A0A5K4F1E2_SCHMA Loading...

Cadherin

AlphaFold DB , UniProt , Accession A0A5K4F1E2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,784 aa.

						>A0A5K4F1E2_SCHMA|A0A5K4F1E2
MQPSIGIDLYHYIYISFILTILFTINIHAQTTRIIRIKENTPIGTVIIPNIINFLYGPSYSSTEHHKNDKNTDYLLAIGNSVMQGANWFAIDDIKHSLYVKQSPDRDILCPNDPKLPDTAVSITNGGIEFPEYNLNHGSNYNIQLNNHNNIDNNDCIIKLSIIHGSSANPSFDLITVILEDINDHAPSFKEVQSNLDSKTNEFIISIPETPTIIDKKDDLSNMKHRIDHKPIRILLPTAIDLDQGVNSIKGYRLEGEDAFHFRLEIGPLINTDLNYRIHKEFQQVGLFQDHKSNRLWLVPVRNGGGTTETINNGELDKEQRSEYHFILVAYDGGSPSKMGKLPIRLIIEDINDHSPEFNQEFYTGRISENDPGGHIIFEFSARDRDNTKENGIVKFRIPGQMDQNEAKIITGQRDRISLTESQLIAAELFSIEYPYEKPNDVMNIQENLHNSTVYGRLIIKRQSKEKIQQATSKAISIARQNQIASGSKLGSNFHLHQSINNNELPSNNDQLHFFIEAYDNGLTPLVTKVPVIILITDVNDHPPEIFISYLKPTRPLNQLNLYNTDRRQIWGKITENLERSMIAQITVIDKDSTLTQSDILCKTNDSRFLLEEINNHHLDRLDDPSTSFWPRNNFYSSNNIDSKTHFIDWYNQNKPLTKMYKLMSISSLDREFSDKQPSFIKFSIICIDNQHNELPGGSLTSQADIFVEIEDTNDNSPVFDHNEYTFHLPENHPRIKSEHNINPSEIERYPIGMVHASDKDGGIHGSVTYKLVSNPSGSIQIDKFNGMLYAVQPFDREAINELIFQVHAIDCTSLNGTSERQCDESLRLTGTTNVRIIIDDLNDSPPVFQEANYHFEVEEGLDLVKVGQVWAVDADQDEAARISYRLAVGINNRIKEPVNDGNFAEQVIKSSNNQNLYDEALEITTHFQIDPRSGLIHLKGRLDRERRAHYEFVVLALDNPRSIPTKIAGYQRQTTNEVIQFTATATVLITVLDHNDNAPRILSPLNHVEFMLSPDQLIAGNTIFTIRATDPDLGENGTIEYKLLQVEDDLGSWNFAESVPRNSQLNHRNTTDTNSQMNQESKSSNVDYPFAVDRTAGICYLRENLPPLNVDGPRAYMLRILAYDLGKPDSLNTTLVIRVARQVGSNADISNGILYSNRINAKEYRQPGRIETQQYLFPSNEHDSESDVKVGTWTSAGQARISDKTMVVILSTVFILLLLTTIVLLLLVRYRRLLIRNIPLEQSLACDGPDSKANEGFAVGKPMSPTQNNLNGFNGFFTEVVTAPWVRGSTSPVVYPTPCNYPTIYNTGINRSRGCIANPNACWSPTTTLCKSPTSNHEDQRKCMQTPTTMYHSSPSHGFRILPTFGVTSSCVGVGNNRLFDSPVSSVNPSFTGLPGGFILQNYSLQDDDDDDDEGNGIFQDITPNNEINNKTMKTNNERQTLQNPKSEQLFSKSLANNLHCQNKVPEPDMTKSFSSLKRTAISLEELNDYKDEINSKNYSRLVRFQLAQSDIRENDPTHNIPISSRNEYQTLTSFHRGDDDNRLLNKTSPLFCSWMRSDQQQQPIESFLNPYDQLNCKTQLKSSKPNNNNNNSGKQNHTTTTNNNNNNNSSGGAGGGGGGHSNNNSSNIHTIFPDIFQLQPLTHSQLSDNHEISSCENLCQTDEFYMSTIKPNKKLNNNNNNTDMIFTNSSSNKLMPTLNKCNILHNNNNNNHSLPNYPTTNECTHNLSNCNLPTNDMNKSSNQKIGEEKKSKTTRHSKMVTLISPKKDSSLINDHKNDTHNI
					

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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	27.4	Very low	34.8	Very low	245 Å²	245	152.8 Å²	152.8	100%	1.207	80%	0.804	S	S	*	*				0	158.8	0	-64.9	174.3	166.7	0	0	108.4
2	Q	35.4	Very low	35.4	Very low	186 Å²	186	155.7 Å²	155.7	87%	0.869	80%	0.798	S	S	*	*			trans	-70.9	166.4	152.3	-64.7	175.8	-44.3	0	0	108.9
3	P	39.6	Very low	36.5	Very low	112 Å²	112	153.5 Å²	153.5	73%	0.727	79%	0.787	S	S	*	*			cis	-134	-169.5	-0.5	31.3	-7.4	0	0	0	113.7
4	S	30.7	Very low	37.2	Very low	89 Å²	89	154.9 Å²	154.9	62%	0.622	78%	0.779	S	S	*	*			trans	32.4	131.1	138.8	67.2	0	0	0	0	123.3
5	I	30.6	Very low	38.1	Very low	171 Å²	171	151.1 Å²	151.1	88%	0.877	76%	0.761	S	S	*	*			trans	64.6	115.2	137.6	-56.9	163.4	0	0	0	118.2
6	G	30.8	Very low	38.8	Very low	63 Å²	63	146.4 Å²	146.4	65%	0.649	75%	0.746	S	S	*	*				125.3	124.8	127.4	0	0	0	0	0	119.9
7	I	30.8	Very low	39.2	Very low	165 Å²	165	146.2 Å²	146.2	85%	0.846	74%	0.739	S	S	*	*			trans	78.1	137.2	142.3	-55.5	174.1	0	0	0	118.8
8	D	35.2	Very low	39.9	Very low	143 Å²	143	142.9 Å²	142.9	77%	0.765	72%	0.723	S	S	*	*			trans	-60.2	140.9	-176.5	-53.7	-92.3	0	0	0	116.3
9	L	35.7	Very low	40.1	Very low	137 Å²	137	141.6 Å²	141.6	72%	0.717	72%	0.717	S	S	*	*			trans	-144.5	2	157.6	-117.9	126.1	0	0	0	115.3	H11 Y12	L9-H11 PolarHBondContact O-N 3.39Å; L9-H11 VanDerWaalsContact O-N 3.07Å; L9-Y12 PolarHBondContact O-N 2.88Å
10	Y	40.7	Very low	40.4	Very low	211 Å²	211	139.1 Å²	139.1	83%	0.827	71%	0.71	S	S	*	*	H	α-helix	trans	-60.8	-20.1	179.3	-118.6	-88.6	0	0	0	113.8	Y12	Y10-Y12 VanDerWaalsContact C-N 3.34Å; Y10-Y12 PolarHBondContact O-N 3.45Å
11	H	46.4	Very low	40.7	Very low	159 Å²	159	138 Å²	138	74%	0.736	71%	0.705	S	S	*	*	H	α-helix	trans	-71.6	-20.1	178.7	-117	54.2	0	0	0	114.5	L9 I15	L9-H11 PolarHBondContact O-N 3.39Å; L9-H11 VanDerWaalsContact O-N 3.07Å; H11-I15 WeakPolarHBondContact O-CD1 3.41Å; H11-I15 WeakPolarHBondContact O-CG1 3.46Å
12	Y	42	Very low	41.4	Very low	187 Å²	187	132.7 Å²	132.7	73%	0.733	68%	0.68	S	S	*	*	H	α-helix	trans	-87.8	-33	-174.9	-132.4	-90.5	0	0	0	113.7	L9 Y10	L9-Y12 PolarHBondContact O-N 2.88Å; Y10-Y12 VanDerWaalsContact C-N 3.34Å; Y10-Y12 PolarHBondContact O-N 3.45Å
13	I	49	Very low	41.5	Very low	128 Å²	128	133 Å²	133	66%	0.656	68%	0.679	S	S	*	*	H	α-helix	trans	-76.9	-38.8	-178.6	-60.8	177.8	0	0	0	110.9	I15 S16 F17	I13-I15 VanDerWaalsContact C-N 3.28Å; I13-I15 PolarHBondContact O-N 3.3Å; I13-S16 PolarHBondContact O-N 3.1Å; I13-S16 VanDerWaalsContact O-N 3.17Å; I13-F17 PolarHBondContact O-N 3.26Å; I13-F17 VanDerWaalsContact O-N 3.12Å
14	Y	46.7	Very low	41.3	Very low	172 Å²	172	133.3 Å²	133.3	68%	0.675	68%	0.679	S	S	*	*	H	α-helix	trans	-60.9	-36.1	179.9	-150.2	-98.4	0	0	0	112.6	I18	Y14-I18 HydrophobicContact CD1-CD1 3.76Å; Y14-I18 HydrophobicContact CE1-CD1 3.79Å; Y14-I18 WeakPolarHBondContact O-CG1 3.46Å; Y14-I18 PolarHBondContact O-N 3.4Å
15	I	50	Low	41.6	Very low	99 Å²	99	137.1 Å²	137.1	51%	0.508	69%	0.691	S	S	.	*	H	α-helix	trans	-71.9	-39.1	177	-63.8	174.3	0	0	0	111.3	H11 I13 I18 L19	H11-I15 WeakPolarHBondContact O-CD1 3.41Å; H11-I15 WeakPolarHBondContact O-CG1 3.46Å; I13-I15 VanDerWaalsContact C-N 3.28Å; I13-I15 PolarHBondContact O-N 3.3Å; I15-I18 PolarHBondContact O-N 2.93Å; I15-L19 HydrophobicContact CG2-CD1 4.15Å; I15-L19 WeakPolarHBondContact O-CD1 3.44Å; I15-L19 PolarHBondContact O-N 2.75Å; I15-L19 VanDerWaalsContact O-N 3.15Å
16	S	49.3	Very low	41.7	Very low	75 Å²	75	136.3 Å²	136.3	52%	0.524	69%	0.688	S	S	.	*	H	α-helix	trans	-65.9	-39.4	179.6	-163.8	0	0	0	0	112.6	I13 L19 T20	I13-S16 PolarHBondContact O-N 3.1Å; I13-S16 VanDerWaalsContact O-N 3.17Å; S16-L19 PolarHBondContact O-N 3.08Å; S16-T20 PolarHBondContact O-N 2.76Å; S16-T20 PolarHBondContact O-OG1 3.07Å
17	F	46.2	Very low	42	Very low	143 Å²	143	140.8 Å²	140.8	63%	0.627	70%	0.695	S	S	*	*	H	α-helix	trans	-70.3	-33.6	178.7	-145.9	-96.7	0	0	0	112.5	I13 T20 I21	I13-F17 PolarHBondContact O-N 3.26Å; I13-F17 VanDerWaalsContact O-N 3.12Å; F17-T20 PolarHBondContact O-OG1 2.89Å; F17-I21 HydrophobicContact CD1-CD1 3.95Å; F17-I21 HydrophobicContact CE1-CD1 4.03Å
18	I	51	Low	42	Very low	88 Å²	88	141.9 Å²	141.9	45%	0.451	70%	0.697	S	S	.	*	H	α-helix	trans	-70.2	-34.3	174.5	-71.2	172.1	0	0	0	111.7	Y14 I15	Y14-I18 HydrophobicContact CD1-CD1 3.76Å; Y14-I18 HydrophobicContact CE1-CD1 3.79Å; Y14-I18 WeakPolarHBondContact O-CG1 3.46Å; Y14-I18 PolarHBondContact O-N 3.4Å; I15-I18 PolarHBondContact O-N 2.93Å
19	L	44.1	Very low	41.8	Very low	117 Å²	117	139.6 Å²	139.6	61%	0.613	70%	0.698	S	S	*	*	H	α-helix	trans	-72.6	-31.1	177	-98.6	76.6	0	0	0	113.9	I15 S16	I15-L19 HydrophobicContact CG2-CD1 4.15Å; I15-L19 WeakPolarHBondContact O-CD1 3.44Å; I15-L19 PolarHBondContact O-N 2.75Å; I15-L19 VanDerWaalsContact O-N 3.15Å; S16-L19 PolarHBondContact O-N 3.08Å
20	T	47.1	Very low	41.7	Very low	92 Å²	92	141.6 Å²	141.6	56%	0.564	70%	0.703	S	S	*	*	H	α-helix	trans	-77.5	-23.6	-177.1	32	0	0	0	0	114	S16 F17 L22	S16-T20 PolarHBondContact O-N 2.76Å; S16-T20 PolarHBondContact O-OG1 3.07Å; F17-T20 PolarHBondContact O-OG1 2.89Å; T20-L22 VanDerWaalsContact C-N 3.32Å
21	I	45	Very low	41.7	Very low	117 Å²	117	137.1 Å²	137.1	60%	0.6	70%	0.698	S	S	*	*	H	α-helix	trans	-77.1	-19	176.9	-66.7	171.6	0	0	0	112.2	F17 F23	F17-I21 HydrophobicContact CD1-CD1 3.95Å; F17-I21 HydrophobicContact CE1-CD1 4.03Å; I21-F23 PolarHBondContact O-N 3Å
22	L	42.7	Very low	42.1	Very low	133 Å²	133	133.6 Å²	133.6	70%	0.696	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	4.5	-170.9	-79.2	168.9	0	0	0	116.2	T20	T20-L22 VanDerWaalsContact C-N 3.32Å
23	F	37.4	Very low	43.4	Very low	191 Å²	191	128.8 Å²	128.8	84%	0.838	67%	0.668	S	S	*	*	S	Bend	trans	-130.6	4	-166.9	-123.2	-88.8	0	0	0	117.9	I21	I21-F23 PolarHBondContact O-N 3Å
24	T	36.8	Very low	44.8	Very low	120 Å²	120	125.6 Å²	125.6	74%	0.736	65%	0.652	S	S	*	*	S	Bend	trans	-126.4	-3.6	-171.4	46.2	0	0	0	0	116.9
25	I	35.5	Very low	46.5	Very low	168 Å²	168	118.5 Å²	118.5	86%	0.862	63%	0.626	S	S	*	*			trans	-117.5	83.2	172.7	-53.2	-177.8	0	0	0	110.2
26	N	33	Very low	48.2	Very low	155 Å²	155	120.6 Å²	120.6	83%	0.829	63%	0.627	S	S	*	*			trans	-153.9	68.6	168.2	-168.8	3.8	0	0	0	110.9
27	I	36.7	Very low	50.1	Low	156 Å²	156	117.5 Å²	117.5	80%	0.8	61%	0.605	S	S	*	*	S	Bend	trans	-159.5	132.7	169.2	-113.9	155.3	0	0	0	111
28	H	31.4	Very low	52.1	Low	188 Å²	188	116 Å²	116	87%	0.87	60%	0.598	S	S	*	*			trans	62.6	130.7	168.1	-73.3	61.3	0	0	0	119.1
29	A	30.6	Very low	53.8	Low	95 Å²	95	111.8 Å²	111.8	79%	0.785	58%	0.576	S	S	*	*			trans	-120.7	147.5	-179.5	0	0	0	0	0	111.2
30	Q	33.8	Very low	55.9	Low	180 Å²	180	109.9 Å²	109.9	84%	0.841	57%	0.567	S	S	*	*			trans	-169.6	85.3	144	-107	166.8	20.3	0	0	111.6	T32	Q30-T32 PolarHBondContact O-N 2.97Å
31	T	41.5	Very low	57.8	Low	117 Å²	117	106.5 Å²	106.5	72%	0.718	55%	0.546	S	S	*	.			trans	37.6	67.9	151.5	57.9	0	0	0	0	118.3
32	T	53.3	Low	59.9	Low	84 Å²	84	104.9 Å²	104.9	52%	0.515	54%	0.543	S	S	.	.			trans	-83.6	128.9	164.9	42.4	0	0	0	0	110.8	Q30 I34	Q30-T32 PolarHBondContact O-N 2.97Å; T32-I34 VanDerWaalsContact C-N 3.3Å; T32-I34 PolarHBondContact O-N 3.35Å
33	R	70	Confident	62.2	Low	86 Å²	86	104 Å²	104	33%	0.325	54%	0.538	S	S	.	.			trans	-95.9	43	-179	-60.8	179.1	179.9	170	-15.2	112.4	D173 L174 T176	R33-D173 IonicContact CZ-OD1 3.62Å; R33-D173 IonicContact CZ-OD2 2.82Å; R33-D173 IonicContact NH1-OD1 3.68Å; R33-D173 PolarHBondContact NH1-OD1 3.4Å; R33-D173 IonicContact NH1-OD2 2.66Å; R33-D173 IonicContact NH2-OD1 2.69Å; R33-D173 PolarHBondContact NH2-OD1 2.92Å; R33-D173 IonicContact NH2-OD2 3.41Å; R33-D173 PolarHBondContact NH2-OD2 3.44Å; R33-L174 WeakPolarHBondContact CB-O 3.36Å; R33-L174 VanDerWaalsContact CD-O 3.23Å; R33-L174 WeakPolarHBondContact CD-O 3.32Å; R33-T176 PolarHBondContact O-N 3.2Å
34	I	77.7	Confident	64.5	Low	62 Å²	62	96.9 Å²	96.9	32%	0.318	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.7	-179.6	-55.9	177.1	0	0	0	108.1	T32 I151 T176 I178	T32-I34 VanDerWaalsContact C-N 3.3Å; T32-I34 PolarHBondContact O-N 3.35Å; I34-I151 HydrophobicContact CD1-CD1 4.37Å; I34-I151 HydrophobicContact CD1-CG1 4.24Å; I34-T176 CarbonylContact C-O 3.45Å; I34-T176 WeakPolarHBondContact CA-O 3.4Å; I34-I178 HydrophobicContact CG2-CD1 3.71Å; I34-I178 HydrophobicContact CG2-CG1 4.2Å
35	I	83.4	Confident	67	Low	23 Å²	23	93.7 Å²	93.7	12%	0.118	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.3	-179.5	-53.7	-175.5	0	0	0	107.6	I37 I47 I48 F54 I175 T176 V177 I178	I35-I37 HydrophobicContact CG2-CD1 4.29Å; I35-I37 HydrophobicContact CG2-CG1 3.86Å; I35-I47 HydrophobicContact CD1-CG2 3.98Å; I35-I47 HydrophobicContact CG2-CG2 3.7Å; I35-I48 HydrophobicContact CD1-CD1 3.57Å; I35-I48 HydrophobicContact CD1-CG1 3.61Å; I35-F54 HydrophobicContact CD1-CE1 4.4Å; I35-F54 HydrophobicContact CD1-CZ 3.97Å; I35-F54 HydrophobicContact CG1-CZ 4.09Å; I35-I175 HydrophobicContact CD1-CG2 3.58Å; I35-I175 HydrophobicContact CG1-CG2 3.94Å; I35-T176 PolarHBondContact N-O 2.8Å; I35-V177 CarbonylContact O-C 3.53Å; I35-V177 WeakPolarHBondContact O-CA 3.39Å; I35-I178 PolarHBondContact O-N 2.85Å
36	R	86.3	Confident	69.6	Low	142 Å²	142	89.2 Å²	89.2	54%	0.536	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.8	169.9	-80.1	159.1	171.5	-87.6	-8.2	108.5	I178 E180	R36-I178 HydrophobicContact CG-CB 3.97Å; R36-I178 HydrophobicContact CG-CD1 4.2Å; R36-I178 HydrophobicContact CG-CG2 4.36Å; R36-E180 HydrophobicContact CB-CG 4.25Å; R36-E180 VanDerWaalsContact CD-OE1 3.24Å; R36-E180 WeakPolarHBondContact CD-OE1 3.44Å; R36-E180 HydrophobicContact CG-CG 4.34Å; R36-E180 WeakPolarHBondContact CG-OE1 3.25Å; R36-E180 IonicContact CZ-OE1 2.74Å; R36-E180 IonicContact NE-OE1 3.11Å; R36-E180 IonicContact NH1-OE1 2.62Å; R36-E180 PolarHBondContact NH1-OE1 3.38Å
37	I	88.3	Confident	72.1	Confident	11 Å²	11	83.4 Å²	83.4	6%	0.056	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.8	179.9	-56.4	-177.5	0	0	0	106.6	I35 T41 I47 F89 P104 V177 I178 L179 E180	I35-I37 HydrophobicContact CG2-CD1 4.29Å; I35-I37 HydrophobicContact CG2-CG1 3.86Å; I37-T41 HydrophobicContact CG2-CG2 4.09Å; I37-T41 WeakPolarHBondContact CG2-OG1 3.45Å; I37-I47 HydrophobicContact CD1-CB 4.45Å; I37-I47 HydrophobicContact CD1-CD1 3.68Å; I37-I47 HydrophobicContact CD1-CG1 3.88Å; I37-I47 HydrophobicContact CD1-CG2 3.69Å; I37-I47 HydrophobicContact CG1-CG2 4.28Å; I37-F89 HydrophobicContact CD1-CE1 3.63Å; I37-F89 HydrophobicContact CD1-CZ 3.98Å; I37-P104 HydrophobicContact CG2-CG 4.29Å; I37-V177 HydrophobicContact CB-CG1 4.15Å; I37-V177 HydrophobicContact CD1-CB 4.46Å; I37-V177 HydrophobicContact CD1-CG1 3.63Å; I37-V177 HydrophobicContact CD1-CG2 3.95Å; I37-V177 HydrophobicContact CG1-CG1 3.91Å; I37-I178 PolarHBondContact N-O 3.27Å; I37-L179 CarbonylContact O-C 3.45Å; I37-L179 WeakPolarHBondContact O-CA 3.47Å; I37-E180 PolarHBondContact O-N 2.92Å
38	K	87.9	Confident	74.4	Confident	110 Å²	110	76.2 Å²	76.2	48%	0.478	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	149.9	176.7	-57.5	-150.9	168.7	-154.9	0	111.4	T41 E180 I182	K38-T41 PolarHBondContact N-OG1 2.97Å; K38-T41 VanDerWaalsContact O-CB 3.3Å; K38-T41 WeakPolarHBondContact O-CB 3.35Å; K38-T41 PolarHBondContact O-N 2.73Å; K38-T41 PolarHBondContact O-OG1 2.85Å; K38-E180 CarbonylContact C-O 3.59Å; K38-E180 WeakPolarHBondContact CA-O 3.23Å; K38-E180 HydrophobicContact CG-CB 4.24Å; K38-I182 HydrophobicContact CB-CD1 3.97Å; K38-I182 HydrophobicContact CB-CG1 4.16Å; K38-I182 HydrophobicContact CD-CD1 4.25Å; K38-I182 HydrophobicContact CD-CG1 4.27Å
39	E	87.6	Confident	76.9	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.005	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46	150.9	155.7	178.3	150.4	-129.2	0	0	111.8	T41 R106 D107 E180 I182	E39-T41 PolarHBondContact O-N 3.43Å; E39-R106 HydrophobicContact CB-CB 4.43Å; E39-R106 WeakPolarHBondContact OE1-CA 3.41Å; E39-R106 WeakPolarHBondContact OE1-CB 3.09Å; E39-R106 PolarHBondContact OE1-N 3.14Å; E39-R106 WeakPolarHBondContact OE2-CB 3.03Å; E39-D107 PolarHBondContact OE1-N 2.89Å; E39-E180 PolarHBondContact N-O 3.4Å; E39-I182 HydrophobicContact CB-CB 4.23Å; E39-I182 HydrophobicContact CB-CG1 4.15Å; E39-I182 HydrophobicContact CG-CB 4.45Å; E39-I182 WeakPolarHBondContact O-CD1 3.44Å; E39-I182 PolarHBondContact OE2-N 2.92Å; E39-I182 VanDerWaalsContact OE2-N 3.16Å
40	N	86.9	Confident	79.5	Confident	76 Å²	76	70.4 Å²	70.4	41%	0.406	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	15.7	-175.3	-74.2	-63.8	0	0	0	115.8	P104 D184	N40-P104 PolarHBondContact N-O 3.4Å; N40-D184 PolarHBondContact ND2-OD2 3.05Å
41	T	89.1	Confident	81.8	Confident	21 Å²	21	61.9 Å²	61.9	13%	0.129	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-54.7	125.6	176.4	-70.1	0	0	0	0	110	I37 K38 E39 T45 V100	I37-T41 HydrophobicContact CG2-CG2 4.09Å; I37-T41 WeakPolarHBondContact CG2-OG1 3.45Å; K38-T41 PolarHBondContact N-OG1 2.97Å; K38-T41 VanDerWaalsContact O-CB 3.3Å; K38-T41 WeakPolarHBondContact O-CB 3.35Å; K38-T41 PolarHBondContact O-N 2.73Å; K38-T41 PolarHBondContact O-OG1 2.85Å; E39-T41 PolarHBondContact O-N 3.43Å; T41-T45 HydrophobicContact CG2-CG2 3.74Å; T41-V100 HydrophobicContact CG2-CG2 3.88Å
42	P	89	Confident	83.4	Confident	83 Å²	83	58 Å²	58	54%	0.539	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-60.2	143.1	-168.1	-28.5	35.3	0	0	0	115.1	G44 T45	P42-G44 PolarHBondContact O-N 2.64Å; P42-T45 WeakPolarHBondContact O-CB 3.44Å; P42-T45 PolarHBondContact O-N 3.45Å; P42-T45 PolarHBondContact O-OG1 3.05Å
43	I	89.1	Confident	84.6	Confident	114 Å²	114	58 Å²	58	59%	0.585	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	132	170.2	-58.4	177.4	0	0	0	109.9
44	G	86.8	Confident	85	Confident	43 Å²	43	57.2 Å²	57.2	44%	0.443	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-6.4	-174.4	0	0	0	0	0	114.8	P42 V46 V100	P42-G44 PolarHBondContact O-N 2.64Å; G44-V46 PolarHBondContact O-N 2.97Å; G44-V100 PolarHBondContact N-O 3.25Å
45	T	90.1	Very high	84.9	Confident	53 Å²	53	54.9 Å²	54.9	33%	0.325	30%	0.298	S	S	.	.			trans	-60.8	122.4	173.7	-61.5	0	0	0	0	110.1	T41 P42 Y99 V100	T41-T45 HydrophobicContact CG2-CG2 3.74Å; P42-T45 WeakPolarHBondContact O-CB 3.44Å; P42-T45 PolarHBondContact O-N 3.45Å; P42-T45 PolarHBondContact O-OG1 3.05Å; T45-Y99 CarbonylContact O-C 3.58Å; T45-Y99 VanDerWaalsContact O-CA 3.24Å; T45-Y99 WeakPolarHBondContact O-CA 3.33Å; T45-Y99 WeakPolarHBondContact O-CB 3.48Å; T45-V100 PolarHBondContact O-N 3.02Å
46	V	88.6	Confident	84.2	Confident	74 Å²	74	57 Å²	57	45%	0.448	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	115.9	176.7	177.3	0	0	0	0	109.2	G44 P49	G44-V46 PolarHBondContact O-N 2.97Å; V46-P49 HydrophobicContact CG1-CB 4.26Å
47	I	86.2	Confident	83	Confident	33 Å²	33	51 Å²	51	17%	0.169	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-43.2	-175.8	-56.7	155.1	0	0	0	110	I35 I37 F89 L98 V100	I35-I47 HydrophobicContact CD1-CG2 3.98Å; I35-I47 HydrophobicContact CG2-CG2 3.7Å; I37-I47 HydrophobicContact CD1-CB 4.45Å; I37-I47 HydrophobicContact CD1-CD1 3.68Å; I37-I47 HydrophobicContact CD1-CG1 3.88Å; I37-I47 HydrophobicContact CD1-CG2 3.69Å; I37-I47 HydrophobicContact CG1-CG2 4.28Å; I47-F89 HydrophobicContact CD1-CD1 3.3Å; I47-F89 HydrophobicContact CD1-CE1 3.47Å; I47-F89 VanDerWaalsContact CD1-CE1 3.47Å; I47-L98 HydrophobicContact CB-CD2 4.35Å; I47-L98 HydrophobicContact CD1-CD2 4.19Å; I47-L98 HydrophobicContact CD1-CG 4.24Å; I47-L98 HydrophobicContact CG2-CD2 4.33Å; I47-L98 PolarHBondContact N-O 2.82Å; I47-V100 HydrophobicContact CD1-CG2 3.78Å; I47-V100 HydrophobicContact CG1-CG2 4.03Å
48	I	85.8	Confident	81.3	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	107.2	178.2	-48.6	175.3	0	0	0	107	I35 N50 I51 F54 S97 L98 I175	I35-I48 HydrophobicContact CD1-CD1 3.57Å; I35-I48 HydrophobicContact CD1-CG1 3.61Å; I48-N50 PolarHBondContact O-N 3.23Å; I48-I51 HydrophobicContact CB-CG1 4.25Å; I48-I51 HydrophobicContact CD1-CG1 4.48Å; I48-I51 HydrophobicContact CG2-CG1 4.24Å; I48-F54 HydrophobicContact CD1-CD1 3.98Å; I48-F54 HydrophobicContact CD1-CE1 4.11Å; I48-F54 HydrophobicContact CD1-CG 4.33Å; I48-F54 HydrophobicContact CG2-CB 3.46Å; I48-F54 VanDerWaalsContact CG2-CB 3.46Å; I48-F54 HydrophobicContact CG2-CD1 4.33Å; I48-F54 HydrophobicContact CG2-CD2 4.01Å; I48-F54 HydrophobicContact CG2-CG 3.7Å; I48-S97 CarbonylContact O-C 3.56Å; I48-S97 WeakPolarHBondContact O-CA 3.49Å; I48-S97 VanDerWaalsContact O-CB 3.29Å; I48-S97 WeakPolarHBondContact O-CB 3.48Å; I48-L98 HydrophobicContact CB-CB 3.82Å; I48-L98 HydrophobicContact CD1-CB 3.93Å; I48-L98 HydrophobicContact CD1-CD2 3.61Å; I48-L98 HydrophobicContact CD1-CG 4.41Å; I48-L98 HydrophobicContact CG1-CB 3.87Å; I48-L98 HydrophobicContact CG1-CD2 3.97Å; I48-L98 PolarHBondContact N-O 2.83Å; I48-L98 PolarHBondContact O-N 2.79Å; I48-I175 HydrophobicContact CD1-CD1 3.53Å
49	P	83	Confident	79.3	Confident	103 Å²	103	56 Å²	56	67%	0.669	33%	0.334	S	S	*	.	S	Bend	trans	-69.1	-19	-174.4	26.3	-34.3	0	0	0	113.8	V46 S97	V46-P49 HydrophobicContact CG1-CB 4.26Å; P49-S97 WeakPolarHBondContact O-CB 3.34Å
50	N	84.2	Confident	77.1	Confident	59 Å²	59	63 Å²	63	32%	0.316	36%	0.361	S	S	.	.			trans	-153.8	108.8	167.6	-177	-41.3	0	0	0	109.3	I48 I52 N53 F54 H96	I48-N50 PolarHBondContact O-N 3.23Å; N50-I52 WeakPolarHBondContact OD1-CB 3.43Å; N50-I52 PolarHBondContact OD1-N 3.19Å; N50-N53 HydrophobicContact CB-CB 4.04Å; N50-N53 PolarHBondContact O-N 2.84Å; N50-N53 PolarHBondContact OD1-N 2.76Å; N50-F54 WeakPolarHBondContact O-CB 3.47Å; N50-F54 PolarHBondContact O-N 2.84Å; N50-H96 CarbonylContact C-O 3.57Å; N50-H96 WeakPolarHBondContact CA-O 3.45Å
