y673 HydrophobicContact CB-CE1 3.98Å; E651-Y673 PolarHBondContact N-O 2.93Å; Q657-Y673 PolarHBondContact OE1-OH 3.37Å; M662-Y673 WeakPolarHBondContact CG-OH 3.48Å; M662-Y673 PolarHBondContact SD-OH 2.97Å; M662-Y673 VanDerWaalsContact SD-OH 3.35Å; L664-Y673 HydrophobicContact CD1-CD2 3.81Å; L664-Y673 HydrophobicContact CD1-CE2 3.82Å; Y673-C675 HydrophobicContact CE1-CB 4.22Å
674	T	87.6	Confident	80.4	Confident	16 Å²	16	78.6 Å²	78.6	10%	0.098	42%	0.423	C	S	.	.			trans	-128.1	127.7	174.7	-21.1	0	0	0	0	108.9	D652 C678 R679	D652-T674 HydrophobicContact CB-CG2 3.91Å; D652-T674 WeakPolarHBondContact OD2-CG2 3.48Å; T674-C678 HydrophobicContact CG2-CB 3.84Å; T674-R679 HydrophobicContact CG2-CG 4.08Å; T674-R679 WeakPolarHBondContact O-CD 3.45Å; T674-R679 PolarHBondContact O-NE 2.83Å; T674-R679 PolarHBondContact O-NH1 2.99Å; T674-R679 PolarHBondContact OG1-NH2 2.98Å
675	C	86.9	Confident	79.2	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	45%	0.45	C	S	.	.			trans	-69.4	162.8	-178	72.2	0	0	0	0	112.3	C650 Q657 Y673 I677 C678 R679	C650-C675 HydrophobicContact CB-CB 3.73Å; C650-C675 PolarHBondContact SG-N 3.41Å; C650-C675 VanDerWaalsContact SG-SG 3.61Å; Q657-C675 VanDerWaalsContact OE1-CB 3.27Å; Y673-C675 HydrophobicContact CE1-CB 4.22Å; C675-I677 PolarHBondContact O-N 3.48Å; C675-C678 PolarHBondContact O-N 3.49Å; C675-C678 PolarHBondContact SG-N 3.45Å; C675-C678 VanDerWaalsContact SG-N 3.39Å; C675-C678 VanDerWaalsContact SG-SG 3.65Å; C675-R679 WeakPolarHBondContact O-CB 3.34Å; C675-R679 WeakPolarHBondContact O-CG 3.38Å; C675-R679 PolarHBondContact O-N 3.15Å
676	Y	81.1	Confident	77.9	Confident	92 Å²	92	88.4 Å²	88.4	36%	0.361	46%	0.459	S	S	.	.	H	α-helix	trans	-60.3	-26.1	177.4	75.2	-86.1	0	0	0	113.2	I637 M662 D680	I637-Y676 HydrophobicContact CB-CE1 3.88Å; I637-Y676 HydrophobicContact CD1-CE1 4.33Å; I637-Y676 HydrophobicContact CD1-CE2 4.33Å; I637-Y676 HydrophobicContact CG1-CE1 4.34Å; M662-Y676 HydrophobicContact CE-CD1 3.89Å; M662-Y676 HydrophobicContact CE-CE1 3.99Å; M662-Y676 HydrophobicContact SD-CD1 4.05Å; Y676-D680 CarbonylContact O-C 3.48Å; Y676-D680 WeakPolarHBondContact O-CA 3.25Å; Y676-D680 PolarHBondContact O-N 3.26Å
677	I	82.5	Confident	76.6	Confident	36 Å²	36	85.7 Å²	85.7	19%	0.185	46%	0.456	C	S	.	.	H	α-helix	trans	-74.2	-42.9	179.9	-52.8	176.4	0	0	0	110.8	R635 C675 D680 P681	R635-I677 HydrophobicContact CG-CD1 4Å; C675-I677 PolarHBondContact O-N 3.48Å; I677-D680 CarbonylContact O-C 3.54Å; I677-P681 WeakPolarHBondContact O-CA 3.25Å; I677-P681 WeakPolarHBondContact O-CB 3.39Å; I677-P681 WeakPolarHBondContact O-CD 3.42Å; I677-P681 VanDerWaalsContact O-N 3.14Å
678	C	79.7	Confident	75.2	Confident	46 Å²	46	82.1 Å²	82.1	31%	0.311	44%	0.436	S	S	.	.	H	α-helix	trans	-75.7	-32.8	177.5	-66.2	0	0	0	0	111.9	D652 T674 C675	D652-C678 HydrophobicContact CB-CB 3.59Å; D652-C678 VanDerWaalsContact CB-SG 3.56Å; T674-C678 HydrophobicContact CG2-CB 3.84Å; C675-C678 PolarHBondContact O-N 3.49Å; C675-C678 PolarHBondContact SG-N 3.45Å; C675-C678 VanDerWaalsContact SG-N 3.39Å; C675-C678 VanDerWaalsContact SG-SG 3.65Å
679	R	76.9	Confident	73.8	Confident	136 Å²	136	83 Å²	83	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-71.1	-41.2	173.5	-71.3	-179.5	170.7	153.7	8.9	113.3	T674 C675	T674-R679 HydrophobicContact CG2-CG 4.08Å; T674-R679 WeakPolarHBondContact O-CD 3.45Å; T674-R679 PolarHBondContact O-NE 2.83Å; T674-R679 PolarHBondContact O-NH1 2.99Å; T674-R679 PolarHBondContact OG1-NH2 2.98Å; C675-R679 WeakPolarHBondContact O-CB 3.34Å; C675-R679 WeakPolarHBondContact O-CG 3.38Å; C675-R679 PolarHBondContact O-N 3.15Å
680	D	74.3	Confident	72.2	Confident	74 Å²	74	89.5 Å²	89.5	40%	0.396	45%	0.451	S	S	.	.	S	Bend	trans	-136.7	71.8	-175.3	-78.4	-42.1	0	0	0	111.6	Y676 I677 R689	Y676-D680 CarbonylContact O-C 3.48Å; Y676-D680 WeakPolarHBondContact O-CA 3.25Å; Y676-D680 PolarHBondContact O-N 3.26Å; I677-D680 CarbonylContact O-C 3.54Å; D680-R689 IonicContact OD1-CZ 3.75Å; D680-R689 IonicContact OD1-NE 2.68Å; D680-R689 PolarHBondContact OD1-NE 2.98Å; D680-R689 IonicContact OD1-NH2 3.11Å; D680-R689 PolarHBondContact OD1-NH2 3.31Å; D680-R689 IonicContact OD2-CZ 3.64Å; D680-R689 IonicContact OD2-NH2 3.32Å; D680-R689 PolarHBondContact OD2-NH2 2.77Å
681	P	74.8	Confident	70.6	Confident	49 Å²	49	95.1 Å²	95.1	32%	0.318	47%	0.465	S	S	.	.			trans	-61.2	131.1	-172.2	17.9	-29	0	0	0	113.3	I677 G683 Q684	I677-P681 WeakPolarHBondContact O-CA 3.25Å; I677-P681 WeakPolarHBondContact O-CB 3.39Å; I677-P681 WeakPolarHBondContact O-CD 3.42Å; I677-P681 VanDerWaalsContact O-N 3.14Å; P681-G683 PolarHBondContact O-N 3.01Å; P681-Q684 HydrophobicContact CG-CB 4.19Å; P681-Q684 HydrophobicContact CG-CG 4.39Å; P681-Q684 VanDerWaalsContact O-CB 3.23Å; P681-Q684 WeakPolarHBondContact O-CB 3.49Å; P681-Q684 PolarHBondContact O-N 3.02Å; P681-Q684 VanDerWaalsContact O-N 3.15Å
682	P	69.8	Low	69.3	Low	112 Å²	112	95.1 Å²	95.1	73%	0.727	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	133.8	-176.3	24.9	-33.6	0	0	0	111.3
683	G	70	Confident	68.2	Low	83 Å²	83	93.2 Å²	93.2	86%	0.856	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	-5.9	-176.4	0	0	0	0	0	115.3	P681 R685	P681-G683 PolarHBondContact O-N 3.01Å; G683-R685 PolarHBondContact O-N 3.24Å
684	Q	70.8	Confident	66.8	Low	72 Å²	72	99 Å²	99	34%	0.336	47%	0.473	S	S	.	.			trans	-61.3	133.4	178.1	-164.8	-168.1	52.8	0	0	112.1	P681 Q686 L688 R689	P681-Q684 HydrophobicContact CG-CB 4.19Å; P681-Q684 HydrophobicContact CG-CG 4.39Å; P681-Q684 VanDerWaalsContact O-CB 3.23Å; P681-Q684 WeakPolarHBondContact O-CB 3.49Å; P681-Q684 PolarHBondContact O-N 3.02Å; P681-Q684 VanDerWaalsContact O-N 3.15Å; Q684-Q686 PolarHBondContact O-N 3.43Å; Q684-L688 HydrophobicContact CG-CB 4.3Å; Q684-R689 VanDerWaalsContact OE1-CB 3.26Å
685	R	62	Low	65.6	Low	189 Å²	189	101 Å²	101	71%	0.713	48%	0.481	S	S	*	.			trans	-68.1	131.3	172.6	-72.7	-176.3	-97.7	-113.4	1.4	109.6	G683 S687 L688 R689	G683-R685 PolarHBondContact O-N 3.24Å; R685-S687 PolarHBondContact O-N 2.87Å; R685-L688 HydrophobicContact CB-CD1 4.34Å; R685-L688 WeakPolarHBondContact O-CB 3.49Å; R685-L688 PolarHBondContact O-N 3.45Å; R685-R689 PolarHBondContact O-N 3.04Å
686	Q	55.8	Low	64.6	Low	157 Å²	157	105.4 Å²	105.4	73%	0.734	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.7	-177.2	-69.3	178.8	-13	0	0	114.5	Q684 L688	Q684-Q686 PolarHBondContact O-N 3.43Å; Q686-L688 VanDerWaalsContact C-N 3.27Å; Q686-L688 PolarHBondContact O-N 2.93Å
687	S	54.9	Low	63.8	Low	87 Å²	87	103 Å²	103	61%	0.608	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-19.2	173.9	55.1	0	0	0	0	114.4	R685	R685-S687 PolarHBondContact O-N 2.87Å
688	L	52	Low	63	Low	74 Å²	74	105.7 Å²	105.7	39%	0.387	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-14.4	178.8	-60	173.7	0	0	0	112.6	Q684 R685 Q686 Y690 W691	Q684-L688 HydrophobicContact CG-CB 4.3Å; R685-L688 HydrophobicContact CB-CD1 4.34Å; R685-L688 WeakPolarHBondContact O-CB 3.49Å; R685-L688 PolarHBondContact O-N 3.45Å; Q686-L688 VanDerWaalsContact C-N 3.27Å; Q686-L688 PolarHBondContact O-N 2.93Å; L688-Y690 PolarHBondContact O-N 3.46Å; L688-Y690 VanDerWaalsContact O-N 3.11Å; L688-W691 PolarHBondContact O-N 3.38Å
689	R	53.9	Low	62.6	Low	118 Å²	118	107.1 Å²	107.1	45%	0.445	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.4	-178	-169.2	172.1	179.2	-173.6	-1.1	114.8	D680 Q684 R685	D680-R689 IonicContact OD1-CZ 3.75Å; D680-R689 IonicContact OD1-NE 2.68Å; D680-R689 PolarHBondContact OD1-NE 2.98Å; D680-R689 IonicContact OD1-NH2 3.11Å; D680-R689 PolarHBondContact OD1-NH2 3.31Å; D680-R689 IonicContact OD2-CZ 3.64Å; D680-R689 IonicContact OD2-NH2 3.32Å; D680-R689 PolarHBondContact OD2-NH2 2.77Å; Q684-R689 VanDerWaalsContact OE1-CB 3.26Å; R685-R689 PolarHBondContact O-N 3.04Å
690	Y	52.1	Low	62.4	Low	199 Å²	199	100.6 Å²	100.6	78%	0.78	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	15	-178.2	-60.6	-70.4	0	0	0	113.4	L688	L688-Y690 PolarHBondContact O-N 3.46Å; L688-Y690 VanDerWaalsContact O-N 3.11Å
691	W	48.1	Very low	62.3	Low	175 Å²	175	100.7 Å²	100.7	66%	0.663	49%	0.487	S	S	*	.	S	Bend	trans	-106.8	-7.4	-166.8	-105.7	80.3	0	0	0	116.3	L688	L688-W691 PolarHBondContact O-N 3.38Å
692	Y	52.2	Low	61.9	Low	168 Å²	168	103.1 Å²	103.1	66%	0.659	50%	0.495	S	S	*	.			trans	-138.4	80.9	-176.1	-60.3	-76.1	0	0	0	111.5	R694	Y692-R694 PolarHBondContact O-N 3.28Å
693	D	57.8	Low	61.7	Low	59 Å²	59	106.9 Å²	106.9	32%	0.316	50%	0.496	S	S	.	.			trans	-74.4	98.5	155.9	-174.7	-27	0	0	0	107.2	E695 W696 L697	D693-E695 PolarHBondContact O-N 2.99Å; D693-E695 WeakPolarHBondContact OD1-CB 3.47Å; D693-E695 PolarHBondContact OD1-N 3.49Å; D693-W696 HydrophobicContact CB-CB 3.88Å; D693-W696 PolarHBondContact O-N 3.19Å; D693-W696 PolarHBondContact OD1-N 3Å; D693-L697 PolarHBondContact O-N 2.85Å
694	R	59.9	Low	61.5	Low	138 Å²	138	104.6 Å²	104.6	52%	0.521	47%	0.473	S	S	.	.	H	α-helix	trans	-62.2	-32.4	-179.1	-169.7	166.3	83.9	120.3	0.5	111.1	D652 Y692 L697 T698	D652-R694 IonicContact OD1-CZ 3.17Å; D652-R694 IonicContact OD1-NE 2.88Å; D652-R694 IonicContact OD1-NH2 3.6Å; D652-R694 PolarHBondContact OD1-NH2 2.99Å; D652-R694 IonicContact OD2-NE 2.65Å; D652-R694 IonicContact OD2-NH2 2.67Å; Y692-R694 PolarHBondContact O-N 3.28Å; R694-L697 PolarHBondContact O-N 2.95Å; R694-T698 PolarHBondContact O-N 3.33Å; R694-T698 VanDerWaalsContact O-N 3.14Å; R694-T698 PolarHBondContact O-OG1 2.99Å; R694-T698 VanDerWaalsContact O-OG1 3.05Å
695	E	61.5	Low	61.6	Low	57 Å²	57	104.9 Å²	104.9	27%	0.266	48%	0.476	S	S	.	.	H	α-helix	trans	-74.7	-39	-176.8	-43.2	-164	139	0	0	111.2	R672 D693 L697 T698 N699 Y703	R672-E695 IonicContact CZ-OE1 2.67Å; R672-E695 VanDerWaalsContact CZ-OE1 3.31Å; R672-E695 IonicContact NH1-OE1 3.21Å; R672-E695 PolarHBondContact NH1-OE1 3.01Å; R672-E695 IonicContact NH2-OE1 3.56Å; R672-E695 PolarHBondContact NH2-OE1 3.3Å; D693-E695 PolarHBondContact O-N 2.99Å; D693-E695 WeakPolarHBondContact OD1-CB 3.47Å; D693-E695 PolarHBondContact OD1-N 3.49Å; E695-L697 VanDerWaalsContact C-N 3.34Å; E695-L697 PolarHBondContact O-N 3.01Å; E695-T698 PolarHBondContact O-N 3.46Å; E695-N699 WeakPolarHBondContact O-CA 3.34Å; E695-N699 WeakPolarHBondContact O-CB 3.48Å; E695-N699 PolarHBondContact O-N 3.21Å; E695-N699 PolarHBondContact O-ND2 3.02Å; E695-Y703 PolarHBondContact OE2-OH 2.94Å
696	W	67.5	Low	61.5	Low	93 Å²	93	102.4 Å²	102.4	35%	0.352	49%	0.487	S	S	.	.	H	α-helix	trans	-59.6	-42.6	172.9	171.4	48.3	0	0	0	112.3	D693 G700 M702	D693-W696 HydrophobicContact CB-CB 3.88Å; D693-W696 PolarHBondContact O-N 3.19Å; D693-W696 PolarHBondContact OD1-N 3Å; W696-G700 WeakPolarHBondContact O-CA 3.45Å; W696-G700 PolarHBondContact O-N 2.98Å; W696-M702 HydrophobicContact CG-CG 4.06Å
697	L	64.3	Low	62.2	Low	41 Å²	41	102.6 Å²	102.6	22%	0.215	49%	0.486	C	S	.	.	H	α-helix	trans	-74.2	-32.2	-178.4	-64.2	-179.9	0	0	0	113.3	D693 R694 E695 H724	D693-L697 PolarHBondContact O-N 2.85Å; R694-L697 PolarHBondContact O-N 2.95Å; E695-L697 VanDerWaalsContact C-N 3.34Å; E695-L697 PolarHBondContact O-N 3.01Å; L697-H724 PolarHBondContact O-ND1 2.94Å; L697-H724 VanDerWaalsContact O-ND1 3.09Å
698	T	65.8	Low	63.2	Low	92 Å²	92	102.7 Å²	102.7	56%	0.564	48%	0.479	S	S	*	.	H	α-helix	trans	-79.7	-51.2	175.3	-55.4	0	0	0	0	111.7	R694 E695 T721	R694-T698 PolarHBondContact O-N 3.33Å; R694-T698 VanDerWaalsContact O-N 3.14Å; R694-T698 PolarHBondContact O-OG1 2.99Å; R694-T698 VanDerWaalsContact O-OG1 3.05Å; E695-T698 PolarHBondContact O-N 3.46Å; T698-T721 WeakPolarHBondContact O-CG2 3.02Å; T698-T721 PolarHBondContact O-OG1 3.24Å
699	N	70.8	Confident	63.6	Low	76 Å²	76	108.8 Å²	108.8	41%	0.406	51%	0.506	S	S	.	.	H	α-helix	trans	-96.5	-12.9	-168	-54.1	-33.9	0	0	0	113.2	E695 H701	E695-N699 WeakPolarHBondContact O-CA 3.34Å; E695-N699 WeakPolarHBondContact O-CB 3.48Å; E695-N699 PolarHBondContact O-N 3.21Å; E695-N699 PolarHBondContact O-ND2 3.02Å; N699-H701 PolarHBondContact O-CD2 3.29Å; N699-H701 PolarHBondContact O-N 3.11Å
700	G	72.4	Confident	64.3	Low	0 Å²	0	109.3 Å²	109.3	0%	0	52%	0.518	C	S	.	.			trans	73.9	-19.5	-175	0	0	0	0	0	114.6	W696 M702 I720 T721	W696-G700 WeakPolarHBondContact O-CA 3.45Å; W696-G700 PolarHBondContact O-N 2.98Å; G700-M702 PolarHBondContact O-N 3.34Å; G700-I720 VanDerWaalsContact O-CD1 3.32Å; G700-I720 WeakPolarHBondContact O-CD1 3.18Å; G700-T721 WeakPolarHBondContact CA-OG1 3.36Å; G700-T721 PolarHBondContact N-OG1 3.15Å; G700-T721 VanDerWaalsContact N-OG1 3.15Å
701	H	71.5	Confident	65.1	Low	76 Å²	76	101 Å²	101	35%	0.352	49%	0.487	S	S	.	.			trans	-75.8	106.5	-178.8	-68.2	-81.5	0	0	0	112.1	N699 H714	N699-H701 PolarHBondContact O-CD2 3.29Å; N699-H701 PolarHBondContact O-N 3.11Å; H701-H714 AromaticContact CE1-CD2 3.92Å; H701-H714 AromaticContact CE1-CE1 3.75Å; H701-H714 AromaticContact CE1-CG 3.46Å; H701-H714 VanDerWaalsContact CE1-CG 3.46Å; H701-H714 AromaticContact CE1-ND1 3.34Å; H701-H714 PolarHBondContact CE1-ND1 2.92Å; H701-H714 VanDerWaalsContact CE1-ND1 3.34Å; H701-H714 AromaticContact ND1-CD2 3.27Å; H701-H714 PolarHBondContact ND1-CD2 3.15Å; H701-H714 VanDerWaalsContact ND1-CD2 3.27Å; H701-H714 AromaticContact ND1-CE1 3.45Å; H701-H714 PolarHBondContact ND1-CE1 3.4Å; H701-H714 AromaticContact ND1-CG 3.3Å; H701-H714 VanDerWaalsContact ND1-CG 3.3Å; H701-H714 AromaticContact ND1-ND1 3.41Å; H701-H714 PolarHBondContact ND1-ND1 3.14Å; H701-H714 AromaticContact ND1-NE2 3.38Å; H701-H714 PolarHBondContact ND1-NE2 2.75Å
702	M	67.8	Low	66.1	Low	100 Å²	100	100.6 Å²	100.6	49%	0.493	49%	0.486	S	S	.	.			trans	-74	146.7	159.6	-57.9	179.1	73.2	0	0	110.7	W696 G700 G704 S713	W696-M702 HydrophobicContact CG-CG 4.06Å; G700-M702 PolarHBondContact O-N 3.34Å; M702-G704 PolarHBondContact O-N 3.33Å; M702-G704 VanDerWaalsContact O-N 3.08Å; M702-S713 WeakPolarHBondContact O-CB 3.5Å; M702-S713 PolarHBondContact O-OG 2.86Å
703	Y	64.7	Low	66.8	Low	190 Å²	190	92.8 Å²	92.8	75%	0.745	46%	0.457	S	S	*	.			trans	-53.3	112.6	169.8	-73.3	-86	0	0	0	112.2	E695	E695-Y703 PolarHBondContact OE2-OH 2.94Å
704	G	65.4	Low	67.6	Low	36 Å²	36	95.4 Å²	95.4	37%	0.371	47%	0.466	S	S	.	.			trans	-105.8	-172.1	173.9	0	0	0	0	0	113.1	M702 N711	M702-G704 PolarHBondContact O-N 3.33Å; M702-G704 VanDerWaalsContact O-N 3.08Å; G704-N711 WeakPolarHBondContact CA-ND2 3.36Å
705	L	72.5	Confident	68.2	Low	78 Å²	78	94.1 Å²	94.1	41%	0.408	47%	0.467	S	S	.	.			trans	-98.5	117.8	179.6	-60.2	171.4	0	0	0	108.8	F707 L708	L705-F707 HydrophobicContact CB-CD1 4.11Å; L705-F707 HydrophobicContact CB-CE1 3.77Å; L705-F707 HydrophobicContact CB-CE2 4.44Å; L705-F707 HydrophobicContact CB-CZ 3.96Å; L705-F707 HydrophobicContact CD1-CE1 4.15Å; L705-F707 HydrophobicContact CD1-CE2 4.44Å; L705-F707 HydrophobicContact CD1-CZ 3.72Å; L705-F707 HydrophobicContact CD2-CE1 4.36Å; L705-F707 HydrophobicContact CG-CE1 4.31Å; L705-F707 HydrophobicContact CG-CZ 4.33Å; L705-F707 PolarHBondContact O-N 2.78Å; L705-L708 HydrophobicContact CB-CD1 4.19Å; L705-L708 HydrophobicContact CB-CG 4.32Å; L705-L708 HydrophobicContact CD1-CD1 4.24Å; L705-L708 PolarHBondContact O-N 3.42Å
706	S	60.2	Low	68.8	Low	136 Å²	136	92.7 Å²	92.7	95%	0.951	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-4.7	-172.2	-35.4	0	0	0	0	115.8
707	F	71.8	Confident	69.5	Low	162 Å²	162	88.5 Å²	88.5	71%	0.711	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-1.8	174.1	64.8	-103.1	0	0	0	113.5	L705	L705-F707 HydrophobicContact CB-CD1 4.11Å; L705-F707 HydrophobicContact CB-CE1 3.77Å; L705-F707 HydrophobicContact CB-CE2 4.44Å; L705-F707 HydrophobicContact CB-CZ 3.96Å; L705-F707 HydrophobicContact CD1-CE1 4.15Å; L705-F707 HydrophobicContact CD1-CE2 4.44Å; L705-F707 HydrophobicContact CD1-CZ 3.72Å; L705-F707 HydrophobicContact CD2-CE1 4.36Å; L705-F707 HydrophobicContact CG-CE1 4.31Å; L705-F707 HydrophobicContact CG-CZ 4.33Å; L705-F707 PolarHBondContact O-N 2.78Å
708	L	74.1	Confident	70.2	Confident	88 Å²	88	94 Å²	94	46%	0.461	47%	0.468	S	S	.	.			trans	-96.7	106.8	171.2	-68.1	176.6	0	0	0	108.9	L705	L705-L708 HydrophobicContact CB-CD1 4.19Å; L705-L708 HydrophobicContact CB-CG 4.32Å; L705-L708 HydrophobicContact CD1-CD1 4.24Å; L705-L708 PolarHBondContact O-N 3.42Å
709	E	61.4	Low	70.8	Confident	202 Å²	202	93 Å²	93	94%	0.944	46%	0.456	S	S	*	.	S	Bend	trans	-61.5	-47.4	176.6	-161.8	161.1	-159.5	0	0	110.5	N711	E709-N711 PolarHBondContact O-N 3.49Å; E709-N711 VanDerWaalsContact O-N 3.14Å
710	D	67.8	Low	71.2	Confident	129 Å²	129	91 Å²	91	69%	0.69	45%	0.445	S	S	*	.	S	Bend	trans	-84.5	72.7	167.3	-79.6	-48.2	0	0	0	112.1	Y712 Q715	D710-Y712 PolarHBondContact O-N 2.66Å; D710-Q715 VanDerWaalsContact CG-NE2 3.34Å; D710-Q715 PolarHBondContact OD1-NE2 3.38Å
711	N	70.1	Confident	71.7	Confident	26 Å²	26	92.9 Å²	92.9	14%	0.139	46%	0.456	C	S	.	.			trans	-75.4	113.2	171	-175.2	5.3	0	0	0	110.8	G704 E709 S713 H714 Q715	G704-N711 WeakPolarHBondContact CA-ND2 3.36Å; E709-N711 PolarHBondContact O-N 3.49Å; E709-N711 VanDerWaalsContact O-N 3.14Å; N711-S713 PolarHBondContact ND2-OG 2.96Å; N711-S713 VanDerWaalsContact ND2-OG 3.13Å; N711-S713 PolarHBondContact O-N 2.55Å; N711-S713 PolarHBondContact OD1-N 3.26Å; N711-S713 PolarHBondContact OD1-OG 3.35Å; N711-H714 PolarHBondContact ND2-CD2 2.3Å; N711-H714 PolarHBondContact ND2-NE2 3.24Å; N711-H714 PolarHBondContact O-N 3.41Å; N711-Q715 PolarHBondContact O-N 3.11Å
712	Y	67.8	Low	72.2	Confident	165 Å²	165	90.7 Å²	90.7	65%	0.647	45%	0.448	S	S	*	.	H	α-helix	trans	-49.2	-35.6	178.9	179.2	-90.6	0	0	0	113.4	D710 H714 N716	D710-Y712 PolarHBondContact O-N 2.66Å; Y712-H714 VanDerWaalsContact C-N 3.34Å; Y712-H714 PolarHBondContact O-N 2.67Å; Y712-N716 WeakPolarHBondContact CD2-ND2 3.42Å; Y712-N716 HydrophobicContact CE1-CB 4.41Å; Y712-N716 VanDerWaalsContact CE2-ND2 3.26Å; Y712-N716 WeakPolarHBondContact CE2-ND2 3.42Å; Y712-N716 WeakPolarHBondContact O-CB 3.42Å; Y712-N716 PolarHBondContact O-N 2.96Å; Y712-N716 PolarHBondContact O-ND2 2.8Å
713	S	68.3	Low	72.8	Confident	5 Å²	5	88.7 Å²	88.7	4%	0.035	44%	0.442	C	S	.	.	H	α-helix	trans	-71.4	-25.6	179.2	69.6	0	0	0	0	113.5	M702 N711 A717	M702-S713 WeakPolarHBondContact O-CB 3.5Å; M702-S713 PolarHBondContact O-OG 2.86Å; N711-S713 PolarHBondContact ND2-OG 2.96Å; N711-S713 VanDerWaalsContact ND2-OG 3.13Å; N711-S713 PolarHBondContact O-N 2.55Å; N711-S713 PolarHBondContact OD1-N 3.26Å; N711-S713 PolarHBondContact OD1-OG 3.35Å; S713-A717 WeakPolarHBondContact O-CA 3.25Å; S713-A717 VanDerWaalsContact O-CB 3.28Å; S713-A717 WeakPolarHBondContact O-CB 3.44Å; S713-A717 PolarHBondContact O-N 2.98Å
714	H	73.2	Confident	73.7	Confident	113 Å²	113	83.2 Å²	83.2	52%	0.523	42%	0.423	S	S	.	.	H	α-helix	trans	-81.1	-42.2	175.5	-71.6	-124.6	0	0	0	111.1	H701 N711 Y712 N716 A717	H701-H714 AromaticContact CE1-CD2 3.92Å; H701-H714 AromaticContact CE1-CE1 3.75Å; H701-H714 AromaticContact CE1-CG 3.46Å; H701-H714 VanDerWaalsContact CE1-CG 3.46Å; H701-H714 AromaticContact CE1-ND1 3.34Å; H701-H714 PolarHBondContact CE1-ND1 2.92Å; H701-H714 VanDerWaalsContact CE1-ND1 3.34Å; H701-H714 AromaticContact ND1-CD2 3.27Å; H701-H714 PolarHBondContact ND1-CD2 3.15Å; H701-H714 VanDerWaalsContact ND1-CD2 3.27Å; H701-H714 AromaticContact ND1-CE1 3.45Å; H701-H714 PolarHBondContact ND1-CE1 3.4Å; H701-H714 AromaticContact ND1-CG 3.3Å; H701-H714 VanDerWaalsContact ND1-CG 3.3Å; H701-H714 AromaticContact ND1-ND1 3.41Å; H701-H714 PolarHBondContact ND1-ND1 3.14Å; H701-H714 AromaticContact ND1-NE2 3.38Å; H701-H714 PolarHBondContact ND1-NE2 2.75Å; N711-H714 PolarHBondContact ND2-CD2 2.3Å; N711-H714 PolarHBondContact ND2-NE2 3.24Å; N711-H714 PolarHBondContact O-N 3.41Å; Y712-H714 VanDerWaalsContact C-N 3.34Å; Y712-H714 PolarHBondContact O-N 2.67Å; H714-N716 VanDerWaalsContact C-N 3.26Å; H714-N716 PolarHBondContact O-N 2.8Å; H714-A717 PolarHBondContact O-N 3.08Å
715	Q	73	Confident	74.5	Confident	112 Å²	112	85.4 Å²	85.4	52%	0.523	42%	0.424	S	S	.	.	H	α-helix	trans	-60.1	-37	174.4	-66	-178.6	-10.3	0	0	111.9	D710 N711	D710-Q715 VanDerWaalsContact CG-NE2 3.34Å; D710-Q715 PolarHBondContact OD1-NE2 3.38Å; N711-Q715 PolarHBondContact O-N 3.11Å
716	N	75.4	Confident	75.1	Confident	27 Å²	27	82.4 Å²	82.4	14%	0.144	41%	0.408	C	S	.	.	H	α-helix	trans	-101.8	0.3	-177.2	-64.6	-82.3	0	0	0	114.6	Y712 H714 K718 K719 I720	Y712-N716 WeakPolarHBondContact CD2-ND2 3.42Å; Y712-N716 HydrophobicContact CE1-CB 4.41Å; Y712-N716 VanDerWaalsContact CE2-ND2 3.26Å; Y712-N716 WeakPolarHBondContact CE2-ND2 3.42Å; Y712-N716 WeakPolarHBondContact O-CB 3.42Å; Y712-N716 PolarHBondContact O-N 2.96Å; Y712-N716 PolarHBondContact O-ND2 2.8Å; H714-N716 VanDerWaalsContact C-N 3.26Å; H714-N716 PolarHBondContact O-N 2.8Å; N716-K718 VanDerWaalsContact C-N 3.29Å; N716-K718 PolarHBondContact O-N 2.69Å; N716-K719 WeakPolarHBondContact O-CA 3.46Å; N716-K719 WeakPolarHBondContact O-CB 3.46Å; N716-K719 PolarHBondContact O-N 2.75Å; N716-I720 HydrophobicContact CB-CD1 4.37Å; N716-I720 WeakPolarHBondContact O-CG1 3.49Å; N716-I720 PolarHBondContact O-N 2.81Å
717	A	80.2	Confident	76.3	Confident	5 Å²	5	81.8 Å²	81.8	4%	0.041	39%	0.393	C	S	.	.	H	α-helix	trans	-50.1	-48.9	-178.5	0	0	0	0	0	112	S713 H714 K719 I720 T721	S713-A717 WeakPolarHBondContact O-CA 3.25Å; S713-A717 VanDerWaalsContact O-CB 3.28Å; S713-A717 WeakPolarHBondContact O-CB 3.44Å; S713-A717 PolarHBondContact O-N 2.98Å; H714-A717 PolarHBondContact O-N 3.08Å; A717-K719 VanDerWaalsContact C-N 3.35Å; A717-K719 PolarHBondContact O-N 3.18Å; A717-I720 WeakPolarHBondContact O-CB 3.12Å; A717-I720 PolarHBondContact O-N 2.65Å; A717-I720 VanDerWaalsContact O-N 3.12Å; A717-T721 PolarHBondContact O-N 2.98Å; A717-T721 PolarHBondContact O-OG1 3.41Å
718	K	79.8	Confident	76.9	Confident	156 Å²	156	75.7 Å²	75.7	68%	0.678	38%	0.376	S	S	*	.	H	α-helix	trans	-59.6	-41.4	176.8	-64.6	-176.6	179.7	-179.7	0	112.9	N716 I720 T722 W959	N716-K718 VanDerWaalsContact C-N 3.29Å; N716-K718 PolarHBondContact O-N 2.69Å; K718-I720 VanDerWaalsContact C-N 3.31Å; K718-I720 PolarHBondContact O-N 3.19Å; K718-T722 PolarHBondContact O-N 3.1Å; K718-T722 VanDerWaalsContact O-N 3.07Å; K718-T722 PolarHBondContact O-OG1 3.33Å; K718-T722 VanDerWaalsContact O-OG1 3.05Å; K718-W959 HydrophobicContact CB-CH2 3.97Å; K718-W959 HydrophobicContact CB-CZ3 4.31Å
719	K	78	Confident	77.3	Confident	70 Å²	70	71.7 Å²	71.7	30%	0.304	36%	0.355	S	S	.	.	H	α-helix	trans	-64.8	-36	176.7	-51.8	-156.3	-179.8	-169.3	0	111.5	N716 A717 T723 W959	N716-K719 WeakPolarHBondContact O-CA 3.46Å; N716-K719 WeakPolarHBondContact O-CB 3.46Å; N716-K719 PolarHBondContact O-N 2.75Å; A717-K719 VanDerWaalsContact C-N 3.35Å; A717-K719 PolarHBondContact O-N 3.18Å; K719-T723 VanDerWaalsContact O-CB 3.26Å; K719-T723 WeakPolarHBondContact O-CB 3.48Å; K719-T723 PolarHBondContact O-N 2.92Å; K719-T723 PolarHBondContact O-OG1 3.26Å; K719-W959 HydrophobicContact CB-CE3 4.29Å; K719-W959 HydrophobicContact CB-CZ3 4.44Å; K719-W959 HydrophobicContact CD-CB 4.41Å; K719-W959 HydrophobicContact CD-CE3 4.33Å; K719-W959 HydrophobicContact CG-CD2 4.47Å; K719-W959 HydrophobicContact CG-CE3 3.7Å; K719-W959 HydrophobicContact CG-CZ3 4.13Å; K719-W959 PolarHBondContact NZ-O 3.23Å
720	I	79.6	Confident	78.5	Confident	35 Å²	35	64.2 Å²	64.2	18%	0.179	32%	0.324	C	S	.	.	H	α-helix	trans	-71.1	-52.3	177.8	-67.2	165.2	0	0	0	110.5	G700 N716 A717 K718 T722 T723 H724	G700-I720 VanDerWaalsContact O-CD1 3.32Å; G700-I720 WeakPolarHBondContact O-CD1 3.18Å; N716-I720 HydrophobicContact CB-CD1 4.37Å; N716-I720 WeakPolarHBondContact O-CG1 3.49Å; N716-I720 PolarHBondContact O-N 2.81Å; A717-I720 WeakPolarHBondContact O-CB 3.12Å; A717-I720 PolarHBondContact O-N 2.65Å; A717-I720 VanDerWaalsContact O-N 3.12Å; K718-I720 VanDerWaalsContact C-N 3.31Å; K718-I720 PolarHBondContact O-N 3.19Å; I720-T722 PolarHBondContact O-N 3.19Å; I720-T723 PolarHBondContact O-N 2.91Å; I720-H724 PolarHBondContact O-N 3.42Å
721	T	82.1	Confident	79.2	Confident	39 Å²	39	63.3 Å²	63.3	24%	0.239	32%	0.315	C	S	.	.	H	α-helix	trans	-60.1	-46.2	-179.5	-58.3	0	0	0	0	111.9	T698 G700 A717 T723 H724 Q725	T698-T721 WeakPolarHBondContact O-CG2 3.02Å; T698-T721 PolarHBondContact O-OG1 3.24Å; G700-T721 WeakPolarHBondContact CA-OG1 3.36Å; G700-T721 PolarHBondContact N-OG1 3.15Å; G700-T721 VanDerWaalsContact N-OG1 3.15Å; A717-T721 PolarHBondContact O-N 2.98Å; A717-T721 PolarHBondContact O-OG1 3.41Å; T721-T723 PolarHBondContact O-N 3.3Å; T721-H724 PolarHBondContact O-N 3.09Å; T721-Q725 WeakPolarHBondContact O-CB 3.37Å; T721-Q725 PolarHBondContact O-N 3.01Å
722	T	82.4	Confident	79.8	Confident	30 Å²	30	65.4 Å²	65.4	18%	0.184	32%	0.324	C	S	.	.	H	α-helix	trans	-70.3	-31.4	178.5	59.1	0	0	0	0	112.8	K718 I720 H724 Q725 L726 L956 W959	K718-T722 PolarHBondContact O-N 3.1Å; K718-T722 VanDerWaalsContact O-N 3.07Å; K718-T722 PolarHBondContact O-OG1 3.33Å; K718-T722 VanDerWaalsContact O-OG1 3.05Å; I720-T722 PolarHBondContact O-N 3.19Å; T722-H724 VanDerWaalsContact C-N 3.32Å; T722-Q725 PolarHBondContact O-N 2.8Å; T722-L726 WeakPolarHBondContact O-CB 3.48Å; T722-L726 PolarHBondContact O-N 3.42Å; T722-L956 WeakPolarHBondContact OG1-CD2 3.4Å; T722-W959 HydrophobicContact CG2-CH2 4.17Å; T722-W959 HydrophobicContact CG2-CZ3 4.26Å; T722-W959 WeakPolarHBondContact OG1-CZ3 3.3Å
723	T	82	Confident	80.8	Confident	59 Å²	59	57.9 Å²	57.9	36%	0.362	30%	0.295	S	S	.	.	H	α-helix	trans	-67.4	-34.7	172.3	-58.3	0	0	0	0	111.6	K719 I720 T721 L727	K719-T723 VanDerWaalsContact O-CB 3.26Å; K719-T723 WeakPolarHBondContact O-CB 3.48Å; K719-T723 PolarHBondContact O-N 2.92Å; K719-T723 PolarHBondContact O-OG1 3.26Å; I720-T723 PolarHBondContact O-N 2.91Å; T721-T723 PolarHBondContact O-N 3.3Å; T723-L727 WeakPolarHBondContact O-CB 3.49Å; T723-L727 PolarHBondContact O-N 2.82Å
724	H	81.7	Confident	81.6	Confident	74 Å²	74	61.1 Å²	61.1	34%	0.343	31%	0.314	S	S	.	.	H	α-helix	trans	-71.5	-42.6	173.9	177.8	-114.9	0	0	0	112	L697 I720 T721 T722 L727 G728	L697-H724 PolarHBondContact O-ND1 2.94Å; L697-H724 VanDerWaalsContact O-ND1 3.09Å; I720-H724 PolarHBondContact O-N 3.42Å; T721-H724 PolarHBondContact O-N 3.09Å; T722-H724 VanDerWaalsContact C-N 3.32Å; H724-L727 PolarHBondContact O-N 3.39Å; H724-G728 PolarHBondContact O-N 2.6Å
725	Q	84.1	Confident	82.2	Confident	83 Å²	83	60.8 Å²	60.8	39%	0.388	31%	0.313	S	S	.	.	H	α-helix	trans	-59.1	-52.5	175.3	-167.7	64.2	61.9	0	0	110.8	T721 T722 L727 G728 D729	T721-Q725 WeakPolarHBondContact O-CB 3.37Å; T721-Q725 PolarHBondContact O-N 3.01Å; T722-Q725 PolarHBondContact O-N 2.8Å; Q725-L727 PolarHBondContact O-N 2.54Å; Q725-G728 PolarHBondContact O-N 2.95Å; Q725-G728 VanDerWaalsContact O-N 3.08Å; Q725-D729 PolarHBondContact NE2-OD1 3.4Å; Q725-D729 WeakPolarHBondContact O-CB 3.38Å; Q725-D729 PolarHBondContact O-N 2.66Å
726	L	85.1	Confident	82.9	Confident	15 Å²	15	56.7 Å²	56.7	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-48.3	-44	171.7	166.6	63.6	0	0	0	112.7	T722 V730 I949 L953 L956	T722-L726 WeakPolarHBondContact O-CB 3.48Å; T722-L726 PolarHBondContact O-N 3.42Å; L726-V730 HydrophobicContact CD1-CG2 4.01Å; L726-V730 WeakPolarHBondContact O-CB 3.49Å; L726-V730 VanDerWaalsContact O-CG2 3.25Å; L726-V730 WeakPolarHBondContact O-CG2 3.16Å; L726-V730 PolarHBondContact O-N 2.97Å; L726-I949 HydrophobicContact CD1-CG2 3.31Å; L726-L953 HydrophobicContact CD1-CD2 3.92Å; L726-L953 HydrophobicContact CD1-CG 4.07Å; L726-L953 HydrophobicContact CD2-CD2 3.69Å; L726-L956 HydrophobicContact CB-CD1 4.48Å; L726-L956 HydrophobicContact CD2-CD1 3.59Å
727	L	84.2	Confident	83.3	Confident	122 Å²	122	58 Å²	58	64%	0.639	30%	0.301	S	S	*	.	H	α-helix	trans	-68.4	-43.6	179.9	-179.6	62.3	0	0	0	112.1	T723 H724 Q725 H731	T723-L727 WeakPolarHBondContact O-CB 3.49Å; T723-L727 PolarHBondContact O-N 2.82Å; H724-L727 PolarHBondContact O-N 3.39Å; Q725-L727 PolarHBondContact O-N 2.54Å; L727-H731 WeakPolarHBondContact O-CB 3.37Å; L727-H731 PolarHBondContact O-N 3.07Å
728	G	83.8	Confident	83.6	Confident	35 Å²	35	62 Å²	62	36%	0.361	32%	0.322	S	S	.	.	H	α-helix	trans	-64	-41.7	175.1	0	0	0	0	0	112.2	H724 Q725 H731 H732	H724-G728 PolarHBondContact O-N 2.6Å; Q725-G728 PolarHBondContact O-N 2.95Å; Q725-G728 VanDerWaalsContact O-N 3.08Å; G728-H731 WeakPolarHBondContact O-CB 3.46Å; G728-H731 PolarHBondContact O-N 3.3Å; G728-H732 WeakPolarHBondContact O-CB 3.43Å; G728-H732 PolarHBondContact O-N 3.39Å
729	D	83.8	Confident	84	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-67.1	-41.7	-179.3	-68.5	5.9	0	0	0	111.7	Q725 H732 V733 R945 F948 I949	Q725-D729 PolarHBondContact NE2-OD1 3.4Å; Q725-D729 WeakPolarHBondContact O-CB 3.38Å; Q725-D729 PolarHBondContact O-N 2.66Å; D729-H732 PolarHBondContact O-N 2.88Å; D729-V733 WeakPolarHBondContact O-CG2 3.29Å; D729-V733 PolarHBondContact O-N 3.5Å; D729-R945 VanDerWaalsContact CG-CZ 3.49Å; D729-R945 IonicContact OD1-CZ 2.68Å; D729-R945 IonicContact OD1-NH1 2.81Å; D729-R945 IonicContact OD1-NH2 3.44Å; D729-R945 PolarHBondContact OD1-NH2 3.04Å; D729-R945 IonicContact OD2-CZ 3.1Å; D729-R945 IonicContact OD2-NH1 3.22Å; D729-R945 PolarHBondContact OD2-NH1 3.34Å; D729-R945 IonicContact OD2-NH2 3.96Å; D729-R945 PolarHBondContact OD2-NH2 3.21Å; D729-F948 WeakPolarHBondContact OD2-CE1 3.24Å; D729-I949 HydrophobicContact CB-CD1 3.79Å; D729-I949 HydrophobicContact CB-CG1 3.65Å
730	V	86.4	Confident	84.4	Confident	46 Å²	46	53.1 Å²	53.1	28%	0.279	29%	0.291	S	S	.	.	H	α-helix	trans	-66.1	-38.1	172.3	169.2	0	0	0	0	111.6	L726 V734 I949 M982	L726-V730 HydrophobicContact CD1-CG2 4.01Å; L726-V730 WeakPolarHBondContact O-CB 3.49Å; L726-V730 VanDerWaalsContact O-CG2 3.25Å; L726-V730 WeakPolarHBondContact O-CG2 3.16Å; L726-V730 PolarHBondContact O-N 2.97Å; V730-V734 WeakPolarHBondContact O-CG2 3.48Å; V730-V734 PolarHBondContact O-N 3.32Å; V730-V734 VanDerWaalsContact O-N 3.15Å; V730-I949 HydrophobicContact CG2-CD1 4.34Å; V730-I949 HydrophobicContact CG2-CG2 4.17Å; V730-M982 HydrophobicContact CG2-CE 4.45Å; V730-M982 HydrophobicContact CG2-SD 4.34Å
731	H	82.3	Confident	84.7	Confident	110 Å²	110	58.2 Å²	58.2	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-45.7	175	-167.2	-86.7	0	0	0	111.3	L727 G728 V733 V734 E735	L727-H731 WeakPolarHBondContact O-CB 3.37Å; L727-H731 PolarHBondContact O-N 3.07Å; G728-H731 WeakPolarHBondContact O-CB 3.46Å; G728-H731 PolarHBondContact O-N 3.3Å; H731-V733 PolarHBondContact O-N 2.82Å; H731-V734 WeakPolarHBondContact O-CA 3.32Å; H731-V734 WeakPolarHBondContact O-CB 3.15Å; H731-V734 PolarHBondContact O-N 3.39Å; H731-E735 VanDerWaalsContact CE1-CD 3.48Å; H731-E735 IonicContact CE1-OE1 2.79Å; H731-E735 PolarHBondContact CE1-OE1 2.05Å; H731-E735 IonicContact ND1-OE1 3.89Å; H731-E735 PolarHBondContact ND1-OE1 3.24Å; H731-E735 IonicContact ND1-OE2 2.89Å; H731-E735 PolarHBondContact ND1-OE2 2.75Å; H731-E735 WeakPolarHBondContact O-CG 3.35Å; H731-E735 PolarHBondContact O-N 3.2Å
732	H	83.5	Confident	85	Confident	69 Å²	69	62 Å²	62	32%	0.319	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-41.7	179.1	-173.5	53.9	0	0	0	112.5	G728 D729 V734 E735 I736	G728-H732 WeakPolarHBondContact O-CB 3.43Å; G728-H732 PolarHBondContact O-N 3.39Å; D729-H732 PolarHBondContact O-N 2.88Å; H732-V734 VanDerWaalsContact C-N 3.31Å; H732-V734 PolarHBondContact O-N 3.17Å; H732-E735 WeakPolarHBondContact CA-OE2 3.14Å; H732-E735 IonicContact ND1-OE2 3.78Å; H732-E735 PolarHBondContact O-N 2.86Å; H732-I736 VanDerWaalsContact O-CG1 3.32Å; H732-I736 WeakPolarHBondContact O-CG1 3.44Å; H732-I736 PolarHBondContact O-N 3.18Å
733	V	87.1	Confident	85.2	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.042	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-39.1	171.9	168.4	0	0	0	0	111.5	D729 H731 I736 L737 V942 R945 M946 I949	D729-V733 WeakPolarHBondContact O-CG2 3.29Å; D729-V733 PolarHBondContact O-N 3.5Å; H731-V733 PolarHBondContact O-N 2.82Å; V733-I736 PolarHBondContact O-N 2.89Å; V733-L737 HydrophobicContact CG1-CD1 3.78Å; V733-L737 HydrophobicContact CG1-CG 4.3Å; V733-L737 WeakPolarHBondContact O-CB 3.47Å; V733-L737 WeakPolarHBondContact O-CG 3.24Å; V733-L737 PolarHBondContact O-N 2.83Å; V733-V942 HydrophobicContact CG1-CG1 4.24Å; V733-R945 HydrophobicContact CG2-CB 4.31Å; V733-R945 HydrophobicContact CG2-CG 4.26Å; V733-M946 HydrophobicContact CG1-CG 4.46Å; V733-M946 HydrophobicContact CG1-SD 3.98Å; V733-M946 HydrophobicContact CG2-CG 4.49Å; V733-M946 HydrophobicContact CG2-SD 4.39Å; V733-I949 HydrophobicContact CG2-CD1 3.97Å
734	V	85.5	Confident	85.4	Confident	74 Å²	74	63.6 Å²	63.6	45%	0.448	33%	0.333	S	S	.	.	H	α-helix	trans	-66.6	-40.9	175.5	170.5	0	0	0	0	111.8	V730 H731 H732 L737 N738	V730-V734 WeakPolarHBondContact O-CG2 3.48Å; V730-V734 PolarHBondContact O-N 3.32Å; V730-V734 VanDerWaalsContact O-N 3.15Å; H731-V734 WeakPolarHBondContact O-CA 3.32Å; H731-V734 WeakPolarHBondContact O-CB 3.15Å; H731-V734 PolarHBondContact O-N 3.39Å; H732-V734 VanDerWaalsContact C-N 3.31Å; H732-V734 PolarHBondContact O-N 3.17Å; V734-L737 PolarHBondContact O-N 3.23Å; V734-N738 VanDerWaalsContact O-CG 3.24Å; V734-N738 PolarHBondContact O-N 3.13Å; V734-N738 PolarHBondContact O-ND2 3.39Å
735	E	85.5	Confident	85.6	Confident	105 Å²	105	62.7 Å²	62.7	49%	0.491	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-47.6	174.4	-70.8	171.3	142.6	0	0	111.7	H731 H732 N738 G739	H731-E735 VanDerWaalsContact CE1-CD 3.48Å; H731-E735 IonicContact CE1-OE1 2.79Å; H731-E735 PolarHBondContact CE1-OE1 2.05Å; H731-E735 IonicContact ND1-OE1 3.89Å; H731-E735 PolarHBondContact ND1-OE1 3.24Å; H731-E735 IonicContact ND1-OE2 2.89Å; H731-E735 PolarHBondContact ND1-OE2 2.75Å; H731-E735 WeakPolarHBondContact O-CG 3.35Å; H731-E735 PolarHBondContact O-N 3.2Å; H732-E735 WeakPolarHBondContact CA-OE2 3.14Å; H732-E735 IonicContact ND1-OE2 3.78Å; H732-E735 PolarHBondContact O-N 2.86Å; E735-N738 PolarHBondContact O-N 3.4Å; E735-G739 PolarHBondContact O-N 3.19Å
736	I	87.4	Confident	85.8	Confident	26 Å²	26	59.4 Å²	59.4	13%	0.133	32%	0.321	C	S	.	.	H	α-helix	trans	-63.9	-43.3	177.8	-63.6	163.7	0	0	0	111	H732 V733 N738 G739 L740 V938 V942	H732-I736 VanDerWaalsContact O-CG1 3.32Å; H732-I736 WeakPolarHBondContact O-CG1 3.44Å; H732-I736 PolarHBondContact O-N 3.18Å; V733-I736 PolarHBondContact O-N 2.89Å; I736-N738 VanDerWaalsContact C-N 3.33Å; I736-N738 PolarHBondContact O-N 2.99Å; I736-G739 CarbonylContact O-C 3.38Å; I736-G739 WeakPolarHBondContact O-CA 3.48Å; I736-G739 PolarHBondContact O-N 3.42Å; I736-G739 VanDerWaalsContact O-N 3.11Å; I736-L740 HydrophobicContact CG2-CD1 4Å; I736-L740 HydrophobicContact CG2-CG 4.17Å; I736-L740 WeakPolarHBondContact O-CB 3.47Å; I736-L740 WeakPolarHBondContact O-CG 3.46Å; I736-L740 PolarHBondContact O-N 2.98Å; I736-V938 HydrophobicContact CG2-CG1 3.32Å; I736-V942 HydrophobicContact CB-CG2 3.98Å; I736-V942 HydrophobicContact CD1-CG2 4.23Å; I736-V942 HydrophobicContact CG2-CG2 3.32Å