51	I	83	Confident	74.6	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-64.3	-39.7	-178	-63.3	169	0	0	0	111.2	I48 N53 F54 L55 L76 I91 H96 L98 I162	I48-I51 HydrophobicContact CB-CG1 4.25Å; I48-I51 HydrophobicContact CD1-CG1 4.48Å; I48-I51 HydrophobicContact CG2-CG1 4.24Å; I51-N53 PolarHBondContact O-N 3.32Å; I51-F54 WeakPolarHBondContact O-CB 3.37Å; I51-F54 PolarHBondContact O-N 2.78Å; I51-F54 VanDerWaalsContact O-N 3.15Å; I51-L55 HydrophobicContact CG2-CD1 3.71Å; I51-L55 HydrophobicContact CG2-CG 4.09Å; I51-L55 WeakPolarHBondContact O-CB 3.32Å; I51-L55 WeakPolarHBondContact O-CG 3.49Å; I51-L55 PolarHBondContact O-N 3.34Å; I51-L76 HydrophobicContact CG2-CD1 4.22Å; I51-I91 HydrophobicContact CD1-CB 4.25Å; I51-I91 HydrophobicContact CD1-CD1 3.67Å; I51-I91 HydrophobicContact CD1-CG1 3.62Å; I51-I91 HydrophobicContact CD1-CG2 3.76Å; I51-H96 WeakPolarHBondContact CB-O 3.15Å; I51-H96 VanDerWaalsContact CG1-O 3.3Å; I51-H96 WeakPolarHBondContact CG1-O 3.49Å; I51-H96 PolarHBondContact N-O 2.91Å; I51-L98 HydrophobicContact CD1-CB 3.81Å; I51-L98 HydrophobicContact CD1-CD1 4.36Å; I51-L98 HydrophobicContact CG1-CB 3.94Å; I51-I162 HydrophobicContact CG2-CG2 4.03Å
52	I	75.9	Confident	72.1	Confident	36 Å²	36	67.6 Å²	67.6	19%	0.185	40%	0.4	C	S	.	.	H	α-helix	trans	-63.2	-45	-179.1	-55.9	177.2	0	0	0	109.6	N50 F54 L55 Y56 Y74 H96	N50-I52 WeakPolarHBondContact OD1-CB 3.43Å; N50-I52 PolarHBondContact OD1-N 3.19Å; I52-F54 VanDerWaalsContact C-N 3.34Å; I52-F54 PolarHBondContact O-N 2.91Å; I52-L55 PolarHBondContact O-N 3.32Å; I52-Y56 HydrophobicContact CG2-CD2 3.81Å; I52-Y56 HydrophobicContact CG2-CE2 4.27Å; I52-Y56 WeakPolarHBondContact O-CB 3.43Å; I52-Y56 WeakPolarHBondContact O-CD2 3.48Å; I52-Y56 PolarHBondContact O-N 2.79Å; I52-Y74 HydrophobicContact CD1-CD1 4.4Å; I52-Y74 HydrophobicContact CD1-CE1 3.68Å; I52-Y74 HydrophobicContact CG1-CE1 4.26Å; I52-H96 HydrophobicContact CD1-CB 4.22Å; I52-H96 HydrophobicContact CG1-CB 4.33Å
53	N	76.9	Confident	69.6	Low	83 Å²	83	69.1 Å²	69.1	44%	0.444	41%	0.408	S	S	.	.	H	α-helix	trans	-66.9	-32.5	174.8	-169.2	32.2	0	0	0	112.7	N50 I51 G57 P58	N50-N53 HydrophobicContact CB-CB 4.04Å; N50-N53 PolarHBondContact O-N 2.84Å; N50-N53 PolarHBondContact OD1-N 2.76Å; I51-N53 PolarHBondContact O-N 3.32Å; N53-G57 WeakPolarHBondContact O-CA 3.48Å; N53-G57 PolarHBondContact O-N 3.27Å; N53-P58 WeakPolarHBondContact OD1-CA 3.3Å
54	F	80.2	Confident	66.9	Low	70 Å²	70	72.1 Å²	72.1	31%	0.307	42%	0.419	S	S	.	.	H	α-helix	trans	-71	-34.7	175.4	-176.7	-95.5	0	0	0	113	I35 I48 N50 I51 I52 I175	I35-F54 HydrophobicContact CD1-CE1 4.4Å; I35-F54 HydrophobicContact CD1-CZ 3.97Å; I35-F54 HydrophobicContact CG1-CZ 4.09Å; I48-F54 HydrophobicContact CD1-CD1 3.98Å; I48-F54 HydrophobicContact CD1-CE1 4.11Å; I48-F54 HydrophobicContact CD1-CG 4.33Å; I48-F54 HydrophobicContact CG2-CB 3.46Å; I48-F54 VanDerWaalsContact CG2-CB 3.46Å; I48-F54 HydrophobicContact CG2-CD1 4.33Å; I48-F54 HydrophobicContact CG2-CD2 4.01Å; I48-F54 HydrophobicContact CG2-CG 3.7Å; N50-F54 WeakPolarHBondContact O-CB 3.47Å; N50-F54 PolarHBondContact O-N 2.84Å; I51-F54 WeakPolarHBondContact O-CB 3.37Å; I51-F54 PolarHBondContact O-N 2.78Å; I51-F54 VanDerWaalsContact O-N 3.15Å; I52-F54 VanDerWaalsContact C-N 3.34Å; I52-F54 PolarHBondContact O-N 2.91Å; F54-I175 HydrophobicContact CD1-CD1 4.02Å; F54-I175 HydrophobicContact CE1-CD1 3.87Å; F54-I175 HydrophobicContact CE1-CG1 4.24Å; F54-I175 HydrophobicContact CE1-CG2 4.43Å
55	L	75.2	Confident	64.3	Low	14 Å²	14	77.8 Å²	77.8	7%	0.073	43%	0.434	C	S	.	.	H	α-helix	trans	-84	-37.8	-179.7	-67.8	178.4	0	0	0	113.5	I51 I52 I162 D173 I175	I51-L55 HydrophobicContact CG2-CD1 3.71Å; I51-L55 HydrophobicContact CG2-CG 4.09Å; I51-L55 WeakPolarHBondContact O-CB 3.32Å; I51-L55 WeakPolarHBondContact O-CG 3.49Å; I51-L55 PolarHBondContact O-N 3.34Å; I52-L55 PolarHBondContact O-N 3.32Å; L55-I162 HydrophobicContact CD1-CB 4.42Å; L55-I162 HydrophobicContact CD1-CG2 4.01Å; L55-D173 HydrophobicContact CD1-CB 4.28Å; L55-D173 HydrophobicContact CD2-CB 3.82Å; L55-I175 HydrophobicContact CD2-CD1 4.29Å; L55-I175 HydrophobicContact CD2-CG1 4.39Å
56	Y	69	Low	61.8	Low	68 Å²	68	81.2 Å²	81.2	27%	0.267	45%	0.446	S	S	.	.	H	α-helix	trans	-105.4	-17.4	-175.3	-68.9	-74.7	0	0	0	115.1	I52 Y60 H164	I52-Y56 HydrophobicContact CG2-CD2 3.81Å; I52-Y56 HydrophobicContact CG2-CE2 4.27Å; I52-Y56 WeakPolarHBondContact O-CB 3.43Å; I52-Y56 WeakPolarHBondContact O-CD2 3.48Å; I52-Y56 PolarHBondContact O-N 2.79Å; Y56-Y60 AromaticContact CD1-CD2 3.8Å; Y56-Y60 HydrophobicContact CD1-CD2 3.8Å; Y56-Y60 AromaticContact CD1-CE2 3.6Å; Y56-Y60 HydrophobicContact CD1-CE2 3.6Å; Y56-Y60 AromaticContact CE1-CE2 3.99Å; Y56-Y60 HydrophobicContact CE1-CE2 3.99Å; Y56-Y60 AromaticContact CG-CD2 3.96Å; Y56-Y60 HydrophobicContact CG-CD2 3.96Å; Y56-Y60 HydrophobicContact CG-CE2 4.15Å; Y56-Y60 HydrophobicContact CG-CG 4.29Å; Y56-H164 AromaticContact CE2-CE1 3.54Å; Y56-H164 AromaticContact CE2-ND1 3.35Å; Y56-H164 VanDerWaalsContact CE2-ND1 3.35Å; Y56-H164 WeakPolarHBondContact CE2-ND1 3.39Å; Y56-H164 AromaticContact CZ-CE1 3.37Å; Y56-H164 AromaticContact CZ-ND1 3.46Å; Y56-H164 PolarHBondContact OH-CE1 2.89Å; Y56-H164 PolarHBondContact OH-ND1 3.03Å
57	G	59.9	Low	59.3	Low	14 Å²	14	86.2 Å²	86.2	14%	0.144	46%	0.462	C	S	.	.			trans	79.6	168.4	-177.2	0	0	0	0	0	115	N53 S59 Y60	N53-G57 WeakPolarHBondContact O-CA 3.48Å; N53-G57 PolarHBondContact O-N 3.27Å; G57-S59 PolarHBondContact O-N 2.81Å; G57-Y60 PolarHBondContact O-N 3.47Å
58	P	52.9	Low	56.8	Low	128 Å²	128	92.6 Å²	92.6	83%	0.831	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-0.8	-167.8	29.4	-37.2	0	0	0	115.5	N53	N53-P58 WeakPolarHBondContact OD1-CA 3.3Å
59	S	45.8	Very low	54.3	Low	100 Å²	100	98.1 Å²	98.1	70%	0.699	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-1.6	-179.5	45.3	0	0	0	0	114.2	G57 S61	G57-S59 PolarHBondContact O-N 2.81Å; S59-S61 PolarHBondContact O-N 3.15Å
60	Y	42.6	Very low	52.1	Low	146 Å²	146	103.2 Å²	103.2	57%	0.573	54%	0.538	S	S	*	.			trans	-80.2	76.7	-175.3	-148	-86	0	0	0	113	Y56 G57	Y56-Y60 AromaticContact CD1-CD2 3.8Å; Y56-Y60 HydrophobicContact CD1-CD2 3.8Å; Y56-Y60 AromaticContact CD1-CE2 3.6Å; Y56-Y60 HydrophobicContact CD1-CE2 3.6Å; Y56-Y60 AromaticContact CE1-CE2 3.99Å; Y56-Y60 HydrophobicContact CE1-CE2 3.99Å; Y56-Y60 AromaticContact CG-CD2 3.96Å; Y56-Y60 HydrophobicContact CG-CD2 3.96Å; Y56-Y60 HydrophobicContact CG-CE2 4.15Å; Y56-Y60 HydrophobicContact CG-CG 4.29Å; G57-Y60 PolarHBondContact O-N 3.47Å
61	S	33.7	Very low	50	Low	104 Å²	104	107.4 Å²	107.4	73%	0.727	56%	0.56	S	S	*	*			trans	-107	76.6	-176.8	55.1	0	0	0	0	113.3	S59 T63	S59-S61 PolarHBondContact O-N 3.15Å; S61-T63 VanDerWaalsContact C-N 3.32Å; S61-T63 PolarHBondContact O-N 3.03Å
62	S	35.3	Very low	48.2	Very low	91 Å²	91	110.6 Å²	110.6	64%	0.636	58%	0.58	S	S	*	*			trans	-74.3	76.7	178.7	49.3	0	0	0	0	113.4
63	T	36.7	Very low	47.4	Very low	114 Å²	114	114.3 Å²	114.3	70%	0.699	60%	0.6	S	S	*	*			trans	-65.7	149.2	149.4	46.8	0	0	0	0	109.9	S61	S61-T63 VanDerWaalsContact C-N 3.32Å; S61-T63 PolarHBondContact O-N 3.03Å
64	E	33.2	Very low	47	Very low	178 Å²	178	115.3 Å²	115.3	83%	0.832	60%	0.598	S	S	*	*	S	Bend	trans	72.7	38.7	177.4	-51.4	-161.2	145.3	0	0	118.6
65	H	32.9	Very low	46.7	Very low	162 Å²	162	115.2 Å²	115.2	75%	0.75	60%	0.6	S	S	*	*	S	Bend	trans	-151.6	165.2	131.5	-99.2	-75.9	0	0	0	109.3	K67	H65-K67 VanDerWaalsContact C-N 3.31Å; H65-K67 PolarHBondContact O-N 3.47Å
66	H	37	Very low	47.1	Very low	125 Å²	125	115.5 Å²	115.5	58%	0.579	60%	0.602	S	S	*	*	S	Bend	trans	59.4	27.7	-175.5	-51.6	-70.6	0	0	0	116.8	T72	H66-T72 PolarHBondContact CE1-OG1 3.37Å; H66-T72 WeakPolarHBondContact ND1-CB 3.34Å; H66-T72 PolarHBondContact ND1-OG1 2.95Å
67	K	36.1	Very low	47.9	Very low	178 Å²	178	113.8 Å²	113.8	77%	0.774	60%	0.602	S	S	*	*	S	Bend	trans	-106.3	62.7	153.5	-77	-172.6	177.4	177.1	0	111	H65	H65-K67 VanDerWaalsContact C-N 3.31Å; H65-K67 PolarHBondContact O-N 3.47Å
68	N	33.7	Very low	49.2	Very low	167 Å²	167	113.9 Å²	113.9	89%	0.893	60%	0.599	S	S	*	*	S	Bend	trans	-174.5	-25.5	152.5	-99	-18.9	0	0	0	114.4
69	D	32.9	Very low	50.6	Low	120 Å²	120	110 Å²	110	64%	0.642	58%	0.582	S	S	*	*			trans	-85.8	136.4	172.2	-86.6	-56.9	0	0	0	112.3	T72	D69-T72 HydrophobicContact CB-CG2 3.87Å
70	K	37.9	Very low	52.6	Low	211 Å²	211	106.9 Å²	106.9	92%	0.917	56%	0.557	S	S	*	*	S	Bend	trans	-92.4	9.4	178	-82.5	-170.5	171.4	-174.9	0	113.9
71	N	39.7	Very low	54.5	Low	147 Å²	147	102.8 Å²	102.8	79%	0.786	55%	0.55	S	S	*	*			trans	-156.6	67.7	-161.8	-154	76.8	0	0	0	113.1
72	T	45.7	Very low	56.9	Low	67 Å²	67	104.5 Å²	104.5	41%	0.411	56%	0.556	S	S	.	*			trans	-137.4	120.9	-174.5	50.1	0	0	0	0	112.5	H66 D69 Y74	H66-T72 PolarHBondContact CE1-OG1 3.37Å; H66-T72 WeakPolarHBondContact ND1-CB 3.34Å; H66-T72 PolarHBondContact ND1-OG1 2.95Å; D69-T72 HydrophobicContact CB-CG2 3.87Å; T72-Y74 PolarHBondContact O-N 3.45Å
73	D	58.9	Low	59.2	Low	114 Å²	114	104.9 Å²	104.9	61%	0.61	55%	0.549	S	S	*	.			trans	-74.7	120.1	-170.7	-50.2	-49.3	0	0	0	113.5	S167	D73-S167 PolarHBondContact O-N 2.87Å
74	Y	67.4	Low	61.4	Low	103 Å²	103	104.6 Å²	104.6	40%	0.404	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	114.1	158.5	-168.7	-83.9	0	0	0	108.3	I52 T72 L76 G165	I52-Y74 HydrophobicContact CD1-CD1 4.4Å; I52-Y74 HydrophobicContact CD1-CE1 3.68Å; I52-Y74 HydrophobicContact CG1-CE1 4.26Å; T72-Y74 PolarHBondContact O-N 3.45Å; Y74-L76 HydrophobicContact CE1-CB 4.46Å; Y74-G165 CarbonylContact C-O 3.53Å; Y74-G165 WeakPolarHBondContact CA-O 3.45Å
75	L	74.4	Confident	63.8	Low	69 Å²	69	96.1 Å²	96.1	36%	0.361	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	136	175.6	-174.4	67	0	0	0	109.5	I163 H164 G165 P170	L75-I163 HydrophobicContact CD2-CG2 3.69Å; L75-I163 HydrophobicContact CG-CG2 4.47Å; L75-H164 CarbonylContact O-C 3.56Å; L75-H164 VanDerWaalsContact O-CA 3.25Å; L75-H164 WeakPolarHBondContact O-CA 3.5Å; L75-G165 PolarHBondContact N-O 2.96Å; L75-G165 PolarHBondContact O-N 2.59Å; L75-G165 VanDerWaalsContact O-N 3.08Å; L75-P170 HydrophobicContact CD2-CB 4.13Å
76	L	83.9	Confident	66.4	Low	19 Å²	19	88.4 Å²	88.4	10%	0.099	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	119	168.7	-172.4	63	0	0	0	108.3	I51 Y74 I91 H96 I162 I163 H164	I51-L76 HydrophobicContact CG2-CD1 4.22Å; Y74-L76 HydrophobicContact CE1-CB 4.46Å; L76-I91 HydrophobicContact CD1-CD1 4.47Å; L76-I91 HydrophobicContact CD2-CG2 3.75Å; L76-I91 HydrophobicContact CG-CD1 4.06Å; L76-I91 HydrophobicContact CG-CG2 4.05Å; L76-H96 HydrophobicContact CD2-CB 3.98Å; L76-I162 HydrophobicContact CD1-CG2 4.13Å; L76-I163 CarbonylContact C-O 3.15Å; L76-I163 WeakPolarHBondContact CA-O 3.24Å; L76-H164 HydrophobicContact CD1-CB 3.76Å
77	A	85.2	Confident	68.9	Low	33 Å²	33	84.8 Å²	84.8	27%	0.273	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	159.4	-173.4	0	0	0	0	0	113.3	I162 I163	A77-I162 WeakPolarHBondContact O-CA 3.47Å; A77-I163 HydrophobicContact CB-CB 4.48Å; A77-I163 PolarHBondContact N-O 3.42Å; A77-I163 PolarHBondContact O-N 2.93Å
78	I	88.2	Confident	71.5	Confident	16 Å²	16	76.8 Å²	76.8	8%	0.082	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	104.3	168.3	-53.3	178.2	0	0	0	109	N80 S81 F89 I91 L98 S161 I162	I78-N80 VanDerWaalsContact C-N 3.27Å; I78-N80 PolarHBondContact O-N 2.6Å; I78-S81 WeakPolarHBondContact O-CB 3.36Å; I78-S81 PolarHBondContact O-N 2.88Å; I78-S81 PolarHBondContact O-OG 2.89Å; I78-F89 HydrophobicContact CD1-CB 3.95Å; I78-I91 HydrophobicContact CD1-CG1 4.17Å; I78-I91 HydrophobicContact CG1-CD1 3.79Å; I78-I91 HydrophobicContact CG1-CG1 3.84Å; I78-L98 HydrophobicContact CD1-CD1 3.77Å; I78-L98 HydrophobicContact CG1-CD1 4.43Å; I78-S161 CarbonylContact C-O 3.58Å; I78-S161 VanDerWaalsContact CA-O 3.32Å; I78-S161 WeakPolarHBondContact CA-O 3.47Å; I78-I162 HydrophobicContact CG1-CD1 4.07Å
79	G	81.4	Confident	74.3	Confident	45 Å²	45	69.1 Å²	69.1	46%	0.464	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-18.4	-173.3	0	0	0	0	0	115.3	S161	G79-S161 PolarHBondContact N-O 2.95Å
80	N	87.7	Confident	77	Confident	36 Å²	36	64.2 Å²	64.2	19%	0.193	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	26.9	176.5	72.8	-44.9	0	0	0	113.8	I78 V82 M83 A86 K159 S161	I78-N80 VanDerWaalsContact C-N 3.27Å; I78-N80 PolarHBondContact O-N 2.6Å; N80-V82 PolarHBondContact O-N 2.88Å; N80-M83 WeakPolarHBondContact O-CB 3.2Å; N80-M83 PolarHBondContact O-N 2.97Å; N80-A86 WeakPolarHBondContact O-CB 3.42Å; N80-K159 PolarHBondContact ND2-O 2.87Å; N80-S161 PolarHBondContact OD1-N 3.41Å
81	S	83.4	Confident	79.5	Confident	60 Å²	60	55.2 Å²	55.2	42%	0.42	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-2.6	-178.7	43.6	0	0	0	0	116.8	I78 N87	I78-S81 WeakPolarHBondContact O-CB 3.36Å; I78-S81 PolarHBondContact O-N 2.88Å; I78-S81 PolarHBondContact O-OG 2.89Å; S81-N87 WeakPolarHBondContact O-CA 3.23Å; S81-N87 WeakPolarHBondContact O-CB 3.37Å
82	V	83.7	Confident	81.7	Confident	139 Å²	139	49.8 Å²	49.8	84%	0.842	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-17	174.9	-171	0	0	0	0	112.3	N80	N80-V82 PolarHBondContact O-N 2.88Å
83	M	83.2	Confident	83.3	Confident	100 Å²	100	51.6 Å²	51.6	49%	0.493	29%	0.289	S	S	.	.	S	Bend	trans	-71.2	140.5	178.9	178.1	-179.6	170.3	0	0	111	N80 G85 A86 N87	N80-M83 WeakPolarHBondContact O-CB 3.2Å; N80-M83 PolarHBondContact O-N 2.97Å; M83-G85 PolarHBondContact O-N 2.91Å; M83-A86 HydrophobicContact CB-CB 3.95Å; M83-A86 WeakPolarHBondContact O-CB 3.47Å; M83-A86 PolarHBondContact O-N 3.25Å; M83-N87 PolarHBondContact O-N 2.84Å; M83-N87 PolarHBondContact O-OD1 3.34Å
84	Q	82.7	Confident	84.2	Confident	108 Å²	108	53.8 Å²	53.8	51%	0.505	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	134.1	172.3	-174.8	177.6	-17.1	0	0	110	A86 I108 L109	Q84-A86 PolarHBondContact O-N 2.77Å; Q84-I108 PolarHBondContact NE2-O 2.82Å; Q84-L109 HydrophobicContact CG-CD1 3.99Å
85	G	84	Confident	84.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-48.9	-170.4	0	0	0	0	0	113	M83 N87 W88 F89	M83-G85 PolarHBondContact O-N 2.91Å; G85-N87 VanDerWaalsContact C-N 3.27Å; G85-N87 PolarHBondContact N-OD1 3.28Å; G85-N87 PolarHBondContact O-N 2.88Å; G85-W88 WeakPolarHBondContact O-CB 3.49Å; G85-W88 PolarHBondContact O-N 3.41Å; G85-F89 WeakPolarHBondContact O-CD2 3.47Å; G85-F89 VanDerWaalsContact O-CE2 3.26Å; G85-F89 WeakPolarHBondContact O-CE2 3.29Å
86	A	86.5	Confident	85.2	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-67.5	-29.3	177.4	0	0	0	0	0	112.8	N80 M83 Q84 W88 F89 I158 L160	N80-A86 WeakPolarHBondContact O-CB 3.42Å; M83-A86 HydrophobicContact CB-CB 3.95Å; M83-A86 WeakPolarHBondContact O-CB 3.47Å; M83-A86 PolarHBondContact O-N 3.25Å; Q84-A86 PolarHBondContact O-N 2.77Å; A86-W88 PolarHBondContact O-N 2.74Å; A86-F89 PolarHBondContact O-N 2.9Å; A86-I158 HydrophobicContact CB-CG2 4.29Å; A86-L160 HydrophobicContact CB-CD2 3.76Å
87	N	89.4	Confident	85.4	Confident	49 Å²	49	54.3 Å²	54.3	26%	0.262	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-65.5	-14.2	175.3	66.6	-35.5	0	0	0	114.6	S81 M83 G85 F89	S81-N87 WeakPolarHBondContact O-CA 3.23Å; S81-N87 WeakPolarHBondContact O-CB 3.37Å; M83-N87 PolarHBondContact O-N 2.84Å; M83-N87 PolarHBondContact O-OD1 3.34Å; G85-N87 VanDerWaalsContact C-N 3.27Å; G85-N87 PolarHBondContact N-OD1 3.28Å; G85-N87 PolarHBondContact O-N 2.88Å; N87-F89 VanDerWaalsContact C-N 3.27Å
88	W	91.8	Very high	85.7	Confident	10 Å²	10	52.7 Å²	52.7	4%	0.038	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-78.2	-8.2	175.2	-59.2	-25.6	0	0	0	114.1	G85 A86 K101 Q102 P104 D105 L109 I158 L179	G85-W88 WeakPolarHBondContact O-CB 3.49Å; G85-W88 PolarHBondContact O-N 3.41Å; A86-W88 PolarHBondContact O-N 2.74Å; W88-K101 WeakPolarHBondContact O-CA 3.36Å; W88-K101 WeakPolarHBondContact O-CB 3.38Å; W88-K101 PolarHBondContact O-N 2.81Å; W88-Q102 HydrophobicContact CB-CB 4.5Å; W88-Q102 WeakPolarHBondContact CB-O 3.4Å; W88-Q102 HydrophobicContact CG-CB 4.45Å; W88-Q102 PolarHBondContact O-N 2.99Å; W88-P104 HydrophobicContact CD2-CB 4.43Å; W88-P104 VanDerWaalsContact CE3-CA 3.43Å; W88-P104 HydrophobicContact CE3-CB 3.58Å; W88-P104 HydrophobicContact CE3-CG 4.26Å; W88-P104 HydrophobicContact CZ3-CB 3.88Å; W88-D105 HydrophobicContact CH2-CB 4.28Å; W88-D105 WeakPolarHBondContact CH2-O 3.39Å; W88-D105 HydrophobicContact CZ2-CB 4.35Å; W88-L109 HydrophobicContact CH2-CB 4.17Å; W88-L109 HydrophobicContact CH2-CD2 4.46Å; W88-L109 HydrophobicContact CZ3-CD2 4.4Å; W88-I158 HydrophobicContact CE3-CD1 3.76Å; W88-I158 HydrophobicContact CZ3-CD1 3.69Å; W88-L179 HydrophobicContact CZ3-CD1 3.88Å
89	F	92	Very high	85.9	Confident	5 Å²	5	55.4 Å²	55.4	2%	0.022	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	150.4	-177.6	-55.2	-72.7	0	0	0	111.4	I37 I47 I78 G85 A86 N87 L98 Y99 V100 P104 I158 L160 V177	I37-F89 HydrophobicContact CD1-CE1 3.63Å; I37-F89 HydrophobicContact CD1-CZ 3.98Å; I47-F89 HydrophobicContact CD1-CD1 3.3Å; I47-F89 HydrophobicContact CD1-CE1 3.47Å; I47-F89 VanDerWaalsContact CD1-CE1 3.47Å; I78-F89 HydrophobicContact CD1-CB 3.95Å; G85-F89 WeakPolarHBondContact O-CD2 3.47Å; G85-F89 VanDerWaalsContact O-CE2 3.26Å; G85-F89 WeakPolarHBondContact O-CE2 3.29Å; A86-F89 PolarHBondContact O-N 2.9Å; N87-F89 VanDerWaalsContact C-N 3.27Å; F89-L98 HydrophobicContact CB-CD1 4.33Å; F89-Y99 WeakPolarHBondContact CA-O 3.24Å; F89-V100 HydrophobicContact CE1-CG2 4.32Å; F89-P104 HydrophobicContact CE1-CG 4.33Å; F89-P104 HydrophobicContact CZ-CG 4.11Å; F89-I158 HydrophobicContact CE2-CD1 3.89Å; F89-I158 HydrophobicContact CE2-CG2 4.32Å; F89-I158 HydrophobicContact CZ-CD1 4.45Å; F89-L160 HydrophobicContact CB-CD1 4.09Å; F89-L160 HydrophobicContact CB-CD2 4.49Å; F89-L160 HydrophobicContact CD2-CD1 3.89Å; F89-L160 HydrophobicContact CD2-CD2 3.68Å; F89-L160 HydrophobicContact CD2-CG 4.35Å; F89-L160 HydrophobicContact CE2-CD2 4.37Å; F89-L160 HydrophobicContact CG-CD1 3.92Å; F89-L160 HydrophobicContact CG-CD2 4.37Å; F89-V177 HydrophobicContact CE2-CG1 4.49Å; F89-V177 HydrophobicContact CZ-CG1 4.03Å; F89-V177 HydrophobicContact CZ-CG2 4.49Å
90	A	90.4	Very high	86.4	Confident	17 Å²	17	53.3 Å²	53.3	14%	0.14	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	165.3	175.6	0	0	0	0	0	110.7	L98 Y99 K101	A90-L98 WeakPolarHBondContact O-CA 3.39Å; A90-Y99 HydrophobicContact CB-CD1 4.33Å; A90-Y99 HydrophobicContact CB-CE1 3.69Å; A90-Y99 HydrophobicContact CB-CE2 4Å; A90-Y99 VanDerWaalsContact CB-CZ 3.49Å; A90-Y99 PolarHBondContact N-O 3.22Å; A90-Y99 WeakPolarHBondContact O-CD1 3.5Å; A90-Y99 PolarHBondContact O-N 3.33Å; A90-K101 HydrophobicContact CB-CB 3.93Å; A90-K101 HydrophobicContact CB-CD 4.17Å; A90-K101 HydrophobicContact CB-CG 4.43Å
91	I	90.1	Very high	86.5	Confident	22 Å²	22	57.2 Å²	57.2	11%	0.113	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.3	176.7	-58.6	179.1	0	0	0	108.1	I51 L76 I78 S97 L98 I162	I51-I91 HydrophobicContact CD1-CB 4.25Å; I51-I91 HydrophobicContact CD1-CD1 3.67Å; I51-I91 HydrophobicContact CD1-CG1 3.62Å; I51-I91 HydrophobicContact CD1-CG2 3.76Å; L76-I91 HydrophobicContact CD1-CD1 4.47Å; L76-I91 HydrophobicContact CD2-CG2 3.75Å; L76-I91 HydrophobicContact CG-CD1 4.06Å; L76-I91 HydrophobicContact CG-CG2 4.05Å; I78-I91 HydrophobicContact CD1-CG1 4.17Å; I78-I91 HydrophobicContact CG1-CD1 3.79Å; I78-I91 HydrophobicContact CG1-CG1 3.84Å; I91-S97 WeakPolarHBondContact CA-O 3.26Å; I91-L98 HydrophobicContact CG1-CD1 4.03Å; I91-I162 HydrophobicContact CD1-CD1 4.47Å
92	D	85.8	Confident	86.8	Confident	33 Å²	33	59.1 Å²	59.1	18%	0.176	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	106	165.5	-179.6	-38	0	0	0	107.5	I94 K95 H96 S97 Y99	D92-I94 PolarHBondContact O-N 3.26Å; D92-I94 WeakPolarHBondContact OD1-CA 3.15Å; D92-I94 WeakPolarHBondContact OD1-CB 3.4Å; D92-I94 PolarHBondContact OD1-N 3.24Å; D92-K95 HydrophobicContact CB-CB 4.24Å; D92-K95 PolarHBondContact O-N 2.95Å; D92-K95 PolarHBondContact OD1-N 2.97Å; D92-K95 IonicContact OD2-NZ 3.64Å; D92-K95 PolarHBondContact OD2-NZ 3.27Å; D92-H96 CarbonylContact O-C 3.53Å; D92-H96 WeakPolarHBondContact O-CA 3.47Å; D92-H96 PolarHBondContact O-N 3.43Å; D92-S97 WeakPolarHBondContact CB-OG 3.39Å; D92-S97 PolarHBondContact N-O 3.17Å; D92-S97 PolarHBondContact O-N 3.04Å; D92-Y99 HydrophobicContact CB-CD1 4.15Å; D92-Y99 HydrophobicContact CB-CE1 4.11Å