737	L	84.7	Confident	85.7	Confident	55 Å²	55	60.2 Å²	60.2	29%	0.288	33%	0.325	S	S	.	.	H	α-helix	trans	-62.1	-38.9	178	-74.2	169.7	0	0	0	112.3	V733 V734 L740 Q741 L985	V733-L737 HydrophobicContact CG1-CD1 3.78Å; V733-L737 HydrophobicContact CG1-CG 4.3Å; V733-L737 WeakPolarHBondContact O-CB 3.47Å; V733-L737 WeakPolarHBondContact O-CG 3.24Å; V733-L737 PolarHBondContact O-N 2.83Å; V734-L737 PolarHBondContact O-N 3.23Å; L737-L740 PolarHBondContact O-N 3.27Å; L737-Q741 WeakPolarHBondContact O-CB 3.16Å; L737-Q741 PolarHBondContact O-N 2.73Å; L737-L985 HydrophobicContact CD1-CD2 4.38Å
738	N	85.7	Confident	85.6	Confident	88 Å²	88	62 Å²	62	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-64.3	-42.4	172.3	-68.7	-36	0	0	0	111.3	V734 E735 I736 Q741 L742	V734-N738 VanDerWaalsContact O-CG 3.24Å; V734-N738 PolarHBondContact O-N 3.13Å; V734-N738 PolarHBondContact O-ND2 3.39Å; E735-N738 PolarHBondContact O-N 3.4Å; I736-N738 VanDerWaalsContact C-N 3.33Å; I736-N738 PolarHBondContact O-N 2.99Å; N738-Q741 PolarHBondContact O-N 3.28Å; N738-L742 WeakPolarHBondContact O-CG 3.46Å; N738-L742 PolarHBondContact O-N 2.79Å; N738-L742 VanDerWaalsContact O-N 3.09Å
739	G	88.3	Confident	85.5	Confident	24 Å²	24	62.2 Å²	62.2	25%	0.247	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-39.3	175.4	0	0	0	0	0	113.6	E735 I736 L742 K743	E735-G739 PolarHBondContact O-N 3.19Å; I736-G739 CarbonylContact O-C 3.38Å; I736-G739 WeakPolarHBondContact O-CA 3.48Å; I736-G739 PolarHBondContact O-N 3.42Å; I736-G739 VanDerWaalsContact O-N 3.11Å; G739-L742 PolarHBondContact O-N 3.06Å; G739-K743 WeakPolarHBondContact O-CB 3.41Å; G739-K743 VanDerWaalsContact O-CG 3.28Å; G739-K743 WeakPolarHBondContact O-CG 3.4Å; G739-K743 PolarHBondContact O-N 2.82Å
740	L	87.8	Confident	84.7	Confident	17 Å²	17	65.5 Å²	65.5	9%	0.089	35%	0.349	C	S	.	.	H	α-helix	trans	-65.7	-40.2	173.1	-76.6	173.6	0	0	0	111.4	I736 L737 L742 K743 M744 I935 V938 Q939 V942	I736-L740 HydrophobicContact CG2-CD1 4Å; I736-L740 HydrophobicContact CG2-CG 4.17Å; I736-L740 WeakPolarHBondContact O-CB 3.47Å; I736-L740 WeakPolarHBondContact O-CG 3.46Å; I736-L740 PolarHBondContact O-N 2.98Å; L737-L740 PolarHBondContact O-N 3.27Å; L740-L742 VanDerWaalsContact C-N 3.33Å; L740-L742 PolarHBondContact O-N 3.17Å; L740-K743 PolarHBondContact O-N 2.94Å; L740-M744 VanDerWaalsContact O-CB 3.26Å; L740-M744 WeakPolarHBondContact O-CB 3.26Å; L740-M744 PolarHBondContact O-N 2.89Å; L740-I935 HydrophobicContact CD2-CB 4.4Å; L740-I935 HydrophobicContact CD2-CG1 4.15Å; L740-I935 HydrophobicContact CD2-CG2 4.27Å; L740-V938 HydrophobicContact CD1-CG1 4.32Å; L740-V938 HydrophobicContact CD2-CB 4.46Å; L740-V938 HydrophobicContact CD2-CG1 4.09Å; L740-V938 HydrophobicContact CG-CG1 4.24Å; L740-Q939 HydrophobicContact CD1-CG 4.27Å; L740-V942 HydrophobicContact CD1-CG2 4.35Å
741	Q	86.2	Confident	84	Confident	141 Å²	141	69 Å²	69	66%	0.659	37%	0.371	S	S	*	.	H	α-helix	trans	-61	-42	175.1	-175.9	177.5	-8.6	0	0	111.8	L737 N738 S745	L737-Q741 WeakPolarHBondContact O-CB 3.16Å; L737-Q741 PolarHBondContact O-N 2.73Å; N738-Q741 PolarHBondContact O-N 3.28Å; Q741-S745 PolarHBondContact O-N 3.45Å
742	L	87.1	Confident	83.9	Confident	119 Å²	119	66.2 Å²	66.2	62%	0.623	36%	0.358	S	S	*	.	H	α-helix	trans	-62.8	-51	174.1	-69.7	169.5	0	0	0	111.3	N738 G739 L740 M744 S745 V746	N738-L742 WeakPolarHBondContact O-CG 3.46Å; N738-L742 PolarHBondContact O-N 2.79Å; N738-L742 VanDerWaalsContact O-N 3.09Å; G739-L742 PolarHBondContact O-N 3.06Å; L740-L742 VanDerWaalsContact C-N 3.33Å; L740-L742 PolarHBondContact O-N 3.17Å; L742-M744 VanDerWaalsContact C-N 3.31Å; L742-M744 PolarHBondContact O-N 2.68Å; L742-S745 WeakPolarHBondContact O-CA 3.46Å; L742-S745 WeakPolarHBondContact O-CB 3.42Å; L742-S745 PolarHBondContact O-N 3.37Å; L742-S745 PolarHBondContact O-OG 3.5Å; L742-V746 PolarHBondContact O-N 3.09Å
743	K	87.1	Confident	83.8	Confident	54 Å²	54	67 Å²	67	24%	0.235	37%	0.369	C	S	.	.	H	α-helix	trans	-58.8	-39.1	178.2	-72.8	169.6	-174.9	172.1	0	112.9	G739 L740 S745 V746 L747 W758 L931 I935	G739-K743 WeakPolarHBondContact O-CB 3.41Å; G739-K743 VanDerWaalsContact O-CG 3.28Å; G739-K743 WeakPolarHBondContact O-CG 3.4Å; G739-K743 PolarHBondContact O-N 2.82Å; L740-K743 PolarHBondContact O-N 2.94Å; K743-S745 VanDerWaalsContact C-N 3.33Å; K743-S745 PolarHBondContact O-N 3.41Å; K743-V746 WeakPolarHBondContact O-CB 3.48Å; K743-V746 PolarHBondContact O-N 2.92Å; K743-L747 PolarHBondContact O-N 3.47Å; K743-L747 VanDerWaalsContact O-N 3.13Å; K743-W758 HydrophobicContact CD-CZ2 4.44Å; K743-L931 HydrophobicContact CB-CD1 4Å; K743-L931 HydrophobicContact CD-CD1 4.5Å; K743-L931 HydrophobicContact CG-CD1 4.15Å; K743-I935 HydrophobicContact CB-CD1 3.9Å; K743-I935 HydrophobicContact CB-CG1 4.06Å
744	M	86.8	Confident	83.8	Confident	69 Å²	69	70.3 Å²	70.3	34%	0.34	39%	0.387	S	S	.	.	H	α-helix	trans	-66.6	-33.1	174.3	-163.7	68.7	70.4	0	0	112.2	L740 L742 L747 Q748 I935	L740-M744 VanDerWaalsContact O-CB 3.26Å; L740-M744 WeakPolarHBondContact O-CB 3.26Å; L740-M744 PolarHBondContact O-N 2.89Å; L742-M744 VanDerWaalsContact C-N 3.31Å; L742-M744 PolarHBondContact O-N 2.68Å; M744-L747 PolarHBondContact O-N 2.81Å; M744-L747 HydrophobicContact SD-CD1 4.5Å; M744-Q748 VanDerWaalsContact O-CG 3.29Å; M744-Q748 WeakPolarHBondContact O-CG 3.33Å; M744-Q748 PolarHBondContact O-N 3.23Å; M744-Q748 VanDerWaalsContact O-N 3.1Å; M744-I935 HydrophobicContact CE-CG2 3.98Å
745	S	86.1	Confident	83.8	Confident	54 Å²	54	66.8 Å²	66.8	38%	0.378	37%	0.365	S	S	.	.	H	α-helix	trans	-71.1	-34.5	174.4	77.2	0	0	0	0	112.9	Q741 L742 K743 Q748 S749	Q741-S745 PolarHBondContact O-N 3.45Å; L742-S745 WeakPolarHBondContact O-CA 3.46Å; L742-S745 WeakPolarHBondContact O-CB 3.42Å; L742-S745 PolarHBondContact O-N 3.37Å; L742-S745 PolarHBondContact O-OG 3.5Å; K743-S745 VanDerWaalsContact C-N 3.33Å; K743-S745 PolarHBondContact O-N 3.41Å; S745-Q748 PolarHBondContact O-N 3.05Å; S745-S749 PolarHBondContact O-N 3.14Å; S745-S749 PolarHBondContact O-OG 2.84Å
746	V	86.6	Confident	83.8	Confident	15 Å²	15	68 Å²	68	9%	0.091	37%	0.365	C	S	.	.	H	α-helix	trans	-61.3	-46.6	171	174.8	0	0	0	0	110.2	L742 K743 Q748 S749 H752 L755 L931	L742-V746 PolarHBondContact O-N 3.09Å; K743-V746 WeakPolarHBondContact O-CB 3.48Å; K743-V746 PolarHBondContact O-N 2.92Å; V746-Q748 PolarHBondContact O-N 3.24Å; V746-S749 CarbonylContact O-C 3.59Å; V746-S749 PolarHBondContact O-N 3.25Å; V746-S749 VanDerWaalsContact O-N 3.16Å; V746-S749 PolarHBondContact O-OG 3.49Å; V746-H752 HydrophobicContact CG1-CB 4.02Å; V746-L755 HydrophobicContact CG1-CB 4.24Å; V746-L755 HydrophobicContact CG1-CD1 4.42Å; V746-L931 HydrophobicContact CB-CD2 4.26Å; V746-L931 HydrophobicContact CG1-CD2 3.86Å
747	L	83.6	Confident	83.7	Confident	31 Å²	31	73.2 Å²	73.2	16%	0.162	39%	0.393	C	S	.	.	H	α-helix	trans	-61.3	-37.7	175.1	-78.1	179.3	0	0	0	114.1	K743 M744 S749 Q928 L931 L932 I935	K743-L747 PolarHBondContact O-N 3.47Å; K743-L747 VanDerWaalsContact O-N 3.13Å; M744-L747 PolarHBondContact O-N 2.81Å; M744-L747 HydrophobicContact SD-CD1 4.5Å; L747-S749 PolarHBondContact O-N 3.46Å; L747-Q928 HydrophobicContact CD2-CB 4.06Å; L747-Q928 HydrophobicContact CD2-CG 4.17Å; L747-L931 HydrophobicContact CD1-CG 4.24Å; L747-L931 HydrophobicContact CD2-CB 4.09Å; L747-L931 HydrophobicContact CD2-CD2 3.69Å; L747-L931 HydrophobicContact CD2-CG 3.83Å; L747-L931 HydrophobicContact CG-CD2 3.67Å; L747-L931 HydrophobicContact CG-CG 3.8Å; L747-L932 HydrophobicContact CD1-CD2 3.51Å; L747-L932 HydrophobicContact CD1-CG 3.79Å; L747-L932 HydrophobicContact CD2-CG 4.32Å; L747-I935 HydrophobicContact CD1-CD1 3.47Å; L747-I935 VanDerWaalsContact CD1-CD1 3.47Å; L747-I935 HydrophobicContact CG-CD1 4.26Å
748	Q	82.5	Confident	83.9	Confident	160 Å²	160	72.8 Å²	72.8	75%	0.748	39%	0.388	S	S	*	.	H	α-helix	trans	-66.2	-15.2	178.7	-73.9	168.8	22.8	0	0	113.2	M744 S745 V746	M744-Q748 VanDerWaalsContact O-CG 3.29Å; M744-Q748 WeakPolarHBondContact O-CG 3.33Å; M744-Q748 PolarHBondContact O-N 3.23Å; M744-Q748 VanDerWaalsContact O-N 3.1Å; S745-Q748 PolarHBondContact O-N 3.05Å; V746-Q748 PolarHBondContact O-N 3.24Å
749	S	81.5	Confident	83.9	Confident	40 Å²	40	74 Å²	74	28%	0.28	39%	0.39	S	S	.	.			trans	-114.9	90.7	175.8	44.1	0	0	0	0	110.2	S745 V746 L747 T751 H752	S745-S749 PolarHBondContact O-N 3.14Å; S745-S749 PolarHBondContact O-OG 2.84Å; V746-S749 CarbonylContact O-C 3.59Å; V746-S749 PolarHBondContact O-N 3.25Å; V746-S749 VanDerWaalsContact O-N 3.16Å; V746-S749 PolarHBondContact O-OG 3.49Å; L747-S749 PolarHBondContact O-N 3.46Å; S749-T751 PolarHBondContact O-N 3.18Å; S749-H752 WeakPolarHBondContact O-CB 3.42Å; S749-H752 PolarHBondContact O-N 3.07Å; S749-H752 PolarHBondContact OG-CD2 2.66Å; S749-H752 VanDerWaalsContact OG-CD2 3.3Å
750	S	67.4	Low	83.7	Confident	72 Å²	72	79.3 Å²	79.3	50%	0.503	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-13.9	-177.1	57	0	0	0	0	115.5
751	T	72.1	Confident	83.5	Confident	118 Å²	118	81.9 Å²	81.9	72%	0.724	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	17.1	176.3	56	0	0	0	0	113.9	S749	S749-T751 PolarHBondContact O-N 3.18Å
752	H	79.8	Confident	83.4	Confident	52 Å²	52	79.8 Å²	79.8	24%	0.241	41%	0.412	C	S	.	.			trans	-65.5	135.1	-179.8	-156.8	-85.1	0	0	0	111.7	V746 S749 D754 L755	V746-H752 HydrophobicContact CG1-CB 4.02Å; S749-H752 WeakPolarHBondContact O-CB 3.42Å; S749-H752 PolarHBondContact O-N 3.07Å; S749-H752 PolarHBondContact OG-CD2 2.66Å; S749-H752 VanDerWaalsContact OG-CD2 3.3Å; H752-D754 IonicContact CE1-OD1 2.54Å; H752-D754 IonicContact CE1-OD2 2.66Å; H752-D754 PolarHBondContact CE1-OD2 2.92Å; H752-D754 WeakPolarHBondContact ND1-CB 3.3Å; H752-D754 PolarHBondContact ND1-N 3.43Å; H752-D754 IonicContact ND1-OD1 2.6Å; H752-D754 IonicContact ND1-OD2 2.73Å; H752-D754 PolarHBondContact O-N 3.09Å; H752-L755 VanDerWaalsContact O-CB 3.28Å; H752-L755 WeakPolarHBondContact O-CB 3.48Å; H752-L755 PolarHBondContact O-N 3.48Å
753	P	81.8	Confident	83.1	Confident	87 Å²	87	80.9 Å²	80.9	57%	0.565	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-59.8	-47.3	178.7	21.6	-31.7	0	0	0	112.1	L755 R756	P753-L755 PolarHBondContact O-N 3.3Å; P753-R756 VanDerWaalsContact O-CB 3.32Å; P753-R756 WeakPolarHBondContact O-CB 3.5Å; P753-R756 WeakPolarHBondContact O-CG 3.34Å; P753-R756 PolarHBondContact O-N 2.9Å
754	D	85.8	Confident	81.8	Confident	76 Å²	76	84.2 Å²	84.2	41%	0.406	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-63.7	-10.7	-177.3	-50.6	9.8	0	0	0	114.2	H752 R756 L757	H752-D754 IonicContact CE1-OD1 2.54Å; H752-D754 IonicContact CE1-OD2 2.66Å; H752-D754 PolarHBondContact CE1-OD2 2.92Å; H752-D754 WeakPolarHBondContact ND1-CB 3.3Å; H752-D754 PolarHBondContact ND1-N 3.43Å; H752-D754 IonicContact ND1-OD1 2.6Å; H752-D754 IonicContact ND1-OD2 2.73Å; H752-D754 PolarHBondContact O-N 3.09Å; D754-R756 PolarHBondContact O-N 3.23Å; D754-L757 HydrophobicContact CB-CD1 4.05Å; D754-L757 HydrophobicContact CB-CG 4.47Å; D754-L757 VanDerWaalsContact O-CB 3.27Å; D754-L757 WeakPolarHBondContact O-CB 3.24Å; D754-L757 WeakPolarHBondContact O-CG 3.16Å; D754-L757 PolarHBondContact O-N 3.09Å
755	L	85.9	Confident	79.8	Confident	0 Å²	0	90.2 Å²	90.2	0%	0	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-58.5	-30.2	170.1	-173.5	65.1	0	0	0	110.8	V746 H752 P753 L757 W758 Y924 W927 Q928 L931	V746-L755 HydrophobicContact CG1-CB 4.24Å; V746-L755 HydrophobicContact CG1-CD1 4.42Å; H752-L755 VanDerWaalsContact O-CB 3.28Å; H752-L755 WeakPolarHBondContact O-CB 3.48Å; H752-L755 PolarHBondContact O-N 3.48Å; P753-L755 PolarHBondContact O-N 3.3Å; L755-L757 PolarHBondContact O-N 3.14Å; L755-L757 VanDerWaalsContact O-N 3.14Å; L755-W758 PolarHBondContact O-N 3.47Å; L755-Y924 HydrophobicContact CD2-CD1 3.95Å; L755-W927 HydrophobicContact CD1-CB 4.1Å; L755-W927 HydrophobicContact CD2-CB 4.47Å; L755-W927 HydrophobicContact CD2-CE3 4.46Å; L755-W927 HydrophobicContact CG-CB 3.83Å; L755-W927 HydrophobicContact CG-CE3 4.25Å; L755-Q928 HydrophobicContact CD1-CG 4.07Å; L755-Q928 HydrophobicContact CD2-CG 3.96Å; L755-L931 HydrophobicContact CD1-CD2 3.88Å
756	R	85.1	Confident	77.5	Confident	129 Å²	129	94.7 Å²	94.7	49%	0.487	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-61.4	-16.1	173.5	-68.9	174.5	174.8	-164.7	-3.1	114.1	P753 D754 W758 Q759 Y924 W927	P753-R756 VanDerWaalsContact O-CB 3.32Å; P753-R756 WeakPolarHBondContact O-CB 3.5Å; P753-R756 WeakPolarHBondContact O-CG 3.34Å; P753-R756 PolarHBondContact O-N 2.9Å; D754-R756 PolarHBondContact O-N 3.23Å; R756-W758 PolarHBondContact O-N 2.82Å; R756-Q759 VanDerWaalsContact O-CG 3.31Å; R756-Q759 WeakPolarHBondContact O-CG 3.45Å; R756-Q759 PolarHBondContact O-NE2 2.9Å; R756-Y924 PolarHBondContact NE-OH 3.19Å; R756-Y924 PolarHBondContact NH2-OH 3.37Å; R756-W927 HydrophobicContact CB-CZ3 4.42Å; R756-W927 HydrophobicContact CG-CE3 3.98Å; R756-W927 HydrophobicContact CG-CH2 3.81Å; R756-W927 HydrophobicContact CG-CZ3 3.41Å; R756-W927 VanDerWaalsContact CG-CZ3 3.41Å
757	L	86.6	Confident	74.7	Confident	137 Å²	137	104.7 Å²	104.7	72%	0.717	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-69.2	-18.3	173.1	-58.3	177	0	0	0	112.1	D754 L755	D754-L757 HydrophobicContact CB-CD1 4.05Å; D754-L757 HydrophobicContact CB-CG 4.47Å; D754-L757 VanDerWaalsContact O-CB 3.27Å; D754-L757 WeakPolarHBondContact O-CB 3.24Å; D754-L757 WeakPolarHBondContact O-CG 3.16Å; D754-L757 PolarHBondContact O-N 3.09Å; L755-L757 PolarHBondContact O-N 3.14Å; L755-L757 VanDerWaalsContact O-N 3.14Å
758	W	87.6	Confident	72.4	Confident	46 Å²	46	109 Å²	109	17%	0.174	54%	0.539	C	S	.	.	G	3₁₀ helix	trans	-99.9	30.2	-177.7	-55.3	90.2	0	0	0	112.4	K743 L755 R756 Q760 W927 N930 L931 H934	K743-W758 HydrophobicContact CD-CZ2 4.44Å; L755-W758 PolarHBondContact O-N 3.47Å; R756-W758 PolarHBondContact O-N 2.82Å; W758-Q760 PolarHBondContact O-N 2.91Å; W758-W927 HydrophobicContact CB-CB 4.41Å; W758-N930 HydrophobicContact CB-CB 4.28Å; W758-N930 WeakPolarHBondContact O-CB 3.3Å; W758-N930 PolarHBondContact O-ND2 2.92Å; W758-L931 HydrophobicContact CB-CB 4.14Å; W758-L931 HydrophobicContact CD2-CB 4.08Å; W758-L931 HydrophobicContact CD2-CD1 3.83Å; W758-L931 HydrophobicContact CD2-CG 4.44Å; W758-L931 HydrophobicContact CE3-CD1 4.36Å; W758-L931 HydrophobicContact CG-CB 3.81Å; W758-L931 HydrophobicContact CG-CD1 4.22Å; W758-L931 HydrophobicContact CG-CD2 4.4Å; W758-L931 HydrophobicContact CG-CG 4.36Å; W758-L931 HydrophobicContact CH2-CD1 4.45Å; W758-L931 HydrophobicContact CZ2-CD1 3.93Å; W758-H934 HydrophobicContact CE3-CB 4.13Å; W758-H934 HydrophobicContact CH2-CB 4.17Å; W758-H934 AromaticContact CH2-CD2 3.43Å; W758-H934 VanDerWaalsContact CH2-CD2 3.43Å; W758-H934 WeakPolarHBondContact CH2-CD2 3.4Å; W758-H934 AromaticContact CH2-CG 3.55Å; W758-H934 AromaticContact CH2-ND1 3.99Å; W758-H934 HydrophobicContact CZ3-CB 3.5Å; W758-H934 AromaticContact CZ3-CD2 3.71Å; W758-H934 AromaticContact CZ3-CG 3.32Å; W758-H934 AromaticContact CZ3-ND1 3.8Å
759	Q	86.2	Confident	70	Confident	113 Å²	113	112.8 Å²	112.8	53%	0.528	55%	0.546	S	S	.	.			trans	-59.8	-30.6	174.9	-88.8	171.8	78.8	0	0	114	R756 W927	R756-Q759 VanDerWaalsContact O-CG 3.31Å; R756-Q759 WeakPolarHBondContact O-CG 3.45Å; R756-Q759 PolarHBondContact O-NE2 2.9Å; Q759-W927 HydrophobicContact CG-CD2 4.46Å; Q759-W927 HydrophobicContact CG-CZ2 4Å
760	Q	84.4	Confident	67.9	Low	136 Å²	136	119.3 Å²	119.3	64%	0.636	58%	0.577	S	S	*	*	S	Bend	trans	-100.3	141.5	179.3	-64	-62.3	-51.5	0	0	110.7	W758 N930	W758-Q760 PolarHBondContact O-N 2.91Å; Q760-N930 VanDerWaalsContact C-ND2 3.34Å; Q760-N930 PolarHBondContact O-ND2 2.98Å
761	P	83.3	Confident	66.1	Low	71 Å²	71	118.6 Å²	118.6	46%	0.461	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-56.5	145.1	168.8	-23.8	34.3	0	0	0	111.3
762	W	85.3	Confident	64.5	Low	96 Å²	96	119.1 Å²	119.1	36%	0.364	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-64.6	143.3	172.7	-177.1	-120.5	0	0	0	109.7	H764 D933 H934	W762-H764 AromaticContact CD1-NE2 3.96Å; W762-D933 WeakPolarHBondContact CB-OD2 3.42Å; W762-H934 HydrophobicContact CB-CB 4.2Å; W762-H934 AromaticContact CD1-CE1 3.56Å; W762-H934 HydrophobicContact CD2-CB 4.18Å; W762-H934 AromaticContact CD2-CE1 2.24Å; W762-H934 AromaticContact CD2-ND1 3.23Å; W762-H934 AromaticContact CE2-CE1 2.38Å; W762-H934 AromaticContact CE2-ND1 3.32Å; W762-H934 VanDerWaalsContact CE2-ND1 3.32Å; W762-H934 AromaticContact CE2-NE2 3.94Å; W762-H934 HydrophobicContact CE3-CB 4.46Å; W762-H934 AromaticContact CE3-CE1 2.36Å; W762-H934 AromaticContact CE3-ND1 3.2Å; W762-H934 HydrophobicContact CG-CB 4.06Å; W762-H934 AromaticContact CG-CE1 3.11Å; W762-H934 AromaticContact CG-ND1 3.99Å; W762-H934 AromaticContact CH2-CE1 2.79Å; W762-H934 WeakPolarHBondContact CH2-CE1 3.19Å; W762-H934 AromaticContact CH2-ND1 3.42Å; W762-H934 WeakPolarHBondContact CH2-ND1 3.47Å; W762-H934 AromaticContact CH2-NE2 2.92Å; W762-H934 WeakPolarHBondContact CH2-NE2 3.43Å; W762-H934 AromaticContact CZ2-CE1 2.67Å; W762-H934 WeakPolarHBondContact CZ2-CE1 3.36Å; W762-H934 AromaticContact CZ2-ND1 3.42Å; W762-H934 WeakPolarHBondContact CZ2-ND1 3.35Å; W762-H934 AromaticContact CZ2-NE2 3.22Å; W762-H934 WeakPolarHBondContact CZ2-NE2 3.44Å; W762-H934 AromaticContact CZ3-CE1 2.64Å; W762-H934 WeakPolarHBondContact CZ3-CE1 3.4Å; W762-H934 AromaticContact CZ3-ND1 3.3Å; W762-H934 VanDerWaalsContact CZ3-ND1 3.3Å; W762-H934 WeakPolarHBondContact CZ3-ND1 3.26Å; W762-H934 AromaticContact CZ3-NE2 3.45Å; W762-H934 WeakPolarHBondContact CZ3-NE2 3.48Å; W762-H934 AromaticContact NE1-CE1 3.2Å; W762-H934 PolarHBondContact NE1-CE1 2.89Å
763	K	80	Confident	62.1	Low	142 Å²	142	124.4 Å²	124.4	62%	0.617	62%	0.62	S	S	*	*			trans	-118.9	105.9	-177.5	-68.4	-178.4	-175.7	174.2	0	108.7	F765	K763-F765 PolarHBondContact O-N 2.8Å