93	D	78.8	Confident	87.1	Confident	106 Å²	106	54.3 Å²	54.3	57%	0.567	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.9	-175	-58.5	-34.8	0	0	0	113.3	H96	D93-H96 PolarHBondContact O-CE1 2.8Å; D93-H96 PolarHBondContact O-ND1 3.21Å
94	I	78.3	Confident	87.4	Confident	159 Å²	159	49.6 Å²	49.6	82%	0.815	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-36.8	-178.6	-56.3	175.9	0	0	0	110.6	D92	D92-I94 PolarHBondContact O-N 3.26Å; D92-I94 WeakPolarHBondContact OD1-CA 3.15Å; D92-I94 WeakPolarHBondContact OD1-CB 3.4Å; D92-I94 PolarHBondContact OD1-N 3.24Å
95	K	79.1	Confident	87.7	Confident	133 Å²	133	46.6 Å²	46.6	58%	0.578	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-10.2	175.5	-57.5	-169.4	-164.3	85.8	0	113.3	D92 S97	D92-K95 HydrophobicContact CB-CB 4.24Å; D92-K95 PolarHBondContact O-N 2.95Å; D92-K95 PolarHBondContact OD1-N 2.97Å; D92-K95 IonicContact OD2-NZ 3.64Å; D92-K95 PolarHBondContact OD2-NZ 3.27Å; K95-S97 PolarHBondContact O-N 3.38Å
96	H	83.7	Confident	87.9	Confident	65 Å²	65	46.7 Å²	46.7	30%	0.301	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	32.8	-164.6	-53.8	-55.8	0	0	0	113.4	N50 I51 I52 L76 D92 D93	N50-H96 CarbonylContact C-O 3.57Å; N50-H96 WeakPolarHBondContact CA-O 3.45Å; I51-H96 WeakPolarHBondContact CB-O 3.15Å; I51-H96 VanDerWaalsContact CG1-O 3.3Å; I51-H96 WeakPolarHBondContact CG1-O 3.49Å; I51-H96 PolarHBondContact N-O 2.91Å; I52-H96 HydrophobicContact CD1-CB 4.22Å; I52-H96 HydrophobicContact CG1-CB 4.33Å; L76-H96 HydrophobicContact CD2-CB 3.98Å; D92-H96 CarbonylContact O-C 3.53Å; D92-H96 WeakPolarHBondContact O-CA 3.47Å; D92-H96 PolarHBondContact O-N 3.43Å; D93-H96 PolarHBondContact O-CE1 2.8Å; D93-H96 PolarHBondContact O-ND1 3.21Å
97	S	88.2	Confident	87.8	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.028	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.5	-169.4	68.9	0	0	0	0	113.3	I48 P49 I91 D92 K95	I48-S97 CarbonylContact O-C 3.56Å; I48-S97 WeakPolarHBondContact O-CA 3.49Å; I48-S97 VanDerWaalsContact O-CB 3.29Å; I48-S97 WeakPolarHBondContact O-CB 3.48Å; P49-S97 WeakPolarHBondContact O-CB 3.34Å; I91-S97 WeakPolarHBondContact CA-O 3.26Å; D92-S97 WeakPolarHBondContact CB-OG 3.39Å; D92-S97 PolarHBondContact N-O 3.17Å; D92-S97 PolarHBondContact O-N 3.04Å; K95-S97 PolarHBondContact O-N 3.38Å
98	L	90.2	Very high	87.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	128.6	172.8	-170.4	75.7	0	0	0	109.1	I47 I48 I51 I78 F89 A90 I91 L160	I47-L98 HydrophobicContact CB-CD2 4.35Å; I47-L98 HydrophobicContact CD1-CD2 4.19Å; I47-L98 HydrophobicContact CD1-CG 4.24Å; I47-L98 HydrophobicContact CG2-CD2 4.33Å; I47-L98 PolarHBondContact N-O 2.82Å; I48-L98 HydrophobicContact CB-CB 3.82Å; I48-L98 HydrophobicContact CD1-CB 3.93Å; I48-L98 HydrophobicContact CD1-CD2 3.61Å; I48-L98 HydrophobicContact CD1-CG 4.41Å; I48-L98 HydrophobicContact CG1-CB 3.87Å; I48-L98 HydrophobicContact CG1-CD2 3.97Å; I48-L98 PolarHBondContact N-O 2.83Å; I48-L98 PolarHBondContact O-N 2.79Å; I51-L98 HydrophobicContact CD1-CB 3.81Å; I51-L98 HydrophobicContact CD1-CD1 4.36Å; I51-L98 HydrophobicContact CG1-CB 3.94Å; I78-L98 HydrophobicContact CD1-CD1 3.77Å; I78-L98 HydrophobicContact CG1-CD1 4.43Å; F89-L98 HydrophobicContact CB-CD1 4.33Å; A90-L98 WeakPolarHBondContact O-CA 3.39Å; I91-L98 HydrophobicContact CG1-CD1 4.03Å; L98-L160 HydrophobicContact CD1-CD1 4.44Å; L98-L160 HydrophobicContact CD2-CD1 3.88Å
99	Y	92.5	Very high	87.2	Confident	73 Å²	73	51.8 Å²	51.8	29%	0.286	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	159.4	-179	72.8	-87.8	0	0	0	113.1	T45 F89 A90 D92 K101	T45-Y99 CarbonylContact O-C 3.58Å; T45-Y99 VanDerWaalsContact O-CA 3.24Å; T45-Y99 WeakPolarHBondContact O-CA 3.33Å; T45-Y99 WeakPolarHBondContact O-CB 3.48Å; F89-Y99 WeakPolarHBondContact CA-O 3.24Å; A90-Y99 HydrophobicContact CB-CD1 4.33Å; A90-Y99 HydrophobicContact CB-CE1 3.69Å; A90-Y99 HydrophobicContact CB-CE2 4Å; A90-Y99 VanDerWaalsContact CB-CZ 3.49Å; A90-Y99 PolarHBondContact N-O 3.22Å; A90-Y99 WeakPolarHBondContact O-CD1 3.5Å; A90-Y99 PolarHBondContact O-N 3.33Å; D92-Y99 HydrophobicContact CB-CD1 4.15Å; D92-Y99 HydrophobicContact CB-CE1 4.11Å; Y99-K101 PolarHBondContact O-N 2.73Å
100	V	92.1	Very high	86.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	114.4	174.3	179.6	0	0	0	0	110.2	T41 G44 T45 I47 F89 Q102	T41-V100 HydrophobicContact CG2-CG2 3.88Å; G44-V100 PolarHBondContact N-O 3.25Å; T45-V100 PolarHBondContact O-N 3.02Å; I47-V100 HydrophobicContact CD1-CG2 3.78Å; I47-V100 HydrophobicContact CG1-CG2 4.03Å; F89-V100 HydrophobicContact CE1-CG2 4.32Å; V100-Q102 WeakPolarHBondContact CG1-O 3.18Å
101	K	91.4	Very high	86	Confident	119 Å²	119	57.4 Å²	57.4	52%	0.517	29%	0.293	S	S	.	.	S	Bend	trans	-85.7	-33.4	175.3	176.6	-174.3	163.7	-159.6	0	112.6	W88 A90 Y99	W88-K101 WeakPolarHBondContact O-CA 3.36Å; W88-K101 WeakPolarHBondContact O-CB 3.38Å; W88-K101 PolarHBondContact O-N 2.81Å; A90-K101 HydrophobicContact CB-CB 3.93Å; A90-K101 HydrophobicContact CB-CD 4.17Å; A90-K101 HydrophobicContact CB-CG 4.43Å; Y99-K101 PolarHBondContact O-N 2.73Å
102	Q	89.7	Confident	85	Confident	100 Å²	100	58.9 Å²	58.9	47%	0.467	30%	0.301	S	S	.	.	S	Bend	trans	-142.5	140	175.9	170	179.1	-5.4	0	0	106.9	W88 V100	W88-Q102 HydrophobicContact CB-CB 4.5Å; W88-Q102 WeakPolarHBondContact CB-O 3.4Å; W88-Q102 HydrophobicContact CG-CB 4.45Å; W88-Q102 PolarHBondContact O-N 2.99Å; V100-Q102 WeakPolarHBondContact CG1-O 3.18Å
103	S	89.6	Confident	83.9	Confident	38 Å²	38	63 Å²	63	27%	0.266	32%	0.323	S	S	.	.			trans	-54.1	129.3	178.9	-54	0	0	0	0	111.1
104	P	88.7	Confident	83.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.322	C	S	.	.			trans	-68	146.5	172.9	-21.4	34.8	0	0	0	112.1	I37 N40 W88 F89 L179	I37-P104 HydrophobicContact CG2-CG 4.29Å; N40-P104 PolarHBondContact N-O 3.4Å; W88-P104 HydrophobicContact CD2-CB 4.43Å; W88-P104 VanDerWaalsContact CE3-CA 3.43Å; W88-P104 HydrophobicContact CE3-CB 3.58Å; W88-P104 HydrophobicContact CE3-CG 4.26Å; W88-P104 HydrophobicContact CZ3-CB 3.88Å; F89-P104 HydrophobicContact CE1-CG 4.33Å; F89-P104 HydrophobicContact CZ-CG 4.11Å; P104-L179 HydrophobicContact CB-CD2 3.69Å
105	D	89.1	Confident	82.7	Confident	46 Å²	46	60.9 Å²	60.9	25%	0.246	31%	0.311	C	S	.	.			trans	-135.1	115.9	-175.9	-179.1	-47.5	0	0	0	107.1	W88 D107 I108	W88-D105 HydrophobicContact CH2-CB 4.28Å; W88-D105 WeakPolarHBondContact CH2-O 3.39Å; W88-D105 HydrophobicContact CZ2-CB 4.35Å; D105-D107 PolarHBondContact OD1-N 3.25Å; D105-I108 HydrophobicContact CB-CB 4.45Å; D105-I108 WeakPolarHBondContact OD1-CB 3.27Å; D105-I108 VanDerWaalsContact OD1-CG1 3.27Å; D105-I108 WeakPolarHBondContact OD1-CG1 3.21Å; D105-I108 PolarHBondContact OD1-N 2.95Å; D105-I108 WeakPolarHBondContact OD2-CD1 3.1Å
106	R	88.3	Confident	82.5	Confident	1 Å²	1	55.7 Å²	55.7	0%	0.004	29%	0.289	C	S	.	.	S	Bend	trans	-81.1	-39.3	-174.2	-160.7	-153.1	110.4	-64.8	-23	110.2	E39 L109 C110 N112 C156 L179 D181 Q244	E39-R106 HydrophobicContact CB-CB 4.43Å; E39-R106 WeakPolarHBondContact OE1-CA 3.41Å; E39-R106 WeakPolarHBondContact OE1-CB 3.09Å; E39-R106 PolarHBondContact OE1-N 3.14Å; E39-R106 WeakPolarHBondContact OE2-CB 3.03Å; R106-L109 PolarHBondContact O-N 2.79Å; R106-C110 PolarHBondContact NH2-O 2.81Å; R106-C110 PolarHBondContact O-N 2.88Å; R106-N112 PolarHBondContact NH2-ND2 3.37Å; R106-N112 VanDerWaalsContact NH2-ND2 3.19Å; R106-C156 HydrophobicContact CG-CB 3.75Å; R106-L179 HydrophobicContact CB-CB 4.35Å; R106-L179 HydrophobicContact CB-CD1 4.36Å; R106-L179 HydrophobicContact CG-CB 3.9Å; R106-L179 HydrophobicContact CG-CD1 4.34Å; R106-D181 VanDerWaalsContact CD-OD1 3.28Å; R106-D181 WeakPolarHBondContact CD-OD1 3.47Å; R106-D181 IonicContact CZ-OD1 2.82Å; R106-D181 IonicContact NE-OD1 2.97Å; R106-D181 PolarHBondContact NE-OD1 2.81Å; R106-D181 IonicContact NH1-OD1 3.3Å; R106-D181 PolarHBondContact NH1-OD1 3.12Å; R106-Q244 VanDerWaalsContact CZ-CB 3.48Å
107	D	84.2	Confident	82	Confident	12 Å²	12	53.8 Å²	53.8	6%	0.064	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-37.7	-177.8	-83.1	-23	0	0	0	113.9	E39 D105 L109 P111 H185 L242 D243	E39-D107 PolarHBondContact OE1-N 2.89Å; D105-D107 PolarHBondContact OD1-N 3.25Å; D107-L109 VanDerWaalsContact C-N 3.28Å; D107-L109 PolarHBondContact O-N 3.33Å; D107-P111 WeakPolarHBondContact O-CA 3.45Å; D107-H185 IonicContact OD2-CE1 3.04Å; D107-H185 PolarHBondContact OD2-CE1 2.72Å; D107-H185 IonicContact OD2-ND1 2.66Å; D107-H185 PolarHBondContact OD2-ND1 2.96Å; D107-L242 HydrophobicContact CB-CB 4.41Å; D107-L242 VanDerWaalsContact OD1-C 3.3Å; D107-L242 VanDerWaalsContact OD2-C 3.29Å; D107-L242 WeakPolarHBondContact OD2-CB 3.17Å; D107-D243 PolarHBondContact OD2-N 3.36Å
108	I	84.1	Confident	81.2	Confident	111 Å²	111	60.3 Å²	60.3	57%	0.569	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-24.7	174.1	-68	-178.5	0	0	0	111.8	Q84 D105	Q84-I108 PolarHBondContact NE2-O 2.82Å; D105-I108 HydrophobicContact CB-CB 4.45Å; D105-I108 WeakPolarHBondContact OD1-CB 3.27Å; D105-I108 VanDerWaalsContact OD1-CG1 3.27Å; D105-I108 WeakPolarHBondContact OD1-CG1 3.21Å; D105-I108 PolarHBondContact OD1-N 2.95Å; D105-I108 WeakPolarHBondContact OD2-CD1 3.1Å
109	L	84.5	Confident	80.2	Confident	44 Å²	44	64.3 Å²	64.3	23%	0.23	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-35.5	179.1	-168	67.3	0	0	0	113.3	Q84 W88 R106 D107 I158 L179	Q84-L109 HydrophobicContact CG-CD1 3.99Å; W88-L109 HydrophobicContact CH2-CB 4.17Å; W88-L109 HydrophobicContact CH2-CD2 4.46Å; W88-L109 HydrophobicContact CZ3-CD2 4.4Å; R106-L109 PolarHBondContact O-N 2.79Å; D107-L109 VanDerWaalsContact C-N 3.28Å; D107-L109 PolarHBondContact O-N 3.33Å; L109-I158 HydrophobicContact CD2-CD1 3.89Å; L109-I158 HydrophobicContact CD2-CG1 3.5Å; L109-I158 VanDerWaalsContact CD2-CG1 3.5Å; L109-L179 HydrophobicContact CB-CD1 4.49Å; L109-L179 HydrophobicContact CD2-CD1 3.67Å
110	C	82.7	Confident	79.4	Confident	38 Å²	38	62.7 Å²	62.7	26%	0.257	34%	0.344	S	S	.	.	S	Bend	trans	-136	62.2	-170.7	-63	0	0	0	0	110.9	R106 N112 C156	R106-C110 PolarHBondContact NH2-O 2.81Å; R106-C110 PolarHBondContact O-N 2.88Å; C110-N112 PolarHBondContact O-N 2.94Å; C110-C156 HydrophobicContact CB-CB 3.82Å; C110-C156 WeakPolarHBondContact CB-SG 3.35Å; C110-C156 VanDerWaalsContact SG-CA 3.54Å; C110-C156 WeakPolarHBondContact SG-CB 3.3Å; C110-C156 CovalentContact SG-SG 2.04Å; C110-C156 PolarHBondContact SG-SG 3.27Å
111	P	74.8	Confident	78.9	Confident	102 Å²	102	66.8 Å²	66.8	66%	0.662	37%	0.369	S	S	*	.			trans	-62.5	136.1	-175.4	25.7	-35.4	0	0	0	112.1	D107	D107-P111 WeakPolarHBondContact O-CA 3.45Å
112	N	68.9	Low	78.2	Confident	53 Å²	53	65 Å²	65	28%	0.283	37%	0.371	S	S	.	.			trans	-84.6	147.4	-179.6	-69.5	-53.2	0	0	0	112.4	R106 C110 P114 L242 D243 Q244	R106-N112 PolarHBondContact NH2-ND2 3.37Å; R106-N112 VanDerWaalsContact NH2-ND2 3.19Å; C110-N112 PolarHBondContact O-N 2.94Å; N112-P114 WeakPolarHBondContact O-CD 3.4Å; N112-L242 PolarHBondContact ND2-O 2.6Å; N112-D243 PolarHBondContact ND2-O 3.44Å; N112-Q244 WeakPolarHBondContact ND2-CB 3.39Å
113	D	62.5	Low	77.7	Confident	118 Å²	118	62.4 Å²	62.4	63%	0.631	36%	0.36	S	S	*	.			trans	-102.8	99	-176.1	-151.7	33.2	0	0	0	108.3	K115	D113-K115 PolarHBondContact O-N 2.79Å; D113-K115 VanDerWaalsContact O-N 3.07Å; D113-K115 WeakPolarHBondContact OD2-CE 3.42Å; D113-K115 IonicContact OD2-NZ 2.96Å; D113-K115 PolarHBondContact OD2-NZ 3.19Å
114	P	64	Low	76.8	Confident	84 Å²	84	66.2 Å²	66.2	55%	0.545	38%	0.382	S	S	.	.			trans	-71.6	106.6	-164.9	27.5	-35.2	0	0	0	112	N112 I240	N112-P114 WeakPolarHBondContact O-CD 3.4Å; P114-I240 HydrophobicContact CG-CG2 4.4Å
115	K	67.4	Low	75.7	Confident	138 Å²	138	72.2 Å²	72.2	60%	0.6	41%	0.414	S	S	*	.			trans	-130.2	129.2	179.7	-74.2	165	-179.4	155.8	0	110.5	D113	D113-K115 PolarHBondContact O-N 2.79Å; D113-K115 VanDerWaalsContact O-N 3.07Å; D113-K115 WeakPolarHBondContact OD2-CE 3.42Å; D113-K115 IonicContact OD2-NZ 2.96Å; D113-K115 PolarHBondContact OD2-NZ 3.19Å
116	L	75.1	Confident	74.7	Confident	23 Å²	23	70.9 Å²	70.9	12%	0.12	41%	0.41	C	S	.	.			trans	-67.2	127.4	172.8	-74.1	178	0	0	0	110.4	F130 T238 Y252 I266 N294 L296	L116-F130 HydrophobicContact CD2-CE2 4.26Å; L116-F130 HydrophobicContact CD2-CZ 3.74Å; L116-T238 HydrophobicContact CD1-CG2 3.72Å; L116-T238 HydrophobicContact CD2-CG2 4.37Å; L116-T238 HydrophobicContact CG-CG2 4.11Å; L116-Y252 HydrophobicContact CD2-CE2 3.99Å; L116-I266 HydrophobicContact CB-CD1 4.27Å; L116-I266 HydrophobicContact CD1-CD1 4.19Å; L116-I266 HydrophobicContact CD2-CD1 4.01Å; L116-I266 HydrophobicContact CG-CD1 4.39Å; L116-N294 HydrophobicContact CB-CB 4.14Å; L116-N294 PolarHBondContact O-ND2 3.44Å; L116-L296 HydrophobicContact CD1-CB 4.17Å
117	P	74.9	Confident	74.4	Confident	26 Å²	26	70.8 Å²	70.8	17%	0.169	41%	0.41	C	S	.	.			trans	-57.9	156	176	-27	36.6	0	0	0	113.5	T119 F130	P117-T119 PolarHBondContact O-N 2.69Å; P117-F130 HydrophobicContact CG-CB 4.14Å; P117-F130 HydrophobicContact CG-CD1 4.28Å; P117-F130 HydrophobicContact CG-CD2 4.31Å; P117-F130 HydrophobicContact CG-CG 3.97Å
118	D	70.5	Confident	74.6	Confident	141 Å²	141	70.4 Å²	70.4	75%	0.754	41%	0.408	S	S	*	.	S	Bend	trans	-68.2	-15	177.7	-74.4	-25.4	0	0	0	113.6	N294	D118-N294 PolarHBondContact OD1-ND2 3.47Å
119	T	70	Confident	74.7	Confident	84 Å²	84	67.5 Å²	67.5	52%	0.515	39%	0.392	S	S	.	.			trans	-135.9	143.6	178.4	64.9	0	0	0	0	111.9	P117	P117-T119 PolarHBondContact O-N 2.69Å
120	A	75.5	Confident	74.6	Confident	38 Å²	38	66.2 Å²	66.2	31%	0.314	39%	0.385	S	S	.	.			trans	-138.7	143.5	170.9	0	0	0	0	0	110.1	I128 E129 F130 I266	A120-I128 HydrophobicContact CB-CB 3.99Å; A120-I128 HydrophobicContact CB-CD1 4.46Å; A120-I128 HydrophobicContact CB-CG2 4.28Å; A120-E129 CarbonylContact C-O 3.55Å; A120-E129 WeakPolarHBondContact CA-O 3.34Å; A120-F130 HydrophobicContact CB-CD1 3.86Å; A120-F130 HydrophobicContact CB-CE1 3.94Å; A120-I266 HydrophobicContact CB-CD1 4.16Å
121	V	81.2	Confident	74	Confident	87 Å²	87	67.2 Å²	67.2	53%	0.527	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	120.5	176.6	-177.7	0	0	0	0	107.7	I123 I128 E129 P131	V121-I123 PolarHBondContact O-N 2.88Å; V121-I128 CarbonylContact O-C 3.04Å; V121-I128 WeakPolarHBondContact O-CA 3.35Å; V121-E129 PolarHBondContact N-O 2.75Å; V121-E129 PolarHBondContact O-N 3.21Å; V121-P131 HydrophobicContact CG2-CB 4.42Å
122	S	77.5	Confident	73.2	Confident	80 Å²	80	69.1 Å²	69.1	56%	0.559	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	135	175.2	-175.3	0	0	0	0	110.7	G127	S122-G127 WeakPolarHBondContact CA-O 3.48Å; S122-G127 PolarHBondContact OG-O 3.49Å
123	I	77.7	Confident	72.5	Confident	46 Å²	46	70.1 Å²	70.1	24%	0.236	39%	0.391	C	S	.	.			trans	-115	172.3	177.9	57.3	156.5	0	0	0	111.2	V121 G127 E129 Y331	V121-I123 PolarHBondContact O-N 2.88Å; I123-G127 PolarHBondContact N-O 2.81Å; I123-G127 PolarHBondContact O-N 2.04Å; I123-E129 HydrophobicContact CD1-CG 4.05Å; I123-E129 HydrophobicContact CG1-CG 4.4Å; I123-E129 HydrophobicContact CG2-CB 4.26Å; I123-E129 HydrophobicContact CG2-CG 3.79Å; I123-Y331 WeakPolarHBondContact CD1-OH 3.17Å
124	T	71.7	Confident	71.3	Confident	118 Å²	118	72 Å²	72	72%	0.724	40%	0.401	S	S	*	.	S	Bend	trans	-50.9	148.5	174.6	49.7	0	0	0	0	112.7
125	N	64.7	Low	69.8	Low	127 Å²	127	75.4 Å²	75.4	68%	0.679	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	39.7	-179.2	-52.2	1.1	0	0	0	113.5	G127	N125-G127 PolarHBondContact O-N 2.86Å; N125-G127 VanDerWaalsContact O-N 3.1Å
126	G	67.5	Low	68	Low	17 Å²	17	76.7 Å²	76.7	18%	0.175	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	9.1	173.3	0	0	0	0	0	115	L264	G126-L264 WeakPolarHBondContact O-CB 3.1Å; G126-L264 PolarHBondContact O-N 2.88Å
127	G	82.9	Confident	65.7	Low	0 Å²	0	82.6 Å²	82.6	0%	0	45%	0.454	C	S	.	.			trans	-80.5	177.5	-179.3	0	0	0	0	0	114.3	S122 I123 N125 Y252	S122-G127 WeakPolarHBondContact CA-O 3.48Å; S122-G127 PolarHBondContact OG-O 3.49Å; I123-G127 PolarHBondContact N-O 2.81Å; I123-G127 PolarHBondContact O-N 2.04Å; N125-G127 PolarHBondContact O-N 2.86Å; N125-G127 VanDerWaalsContact O-N 3.1Å; G127-Y252 CarbonylContact C-O 3.59Å; G127-Y252 WeakPolarHBondContact CA-O 3.46Å
128	I	88.2	Confident	63.5	Low	4 Å²	4	84.9 Å²	84.9	2%	0.021	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	141	177.4	52.2	170.6	0	0	0	110.9	A120 V121 F130 G251 Y252 L264 I266 L296	A120-I128 HydrophobicContact CB-CB 3.99Å; A120-I128 HydrophobicContact CB-CD1 4.46Å; A120-I128 HydrophobicContact CB-CG2 4.28Å; V121-I128 CarbonylContact O-C 3.04Å; V121-I128 WeakPolarHBondContact O-CA 3.35Å; I128-F130 HydrophobicContact CD1-CE1 4.17Å; I128-G251 CarbonylContact O-C 3.6Å; I128-G251 WeakPolarHBondContact O-CA 3.34Å; I128-Y252 HydrophobicContact CD1-CD2 4.48Å; I128-Y252 PolarHBondContact N-O 2.86Å; I128-Y252 PolarHBondContact O-N 2.86Å; I128-L264 HydrophobicContact CD1-CB 4.14Å; I128-L264 HydrophobicContact CG1-CB 4.02Å; I128-L264 HydrophobicContact CG1-CD1 4.23Å; I128-L264 HydrophobicContact CG2-CB 4.1Å; I128-L264 WeakPolarHBondContact CG2-O 3.18Å; I128-I266 HydrophobicContact CD1-CD1 3.76Å; I128-I266 HydrophobicContact CD1-CG1 3.7Å; I128-L296 HydrophobicContact CD1-CD1 3.54Å
129	E	86.2	Confident	61.4	Low	49 Å²	49	83.7 Å²	83.7	23%	0.229	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	150.4	170.4	-70.4	-160.3	151.9	0	0	112.1	A120 V121 I123 K250 Y331	A120-E129 CarbonylContact C-O 3.55Å; A120-E129 WeakPolarHBondContact CA-O 3.34Å; V121-E129 PolarHBondContact N-O 2.75Å; V121-E129 PolarHBondContact O-N 3.21Å; I123-E129 HydrophobicContact CD1-CG 4.05Å; I123-E129 HydrophobicContact CG1-CG 4.4Å; I123-E129 HydrophobicContact CG2-CB 4.26Å; I123-E129 HydrophobicContact CG2-CG 3.79Å; E129-K250 WeakPolarHBondContact CA-O 3.44Å; E129-K250 IonicContact OE1-NZ 3.89Å; E129-K250 PolarHBondContact OE1-NZ 2.78Å; E129-K250 IonicContact OE2-NZ 3.11Å; E129-K250 PolarHBondContact OE2-NZ 3.03Å; E129-Y331 VanDerWaalsContact CD-OH 3.29Å; E129-Y331 WeakPolarHBondContact CG-OH 3.18Å; E129-Y331 VanDerWaalsContact OE1-CE2 3.32Å; E129-Y331 WeakPolarHBondContact OE1-CE2 3.18Å; E129-Y331 PolarHBondContact OE1-OH 3.46Å
130	F	83.7	Confident	59.2	Low	17 Å²	17	86.6 Å²	86.6	8%	0.075	50%	0.498	C	S	.	.			trans	-94.6	124.2	179.8	-53.5	-34.6	0	0	0	110.7	L116 P117 A120 I128 E132 I249 K250 Y252 I266	L116-F130 HydrophobicContact CD2-CE2 4.26Å; L116-F130 HydrophobicContact CD2-CZ 3.74Å; P117-F130 HydrophobicContact CG-CB 4.14Å; P117-F130 HydrophobicContact CG-CD1 4.28Å; P117-F130 HydrophobicContact CG-CD2 4.31Å; P117-F130 HydrophobicContact CG-CG 3.97Å; A120-F130 HydrophobicContact CB-CD1 3.86Å; A120-F130 HydrophobicContact CB-CE1 3.94Å; I128-F130 HydrophobicContact CD1-CE1 4.17Å; F130-E132 VanDerWaalsContact C-N 3.29Å; F130-E132 PolarHBondContact O-N 3Å; F130-I249 WeakPolarHBondContact CD2-O 3.36Å; F130-I249 HydrophobicContact CE2-CG2 4.05Å; F130-K250 PolarHBondContact N-O 2.83Å; F130-Y252 HydrophobicContact CE2-CD2 4.2Å; F130-Y252 AromaticContact CE2-CE2 3.97Å; F130-Y252 HydrophobicContact CE2-CE2 3.97Å; F130-Y252 AromaticContact CZ-CD2 3.72Å; F130-Y252 HydrophobicContact CZ-CD2 3.72Å; F130-Y252 AromaticContact CZ-CE2 3.73Å; F130-Y252 HydrophobicContact CZ-CE2 3.73Å; F130-I266 HydrophobicContact CD1-CD1 4.45Å; F130-I266 HydrophobicContact CE1-CD1 3.46Å; F130-I266 VanDerWaalsContact CE1-CD1 3.46Å; F130-I266 HydrophobicContact CZ-CD1 3.96Å
131	P	69	Low	56.9	Low	60 Å²	60	94.7 Å²	94.7	39%	0.39	52%	0.522	S	S	.	.			trans	-76.9	-11.5	-175.3	30.2	-34.8	0	0	0	114.1	V121 Y133	V121-P131 HydrophobicContact CG2-CB 4.42Å; P131-Y133 VanDerWaalsContact C-N 3.31Å; P131-Y133 PolarHBondContact O-N 3.48Å
132	E	58.1	Low	54.2	Low	141 Å²	141	96.8 Å²	96.8	66%	0.659	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	58.7	-171.1	-63.5	-165.4	124.5	0	0	114.2	F130	F130-E132 VanDerWaalsContact C-N 3.29Å; F130-E132 PolarHBondContact O-N 3Å
133	Y	54	Low	51.6	Low	75 Å²	75	99.9 Å²	99.9	29%	0.294	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	12.8	167.9	-70.1	-59	0	0	0	114.5	P131 G245 V246 I249 K250	P131-Y133 VanDerWaalsContact C-N 3.31Å; P131-Y133 PolarHBondContact O-N 3.48Å; Y133-G245 WeakPolarHBondContact CE1-O 3.49Å; Y133-V246 HydrophobicContact CD1-CG2 4.41Å; Y133-I249 PolarHBondContact OH-O 2.96Å; Y133-K250 HydrophobicContact CE2-CB 4.46Å
134	N	38.5	Very low	49.2	Very low	156 Å²	156	106.4 Å²	106.4	83%	0.834	57%	0.568	S	S	*	*			trans	-90.9	117.1	173	-86.8	-62.3	0	0	0	112	N136	N134-N136 PolarHBondContact O-N 2.73Å
135	L	31.5	Very low	46.9	Very low	157 Å²	157	107.9 Å²	107.9	82%	0.822	57%	0.571	S	S	*	*			trans	-61.1	108.8	165.6	-76.4	151.8	0	0	0	110.8
136	N	29.5	Very low	45.1	Very low	165 Å²	165	108.9 Å²	108.9	88%	0.882	58%	0.576	S	S	*	*			trans	-165.9	137.6	148.8	-98.1	-47.6	0	0	0	111.8	N134	N134-N136 PolarHBondContact O-N 2.73Å
137	H	27.4	Very low	43.3	Very low	146 Å²	146	114.9 Å²	114.9	68%	0.676	60%	0.604	S	S	*	*			trans	-67.4	158.6	166.3	-79.1	-100.5	0	0	0	111.1	D152	H137-D152 IonicContact CD2-OD1 3.85Å; H137-D152 IonicContact CE1-OD1 3.89Å; H137-D152 PolarHBondContact CE1-OD1 3.36Å; H137-D152 IonicContact NE2-OD1 2.75Å; H137-D152 PolarHBondContact NE2-OD1 3.16Å; H137-D152 IonicContact NE2-OD2 3.29Å
138	G	27.6	Very low	41.1	Very low	75 Å²	75	124.3 Å²	124.3	77%	0.773	65%	0.648	S	S	*	*			trans	155.1	80.2	156.5	0	0	0	0	0	117.7
139	S	26.3	Very low	38.9	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	67%	0.673	S	S	*	*	S	Bend	trans	-61.6	166.1	138.9	57.8	0	0	0	0	110.1
140	N	24.1	Very low	36.9	Very low	146 Å²	146	133.5 Å²	133.5	78%	0.781	70%	0.698	S	S	*	*	S	Bend	trans	-30.5	147.9	174.8	-68.5	-41.1	0	0	0	116.5
141	Y	27.8	Very low	35.4	Very low	208 Å²	208	135.7 Å²	135.7	82%	0.816	71%	0.71	S	S	*	*			trans	98.8	109	169.1	-64.5	-80.4	0	0	0	118.6
142	N	23.9	Very low	34.9	Very low	130 Å²	130	135.7 Å²	135.7	70%	0.695	71%	0.707	S	S	*	*				37.8	122.7	129.4	-62.9	-12.4	0	0	0	121.6
143	I	24.3	Very low	34.9	Very low	145 Å²	145	137 Å²	137	74%	0.744	72%	0.719	S	S	*	*				37.4	103.6	123.1	-36.8	165	0	0	0	116.8
144	Q	25.4	Very low	35.4	Very low	184 Å²	184	139.5 Å²	139.5	86%	0.86	74%	0.737	S	S	*	*				-174.7	156.7	115.3	-100.8	171.9	19.5	0	0	112.1
145	L	25.2	Very low	37.1	Very low	149 Å²	149	134 Å²	134	78%	0.78	71%	0.708	S	S	*	*			trans	-80.7	148.9	173.2	-64	75.2	0	0	0	109.9
146	N	25.8	Very low	39.6	Very low	147 Å²	147	126.8 Å²	126.8	79%	0.786	67%	0.67	S	S	*	*			trans	141.1	157.7	140.2	-70.9	-35.4	0	0	0	114.5
147	N	29.9	Very low	42.2	Very low	144 Å²	144	121.9 Å²	121.9	77%	0.77	64%	0.643	S	S	*	*			trans	76.3	114.1	167	-61.4	-17.3	0	0	0	118.7	N149	N147-N149 PolarHBondContact O-N 2.95Å
148	H	37.2	Very low	45	Very low	198 Å²	198	115 Å²	115	92%	0.917	61%	0.611	S	S	*	*	S	Bend	trans	-76.6	26.6	-176.4	-113.4	-54	0	0	0	115.3
149	N	41.8	Very low	47.7	Very low	104 Å²	104	115.9 Å²	115.9	56%	0.556	59%	0.594	S	S	*	*			trans	-113.5	5.3	-158.8	-75.4	-6.4	0	0	0	116.7	N147	N147-N149 PolarHBondContact O-N 2.95Å
150	N	44.9	Very low	50.7	Low	141 Å²	141	110.4 Å²	110.4	75%	0.754	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-80.1	133.6	174.3	-86.1	7.2	0	0	0	111.6
151	I	50.7	Low	53.7	Low	63 Å²	63	104.9 Å²	104.9	32%	0.323	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-94.1	129.4	154.8	-63	167.1	0	0	0	104.6	I34 D155 I157 T176	I34-I151 HydrophobicContact CD1-CD1 4.37Å; I34-I151 HydrophobicContact CD1-CG1 4.24Å; I151-D155 HydrophobicContact CG2-CB 3.98Å; I151-I157 HydrophobicContact CG2-CG2 4.05Å; I151-T176 HydrophobicContact CD1-CG2 4.15Å
152	D	59.9	Low	56.6	Low	60 Å²	60	95 Å²	95	32%	0.321	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-80.4	149.6	178	-86.9	-37.4	0	0	0	110.8	H137 N154 D155	H137-D152 IonicContact CD2-OD1 3.85Å; H137-D152 IonicContact CE1-OD1 3.89Å; H137-D152 PolarHBondContact CE1-OD1 3.36Å; H137-D152 IonicContact NE2-OD1 2.75Å; H137-D152 PolarHBondContact NE2-OD1 3.16Å; H137-D152 IonicContact NE2-OD2 3.29Å; D152-N154 PolarHBondContact O-N 3.33Å; D152-D155 PolarHBondContact N-OD2 2.73Å; D152-D155 WeakPolarHBondContact O-CB 3.05Å; D152-D155 PolarHBondContact O-N 2.84Å
153	N	57.7	Low	59.5	Low	169 Å²	169	90.3 Å²	90.3	90%	0.904	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-12.5	-178.4	-78.6	-18.9	0	0	0	114.1
154	N	64.8	Low	62.2	Low	128 Å²	128	83.5 Å²	83.5	68%	0.684	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-2.3	179.5	-62.8	5.5	0	0	0	113.1	D152 C156	D152-N154 PolarHBondContact O-N 3.33Å; N154-C156 PolarHBondContact O-N 3.47Å
155	D	73.2	Confident	64.6	Low	41 Å²	41	75 Å²	75	22%	0.219	39%	0.391	C	S	.	.			trans	-67.2	126.7	177.1	-79.4	-36.5	0	0	0	110.6	I151 D152 I157 I178	I151-D155 HydrophobicContact CG2-CB 3.98Å; D152-D155 PolarHBondContact N-OD2 2.73Å; D152-D155 WeakPolarHBondContact O-CB 3.05Å; D152-D155 PolarHBondContact O-N 2.84Å; D155-I157 HydrophobicContact CB-CG2 3.97Å; D155-I157 PolarHBondContact O-N 2.99Å; D155-I157 VanDerWaalsContact O-N 3.14Å; D155-I178 HydrophobicContact CB-CG2 4.36Å
156	C	83.4	Confident	66.9	Low	5 Å²	5	70.6 Å²	70.6	3%	0.034	37%	0.373	C	S	.	.			trans	-75.3	103.3	174.7	-171.1	0	0	0	0	110.4	R106 C110 N154 L179	R106-C156 HydrophobicContact CG-CB 3.75Å; C110-C156 HydrophobicContact CB-CB 3.82Å; C110-C156 WeakPolarHBondContact CB-SG 3.35Å; C110-C156 VanDerWaalsContact SG-CA 3.54Å; C110-C156 WeakPolarHBondContact SG-CB 3.3Å; C110-C156 CovalentContact SG-SG 2.04Å; C110-C156 PolarHBondContact SG-SG 3.27Å; N154-C156 PolarHBondContact O-N 3.47Å; C156-L179 HydrophobicContact CB-CB 4.28Å; C156-L179 PolarHBondContact O-N 3.19Å
157	I	84.4	Confident	68.9	Low	61 Å²	61	67 Å²	67	31%	0.313	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	131.5	-167.1	52.8	171.7	0	0	0	115.2	I151 D155 T176 V177 I178	I151-I157 HydrophobicContact CG2-CG2 4.05Å; D155-I157 HydrophobicContact CB-CG2 3.97Å; D155-I157 PolarHBondContact O-N 2.99Å; D155-I157 VanDerWaalsContact O-N 3.14Å; I157-T176 HydrophobicContact CG2-CG2 4.22Å; I157-V177 WeakPolarHBondContact CA-O 3.11Å; I157-I178 HydrophobicContact CG2-CG1 4.07Å
158	I	86.2	Confident	71	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.9	166.6	-59.1	166.6	0	0	0	108.2	A86 W88 F89 L109 L160 V177 L179	A86-I158 HydrophobicContact CB-CG2 4.29Å; W88-I158 HydrophobicContact CE3-CD1 3.76Å; W88-I158 HydrophobicContact CZ3-CD1 3.69Å; F89-I158 HydrophobicContact CE2-CD1 3.89Å; F89-I158 HydrophobicContact CE2-CG2 4.32Å; F89-I158 HydrophobicContact CZ-CD1 4.45Å; L109-I158 HydrophobicContact CD2-CD1 3.89Å; L109-I158 HydrophobicContact CD2-CG1 3.5Å; L109-I158 VanDerWaalsContact CD2-CG1 3.5Å; I158-L160 HydrophobicContact CG2-CD2 3.74Å; I158-L160 HydrophobicContact CG2-CG 4.4Å; I158-V177 HydrophobicContact CB-CB 4.23Å; I158-V177 PolarHBondContact N-O 3.15Å; I158-V177 PolarHBondContact O-N 2.66Å; I158-L179 HydrophobicContact CD1-CD1 3.98Å; I158-L179 HydrophobicContact CD1-CD2 3.94Å; I158-L179 HydrophobicContact CD1-CG 4.05Å
159	K	85.6	Confident	72.8	Confident	95 Å²	95	60.9 Å²	60.9	41%	0.413	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	113.2	175.5	-74.4	169.1	177.5	166.9	0	109.2	N80 L174	N80-K159 PolarHBondContact ND2-O 2.87Å; K159-L174 HydrophobicContact CB-CD1 4.24Å; K159-L174 HydrophobicContact CB-CD2 4.3Å; K159-L174 HydrophobicContact CB-CG 4.42Å; K159-L174 HydrophobicContact CD-CD2 4.21Å; K159-L174 HydrophobicContact CG-CD2 4.2Å
160	L	87.9	Confident	74.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	122.1	177.2	-54.9	-179.2	0	0	0	109.6	A86 F89 L98 I158 I162 L174 I175 V177	A86-L160 HydrophobicContact CB-CD2 3.76Å; F89-L160 HydrophobicContact CB-CD1 4.09Å; F89-L160 HydrophobicContact CB-CD2 4.49Å; F89-L160 HydrophobicContact CD2-CD1 3.89Å; F89-L160 HydrophobicContact CD2-CD2 3.68Å; F89-L160 HydrophobicContact CD2-CG 4.35Å; F89-L160 HydrophobicContact CE2-CD2 4.37Å; F89-L160 HydrophobicContact CG-CD1 3.92Å; F89-L160 HydrophobicContact CG-CD2 4.37Å; L98-L160 HydrophobicContact CD1-CD1 4.44Å; L98-L160 HydrophobicContact CD2-CD1 3.88Å; I158-L160 HydrophobicContact CG2-CD2 3.74Å; I158-L160 HydrophobicContact CG2-CG 4.4Å; L160-I162 HydrophobicContact CB-CD1 4.33Å; L160-L174 WeakPolarHBondContact O-CA 3.23Å; L160-I175 HydrophobicContact CB-CB 4.45Å; L160-I175 PolarHBondContact N-O 2.7Å; L160-I175 PolarHBondContact O-N 2.77Å; L160-V177 HydrophobicContact CD1-CG2 3.92Å; L160-V177 HydrophobicContact CG-CG2 4.33Å
161	S	88.3	Confident	76	Confident	29 Å²	29	53.9 Å²	53.9	20%	0.203	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	117.4	169	-179.4	0	0	0	0	108.9	I78 G79 N80 D173	I78-S161 CarbonylContact C-O 3.58Å; I78-S161 VanDerWaalsContact CA-O 3.32Å; I78-S161 WeakPolarHBondContact CA-O 3.47Å; G79-S161 PolarHBondContact N-O 2.95Å; N80-S161 PolarHBondContact OD1-N 3.41Å; S161-D173 WeakPolarHBondContact CA-O 3.05Å
162	I	87.4	Confident	77.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120	175.8	-51.5	-57	0	0	0	108.6	I51 L55 L76 A77 I78 I91 L160 F172 D173 I175	I51-I162 HydrophobicContact CG2-CG2 4.03Å; L55-I162 HydrophobicContact CD1-CB 4.42Å; L55-I162 HydrophobicContact CD1-CG2 4.01Å; L76-I162 HydrophobicContact CD1-CG2 4.13Å; A77-I162 WeakPolarHBondContact O-CA 3.47Å; I78-I162 HydrophobicContact CG1-CD1 4.07Å; I91-I162 HydrophobicContact CD1-CD1 4.47Å; L160-I162 HydrophobicContact CB-CD1 4.33Å; I162-F172 WeakPolarHBondContact O-CA 3.28Å; I162-D173 PolarHBondContact N-O 3.15Å; I162-D173 PolarHBondContact O-N 3.38Å; I162-I175 HydrophobicContact CD1-CD1 4.37Å; I162-I175 HydrophobicContact CG1-CD1 3.7Å; I162-I175 HydrophobicContact CG1-CG1 3.97Å
163	I	85.3	Confident	78.6	Confident	32 Å²	32	55.8 Å²	55.8	16%	0.164	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.1	169.9	-40.2	-177.9	0	0	0	107.2	L75 L76 A77 P170 S171 F172	L75-I163 HydrophobicContact CD2-CG2 3.69Å; L75-I163 HydrophobicContact CG-CG2 4.47Å; L76-I163 CarbonylContact C-O 3.15Å; L76-I163 WeakPolarHBondContact CA-O 3.24Å; A77-I163 HydrophobicContact CB-CB 4.48Å; A77-I163 PolarHBondContact N-O 3.42Å; A77-I163 PolarHBondContact O-N 2.93Å; I163-P170 HydrophobicContact CG2-CB 3.99Å; I163-S171 WeakPolarHBondContact CA-O 3.42Å; I163-F172 HydrophobicContact CB-CD1 4.48Å; I163-F172 HydrophobicContact CB-CE1 4.35Å; I163-F172 HydrophobicContact CD1-CD1 4.48Å; I163-F172 HydrophobicContact CD1-CE1 3.76Å; I163-F172 HydrophobicContact CD1-CZ 4.46Å; I163-F172 HydrophobicContact CG1-CD1 3.9Å; I163-F172 HydrophobicContact CG1-CE1 3.67Å; I163-F172 HydrophobicContact CG2-CD1 4.31Å; I163-F172 HydrophobicContact CG2-CE1 3.95Å; I163-F172 HydrophobicContact CG2-CZ 4.07Å
164	H	81.8	Confident	79.8	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.009	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	155.7	-179.3	65.7	103.1	0	0	0	113	Y56 L75 L76 S171 D173	Y56-H164 AromaticContact CE2-CE1 3.54Å; Y56-H164 AromaticContact CE2-ND1 3.35Å; Y56-H164 VanDerWaalsContact CE2-ND1 3.35Å; Y56-H164 WeakPolarHBondContact CE2-ND1 3.39Å; Y56-H164 AromaticContact CZ-CE1 3.37Å; Y56-H164 AromaticContact CZ-ND1 3.46Å; Y56-H164 PolarHBondContact OH-CE1 2.89Å; Y56-H164 PolarHBondContact OH-ND1 3.03Å; L75-H164 CarbonylContact O-C 3.56Å; L75-H164 VanDerWaalsContact O-CA 3.25Å; L75-H164 WeakPolarHBondContact O-CA 3.5Å; L76-H164 HydrophobicContact CD1-CB 3.76Å; H164-S171 PolarHBondContact N-O 3.36Å; H164-S171 WeakPolarHBondContact O-CA 3.41Å; H164-S171 WeakPolarHBondContact O-CB 3.1Å; H164-S171 PolarHBondContact O-N 2.83Å; H164-D173 IonicContact CD2-OD2 3.8Å; H164-D173 IonicContact CE1-OD2 3.43Å; H164-D173 PolarHBondContact CE1-OD2 3.34Å; H164-D173 IonicContact NE2-OD2 2.73Å; H164-D173 PolarHBondContact NE2-OD2 3.25Å
165	G	75.7	Confident	80.9	Confident	6 Å²	6	45.5 Å²	45.5	6%	0.062	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	120.5	-159.9	175.8	0	0	0	0	0	112.9	Y74 L75	Y74-G165 CarbonylContact C-O 3.53Å; Y74-G165 WeakPolarHBondContact CA-O 3.45Å; L75-G165 PolarHBondContact N-O 2.96Å; L75-G165 PolarHBondContact O-N 2.59Å; L75-G165 VanDerWaalsContact O-N 3.08Å
166	S	72.6	Confident	81.5	Confident	56 Å²	56	44.2 Å²	44.2	39%	0.392	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	149.1	176.2	179	0	0	0	0	111	A168 N169	S166-A168 PolarHBondContact O-N 3.17Å; S166-A168 VanDerWaalsContact O-N 3.1Å; S166-A168 PolarHBondContact OG-N 3.42Å; S166-N169 CarbonylContact O-C 3.49Å; S166-N169 PolarHBondContact O-N 3.24Å
167	S	69	Low	81.6	Confident	72 Å²	72	44 Å²	44	50%	0.503	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-24	168.3	59.2	0	0	0	0	113.6	D73	D73-S167 PolarHBondContact O-N 2.87Å
168	A	73.7	Confident	81.7	Confident	91 Å²	91	41.3 Å²	41.3	75%	0.752	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-12.5	174.9	0	0	0	0	0	114.7	S166	S166-A168 PolarHBondContact O-N 3.17Å; S166-A168 VanDerWaalsContact O-N 3.1Å; S166-A168 PolarHBondContact OG-N 3.42Å
169	N	73.8	Confident	81.8	Confident	122 Å²	122	41.6 Å²	41.6	65%	0.652	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-154.4	75.2	179.7	-171.2	28.2	0	0	0	111.1	S166	S166-N169 CarbonylContact O-C 3.49Å; S166-N169 PolarHBondContact O-N 3.24Å
170	P	76.8	Confident	81.8	Confident	53 Å²	53	39.7 Å²	39.7	34%	0.344	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	126.3	179.6	30.5	-34.3	0	0	0	112	L75 I163	L75-P170 HydrophobicContact CD2-CB 4.13Å; I163-P170 HydrophobicContact CG2-CB 3.99Å
171	S	78.3	Confident	81.6	Confident	45 Å²	45	41 Å²	41	32%	0.315	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	152.3	168.3	-64.8	0	0	0	0	110.8	I163 H164	I163-S171 WeakPolarHBondContact CA-O 3.42Å; H164-S171 PolarHBondContact N-O 3.36Å; H164-S171 WeakPolarHBondContact O-CA 3.41Å; H164-S171 WeakPolarHBondContact O-CB 3.1Å; H164-S171 PolarHBondContact O-N 2.83Å
172	F	82.1	Confident	81.5	Confident	131 Å²	131	42.3 Å²	42.3	58%	0.575	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.7	177.1	-67.3	-98.6	0	0	0	109.7	I162 I163	I162-F172 WeakPolarHBondContact O-CA 3.28Å; I163-F172 HydrophobicContact CB-CD1 4.48Å; I163-F172 HydrophobicContact CB-CE1 4.35Å; I163-F172 HydrophobicContact CD1-CD1 4.48Å; I163-F172 HydrophobicContact CD1-CE1 3.76Å; I163-F172 HydrophobicContact CD1-CZ 4.46Å; I163-F172 HydrophobicContact CG1-CD1 3.9Å; I163-F172 HydrophobicContact CG1-CE1 3.67Å; I163-F172 HydrophobicContact CG2-CD1 4.31Å; I163-F172 HydrophobicContact CG2-CE1 3.95Å; I163-F172 HydrophobicContact CG2-CZ 4.07Å
173	D	83	Confident	81.6	Confident	32 Å²	32	43.3 Å²	43.3	17%	0.171	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	160	174.1	-79.7	-38.9	0	0	0	111.5	R33 L55 S161 I162 H164	R33-D173 IonicContact CZ-OD1 3.62Å; R33-D173 IonicContact CZ-OD2 2.82Å; R33-D173 IonicContact NH1-OD1 3.68Å; R33-D173 PolarHBondContact NH1-OD1 3.4Å; R33-D173 IonicContact NH1-OD2 2.66Å; R33-D173 IonicContact NH2-OD1 2.69Å; R33-D173 PolarHBondContact NH2-OD1 2.92Å; R33-D173 IonicContact NH2-OD2 3.41Å; R33-D173 PolarHBondContact NH2-OD2 3.44Å; L55-D173 HydrophobicContact CD1-CB 4.28Å; L55-D173 HydrophobicContact CD2-CB 3.82Å; S161-D173 WeakPolarHBondContact CA-O 3.05Å; I162-D173 PolarHBondContact N-O 3.15Å; I162-D173 PolarHBondContact O-N 3.38Å; H164-D173 IonicContact CD2-OD2 3.8Å; H164-D173 IonicContact CE1-OD2 3.43Å; H164-D173 PolarHBondContact CE1-OD2 3.34Å; H164-D173 IonicContact NE2-OD2 2.73Å; H164-D173 PolarHBondContact NE2-OD2 3.25Å
174	L	83.6	Confident	81.7	Confident	81 Å²	81	45 Å²	45	42%	0.424	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.6	177.6	-157.4	79.6	0	0	0	110.3	R33 K159 L160	R33-L174 WeakPolarHBondContact CB-O 3.36Å; R33-L174 VanDerWaalsContact CD-O 3.23Å; R33-L174 WeakPolarHBondContact CD-O 3.32Å; K159-L174 HydrophobicContact CB-CD1 4.24Å; K159-L174 HydrophobicContact CB-CD2 4.3Å; K159-L174 HydrophobicContact CB-CG 4.42Å; K159-L174 HydrophobicContact CD-CD2 4.21Å; K159-L174 HydrophobicContact CG-CD2 4.2Å; L160-L174 WeakPolarHBondContact O-CA 3.23Å
175	I	86.5	Confident	81.9	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121	170.8	-57.3	-175.9	0	0	0	107.6	I35 I48 F54 L55 L160 I162	I35-I175 HydrophobicContact CD1-CG2 3.58Å; I35-I175 HydrophobicContact CG1-CG2 3.94Å; I48-I175 HydrophobicContact CD1-CD1 3.53Å; F54-I175 HydrophobicContact CD1-CD1 4.02Å; F54-I175 HydrophobicContact CE1-CD1 3.87Å; F54-I175 HydrophobicContact CE1-CG1 4.24Å; F54-I175 HydrophobicContact CE1-CG2 4.43Å; L55-I175 HydrophobicContact CD2-CD1 4.29Å; L55-I175 HydrophobicContact CD2-CG1 4.39Å; L160-I175 HydrophobicContact CB-CB 4.45Å; L160-I175 PolarHBondContact N-O 2.7Å; L160-I175 PolarHBondContact O-N 2.77Å; I162-I175 HydrophobicContact CD1-CD1 4.37Å; I162-I175 HydrophobicContact CG1-CD1 3.7Å; I162-I175 HydrophobicContact CG1-CG1 3.97Å
176	T	86.2	Confident	82.5	Confident	14 Å²	14	49.5 Å²	49.5	9%	0.086	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	121.2	174.7	-57.5	0	0	0	0	109	R33 I34 I35 I151 I157	R33-T176 PolarHBondContact O-N 3.2Å; I34-T176 CarbonylContact C-O 3.45Å; I34-T176 WeakPolarHBondContact CA-O 3.4Å; I35-T176 PolarHBondContact N-O 2.8Å; I151-T176 HydrophobicContact CD1-CG2 4.15Å; I157-T176 HydrophobicContact CG2-CG2 4.22Å
177	V	86.5	Confident	83.3	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.6	167.5	169.7	0	0	0	0	107.9	I35 I37 F89 I157 I158 L160 L179	I35-V177 CarbonylContact O-C 3.53Å; I35-V177 WeakPolarHBondContact O-CA 3.39Å; I37-V177 HydrophobicContact CB-CG1 4.15Å; I37-V177 HydrophobicContact CD1-CB 4.46Å; I37-V177 HydrophobicContact CD1-CG1 3.63Å; I37-V177 HydrophobicContact CD1-CG2 3.95Å; I37-V177 HydrophobicContact CG1-CG1 3.91Å; F89-V177 HydrophobicContact CE2-CG1 4.49Å; F89-V177 HydrophobicContact CZ-CG1 4.03Å; F89-V177 HydrophobicContact CZ-CG2 4.49Å; I157-V177 WeakPolarHBondContact CA-O 3.11Å; I158-V177 HydrophobicContact CB-CB 4.23Å; I158-V177 PolarHBondContact N-O 3.15Å; I158-V177 PolarHBondContact O-N 2.66Å; L160-V177 HydrophobicContact CD1-CG2 3.92Å; L160-V177 HydrophobicContact CG-CG2 4.33Å; V177-L179 HydrophobicContact CG1-CD2 4.19Å
178	I	86.4	Confident	84.2	Confident	6 Å²	6	45.6 Å²	45.6	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128	166.2	-59.6	169.9	0	0	0	106.8	I34 I35 R36 I37 D155 I157	I34-I178 HydrophobicContact CG2-CD1 3.71Å; I34-I178 HydrophobicContact CG2-CG1 4.2Å; I35-I178 PolarHBondContact O-N 2.85Å; R36-I178 HydrophobicContact CG-CB 3.97Å; R36-I178 HydrophobicContact CG-CD1 4.2Å; R36-I178 HydrophobicContact CG-CG2 4.36Å; I37-I178 PolarHBondContact N-O 3.27Å; D155-I178 HydrophobicContact CB-CG2 4.36Å; I157-I178 HydrophobicContact CG2-CG1 4.07Å
179	L	86.9	Confident	84.8	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	120.8	169.5	-61.6	-178	0	0	0	109.5	I37 W88 P104 R106 L109 C156 I158 V177	I37-L179 CarbonylContact O-C 3.45Å; I37-L179 WeakPolarHBondContact O-CA 3.47Å; W88-L179 HydrophobicContact CZ3-CD1 3.88Å; P104-L179 HydrophobicContact CB-CD2 3.69Å; R106-L179 HydrophobicContact CB-CB 4.35Å; R106-L179 HydrophobicContact CB-CD1 4.36Å; R106-L179 HydrophobicContact CG-CB 3.9Å; R106-L179 HydrophobicContact CG-CD1 4.34Å; L109-L179 HydrophobicContact CB-CD1 4.49Å; L109-L179 HydrophobicContact CD2-CD1 3.67Å; C156-L179 HydrophobicContact CB-CB 4.28Å; C156-L179 PolarHBondContact O-N 3.19Å; I158-L179 HydrophobicContact CD1-CD1 3.98Å; I158-L179 HydrophobicContact CD1-CD2 3.94Å; I158-L179 HydrophobicContact CD1-CG 4.05Å; V177-L179 HydrophobicContact CG1-CD2 4.19Å
180	E	85.6	Confident	84.7	Confident	56 Å²	56	41.9 Å²	41.9	26%	0.262	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	121.3	170.3	-63.9	-172.6	160.8	0	0	109.7	R36 I37 K38 E39	R36-E180 HydrophobicContact CB-CG 4.25Å; R36-E180 VanDerWaalsContact CD-OE1 3.24Å; R36-E180 WeakPolarHBondContact CD-OE1 3.44Å; R36-E180 HydrophobicContact CG-CG 4.34Å; R36-E180 WeakPolarHBondContact CG-OE1 3.25Å; R36-E180 IonicContact CZ-OE1 2.74Å; R36-E180 IonicContact NE-OE1 3.11Å; R36-E180 IonicContact NH1-OE1 2.62Å; R36-E180 PolarHBondContact NH1-OE1 3.38Å; I37-E180 PolarHBondContact O-N 2.92Å; K38-E180 CarbonylContact C-O 3.59Å; K38-E180 WeakPolarHBondContact CA-O 3.23Å; K38-E180 HydrophobicContact CG-CB 4.24Å; E39-E180 PolarHBondContact N-O 3.4Å