764	H	58.9	Low	59.6	Low	125 Å²	125	125.2 Å²	125.2	58%	0.579	63%	0.627	S	S	*	*			trans	-58.8	107.1	168	-74.7	-100.4	0	0	0	109.1	W762 D766	W762-H764 AromaticContact CD1-NE2 3.96Å; H764-D766 PolarHBondContact O-N 2.67Å
765	F	45.6	Very low	57	Low	195 Å²	195	128.1 Å²	128.1	86%	0.855	65%	0.652	S	S	*	*			trans	-75.9	80.7	169.4	-99.5	-87	0	0	0	108.9	K763 R767	K763-F765 PolarHBondContact O-N 2.8Å; F765-R767 PolarHBondContact O-N 3.33Å
766	D	38.1	Very low	54.4	Low	148 Å²	148	139.3 Å²	139.3	79%	0.791	69%	0.694	S	S	*	*			trans	-60.9	89.4	163.1	-97.2	-38.8	0	0	0	108.8	H764 P768	H764-D766 PolarHBondContact O-N 2.67Å; D766-P768 WeakPolarHBondContact O-CD 3.21Å; D766-P768 VanDerWaalsContact O-N 3.11Å
767	R	28.3	Very low	51.6	Low	224 Å²	224	136.5 Å²	136.5	85%	0.845	71%	0.705	S	S	*	*			trans	-59.1	114.2	172.1	-174.6	-177.5	-171	-166	4.1	107.2	F765 R769	F765-R767 PolarHBondContact O-N 3.33Å; R767-R769 PolarHBondContact O-N 3.28Å
768	P	33.6	Very low	48.9	Very low	122 Å²	122	135.4 Å²	135.4	79%	0.792	71%	0.709	S	S	*	*			trans	-60.4	112.6	-172.7	-26.1	36.2	0	0	0	110.6	D766 L770	D766-P768 WeakPolarHBondContact O-CD 3.21Å; D766-P768 VanDerWaalsContact O-N 3.11Å; P768-L770 PolarHBondContact O-N 3.25Å
769	R	33.4	Very low	46.1	Very low	240 Å²	240	140.5 Å²	140.5	91%	0.906	74%	0.74	S	S	*	*			trans	-67.6	113.2	167.1	-62.5	-179.4	-170	-108.3	2	105.9	R767 G771	R767-R769 PolarHBondContact O-N 3.28Å; R769-G771 PolarHBondContact O-N 3.37Å
770	L	38	Very low	43.3	Very low	177 Å²	177	141.8 Å²	141.8	93%	0.927	76%	0.755	S	S	*	*			trans	-70.1	79.4	179.4	-173	63.9	0	0	0	110	P768	P768-L770 PolarHBondContact O-N 3.25Å
771	G	28.4	Very low	40.6	Very low	57 Å²	57	139.3 Å²	139.3	59%	0.588	76%	0.758	S	S	*	*			trans	-76.6	140.2	173.4	0	0	0	0	0	111	R769 D773	R769-G771 PolarHBondContact O-N 3.37Å; G771-D773 PolarHBondContact O-N 3.02Å; G771-D773 VanDerWaalsContact O-N 3.14Å
772	S	39.3	Very low	38.1	Very low	129 Å²	129	141.7 Å²	141.7	90%	0.902	77%	0.774	S	S	*	*			trans	-71.4	104.1	-175.1	-53.2	0	0	0	0	112.8	S774	S772-S774 PolarHBondContact O-N 2.96Å
773	D	28.5	Very low	35.2	Very low	163 Å²	163	142.4 Å²	142.4	87%	0.872	79%	0.793	S	S	*	*			trans	-84.6	103.2	175.3	-110.7	-34.3	0	0	0	113.2	G771	G771-D773 PolarHBondContact O-N 3.02Å; G771-D773 VanDerWaalsContact O-N 3.14Å
774	S	30.5	Very low	33.3	Very low	104 Å²	104	140.7 Å²	140.7	73%	0.727	80%	0.797	S	S	*	*			trans	10.1	107.4	149.9	-163.7	0	0	0	0	118.8	S772 R776	S772-S774 PolarHBondContact O-N 2.96Å; S774-R776 PolarHBondContact O-N 3.02Å
775	C	29.7	Very low	31.7	Very low	136 Å²	136	141.5 Å²	141.5	92%	0.919	81%	0.805	S	S	*	*			trans	-68	118.6	169.3	-61.2	0	0	0	0	112.6
776	R	31.2	Very low	31.1	Very low	236 Å²	236	138.1 Å²	138.1	89%	0.891	80%	0.8	S	S	*	*			trans	-138.1	86.9	159.1	-173.6	178.4	-67.9	-95.1	-0.6	110.7	S774	S774-R776 PolarHBondContact O-N 3.02Å
777	G	26.5	Very low	30.9	Very low	70 Å²	70	136.3 Å²	136.3	72%	0.722	80%	0.796	S	S	*	*			trans	-91.1	172.6	-179.2	0	0	0	0	0	114.4
778	S	30.7	Very low	30.8	Very low	114 Å²	114	133.3 Å²	133.3	80%	0.797	80%	0.797	S	S	*	*			trans	-163.6	113.5	149.1	-81.5	0	0	0	0	111.4
779	N	28.5	Very low	30.8	Very low	152 Å²	152	136.4 Å²	136.4	81%	0.813	80%	0.801	S	S	*	*			trans	20.5	122.7	147.2	-48.8	-18	0	0	0	119.5
780	T	27.1	Very low	30.6	Very low	140 Å²	140	128.9 Å²	128.9	86%	0.859	78%	0.779	S	S	*	*				-167.4	138.5	110.4	-71.7	0	0	0	0	109.6
781	A	27.1	Very low	30.5	Very low	84 Å²	84	129.3 Å²	129.3	69%	0.694	78%	0.778	S	S	*	*			trans	-121.2	153.1	165.5	0	0	0	0	0	108.1
782	P	31	Very low	31	Very low	122 Å²	122	131 Å²	131	79%	0.792	78%	0.781	S	S	*	*				-142.7	149.6	85.4	38.7	-24.2	0	0	0	115.8
783	S	24.6	Very low	31	Very low	110 Å²	110	133 Å²	133	77%	0.769	77%	0.769	S	S	*	*			trans	-73.9	178.3	158.5	-19	0	0	0	0	110.2
784	P	41.2	Very low	31.5	Very low	107 Å²	107	127.9 Å²	127.9	70%	0.695	76%	0.755	S	S	*	*			cis	-140.3	172.1	24.5	35.5	-12.9	0	0	0	117.2
785	L	24.8	Very low	31.9	Very low	142 Å²	142	130.9 Å²	130.9	74%	0.743	76%	0.757	S	S	*	*				172.9	88	108.8	-87.7	178.6	0	0	0	114.7
786	T	31.8	Very low	32.6	Very low	123 Å²	123	129.6 Å²	129.6	76%	0.755	74%	0.74	S	S	*	*			trans	66.8	176.7	139.3	72.5	0	0	0	0	116.8
787	P	35.8	Very low	33.1	Very low	110 Å²	110	124.4 Å²	124.4	71%	0.714	73%	0.729	S	S	*	*				-143.2	138.8	-103.5	36.2	-13.4	0	0	0	117
788	D	25.4	Very low	33.6	Very low	162 Å²	162	128.1 Å²	128.1	87%	0.866	73%	0.73	S	S	*	*			trans	-157.3	166.9	148.4	-126.8	-39.5	0	0	0	113.8
789	E	32.5	Very low	34.1	Very low	186 Å²	186	126.5 Å²	126.5	87%	0.869	72%	0.718	S	S	*	*			trans	65.7	117.9	171.8	-47.3	-145.7	139.1	0	0	118.7
790	D	30.6	Very low	34.7	Very low	83 Å²	83	122.5 Å²	122.5	44%	0.444	70%	0.697	S	S	.	*			trans	-150.1	69.8	175.9	-176.2	17.6	0	0	0	110.8	R793	D790-R793 WeakPolarHBondContact OD2-CD 3.4Å; D790-R793 IonicContact OD2-CZ 3.69Å; D790-R793 IonicContact OD2-NE 3.99Å; D790-R793 IonicContact OD2-NH1 3.58Å; D790-R793 PolarHBondContact OD2-NH1 3.24Å
791	M	35.6	Very low	35.4	Very low	186 Å²	186	118.1 Å²	118.1	92%	0.916	68%	0.675	S	S	*	*			trans	-97.3	21.9	178	-117.8	-52.3	110.4	0	0	114.2
792	S	39.3	Very low	36.1	Very low	91 Å²	91	120.4 Å²	120.4	64%	0.636	68%	0.675	S	S	*	*			trans	-113.7	28.2	-176.8	51.6	0	0	0	0	113.2
793	R	38.9	Very low	36.8	Very low	172 Å²	172	118.9 Å²	118.9	65%	0.649	66%	0.657	S	S	*	*			trans	-108.8	-8.3	-167.4	-144.2	169.3	-174.5	127.9	1.1	116.1	D790	D790-R793 WeakPolarHBondContact OD2-CD 3.4Å; D790-R793 IonicContact OD2-CZ 3.69Å; D790-R793 IonicContact OD2-NE 3.99Å; D790-R793 IonicContact OD2-NH1 3.58Å; D790-R793 PolarHBondContact OD2-NH1 3.24Å
794	G	38	Very low	37.5	Very low	56 Å²	56	120 Å²	120	58%	0.577	65%	0.648	S	S	*	*	S	Bend	trans	-74.1	-56.3	-178.5	0	0	0	0	0	114.2	I796 L797	G794-I796 VanDerWaalsContact C-N 3.32Å; G794-I796 PolarHBondContact O-N 3.35Å; G794-L797 PolarHBondContact O-N 3.14Å
795	E	39	Very low	37.5	Very low	166 Å²	166	120.9 Å²	120.9	78%	0.776	65%	0.646	S	S	*	*	H	α-helix	trans	-65	-33.3	-170.6	-58.8	-172.2	112.1	0	0	113.9	L797 M798 S799	E795-L797 PolarHBondContact O-N 2.93Å; E795-M798 PolarHBondContact O-N 3.45Å; E795-S799 PolarHBondContact O-N 2.93Å; E795-S799 VanDerWaalsContact O-N 3.13Å; E795-S799 PolarHBondContact O-OG 3.13Å; E795-S799 VanDerWaalsContact O-OG 3.06Å
796	I	44.7	Very low	38.2	Very low	109 Å²	109	117.3 Å²	117.3	56%	0.559	63%	0.633	S	S	*	*	H	α-helix	trans	-65	-30	-178.4	-59.4	177.2	0	0	0	110.9	G794 N800	G794-I796 VanDerWaalsContact C-N 3.32Å; G794-I796 PolarHBondContact O-N 3.35Å; I796-N800 WeakPolarHBondContact O-CB 3.22Å; I796-N800 PolarHBondContact O-N 3.43Å; I796-N800 PolarHBondContact O-ND2 3.11Å
797	L	41.8	Very low	38.7	Very low	127 Å²	127	118 Å²	118	67%	0.665	62%	0.622	S	S	*	*	H	α-helix	trans	-74.4	-43.7	176.6	-81.8	166.7	0	0	0	112.6	G794 E795 N800 A801	G794-L797 PolarHBondContact O-N 3.14Å; E795-L797 PolarHBondContact O-N 2.93Å; L797-N800 PolarHBondContact O-N 3.19Å; L797-A801 WeakPolarHBondContact O-CB 3.41Å; L797-A801 PolarHBondContact O-N 3.24Å
798	M	38	Very low	39	Very low	149 Å²	149	115.7 Å²	115.7	73%	0.734	61%	0.612	S	S	*	*	H	α-helix	trans	-60.6	-47.1	176.9	-72.5	-63.2	-162.1	0	0	111.4	E795 N800 A801 L802	E795-M798 PolarHBondContact O-N 3.45Å; M798-N800 VanDerWaalsContact C-N 3.35Å; M798-N800 PolarHBondContact O-N 2.81Å; M798-A801 PolarHBondContact O-N 3.08Å; M798-A801 VanDerWaalsContact O-N 3.15Å; M798-L802 PolarHBondContact O-N 2.97Å; M798-L802 VanDerWaalsContact O-N 3.07Å
799	S	39.7	Very low	39.6	Very low	79 Å²	79	111.3 Å²	111.3	55%	0.552	60%	0.598	S	S	*	*	H	α-helix	trans	-57.4	-46.6	176.9	-58	0	0	0	0	111.9	E795 A801 E803	E795-S799 PolarHBondContact O-N 2.93Å; E795-S799 VanDerWaalsContact O-N 3.13Å; E795-S799 PolarHBondContact O-OG 3.13Å; E795-S799 VanDerWaalsContact O-OG 3.06Å; S799-A801 VanDerWaalsContact C-N 3.35Å; S799-A801 PolarHBondContact O-N 3.05Å; S799-E803 WeakPolarHBondContact O-CB 3.45Å; S799-E803 PolarHBondContact O-N 3.18Å; S799-E803 VanDerWaalsContact O-N 3.13Å
800	N	41.5	Very low	40.1	Very low	68 Å²	68	107 Å²	107	36%	0.364	59%	0.585	S	S	.	*	H	α-helix	trans	-68.8	-27.7	177.8	-90.4	-91.8	0	0	0	113.9	I796 L797 M798 K804	I796-N800 WeakPolarHBondContact O-CB 3.22Å; I796-N800 PolarHBondContact O-N 3.43Å; I796-N800 PolarHBondContact O-ND2 3.11Å; L797-N800 PolarHBondContact O-N 3.19Å; M798-N800 VanDerWaalsContact C-N 3.35Å; M798-N800 PolarHBondContact O-N 2.81Å; N800-K804 WeakPolarHBondContact O-CB 3.31Å; N800-K804 VanDerWaalsContact O-CD 3.31Å; N800-K804 WeakPolarHBondContact O-CD 3.4Å; N800-K804 WeakPolarHBondContact O-CG 3.48Å; N800-K804 PolarHBondContact O-N 2.84Å
801	A	41.8	Very low	40.6	Very low	49 Å²	49	105.7 Å²	105.7	41%	0.405	59%	0.585	S	S	.	*	H	α-helix	trans	-72.3	-47.5	176.7	0	0	0	0	0	111	L797 M798 S799 E803 K804 L805	L797-A801 WeakPolarHBondContact O-CB 3.41Å; L797-A801 PolarHBondContact O-N 3.24Å; M798-A801 PolarHBondContact O-N 3.08Å; M798-A801 VanDerWaalsContact O-N 3.15Å; S799-A801 VanDerWaalsContact C-N 3.35Å; S799-A801 PolarHBondContact O-N 3.05Å; A801-E803 VanDerWaalsContact C-N 3.33Å; A801-E803 PolarHBondContact O-N 2.67Å; A801-K804 PolarHBondContact O-N 2.94Å; A801-L805 PolarHBondContact O-N 2.89Å; A801-L805 VanDerWaalsContact O-N 3.11Å
802	L	42.4	Very low	40.7	Very low	132 Å²	132	100.2 Å²	100.2	69%	0.691	57%	0.57	S	S	*	*	H	α-helix	trans	-61.2	-42.3	178.2	-157.7	76.6	0	0	0	111.5	M798 K804 L805 S806	M798-L802 PolarHBondContact O-N 2.97Å; M798-L802 VanDerWaalsContact O-N 3.07Å; L802-K804 PolarHBondContact O-N 3.03Å; L802-L805 PolarHBondContact O-N 2.65Å; L802-S806 PolarHBondContact O-N 2.87Å; L802-S806 VanDerWaalsContact O-N 3.16Å
803	E	44.7	Very low	40.6	Very low	90 Å²	90	99.7 Å²	99.7	42%	0.421	57%	0.571	S	S	.	*	H	α-helix	trans	-72.8	-25	179.4	-146.4	-162.6	176	0	0	113.6	S799 A801 S806 R807	S799-E803 WeakPolarHBondContact O-CB 3.45Å; S799-E803 PolarHBondContact O-N 3.18Å; S799-E803 VanDerWaalsContact O-N 3.13Å; A801-E803 VanDerWaalsContact C-N 3.33Å; A801-E803 PolarHBondContact O-N 2.67Å; E803-S806 PolarHBondContact O-OG 3.28Å; E803-S806 VanDerWaalsContact O-OG 3.12Å; E803-R807 VanDerWaalsContact CD-CZ 3.46Å; E803-R807 WeakPolarHBondContact O-CB 3.44Å; E803-R807 WeakPolarHBondContact O-CD 3.49Å; E803-R807 WeakPolarHBondContact O-CG 3.48Å; E803-R807 PolarHBondContact O-N 3.17Å; E803-R807 IonicContact OE1-CZ 2.65Å; E803-R807 IonicContact OE1-NE 2.66Å; E803-R807 IonicContact OE1-NH2 3.52Å; E803-R807 PolarHBondContact OE1-NH2 3.24Å; E803-R807 IonicContact OE2-CZ 2.79Å; E803-R807 IonicContact OE2-NH1 3.39Å; E803-R807 IonicContact OE2-NH2 3.95Å; E803-R807 PolarHBondContact OE2-NH2 3.02Å
804	K	39.7	Very low	40.5	Very low	133 Å²	133	95.5 Å²	95.5	58%	0.578	57%	0.568	S	S	*	*	H	α-helix	trans	-74.2	-36.4	171.7	-78	168.9	-172.1	171.2	0	112	N800 A801 L802 A808	N800-K804 WeakPolarHBondContact O-CB 3.31Å; N800-K804 VanDerWaalsContact O-CD 3.31Å; N800-K804 WeakPolarHBondContact O-CD 3.4Å; N800-K804 WeakPolarHBondContact O-CG 3.48Å; N800-K804 PolarHBondContact O-N 2.84Å; A801-K804 PolarHBondContact O-N 2.94Å; L802-K804 PolarHBondContact O-N 3.03Å; K804-A808 WeakPolarHBondContact O-CB 3.21Å; K804-A808 PolarHBondContact O-N 3.04Å
805	L	40.6	Very low	40.3	Very low	125 Å²	125	96.8 Å²	96.8	65%	0.654	57%	0.573	S	S	*	*	H	α-helix	trans	-67	-42.7	176.7	-72.4	167	0	0	0	112	A801 L802 A808 A809	A801-L805 PolarHBondContact O-N 2.89Å; A801-L805 VanDerWaalsContact O-N 3.11Å; L802-L805 PolarHBondContact O-N 2.65Å; L805-A808 PolarHBondContact O-N 3.46Å; L805-A809 PolarHBondContact O-N 2.9Å; L805-A809 VanDerWaalsContact O-N 3.15Å
806	S	40.8	Very low	40.1	Very low	67 Å²	67	93.4 Å²	93.4	47%	0.469	57%	0.573	S	S	.	*	H	α-helix	trans	-64.8	-42.4	177.1	64.7	0	0	0	0	112.6	L802 E803 A809 T810	L802-S806 PolarHBondContact O-N 2.87Å; L802-S806 VanDerWaalsContact O-N 3.16Å; E803-S806 PolarHBondContact O-OG 3.28Å; E803-S806 VanDerWaalsContact O-OG 3.12Å; S806-A809 PolarHBondContact O-N 2.79Å; S806-T810 PolarHBondContact O-N 3.47Å; S806-T810 PolarHBondContact O-OG1 3.37Å
807	R	41.8	Very low	39.6	Very low	139 Å²	139	93.2 Å²	93.2	53%	0.525	58%	0.582	S	S	.	*	H	α-helix	trans	-66.2	-34.3	175.1	-68.4	171.5	-173	173.4	2.3	113	E803 T810 A811	E803-R807 VanDerWaalsContact CD-CZ 3.46Å; E803-R807 WeakPolarHBondContact O-CB 3.44Å; E803-R807 WeakPolarHBondContact O-CD 3.49Å; E803-R807 WeakPolarHBondContact O-CG 3.48Å; E803-R807 PolarHBondContact O-N 3.17Å; E803-R807 IonicContact OE1-CZ 2.65Å; E803-R807 IonicContact OE1-NE 2.66Å; E803-R807 IonicContact OE1-NH2 3.52Å; E803-R807 PolarHBondContact OE1-NH2 3.24Å; E803-R807 IonicContact OE2-CZ 2.79Å; E803-R807 IonicContact OE2-NH1 3.39Å; E803-R807 IonicContact OE2-NH2 3.95Å; E803-R807 PolarHBondContact OE2-NH2 3.02Å; R807-T810 PolarHBondContact O-OG1 3.41Å; R807-T810 VanDerWaalsContact O-OG1 3.08Å; R807-A811 WeakPolarHBondContact O-CB 3.44Å; R807-A811 PolarHBondContact O-N 2.99Å; R807-A811 VanDerWaalsContact O-N 3.08Å
808	A	42.5	Very low	38.9	Very low	60 Å²	60	92.7 Å²	92.7	50%	0.496	59%	0.589	S	S	.	*	H	α-helix	trans	-67.6	-41.4	176.9	0	0	0	0	0	112.2	K804 L805 A811 A812	K804-A808 WeakPolarHBondContact O-CB 3.21Å; K804-A808 PolarHBondContact O-N 3.04Å; L805-A808 PolarHBondContact O-N 3.46Å; A808-A811 PolarHBondContact O-N 2.89Å; A808-A812 PolarHBondContact O-N 2.95Å; A808-A812 VanDerWaalsContact O-N 3.15Å
809	A	38.5	Very low	38.4	Very low	70 Å²	70	90.9 Å²	90.9	58%	0.579	59%	0.591	S	S	*	*	H	α-helix	trans	-63.3	-41.2	177.6	0	0	0	0	0	112.5	L805 S806	L805-A809 PolarHBondContact O-N 2.9Å; L805-A809 VanDerWaalsContact O-N 3.15Å; S806-A809 PolarHBondContact O-N 2.79Å
810	T	42.5	Very low	37.9	Very low	96 Å²	96	92.2 Å²	92.2	59%	0.589	60%	0.6	S	S	*	*	H	α-helix	trans	-71.3	-36.2	176.8	49.4	0	0	0	0	112.7	S806 R807 A812 A813 S814	S806-T810 PolarHBondContact O-N 3.47Å; S806-T810 PolarHBondContact O-OG1 3.37Å; R807-T810 PolarHBondContact O-OG1 3.41Å; R807-T810 VanDerWaalsContact O-OG1 3.08Å; T810-A812 PolarHBondContact O-N 3.44Å; T810-A813 PolarHBondContact O-N 3.47Å; T810-S814 PolarHBondContact O-N 2.76Å; T810-S814 PolarHBondContact O-OG 2.78Å
811	A	40	Very low	37.3	Very low	55 Å²	55	93.8 Å²	93.8	46%	0.455	62%	0.617	S	S	.	*	H	α-helix	trans	-61.9	-41.1	175.7	0	0	0	0	0	112.6	R807 A808 A813 S814 A815	R807-A811 WeakPolarHBondContact O-CB 3.44Å; R807-A811 PolarHBondContact O-N 2.99Å; R807-A811 VanDerWaalsContact O-N 3.08Å; A808-A811 PolarHBondContact O-N 2.89Å; A811-A813 PolarHBondContact O-N 2.99Å; A811-S814 PolarHBondContact O-N 3.15Å; A811-S814 PolarHBondContact O-OG 3.28Å; A811-A815 PolarHBondContact O-N 2.89Å
812	A	38.5	Very low	36.6	Very low	72 Å²	72	96.7 Å²	96.7	60%	0.595	63%	0.634	S	S	*	*	H	α-helix	trans	-61.6	-40.1	178.9	0	0	0	0	0	112.9	A808 T810 S814 A815	A808-A812 PolarHBondContact O-N 2.95Å; A808-A812 VanDerWaalsContact O-N 3.15Å; T810-A812 PolarHBondContact O-N 3.44Å; A812-S814 VanDerWaalsContact C-N 3.33Å; A812-S814 PolarHBondContact O-N 2.85Å; A812-A815 PolarHBondContact O-N 3.29Å
813	A	37.6	Very low	35.8	Very low	80 Å²	80	96.4 Å²	96.4	66%	0.661	64%	0.643	S	S	*	*	H	α-helix	trans	-66.5	-32.9	177.6	0	0	0	0	0	113	T810 A811	T810-A813 PolarHBondContact O-N 3.47Å; A811-A813 PolarHBondContact O-N 2.99Å
814	S	36.5	Very low	34.8	Very low	83 Å²	83	97.3 Å²	97.3	58%	0.58	66%	0.659	S	S	*	*	H	α-helix	trans	-79.2	-14	179.8	57	0	0	0	0	115.3	T810 A811 A812 A816	T810-S814 PolarHBondContact O-N 2.76Å; T810-S814 PolarHBondContact O-OG 2.78Å; A811-S814 PolarHBondContact O-N 3.15Å; A811-S814 PolarHBondContact O-OG 3.28Å; A812-S814 VanDerWaalsContact C-N 3.33Å; A812-S814 PolarHBondContact O-N 2.85Å; S814-A816 VanDerWaalsContact C-N 3.3Å; S814-A816 PolarHBondContact O-N 3.35Å
815	A	34.4	Very low	34.7	Very low	84 Å²	84	96.3 Å²	96.3	69%	0.694	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-9.7	-174.2	0	0	0	0	0	114.8	A811 A812	A811-A815 PolarHBondContact O-N 2.89Å; A812-A815 PolarHBondContact O-N 3.29Å
816	A	34.5	Very low	33.9	Very low	94 Å²	94	99.6 Å²	99.6	78%	0.777	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-12.2	-170	0	0	0	0	0	115.4	S814	S814-A816 VanDerWaalsContact C-N 3.3Å; S814-A816 PolarHBondContact O-N 3.35Å
817	S	33.2	Very low	33.5	Very low	105 Å²	105	101.7 Å²	101.7	73%	0.734	69%	0.688	S	S	*	*	S	Bend	trans	-153	66.3	-167.3	57.7	0	0	0	0	115.6
818	S	28.9	Very low	32.8	Very low	116 Å²	116	99.4 Å²	99.4	81%	0.811	69%	0.693	S	S	*	*			trans	-152.9	112.8	154.9	63.5	0	0	0	0	112.5
819	S	26.3	Very low	31.9	Very low	112 Å²	112	106 Å²	106	78%	0.783	71%	0.711	S	S	*	*			trans	-120	146.2	167	59.3	0	0	0	0	110.6
820	S	29.1	Very low	31.8	Very low	107 Å²	107	110 Å²	110	75%	0.748	72%	0.717	S	S	*	*			trans	64.4	100.8	171	46.3	0	0	0	0	119.3
821	S	29.4	Very low	31	Very low	101 Å²	101	112.1 Å²	112.1	71%	0.706	73%	0.725	S	S	*	*				84.2	98.8	118.9	67.1	0	0	0	0	122.9
822	S	26.3	Very low	30.4	Very low	110 Å²	110	114.9 Å²	114.9	77%	0.769	74%	0.742	S	S	*	*				96	149.2	110	74.8	0	0	0	0	121.8
823	S	25.5	Very low	30	Very low	125 Å²	125	121.4 Å²	121.4	87%	0.874	75%	0.752	S	S	*	*			trans	75.8	146.9	169.5	76.6	0	0	0	0	120.1
824	S	23.4	Very low	29.6	Very low	109 Å²	109	125 Å²	125	76%	0.762	76%	0.759	S	S	*	*			trans	-125.7	175	-179.3	61	0	0	0	0	108.3
825	P	38.4	Very low	29.5	Very low	113 Å²	113	126.4 Å²	126.4	73%	0.734	76%	0.764	S	S	*	*			cis	-133.4	-167	7.5	40.7	-21	0	0	0	115.1
826	F	23.5	Very low	29.3	Very low	193 Å²	193	128 Å²	128	85%	0.846	77%	0.77	S	S	*	*			trans	-38.7	158.2	164.1	-68	-75	0	0	0	115.2
827	P	33.8	Very low	29.1	Very low	112 Å²	112	131.2 Å²	131.2	73%	0.727	77%	0.769	S	S	*	*			cis	-154.7	166	41.2	46.2	-26	0	0	0	121.4
828	S	25.5	Very low	29.1	Very low	91 Å²	91	134.5 Å²	134.5	64%	0.636	77%	0.772	S	S	*	*			trans	44.6	150.7	134.9	73.6	0	0	0	0	125.8
829	F	23.9	Very low	29.1	Very low	199 Å²	199	133.9 Å²	133.9	87%	0.873	77%	0.767	S	S	*	*			trans	99	157.7	147.7	-90.6	-70.5	0	0	0	120.6
830	Q	37.3	Very low	29.2	Very low	152 Å²	152	138.1 Å²	138.1	71%	0.71	77%	0.767	S	S	*	*			trans	-81.1	169.4	-165.1	-144.9	87.1	-4.9	0	0	112.6
831	D	26.1	Very low	29	Very low	141 Å²	141	141.8 Å²	141.8	75%	0.754	77%	0.772	S	S	*	*			trans	62.1	123.5	164.4	-50.5	-31.5	0	0	0	115.9
832	S	27.3	Very low	29.1	Very low	114 Å²	114	145 Å²	145	80%	0.797	77%	0.774	S	S	*	*				-160.9	145.6	63.4	-61.2	0	0	0	0	113.6
833	Y	29.8	Very low	29.2	Very low	209 Å²	209	146 Å²	146	82%	0.82	78%	0.777	S	S	*	*			trans	-71.2	126.9	158.7	175.3	-87.2	0	0	0	109.8
834	I	28.9	Very low	29.2	Very low	156 Å²	156	150.9 Å²	150.9	80%	0.8	78%	0.777	S	S	*	*			trans	-160.8	145.8	152.2	-109.8	156.8	0	0	0	111.2
835	T	34.9	Very low	29.5	Very low	111 Å²	111	151.6 Å²	151.6	68%	0.681	78%	0.777	S	S	*	*			trans	-71.6	142.1	-178	49.6	0	0	0	0	113.8
836	S	28.9	Very low	28.8	Very low	118 Å²	118	155.3 Å²	155.3	83%	0.825	78%	0.777	S	S	*	*			trans	-140.7	116.8	146.9	-169.2	0	0	0	0	109.8
837	E	31.1	Very low	28.9	Very low	161 Å²	161	156.2 Å²	156.2	75%	0.752	78%	0.777	S	S	*	*			trans	-74.3	-179.7	158.7	-61.3	-171.3	128.9	0	0	110
838	H	33.1	Very low	28.8	Very low	175 Å²	175	155.6 Å²	155.6	81%	0.81	77%	0.773	S	S	*	*			trans	85.2	136.6	179	-49.5	-7	0	0	0	116
839	C	29.5	Very low	29.6	Very low	103 Å²	103	155.1 Å²	155.1	70%	0.696	77%	0.774	S	S	*	*			cis	-163.3	149.8	-26.5	-120.4	0	0	0	0	110.1
840	Y	27.1	Very low	29.8	Very low	201 Å²	201	152.2 Å²	152.2	79%	0.788	77%	0.772	S	S	*	*			trans	8	130.4	162.1	-68.8	-93.7	0	0	0	120.9
841	Q	26.5	Very low	29.7	Very low	184 Å²	184	151.9 Å²	151.9	86%	0.86	77%	0.771	S	S	*	*				-146.3	106.9	121.8	-159.9	69.9	-61.9	0	0	112.7
842	K	30.3	Very low	29.9	Very low	169 Å²	169	150.7 Å²	150.7	74%	0.735	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-96	132.2	170.3	-103	-172.9	177.7	178.8	0	110	R844	K842-R844 PolarHBondContact O-N 3.06Å
843	P	27.7	Very low	30.3	Very low	130 Å²	130	154.9 Å²	154.9	84%	0.844	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-65.1	116.8	156	-20.2	33.9	0	0	0	110.6
844	R	27.3	Very low	30	Very low	227 Å²	227	152.3 Å²	152.3	86%	0.857	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-73.3	161.2	156.5	-70.4	180	173.5	177.9	-2.7	108.1	K842	K842-R844 PolarHBondContact O-N 3.06Å
845	T	28.7	Very low	30.2	Very low	125 Å²	125	150.8 Å²	150.8	77%	0.767	76%	0.757	S	S	*	*			cis	-157	171.4	3.4	0	0	0	0	0	106.3
846	Y	24.1	Very low	29.9	Very low	190 Å²	190	152.5 Å²	152.5	75%	0.745	77%	0.766	S	S	*	*				-175.1	141.1	64.9	178.4	-104	0	0	0	110.7	P848	Y846-P848 HydrophobicContact CD1-CG 4.45Å; Y846-P848 HydrophobicContact CE1-CG 3.69Å
847	Y	25.9	Very low	30.5	Very low	212 Å²	212	154.8 Å²	154.8	83%	0.831	76%	0.764	S	S	*	*			trans	-146	127.5	169.3	-124.8	-80.1	0	0	0	107.4	A849	Y847-A849 PolarHBondContact O-N 3.15Å
848	P	30.2	Very low	30.4	Very low	100 Å²	100	154 Å²	154	65%	0.649	77%	0.771	S	S	*	*			trans	-74.3	120.5	163.7	-11.1	27.4	0	0	0	109	Y846	Y846-P848 HydrophobicContact CD1-CG 4.45Å; Y846-P848 HydrophobicContact CE1-CG 3.69Å
849	A	42.2	Very low	30.3	Very low	81 Å²	81	156.4 Å²	156.4	67%	0.669	77%	0.773	S	S	*	*			trans	-134.9	127.4	170	0	0	0	0	0	109.1	Y847	Y847-A849 PolarHBondContact O-N 3.15Å
850	V	28.9	Very low	30.3	Very low	137 Å²	137	160 Å²	160	83%	0.83	78%	0.779	S	S	*	*			trans	-142.6	101.6	166.4	-175.2	0	0	0	0	104
851	E	35.8	Very low	30.5	Very low	146 Å²	146	153.9 Å²	153.9	68%	0.682	78%	0.777	S	S	*	*				71.5	141.2	69.9	-67.1	-153.3	135.3	0	0	112.2
852	Q	30.4	Very low	31	Very low	116 Å²	116	150.4 Å²	150.4	54%	0.542	77%	0.773	S	S	.	*			cis	-172.3	-175.6	5.2	-126.5	-174.6	31.5	0	0	110.8
853	R	34.5	Very low	31.4	Very low	201 Å²	201	151 Å²	151	76%	0.758	78%	0.779	S	S	*	*			trans	80.7	153.3	158.6	-35.8	-163.6	97.6	87	-10.6	116.2
854	L	24.9	Very low	31.8	Very low	156 Å²	156	152 Å²	152	82%	0.817	78%	0.776	S	S	*	*			cis	-135.6	175.3	10.4	-136.4	132.4	0	0	0	113.1
855	V	31.7	Very low	32.5	Very low	124 Å²	124	148.2 Å²	148.2	75%	0.752	77%	0.768	S	S	*	*			trans	-112.9	150	-168.4	170.3	0	0	0	0	111
856	V	30.2	Very low	32.9	Very low	146 Å²	146	148.2 Å²	148.2	89%	0.885	76%	0.763	S	S	*	*			trans	-171.5	160	134.2	141	0	0	0	0	111.6
857	E	40.7	Very low	33.7	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	76%	0.757	S	S	*	*			trans	-106.5	150.7	-162.2	167	-169.7	-176	0	0	113.2
858	T	29.6	Very low	34.4	Very low	145 Å²	145	139.9 Å²	139.9	89%	0.89	75%	0.75	S	S	*	*			trans	-168.5	155.8	139.7	7.9	0	0	0	0	115.6
859	R	30.6	Very low	35	Very low	224 Å²	224	143 Å²	143	85%	0.845	75%	0.749	S	S	*	*			trans	-66.3	150.6	178.5	-70.1	168.1	154.8	168.7	-9.3	114.8
860	Q	29	Very low	34.8	Very low	180 Å²	180	142.8 Å²	142.8	84%	0.841	74%	0.743	S	S	*	*				-167.1	152.3	101.9	-150.9	68.1	-4.3	0	0	110.3
861	G	30.7	Very low	35.3	Very low	72 Å²	72	140.5 Å²	140.5	74%	0.742	73%	0.729	S	S	*	*			trans	-108	172.3	-179.6	0	0	0	0	0	114
862	S	37.7	Very low	35.5	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	73%	0.725	S	S	*	*			trans	-150.4	62.8	-174.5	-179.2	0	0	0	0	114.3	L864	S862-L864 VanDerWaalsContact C-N 3.28Å; S862-L864 PolarHBondContact O-N 3.4Å
863	E	37.9	Very low	35.9	Very low	182 Å²	182	141.4 Å²	141.4	85%	0.85	73%	0.733	S	S	*	*	S	Bend	trans	42.5	-7.5	146.5	-58.1	-174.1	144.2	0	0	123.6
864	L	36.7	Very low	35.9	Very low	150 Å²	150	137 Å²	137	79%	0.785	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-31.2	-170.4	-158.8	75.1	0	0	0	114.2	S862	S862-L864 VanDerWaalsContact C-N 3.28Å; S862-L864 PolarHBondContact O-N 3.4Å
865	E	41.8	Very low	36.8	Very low	147 Å²	147	135.3 Å²	135.3	69%	0.687	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-32	-172.7	-63.5	-160.9	162.5	0	0	114.1	S867 M868	E865-S867 PolarHBondContact O-N 3.42Å; E865-M868 PolarHBondContact O-N 3.25Å; E865-M868 VanDerWaalsContact O-N 3.14Å
866	D	38.2	Very low	37.3	Very low	125 Å²	125	134.8 Å²	134.8	67%	0.668	71%	0.705	S	S	*	*	H	α-helix	trans	-62.1	-30.5	-178.1	-67.5	-43.8	0	0	0	112.4	M868 R869 S870	D866-M868 VanDerWaalsContact C-N 3.25Å; D866-M868 PolarHBondContact O-N 3.07Å; D866-R869 PolarHBondContact O-N 2.87Å; D866-S870 PolarHBondContact O-N 3.12Å
867	S	40.1	Very low	37.5	Very low	88 Å²	88	136.8 Å²	136.8	62%	0.615	70%	0.696	S	S	*	*	H	α-helix	trans	-62.4	-27.5	178.1	-168.2	0	0	0	0	113.6	E865	E865-S867 PolarHBondContact O-N 3.42Å
868	M	41.7	Very low	37.4	Very low	140 Å²	140	135.9 Å²	135.9	69%	0.69	69%	0.692	S	S	*	*	H	α-helix	trans	-86	-28.7	179.4	-62.8	-160.3	-58.5	0	0	113.3	E865 D866 T871	E865-M868 PolarHBondContact O-N 3.25Å; E865-M868 VanDerWaalsContact O-N 3.14Å; D866-M868 VanDerWaalsContact C-N 3.25Å; D866-M868 PolarHBondContact O-N 3.07Å; M868-T871 PolarHBondContact O-OG1 3.48Å
869	R	42.8	Very low	38.1	Very low	165 Å²	165	137.2 Å²	137.2	62%	0.623	69%	0.688	S	S	*	*	H	α-helix	trans	-76.9	-35	176.6	-64	-171.9	-178.2	-76.7	-1.3	112.2	D866 T871 E872 E873	D866-R869 PolarHBondContact O-N 2.87Å; R869-T871 PolarHBondContact O-N 2.93Å; R869-T871 VanDerWaalsContact O-N 3.16Å; R869-E872 WeakPolarHBondContact O-CB 3.2Å; R869-E872 PolarHBondContact O-N 3.22Å; R869-E872 VanDerWaalsContact O-N 3.07Å; R869-E873 PolarHBondContact O-N 3.38Å
870	S	37.3	Very low	38.5	Very low	77 Å²	77	135.1 Å²	135.1	54%	0.538	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.1	-21.6	179.1	-175.7	0	0	0	0	114.5	D866	D866-S870 PolarHBondContact O-N 3.12Å
871	T	39.6	Very low	38.9	Very low	89 Å²	89	135.3 Å²	135.3	55%	0.546	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.8	-22.8	175.7	41.9	0	0	0	0	113.4	M868 R869	M868-T871 PolarHBondContact O-OG1 3.48Å; R869-T871 PolarHBondContact O-N 2.93Å; R869-T871 VanDerWaalsContact O-N 3.16Å
872	E	39.8	Very low	39.1	Very low	127 Å²	127	135.7 Å²	135.7	59%	0.593	68%	0.683	S	S	*	*	H	α-helix	trans	-76.6	-49.9	-179.1	-162.1	166.5	-151.3	0	0	110.4	R869 L874 L875 E876	R869-E872 WeakPolarHBondContact O-CB 3.2Å; R869-E872 PolarHBondContact O-N 3.22Å; R869-E872 VanDerWaalsContact O-N 3.07Å; E872-L874 PolarHBondContact O-N 3.46Å; E872-L875 PolarHBondContact O-N 3.05Å; E872-E876 PolarHBondContact O-N 2.93Å
873	E	38.6	Very low	38.9	Very low	154 Å²	154	135.9 Å²	135.9	72%	0.72	68%	0.684	S	S	*	*	H	α-helix	trans	-62.1	-23.7	175.4	-76.2	-162.9	118.9	0	0	114.3	R869	R869-E873 PolarHBondContact O-N 3.38Å
874	L	34.8	Very low	38.6	Very low	107 Å²	107	134.7 Å²	134.7	56%	0.56	68%	0.683	S	S	*	*	H	α-helix	trans	-75.7	-42.9	179.5	-156.5	158.3	0	0	0	110.7	E872 R877 E878	E872-L874 PolarHBondContact O-N 3.46Å; L874-R877 WeakPolarHBondContact O-CB 3.47Å; L874-R877 PolarHBondContact O-N 2.97Å; L874-R877 VanDerWaalsContact O-N 3.16Å; L874-E878 PolarHBondContact O-N 3.19Å
875	L	44.4	Very low	38.3	Very low	121 Å²	121	135.9 Å²	135.9	63%	0.634	69%	0.689	S	S	*	*	H	α-helix	trans	-67.7	-35.8	177.6	-67.8	170.4	0	0	0	112.5	E872 R877	E872-L875 PolarHBondContact O-N 3.05Å; L875-R877 PolarHBondContact O-N 2.91Å
876	E	41.7	Very low	37.5	Very low	114 Å²	114	136.1 Å²	136.1	53%	0.533	70%	0.695	S	S	.	*	H	α-helix	trans	-66.5	-14.3	173.1	-77	-152.6	174.4	0	0	114.6	E872 R880	E872-E876 PolarHBondContact O-N 2.93Å; E876-R880 PolarHBondContact O-NE 2.89Å; E876-R880 IonicContact OE2-NH2 3.93Å; E876-R880 PolarHBondContact OE2-NH2 3.3Å; E876-R880 VanDerWaalsContact OE2-NH2 3.15Å
877	R	34.6	Very low	37.2	Very low	187 Å²	187	138.3 Å²	138.3	71%	0.706	70%	0.703	S	S	*	*	H	α-helix	trans	-90.4	-40.7	-176.7	-154.5	174.5	-156.8	137.1	6.8	112.4	L874 L875 Q879 R880	L874-R877 WeakPolarHBondContact O-CB 3.47Å; L874-R877 PolarHBondContact O-N 2.97Å; L874-R877 VanDerWaalsContact O-N 3.16Å; L875-R877 PolarHBondContact O-N 2.91Å; R877-Q879 VanDerWaalsContact C-N 3.34Å; R877-Q879 PolarHBondContact O-N 3.21Å; R877-R880 PolarHBondContact O-N 3.37Å
878	E	37.6	Very low	36.5	Very low	148 Å²	148	141.5 Å²	141.5	69%	0.692	71%	0.714	S	S	*	*	H	α-helix	trans	-63.1	-39.9	-178.4	-145.3	67	-154.8	0	0	111.6	L874 R880 F881	L874-E878 PolarHBondContact O-N 3.19Å; E878-R880 PolarHBondContact O-N 2.89Å; E878-F881 PolarHBondContact O-N 2.66Å
879	Q	43.8	Very low	36	Very low	174 Å²	174	145.6 Å²	145.6	81%	0.813	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-11.2	-177.5	-66.3	-172.4	-0.4	0	0	114.7	R877	R877-Q879 VanDerWaalsContact C-N 3.34Å; R877-Q879 PolarHBondContact O-N 3.21Å
880	R	40.1	Very low	35.4	Very low	180 Å²	180	143.7 Å²	143.7	68%	0.679	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-1.4	-175.4	-55.3	-170.6	-148.8	-162	3.1	114.9	E876 R877 E878	E876-R880 PolarHBondContact O-NE 2.89Å; E876-R880 IonicContact OE2-NH2 3.93Å; E876-R880 PolarHBondContact OE2-NH2 3.3Å; E876-R880 VanDerWaalsContact OE2-NH2 3.15Å; R877-R880 PolarHBondContact O-N 3.37Å; E878-R880 PolarHBondContact O-N 2.89Å
881	F	37.1	Very low	34.9	Very low	183 Å²	183	149.7 Å²	149.7	80%	0.803	75%	0.747	S	S	*	*	S	Bend	trans	-107.6	-6.8	-177.7	-90.6	-84	0	0	0	115.9	E878 S883	E878-F881 PolarHBondContact O-N 2.66Å; F881-S883 PolarHBondContact O-N 3.29Å
882	G	35.3	Very low	34.3	Very low	80 Å²	80	150.9 Å²	150.9	83%	0.825	76%	0.759	S	S	*	*	S	Bend	trans	-78.6	-7.6	-176	0	0	0	0	0	117.1
883	S	32.6	Very low	33.6	Very low	115 Å²	115	151 Å²	151	80%	0.804	77%	0.769	S	S	*	*	S	Bend	trans	-115.8	32.5	-163.1	-171	0	0	0	0	115.3	F881	F881-S883 PolarHBondContact O-N 3.29Å
884	L	32.1	Very low	33.1	Very low	157 Å²	157	146.7 Å²	146.7	82%	0.822	77%	0.765	S	S	*	*			trans	-143.5	43.5	-178.4	-158.7	82.2	0	0	0	115.4
885	L	30.9	Very low	32.8	Very low	175 Å²	175	149.2 Å²	149.2	92%	0.916	78%	0.779	S	S	*	*			trans	-150.1	95.8	158.5	-77.9	-175.1	0	0	0	110.6
886	D	25	Very low	31.9	Very low	153 Å²	153	148.2 Å²	148.2	82%	0.818	78%	0.782	S	S	*	*				-163.6	138.9	116.1	-137.5	-28.9	0	0	0	112.5
887	M	30.5	Very low	31.3	Very low	171 Å²	171	150.2 Å²	150.2	84%	0.842	80%	0.796	S	S	*	*			trans	-155.3	97.7	175.2	-86.9	-80.8	95	0	0	108.6
888	D	26.5	Very low	31.1	Very low	155 Å²	155	151 Å²	151	83%	0.829	81%	0.805	S	S	*	*				-165.3	165.9	110.2	-129.1	-37.7	0	0	0	113.6
889	R	30.1	Very low	30.6	Very low	225 Å²	225	148.7 Å²	148.7	85%	0.849	81%	0.811	S	S	*	*			trans	-137.8	112.1	-175.8	-167.3	-174.1	-172.4	-169.7	6.6	113.7
890	P	31.4	Very low	29.9	Very low	126 Å²	126	147.7 Å²	147.7	82%	0.818	81%	0.811	S	S	*	*			trans	-75.7	162.1	161.6	-18	33.6	0	0	0	112.9
891	K	27.3	Very low	29.2	Very low	202 Å²	202	147.3 Å²	147.3	88%	0.878	82%	0.819	S	S	*	*			trans	-143.8	114.6	-155.6	172.3	-171.3	177.3	-178.7	0	113.1
892	S	26.3	Very low	28.6	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	82%	0.819	S	S	*	*			trans	-177.4	158	163.8	-168.9	0	0	0	0	110.2
893	T	25.9	Very low	28.4	Very low	130 Å²	130	145 Å²	145	80%	0.798	82%	0.819	S	S	*	*			cis	-170.2	138.5	-36.1	-71.9	0	0	0	0	106.7
894	G	26.7	Very low	27.9	Very low	62 Å²	62	144.4 Å²	144.4	64%	0.639	82%	0.815	S	S	*	*			trans	91.6	117.9	147.7	0	0	0	0	0	120.8
895	N	28.3	Very low	27.6	Very low	160 Å²	160	146.2 Å²	146.2	86%	0.856	81%	0.811	S	S	*	*			trans	61.1	101.6	134.4	-59.8	14.7	0	0	0	122.3
896	S	25.8	Very low	27.4	Very low	101 Å²	101	146.1 Å²	146.1	71%	0.706	81%	0.81	S	S	*	*				35.4	114.3	114.9	-154.4	0	0	0	0	119.7
897	N	29.3	Very low	27.4	Very low	155 Å²	155	145.7 Å²	145.7	83%	0.829	80%	0.803	S	S	*	*				177.4	169.3	106.3	-88.4	-28.1	0	0	0	114.6
898	K	31.5	Very low	27.3	Very low	203 Å²	203	142.3 Å²	142.3	88%	0.883	80%	0.803	S	S	*	*			trans	-70	146.1	177.2	-48.8	165.4	-178.4	177.3	0	111.9
899	A	27.2	Very low	27.4	Very low	100 Å²	100	143.6 Å²	143.6	83%	0.826	80%	0.804	S	S	*	*				175.5	119.5	119.8	0	0	0	0	0	115
900	L	28	Very low	27.4	Very low	153 Å²	153	138.1 Å²	138.1	80%	0.801	80%	0.8	S	S	*	*			trans	-13.1	145.1	141.7	179.5	61.8	0	0	0	120
901	M	26.4	Very low	27.6	Very low	173 Å²	173	143.5 Å²	143.5	85%	0.852	80%	0.804	S	S	*	*			trans	75.9	136.7	165.4	-71.5	-78.2	178.3	0	0	119.2
902	G	23.9	Very low	28.2	Very low	78 Å²	78	143.4 Å²	143.4	80%	0.804	81%	0.807	S	S	*	*			trans	169.7	62.9	177.7	0	0	0	0	0	115.3
903	V	30	Very low	28.8	Very low	136 Å²	136	145.4 Å²	145.4	82%	0.824	81%	0.808	S	S	*	*			trans	-86.9	121.3	169.8	175.2	0	0	0	0	109.8
904	S	23.5	Very low	29.5	Very low	102 Å²	102	145.2 Å²	145.2	71%	0.713	80%	0.802	S	S	*	*			trans	-174.7	120.6	138.4	-175.6	0	0	0	0	113.3
905	W	25.4	Very low	30.2	Very low	195 Å²	195	144.5 Å²	144.5	74%	0.739	80%	0.795	S	S	*	*			trans	4.2	134.6	140.8	-59.4	77.3	0	0	0	120	H907	W905-H907 AromaticContact CE3-CD2 3.87Å; W905-H907 AromaticContact CZ3-NE2 3.73Å
906	L	26	Very low	31	Very low	174 Å²	174	146.3 Å²	146.3	91%	0.911	79%	0.79	S	S	*	*			trans	-132.2	138.4	130.7	-93.6	176.4	0	0	0	109.7
907	H	24.8	Very low	31.8	Very low	143 Å²	143	148.4 Å²	148.4	66%	0.662	79%	0.793	S	S	*	*			trans	-70.7	148	175.8	-101.6	-117	0	0	0	111.8	W905	W905-H907 AromaticContact CE3-CD2 3.87Å; W905-H907 AromaticContact CZ3-NE2 3.73Å
908	A	28	Very low	32.8	Very low	101 Å²	101	148 Å²	148	84%	0.835	79%	0.79	S	S	*	*			trans	-128.7	103.4	153.3	0	0	0	0	0	107.8
909	E	30.2	Very low	33.7	Very low	182 Å²	182	141.6 Å²	141.6	85%	0.85	78%	0.775	S	S	*	*			trans	-73.2	126.7	175.2	-63.7	-179.9	125.7	0	0	110.1
910	S	30.2	Very low	35.1	Very low	110 Å²	110	140.6 Å²	140.6	77%	0.769	76%	0.756	S	S	*	*			trans	-151.1	87.2	165.6	178.6	0	0	0	0	111.3
911	R	34.2	Very low	36.7	Very low	238 Å²	238	138.2 Å²	138.2	90%	0.898	74%	0.744	S	S	*	*			trans	42.9	108.6	155.4	-74.1	176.4	151.1	-117.7	-6.1	117.4	D913	R911-D913 PolarHBondContact O-N 3.41Å
912	E	41	Very low	39.1	Very low	201 Å²	201	132 Å²	132	94%	0.939	73%	0.725	S	S	*	*			trans	-60.8	126.5	152.5	-58.5	174.7	120.9	0	0	110.1
913	D	39.4	Very low	41.7	Very low	156 Å²	156	133.4 Å²	133.4	83%	0.834	71%	0.71	S	S	*	*			trans	-149.6	160.5	146.2	-155.3	-4.2	0	0	0	107.7	R911	R911-D913 PolarHBondContact O-N 3.41Å
914	D	39.5	Very low	44.2	Very low	126 Å²	126	128.7 Å²	128.7	67%	0.674	68%	0.678	S	S	*	*	S	Bend	trans	-48	130.5	-152.3	-149.8	17.9	0	0	0	116.8	R916	D914-R916 IonicContact OD1-CZ 3.76Å; D914-R916 IonicContact OD1-NE 3.8Å; D914-R916 IonicContact OD1-NH2 2.9Å; D914-R916 PolarHBondContact OD1-NH2 3.28Å
915	G	41.4	Very low	47	Very low	48 Å²	48	128.1 Å²	128.1	50%	0.495	66%	0.664	S	S	.	*			trans	-161.4	25.5	-169.4	0	0	0	0	0	116.8
916	R	44.3	Very low	50	Low	197 Å²	197	123 Å²	123	74%	0.743	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-36.4	-177.1	-92.2	169.1	-76.1	-112.8	-12.6	114.4	D914 L918 A919	D914-R916 IonicContact OD1-CZ 3.76Å; D914-R916 IonicContact OD1-NE 3.8Å; D914-R916 IonicContact OD1-NH2 2.9Å; D914-R916 PolarHBondContact OD1-NH2 3.28Å; R916-L918 VanDerWaalsContact C-N 3.25Å; R916-L918 PolarHBondContact O-N 3.27Å; R916-A919 PolarHBondContact O-N 3.45Å
917	D	44.6	Very low	53	Low	146 Å²	146	115.6 Å²	115.6	78%	0.781	61%	0.608	S	S	*	*	H	α-helix	trans	-69.1	-20	-173.4	-60.1	-13.6	0	0	0	114
918	L	48.5	Very low	55.9	Low	145 Å²	145	110.4 Å²	110.4	76%	0.759	59%	0.585	S	S	*	*	H	α-helix	trans	-77.4	-25.8	-179.1	-93.7	154.5	0	0	0	113.5	R916	R916-L918 VanDerWaalsContact C-N 3.25Å; R916-L918 PolarHBondContact O-N 3.27Å
919	A	51.3	Low	58.8	Low	69 Å²	69	109.5 Å²	109.5	57%	0.57	57%	0.565	S	S	*	*	H	α-helix	trans	-78.8	-38.8	179.6	0	0	0	0	0	112.3	R916 G922	R916-A919 PolarHBondContact O-N 3.45Å; A919-G922 PolarHBondContact O-N 3.44Å