181	D	85.1	Confident	84.1	Confident	26 Å²	26	45 Å²	45	14%	0.139	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-52.3	139.1	176.6	-160.3	85.5	0	0	0	112.5	R106 Q244 N247	R106-D181 VanDerWaalsContact CD-OD1 3.28Å; R106-D181 WeakPolarHBondContact CD-OD1 3.47Å; R106-D181 IonicContact CZ-OD1 2.82Å; R106-D181 IonicContact NE-OD1 2.97Å; R106-D181 PolarHBondContact NE-OD1 2.81Å; R106-D181 IonicContact NH1-OD1 3.3Å; R106-D181 PolarHBondContact NH1-OD1 3.12Å; D181-Q244 VanDerWaalsContact CG-N 3.33Å; D181-Q244 WeakPolarHBondContact OD1-CB 3.31Å; D181-Q244 PolarHBondContact OD1-N 3.02Å; D181-Q244 PolarHBondContact OD2-N 3.02Å; D181-Q244 VanDerWaalsContact OD2-N 3.15Å; D181-N247 PolarHBondContact O-ND2 3.01Å; D181-N247 VanDerWaalsContact OD2-CB 3.23Å; D181-N247 WeakPolarHBondContact OD2-CB 3.4Å; D181-N247 PolarHBondContact OD2-ND2 3.17Å
182	I	86.2	Confident	83.6	Confident	58 Å²	58	43.2 Å²	43.2	30%	0.297	22%	0.219	S	C	.	.			trans	-114.8	137.7	164.6	-68.9	-169.9	0	0	0	107.8	K38 E39 D184	K38-I182 HydrophobicContact CB-CD1 3.97Å; K38-I182 HydrophobicContact CB-CG1 4.16Å; K38-I182 HydrophobicContact CD-CD1 4.25Å; K38-I182 HydrophobicContact CD-CG1 4.27Å; E39-I182 HydrophobicContact CB-CB 4.23Å; E39-I182 HydrophobicContact CB-CG1 4.15Å; E39-I182 HydrophobicContact CG-CB 4.45Å; E39-I182 WeakPolarHBondContact O-CD1 3.44Å; E39-I182 PolarHBondContact OE2-N 2.92Å; E39-I182 VanDerWaalsContact OE2-N 3.16Å; I182-D184 VanDerWaalsContact C-N 3.33Å; I182-D184 HydrophobicContact CG2-CB 4.34Å; I182-D184 PolarHBondContact O-N 3.32Å
183	N	88	Confident	82.6	Confident	21 Å²	21	45.1 Å²	45.1	11%	0.112	23%	0.23	C	C	.	.			trans	-65.1	93.2	168.5	178	-103	0	0	0	109.5	D243 N247 D332 P336 K338	N183-D243 WeakPolarHBondContact CA-OD2 3.16Å; N183-D243 PolarHBondContact ND2-OD2 3.33Å; N183-N247 HydrophobicContact CB-CB 3.73Å; N183-N247 PolarHBondContact N-ND2 3.07Å; N183-N247 VanDerWaalsContact N-ND2 3.2Å; N183-N247 PolarHBondContact ND2-O 2.99Å; N183-D332 PolarHBondContact ND2-OD2 2.58Å; N183-P336 PolarHBondContact OD1-O 3.2Å; N183-K338 PolarHBondContact O-NZ 3.49Å; N183-K338 WeakPolarHBondContact OD1-CE 3.3Å; N183-K338 PolarHBondContact OD1-NZ 3.29Å
184	D	87.2	Confident	81.6	Confident	67 Å²	67	48.6 Å²	48.6	36%	0.358	26%	0.257	S	S	.	.			trans	-121.2	-25	178.8	93.1	-21.3	0	0	0	113.4	N40 I182 D243 K338	N40-D184 PolarHBondContact ND2-OD2 3.05Å; I182-D184 VanDerWaalsContact C-N 3.33Å; I182-D184 HydrophobicContact CG2-CB 4.34Å; I182-D184 PolarHBondContact O-N 3.32Å; D184-D243 PolarHBondContact N-OD1 2.84Å; D184-D243 PolarHBondContact N-OD2 2.85Å; D184-K338 VanDerWaalsContact C-NZ 3.35Å; D184-K338 VanDerWaalsContact CA-NZ 3.35Å; D184-K338 PolarHBondContact O-NZ 3Å
185	H	85.8	Confident	80.6	Confident	66 Å²	66	47.3 Å²	47.3	31%	0.306	25%	0.25	S	S	.	.	S	Bend	trans	-81.8	-176.3	165	-62.6	92.6	0	0	0	112.9	D107 D241 L242 D243 K338	D107-H185 IonicContact OD2-CE1 3.04Å; D107-H185 PolarHBondContact OD2-CE1 2.72Å; D107-H185 IonicContact OD2-ND1 2.66Å; D107-H185 PolarHBondContact OD2-ND1 2.96Å; H185-D241 WeakPolarHBondContact CB-OD1 3.45Å; H185-L242 HydrophobicContact CB-CB 4.22Å; H185-D243 VanDerWaalsContact CB-OD1 3.23Å; H185-D243 WeakPolarHBondContact CB-OD1 3.25Å; H185-D243 IonicContact CG-OD1 2.69Å; H185-D243 PolarHBondContact N-OD1 3.44Å; H185-D243 IonicContact ND1-OD1 3.67Å; H185-D243 PolarHBondContact ND1-OD1 3.05Å; H185-K338 WeakPolarHBondContact O-CD 3.36Å; H185-K338 WeakPolarHBondContact O-CE 3.3Å; H185-K338 PolarHBondContact O-NZ 2.92Å
186	A	88.4	Confident	79.9	Confident	37 Å²	37	50.1 Å²	50.1	31%	0.306	27%	0.265	S	S	.	.			trans	-150.2	148.8	178.1	0	0	0	0	0	108.9	S188 D241 K338	A186-S188 PolarHBondContact O-N 3.25Å; A186-D241 PolarHBondContact N-OD1 2.81Å; A186-K338 HydrophobicContact CB-CB 3.84Å; A186-K338 HydrophobicContact CB-CD 4.08Å
187	P	89.6	Confident	79.1	Confident	4 Å²	4	51.1 Å²	51.1	3%	0.026	27%	0.27	C	S	.	.			trans	-55.1	128.7	178.8	-24.8	33.1	0	0	0	111.3	A239 D241 I249 A330 D332 G340	P187-A239 HydrophobicContact CB-CB 4.04Å; P187-D241 WeakPolarHBondContact CD-OD2 3.08Å; P187-D241 HydrophobicContact CG-CB 4.47Å; P187-D241 VanDerWaalsContact CG-OD2 3.28Å; P187-D241 WeakPolarHBondContact CG-OD2 3.49Å; P187-I249 HydrophobicContact CB-CD1 4.49Å; P187-I249 HydrophobicContact CB-CG1 4.28Å; P187-I249 HydrophobicContact CG-CG1 4.24Å; P187-A330 HydrophobicContact CB-CB 3.72Å; P187-D332 HydrophobicContact CG-CB 4.37Å; P187-G340 WeakPolarHBondContact O-CA 3.07Å; P187-G340 PolarHBondContact O-N 2.82Å
188	S	88.7	Confident	78.2	Confident	41 Å²	41	56.9 Å²	56.9	29%	0.287	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-138.6	122.8	-167.6	-164.9	0	0	0	0	112.6	A186 K190 I240	A186-S188 PolarHBondContact O-N 3.25Å; S188-K190 VanDerWaalsContact C-N 3.3Å; S188-K190 PolarHBondContact O-N 3.2Å; S188-K190 WeakPolarHBondContact OG-CE 2.92Å; S188-K190 WeakPolarHBondContact OG-CG 3.24Å; S188-I240 PolarHBondContact N-O 3.2Å; S188-I240 PolarHBondContact O-N 2.66Å
189	F	86.5	Confident	77.5	Confident	25 Å²	25	65.5 Å²	65.5	11%	0.11	35%	0.347	C	S	.	.			trans	-83.7	65.3	-179.9	-65.1	-80	0	0	0	111.7	V192 A239 Y252 L328 A330 L342	F189-V192 HydrophobicContact CB-CG2 3.9Å; F189-A239 HydrophobicContact CD1-CB 3.98Å; F189-A239 HydrophobicContact CD2-CB 4.45Å; F189-A239 HydrophobicContact CE1-CB 3.74Å; F189-A239 HydrophobicContact CE2-CB 4.23Å; F189-A239 HydrophobicContact CG-CB 4.33Å; F189-A239 HydrophobicContact CZ-CB 3.87Å; F189-Y252 HydrophobicContact CE1-CE1 4.12Å; F189-Y252 HydrophobicContact CZ-CD1 4.48Å; F189-Y252 HydrophobicContact CZ-CE1 4.2Å; F189-L328 HydrophobicContact CE1-CD2 3.58Å; F189-L328 HydrophobicContact CE1-CG 4.18Å; F189-L328 HydrophobicContact CZ-CD2 3.77Å; F189-L328 HydrophobicContact CZ-CG 3.83Å; F189-A330 HydrophobicContact CE2-CB 4.13Å; F189-A330 HydrophobicContact CZ-CB 3.79Å; F189-L342 HydrophobicContact CB-CD2 4.48Å; F189-L342 HydrophobicContact CD1-CB 4.47Å; F189-L342 HydrophobicContact CD1-CD2 4.19Å; F189-L342 HydrophobicContact CD2-CB 3.7Å; F189-L342 HydrophobicContact CE2-CB 3.93Å; F189-L342 HydrophobicContact CG-CB 4Å; F189-L342 HydrophobicContact CG-CD2 4.26Å; F189-L342 HydrophobicContact CZ-CB 4.41Å
190	K	70.7	Confident	76.9	Confident	111 Å²	111	68.6 Å²	68.6	48%	0.483	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-72.2	-28.7	-170.3	-68.4	174.3	-179.5	162.4	0	114.6	S188 V192	S188-K190 VanDerWaalsContact C-N 3.3Å; S188-K190 PolarHBondContact O-N 3.2Å; S188-K190 WeakPolarHBondContact OG-CE 2.92Å; S188-K190 WeakPolarHBondContact OG-CG 3.24Å; K190-V192 VanDerWaalsContact C-N 3.26Å; K190-V192 PolarHBondContact O-N 2.71Å
191	E	65.1	Low	76.5	Confident	118 Å²	118	71.1 Å²	71.1	55%	0.551	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-80.6	1.1	-172.4	-57.5	-170.8	139.4	0	0	114.6	I240	E191-I240 HydrophobicContact CG-CD1 4.3Å
192	V	67.1	Low	76.4	Confident	7 Å²	7	71.3 Å²	71.3	4%	0.042	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-92.5	-2.4	-162.9	-167.7	0	0	0	0	113.6	F189 K190 S194 N195 L196 F203 P237 L342	F189-V192 HydrophobicContact CB-CG2 3.9Å; K190-V192 VanDerWaalsContact C-N 3.26Å; K190-V192 PolarHBondContact O-N 2.71Å; V192-S194 PolarHBondContact O-N 3.21Å; V192-N195 PolarHBondContact O-N 2.86Å; V192-L196 HydrophobicContact CB-CD1 4.45Å; V192-L196 HydrophobicContact CG1-CD1 3.79Å; V192-F203 HydrophobicContact CG1-CB 3.96Å; V192-F203 HydrophobicContact CG1-CD2 3.16Å; V192-F203 HydrophobicContact CG1-CE2 3.61Å; V192-F203 HydrophobicContact CG1-CG 3.67Å; V192-F203 HydrophobicContact CG1-CZ 4.46Å; V192-P237 HydrophobicContact CG2-CB 3.66Å; V192-P237 HydrophobicContact CG2-CG 3.95Å; V192-L342 HydrophobicContact CG1-CD1 4.01Å; V192-L342 HydrophobicContact CG1-CD2 4.06Å; V192-L342 HydrophobicContact CG2-CD2 4.27Å
193	Q	60.5	Low	76.4	Confident	171 Å²	171	69.8 Å²	69.8	80%	0.799	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-16.8	-166.9	-64.3	-174	-6.2	0	0	116.1
194	S	62	Low	76.2	Confident	106 Å²	106	70.9 Å²	70.9	74%	0.741	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-24.3	-179	58.6	0	0	0	0	114.7	V192	V192-S194 PolarHBondContact O-N 3.21Å
195	N	62.8	Low	76.1	Confident	54 Å²	54	68.7 Å²	68.7	29%	0.289	37%	0.367	S	S	.	.	S	Bend	trans	-121.3	19.7	-170.4	-60.2	27.7	0	0	0	112.4	V192 F203 I204	V192-N195 PolarHBondContact O-N 2.86Å; N195-F203 HydrophobicContact CB-CD2 3.71Å; N195-F203 HydrophobicContact CB-CE2 3.61Å; N195-I204 PolarHBondContact O-N 3.05Å; N195-I204 VanDerWaalsContact O-N 3.13Å
196	L	73	Confident	75.9	Confident	59 Å²	59	67.7 Å²	67.7	31%	0.309	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-79.8	132.8	172.2	-114.4	69	0	0	0	110.3	V192 S198 E202 F203 L342	V192-L196 HydrophobicContact CB-CD1 4.45Å; V192-L196 HydrophobicContact CG1-CD1 3.79Å; L196-S198 PolarHBondContact O-N 3.29Å; L196-E202 CarbonylContact C-O 3.39Å; L196-E202 WeakPolarHBondContact CA-O 3.1Å; L196-F203 HydrophobicContact CD1-CB 4.18Å; L196-L342 HydrophobicContact CD1-CD1 4.39Å
197	D	68.7	Low	75.5	Confident	34 Å²	34	66.8 Å²	66.8	18%	0.182	36%	0.357	C	S	.	.			trans	-66	120.6	170	-167.5	-39.4	0	0	0	109.7	K199 T200 N201 E202 I204 R345	D197-K199 PolarHBondContact O-N 3.07Å; D197-K199 WeakPolarHBondContact OD1-CB 3.39Å; D197-K199 PolarHBondContact OD1-N 3.46Å; D197-T200 WeakPolarHBondContact CB-OG1 3.43Å; D197-T200 PolarHBondContact O-N 3.4Å; D197-N201 WeakPolarHBondContact O-CA 2.96Å; D197-N201 PolarHBondContact O-N 3.32Å; D197-E202 PolarHBondContact N-O 2.62Å; D197-I204 HydrophobicContact CB-CD1 3.91Å; D197-I204 HydrophobicContact CB-CG1 4.34Å; D197-R345 IonicContact OD2-NH2 3.16Å
198	S	67.9	Low	74.7	Confident	121 Å²	121	67.7 Å²	67.7	85%	0.846	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-17	175.4	62.3	0	0	0	0	115.7	L196	L196-S198 PolarHBondContact O-N 3.29Å
199	K	72.2	Confident	74.1	Confident	187 Å²	187	65.9 Å²	65.9	81%	0.813	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-45.4	-178.7	-63.9	176	-178.6	171.8	0	113.4	D197	D197-K199 PolarHBondContact O-N 3.07Å; D197-K199 WeakPolarHBondContact OD1-CB 3.39Å; D197-K199 PolarHBondContact OD1-N 3.46Å
200	T	73.4	Confident	73.2	Confident	71 Å²	71	65.8 Å²	65.8	44%	0.436	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-15.6	-175	66.1	0	0	0	0	113.4	D197 E202	D197-T200 WeakPolarHBondContact CB-OG1 3.43Å; D197-T200 PolarHBondContact O-N 3.4Å; T200-E202 WeakPolarHBondContact CB-OE2 3.18Å; T200-E202 PolarHBondContact O-N 3.17Å; T200-E202 WeakPolarHBondContact OG1-CB 3.47Å; T200-E202 WeakPolarHBondContact OG1-CG 3.48Å; T200-E202 PolarHBondContact OG1-N 3.08Å; T200-E202 PolarHBondContact OG1-OE2 2.89Å
201	N	78.3	Confident	72.4	Confident	110 Å²	110	63.5 Å²	63.5	59%	0.588	35%	0.348	S	S	*	.			trans	59.6	26.4	-174.4	-156.9	101.4	0	0	0	112.8	D197	D197-N201 WeakPolarHBondContact O-CA 2.96Å; D197-N201 PolarHBondContact O-N 3.32Å
202	E	82.9	Confident	71.7	Confident	29 Å²	29	61.1 Å²	61.1	14%	0.136	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-93	148.1	171.8	-60.1	168.6	124.9	0	0	110.6	L196 D197 T200 H325 P343 R345	L196-E202 CarbonylContact C-O 3.39Å; L196-E202 WeakPolarHBondContact CA-O 3.1Å; D197-E202 PolarHBondContact N-O 2.62Å; T200-E202 WeakPolarHBondContact CB-OE2 3.18Å; T200-E202 PolarHBondContact O-N 3.17Å; T200-E202 WeakPolarHBondContact OG1-CB 3.47Å; T200-E202 WeakPolarHBondContact OG1-CG 3.48Å; T200-E202 PolarHBondContact OG1-N 3.08Å; T200-E202 PolarHBondContact OG1-OE2 2.89Å; E202-H325 IonicContact OE1-CE1 3.54Å; E202-H325 PolarHBondContact OE1-CE1 3.12Å; E202-H325 IonicContact OE1-ND1 3.29Å; E202-H325 PolarHBondContact OE1-ND1 3.19Å; E202-H325 IonicContact OE2-CE1 3.86Å; E202-P343 HydrophobicContact CB-CB 4.37Å; E202-P343 HydrophobicContact CG-CB 3.92Å; E202-R345 HydrophobicContact CB-CB 4.35Å; E202-R345 IonicContact OE2-NE 3.52Å
203	F	85.6	Confident	70.7	Confident	26 Å²	26	66.3 Å²	66.3	11%	0.114	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	118.3	167.8	176.4	-116.1	0	0	0	109.7	V192 N195 L196 I205 P237 L342 P343 I344 R345	V192-F203 HydrophobicContact CG1-CB 3.96Å; V192-F203 HydrophobicContact CG1-CD2 3.16Å; V192-F203 HydrophobicContact CG1-CE2 3.61Å; V192-F203 HydrophobicContact CG1-CG 3.67Å; V192-F203 HydrophobicContact CG1-CZ 4.46Å; N195-F203 HydrophobicContact CB-CD2 3.71Å; N195-F203 HydrophobicContact CB-CE2 3.61Å; L196-F203 HydrophobicContact CD1-CB 4.18Å; F203-I205 HydrophobicContact CD1-CD1 4.03Å; F203-I205 HydrophobicContact CD1-CG1 3.75Å; F203-I205 HydrophobicContact CE1-CD1 3.71Å; F203-I205 HydrophobicContact CE1-CG1 3.5Å; F203-I205 VanDerWaalsContact CE1-CG1 3.5Å; F203-I205 HydrophobicContact CZ-CG1 4.36Å; F203-P237 HydrophobicContact CD1-CG 4.4Å; F203-P237 HydrophobicContact CE1-CG 4.04Å; F203-P237 HydrophobicContact CZ-CG 4.32Å; F203-L342 HydrophobicContact CB-CD1 4.09Å; F203-L342 HydrophobicContact CB-CD2 4.27Å; F203-L342 HydrophobicContact CB-CG 4.27Å; F203-L342 HydrophobicContact CD1-CD2 4.44Å; F203-L342 HydrophobicContact CG-CD2 4.47Å; F203-P343 PolarHBondContact N-O 2.75Å; F203-I344 HydrophobicContact CB-CG1 4.38Å; F203-I344 HydrophobicContact CD1-CD1 4.42Å; F203-I344 HydrophobicContact CD1-CG1 4.2Å; F203-I344 HydrophobicContact CD1-CG2 4.36Å; F203-I344 WeakPolarHBondContact O-CA 3.43Å; F203-R345 PolarHBondContact O-N 3.37Å
204	I	83.9	Confident	69.7	Low	44 Å²	44	62.3 Å²	62.3	23%	0.226	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	131	178.5	-62.4	175.8	0	0	0	110	N195 D197 R345 I347	N195-I204 PolarHBondContact O-N 3.05Å; N195-I204 VanDerWaalsContact O-N 3.13Å; D197-I204 HydrophobicContact CB-CD1 3.91Å; D197-I204 HydrophobicContact CB-CG1 4.34Å; I204-R345 WeakPolarHBondContact CA-O 3.32Å; I204-I347 HydrophobicContact CG2-CD1 3.69Å; I204-I347 HydrophobicContact CG2-CG1 4.32Å
205	I	84.4	Confident	68.3	Low	22 Å²	22	63.4 Å²	63.4	11%	0.113	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123	166.1	-52.9	175.8	0	0	0	107.2	F203 I207 I234 L236 I344 R345 L346 I347	F203-I205 HydrophobicContact CD1-CD1 4.03Å; F203-I205 HydrophobicContact CD1-CG1 3.75Å; F203-I205 HydrophobicContact CE1-CD1 3.71Å; F203-I205 HydrophobicContact CE1-CG1 3.5Å; F203-I205 VanDerWaalsContact CE1-CG1 3.5Å; F203-I205 HydrophobicContact CZ-CG1 4.36Å; I205-I207 HydrophobicContact CG2-CG2 4.27Å; I205-I234 HydrophobicContact CD1-CG2 4.26Å; I205-I234 HydrophobicContact CG2-CG2 3.86Å; I205-L236 HydrophobicContact CD1-CD2 3.91Å; I205-I344 HydrophobicContact CD1-CG2 3.74Å; I205-I344 HydrophobicContact CG1-CG2 4.13Å; I205-R345 PolarHBondContact N-O 2.86Å; I205-L346 HydrophobicContact CB-CD1 3.83Å; I205-L346 HydrophobicContact CG2-CD1 3.74Å; I205-L346 CarbonylContact O-C 2.96Å; I205-L346 WeakPolarHBondContact O-CA 3.47Å; I205-I347 PolarHBondContact O-N 2.99Å
206	S	81.9	Confident	67.1	Low	45 Å²	45	68 Å²	68	32%	0.315	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.4	168.2	-54	0	0	0	0	110.1	I347 E349	S206-I347 WeakPolarHBondContact CA-O 3.31Å; S206-E349 WeakPolarHBondContact CB-OE1 3.36Å
207	I	80	Confident	65.3	Low	17 Å²	17	74 Å²	74	9%	0.087	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	146.4	173.4	55	176	0	0	0	110.3	I205 I234 I278 L316 L346 I347 I348 E349	I205-I207 HydrophobicContact CG2-CG2 4.27Å; I207-I234 HydrophobicContact CD1-CD1 3.5Å; I207-I234 VanDerWaalsContact CD1-CD1 3.5Å; I207-I234 HydrophobicContact CD1-CG1 3.86Å; I207-I278 HydrophobicContact CG2-CD1 4.28Å; I207-L316 HydrophobicContact CD1-CD1 3.63Å; I207-L346 HydrophobicContact CD1-CD1 3.87Å; I207-L346 HydrophobicContact CD1-CD2 4.38Å; I207-L346 HydrophobicContact CD1-CG 4.45Å; I207-L346 HydrophobicContact CG1-CD1 3.99Å; I207-I347 PolarHBondContact N-O 2.75Å; I207-I347 VanDerWaalsContact N-O 3.09Å; I207-I348 HydrophobicContact CD1-CD1 4.2Å; I207-I348 HydrophobicContact CG1-CD1 4.03Å; I207-I348 CarbonylContact O-C 3.52Å; I207-I348 WeakPolarHBondContact O-CA 3.29Å; I207-E349 PolarHBondContact O-N 3.11Å
208	P	73.6	Confident	63.7	Low	24 Å²	24	77.6 Å²	77.6	16%	0.156	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	151.8	165.5	30.8	-34.8	0	0	0	110.6	Y276 E349 I351	P208-Y276 HydrophobicContact CG-CD1 3.65Å; P208-Y276 HydrophobicContact CG-CE1 4.16Å; P208-E349 WeakPolarHBondContact CA-O 3.31Å; P208-I351 HydrophobicContact CB-CD1 4.31Å; P208-I351 HydrophobicContact CB-CG1 4.38Å
209	E	74.7	Confident	62.2	Low	3 Å²	3	78.1 Å²	78.1	1%	0.014	40%	0.402	C	S	.	.			trans	-69.2	175.3	178.2	80.2	-161.7	118.2	0	0	113.6	P211 L316 K318 I348 E349 I351	E209-P211 VanDerWaalsContact O-CD 3.31Å; E209-P211 WeakPolarHBondContact O-CD 3.24Å; E209-L316 WeakPolarHBondContact CB-O 3.28Å; E209-K318 WeakPolarHBondContact OE2-CB 3.36Å; E209-K318 PolarHBondContact OE2-N 2.85Å; E209-I348 HydrophobicContact CB-CG2 3.5Å; E209-I348 VanDerWaalsContact CB-CG2 3.5Å; E209-E349 PolarHBondContact N-O 2.84Å; E209-E349 VanDerWaalsContact N-O 3.12Å; E209-I351 HydrophobicContact CG-CB 4.16Å; E209-I351 HydrophobicContact CG-CD1 3.97Å; E209-I351 HydrophobicContact CG-CG1 3.99Å; E209-I351 WeakPolarHBondContact O-CD1 3.26Å; E209-I351 PolarHBondContact OE1-N 3.45Å
210	T	67.9	Low	60.3	Low	23 Å²	23	74.9 Å²	74.9	14%	0.141	39%	0.393	C	S	.	.			trans	-78.1	114.3	169.5	38.1	0	0	0	0	109.6	T212 I232 E315 L316	T210-T212 PolarHBondContact O-N 3.4Å; T210-T212 VanDerWaalsContact O-N 3.14Å; T210-I232 HydrophobicContact CG2-CD1 3.45Å; T210-I232 VanDerWaalsContact CG2-CD1 3.45Å; T210-I232 HydrophobicContact CG2-CG1 4.34Å; T210-E315 HydrophobicContact CG2-CG 4.37Å; T210-E315 VanDerWaalsContact OG1-CA 3.29Å; T210-E315 WeakPolarHBondContact OG1-CA 3.4Å; T210-E315 VanDerWaalsContact OG1-CB 3.31Å; T210-E315 WeakPolarHBondContact OG1-CB 3.19Å; T210-L316 PolarHBondContact N-O 3.32Å; T210-L316 PolarHBondContact OG1-N 2.77Å; T210-L316 PolarHBondContact OG1-O 3.25Å
211	P	54.7	Low	58.4	Low	63 Å²	63	76 Å²	76	41%	0.409	40%	0.404	S	S	.	.			trans	-61.8	119.9	178.2	25.2	-33.6	0	0	0	109.7	E209 I213 I351	E209-P211 VanDerWaalsContact O-CD 3.31Å; E209-P211 WeakPolarHBondContact O-CD 3.24Å; P211-I213 PolarHBondContact O-N 3.29Å; P211-I351 HydrophobicContact CB-CD1 3.95Å; P211-I351 HydrophobicContact CB-CG2 4.47Å; P211-I351 HydrophobicContact CG-CD1 4.29Å
212	T	50.7	Low	56.2	Low	68 Å²	68	77.8 Å²	77.8	42%	0.417	41%	0.413	S	S	.	.			trans	-70.9	127.9	-177.9	68.2	0	0	0	0	109.9	T210 I214 D353	T210-T212 PolarHBondContact O-N 3.4Å; T210-T212 VanDerWaalsContact O-N 3.14Å; T212-I214 PolarHBondContact O-N 3.29Å; T212-D353 WeakPolarHBondContact CB-OD2 3.48Å; T212-D353 VanDerWaalsContact CG2-OD2 3.29Å; T212-D353 WeakPolarHBondContact CG2-OD2 3.34Å; T212-D353 PolarHBondContact N-OD2 2.85Å; T212-D353 PolarHBondContact OG1-OD2 3.14Å
213	I	45.1	Very low	53.8	Low	116 Å²	116	84.1 Å²	84.1	60%	0.595	45%	0.445	S	S	*	.			trans	-80.6	92.6	170.3	-61.1	-172.8	0	0	0	107.1	P211 D215	P211-I213 PolarHBondContact O-N 3.29Å; I213-D215 PolarHBondContact O-N 2.79Å
214	I	39.5	Very low	51	Low	87 Å²	87	92.4 Å²	92.4	45%	0.446	48%	0.481	S	S	.	.			trans	-67.3	94.2	175.8	-59.2	-178	0	0	0	109.4	T212 K216 D353	T212-I214 PolarHBondContact O-N 3.29Å; I214-K216 HydrophobicContact CG2-CD 4.18Å; I214-K216 HydrophobicContact CG2-CG 3.96Å; I214-K216 PolarHBondContact O-N 2.85Å; I214-D353 VanDerWaalsContact CD1-O 3.31Å; I214-D353 WeakPolarHBondContact CD1-O 3.33Å
215	D	33	Very low	48.6	Very low	128 Å²	128	98.5 Å²	98.5	68%	0.684	51%	0.508	S	S	*	.			trans	-72	63	177.9	-130	0.6	0	0	0	110.9	I213 K217	I213-D215 PolarHBondContact O-N 2.79Å; D215-K217 PolarHBondContact O-N 3.04Å
216	K	37.7	Very low	46.1	Very low	152 Å²	152	107.6 Å²	107.6	66%	0.661	54%	0.541	S	S	*	.			trans	-65.5	123.3	171.8	-93.8	170.1	-177	168.9	0	108.8	I214 D218	I214-K216 HydrophobicContact CG2-CD 4.18Å; I214-K216 HydrophobicContact CG2-CG 3.96Å; I214-K216 PolarHBondContact O-N 2.85Å; K216-D218 PolarHBondContact O-N 3.27Å