920	D	56	Low	61.7	Low	80 Å²	80	101 Å²	101	43%	0.428	53%	0.526	S	S	.	.	H	α-helix	trans	-67.7	-45.2	-178.4	-167.3	37.4	0	0	0	111.4	G922 Q923 Y924	D920-G922 PolarHBondContact O-N 2.76Å; D920-G922 VanDerWaalsContact O-N 3.12Å; D920-Q923 WeakPolarHBondContact O-CB 3.29Å; D920-Q923 PolarHBondContact O-N 3.11Å; D920-Y924 WeakPolarHBondContact O-CD2 3.48Å; D920-Y924 PolarHBondContact O-N 3.29Å; D920-Y924 VanDerWaalsContact O-N 3.12Å; D920-Y924 WeakPolarHBondContact OD1-CE2 3.27Å
921	N	62.7	Low	64.5	Low	102 Å²	102	95.8 Å²	95.8	55%	0.545	49%	0.489	S	S	.	.	H	α-helix	trans	-57	-31.7	177.8	-165.8	35.5	0	0	0	112.9	Q925	N921-Q925 WeakPolarHBondContact O-CB 3.18Å; N921-Q925 PolarHBondContact O-N 3.24Å
922	G	75.3	Confident	67.1	Low	44 Å²	44	88.8 Å²	88.8	45%	0.454	47%	0.469	S	S	.	.	H	α-helix	trans	-65.5	-34.7	173.7	0	0	0	0	0	113.8	A919 D920 Q926	A919-G922 PolarHBondContact O-N 3.44Å; D920-G922 PolarHBondContact O-N 2.76Å; D920-G922 VanDerWaalsContact O-N 3.12Å; G922-Q926 PolarHBondContact O-N 3.15Å; G922-Q926 VanDerWaalsContact O-N 3.07Å
923	Q	79.5	Confident	69.5	Low	106 Å²	106	82.7 Å²	82.7	50%	0.495	44%	0.442	S	S	.	.	H	α-helix	trans	-72.9	-46.1	175.5	-57.5	-169.9	19	0	0	111	D920 Q925 Q926 W927	D920-Q923 WeakPolarHBondContact O-CB 3.29Å; D920-Q923 PolarHBondContact O-N 3.11Å; Q923-Q925 VanDerWaalsContact C-N 3.25Å; Q923-Q925 PolarHBondContact O-N 3.33Å; Q923-Q926 PolarHBondContact O-N 2.92Å; Q923-Q926 VanDerWaalsContact O-N 3.07Å; Q923-W927 HydrophobicContact CB-CH2 4.32Å; Q923-W927 HydrophobicContact CB-CZ2 3.75Å; Q923-W927 PolarHBondContact O-N 3.46Å; Q923-W927 PolarHBondContact O-NE1 2.82Å
924	Y	82	Confident	71.8	Confident	37 Å²	37	76.3 Å²	76.3	15%	0.145	41%	0.408	C	S	.	.	H	α-helix	trans	-56.5	-39.4	173.6	-83.7	-100.5	0	0	0	112	L755 R756 D920 W927 Q928	L755-Y924 HydrophobicContact CD2-CD1 3.95Å; R756-Y924 PolarHBondContact NE-OH 3.19Å; R756-Y924 PolarHBondContact NH2-OH 3.37Å; D920-Y924 WeakPolarHBondContact O-CD2 3.48Å; D920-Y924 PolarHBondContact O-N 3.29Å; D920-Y924 VanDerWaalsContact O-N 3.12Å; D920-Y924 WeakPolarHBondContact OD1-CE2 3.27Å; Y924-W927 HydrophobicContact CD1-CE3 4.15Å; Y924-W927 AromaticContact CD1-CZ3 3.96Å; Y924-W927 HydrophobicContact CD1-CZ3 3.96Å; Y924-W927 HydrophobicContact CD2-CE3 4.33Å; Y924-W927 HydrophobicContact CD2-CH2 4.1Å; Y924-W927 AromaticContact CD2-CZ3 3.67Å; Y924-W927 HydrophobicContact CD2-CZ3 3.67Å; Y924-W927 HydrophobicContact CE1-CE3 4.41Å; Y924-W927 AromaticContact CE1-CZ3 3.87Å; Y924-W927 HydrophobicContact CE1-CZ3 3.87Å; Y924-W927 AromaticContact CE2-CH2 3.94Å; Y924-W927 HydrophobicContact CE2-CH2 3.94Å; Y924-W927 AromaticContact CE2-CZ3 3.58Å; Y924-W927 HydrophobicContact CE2-CZ3 3.58Å; Y924-W927 HydrophobicContact CG-CE3 4.1Å; Y924-W927 AromaticContact CG-CZ3 3.85Å; Y924-W927 HydrophobicContact CG-CZ3 3.85Å; Y924-W927 AromaticContact CZ-CZ3 3.68Å; Y924-W927 PolarHBondContact O-N 2.88Å; Y924-Q928 WeakPolarHBondContact O-CG 3.36Å; Y924-Q928 PolarHBondContact O-N 3.32Å; Y924-Q928 VanDerWaalsContact O-N 3.15Å
925	Q	83.8	Confident	74.2	Confident	90 Å²	90	70.5 Å²	70.5	42%	0.421	38%	0.376	S	S	.	.	H	α-helix	trans	-66.7	-40.8	174.8	-160.4	64.8	58.4	0	0	112.4	N921 Q923 W927 Q928 I929	N921-Q925 WeakPolarHBondContact O-CB 3.18Å; N921-Q925 PolarHBondContact O-N 3.24Å; Q923-Q925 VanDerWaalsContact C-N 3.25Å; Q923-Q925 PolarHBondContact O-N 3.33Å; Q925-W927 VanDerWaalsContact C-N 3.33Å; Q925-W927 PolarHBondContact O-N 3.37Å; Q925-Q928 WeakPolarHBondContact O-CB 3.41Å; Q925-Q928 PolarHBondContact O-N 2.88Å; Q925-I929 WeakPolarHBondContact O-CG1 3.3Å; Q925-I929 PolarHBondContact O-N 3.21Å
926	Q	87.1	Confident	76.4	Confident	89 Å²	89	70.9 Å²	70.9	42%	0.416	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-37.5	175.7	-174	62	59.7	0	0	112.1	G922 Q923 I929 N930	G922-Q926 PolarHBondContact O-N 3.15Å; G922-Q926 VanDerWaalsContact O-N 3.07Å; Q923-Q926 PolarHBondContact O-N 2.92Å; Q923-Q926 VanDerWaalsContact O-N 3.07Å; Q926-I929 PolarHBondContact O-N 2.99Å; Q926-N930 PolarHBondContact NE2-OD1 3.35Å; Q926-N930 PolarHBondContact O-N 3.13Å; Q926-N930 PolarHBondContact O-ND2 2.83Å; Q926-N930 PolarHBondContact O-OD1 3.33Å
927	W	88.9	Confident	78.5	Confident	17 Å²	17	62.2 Å²	62.2	6%	0.064	34%	0.338	C	S	.	.	H	α-helix	trans	-68.5	-35.1	177	-53.4	-18.9	0	0	0	112.1	L755 R756 W758 Q759 Q923 Y924 Q925 N930 L931	L755-W927 HydrophobicContact CD1-CB 4.1Å; L755-W927 HydrophobicContact CD2-CB 4.47Å; L755-W927 HydrophobicContact CD2-CE3 4.46Å; L755-W927 HydrophobicContact CG-CB 3.83Å; L755-W927 HydrophobicContact CG-CE3 4.25Å; R756-W927 HydrophobicContact CB-CZ3 4.42Å; R756-W927 HydrophobicContact CG-CE3 3.98Å; R756-W927 HydrophobicContact CG-CH2 3.81Å; R756-W927 HydrophobicContact CG-CZ3 3.41Å; R756-W927 VanDerWaalsContact CG-CZ3 3.41Å; W758-W927 HydrophobicContact CB-CB 4.41Å; Q759-W927 HydrophobicContact CG-CD2 4.46Å; Q759-W927 HydrophobicContact CG-CZ2 4Å; Q923-W927 HydrophobicContact CB-CH2 4.32Å; Q923-W927 HydrophobicContact CB-CZ2 3.75Å; Q923-W927 PolarHBondContact O-N 3.46Å; Q923-W927 PolarHBondContact O-NE1 2.82Å; Y924-W927 HydrophobicContact CD1-CE3 4.15Å; Y924-W927 AromaticContact CD1-CZ3 3.96Å; Y924-W927 HydrophobicContact CD1-CZ3 3.96Å; Y924-W927 HydrophobicContact CD2-CE3 4.33Å; Y924-W927 HydrophobicContact CD2-CH2 4.1Å; Y924-W927 AromaticContact CD2-CZ3 3.67Å; Y924-W927 HydrophobicContact CD2-CZ3 3.67Å; Y924-W927 HydrophobicContact CE1-CE3 4.41Å; Y924-W927 AromaticContact CE1-CZ3 3.87Å; Y924-W927 HydrophobicContact CE1-CZ3 3.87Å; Y924-W927 AromaticContact CE2-CH2 3.94Å; Y924-W927 HydrophobicContact CE2-CH2 3.94Å; Y924-W927 AromaticContact CE2-CZ3 3.58Å; Y924-W927 HydrophobicContact CE2-CZ3 3.58Å; Y924-W927 HydrophobicContact CG-CE3 4.1Å; Y924-W927 AromaticContact CG-CZ3 3.85Å; Y924-W927 HydrophobicContact CG-CZ3 3.85Å; Y924-W927 AromaticContact CZ-CZ3 3.68Å; Y924-W927 PolarHBondContact O-N 2.88Å; Q925-W927 VanDerWaalsContact C-N 3.33Å; Q925-W927 PolarHBondContact O-N 3.37Å; W927-N930 PolarHBondContact O-N 2.81Å; W927-L931 VanDerWaalsContact O-CB 3.29Å; W927-L931 WeakPolarHBondContact O-CB 3.32Å; W927-L931 PolarHBondContact O-N 2.73Å
928	Q	86.8	Confident	80.6	Confident	34 Å²	34	55.8 Å²	55.8	16%	0.159	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-42.6	170.7	-69.5	168.3	24.1	0	0	111.3	L747 L755 Y924 Q925 L931 L932	L747-Q928 HydrophobicContact CD2-CB 4.06Å; L747-Q928 HydrophobicContact CD2-CG 4.17Å; L755-Q928 HydrophobicContact CD1-CG 4.07Å; L755-Q928 HydrophobicContact CD2-CG 3.96Å; Y924-Q928 WeakPolarHBondContact O-CG 3.36Å; Y924-Q928 PolarHBondContact O-N 3.32Å; Y924-Q928 VanDerWaalsContact O-N 3.15Å; Q925-Q928 WeakPolarHBondContact O-CB 3.41Å; Q925-Q928 PolarHBondContact O-N 2.88Å; Q928-L931 PolarHBondContact O-N 3.22Å; Q928-L932 WeakPolarHBondContact O-CB 3.12Å; Q928-L932 VanDerWaalsContact O-CG 3.3Å; Q928-L932 WeakPolarHBondContact O-CG 3.44Å; Q928-L932 PolarHBondContact O-N 2.67Å
929	I	88.7	Confident	82.4	Confident	83 Å²	83	49.5 Å²	49.5	43%	0.426	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-47.4	176.6	-67.2	164	0	0	0	110.8	Q925 Q926 L931 L932 D933	Q925-I929 WeakPolarHBondContact O-CG1 3.3Å; Q925-I929 PolarHBondContact O-N 3.21Å; Q926-I929 PolarHBondContact O-N 2.99Å; I929-L931 VanDerWaalsContact C-N 3.28Å; I929-L931 PolarHBondContact O-N 3.14Å; I929-L932 PolarHBondContact O-N 2.98Å; I929-D933 WeakPolarHBondContact O-CB 3.35Å; I929-D933 PolarHBondContact O-N 2.9Å
930	N	90.3	Very high	84.1	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-34.8	178.2	-63.5	-13.6	0	0	0	112.5	W758 Q760 Q926 W927 H934	W758-N930 HydrophobicContact CB-CB 4.28Å; W758-N930 WeakPolarHBondContact O-CB 3.3Å; W758-N930 PolarHBondContact O-ND2 2.92Å; Q760-N930 VanDerWaalsContact C-ND2 3.34Å; Q760-N930 PolarHBondContact O-ND2 2.98Å; Q926-N930 PolarHBondContact NE2-OD1 3.35Å; Q926-N930 PolarHBondContact O-N 3.13Å; Q926-N930 PolarHBondContact O-ND2 2.83Å; Q926-N930 PolarHBondContact O-OD1 3.33Å; W927-N930 PolarHBondContact O-N 2.81Å; N930-H934 PolarHBondContact O-N 2.98Å
931	L	89.1	Confident	85.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-74.2	-37.6	175.4	177	50.4	0	0	0	112.2	K743 V746 L747 L755 W758 W927 Q928 I929 I935	K743-L931 HydrophobicContact CB-CD1 4Å; K743-L931 HydrophobicContact CD-CD1 4.5Å; K743-L931 HydrophobicContact CG-CD1 4.15Å; V746-L931 HydrophobicContact CB-CD2 4.26Å; V746-L931 HydrophobicContact CG1-CD2 3.86Å; L747-L931 HydrophobicContact CD1-CG 4.24Å; L747-L931 HydrophobicContact CD2-CB 4.09Å; L747-L931 HydrophobicContact CD2-CD2 3.69Å; L747-L931 HydrophobicContact CD2-CG 3.83Å; L747-L931 HydrophobicContact CG-CD2 3.67Å; L747-L931 HydrophobicContact CG-CG 3.8Å; L755-L931 HydrophobicContact CD1-CD2 3.88Å; W758-L931 HydrophobicContact CB-CB 4.14Å; W758-L931 HydrophobicContact CD2-CB 4.08Å; W758-L931 HydrophobicContact CD2-CD1 3.83Å; W758-L931 HydrophobicContact CD2-CG 4.44Å; W758-L931 HydrophobicContact CE3-CD1 4.36Å; W758-L931 HydrophobicContact CG-CB 3.81Å; W758-L931 HydrophobicContact CG-CD1 4.22Å; W758-L931 HydrophobicContact CG-CD2 4.4Å; W758-L931 HydrophobicContact CG-CG 4.36Å; W758-L931 HydrophobicContact CH2-CD1 4.45Å; W758-L931 HydrophobicContact CZ2-CD1 3.93Å; W927-L931 VanDerWaalsContact O-CB 3.29Å; W927-L931 WeakPolarHBondContact O-CB 3.32Å; W927-L931 PolarHBondContact O-N 2.73Å; Q928-L931 PolarHBondContact O-N 3.22Å; I929-L931 VanDerWaalsContact C-N 3.28Å; I929-L931 PolarHBondContact O-N 3.14Å; L931-I935 HydrophobicContact CD1-CD1 3.81Å; L931-I935 HydrophobicContact CD1-CG1 4.14Å; L931-I935 HydrophobicContact CG-CD1 3.96Å; L931-I935 WeakPolarHBondContact O-CB 3.49Å; L931-I935 WeakPolarHBondContact O-CD1 3.49Å; L931-I935 WeakPolarHBondContact O-CG1 3.47Å; L931-I935 PolarHBondContact O-N 2.83Å
932	L	89.8	Confident	86.9	Confident	91 Å²	91	45.6 Å²	45.6	48%	0.476	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-46.9	172.8	-78.4	164.7	0	0	0	111.6	L747 Q928 I929 H934 I935 D936	L747-L932 HydrophobicContact CD1-CD2 3.51Å; L747-L932 HydrophobicContact CD1-CG 3.79Å; L747-L932 HydrophobicContact CD2-CG 4.32Å; Q928-L932 WeakPolarHBondContact O-CB 3.12Å; Q928-L932 VanDerWaalsContact O-CG 3.3Å; Q928-L932 WeakPolarHBondContact O-CG 3.44Å; Q928-L932 PolarHBondContact O-N 2.67Å; I929-L932 PolarHBondContact O-N 2.98Å; L932-H934 VanDerWaalsContact C-N 3.34Å; L932-H934 PolarHBondContact O-N 2.79Å; L932-I935 CarbonylContact O-C 3.55Å; L932-I935 WeakPolarHBondContact O-CA 3.24Å; L932-I935 WeakPolarHBondContact O-CB 3.36Å; L932-I935 PolarHBondContact O-N 2.72Å; L932-D936 PolarHBondContact O-N 2.94Å
933	D	89.9	Confident	87.4	Confident	72 Å²	72	44.5 Å²	44.5	39%	0.385	22%	0.222	S	C	.	.	H	α-helix	trans	-56.9	-45.6	176.3	-171.5	60.6	0	0	0	111.5	W762 I929 I935 D936 A937	W762-D933 WeakPolarHBondContact CB-OD2 3.42Å; I929-D933 WeakPolarHBondContact O-CB 3.35Å; I929-D933 PolarHBondContact O-N 2.9Å; D933-I935 PolarHBondContact O-N 3.08Å; D933-D936 PolarHBondContact O-N 3.48Å; D933-A937 PolarHBondContact O-N 3.25Å; D933-A937 VanDerWaalsContact O-N 3.09Å
934	H	89.3	Confident	87.8	Confident	22 Å²	22	45.7 Å²	45.7	10%	0.102	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-35.5	172.1	178.5	80.1	0	0	0	113.6	W758 W762 N930 L932 V938	W758-H934 HydrophobicContact CE3-CB 4.13Å; W758-H934 HydrophobicContact CH2-CB 4.17Å; W758-H934 AromaticContact CH2-CD2 3.43Å; W758-H934 VanDerWaalsContact CH2-CD2 3.43Å; W758-H934 WeakPolarHBondContact CH2-CD2 3.4Å; W758-H934 AromaticContact CH2-CG 3.55Å; W758-H934 AromaticContact CH2-ND1 3.99Å; W758-H934 HydrophobicContact CZ3-CB 3.5Å; W758-H934 AromaticContact CZ3-CD2 3.71Å; W758-H934 AromaticContact CZ3-CG 3.32Å; W758-H934 AromaticContact CZ3-ND1 3.8Å; W762-H934 HydrophobicContact CB-CB 4.2Å; W762-H934 AromaticContact CD1-CE1 3.56Å; W762-H934 HydrophobicContact CD2-CB 4.18Å; W762-H934 AromaticContact CD2-CE1 2.24Å; W762-H934 AromaticContact CD2-ND1 3.23Å; W762-H934 AromaticContact CE2-CE1 2.38Å; W762-H934 AromaticContact CE2-ND1 3.32Å; W762-H934 VanDerWaalsContact CE2-ND1 3.32Å; W762-H934 AromaticContact CE2-NE2 3.94Å; W762-H934 HydrophobicContact CE3-CB 4.46Å; W762-H934 AromaticContact CE3-CE1 2.36Å; W762-H934 AromaticContact CE3-ND1 3.2Å; W762-H934 HydrophobicContact CG-CB 4.06Å; W762-H934 AromaticContact CG-CE1 3.11Å; W762-H934 AromaticContact CG-ND1 3.99Å; W762-H934 AromaticContact CH2-CE1 2.79Å; W762-H934 WeakPolarHBondContact CH2-CE1 3.19Å; W762-H934 AromaticContact CH2-ND1 3.42Å; W762-H934 WeakPolarHBondContact CH2-ND1 3.47Å; W762-H934 AromaticContact CH2-NE2 2.92Å; W762-H934 WeakPolarHBondContact CH2-NE2 3.43Å; W762-H934 AromaticContact CZ2-CE1 2.67Å; W762-H934 WeakPolarHBondContact CZ2-CE1 3.36Å; W762-H934 AromaticContact CZ2-ND1 3.42Å; W762-H934 WeakPolarHBondContact CZ2-ND1 3.35Å; W762-H934 AromaticContact CZ2-NE2 3.22Å; W762-H934 WeakPolarHBondContact CZ2-NE2 3.44Å; W762-H934 AromaticContact CZ3-CE1 2.64Å; W762-H934 WeakPolarHBondContact CZ3-CE1 3.4Å; W762-H934 AromaticContact CZ3-ND1 3.3Å; W762-H934 VanDerWaalsContact CZ3-ND1 3.3Å; W762-H934 WeakPolarHBondContact CZ3-ND1 3.26Å; W762-H934 AromaticContact CZ3-NE2 3.45Å; W762-H934 WeakPolarHBondContact CZ3-NE2 3.48Å; W762-H934 AromaticContact NE1-CE1 3.2Å; W762-H934 PolarHBondContact NE1-CE1 2.89Å; N930-H934 PolarHBondContact O-N 2.98Å; L932-H934 VanDerWaalsContact C-N 3.34Å; L932-H934 PolarHBondContact O-N 2.79Å; H934-V938 WeakPolarHBondContact O-CA 3.48Å; H934-V938 PolarHBondContact O-N 2.67Å
935	I	89.2	Confident	88.1	Confident	4 Å²	4	47 Å²	47	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-71.2	-30.8	177.8	-78.5	165.3	0	0	0	111.7	L740 K743 M744 L747 L931 L932 D933 V938 Q939	L740-I935 HydrophobicContact CD2-CB 4.4Å; L740-I935 HydrophobicContact CD2-CG1 4.15Å; L740-I935 HydrophobicContact CD2-CG2 4.27Å; K743-I935 HydrophobicContact CB-CD1 3.9Å; K743-I935 HydrophobicContact CB-CG1 4.06Å; M744-I935 HydrophobicContact CE-CG2 3.98Å; L747-I935 HydrophobicContact CD1-CD1 3.47Å; L747-I935 VanDerWaalsContact CD1-CD1 3.47Å; L747-I935 HydrophobicContact CG-CD1 4.26Å; L931-I935 HydrophobicContact CD1-CD1 3.81Å; L931-I935 HydrophobicContact CD1-CG1 4.14Å; L931-I935 HydrophobicContact CG-CD1 3.96Å; L931-I935 WeakPolarHBondContact O-CB 3.49Å; L931-I935 WeakPolarHBondContact O-CD1 3.49Å; L931-I935 WeakPolarHBondContact O-CG1 3.47Å; L931-I935 PolarHBondContact O-N 2.83Å; L932-I935 CarbonylContact O-C 3.55Å; L932-I935 WeakPolarHBondContact O-CA 3.24Å; L932-I935 WeakPolarHBondContact O-CB 3.36Å; L932-I935 PolarHBondContact O-N 2.72Å; D933-I935 PolarHBondContact O-N 3.08Å; I935-V938 WeakPolarHBondContact O-CA 3.46Å; I935-V938 PolarHBondContact O-N 3.38Å; I935-Q939 WeakPolarHBondContact O-CG 3.09Å; I935-Q939 PolarHBondContact O-N 3.41Å; I935-Q939 PolarHBondContact O-NE2 3.11Å
936	D	87.4	Confident	88.1	Confident	56 Å²	56	43 Å²	43	30%	0.299	21%	0.213	S	C	.	.	H	α-helix	trans	-75.2	-49.6	177.4	-148.3	55.7	0	0	0	110.7	L932 D933 V938 Q939 D940	L932-D936 PolarHBondContact O-N 2.94Å; D933-D936 PolarHBondContact O-N 3.48Å; D936-V938 PolarHBondContact O-N 3.43Å; D936-Q939 PolarHBondContact O-N 3.27Å; D936-D940 PolarHBondContact O-N 2.81Å
937	A	89.3	Confident	88.1	Confident	15 Å²	15	42.4 Å²	42.4	12%	0.124	21%	0.213	C	C	.	.	H	α-helix	trans	-54.9	-36.9	167.1	0	0	0	0	0	111.9	D933 Q939 D940 E941	D933-A937 PolarHBondContact O-N 3.25Å; D933-A937 VanDerWaalsContact O-N 3.09Å; A937-Q939 PolarHBondContact O-N 3.5Å; A937-D940 PolarHBondContact O-N 3.02Å; A937-E941 PolarHBondContact O-N 3.05Å
938	V	87.9	Confident	88	Confident	11 Å²	11	45.1 Å²	45.1	7%	0.067	23%	0.225	C	C	.	.	H	α-helix	trans	-42.7	-58.4	166.4	-170.9	0	0	0	0	112.9	I736 L740 H934 I935 D936 E941 V942	I736-V938 HydrophobicContact CG2-CG1 3.32Å; L740-V938 HydrophobicContact CD1-CG1 4.32Å; L740-V938 HydrophobicContact CD2-CB 4.46Å; L740-V938 HydrophobicContact CD2-CG1 4.09Å; L740-V938 HydrophobicContact CG-CG1 4.24Å; H934-V938 WeakPolarHBondContact O-CA 3.48Å; H934-V938 PolarHBondContact O-N 2.67Å; I935-V938 WeakPolarHBondContact O-CA 3.46Å; I935-V938 PolarHBondContact O-N 3.38Å; D936-V938 PolarHBondContact O-N 3.43Å; V938-E941 HydrophobicContact CG2-CB 4.21Å; V938-E941 WeakPolarHBondContact CG2-OE2 3.16Å; V938-V942 WeakPolarHBondContact O-CG2 3.4Å; V938-V942 PolarHBondContact O-N 3.45Å
939	Q	86.8	Confident	88	Confident	14 Å²	14	43.5 Å²	43.5	7%	0.065	22%	0.218	C	C	.	.	H	α-helix	trans	-75.3	-34.2	-173.9	-74.4	166.9	93.2	0	0	112.8	L740 I935 D936 A937 V942 S943	L740-Q939 HydrophobicContact CD1-CG 4.27Å; I935-Q939 WeakPolarHBondContact O-CG 3.09Å; I935-Q939 PolarHBondContact O-N 3.41Å; I935-Q939 PolarHBondContact O-NE2 3.11Å; D936-Q939 PolarHBondContact O-N 3.27Å; A937-Q939 PolarHBondContact O-N 3.5Å; Q939-V942 PolarHBondContact O-N 3.36Å; Q939-S943 VanDerWaalsContact O-CB 3.32Å; Q939-S943 WeakPolarHBondContact O-CB 3.12Å; Q939-S943 PolarHBondContact O-N 3.5Å; Q939-S943 PolarHBondContact O-OG 2.75Å
940	D	87.5	Confident	87.9	Confident	65 Å²	65	41.4 Å²	41.4	35%	0.348	21%	0.206	S	C	.	.	H	α-helix	trans	-64.9	-42	172.5	-91.5	-3	0	0	0	111.4	D936 A937 S943 H944 Q993	D936-D940 PolarHBondContact O-N 2.81Å; A937-D940 PolarHBondContact O-N 3.02Å; D940-S943 PolarHBondContact O-N 3.2Å; D940-H944 PolarHBondContact O-N 3.13Å; D940-H944 PolarHBondContact O-ND1 3.3Å; D940-Q993 PolarHBondContact OD1-NE2 3.39Å
941	E	88.3	Confident	87.7	Confident	104 Å²	104	47.9 Å²	47.9	49%	0.486	23%	0.23	S	C	.	.	H	α-helix	trans	-60.7	-48.1	174.3	-176.9	170	-148.2	0	0	111.1	A937 V938 S943 H944 R945	A937-E941 PolarHBondContact O-N 3.05Å; V938-E941 HydrophobicContact CG2-CB 4.21Å; V938-E941 WeakPolarHBondContact CG2-OE2 3.16Å; E941-S943 VanDerWaalsContact C-N 3.31Å; E941-S943 PolarHBondContact O-N 3.07Å; E941-H944 PolarHBondContact O-N 3.48Å; E941-R945 WeakPolarHBondContact O-CB 3.02Å; E941-R945 PolarHBondContact O-N 2.88Å
942	V	88.8	Confident	87.4	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.6	-40.3	176.3	172.1	0	0	0	0	111.9	V733 I736 L740 V938 Q939 R945 M946 L989	V733-V942 HydrophobicContact CG1-CG1 4.24Å; I736-V942 HydrophobicContact CB-CG2 3.98Å; I736-V942 HydrophobicContact CD1-CG2 4.23Å; I736-V942 HydrophobicContact CG2-CG2 3.32Å; L740-V942 HydrophobicContact CD1-CG2 4.35Å; V938-V942 WeakPolarHBondContact O-CG2 3.4Å; V938-V942 PolarHBondContact O-N 3.45Å; Q939-V942 PolarHBondContact O-N 3.36Å; V942-R945 PolarHBondContact O-N 3.34Å; V942-M946 HydrophobicContact CG1-CG 4.28Å; V942-M946 WeakPolarHBondContact O-CB 3.1Å; V942-M946 VanDerWaalsContact O-CG 3.25Å; V942-M946 WeakPolarHBondContact O-CG 3.45Å; V942-M946 PolarHBondContact O-N 3.21Å; V942-L989 HydrophobicContact CG1-CD1 3.95Å; V942-L989 HydrophobicContact CG1-CD2 4.47Å
943	S	85.9	Confident	87.1	Confident	20 Å²	20	44.7 Å²	44.7	14%	0.14	21%	0.213	C	C	.	.	H	α-helix	trans	-67.9	-48.8	-178.7	-59.8	0	0	0	0	111.3	Q939 D940 E941 R945 M946 D947	Q939-S943 VanDerWaalsContact O-CB 3.32Å; Q939-S943 WeakPolarHBondContact O-CB 3.12Å; Q939-S943 PolarHBondContact O-N 3.5Å; Q939-S943 PolarHBondContact O-OG 2.75Å; D940-S943 PolarHBondContact O-N 3.2Å; E941-S943 VanDerWaalsContact C-N 3.31Å; E941-S943 PolarHBondContact O-N 3.07Å; S943-R945 PolarHBondContact O-N 2.79Å; S943-M946 PolarHBondContact O-N 3.1Å; S943-D947 PolarHBondContact O-N 2.94Å
944	H	88.1	Confident	86.8	Confident	131 Å²	131	44.5 Å²	44.5	61%	0.606	21%	0.212	S	C	*	.	H	α-helix	trans	-59.6	-34.5	172.8	-70.2	106.6	0	0	0	112.7	D940 E941 F948	D940-H944 PolarHBondContact O-N 3.13Å; D940-H944 PolarHBondContact O-ND1 3.3Å; E941-H944 PolarHBondContact O-N 3.48Å; H944-F948 PolarHBondContact O-N 3Å; H944-F948 VanDerWaalsContact O-N 3.1Å
945	R	87.1	Confident	86.5	Confident	66 Å²	66	46.5 Å²	46.5	25%	0.249	23%	0.225	C	C	.	.	H	α-helix	trans	-70.3	-42.1	176.1	-150.6	72	169.7	86.8	8.4	111.9	D729 V733 E941 V942 S943 F948 I949	D729-R945 VanDerWaalsContact CG-CZ 3.49Å; D729-R945 IonicContact OD1-CZ 2.68Å; D729-R945 IonicContact OD1-NH1 2.81Å; D729-R945 IonicContact OD1-NH2 3.44Å; D729-R945 PolarHBondContact OD1-NH2 3.04Å; D729-R945 IonicContact OD2-CZ 3.1Å; D729-R945 IonicContact OD2-NH1 3.22Å; D729-R945 PolarHBondContact OD2-NH1 3.34Å; D729-R945 IonicContact OD2-NH2 3.96Å; D729-R945 PolarHBondContact OD2-NH2 3.21Å; V733-R945 HydrophobicContact CG2-CB 4.31Å; V733-R945 HydrophobicContact CG2-CG 4.26Å; E941-R945 WeakPolarHBondContact O-CB 3.02Å; E941-R945 PolarHBondContact O-N 2.88Å; V942-R945 PolarHBondContact O-N 3.34Å; S943-R945 PolarHBondContact O-N 2.79Å; R945-F948 WeakPolarHBondContact O-CB 3.3Å; R945-F948 PolarHBondContact O-N 2.97Å; R945-F948 VanDerWaalsContact O-N 3.15Å; R945-I949 VanDerWaalsContact O-CG1 3.3Å; R945-I949 WeakPolarHBondContact O-CG1 3.44Å; R945-I949 PolarHBondContact O-N 3.49Å
946	M	84.7	Confident	86	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.02	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-41.4	174.5	-77.2	-71.2	-57.8	0	0	112	V733 V942 S943 F948 I949 E950 M982 L985 L986 L989	V733-M946 HydrophobicContact CG1-CG 4.46Å; V733-M946 HydrophobicContact CG1-SD 3.98Å; V733-M946 HydrophobicContact CG2-CG 4.49Å; V733-M946 HydrophobicContact CG2-SD 4.39Å; V942-M946 HydrophobicContact CG1-CG 4.28Å; V942-M946 WeakPolarHBondContact O-CB 3.1Å; V942-M946 VanDerWaalsContact O-CG 3.25Å; V942-M946 WeakPolarHBondContact O-CG 3.45Å; V942-M946 PolarHBondContact O-N 3.21Å; S943-M946 PolarHBondContact O-N 3.1Å; M946-F948 VanDerWaalsContact C-N 3.27Å; M946-F948 PolarHBondContact O-N 3.26Å; M946-I949 PolarHBondContact O-N 2.96Å; M946-E950 PolarHBondContact O-N 3.41Å; M946-M982 HydrophobicContact CE-CB 3.86Å; M946-M982 HydrophobicContact CE-CE 3.5Å; M946-M982 VanDerWaalsContact CE-CE 3.5Å; M946-M982 HydrophobicContact CE-CG 4.22Å; M946-M982 HydrophobicContact SD-CE 3.52Å; M946-M982 VanDerWaalsContact SD-CE 3.52Å; M946-L985 HydrophobicContact CE-CB 3.94Å; M946-L985 HydrophobicContact CE-CD2 3.55Å; M946-L985 HydrophobicContact CE-CG 4.34Å; M946-L985 HydrophobicContact CG-CD2 4.4Å; M946-L985 HydrophobicContact SD-CD2 3.67Å; M946-L986 HydrophobicContact CB-CD1 4.39Å; M946-L986 HydrophobicContact CB-CD2 3.5Å; M946-L986 HydrophobicContact CB-CG 3.92Å; M946-L986 HydrophobicContact CE-CD1 4.5Å; M946-L986 HydrophobicContact CE-CG 3.98Å; M946-L986 HydrophobicContact CG-CD2 4.44Å; M946-L989 HydrophobicContact CG-CD1 4.27Å
947	D	86.6	Confident	85.6	Confident	78 Å²	78	45.6 Å²	45.6	42%	0.417	22%	0.22	S	C	.	.	H	α-helix	trans	-65.8	-27.8	173.7	-75.4	-10.7	0	0	0	112.9	S943 R951 L986	S943-D947 PolarHBondContact O-N 2.94Å; D947-R951 WeakPolarHBondContact O-CG 3.27Å; D947-R951 PolarHBondContact O-NE 2.91Å; D947-R951 PolarHBondContact O-NH2 3.31Å; D947-L986 WeakPolarHBondContact OD1-CD2 3.41Å
948	F	86.3	Confident	85.2	Confident	73 Å²	73	48.8 Å²	48.8	32%	0.32	24%	0.241	S	C	.	.	H	α-helix	trans	-70.7	-47.4	170.5	-177.9	-90.8	0	0	0	111.3	D729 H944 R945 M946 E950 R951 E952	D729-F948 WeakPolarHBondContact OD2-CE1 3.24Å; H944-F948 PolarHBondContact O-N 3Å; H944-F948 VanDerWaalsContact O-N 3.1Å; R945-F948 WeakPolarHBondContact O-CB 3.3Å; R945-F948 PolarHBondContact O-N 2.97Å; R945-F948 VanDerWaalsContact O-N 3.15Å; M946-F948 VanDerWaalsContact C-N 3.27Å; M946-F948 PolarHBondContact O-N 3.26Å; F948-E950 VanDerWaalsContact C-N 3.32Å; F948-E950 PolarHBondContact O-N 2.93Å; F948-R951 VanDerWaalsContact CA-NH2 3.29Å; F948-R951 WeakPolarHBondContact O-CB 3.37Å; F948-R951 PolarHBondContact O-N 3.16Å; F948-R951 VanDerWaalsContact O-N 3.09Å; F948-E952 HydrophobicContact CD1-CG 4.11Å; F948-E952 VanDerWaalsContact CE1-CD 3.41Å; F948-E952 HydrophobicContact CE1-CG 3.67Å; F948-E952 HydrophobicContact CZ-CG 4.14Å; F948-E952 PolarHBondContact O-N 3.02Å
949	I	88	Confident	84.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-35.6	-179.6	-58	159.1	0	0	0	111.6	L726 D729 V730 V733 R945 M946 R951 E952 L953 M982	L726-I949 HydrophobicContact CD1-CG2 3.31Å; D729-I949 HydrophobicContact CB-CD1 3.79Å; D729-I949 HydrophobicContact CB-CG1 3.65Å; V730-I949 HydrophobicContact CG2-CD1 4.34Å; V730-I949 HydrophobicContact CG2-CG2 4.17Å; V733-I949 HydrophobicContact CG2-CD1 3.97Å; R945-I949 VanDerWaalsContact O-CG1 3.3Å; R945-I949 WeakPolarHBondContact O-CG1 3.44Å; R945-I949 PolarHBondContact O-N 3.49Å; M946-I949 PolarHBondContact O-N 2.96Å; I949-R951 VanDerWaalsContact C-N 3.3Å; I949-R951 PolarHBondContact O-N 2.84Å; I949-E952 PolarHBondContact O-N 3.47Å; I949-L953 HydrophobicContact CG2-CD1 4.33Å; I949-L953 HydrophobicContact CG2-CG 4.46Å; I949-L953 WeakPolarHBondContact O-CG 3.21Å; I949-L953 PolarHBondContact O-N 2.8Å; I949-M982 HydrophobicContact CB-CE 3.63Å; I949-M982 HydrophobicContact CD1-CE 3.99Å; I949-M982 HydrophobicContact CG1-CE 4.43Å; I949-M982 HydrophobicContact CG2-CE 3.36Å; I949-M982 HydrophobicContact CG2-SD 3.81Å
950	E	85.6	Confident	83.4	Confident	39 Å²	39	52.8 Å²	52.8	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-40.7	173.4	-176.4	167.6	130.3	0	0	111.7	M946 F948 L953 D954 K983	M946-E950 PolarHBondContact O-N 3.41Å; F948-E950 VanDerWaalsContact C-N 3.32Å; F948-E950 PolarHBondContact O-N 2.93Å; E950-L953 PolarHBondContact O-N 2.93Å; E950-D954 PolarHBondContact O-N 3.32Å; E950-K983 IonicContact OE1-NZ 3.99Å; E950-K983 PolarHBondContact OE1-NZ 2.65Å; E950-K983 WeakPolarHBondContact OE2-CG 3.37Å; E950-K983 IonicContact OE2-NZ 3.74Å; E950-K983 PolarHBondContact OE2-NZ 3.15Å; E950-K983 VanDerWaalsContact OE2-NZ 3.11Å
951	R	86.1	Confident	81.9	Confident	140 Å²	140	55.6 Å²	55.6	53%	0.528	27%	0.272	S	S	.	.	H	α-helix	trans	-68.3	-35.2	175.7	-72	174.2	-74.6	138.2	-10.6	112.9	D947 F948 I949 D954 V955	D947-R951 WeakPolarHBondContact O-CG 3.27Å; D947-R951 PolarHBondContact O-NE 2.91Å; D947-R951 PolarHBondContact O-NH2 3.31Å; F948-R951 VanDerWaalsContact CA-NH2 3.29Å; F948-R951 WeakPolarHBondContact O-CB 3.37Å; F948-R951 PolarHBondContact O-N 3.16Å; F948-R951 VanDerWaalsContact O-N 3.09Å; I949-R951 VanDerWaalsContact C-N 3.3Å; I949-R951 PolarHBondContact O-N 2.84Å; R951-D954 PolarHBondContact O-N 3.2Å; R951-V955 WeakPolarHBondContact O-CG2 3.44Å; R951-V955 PolarHBondContact O-N 2.87Å; R951-V955 VanDerWaalsContact O-N 3.09Å
952	E	83.8	Confident	80.2	Confident	25 Å²	25	59.7 Å²	59.7	12%	0.117	28%	0.284	C	S	.	.	H	α-helix	trans	-66.2	-38.8	171.8	-69.9	-157.2	126.1	0	0	112.3	F948 I949 V955 L956	F948-E952 HydrophobicContact CD1-CG 4.11Å; F948-E952 VanDerWaalsContact CE1-CD 3.41Å; F948-E952 HydrophobicContact CE1-CG 3.67Å; F948-E952 HydrophobicContact CZ-CG 4.14Å; F948-E952 PolarHBondContact O-N 3.02Å; I949-E952 PolarHBondContact O-N 3.47Å; E952-V955 PolarHBondContact O-N 3.31Å; E952-L956 WeakPolarHBondContact O-CB 3.34Å; E952-L956 WeakPolarHBondContact O-CG 3.28Å; E952-L956 PolarHBondContact O-N 3.41Å
953	L	83.3	Confident	78.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.3	-39	174	-73.3	171	0	0	0	112	L726 I949 E950 L956 E957 L975 L978 K979 M982	L726-L953 HydrophobicContact CD1-CD2 3.92Å; L726-L953 HydrophobicContact CD1-CG 4.07Å; L726-L953 HydrophobicContact CD2-CD2 3.69Å; I949-L953 HydrophobicContact CG2-CD1 4.33Å; I949-L953 HydrophobicContact CG2-CG 4.46Å; I949-L953 WeakPolarHBondContact O-CG 3.21Å; I949-L953 PolarHBondContact O-N 2.8Å; E950-L953 PolarHBondContact O-N 2.93Å; L953-L956 PolarHBondContact O-N 2.83Å; L953-E957 VanDerWaalsContact O-CB 3.3Å; L953-E957 WeakPolarHBondContact O-CB 3.43Å; L953-E957 PolarHBondContact O-N 2.71Å; L953-L975 HydrophobicContact CB-CD2 4.39Å; L953-L975 HydrophobicContact CD2-CD1 4.26Å; L953-L975 HydrophobicContact CD2-CD2 3.86Å; L953-L975 HydrophobicContact CD2-CG 3.79Å; L953-L978 HydrophobicContact CD1-CG 4.26Å; L953-L978 HydrophobicContact CD2-CD2 3.95Å; L953-L978 HydrophobicContact CD2-CG 4.43Å; L953-K979 HydrophobicContact CD1-CB 4.33Å; L953-M982 HydrophobicContact CD1-SD 3.58Å; L953-M982 VanDerWaalsContact CD1-SD 3.58Å
954	D	82.6	Confident	76.6	Confident	68 Å²	68	67.2 Å²	67.2	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-62.8	-40.8	173.7	-77	1.5	0	0	0	112	E950 R951 E957 S958 K979	E950-D954 PolarHBondContact O-N 3.32Å; R951-D954 PolarHBondContact O-N 3.2Å; D954-E957 PolarHBondContact O-N 3.38Å; D954-S958 WeakPolarHBondContact O-CB 3.31Å; D954-S958 PolarHBondContact O-N 2.88Å; D954-K979 WeakPolarHBondContact OD1-CE 3.45Å; D954-K979 IonicContact OD1-NZ 3.15Å; D954-K979 PolarHBondContact OD1-NZ 3.14Å
955	V	82.7	Confident	74.5	Confident	63 Å²	63	69.3 Å²	69.3	38%	0.382	35%	0.354	S	S	.	.	H	α-helix	trans	-65.6	-44.4	174.5	171.8	0	0	0	0	111.3	R951 E952 S958 W959	R951-V955 WeakPolarHBondContact O-CG2 3.44Å; R951-V955 PolarHBondContact O-N 2.87Å; R951-V955 VanDerWaalsContact O-N 3.09Å; E952-V955 PolarHBondContact O-N 3.31Å; V955-S958 WeakPolarHBondContact O-CB 3.5Å; V955-S958 PolarHBondContact O-N 2.88Å; V955-S958 PolarHBondContact O-OG 3.11Å; V955-W959 HydrophobicContact CG1-CD2 4.3Å; V955-W959 HydrophobicContact CG1-CH2 3.87Å; V955-W959 HydrophobicContact CG1-CZ2 3.49Å; V955-W959 VanDerWaalsContact CG1-CZ2 3.49Å; V955-W959 HydrophobicContact CG1-CZ3 4.41Å; V955-W959 PolarHBondContact O-N 3.14Å
956	L	79.8	Confident	72.5	Confident	9 Å²	9	73.6 Å²	73.6	5%	0.047	38%	0.381	C	S	.	.	H	α-helix	trans	-65.1	-37	176.6	-77.5	165.2	0	0	0	112.7	T722 L726 E952 L953 W959 L975	T722-L956 WeakPolarHBondContact OG1-CD2 3.4Å; L726-L956 HydrophobicContact CB-CD1 4.48Å; L726-L956 HydrophobicContact CD2-CD1 3.59Å; E952-L956 WeakPolarHBondContact O-CB 3.34Å; E952-L956 WeakPolarHBondContact O-CG 3.28Å; E952-L956 PolarHBondContact O-N 3.41Å; L953-L956 PolarHBondContact O-N 2.83Å; L956-W959 HydrophobicContact CD2-CE3 4.04Å; L956-W959 HydrophobicContact CD2-CZ3 4.26Å; L956-W959 PolarHBondContact O-N 3.08Å; L956-L975 HydrophobicContact CB-CD1 3.69Å; L956-L975 HydrophobicContact CD1-CD1 4.45Å
957	E	78.7	Confident	70.6	Confident	33 Å²	33	82.2 Å²	82.2	15%	0.154	42%	0.421	C	S	.	.	H	α-helix	trans	-68.9	-34.1	173.9	-166	166.6	-137.1	0	0	111.4	L953 D954 W959 L960 L975 K979	L953-E957 VanDerWaalsContact O-CB 3.3Å; L953-E957 WeakPolarHBondContact O-CB 3.43Å; L953-E957 PolarHBondContact O-N 2.71Å; D954-E957 PolarHBondContact O-N 3.38Å; E957-W959 PolarHBondContact O-N 2.75Å; E957-L960 WeakPolarHBondContact O-CB 3.42Å; E957-L960 PolarHBondContact O-N 3.37Å; E957-L960 VanDerWaalsContact O-N 3.14Å; E957-L975 HydrophobicContact CB-CD2 4.05Å; E957-K979 WeakPolarHBondContact OE2-CD 3.43Å; E957-K979 IonicContact OE2-NZ 3.4Å; E957-K979 PolarHBondContact OE2-NZ 3.45Å
958	S	79.7	Confident	68.9	Low	81 Å²	81	81.2 Å²	81.2	57%	0.566	42%	0.419	S	S	*	.	H	α-helix	trans	-65.3	-15.9	171.2	84.5	0	0	0	0	114.1	D954 V955	D954-S958 WeakPolarHBondContact O-CB 3.31Å; D954-S958 PolarHBondContact O-N 2.88Å; V955-S958 WeakPolarHBondContact O-CB 3.5Å; V955-S958 PolarHBondContact O-N 2.88Å; V955-S958 PolarHBondContact O-OG 3.11Å
959	W	70.9	Confident	67.3	Low	76 Å²	76	81.7 Å²	81.7	29%	0.288	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	8.1	176.9	-63.2	-11.1	0	0	0	113.7	K718 K719 T722 V955 L956 E957	K718-W959 HydrophobicContact CB-CH2 3.97Å; K718-W959 HydrophobicContact CB-CZ3 4.31Å; K719-W959 HydrophobicContact CB-CE3 4.29Å; K719-W959 HydrophobicContact CB-CZ3 4.44Å; K719-W959 HydrophobicContact CD-CB 4.41Å; K719-W959 HydrophobicContact CD-CE3 4.33Å; K719-W959 HydrophobicContact CG-CD2 4.47Å; K719-W959 HydrophobicContact CG-CE3 3.7Å; K719-W959 HydrophobicContact CG-CZ3 4.13Å; K719-W959 PolarHBondContact NZ-O 3.23Å; T722-W959 HydrophobicContact CG2-CH2 4.17Å; T722-W959 HydrophobicContact CG2-CZ3 4.26Å; T722-W959 WeakPolarHBondContact OG1-CZ3 3.3Å; V955-W959 HydrophobicContact CG1-CD2 4.3Å; V955-W959 HydrophobicContact CG1-CH2 3.87Å; V955-W959 HydrophobicContact CG1-CZ2 3.49Å; V955-W959 VanDerWaalsContact CG1-CZ2 3.49Å; V955-W959 HydrophobicContact CG1-CZ3 4.41Å; V955-W959 PolarHBondContact O-N 3.14Å; L956-W959 HydrophobicContact CD2-CE3 4.04Å; L956-W959 HydrophobicContact CD2-CZ3 4.26Å; L956-W959 PolarHBondContact O-N 3.08Å; E957-W959 PolarHBondContact O-N 2.75Å
960	L	67.8	Low	65.3	Low	34 Å²	34	88.3 Å²	88.3	18%	0.178	46%	0.46	C	S	.	.	S	Bend	trans	-98.2	95.6	166.9	-75.9	168.8	0	0	0	109.1	E957 Y962 P968 L972	E957-L960 WeakPolarHBondContact O-CB 3.42Å; E957-L960 PolarHBondContact O-N 3.37Å; E957-L960 VanDerWaalsContact O-N 3.14Å; L960-Y962 WeakPolarHBondContact O-CD2 3.31Å; L960-Y962 PolarHBondContact O-N 2.86Å; L960-Y962 VanDerWaalsContact O-N 3.09Å; L960-P968 HydrophobicContact CD2-CB 3.88Å; L960-L972 HydrophobicContact CD1-CB 4.45Å; L960-L972 HydrophobicContact CD2-CB 4.03Å; L960-L972 HydrophobicContact CD2-CD1 3.88Å
961	D	55.5	Low	63.7	Low	124 Å²	124	91.3 Å²	91.3	66%	0.663	48%	0.483	S	S	*	.			trans	-62	111.7	176.4	-70.2	-62.7	0	0	0	111.1	T963	D961-T963 HydrophobicContact CB-CG2 4.12Å; D961-T963 PolarHBondContact O-N 3.18Å
962	Y	52.8	Low	62.3	Low	190 Å²	190	86.9 Å²	86.9	75%	0.745	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	27.8	172.2	-69.5	-89.1	0	0	0	113	L960 G964	L960-Y962 WeakPolarHBondContact O-CD2 3.31Å; L960-Y962 PolarHBondContact O-N 2.86Å; L960-Y962 VanDerWaalsContact O-N 3.09Å; Y962-G964 PolarHBondContact O-N 2.84Å
963	T	47.8	Very low	61.1	Low	106 Å²	106	88.2 Å²	88.2	65%	0.65	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-16.4	179.4	49.9	0	0	0	0	113.2	D961 E965	D961-T963 HydrophobicContact CB-CG2 4.12Å; D961-T963 PolarHBondContact O-N 3.18Å; T963-E965 VanDerWaalsContact C-N 3.26Å; T963-E965 PolarHBondContact O-N 3.32Å
964	G	50.4	Low	60.3	Low	72 Å²	72	95.1 Å²	95.1	74%	0.742	51%	0.511	S	S	*	.	S	Bend	trans	76.4	-1.2	168.5	0	0	0	0	0	116.2	Y962	Y962-G964 PolarHBondContact O-N 2.84Å
965	E	44.9	Very low	59.6	Low	175 Å²	175	92.4 Å²	92.4	82%	0.818	50%	0.496	S	S	*	.	S	Bend	trans	-83.8	-16.9	179.8	-63	-161	136.6	0	0	114.1	T963	T963-E965 VanDerWaalsContact C-N 3.26Å; T963-E965 PolarHBondContact O-N 3.32Å
966	L	44.4	Very low	59.1	Low	156 Å²	156	92.2 Å²	92.2	82%	0.817	50%	0.496	S	S	*	.	S	Bend	trans	-133.2	133.4	178.4	-67.5	174.7	0	0	0	111.4
967	E	46	Very low	58.7	Low	184 Å²	184	97.3 Å²	97.3	86%	0.86	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-68.2	125.4	169.7	-174.2	173.4	-164.6	0	0	109
968	P	49.6	Very low	58.4	Low	58 Å²	58	98.7 Å²	98.7	38%	0.377	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-65.3	139.8	-178	26.8	-34.3	0	0	0	110.1	L960 E970	L960-P968 HydrophobicContact CD2-CB 3.88Å; P968-E970 PolarHBondContact O-N 3.06Å
969	P	53.3	Low	58.1	Low	82 Å²	82	96.5 Å²	96.5	53%	0.532	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-58.4	138.7	-176.1	24.1	-34	0	0	0	110.9	P971 L972	P969-P971 VanDerWaalsContact C-N 3.33Å; P969-P971 VanDerWaalsContact O-CD 3.29Å; P969-P971 WeakPolarHBondContact O-CD 3.39Å; P969-L972 HydrophobicContact CG-CD1 3.98Å; P969-L972 HydrophobicContact CG-CG 4.35Å; P969-L972 PolarHBondContact O-N 3.13Å
970	E	45.5	Very low	58.3	Low	140 Å²	140	99.1 Å²	99.1	65%	0.654	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41	-39.7	-167.7	-157.8	-174.2	153.5	0	0	117.5	P968 L972 R974	P968-E970 PolarHBondContact O-N 3.06Å; E970-L972 PolarHBondContact O-N 3.31Å; E970-R974 IonicContact OE1-NH2 2.59Å; E970-R974 PolarHBondContact OE1-NH2 3.23Å