217	K	35.9	Very low	44	Very low	184 Å²	184	111.6 Å²	111.6	80%	0.8	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	4.4	-139.1	-155.9	170.2	-180	175.1	0	116.2	D215	D215-K217 PolarHBondContact O-N 3.04Å
218	D	35	Very low	42	Very low	110 Å²	110	115.9 Å²	115.9	59%	0.588	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	-5.2	-155	-63.7	-50.5	0	0	0	116.7	K216 N493	K216-D218 PolarHBondContact O-N 3.27Å; D218-N493 WeakPolarHBondContact CB-OD1 3.28Å
219	D	35.2	Very low	40.6	Very low	131 Å²	131	119.2 Å²	119.2	70%	0.701	59%	0.594	S	S	*	*			trans	-122.4	9.9	-178	-106.2	-53.5	0	0	0	115.5	S221	D219-S221 PolarHBondContact O-N 2.92Å
220	L	33.9	Very low	39.5	Very low	119 Å²	119	124.9 Å²	124.9	62%	0.623	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	52.8	-170.1	-151.7	80.8	0	0	0	115.2
221	S	33.2	Very low	38.9	Very low	95 Å²	95	126.2 Å²	126.2	66%	0.664	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-26.6	175.9	61.5	0	0	0	0	114.6	D219	D219-S221 PolarHBondContact O-N 2.92Å
222	N	32.4	Very low	39.4	Very low	147 Å²	147	125.1 Å²	125.1	79%	0.786	62%	0.618	S	S	*	*	S	Bend	trans	-130.2	5.1	-164.7	-80.1	-67.7	0	0	0	117.2
223	M	30.6	Very low	40.5	Very low	163 Å²	163	125.6 Å²	125.6	80%	0.803	61%	0.612	S	S	*	*			trans	-134	56.6	-177.5	-119.7	-177.2	-63.8	0	0	115.6	H225	M223-H225 PolarHBondContact O-N 3.15Å; M223-H225 VanDerWaalsContact O-N 3.14Å
224	K	28.7	Very low	42.1	Very low	199 Å²	199	120.5 Å²	120.5	87%	0.865	59%	0.586	S	S	*	*			trans	-80.9	79.2	165	-84.2	-172.2	173.7	178.2	0	111.9
225	H	33.5	Very low	44.2	Very low	172 Å²	172	120.5 Å²	120.5	80%	0.796	59%	0.586	S	S	*	*			trans	-112.7	122	161	-101.7	-80.8	0	0	0	110.1	M223 I227	M223-H225 PolarHBondContact O-N 3.15Å; M223-H225 VanDerWaalsContact O-N 3.14Å; H225-I227 PolarHBondContact O-N 3.2Å
226	R	30.1	Very low	46.8	Very low	213 Å²	213	114.7 Å²	114.7	80%	0.804	56%	0.555	S	S	*	*			trans	-60.6	121.2	172.4	-83.4	-179.4	170.9	171.6	-5.4	109.8
227	I	39.7	Very low	49	Very low	129 Å²	129	108.6 Å²	108.6	66%	0.662	53%	0.531	S	S	*	.			trans	-99	98.4	154.3	-59.9	177.4	0	0	0	104.8	H225 H229	H225-I227 PolarHBondContact O-N 3.2Å; I227-H229 PolarHBondContact O-CD2 3.02Å; I227-H229 PolarHBondContact O-N 2.78Å
228	D	36.4	Very low	51.4	Low	108 Å²	108	101.8 Å²	101.8	58%	0.578	51%	0.505	S	S	*	.			trans	-70.9	100.6	179	-71	-34.5	0	0	0	108.8	K230	D228-K230 PolarHBondContact O-N 3.2Å
229	H	45.6	Very low	53.9	Low	94 Å²	94	96.8 Å²	96.8	44%	0.435	48%	0.479	S	S	.	.			trans	-61	104.5	-178.7	-65	-86.9	0	0	0	111.1	I227 N313	I227-H229 PolarHBondContact O-CD2 3.02Å; I227-H229 PolarHBondContact O-N 2.78Å; H229-N313 PolarHBondContact O-ND2 3.37Å
230	K	50.7	Low	56.2	Low	122 Å²	122	92.2 Å²	92.2	53%	0.53	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-65.7	145.5	167.2	-73.7	-170.2	175.2	-166.4	0	110.4	D228 T272 N313	D228-K230 PolarHBondContact O-N 3.2Å; K230-T272 PolarHBondContact NZ-OG1 2.88Å; K230-N313 VanDerWaalsContact C-ND2 3.31Å; K230-N313 PolarHBondContact O-ND2 2.83Å
231	P	55.4	Low	58.7	Low	50 Å²	50	87 Å²	87	33%	0.325	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-62.3	136.5	171.6	25.2	-33.3	0	0	0	111.3	R233 V299 N313	P231-R233 PolarHBondContact O-N 2.91Å; P231-V299 HydrophobicContact CB-CG1 4.23Å; P231-N313 VanDerWaalsContact CA-CG 3.4Å; P231-N313 WeakPolarHBondContact CA-OD1 3.03Å; P231-N313 HydrophobicContact CB-CB 4.43Å; P231-N313 WeakPolarHBondContact CB-OD1 3.1Å
232	I	65.9	Low	61.2	Low	40 Å²	40	85.3 Å²	85.3	21%	0.205	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-61.9	133.3	164.2	-69.5	-172.4	0	0	0	108.4	T210 I234	T210-I232 HydrophobicContact CG2-CD1 3.45Å; T210-I232 VanDerWaalsContact CG2-CD1 3.45Å; T210-I232 HydrophobicContact CG2-CG1 4.34Å; I232-I234 HydrophobicContact CG2-CG1 4.02Å
233	R	72.5	Confident	63.7	Low	78 Å²	78	78.3 Å²	78.3	29%	0.294	37%	0.372	S	S	.	.			trans	-127.7	116.6	176.1	-68.2	-178	155.1	174	-7.6	108.3	P231 E265 W297 V299	P231-R233 PolarHBondContact O-N 2.91Å; R233-E265 IonicContact CZ-OE2 2.72Å; R233-E265 IonicContact NE-OE2 3.7Å; R233-E265 PolarHBondContact NE-OE2 2.88Å; R233-E265 IonicContact NH2-OE2 3.36Å; R233-E265 PolarHBondContact NH2-OE2 2.66Å; R233-W297 HydrophobicContact CB-CB 4.32Å; R233-W297 HydrophobicContact CB-CD2 3.98Å; R233-W297 HydrophobicContact CB-CE3 3.54Å; R233-W297 HydrophobicContact CB-CG 4.35Å; R233-W297 HydrophobicContact CB-CZ3 4.08Å; R233-V299 HydrophobicContact CG-CG2 3.96Å
234	I	80.4	Confident	66	Low	9 Å²	9	73.2 Å²	73.2	5%	0.046	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	124.1	-177.9	-53.9	157.4	0	0	0	106.9	I205 I207 I232 W297 L298 L316 L346	I205-I234 HydrophobicContact CD1-CG2 4.26Å; I205-I234 HydrophobicContact CG2-CG2 3.86Å; I207-I234 HydrophobicContact CD1-CD1 3.5Å; I207-I234 VanDerWaalsContact CD1-CD1 3.5Å; I207-I234 HydrophobicContact CD1-CG1 3.86Å; I232-I234 HydrophobicContact CG2-CG1 4.02Å; I234-W297 CarbonylContact O-C 3.51Å; I234-W297 WeakPolarHBondContact O-CA 3.34Å; I234-L298 HydrophobicContact CB-CB 4.19Å; I234-L298 HydrophobicContact CD1-CD2 4.15Å; I234-L298 PolarHBondContact N-O 3.14Å; I234-L298 PolarHBondContact O-N 2.73Å; I234-L316 HydrophobicContact CD1-CD1 4.46Å; I234-L346 HydrophobicContact CD1-CD1 4.27Å; I234-L346 HydrophobicContact CD1-CD2 4.02Å; I234-L346 HydrophobicContact CG2-CD1 4.5Å
235	L	83.2	Confident	68.3	Low	88 Å²	88	65.4 Å²	65.4	46%	0.461	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130.7	-176.9	-179.3	63.8	0	0	0	110.6	R295 W297	L235-R295 HydrophobicContact CD1-CB 3.7Å; L235-R295 HydrophobicContact CD1-CG 4.04Å; L235-W297 HydrophobicContact CB-CE3 4.19Å; L235-W297 HydrophobicContact CB-CZ3 3.96Å; L235-W297 HydrophobicContact CD1-CE3 4.41Å; L235-W297 HydrophobicContact CD1-CH2 4.47Å; L235-W297 HydrophobicContact CD1-CZ3 4.36Å
236	L	86.6	Confident	70.5	Confident	6 Å²	6	61 Å²	61	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	148.8	174.7	-66.1	-173.8	0	0	0	112.1	I205 L264 L296 L298 L328 I344	I205-L236 HydrophobicContact CD1-CD2 3.91Å; L236-L264 HydrophobicContact CD1-CD2 3.45Å; L236-L264 VanDerWaalsContact CD1-CD2 3.45Å; L236-L296 HydrophobicContact CB-CB 4.34Å; L236-L296 HydrophobicContact CB-CD2 3.97Å; L236-L296 HydrophobicContact CB-CG 4.01Å; L236-L296 HydrophobicContact CD1-CD2 4.19Å; L236-L296 HydrophobicContact CD1-CG 4.25Å; L236-L296 PolarHBondContact N-O 2.72Å; L236-L298 HydrophobicContact CD1-CB 3.91Å; L236-L298 HydrophobicContact CD1-CD1 4.29Å; L236-L298 HydrophobicContact CD2-CB 4.07Å; L236-L298 HydrophobicContact CG-CB 3.89Å; L236-L328 HydrophobicContact CB-CD2 4.38Å; L236-L328 HydrophobicContact CD1-CD1 4.07Å; L236-L328 HydrophobicContact CD1-CD2 4.13Å; L236-I344 HydrophobicContact CD2-CD1 3.97Å
237	P	84.8	Confident	73.1	Confident	24 Å²	24	52.3 Å²	52.3	16%	0.156	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-68.3	142	169.4	30.7	-35.1	0	0	0	110.8	V192 F203 L342	V192-P237 HydrophobicContact CG2-CB 3.66Å; V192-P237 HydrophobicContact CG2-CG 3.95Å; F203-P237 HydrophobicContact CD1-CG 4.4Å; F203-P237 HydrophobicContact CE1-CG 4.04Å; F203-P237 HydrophobicContact CZ-CG 4.32Å; P237-L342 HydrophobicContact CG-CD2 3.46Å; P237-L342 VanDerWaalsContact CG-CD2 3.46Å
238	T	85.5	Confident	75.2	Confident	41 Å²	41	47.2 Å²	47.2	25%	0.252	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-87.2	147.7	172.8	45.3	0	0	0	0	111.7	L116 L296	L116-T238 HydrophobicContact CD1-CG2 3.72Å; L116-T238 HydrophobicContact CD2-CG2 4.37Å; L116-T238 HydrophobicContact CG-CG2 4.11Å; T238-L296 HydrophobicContact CG2-CB 4.15Å
239	A	87.1	Confident	77.6	Confident	4 Å²	4	42.9 Å²	42.9	3%	0.033	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-80.5	151.5	166.8	0	0	0	0	0	110.4	P187 F189 I249 Y252 A330	P187-A239 HydrophobicContact CB-CB 4.04Å; F189-A239 HydrophobicContact CD1-CB 3.98Å; F189-A239 HydrophobicContact CD2-CB 4.45Å; F189-A239 HydrophobicContact CE1-CB 3.74Å; F189-A239 HydrophobicContact CE2-CB 4.23Å; F189-A239 HydrophobicContact CG-CB 4.33Å; F189-A239 HydrophobicContact CZ-CB 3.87Å; A239-I249 HydrophobicContact CB-CD1 4.01Å; A239-I249 VanDerWaalsContact O-CD1 3.24Å; A239-I249 WeakPolarHBondContact O-CD1 3.48Å; A239-Y252 HydrophobicContact CB-CE1 4.1Å; A239-Y252 PolarHBondContact N-OH 2.61Å; A239-Y252 PolarHBondContact O-OH 2.92Å; A239-A330 HydrophobicContact CB-CB 3.41Å; A239-A330 VanDerWaalsContact CB-CB 3.41Å
240	I	84.9	Confident	79.6	Confident	35 Å²	35	41.5 Å²	41.5	18%	0.179	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-112.9	129.6	170.4	-59.6	166.6	0	0	0	107.4	P114 S188 E191 L242	P114-I240 HydrophobicContact CG-CG2 4.4Å; S188-I240 PolarHBondContact N-O 3.2Å; S188-I240 PolarHBondContact O-N 2.66Å; E191-I240 HydrophobicContact CG-CD1 4.3Å; I240-L242 HydrophobicContact CG2-CD2 4.43Å
241	D	86.7	Confident	81.4	Confident	9 Å²	9	35.7 Å²	35.7	5%	0.048	20%	0.197	C	C	.	.			trans	-120.2	153.9	167.4	-148.3	-9.4	0	0	0	108.5	H185 A186 P187 I249	H185-D241 WeakPolarHBondContact CB-OD1 3.45Å; A186-D241 PolarHBondContact N-OD1 2.81Å; P187-D241 WeakPolarHBondContact CD-OD2 3.08Å; P187-D241 HydrophobicContact CG-CB 4.47Å; P187-D241 VanDerWaalsContact CG-OD2 3.28Å; P187-D241 WeakPolarHBondContact CG-OD2 3.49Å; D241-I249 HydrophobicContact CB-CD1 4.17Å; D241-I249 HydrophobicContact CB-CG1 3.64Å
242	L	85	Confident	83.2	Confident	60 Å²	60	33.5 Å²	33.5	31%	0.314	18%	0.182	S	C	.	.			trans	-99.2	-43.1	-176.9	-61	-177.5	0	0	0	111.5	D107 N112 H185 I240	D107-L242 HydrophobicContact CB-CB 4.41Å; D107-L242 VanDerWaalsContact OD1-C 3.3Å; D107-L242 VanDerWaalsContact OD2-C 3.29Å; D107-L242 WeakPolarHBondContact OD2-CB 3.17Å; N112-L242 PolarHBondContact ND2-O 2.6Å; H185-L242 HydrophobicContact CB-CB 4.22Å; I240-L242 HydrophobicContact CG2-CD2 4.43Å
243	D	85.3	Confident	84.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	-38.7	147	172.5	-60.2	-1.2	0	0	0	114.6	D107 N112 N183 D184 H185 N247 S248	D107-D243 PolarHBondContact OD2-N 3.36Å; N112-D243 PolarHBondContact ND2-O 3.44Å; N183-D243 WeakPolarHBondContact CA-OD2 3.16Å; N183-D243 PolarHBondContact ND2-OD2 3.33Å; D184-D243 PolarHBondContact N-OD1 2.84Å; D184-D243 PolarHBondContact N-OD2 2.85Å; H185-D243 VanDerWaalsContact CB-OD1 3.23Å; H185-D243 WeakPolarHBondContact CB-OD1 3.25Å; H185-D243 IonicContact CG-OD1 2.69Å; H185-D243 PolarHBondContact N-OD1 3.44Å; H185-D243 IonicContact ND1-OD1 3.67Å; H185-D243 PolarHBondContact ND1-OD1 3.05Å; D243-N247 HydrophobicContact CB-CB 3.75Å; D243-N247 WeakPolarHBondContact CB-O 3.39Å; D243-S248 WeakPolarHBondContact O-CB 3.02Å; D243-S248 PolarHBondContact O-OG 2.71Å
244	Q	78.7	Confident	85.3	Confident	56 Å²	56	31 Å²	31	26%	0.262	17%	0.171	S	C	.	.			trans	-104.2	147.8	-177.1	-160.6	179.1	11.1	0	0	114.7	R106 N112 D181 V246 N247	R106-Q244 VanDerWaalsContact CZ-CB 3.48Å; N112-Q244 WeakPolarHBondContact ND2-CB 3.39Å; D181-Q244 VanDerWaalsContact CG-N 3.33Å; D181-Q244 WeakPolarHBondContact OD1-CB 3.31Å; D181-Q244 PolarHBondContact OD1-N 3.02Å; D181-Q244 PolarHBondContact OD2-N 3.02Å; D181-Q244 VanDerWaalsContact OD2-N 3.15Å; Q244-V246 PolarHBondContact O-N 2.89Å; Q244-N247 PolarHBondContact O-N 2.86Å
245	G	75.5	Confident	85.7	Confident	36 Å²	36	32.9 Å²	32.9	37%	0.371	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	63.2	-134.2	170.8	0	0	0	0	0	110.3	Y133 N247 S248	Y133-G245 WeakPolarHBondContact CE1-O 3.49Å; G245-N247 PolarHBondContact O-N 2.85Å; G245-S248 VanDerWaalsContact O-CB 3.24Å; G245-S248 WeakPolarHBondContact O-CB 3.43Å; G245-S248 PolarHBondContact O-N 2.84Å
246	V	80.2	Confident	85.8	Confident	79 Å²	79	31 Å²	31	48%	0.479	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-56.4	-25.6	-175.5	-175.4	0	0	0	0	112.9	Y133 Q244 S248 G333 G334	Y133-V246 HydrophobicContact CD1-CG2 4.41Å; Q244-V246 PolarHBondContact O-N 2.89Å; V246-S248 VanDerWaalsContact C-N 3.31Å; V246-G333 WeakPolarHBondContact CG1-O 3.1Å; V246-G333 CarbonylContact O-C 3.54Å; V246-G333 WeakPolarHBondContact O-CA 3.36Å; V246-G333 PolarHBondContact O-N 2.81Å; V246-G334 PolarHBondContact O-N 2.91Å
247	N	84.6	Confident	85.5	Confident	30 Å²	30	39 Å²	39	16%	0.16	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-80.2	-9.8	177.8	-62.4	-24.1	0	0	0	113.6	D181 N183 D243 Q244 G245 D332	D181-N247 PolarHBondContact O-ND2 3.01Å; D181-N247 VanDerWaalsContact OD2-CB 3.23Å; D181-N247 WeakPolarHBondContact OD2-CB 3.4Å; D181-N247 PolarHBondContact OD2-ND2 3.17Å; N183-N247 HydrophobicContact CB-CB 3.73Å; N183-N247 PolarHBondContact N-ND2 3.07Å; N183-N247 VanDerWaalsContact N-ND2 3.2Å; N183-N247 PolarHBondContact ND2-O 2.99Å; D243-N247 HydrophobicContact CB-CB 3.75Å; D243-N247 WeakPolarHBondContact CB-O 3.39Å; Q244-N247 PolarHBondContact O-N 2.86Å; G245-N247 PolarHBondContact O-N 2.85Å; N247-D332 VanDerWaalsContact O-CB 3.3Å; N247-D332 WeakPolarHBondContact O-CB 3.32Å
248	S	83.9	Confident	85.5	Confident	22 Å²	22	38.4 Å²	38.4	15%	0.154	21%	0.214	C	C	.	.	S	Bend	trans	-88.1	-179	178.4	-146.5	0	0	0	0	112.5	D243 G245 V246 K250 D332 G333	D243-S248 WeakPolarHBondContact O-CB 3.02Å; D243-S248 PolarHBondContact O-OG 2.71Å; G245-S248 VanDerWaalsContact O-CB 3.24Å; G245-S248 WeakPolarHBondContact O-CB 3.43Å; G245-S248 PolarHBondContact O-N 2.84Å; V246-S248 VanDerWaalsContact C-N 3.31Å; S248-K250 PolarHBondContact O-N 2.81Å; S248-K250 VanDerWaalsContact O-N 3.12Å; S248-D332 CarbonylContact O-C 3.58Å; S248-D332 WeakPolarHBondContact O-CA 3.45Å; S248-D332 WeakPolarHBondContact O-CB 3.39Å; S248-G333 PolarHBondContact O-N 2.92Å; S248-G333 VanDerWaalsContact O-N 3.08Å
249	I	86.9	Confident	85.4	Confident	17 Å²	17	37 Å²	37	9%	0.087	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	116.1	-175.1	-51.8	-179.3	0	0	0	111.5	F130 Y133 P187 A239 D241 Y252	F130-I249 WeakPolarHBondContact CD2-O 3.36Å; F130-I249 HydrophobicContact CE2-CG2 4.05Å; Y133-I249 PolarHBondContact OH-O 2.96Å; P187-I249 HydrophobicContact CB-CD1 4.49Å; P187-I249 HydrophobicContact CB-CG1 4.28Å; P187-I249 HydrophobicContact CG-CG1 4.24Å; A239-I249 HydrophobicContact CB-CD1 4.01Å; A239-I249 VanDerWaalsContact O-CD1 3.24Å; A239-I249 WeakPolarHBondContact O-CD1 3.48Å; D241-I249 HydrophobicContact CB-CD1 4.17Å; D241-I249 HydrophobicContact CB-CG1 3.64Å; I249-Y252 HydrophobicContact CG2-CD2 4.42Å; I249-Y252 HydrophobicContact CG2-CE2 3.89Å
250	K	87.2	Confident	85.2	Confident	66 Å²	66	42.1 Å²	42.1	29%	0.287	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-30.6	175.5	179.4	165.9	-176.7	-86.9	0	113.2	E129 F130 Y133 S248 Y331 D332	E129-K250 WeakPolarHBondContact CA-O 3.44Å; E129-K250 IonicContact OE1-NZ 3.89Å; E129-K250 PolarHBondContact OE1-NZ 2.78Å; E129-K250 IonicContact OE2-NZ 3.11Å; E129-K250 PolarHBondContact OE2-NZ 3.03Å; F130-K250 PolarHBondContact N-O 2.83Å; Y133-K250 HydrophobicContact CE2-CB 4.46Å; S248-K250 PolarHBondContact O-N 2.81Å; S248-K250 VanDerWaalsContact O-N 3.12Å; K250-Y331 HydrophobicContact CB-CD2 4.29Å; K250-Y331 HydrophobicContact CB-CE2 4.26Å; K250-Y331 HydrophobicContact CG-CE2 4.21Å; K250-Y331 PolarHBondContact N-O 3.12Å; K250-D332 VanDerWaalsContact CB-C 3.41Å; K250-D332 WeakPolarHBondContact CB-O 3.48Å
251	G	88.8	Confident	84.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.6	178.6	-178.2	0	0	0	0	0	114.9	I128 Y331	I128-G251 CarbonylContact O-C 3.6Å; I128-G251 WeakPolarHBondContact O-CA 3.34Å; G251-Y331 PolarHBondContact N-O 2.77Å; G251-Y331 WeakPolarHBondContact O-CD1 3.36Å; G251-Y331 PolarHBondContact O-N 3.4Å
252	Y	92.7	Very high	84.9	Confident	3 Å²	3	42.2 Å²	42.2	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.4	175.2	-67.4	-102.8	0	0	0	109.3	L116 G127 I128 F130 F189 A239 I249 L296 L328 V329 A330	L116-Y252 HydrophobicContact CD2-CE2 3.99Å; G127-Y252 CarbonylContact C-O 3.59Å; G127-Y252 WeakPolarHBondContact CA-O 3.46Å; I128-Y252 HydrophobicContact CD1-CD2 4.48Å; I128-Y252 PolarHBondContact N-O 2.86Å; I128-Y252 PolarHBondContact O-N 2.86Å; F130-Y252 HydrophobicContact CE2-CD2 4.2Å; F130-Y252 AromaticContact CE2-CE2 3.97Å; F130-Y252 HydrophobicContact CE2-CE2 3.97Å; F130-Y252 AromaticContact CZ-CD2 3.72Å; F130-Y252 HydrophobicContact CZ-CD2 3.72Å; F130-Y252 AromaticContact CZ-CE2 3.73Å; F130-Y252 HydrophobicContact CZ-CE2 3.73Å; F189-Y252 HydrophobicContact CE1-CE1 4.12Å; F189-Y252 HydrophobicContact CZ-CD1 4.48Å; F189-Y252 HydrophobicContact CZ-CE1 4.2Å; A239-Y252 HydrophobicContact CB-CE1 4.1Å; A239-Y252 PolarHBondContact N-OH 2.61Å; A239-Y252 PolarHBondContact O-OH 2.92Å; I249-Y252 HydrophobicContact CG2-CD2 4.42Å; I249-Y252 HydrophobicContact CG2-CE2 3.89Å; Y252-L296 HydrophobicContact CD1-CD2 3.69Å; Y252-L296 HydrophobicContact CE1-CD2 3.85Å; Y252-L296 HydrophobicContact CG-CD2 4.09Å; Y252-L328 HydrophobicContact CD1-CD1 4.14Å; Y252-L328 HydrophobicContact CD1-CG 4.41Å; Y252-V329 CarbonylContact C-O 3.55Å; Y252-V329 VanDerWaalsContact CA-O 3.28Å; Y252-V329 WeakPolarHBondContact CA-O 3.48Å; Y252-A330 HydrophobicContact CD1-CB 3.77Å; Y252-A330 HydrophobicContact CE1-CB 3.62Å; Y252-A330 HydrophobicContact CG-CB 4.49Å
253	R	91.9	Very high	85	Confident	63 Å²	63	42.9 Å²	42.9	24%	0.238	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	164.3	172	67.5	177.7	-175.6	-107.2	0.5	111.5	E255 V329 Y331	R253-E255 IonicContact CZ-OE1 2.64Å; R253-E255 IonicContact NE-OE1 2.85Å; R253-E255 PolarHBondContact NE-OE1 2.9Å; R253-E255 IonicContact NH2-OE1 2.6Å; R253-E255 PolarHBondContact NH2-OE1 3.23Å; R253-V329 HydrophobicContact CG-CB 3.96Å; R253-V329 HydrophobicContact CG-CG1 4.43Å; R253-V329 PolarHBondContact N-O 2.68Å; R253-V329 PolarHBondContact O-N 2.82Å; R253-Y331 HydrophobicContact CB-CE1 4.37Å; R253-Y331 HydrophobicContact CG-CD1 4.44Å; R253-Y331 HydrophobicContact CG-CE1 4.17Å
254	L	90.8	Very high	85.2	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.016	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.5	172.2	-59.4	173.3	0	0	0	109.6	A259 F262 L264 L298 F326 L328	L254-A259 HydrophobicContact CB-CB 3.68Å; L254-F262 HydrophobicContact CD1-CB 3.92Å; L254-L264 HydrophobicContact CD1-CD2 4.46Å; L254-L264 HydrophobicContact CD1-CG 4.43Å; L254-L264 HydrophobicContact CD2-CD2 4.08Å; L254-L264 HydrophobicContact CD2-CG 4.42Å; L254-L264 HydrophobicContact CG-CD1 4.42Å; L254-L264 HydrophobicContact CG-CD2 4.31Å; L254-L264 HydrophobicContact CG-CG 4.17Å; L254-L298 HydrophobicContact CD1-CD1 3.64Å; L254-L298 HydrophobicContact CD2-CD1 4.11Å; L254-F326 HydrophobicContact CD2-CD2 4.01Å; L254-F326 HydrophobicContact CD2-CE2 4.48Å; L254-L328 HydrophobicContact CD2-CD1 4.08Å
255	E	90.2	Very high	85.5	Confident	49 Å²	49	42.4 Å²	42.4	23%	0.229	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	166.9	171.3	-68.1	-179.7	-172.3	0	0	109.6	R253 F326 I327 V329 K341	R253-E255 IonicContact CZ-OE1 2.64Å; R253-E255 IonicContact NE-OE1 2.85Å; R253-E255 PolarHBondContact NE-OE1 2.9Å; R253-E255 IonicContact NH2-OE1 2.6Å; R253-E255 PolarHBondContact NH2-OE1 3.23Å; E255-F326 CarbonylContact O-C 3.55Å; E255-F326 WeakPolarHBondContact O-CA 3.43Å; E255-I327 HydrophobicContact CB-CB 4.28Å; E255-I327 PolarHBondContact N-O 2.75Å; E255-I327 PolarHBondContact O-N 2.86Å; E255-V329 HydrophobicContact CB-CG2 4.26Å; E255-V329 HydrophobicContact CG-CG2 3.93Å; E255-K341 IonicContact OE1-NZ 3.21Å; E255-K341 IonicContact OE2-NZ 3.93Å; E255-K341 PolarHBondContact OE2-NZ 2.56Å
256	G	83.5	Confident	85.9	Confident	48 Å²	48	42.3 Å²	42.3	50%	0.495	21%	0.214	S	C	.	.	S	Bend	trans	98.7	170.2	-173.8	0	0	0	0	0	112.8	A259	G256-A259 WeakPolarHBondContact O-CB 3.28Å
257	E	82.2	Confident	85.6	Confident	173 Å²	173	38.9 Å²	38.9	81%	0.808	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-69.1	-37.6	-171.2	-62.5	-169.5	169.8	0	0	112	A259 F260	E257-A259 VanDerWaalsContact C-N 3.31Å; E257-A259 PolarHBondContact O-N 3.5Å; E257-F260 WeakPolarHBondContact O-CD1 3.17Å; E257-F260 WeakPolarHBondContact O-CE1 3.2Å