971	P	53.3	Low	58.8	Low	102 Å²	102	106.1 Å²	106.1	66%	0.662	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-40.8	173	21.7	-34.7	0	0	0	114.3	P969 R974	P969-P971 VanDerWaalsContact C-N 3.33Å; P969-P971 VanDerWaalsContact O-CD 3.29Å; P969-P971 WeakPolarHBondContact O-CD 3.39Å; P971-R974 PolarHBondContact O-N 3.24Å
972	L	54.9	Low	59.7	Low	46 Å²	46	100.8 Å²	100.8	24%	0.241	52%	0.519	C	S	.	.	G	3₁₀ helix	trans	-76.1	-25.2	-175.8	-61.9	-179.3	0	0	0	112.7	L960 P969 E970 R974 L975	L960-L972 HydrophobicContact CD1-CB 4.45Å; L960-L972 HydrophobicContact CD2-CB 4.03Å; L960-L972 HydrophobicContact CD2-CD1 3.88Å; P969-L972 HydrophobicContact CG-CD1 3.98Å; P969-L972 HydrophobicContact CG-CG 4.35Å; P969-L972 PolarHBondContact O-N 3.13Å; E970-L972 PolarHBondContact O-N 3.31Å; L972-R974 PolarHBondContact O-N 3.31Å; L972-L975 HydrophobicContact CD2-CD1 4.3Å; L972-L975 VanDerWaalsContact O-CB 3.24Å; L972-L975 WeakPolarHBondContact O-CB 3.49Å; L972-L975 PolarHBondContact O-N 3.18Å
973	A	59.6	Low	60.7	Low	53 Å²	53	95.7 Å²	95.7	44%	0.438	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-60.2	-14.6	175	0	0	0	0	0	113.9
974	R	67	Low	62.1	Low	146 Å²	146	98.7 Å²	98.7	55%	0.551	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-97.7	-5.4	177.1	-56.1	-175.1	-168.6	-177.9	5.8	113.7	E970 P971 L972 Q977 L978	E970-R974 IonicContact OE1-NH2 2.59Å; E970-R974 PolarHBondContact OE1-NH2 3.23Å; P971-R974 PolarHBondContact O-N 3.24Å; L972-R974 PolarHBondContact O-N 3.31Å; R974-Q977 WeakPolarHBondContact O-CA 3.26Å; R974-Q977 WeakPolarHBondContact O-CB 3.24Å; R974-Q977 PolarHBondContact O-N 2.88Å; R974-L978 PolarHBondContact O-N 3.07Å
975	L	66.9	Low	63.3	Low	10 Å²	10	98.4 Å²	98.4	5%	0.052	48%	0.481	C	S	.	.	H	α-helix	trans	-59.2	-42.2	-174.9	-162.1	154.7	0	0	0	113.1	L953 L956 E957 L972 Q977 L978 K979	L953-L975 HydrophobicContact CB-CD2 4.39Å; L953-L975 HydrophobicContact CD2-CD1 4.26Å; L953-L975 HydrophobicContact CD2-CD2 3.86Å; L953-L975 HydrophobicContact CD2-CG 3.79Å; L956-L975 HydrophobicContact CB-CD1 3.69Å; L956-L975 HydrophobicContact CD1-CD1 4.45Å; E957-L975 HydrophobicContact CB-CD2 4.05Å; L972-L975 HydrophobicContact CD2-CD1 4.3Å; L972-L975 VanDerWaalsContact O-CB 3.24Å; L972-L975 WeakPolarHBondContact O-CB 3.49Å; L972-L975 PolarHBondContact O-N 3.18Å; L975-Q977 VanDerWaalsContact C-N 3.27Å; L975-Q977 PolarHBondContact O-N 2.79Å; L975-L978 WeakPolarHBondContact O-CB 3.15Å; L975-L978 PolarHBondContact O-N 3.41Å; L975-K979 WeakPolarHBondContact O-CB 3.26Å; L975-K979 PolarHBondContact O-N 2.9Å
976	P	71.8	Confident	64.6	Low	60 Å²	60	91.7 Å²	91.7	39%	0.39	45%	0.45	S	S	.	.	H	α-helix	trans	-63.1	-31.2	173.1	-23.8	35.1	0	0	0	113.6	H980	P976-H980 WeakPolarHBondContact O-CB 3.45Å; P976-H980 PolarHBondContact O-N 3.13Å
977	Q	71.9	Confident	66.1	Low	116 Å²	116	87.9 Å²	87.9	54%	0.542	43%	0.434	S	S	.	.	H	α-helix	trans	-73.4	-35.7	177.6	-53.2	-179.4	7.2	0	0	111.5	R974 L975 R981	R974-Q977 WeakPolarHBondContact O-CA 3.26Å; R974-Q977 WeakPolarHBondContact O-CB 3.24Å; R974-Q977 PolarHBondContact O-N 2.88Å; L975-Q977 VanDerWaalsContact C-N 3.27Å; L975-Q977 PolarHBondContact O-N 2.79Å; Q977-R981 VanDerWaalsContact O-CG 3.31Å; Q977-R981 WeakPolarHBondContact O-CG 3.46Å; Q977-R981 PolarHBondContact O-N 3.15Å
978	L	73.3	Confident	67.3	Low	61 Å²	61	83.8 Å²	83.8	32%	0.319	42%	0.415	S	S	.	.	H	α-helix	trans	-64.7	-52.5	171.7	177.5	58.5	0	0	0	110.3	L953 R974 L975 H980 R981 M982	L953-L978 HydrophobicContact CD1-CG 4.26Å; L953-L978 HydrophobicContact CD2-CD2 3.95Å; L953-L978 HydrophobicContact CD2-CG 4.43Å; R974-L978 PolarHBondContact O-N 3.07Å; L975-L978 WeakPolarHBondContact O-CB 3.15Å; L975-L978 PolarHBondContact O-N 3.41Å; L978-H980 VanDerWaalsContact C-N 3.32Å; L978-H980 PolarHBondContact O-N 2.88Å; L978-R981 WeakPolarHBondContact O-CA 3.49Å; L978-R981 WeakPolarHBondContact O-CB 3.04Å; L978-R981 PolarHBondContact O-N 2.64Å; L978-M982 HydrophobicContact CD1-CG 4.03Å; L978-M982 HydrophobicContact CD1-SD 3.95Å; L978-M982 HydrophobicContact CG-CG 4.43Å; L978-M982 HydrophobicContact CG-SD 4.08Å; L978-M982 WeakPolarHBondContact O-CG 3.27Å; L978-M982 PolarHBondContact O-N 3.35Å
979	K	72.3	Confident	68.3	Low	36 Å²	36	82 Å²	82	16%	0.157	40%	0.402	C	S	.	.	H	α-helix	trans	-52.8	-44.7	176.5	-179.5	168	169.6	172.3	0	112.7	L953 D954 E957 L975 R981 M982 K983	L953-K979 HydrophobicContact CD1-CB 4.33Å; D954-K979 WeakPolarHBondContact OD1-CE 3.45Å; D954-K979 IonicContact OD1-NZ 3.15Å; D954-K979 PolarHBondContact OD1-NZ 3.14Å; E957-K979 WeakPolarHBondContact OE2-CD 3.43Å; E957-K979 IonicContact OE2-NZ 3.4Å; E957-K979 PolarHBondContact OE2-NZ 3.45Å; L975-K979 WeakPolarHBondContact O-CB 3.26Å; L975-K979 PolarHBondContact O-N 2.9Å; K979-R981 PolarHBondContact O-N 3.43Å; K979-M982 PolarHBondContact O-N 3.49Å; K979-K983 WeakPolarHBondContact O-CG 3.24Å; K979-K983 PolarHBondContact O-N 3.34Å
980	H	75.6	Confident	69	Low	131 Å²	131	79.6 Å²	79.6	61%	0.606	39%	0.392	S	S	*	.	H	α-helix	trans	-63.6	-39.9	174.9	-178.4	77.3	0	0	0	113.3	P976 L978 R984	P976-H980 WeakPolarHBondContact O-CB 3.45Å; P976-H980 PolarHBondContact O-N 3.13Å; L978-H980 VanDerWaalsContact C-N 3.32Å; L978-H980 PolarHBondContact O-N 2.88Å; H980-R984 PolarHBondContact O-N 2.76Å; H980-R984 VanDerWaalsContact O-N 3.13Å
981	R	78.5	Confident	70.3	Confident	180 Å²	180	78.2 Å²	78.2	68%	0.679	38%	0.384	S	S	*	.	H	α-helix	trans	-66.6	-37.7	175.5	-71.7	172.8	-176.2	-148.5	1.8	112.1	Q977 L978 K979 R984 L985	Q977-R981 VanDerWaalsContact O-CG 3.31Å; Q977-R981 WeakPolarHBondContact O-CG 3.46Å; Q977-R981 PolarHBondContact O-N 3.15Å; L978-R981 WeakPolarHBondContact O-CA 3.49Å; L978-R981 WeakPolarHBondContact O-CB 3.04Å; L978-R981 PolarHBondContact O-N 2.64Å; K979-R981 PolarHBondContact O-N 3.43Å; R981-R984 PolarHBondContact O-N 3.28Å; R981-L985 PolarHBondContact O-N 2.75Å
982	M	73.9	Confident	70.9	Confident	13 Å²	13	76.7 Å²	76.7	6%	0.064	37%	0.373	C	S	.	.	H	α-helix	trans	-70.8	-44.6	179.5	-67.4	-167.4	66.8	0	0	112.3	V730 M946 I949 L953 L978 K979 R984 L985 L986	V730-M982 HydrophobicContact CG2-CE 4.45Å; V730-M982 HydrophobicContact CG2-SD 4.34Å; M946-M982 HydrophobicContact CE-CB 3.86Å; M946-M982 HydrophobicContact CE-CE 3.5Å; M946-M982 VanDerWaalsContact CE-CE 3.5Å; M946-M982 HydrophobicContact CE-CG 4.22Å; M946-M982 HydrophobicContact SD-CE 3.52Å; M946-M982 VanDerWaalsContact SD-CE 3.52Å; I949-M982 HydrophobicContact CB-CE 3.63Å; I949-M982 HydrophobicContact CD1-CE 3.99Å; I949-M982 HydrophobicContact CG1-CE 4.43Å; I949-M982 HydrophobicContact CG2-CE 3.36Å; I949-M982 HydrophobicContact CG2-SD 3.81Å; L953-M982 HydrophobicContact CD1-SD 3.58Å; L953-M982 VanDerWaalsContact CD1-SD 3.58Å; L978-M982 HydrophobicContact CD1-CG 4.03Å; L978-M982 HydrophobicContact CD1-SD 3.95Å; L978-M982 HydrophobicContact CG-CG 4.43Å; L978-M982 HydrophobicContact CG-SD 4.08Å; L978-M982 WeakPolarHBondContact O-CG 3.27Å; L978-M982 PolarHBondContact O-N 3.35Å; K979-M982 PolarHBondContact O-N 3.49Å; M982-R984 PolarHBondContact O-N 2.66Å; M982-L985 WeakPolarHBondContact O-CA 3.41Å; M982-L985 WeakPolarHBondContact O-CB 3.29Å; M982-L985 PolarHBondContact O-N 2.9Å; M982-L986 PolarHBondContact O-N 3.36Å
983	K	73.4	Confident	71.2	Confident	82 Å²	82	76.7 Å²	76.7	36%	0.357	37%	0.371	S	S	.	.	H	α-helix	trans	-53.5	-42.2	168.8	-76.8	178.1	-179.7	-62.8	0	112.2	E950 K979 T987	E950-K983 IonicContact OE1-NZ 3.99Å; E950-K983 PolarHBondContact OE1-NZ 2.65Å; E950-K983 WeakPolarHBondContact OE2-CG 3.37Å; E950-K983 IonicContact OE2-NZ 3.74Å; E950-K983 PolarHBondContact OE2-NZ 3.15Å; E950-K983 VanDerWaalsContact OE2-NZ 3.11Å; K979-K983 WeakPolarHBondContact O-CG 3.24Å; K979-K983 PolarHBondContact O-N 3.34Å; K983-T987 WeakPolarHBondContact O-CB 3.29Å; K983-T987 PolarHBondContact O-N 3.16Å; K983-T987 PolarHBondContact O-OG1 2.79Å
984	R	78.3	Confident	71.5	Confident	170 Å²	170	79.5 Å²	79.5	64%	0.642	38%	0.376	S	S	*	.	H	α-helix	trans	-65.2	-39	174.8	-176.9	175.1	172.8	179.8	-2.9	112.3	H980 R981 M982 T987 Q988	H980-R984 PolarHBondContact O-N 2.76Å; H980-R984 VanDerWaalsContact O-N 3.13Å; R981-R984 PolarHBondContact O-N 3.28Å; M982-R984 PolarHBondContact O-N 2.66Å; R984-T987 PolarHBondContact O-N 3.49Å; R984-Q988 WeakPolarHBondContact O-CG 3.48Å; R984-Q988 PolarHBondContact O-N 3.36Å
985	L	74.1	Confident	71.6	Confident	65 Å²	65	77.7 Å²	77.7	34%	0.34	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-48.8	176.8	-163.5	94.7	0	0	0	111.4	L737 M946 R981 M982 T987 Q988 L989	L737-L985 HydrophobicContact CD1-CD2 4.38Å; M946-L985 HydrophobicContact CE-CB 3.94Å; M946-L985 HydrophobicContact CE-CD2 3.55Å; M946-L985 HydrophobicContact CE-CG 4.34Å; M946-L985 HydrophobicContact CG-CD2 4.4Å; M946-L985 HydrophobicContact SD-CD2 3.67Å; R981-L985 PolarHBondContact O-N 2.75Å; M982-L985 WeakPolarHBondContact O-CA 3.41Å; M982-L985 WeakPolarHBondContact O-CB 3.29Å; M982-L985 PolarHBondContact O-N 2.9Å; L985-T987 VanDerWaalsContact C-N 3.26Å; L985-T987 PolarHBondContact O-N 2.96Å; L985-Q988 CarbonylContact O-C 3.27Å; L985-Q988 WeakPolarHBondContact O-CA 3.39Å; L985-Q988 PolarHBondContact O-N 2.98Å; L985-L989 HydrophobicContact CD2-CD1 3.97Å; L985-L989 HydrophobicContact CG-CD1 4.27Å; L985-L989 PolarHBondContact O-N 3.31Å
986	L	72.3	Confident	70.8	Confident	34 Å²	34	79 Å²	79	18%	0.178	39%	0.386	C	S	.	.	H	α-helix	trans	-52	-45.9	171.5	-81.8	165.5	0	0	0	111.3	M946 D947 M982 Q988 L989 G990	M946-L986 HydrophobicContact CB-CD1 4.39Å; M946-L986 HydrophobicContact CB-CD2 3.5Å; M946-L986 HydrophobicContact CB-CG 3.92Å; M946-L986 HydrophobicContact CE-CD1 4.5Å; M946-L986 HydrophobicContact CE-CG 3.98Å; M946-L986 HydrophobicContact CG-CD2 4.44Å; D947-L986 WeakPolarHBondContact OD1-CD2 3.41Å; M982-L986 PolarHBondContact O-N 3.36Å; L986-Q988 PolarHBondContact O-N 2.94Å; L986-L989 PolarHBondContact O-N 3.12Å; L986-G990 PolarHBondContact O-N 3.11Å
987	T	76.3	Confident	70	Confident	77 Å²	77	81 Å²	81	47%	0.472	39%	0.393	S	S	.	.	H	α-helix	trans	-66	-19.5	176.6	-51	0	0	0	0	113.5	K983 R984 L985 K991	K983-T987 WeakPolarHBondContact O-CB 3.29Å; K983-T987 PolarHBondContact O-N 3.16Å; K983-T987 PolarHBondContact O-OG1 2.79Å; R984-T987 PolarHBondContact O-N 3.49Å; L985-T987 VanDerWaalsContact C-N 3.26Å; L985-T987 PolarHBondContact O-N 2.96Å; T987-K991 WeakPolarHBondContact O-CD 3.45Å; T987-K991 WeakPolarHBondContact O-CG 3.5Å
988	Q	71.5	Confident	69.1	Low	98 Å²	98	84.6 Å²	84.6	46%	0.458	40%	0.402	S	S	.	.	H	α-helix	trans	-87.5	-41.8	169.6	-60.7	-45.1	-99.6	0	0	111.7	R984 L985 L986 K991 V992	R984-Q988 WeakPolarHBondContact O-CG 3.48Å; R984-Q988 PolarHBondContact O-N 3.36Å; L985-Q988 CarbonylContact O-C 3.27Å; L985-Q988 WeakPolarHBondContact O-CA 3.39Å; L985-Q988 PolarHBondContact O-N 2.98Å; L986-Q988 PolarHBondContact O-N 2.94Å; Q988-K991 CarbonylContact O-C 3.59Å; Q988-K991 WeakPolarHBondContact O-CA 3.49Å; Q988-K991 WeakPolarHBondContact O-CB 3.49Å; Q988-K991 PolarHBondContact O-N 3.24Å; Q988-V992 PolarHBondContact O-N 3.19Å
989	L	69.8	Low	67.6	Low	19 Å²	19	86.1 Å²	86.1	10%	0.099	42%	0.418	C	S	.	.	H	α-helix	trans	-57.9	-50.3	178.1	-77.6	163.2	0	0	0	111.3	V942 M946 L985 L986 K991 V992 Q993	V942-L989 HydrophobicContact CG1-CD1 3.95Å; V942-L989 HydrophobicContact CG1-CD2 4.47Å; M946-L989 HydrophobicContact CG-CD1 4.27Å; L985-L989 HydrophobicContact CD2-CD1 3.97Å; L985-L989 HydrophobicContact CG-CD1 4.27Å; L985-L989 PolarHBondContact O-N 3.31Å; L986-L989 PolarHBondContact O-N 3.12Å; L989-K991 PolarHBondContact O-N 3.35Å; L989-K991 VanDerWaalsContact O-N 3.13Å; L989-V992 WeakPolarHBondContact O-CA 3.27Å; L989-V992 PolarHBondContact O-N 3.15Å; L989-Q993 PolarHBondContact O-N 3.28Å
990	G	68.3	Low	65.9	Low	32 Å²	32	89.3 Å²	89.3	33%	0.33	45%	0.445	S	S	.	.	H	α-helix	trans	-60.6	-24.8	175.5	0	0	0	0	0	113.9	L986 Q994	L986-G990 PolarHBondContact O-N 3.11Å; G990-Q994 WeakPolarHBondContact O-CB 3.45Å; G990-Q994 VanDerWaalsContact O-CG 3.27Å; G990-Q994 WeakPolarHBondContact O-CG 3.38Å; G990-Q994 PolarHBondContact O-N 3.08Å
991	K	73.1	Confident	63.9	Low	112 Å²	112	91.5 Å²	91.5	49%	0.487	47%	0.468	S	S	.	.	H	α-helix	trans	-79.3	-34.7	172.2	-70.5	-179.4	-178.4	-165.9	0	112.5	T987 Q988 L989 I995	T987-K991 WeakPolarHBondContact O-CD 3.45Å; T987-K991 WeakPolarHBondContact O-CG 3.5Å; Q988-K991 CarbonylContact O-C 3.59Å; Q988-K991 WeakPolarHBondContact O-CA 3.49Å; Q988-K991 WeakPolarHBondContact O-CB 3.49Å; Q988-K991 PolarHBondContact O-N 3.24Å; L989-K991 PolarHBondContact O-N 3.35Å; L989-K991 VanDerWaalsContact O-N 3.13Å; K991-I995 WeakPolarHBondContact O-CB 3.39Å; K991-I995 WeakPolarHBondContact O-CD1 3.35Å; K991-I995 WeakPolarHBondContact O-CG1 3.17Å; K991-I995 PolarHBondContact O-N 2.99Å
992	V	66.1	Low	63.2	Low	70 Å²	70	87.1 Å²	87.1	42%	0.424	46%	0.458	S	S	.	.	H	α-helix	trans	-66.1	-42.3	171.8	176.1	0	0	0	0	110.1	Q988 L989 I995 S996	Q988-V992 PolarHBondContact O-N 3.19Å; L989-V992 WeakPolarHBondContact O-CA 3.27Å; L989-V992 PolarHBondContact O-N 3.15Å; V992-I995 CarbonylContact O-C 3.51Å; V992-I995 WeakPolarHBondContact O-CA 3.47Å; V992-I995 WeakPolarHBondContact O-CB 3.44Å; V992-I995 PolarHBondContact O-N 3.31Å; V992-I995 VanDerWaalsContact O-N 3.08Å; V992-S996 PolarHBondContact O-N 3.47Å
993	Q	60.3	Low	62.6	Low	45 Å²	45	91 Å²	91	21%	0.21	48%	0.478	C	S	.	.	H	α-helix	trans	-65.5	-39.9	175.6	-166.2	173.3	30.2	0	0	112.4	D940 L989 I995 S996 L997	D940-Q993 PolarHBondContact OD1-NE2 3.39Å; L989-Q993 PolarHBondContact O-N 3.28Å; Q993-I995 VanDerWaalsContact C-N 3.3Å; Q993-I995 PolarHBondContact O-N 3.08Å; Q993-S996 WeakPolarHBondContact CA-OG 3.33Å; Q993-S996 PolarHBondContact O-N 3.39Å; Q993-S996 PolarHBondContact O-OG 3.47Å; Q993-L997 HydrophobicContact CG-CD1 4.37Å; Q993-L997 WeakPolarHBondContact O-CB 3.18Å; Q993-L997 WeakPolarHBondContact O-CD1 3.33Å; Q993-L997 VanDerWaalsContact O-CG 3.24Å; Q993-L997 WeakPolarHBondContact O-CG 3.24Å; Q993-L997 PolarHBondContact O-N 3.43Å
994	Q	67.9	Low	62	Low	113 Å²	113	91.5 Å²	91.5	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-59.7	-41	168.7	-78.7	175.2	-15.3	0	0	111.7	G990 Y998	G990-Q994 WeakPolarHBondContact O-CB 3.45Å; G990-Q994 VanDerWaalsContact O-CG 3.27Å; G990-Q994 WeakPolarHBondContact O-CG 3.38Å; G990-Q994 PolarHBondContact O-N 3.08Å; Q994-Y998 WeakPolarHBondContact O-CB 3.47Å; Q994-Y998 WeakPolarHBondContact O-CD2 3.46Å; Q994-Y998 PolarHBondContact O-N 3.44Å
995	I	67.4	Low	61.1	Low	107 Å²	107	86.9 Å²	86.9	55%	0.549	48%	0.476	S	S	.	.	H	α-helix	trans	-69.2	-37.3	178.4	-70.3	164.2	0	0	0	112	K991 V992 Q993 Y998 S999	K991-I995 WeakPolarHBondContact O-CB 3.39Å; K991-I995 WeakPolarHBondContact O-CD1 3.35Å; K991-I995 WeakPolarHBondContact O-CG1 3.17Å; K991-I995 PolarHBondContact O-N 2.99Å; V992-I995 CarbonylContact O-C 3.51Å; V992-I995 WeakPolarHBondContact O-CA 3.47Å; V992-I995 WeakPolarHBondContact O-CB 3.44Å; V992-I995 PolarHBondContact O-N 3.31Å; V992-I995 VanDerWaalsContact O-N 3.08Å; Q993-I995 VanDerWaalsContact C-N 3.3Å; Q993-I995 PolarHBondContact O-N 3.08Å; I995-Y998 PolarHBondContact O-N 3.43Å; I995-S999 VanDerWaalsContact O-CB 3.32Å; I995-S999 WeakPolarHBondContact O-CB 3.33Å; I995-S999 PolarHBondContact O-N 3.37Å; I995-S999 PolarHBondContact O-OG 2.79Å
996	S	50.6	Low	60.3	Low	38 Å²	38	88.3 Å²	88.3	27%	0.266	48%	0.484	S	S	.	.	H	α-helix	trans	-65.7	-45.4	175	60.6	0	0	0	0	111.1	V992 Q993 Y998 S999 S1000	V992-S996 PolarHBondContact O-N 3.47Å; Q993-S996 WeakPolarHBondContact CA-OG 3.33Å; Q993-S996 PolarHBondContact O-N 3.39Å; Q993-S996 PolarHBondContact O-OG 3.47Å; S996-Y998 PolarHBondContact O-N 3.15Å; S996-S999 CarbonylContact O-C 3.6Å; S996-S999 WeakPolarHBondContact O-CA 3.31Å; S996-S999 WeakPolarHBondContact O-CB 3.37Å; S996-S999 PolarHBondContact O-N 3.46Å; S996-S1000 PolarHBondContact O-N 3.36Å
997	L	54.4	Low	59.5	Low	103 Å²	103	91.9 Å²	91.9	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-58.9	-44.7	175.4	-69	168.1	0	0	0	112	Q993 S999 S1000	Q993-L997 HydrophobicContact CG-CD1 4.37Å; Q993-L997 WeakPolarHBondContact O-CB 3.18Å; Q993-L997 WeakPolarHBondContact O-CD1 3.33Å; Q993-L997 VanDerWaalsContact O-CG 3.24Å; Q993-L997 WeakPolarHBondContact O-CG 3.24Å; Q993-L997 PolarHBondContact O-N 3.43Å; L997-S999 PolarHBondContact O-N 3.36Å; L997-S1000 PolarHBondContact O-N 3.24Å
998	Y	52.8	Low	58.3	Low	190 Å²	190	92.9 Å²	92.9	75%	0.745	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-3.4	173.2	-72	-56.6	0	0	0	114.8	Q994 I995 S996	Q994-Y998 WeakPolarHBondContact O-CB 3.47Å; Q994-Y998 WeakPolarHBondContact O-CD2 3.46Å; Q994-Y998 PolarHBondContact O-N 3.44Å; I995-Y998 PolarHBondContact O-N 3.43Å; S996-Y998 PolarHBondContact O-N 3.15Å
999	S	41.8	Very low	57.2	Low	93 Å²	93	92.5 Å²	92.5	65%	0.65	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-3.1	173.3	-57.3	0	0	0	0	112.9	I995 S996 L997	I995-S999 VanDerWaalsContact O-CB 3.32Å; I995-S999 WeakPolarHBondContact O-CB 3.33Å; I995-S999 PolarHBondContact O-N 3.37Å; I995-S999 PolarHBondContact O-OG 2.79Å; S996-S999 CarbonylContact O-C 3.6Å; S996-S999 WeakPolarHBondContact O-CA 3.31Å; S996-S999 WeakPolarHBondContact O-CB 3.37Å; S996-S999 PolarHBondContact O-N 3.46Å; L997-S999 PolarHBondContact O-N 3.36Å
1000	S	36.7	Very low	56.2	Low	104 Å²	104	98.7 Å²	98.7	73%	0.727	55%	0.545	S	S	*	.			trans	-108.3	15.4	-176.6	-169.8	0	0	0	0	113.5	S996 L997	S996-S1000 PolarHBondContact O-N 3.36Å; L997-S1000 PolarHBondContact O-N 3.24Å
1001	T	35	Very low	55.1	Low	177 Å²	177	104.7 Å²	104.7	100%	1.086	57%	0.565	S	S	*	*			trans	-124.2	0	-177.7	60.3	0	0	0	0	112.1

Retrieved 1,001 of 1,001 residues in 256.4 ms (Link to these results)

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