258	D	84.8	Confident	85	Confident	13 Å²	13	40.8 Å²	40.8	7%	0.07	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-86.4	-0.9	-175.8	-58.6	-34.1	0	0	0	114.5	F260 H261 R321 Y324 H325	D258-F260 PolarHBondContact O-N 2.81Å; D258-F260 VanDerWaalsContact O-N 3.08Å; D258-H261 WeakPolarHBondContact O-CB 3.15Å; D258-H261 PolarHBondContact O-N 2.98Å; D258-R321 IonicContact OD1-CZ 2.75Å; D258-R321 IonicContact OD1-NH1 3.49Å; D258-R321 PolarHBondContact OD1-NH1 2.95Å; D258-R321 IonicContact OD1-NH2 3.71Å; D258-R321 PolarHBondContact OD1-NH2 2.93Å; D258-R321 IonicContact OD2-CZ 3.92Å; D258-R321 IonicContact OD2-NH1 3.89Å; D258-R321 IonicContact OD2-NH2 3.59Å; D258-R321 PolarHBondContact OD2-NH2 2.7Å; D258-Y324 HydrophobicContact CB-CD1 4.18Å; D258-Y324 WeakPolarHBondContact OD2-CA 3.37Å; D258-H325 WeakPolarHBondContact CB-O 3.4Å; D258-H325 PolarHBondContact OD2-N 2.76Å
259	A	83.6	Confident	84	Confident	10 Å²	10	43.9 Å²	43.9	8%	0.083	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-56.7	-27.1	-178.5	0	0	0	0	0	113.5	L254 G256 E257 H261 F262	L254-A259 HydrophobicContact CB-CB 3.68Å; G256-A259 WeakPolarHBondContact O-CB 3.28Å; E257-A259 VanDerWaalsContact C-N 3.31Å; E257-A259 PolarHBondContact O-N 3.5Å; A259-H261 VanDerWaalsContact C-N 3.27Å; A259-H261 PolarHBondContact O-N 2.77Å; A259-F262 PolarHBondContact O-N 3.24Å
260	F	81.9	Confident	82.7	Confident	112 Å²	112	46 Å²	46	49%	0.491	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-71.3	-17.9	179.6	69.5	-101	0	0	0	114	E257 D258 F262	E257-F260 WeakPolarHBondContact O-CD1 3.17Å; E257-F260 WeakPolarHBondContact O-CE1 3.2Å; D258-F260 PolarHBondContact O-N 2.81Å; D258-F260 VanDerWaalsContact O-N 3.08Å; F260-F262 PolarHBondContact O-N 2.86Å
261	H	79.1	Confident	80.8	Confident	43 Å²	43	49.5 Å²	49.5	20%	0.199	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-73.4	-10.3	176.6	-73.7	-80.3	0	0	0	113.1	D258 A259 V301 R321 Y324	D258-H261 WeakPolarHBondContact O-CB 3.15Å; D258-H261 PolarHBondContact O-N 2.98Å; A259-H261 VanDerWaalsContact C-N 3.27Å; A259-H261 PolarHBondContact O-N 2.77Å; H261-V301 PolarHBondContact O-N 2.83Å; H261-R321 PolarHBondContact NE2-NH1 2.84Å; H261-Y324 HydrophobicContact CB-CD1 4.34Å; H261-Y324 HydrophobicContact CB-CE1 4.13Å; H261-Y324 AromaticContact CD2-CD1 3.83Å; H261-Y324 AromaticContact CD2-CE1 3.71Å; H261-Y324 AromaticContact CG-CE1 3.73Å; H261-Y324 AromaticContact ND1-CE1 3.94Å; H261-Y324 AromaticContact NE2-CE1 3.9Å
262	F	85.5	Confident	78.8	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	164.3	-170	-53.7	-82.5	0	0	0	113.3	L254 A259 F260 L298 V299 P300 L316 Y324 F326 L346	L254-F262 HydrophobicContact CD1-CB 3.92Å; A259-F262 PolarHBondContact O-N 3.24Å; F260-F262 PolarHBondContact O-N 2.86Å; F262-L298 HydrophobicContact CB-CD1 3.48Å; F262-L298 VanDerWaalsContact CB-CD1 3.48Å; F262-L298 HydrophobicContact CB-CD2 4.44Å; F262-L298 HydrophobicContact CB-CG 3.87Å; F262-L298 HydrophobicContact CD1-CD1 4.36Å; F262-L298 HydrophobicContact CD1-CD2 3.82Å; F262-L298 HydrophobicContact CD1-CG 3.83Å; F262-L298 HydrophobicContact CE1-CD2 4.19Å; F262-L298 HydrophobicContact CG-CD1 3.95Å; F262-L298 HydrophobicContact CG-CD2 4Å; F262-L298 HydrophobicContact CG-CG 3.93Å; F262-V299 CarbonylContact C-O 3.54Å; F262-V299 WeakPolarHBondContact CA-O 3.42Å; F262-P300 HydrophobicContact CD1-CG 4.34Å; F262-P300 HydrophobicContact CE1-CG 4.28Å; F262-L316 HydrophobicContact CE1-CD2 4.2Å; F262-L316 HydrophobicContact CZ-CD2 4.39Å; F262-Y324 AromaticContact CE2-CD1 3.82Å; F262-Y324 HydrophobicContact CE2-CD1 3.82Å; F262-Y324 HydrophobicContact CE2-CE1 4.38Å; F262-Y324 HydrophobicContact CE2-CG 4.01Å; F262-Y324 AromaticContact CZ-CD1 3.99Å; F262-Y324 HydrophobicContact CZ-CD1 3.99Å; F262-Y324 HydrophobicContact CZ-CD2 4.29Å; F262-Y324 HydrophobicContact CZ-CE1 4.27Å; F262-Y324 AromaticContact CZ-CG 4Å; F262-Y324 HydrophobicContact CZ-CG 4Å; F262-F326 HydrophobicContact CD2-CD1 4.26Å; F262-F326 HydrophobicContact CD2-CE1 4.18Å; F262-F326 HydrophobicContact CE2-CD1 4.15Å; F262-F326 AromaticContact CE2-CE1 3.9Å; F262-F326 HydrophobicContact CE2-CE1 3.9Å; F262-L346 HydrophobicContact CE1-CD2 3.89Å; F262-L346 HydrophobicContact CE2-CD2 4.46Å; F262-L346 HydrophobicContact CZ-CD2 3.59Å
263	R	87.6	Confident	76.6	Confident	74 Å²	74	55.7 Å²	55.7	28%	0.279	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	161.4	166.5	67.7	179.7	-179.7	-76.5	0.4	110.5	E265 V299 P300 V301	R263-E265 IonicContact CZ-OE1 3.18Å; R263-E265 IonicContact NE-OE1 2.81Å; R263-E265 PolarHBondContact NE-OE1 3.32Å; R263-E265 IonicContact NH2-OE1 2.74Å; R263-E265 PolarHBondContact NH2-OE1 3.48Å; R263-V299 HydrophobicContact CG-CB 4.13Å; R263-V299 PolarHBondContact N-O 2.77Å; R263-V299 VanDerWaalsContact NH2-CG1 3.29Å; R263-V299 PolarHBondContact O-N 3.35Å; R263-P300 PolarHBondContact NH1-O 3.09Å; R263-V301 HydrophobicContact CB-CG2 3.79Å; R263-V301 HydrophobicContact CG-CG2 3.81Å
264	L	89.8	Confident	74.2	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.7	170.9	-60.7	178.5	0	0	0	110.8	G126 I128 L236 L254 L296 W297 L298 L328	G126-L264 WeakPolarHBondContact O-CB 3.1Å; G126-L264 PolarHBondContact O-N 2.88Å; I128-L264 HydrophobicContact CD1-CB 4.14Å; I128-L264 HydrophobicContact CG1-CB 4.02Å; I128-L264 HydrophobicContact CG1-CD1 4.23Å; I128-L264 HydrophobicContact CG2-CB 4.1Å; I128-L264 WeakPolarHBondContact CG2-O 3.18Å; L236-L264 HydrophobicContact CD1-CD2 3.45Å; L236-L264 VanDerWaalsContact CD1-CD2 3.45Å; L254-L264 HydrophobicContact CD1-CD2 4.46Å; L254-L264 HydrophobicContact CD1-CG 4.43Å; L254-L264 HydrophobicContact CD2-CD2 4.08Å; L254-L264 HydrophobicContact CD2-CG 4.42Å; L254-L264 HydrophobicContact CG-CD1 4.42Å; L254-L264 HydrophobicContact CG-CD2 4.31Å; L254-L264 HydrophobicContact CG-CG 4.17Å; L264-L296 HydrophobicContact CB-CD1 4.27Å; L264-L296 HydrophobicContact CD1-CD1 4.47Å; L264-L296 HydrophobicContact CD2-CD1 4.28Å; L264-W297 CarbonylContact C-O 3.58Å; L264-W297 WeakPolarHBondContact CA-O 3.42Å; L264-L298 HydrophobicContact CD2-CD1 4.15Å; L264-L328 HydrophobicContact CD1-CD1 3.96Å; L264-L328 HydrophobicContact CD2-CD1 4.2Å
265	E	84.6	Confident	71.5	Confident	42 Å²	42	65.3 Å²	65.3	20%	0.196	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	155.8	169.8	-70	-174.8	-175.1	0	0	109.8	R233 R263 W297 V299	R233-E265 IonicContact CZ-OE2 2.72Å; R233-E265 IonicContact NE-OE2 3.7Å; R233-E265 PolarHBondContact NE-OE2 2.88Å; R233-E265 IonicContact NH2-OE2 3.36Å; R233-E265 PolarHBondContact NH2-OE2 2.66Å; R263-E265 IonicContact CZ-OE1 3.18Å; R263-E265 IonicContact NE-OE1 2.81Å; R263-E265 PolarHBondContact NE-OE1 3.32Å; R263-E265 IonicContact NH2-OE1 2.74Å; R263-E265 PolarHBondContact NH2-OE1 3.48Å; E265-W297 HydrophobicContact CB-CB 4.44Å; E265-W297 PolarHBondContact N-O 3.45Å; E265-W297 PolarHBondContact O-N 2.83Å; E265-V299 HydrophobicContact CB-CG2 4.05Å; E265-V299 HydrophobicContact CG-CG2 3.84Å
266	I	83.7	Confident	69	Low	34 Å²	34	68.7 Å²	68.7	17%	0.174	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141	168.1	-70.7	-171.5	0	0	0	109.2	L116 A120 I128 F130 N294 R295 L296	L116-I266 HydrophobicContact CB-CD1 4.27Å; L116-I266 HydrophobicContact CD1-CD1 4.19Å; L116-I266 HydrophobicContact CD2-CD1 4.01Å; L116-I266 HydrophobicContact CG-CD1 4.39Å; A120-I266 HydrophobicContact CB-CD1 4.16Å; I128-I266 HydrophobicContact CD1-CD1 3.76Å; I128-I266 HydrophobicContact CD1-CG1 3.7Å; F130-I266 HydrophobicContact CD1-CD1 4.45Å; F130-I266 HydrophobicContact CE1-CD1 3.46Å; F130-I266 VanDerWaalsContact CE1-CD1 3.46Å; F130-I266 HydrophobicContact CZ-CD1 3.96Å; I266-N294 HydrophobicContact CG2-CB 3.7Å; I266-R295 WeakPolarHBondContact CA-O 3.37Å; I266-L296 HydrophobicContact CG1-CD1 4.42Å
267	G	74.1	Confident	66.4	Low	6 Å²	6	78.6 Å²	78.6	6%	0.062	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	168.6	172.9	0	0	0	0	0	113.9	R295 W297	G267-R295 PolarHBondContact N-O 2.8Å; G267-R295 PolarHBondContact O-N 2.86Å; G267-W297 PolarHBondContact O-NE1 2.66Å
268	P	72.6	Confident	64.2	Low	70 Å²	70	74.3 Å²	74.3	46%	0.455	36%	0.363	S	S	.	.			trans	-71.5	161.7	178.3	31.4	-37	0	0	0	112	I270	P268-I270 PolarHBondContact O-N 3.13Å
269	L	63.3	Low	61.7	Low	87 Å²	87	78.7 Å²	78.7	46%	0.455	38%	0.383	S	S	.	.			trans	-71.3	120.7	170.6	-139	83.5	0	0	0	109.9	R295 W297	L269-R295 HydrophobicContact CD1-CG 4.04Å; L269-W297 HydrophobicContact CD1-CH2 3.97Å; L269-W297 HydrophobicContact CD1-CZ2 3.95Å
270	I	58.6	Low	59.1	Low	63 Å²	63	88 Å²	88	32%	0.323	42%	0.421	S	S	.	.			trans	-106.3	128.6	179.7	-47	-179.6	0	0	0	109.7	P268 T272 D273	P268-I270 PolarHBondContact O-N 3.13Å; I270-T272 WeakPolarHBondContact CG2-OG1 3.34Å; I270-T272 PolarHBondContact O-N 2.94Å; I270-D273 WeakPolarHBondContact O-CB 3.41Å; I270-D273 PolarHBondContact O-N 2.8Å
271	N	48.3	Very low	56.9	Low	139 Å²	139	89.2 Å²	89.2	74%	0.743	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-10.1	-178.6	-86.5	-1.4	0	0	0	115.4	D273	N271-D273 VanDerWaalsContact C-N 3.29Å
272	T	46	Very low	54.7	Low	71 Å²	71	94.2 Å²	94.2	44%	0.436	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-18.8	172.2	47.4	0	0	0	0	113.4	K230 I270 L274	K230-T272 PolarHBondContact NZ-OG1 2.88Å; I270-T272 WeakPolarHBondContact CG2-OG1 3.34Å; I270-T272 PolarHBondContact O-N 2.94Å; T272-L274 VanDerWaalsContact C-N 3.34Å
273	D	47.5	Very low	52.1	Low	62 Å²	62	102.9 Å²	102.9	33%	0.332	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-6.5	-164	-50.2	-6.1	0	0	0	110.6	I270 N271 N275	I270-D273 WeakPolarHBondContact O-CB 3.41Å; I270-D273 PolarHBondContact O-N 2.8Å; N271-D273 VanDerWaalsContact C-N 3.29Å; D273-N275 VanDerWaalsContact C-N 3.31Å
274	L	40.5	Very low	49.2	Very low	122 Å²	122	108.1 Å²	108.1	64%	0.639	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	4.7	169.8	-79	102.6	0	0	0	114.5	T272	T272-L274 VanDerWaalsContact C-N 3.34Å
275	N	33.9	Very low	46.3	Very low	146 Å²	146	113.9 Å²	113.9	78%	0.781	55%	0.553	S	S	*	*			trans	-87.6	-3.5	-171.7	-106.7	3.4	0	0	0	115.7	D273	D273-N275 VanDerWaalsContact C-N 3.31Å
276	Y	38.7	Very low	43.4	Very low	119 Å²	119	114.7 Å²	114.7	47%	0.467	57%	0.573	S	S	.	*	S	Bend	trans	-80.9	139.4	166.4	-88.9	-90.8	0	0	0	110.5	P208 I278	P208-Y276 HydrophobicContact CG-CD1 3.65Å; P208-Y276 HydrophobicContact CG-CE1 4.16Å; Y276-I278 PolarHBondContact O-N 2.86Å
277	R	28.8	Very low	40.6	Very low	256 Å²	256	121.2 Å²	121.2	97%	0.966	61%	0.607	S	S	*	*			trans	-76.4	54.6	-175.1	-74.1	-178.3	167.5	177.4	-1.8	113.5	H279	R277-H279 PolarHBondContact O-N 2.64Å
278	I	36.1	Very low	38.6	Very low	84 Å²	84	128.9 Å²	128.9	43%	0.431	64%	0.639	S	S	.	*			trans	-86.2	114.9	176.6	-56.7	-179.4	0	0	0	110	I207 Y276	I207-I278 HydrophobicContact CG2-CD1 4.28Å; Y276-I278 PolarHBondContact O-N 2.86Å
279	H	30.6	Very low	36.5	Very low	105 Å²	105	134.3 Å²	134.3	49%	0.486	66%	0.659	S	S	.	*			trans	35.5	114	168.1	-81	-94.4	0	0	0	120.3	R277 E281	R277-H279 PolarHBondContact O-N 2.64Å; H279-E281 IonicContact CE1-OE2 2.85Å; H279-E281 IonicContact CG-OE2 3.9Å; H279-E281 IonicContact ND1-OE2 3.57Å; H279-E281 PolarHBondContact ND1-OE2 2.98Å; H279-E281 PolarHBondContact O-N 2.78Å
280	K	31.1	Very low	35.4	Very low	205 Å²	205	134 Å²	134	89%	0.891	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	19.6	174.5	-152.2	178.3	-176.1	-179.7	0	114.3
281	E	34.2	Very low	35	Very low	138 Å²	138	138.5 Å²	138.5	65%	0.645	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.1	-21.3	-165.8	-69.6	170.5	122.4	0	0	113.3	H279 Q283	H279-E281 IonicContact CE1-OE2 2.85Å; H279-E281 IonicContact CG-OE2 3.9Å; H279-E281 IonicContact ND1-OE2 3.57Å; H279-E281 PolarHBondContact ND1-OE2 2.98Å; H279-E281 PolarHBondContact O-N 2.78Å; E281-Q283 PolarHBondContact O-N 2.88Å
282	F	32.6	Very low	35.2	Very low	147 Å²	147	140.9 Å²	140.9	65%	0.645	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-73.7	10.3	178.3	-87.8	-79.7	0	0	0	115.3	Q284	F282-Q284 PolarHBondContact O-N 2.76Å
283	Q	30.6	Very low	36	Very low	186 Å²	186	139 Å²	139	87%	0.869	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-78.7	9.7	173.3	-73.1	-167.5	-28	0	0	114.4	E281	E281-Q283 PolarHBondContact O-N 2.88Å
284	Q	27	Very low	37.3	Very low	184 Å²	184	137.1 Å²	137.1	86%	0.86	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-113.3	23.2	-178	-66.6	-160.8	-1.2	0	0	116	F282	F282-Q284 PolarHBondContact O-N 2.76Å
285	V	29.1	Very low	39.2	Very low	125 Å²	125	134.2 Å²	134.2	76%	0.758	64%	0.641	S	S	*	*			trans	-127	111.4	160.3	-171.4	0	0	0	0	109.5
286	G	24.1	Very low	41.8	Very low	60 Å²	60	127.3 Å²	127.3	62%	0.619	60%	0.604	S	S	*	*			trans	-84.8	178.6	172.3	0	0	0	0	0	112.6
287	L	25.9	Very low	44.1	Very low	170 Å²	170	122.3 Å²	122.3	89%	0.89	58%	0.584	S	S	*	*			trans	88.7	29.9	172	-52.6	172	0	0	0	119.2
288	F	30.5	Very low	46.9	Very low	167 Å²	167	110.1 Å²	110.1	73%	0.732	54%	0.538	S	S	*	.			trans	-126.4	95.7	155.5	-72.6	-70.8	0	0	0	111.7
289	Q	29.9	Very low	49.1	Very low	185 Å²	185	106.2 Å²	106.2	86%	0.864	52%	0.518	S	S	*	.			trans	-109.6	8.8	-176.5	-146	175	25.5	0	0	113.5	H291	Q289-H291 PolarHBondContact O-N 3.47Å
290	D	40.1	Very low	51.4	Low	79 Å²	79	101.7 Å²	101.7	42%	0.422	50%	0.498	S	S	.	.			trans	-91.2	100.8	176.4	179.1	33.1	0	0	0	112	K292 S293	D290-K292 PolarHBondContact O-N 2.87Å; D290-K292 WeakPolarHBondContact OD1-CB 3.4Å; D290-K292 PolarHBondContact OD1-N 3.1Å; D290-S293 WeakPolarHBondContact OD2-CB 3.48Å; D290-S293 PolarHBondContact OD2-N 2.89Å; D290-S293 PolarHBondContact OD2-OG 2.82Å
291	H	48.5	Very low	53.4	Low	159 Å²	159	94.5 Å²	94.5	74%	0.736	47%	0.471	S	S	*	.	S	Bend	trans	-80.3	9.8	174.5	-67.3	-77.1	0	0	0	113.9	Q289	Q289-H291 PolarHBondContact O-N 3.47Å
292	K	53.2	Low	54.6	Low	188 Å²	188	96.2 Å²	96.2	82%	0.817	47%	0.472	S	S	*	.	S	Bend	trans	-113.5	-16.3	-174.8	-66	-173.6	174	-175.8	0	116.1	D290	D290-K292 PolarHBondContact O-N 2.87Å; D290-K292 WeakPolarHBondContact OD1-CB 3.4Å; D290-K292 PolarHBondContact OD1-N 3.1Å
293	S	63.6	Low	55.6	Low	32 Å²	32	94.9 Å²	94.9	22%	0.224	47%	0.471	C	S	.	.	S	Bend	trans	-80.1	141.4	178.4	37.8	0	0	0	0	112.1	D290 R295	D290-S293 WeakPolarHBondContact OD2-CB 3.48Å; D290-S293 PolarHBondContact OD2-N 2.89Å; D290-S293 PolarHBondContact OD2-OG 2.82Å; S293-R295 VanDerWaalsContact CB-NH1 3.31Å; S293-R295 PolarHBondContact O-NH1 3.48Å; S293-R295 PolarHBondContact OG-NH1 3.2Å
294	N	74.1	Confident	56.3	Low	22 Å²	22	89.2 Å²	89.2	12%	0.118	46%	0.463	C	S	.	.			trans	-67.1	164.3	174.9	-62	-56.3	0	0	0	112	L116 D118 I266	L116-N294 HydrophobicContact CB-CB 4.14Å; L116-N294 PolarHBondContact O-ND2 3.44Å; D118-N294 PolarHBondContact OD1-ND2 3.47Å; I266-N294 HydrophobicContact CG2-CB 3.7Å
295	R	81.3	Confident	56.8	Low	62 Å²	62	85 Å²	85	23%	0.234	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	157.5	175.7	-63.3	-64.2	179.9	-87.7	-3.1	111.1	L235 I266 G267 L269 S293 W297	L235-R295 HydrophobicContact CD1-CB 3.7Å; L235-R295 HydrophobicContact CD1-CG 4.04Å; I266-R295 WeakPolarHBondContact CA-O 3.37Å; G267-R295 PolarHBondContact N-O 2.8Å; G267-R295 PolarHBondContact O-N 2.86Å; L269-R295 HydrophobicContact CD1-CG 4.04Å; S293-R295 VanDerWaalsContact CB-NH1 3.31Å; S293-R295 PolarHBondContact O-NH1 3.48Å; S293-R295 PolarHBondContact OG-NH1 3.2Å; R295-W297 HydrophobicContact CB-CZ2 4.34Å; R295-W297 VanDerWaalsContact O-CD1 3.26Å
296	L	88.2	Confident	57	Low	0 Å²	0	82.1 Å²	82.1	0%	0	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129.2	173.1	-176.7	65	0	0	0	109.6	L116 I128 L236 T238 Y252 L264 I266 L328	L116-L296 HydrophobicContact CD1-CB 4.17Å; I128-L296 HydrophobicContact CD1-CD1 3.54Å; L236-L296 HydrophobicContact CB-CB 4.34Å; L236-L296 HydrophobicContact CB-CD2 3.97Å; L236-L296 HydrophobicContact CB-CG 4.01Å; L236-L296 HydrophobicContact CD1-CD2 4.19Å; L236-L296 HydrophobicContact CD1-CG 4.25Å; L236-L296 PolarHBondContact N-O 2.72Å; T238-L296 HydrophobicContact CG2-CB 4.15Å; Y252-L296 HydrophobicContact CD1-CD2 3.69Å; Y252-L296 HydrophobicContact CE1-CD2 3.85Å; Y252-L296 HydrophobicContact CG-CD2 4.09Å; L264-L296 HydrophobicContact CB-CD1 4.27Å; L264-L296 HydrophobicContact CD1-CD1 4.47Å; L264-L296 HydrophobicContact CD2-CD1 4.28Å; I266-L296 HydrophobicContact CG1-CD1 4.42Å; L296-L328 HydrophobicContact CD2-CD1 4.25Å; L296-L328 HydrophobicContact CD2-CD2 4.09Å
297	W	86.3	Confident	57.5	Low	14 Å²	14	85.5 Å²	85.5	5%	0.053	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.3	-177.2	-58.8	94.8	0	0	0	111.1	R233 I234 L235 L264 E265 G267 L269 R295 V299	R233-W297 HydrophobicContact CB-CB 4.32Å; R233-W297 HydrophobicContact CB-CD2 3.98Å; R233-W297 HydrophobicContact CB-CE3 3.54Å; R233-W297 HydrophobicContact CB-CG 4.35Å; R233-W297 HydrophobicContact CB-CZ3 4.08Å; I234-W297 CarbonylContact O-C 3.51Å; I234-W297 WeakPolarHBondContact O-CA 3.34Å; L235-W297 HydrophobicContact CB-CE3 4.19Å; L235-W297 HydrophobicContact CB-CZ3 3.96Å; L235-W297 HydrophobicContact CD1-CE3 4.41Å; L235-W297 HydrophobicContact CD1-CH2 4.47Å; L235-W297 HydrophobicContact CD1-CZ3 4.36Å; L264-W297 CarbonylContact C-O 3.58Å; L264-W297 WeakPolarHBondContact CA-O 3.42Å; E265-W297 HydrophobicContact CB-CB 4.44Å; E265-W297 PolarHBondContact N-O 3.45Å; E265-W297 PolarHBondContact O-N 2.83Å; G267-W297 PolarHBondContact O-NE1 2.66Å; L269-W297 HydrophobicContact CD1-CH2 3.97Å; L269-W297 HydrophobicContact CD1-CZ2 3.95Å; R295-W297 HydrophobicContact CB-CZ2 4.34Å; R295-W297 VanDerWaalsContact O-CD1 3.26Å; W297-V299 HydrophobicContact CB-CG2 4.38Å
298	L	87.7	Confident	57.7	Low	0 Å²	0	84 Å²	84	0%	0	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	131.8	165	-171.4	77.9	0	0	0	108.8	I234 L236 L254 F262 L264 F326	I234-L298 HydrophobicContact CB-CB 4.19Å; I234-L298 HydrophobicContact CD1-CD2 4.15Å; I234-L298 PolarHBondContact N-O 3.14Å; I234-L298 PolarHBondContact O-N 2.73Å; L236-L298 HydrophobicContact CD1-CB 3.91Å; L236-L298 HydrophobicContact CD1-CD1 4.29Å; L236-L298 HydrophobicContact CD2-CB 4.07Å; L236-L298 HydrophobicContact CG-CB 3.89Å; L254-L298 HydrophobicContact CD1-CD1 3.64Å; L254-L298 HydrophobicContact CD2-CD1 4.11Å; F262-L298 HydrophobicContact CB-CD1 3.48Å; F262-L298 VanDerWaalsContact CB-CD1 3.48Å; F262-L298 HydrophobicContact CB-CD2 4.44Å; F262-L298 HydrophobicContact CB-CG 3.87Å; F262-L298 HydrophobicContact CD1-CD1 4.36Å; F262-L298 HydrophobicContact CD1-CD2 3.82Å; F262-L298 HydrophobicContact CD1-CG 3.83Å; F262-L298 HydrophobicContact CE1-CD2 4.19Å; F262-L298 HydrophobicContact CG-CD1 3.95Å; F262-L298 HydrophobicContact CG-CD2 4Å; F262-L298 HydrophobicContact CG-CG 3.93Å; L264-L298 HydrophobicContact CD2-CD1 4.15Å; L298-F326 HydrophobicContact CD1-CE2 4.29Å; L298-F326 HydrophobicContact CD2-CE1 4.13Å; L298-F326 HydrophobicContact CD2-CE2 3.88Å; L298-F326 HydrophobicContact CD2-CZ 3.37Å
299	V	82.6	Confident	57.9	Low	2 Å²	2	85.5 Å²	85.5	1%	0.012	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127.4	-176.5	-171	0	0	0	0	110.1	P231 R233 F262 R263 E265 W297	P231-V299 HydrophobicContact CB-CG1 4.23Å; R233-V299 HydrophobicContact CG-CG2 3.96Å; F262-V299 CarbonylContact C-O 3.54Å; F262-V299 WeakPolarHBondContact CA-O 3.42Å; R263-V299 HydrophobicContact CG-CB 4.13Å; R263-V299 PolarHBondContact N-O 2.77Å; R263-V299 VanDerWaalsContact NH2-CG1 3.29Å; R263-V299 PolarHBondContact O-N 3.35Å; E265-V299 HydrophobicContact CB-CG2 4.05Å; E265-V299 HydrophobicContact CG-CG2 3.84Å; W297-V299 HydrophobicContact CB-CG2 4.38Å
300	P	79.2	Confident	58	Low	11 Å²	11	82.4 Å²	82.4	7%	0.071	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	147.5	177.6	-28	36.5	0	0	0	114.2	F262 R263 G314 L316	F262-P300 HydrophobicContact CD1-CG 4.34Å; F262-P300 HydrophobicContact CE1-CG 4.28Å; R263-P300 PolarHBondContact NH1-O 3.09Å; P300-G314 WeakPolarHBondContact CB-O 3.34Å; P300-L316 HydrophobicContact CG-CD1 4.17Å; P300-L316 HydrophobicContact CG-CD2 4.31Å; P300-L316 HydrophobicContact CG-CG 4.17Å
301	V	72.2	Confident	57.8	Low	53 Å²	53	84.5 Å²	84.5	32%	0.321	48%	0.484	S	S	.	.			trans	-124.7	130.2	179.9	178.6	0	0	0	0	109.2	H261 R263	H261-V301 PolarHBondContact O-N 2.83Å; R263-V301 HydrophobicContact CB-CG2 3.79Å; R263-V301 HydrophobicContact CG-CG2 3.81Å
302	R	59.3	Low	57.4	Low	175 Å²	175	80.9 Å²	80.9	66%	0.66	47%	0.47	S	S	*	.			trans	-80.2	130.1	176.8	-148.4	179.2	-156.6	-155	8.7	110	G304	R302-G304 PolarHBondContact O-N 2.89Å
303	N	54.1	Low	57.3	Low	119 Å²	119	74.2 Å²	74.2	64%	0.636	44%	0.444	S	S	*	.	S	Bend	trans	-67.5	93.6	177.3	-93.3	-19.9	0	0	0	111.5
304	G	45.9	Very low	56.9	Low	67 Å²	67	73.3 Å²	73.3	69%	0.691	44%	0.439	S	S	*	.			trans	-177.6	107.1	175.5	0	0	0	0	0	112.3	R302 G306	R302-G304 PolarHBondContact O-N 2.89Å; G304-G306 PolarHBondContact O-N 3.08Å
305	G	35.8	Very low	56.5	Low	96 Å²	96	77 Å²	77	99%	0.99	46%	0.455	S	S	*	.			trans	-79.2	106.2	-179.8	0	0	0	0	0	112.7
306	G	34	Very low	56.4	Low	63 Å²	63	74.2 Å²	74.2	65%	0.649	45%	0.445	S	S	*	.			trans	178.3	117.1	173.4	0	0	0	0	0	114	G304	G304-G306 PolarHBondContact O-N 3.08Å
307	T	34.9	Very low	55.9	Low	131 Å²	131	76.6 Å²	76.6	80%	0.804	46%	0.458	S	S	*	.			trans	17.7	107.4	157.9	52.7	0	0	0	0	119.4	E309	T307-E309 PolarHBondContact O-N 3.38Å
308	T	30.9	Very low	55.7	Low	139 Å²	139	77.2 Å²	77.2	85%	0.853	46%	0.461	S	S	*	.			trans	19.5	89.3	140.7	55.6	0	0	0	0	118.4
309	E	34.3	Very low	55.4	Low	198 Å²	198	79.4 Å²	79.4	93%	0.925	47%	0.471	S	S	*	.			trans	-152	164.9	148.6	-120	166.3	-138.1	0	0	110.1	T307	T307-E309 PolarHBondContact O-N 3.38Å
310	T	31.6	Very low	55.2	Low	121 Å²	121	86.6 Å²	86.6	74%	0.742	51%	0.505	S	S	*	.			trans	-100.8	151.9	-158.6	53	0	0	0	0	115.1
311	I	35.2	Very low	55.3	Low	123 Å²	123	90 Å²	90	63%	0.631	52%	0.516	S	S	*	.			trans	77.8	80.5	163.6	-53.3	147.2	0	0	0	115.2
312	N	40.9	Very low	55.8	Low	83 Å²	83	90.3 Å²	90.3	44%	0.444	52%	0.521	S	S	.	.				-162.9	147.5	102.5	-104.1	14.6	0	0	0	108.7
313	N	51.5	Low	57.2	Low	48 Å²	48	85.5 Å²	85.5	26%	0.257	51%	0.506	S	S	.	.			trans	-82.2	162.2	-170.6	-50.8	-63.2	0	0	0	110.8	H229 K230 P231 E315	H229-N313 PolarHBondContact O-ND2 3.37Å; K230-N313 VanDerWaalsContact C-ND2 3.31Å; K230-N313 PolarHBondContact O-ND2 2.83Å; P231-N313 VanDerWaalsContact CA-CG 3.4Å; P231-N313 WeakPolarHBondContact CA-OD1 3.03Å; P231-N313 HydrophobicContact CB-CB 4.43Å; P231-N313 WeakPolarHBondContact CB-OD1 3.1Å; N313-E315 PolarHBondContact O-N 2.88Å
314	G	55.4	Low	58.8	Low	12 Å²	12	80.2 Å²	80.2	12%	0.124	48%	0.477	C	S	.	.			trans	-66.3	101.6	173.1	0	0	0	0	0	109.7	P300	P300-G314 WeakPolarHBondContact CB-O 3.34Å
315	E	65.9	Low	60.9	Low	99 Å²	99	80.3 Å²	80.3	46%	0.463	46%	0.459	S	S	.	.			trans	-62.2	140.5	173.3	-75.2	133.5	177.6	0	0	109.9	T210 N313	T210-E315 HydrophobicContact CG2-CG 4.37Å; T210-E315 VanDerWaalsContact OG1-CA 3.29Å; T210-E315 WeakPolarHBondContact OG1-CA 3.4Å; T210-E315 VanDerWaalsContact OG1-CB 3.31Å; T210-E315 WeakPolarHBondContact OG1-CB 3.19Å; N313-E315 PolarHBondContact O-N 2.88Å
316	L	77.8	Confident	63.4	Low	5 Å²	5	76 Å²	76	3%	0.026	41%	0.413	C	S	.	.			trans	-109.2	125.4	172	-65.2	173.8	0	0	0	105.7	I207 E209 T210 I234 F262 P300 Y324 I348	I207-L316 HydrophobicContact CD1-CD1 3.63Å; E209-L316 WeakPolarHBondContact CB-O 3.28Å; T210-L316 PolarHBondContact N-O 3.32Å; T210-L316 PolarHBondContact OG1-N 2.77Å; T210-L316 PolarHBondContact OG1-O 3.25Å; I234-L316 HydrophobicContact CD1-CD1 4.46Å; F262-L316 HydrophobicContact CE1-CD2 4.2Å; F262-L316 HydrophobicContact CZ-CD2 4.39Å; P300-L316 HydrophobicContact CG-CD1 4.17Å; P300-L316 HydrophobicContact CG-CD2 4.31Å; P300-L316 HydrophobicContact CG-CG 4.17Å; L316-Y324 HydrophobicContact CD2-CE2 4.2Å; L316-I348 HydrophobicContact CB-CD1 4.38Å; L316-I348 HydrophobicContact CD1-CD1 4.14Å
317	D	78.6	Confident	66.1	Low	49 Å²	49	75.5 Å²	75.5	26%	0.262	40%	0.395	S	S	.	.			trans	-134.7	116.8	-168.2	163.3	-12.6	0	0	0	105.5	E319 Q320 R321	D317-E319 PolarHBondContact OD1-N 2.83Å; D317-E319 VanDerWaalsContact OD1-N 3.17Å; D317-Q320 HydrophobicContact CB-CB 3.99Å; D317-Q320 VanDerWaalsContact CG-CB 3.46Å; D317-Q320 PolarHBondContact O-N 3.36Å; D317-Q320 WeakPolarHBondContact OD1-CB 3.43Å; D317-Q320 PolarHBondContact OD1-N 3.01Å; D317-R321 PolarHBondContact O-N 3.33Å
318	K	82.6	Confident	68.9	Low	28 Å²	28	69.3 Å²	69.3	12%	0.122	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-36.9	-171.5	-170.9	-166.5	165.8	-155	0	111.6	E209 Q320 R321 S322 I348 D350	E209-K318 WeakPolarHBondContact OE2-CB 3.36Å; E209-K318 PolarHBondContact OE2-N 2.85Å; K318-Q320 VanDerWaalsContact C-N 3.25Å; K318-Q320 PolarHBondContact O-N 2.99Å; K318-R321 CarbonylContact O-C 3.58Å; K318-R321 VanDerWaalsContact O-C 3.24Å; K318-R321 PolarHBondContact O-N 2.77Å; K318-R321 VanDerWaalsContact O-N 3.11Å; K318-S322 PolarHBondContact O-N 2.91Å; K318-I348 HydrophobicContact CB-CB 4.32Å; K318-I348 HydrophobicContact CB-CG2 3.79Å; K318-I348 HydrophobicContact CG-CB 4.23Å; K318-I348 HydrophobicContact CG-CG2 4.18Å; K318-D350 HydrophobicContact CD-CB 3.98Å; K318-D350 WeakPolarHBondContact CD-OD1 3.39Å; K318-D350 IonicContact NZ-OD1 3.81Å; K318-D350 PolarHBondContact NZ-OD1 3.21Å
319	E	79.9	Confident	71.8	Confident	46 Å²	46	62.7 Å²	62.7	22%	0.215	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.7	175.5	-80.3	51.8	-120.8	0	0	111.5	D317 R385 N387	D317-E319 PolarHBondContact OD1-N 2.83Å; D317-E319 VanDerWaalsContact OD1-N 3.17Å; E319-R385 HydrophobicContact CG-CB 4.2Å; E319-R385 WeakPolarHBondContact CG-O 3.28Å; E319-N387 WeakPolarHBondContact OE1-CB 3.49Å; E319-N387 PolarHBondContact OE1-N 2.81Å; E319-N387 PolarHBondContact OE1-ND2 3.43Å
320	Q	79.7	Confident	74.5	Confident	153 Å²	153	53.2 Å²	53.2	72%	0.715	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-48.3	163.1	-176.9	171.7	40.6	0	0	111.8	D317 K318	D317-Q320 HydrophobicContact CB-CB 3.99Å; D317-Q320 VanDerWaalsContact CG-CB 3.46Å; D317-Q320 PolarHBondContact O-N 3.36Å; D317-Q320 WeakPolarHBondContact OD1-CB 3.43Å; D317-Q320 PolarHBondContact OD1-N 3.01Å; K318-Q320 VanDerWaalsContact C-N 3.25Å; K318-Q320 PolarHBondContact O-N 2.99Å
321	R	80.6	Confident	77.4	Confident	81 Å²	81	48.3 Å²	48.3	31%	0.306	24%	0.24	S	C	.	.			trans	-159.9	113.6	-178.9	-171.8	163.3	-174.6	173	8.4	114.8	D258 H261 D317 K318 E323 Y324	D258-R321 IonicContact OD1-CZ 2.75Å; D258-R321 IonicContact OD1-NH1 3.49Å; D258-R321 PolarHBondContact OD1-NH1 2.95Å; D258-R321 IonicContact OD1-NH2 3.71Å; D258-R321 PolarHBondContact OD1-NH2 2.93Å; D258-R321 IonicContact OD2-CZ 3.92Å; D258-R321 IonicContact OD2-NH1 3.89Å; D258-R321 IonicContact OD2-NH2 3.59Å; D258-R321 PolarHBondContact OD2-NH2 2.7Å; H261-R321 PolarHBondContact NE2-NH1 2.84Å; D317-R321 PolarHBondContact O-N 3.33Å; K318-R321 CarbonylContact O-C 3.58Å; K318-R321 VanDerWaalsContact O-C 3.24Å; K318-R321 PolarHBondContact O-N 2.77Å; K318-R321 VanDerWaalsContact O-N 3.11Å; R321-E323 WeakPolarHBondContact CG-O 3.49Å; R321-E323 PolarHBondContact NE-O 2.95Å; R321-Y324 HydrophobicContact CB-CE2 4.37Å; R321-Y324 HydrophobicContact CG-CE1 4.29Å; R321-Y324 HydrophobicContact CG-CE2 4.13Å
322	S	82.7	Confident	80	Confident	60 Å²	60	42.5 Å²	42.5	42%	0.42	21%	0.21	S	C	.	.	S	Bend	trans	-79.6	-24.9	-177.5	56.1	0	0	0	0	116.7	K318 I348	K318-S322 PolarHBondContact O-N 2.91Å; S322-I348 PolarHBondContact O-N 2.79Å
323	E	87.8	Confident	82.1	Confident	75 Å²	75	39.3 Å²	39.3	35%	0.35	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	149.8	176.1	70.8	-173.8	162.4	0	0	114.4	R321 H325 R345 L346	R321-E323 WeakPolarHBondContact CG-O 3.49Å; R321-E323 PolarHBondContact NE-O 2.95Å; E323-H325 IonicContact OE2-NE2 2.65Å; E323-R345 IonicContact OE2-CZ 2.75Å; E323-R345 IonicContact OE2-NH1 3.88Å; E323-R345 PolarHBondContact OE2-NH1 3.42Å; E323-L346 VanDerWaalsContact CA-O 3.3Å; E323-L346 WeakPolarHBondContact CA-O 3.37Å
324	Y	88.4	Confident	83.6	Confident	8 Å²	8	37.3 Å²	37.3	3%	0.031	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	135.3	178	-57.5	-104.9	0	0	0	110.5	D258 H261 F262 L316 R321 L346 I348	D258-Y324 HydrophobicContact CB-CD1 4.18Å; D258-Y324 WeakPolarHBondContact OD2-CA 3.37Å; H261-Y324 HydrophobicContact CB-CD1 4.34Å; H261-Y324 HydrophobicContact CB-CE1 4.13Å; H261-Y324 AromaticContact CD2-CD1 3.83Å; H261-Y324 AromaticContact CD2-CE1 3.71Å; H261-Y324 AromaticContact CG-CE1 3.73Å; H261-Y324 AromaticContact ND1-CE1 3.94Å; H261-Y324 AromaticContact NE2-CE1 3.9Å; F262-Y324 AromaticContact CE2-CD1 3.82Å; F262-Y324 HydrophobicContact CE2-CD1 3.82Å; F262-Y324 HydrophobicContact CE2-CE1 4.38Å; F262-Y324 HydrophobicContact CE2-CG 4.01Å; F262-Y324 AromaticContact CZ-CD1 3.99Å; F262-Y324 HydrophobicContact CZ-CD1 3.99Å; F262-Y324 HydrophobicContact CZ-CD2 4.29Å; F262-Y324 HydrophobicContact CZ-CE1 4.27Å; F262-Y324 AromaticContact CZ-CG 4Å; F262-Y324 HydrophobicContact CZ-CG 4Å; L316-Y324 HydrophobicContact CD2-CE2 4.2Å; R321-Y324 HydrophobicContact CB-CE2 4.37Å; R321-Y324 HydrophobicContact CG-CE1 4.29Å; R321-Y324 HydrophobicContact CG-CE2 4.13Å; Y324-L346 HydrophobicContact CD2-CD2 4.4Å; Y324-L346 PolarHBondContact N-O 3.07Å; Y324-L346 PolarHBondContact O-N 2.74Å; Y324-I348 HydrophobicContact CD2-CD1 4.35Å; Y324-I348 HydrophobicContact CD2-CG1 4.29Å; Y324-I348 HydrophobicContact CE2-CD1 4.12Å; Y324-I348 HydrophobicContact CE2-CG1 3.94Å
325	H	89.4	Confident	84.8	Confident	69 Å²	69	42.4 Å²	42.4	32%	0.319	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	120.9	178.1	-67.9	-112.4	0	0	0	111.5	E202 D258 E323 R345	E202-H325 IonicContact OE1-CE1 3.54Å; E202-H325 PolarHBondContact OE1-CE1 3.12Å; E202-H325 IonicContact OE1-ND1 3.29Å; E202-H325 PolarHBondContact OE1-ND1 3.19Å; E202-H325 IonicContact OE2-CE1 3.86Å; D258-H325 WeakPolarHBondContact CB-O 3.4Å; D258-H325 PolarHBondContact OD2-N 2.76Å; E323-H325 IonicContact OE2-NE2 2.65Å; H325-R345 WeakPolarHBondContact CE1-CD 3.46Å
326	F	89.5	Confident	85.7	Confident	4 Å²	4	43 Å²	43	2%	0.018	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	165.4	177	50.2	-90.9	0	0	0	110.8	L254 E255 F262 L298 I344 L346	L254-F326 HydrophobicContact CD2-CD2 4.01Å; L254-F326 HydrophobicContact CD2-CE2 4.48Å; E255-F326 CarbonylContact O-C 3.55Å; E255-F326 WeakPolarHBondContact O-CA 3.43Å; F262-F326 HydrophobicContact CD2-CD1 4.26Å; F262-F326 HydrophobicContact CD2-CE1 4.18Å; F262-F326 HydrophobicContact CE2-CD1 4.15Å; F262-F326 AromaticContact CE2-CE1 3.9Å; F262-F326 HydrophobicContact CE2-CE1 3.9Å; L298-F326 HydrophobicContact CD1-CE2 4.29Å; L298-F326 HydrophobicContact CD2-CE1 4.13Å; L298-F326 HydrophobicContact CD2-CE2 3.88Å; L298-F326 HydrophobicContact CD2-CZ 3.37Å; F326-I344 HydrophobicContact CD2-CB 4.05Å; F326-I344 HydrophobicContact CD2-CD1 4.5Å; F326-I344 HydrophobicContact CD2-CG2 4.47Å; F326-I344 HydrophobicContact CE2-CB 3.7Å; F326-I344 HydrophobicContact CE2-CD1 3.95Å; F326-I344 HydrophobicContact CE2-CG1 4.35Å; F326-I344 HydrophobicContact CE2-CG2 3.67Å; F326-I344 HydrophobicContact CZ-CB 4.18Å; F326-I344 HydrophobicContact CZ-CG2 3.7Å; F326-I344 PolarHBondContact N-O 3.31Å; F326-I344 VanDerWaalsContact N-O 3.14Å; F326-I344 PolarHBondContact O-N 3.23Å; F326-L346 HydrophobicContact CE1-CB 3.93Å; F326-L346 HydrophobicContact CE1-CD2 4.39Å; F326-L346 HydrophobicContact CZ-CB 4.23Å
327	I	91.2	Very high	86.2	Confident	54 Å²	54	45.5 Å²	45.5	28%	0.277	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	116.3	-178.4	-53.9	175.1	0	0	0	107.8	E255 V329 K341 L342	E255-I327 HydrophobicContact CB-CB 4.28Å; E255-I327 PolarHBondContact N-O 2.75Å; E255-I327 PolarHBondContact O-N 2.86Å; I327-V329 HydrophobicContact CG2-CG2 3.93Å; I327-K341 HydrophobicContact CG2-CB 3.88Å; I327-K341 HydrophobicContact CG2-CD 4.2Å; I327-K341 HydrophobicContact CG2-CG 4.46Å; I327-L342 CarbonylContact C-O 3.53Å; I327-L342 WeakPolarHBondContact CA-O 3.46Å
328	L	92.1	Very high	86.9	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.8	168.8	-179.5	65.4	0	0	0	108.8	F189 L236 Y252 L254 L264 L296 K341 L342 I344	F189-L328 HydrophobicContact CE1-CD2 3.58Å; F189-L328 HydrophobicContact CE1-CG 4.18Å; F189-L328 HydrophobicContact CZ-CD2 3.77Å; F189-L328 HydrophobicContact CZ-CG 3.83Å; L236-L328 HydrophobicContact CB-CD2 4.38Å; L236-L328 HydrophobicContact CD1-CD1 4.07Å; L236-L328 HydrophobicContact CD1-CD2 4.13Å; Y252-L328 HydrophobicContact CD1-CD1 4.14Å; Y252-L328 HydrophobicContact CD1-CG 4.41Å; L254-L328 HydrophobicContact CD2-CD1 4.08Å; L264-L328 HydrophobicContact CD1-CD1 3.96Å; L264-L328 HydrophobicContact CD2-CD1 4.2Å; L296-L328 HydrophobicContact CD2-CD1 4.25Å; L296-L328 HydrophobicContact CD2-CD2 4.09Å; L328-K341 CarbonylContact O-C 3.59Å; L328-K341 WeakPolarHBondContact O-CA 3.47Å; L328-L342 HydrophobicContact CB-CB 4.45Å; L328-L342 PolarHBondContact N-O 3.48Å; L328-L342 PolarHBondContact O-N 3.22Å; L328-I344 HydrophobicContact CB-CD1 3.76Å; L328-I344 HydrophobicContact CD2-CD1 4.33Å
329	V	92.8	Very high	87.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	116.8	-179.6	-178.7	0	0	0	0	109.7	Y252 R253 E255 I327 M339 G340 K341	Y252-V329 CarbonylContact C-O 3.55Å; Y252-V329 VanDerWaalsContact CA-O 3.28Å; Y252-V329 WeakPolarHBondContact CA-O 3.48Å; R253-V329 HydrophobicContact CG-CB 3.96Å; R253-V329 HydrophobicContact CG-CG1 4.43Å; R253-V329 PolarHBondContact N-O 2.68Å; R253-V329 PolarHBondContact O-N 2.82Å; E255-V329 HydrophobicContact CB-CG2 4.26Å; E255-V329 HydrophobicContact CG-CG2 3.93Å; I327-V329 HydrophobicContact CG2-CG2 3.93Å; V329-M339 HydrophobicContact CG1-CB 4.09Å; V329-M339 HydrophobicContact CG1-CG 4.42Å; V329-M339 HydrophobicContact CG1-SD 4Å; V329-G340 WeakPolarHBondContact CA-O 3.03Å; V329-K341 HydrophobicContact CG1-CG 4.3Å; V329-K341 HydrophobicContact CG2-CB 4.48Å; V329-K341 HydrophobicContact CG2-CD 3.92Å; V329-K341 HydrophobicContact CG2-CG 3.9Å
330	A	91.7	Very high	87.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	135.5	168.8	0	0	0	0	0	108.8	P187 F189 A239 Y252 M339 G340	P187-A330 HydrophobicContact CB-CB 3.72Å; F189-A330 HydrophobicContact CE2-CB 4.13Å; F189-A330 HydrophobicContact CZ-CB 3.79Å; A239-A330 HydrophobicContact CB-CB 3.41Å; A239-A330 VanDerWaalsContact CB-CB 3.41Å; Y252-A330 HydrophobicContact CD1-CB 3.77Å; Y252-A330 HydrophobicContact CE1-CB 3.62Å; Y252-A330 HydrophobicContact CG-CB 4.49Å; A330-M339 CarbonylContact O-C 3.51Å; A330-M339 WeakPolarHBondContact O-CA 3.37Å; A330-M339 VanDerWaalsContact O-CB 3.25Å; A330-M339 WeakPolarHBondContact O-CB 3.49Å; A330-G340 PolarHBondContact N-O 2.58Å; A330-G340 PolarHBondContact O-N 3.44Å
331	Y	91.8	Very high	88.5	Confident	17 Å²	17	44.2 Å²	44.2	7%	0.067	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148	-179.4	60.3	-86.1	0	0	0	111.4	I123 E129 K250 G251 R253 K338	I123-Y331 WeakPolarHBondContact CD1-OH 3.17Å; E129-Y331 VanDerWaalsContact CD-OH 3.29Å; E129-Y331 WeakPolarHBondContact CG-OH 3.18Å; E129-Y331 VanDerWaalsContact OE1-CE2 3.32Å; E129-Y331 WeakPolarHBondContact OE1-CE2 3.18Å; E129-Y331 PolarHBondContact OE1-OH 3.46Å; K250-Y331 HydrophobicContact CB-CD2 4.29Å; K250-Y331 HydrophobicContact CB-CE2 4.26Å; K250-Y331 HydrophobicContact CG-CE2 4.21Å; K250-Y331 PolarHBondContact N-O 3.12Å; G251-Y331 PolarHBondContact N-O 2.77Å; G251-Y331 WeakPolarHBondContact O-CD1 3.36Å; G251-Y331 PolarHBondContact O-N 3.4Å; R253-Y331 HydrophobicContact CB-CE1 4.37Å; R253-Y331 HydrophobicContact CG-CD1 4.44Å; R253-Y331 HydrophobicContact CG-CE1 4.17Å; Y331-K338 WeakPolarHBondContact CA-O 3.43Å
332	D	90	Very high	89	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	179.2	178.3	64.3	36.7	0	0	0	112.7	N183 P187 N247 S248 K250 G334 S337 K338	N183-D332 PolarHBondContact ND2-OD2 2.58Å; P187-D332 HydrophobicContact CG-CB 4.37Å; N247-D332 VanDerWaalsContact O-CB 3.3Å; N247-D332 WeakPolarHBondContact O-CB 3.32Å; S248-D332 CarbonylContact O-C 3.58Å; S248-D332 WeakPolarHBondContact O-CA 3.45Å; S248-D332 WeakPolarHBondContact O-CB 3.39Å; K250-D332 VanDerWaalsContact CB-C 3.41Å; K250-D332 WeakPolarHBondContact CB-O 3.48Å; D332-G334 PolarHBondContact OD1-N 2.95Å; D332-S337 PolarHBondContact O-OG 3.31Å; D332-S337 WeakPolarHBondContact OD1-CA 3.16Å; D332-S337 WeakPolarHBondContact OD1-CB 3.45Å; D332-S337 PolarHBondContact OD1-OG 3.06Å; D332-K338 VanDerWaalsContact CG-N 3.26Å; D332-K338 PolarHBondContact N-O 3.14Å; D332-K338 VanDerWaalsContact N-O 3.15Å; D332-K338 PolarHBondContact OD1-N 3.38Å; D332-K338 VanDerWaalsContact OD2-CA 3.31Å; D332-K338 WeakPolarHBondContact OD2-CA 3.41Å; D332-K338 VanDerWaalsContact OD2-CB 3.28Å; D332-K338 WeakPolarHBondContact OD2-CB 3.42Å; D332-K338 PolarHBondContact OD2-N 3.25Å
333	G	84.7	Confident	89.4	Confident	16 Å²	16	40.3 Å²	40.3	17%	0.165	23%	0.229	C	C	.	.	S	Bend	trans	-97.4	9.5	169.6	0	0	0	0	0	114.3	V246 S248	V246-G333 WeakPolarHBondContact CG1-O 3.1Å; V246-G333 CarbonylContact O-C 3.54Å; V246-G333 WeakPolarHBondContact O-CA 3.36Å; V246-G333 PolarHBondContact O-N 2.81Å; S248-G333 PolarHBondContact O-N 2.92Å; S248-G333 VanDerWaalsContact O-N 3.08Å
334	G	82.7	Confident	89.4	Confident	7 Å²	7	36.8 Å²	36.8	7%	0.072	21%	0.213	C	C	.	.			trans	-65.1	174.7	-169.2	0	0	0	0	0	114.8	V246 D332 P336 S337	V246-G334 PolarHBondContact O-N 2.91Å; D332-G334 PolarHBondContact OD1-N 2.95Å; G334-P336 VanDerWaalsContact C-C 3.45Å; G334-P336 CarbonylContact C-O 3.56Å; G334-P336 CarbonylContact O-C 3.51Å; G334-S337 WeakPolarHBondContact O-CB 3.41Å; G334-S337 PolarHBondContact O-N 2.92Å
335	S	81.8	Confident	89.4	Confident	118 Å²	118	38.8 Å²	38.8	83%	0.825	22%	0.22	S	C	*	.	S	Bend	trans	-142.8	95.4	178.3	-76.8	0	0	0	0	111.5
336	P	85	Confident	89.3	Confident	111 Å²	111	35.5 Å²	35.5	72%	0.721	21%	0.205	S	C	*	.	S	Bend	cis	-66.7	152.5	0.9	31.2	-36.9	0	0	0	112.6	N183 G334	N183-P336 PolarHBondContact OD1-O 3.2Å; G334-P336 VanDerWaalsContact C-C 3.45Å; G334-P336 CarbonylContact C-O 3.56Å; G334-P336 CarbonylContact O-C 3.51Å
337	S	87.8	Confident	89.1	Confident	58 Å²	58	37.3 Å²	37.3	41%	0.406	21%	0.214	S	C	.	.			trans	-84.5	138.8	176.1	171.1	0	0	0	0	111.5	D332 G334	D332-S337 PolarHBondContact O-OG 3.31Å; D332-S337 WeakPolarHBondContact OD1-CA 3.16Å; D332-S337 WeakPolarHBondContact OD1-CB 3.45Å; D332-S337 PolarHBondContact OD1-OG 3.06Å; G334-S337 WeakPolarHBondContact O-CB 3.41Å; G334-S337 PolarHBondContact O-N 2.92Å
338	K	92	Very high	88.8	Confident	61 Å²	61	34.9 Å²	34.9	27%	0.265	20%	0.202	S	C	.	.			trans	-106.6	167.8	172.8	-46.3	-163.4	-153.4	76.5	0	111	N183 D184 H185 A186 Y331 D332	N183-K338 PolarHBondContact O-NZ 3.49Å; N183-K338 WeakPolarHBondContact OD1-CE 3.3Å; N183-K338 PolarHBondContact OD1-NZ 3.29Å; D184-K338 VanDerWaalsContact C-NZ 3.35Å; D184-K338 VanDerWaalsContact CA-NZ 3.35Å; D184-K338 PolarHBondContact O-NZ 3Å; H185-K338 WeakPolarHBondContact O-CD 3.36Å; H185-K338 WeakPolarHBondContact O-CE 3.3Å; H185-K338 PolarHBondContact O-NZ 2.92Å; A186-K338 HydrophobicContact CB-CB 3.84Å; A186-K338 HydrophobicContact CB-CD 4.08Å; Y331-K338 WeakPolarHBondContact CA-O 3.43Å; D332-K338 VanDerWaalsContact CG-N 3.26Å; D332-K338 PolarHBondContact N-O 3.14Å; D332-K338 VanDerWaalsContact N-O 3.15Å; D332-K338 PolarHBondContact OD1-N 3.38Å; D332-K338 VanDerWaalsContact OD2-CA 3.31Å; D332-K338 WeakPolarHBondContact OD2-CA 3.41Å; D332-K338 VanDerWaalsContact OD2-CB 3.28Å; D332-K338 WeakPolarHBondContact OD2-CB 3.42Å; D332-K338 PolarHBondContact OD2-N 3.25Å
339	M	93.5	Very high	88.3	Confident	74 Å²	74	38.2 Å²	38.2	37%	0.365	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	143.9	-177.4	61.6	-175.3	66.1	0	0	113	V329 A330	V329-M339 HydrophobicContact CG1-CB 4.09Å; V329-M339 HydrophobicContact CG1-CG 4.42Å; V329-M339 HydrophobicContact CG1-SD 4Å; A330-M339 CarbonylContact O-C 3.51Å; A330-M339 WeakPolarHBondContact O-CA 3.37Å; A330-M339 VanDerWaalsContact O-CB 3.25Å; A330-M339 WeakPolarHBondContact O-CB 3.49Å
340	G	91.2	Very high	87.8	Confident	9 Å²	9	39.6 Å²	39.6	9%	0.093	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	146.7	165.6	0	0	0	0	0	111.1	P187 V329 A330	P187-G340 WeakPolarHBondContact O-CA 3.07Å; P187-G340 PolarHBondContact O-N 2.82Å; V329-G340 WeakPolarHBondContact CA-O 3.03Å; A330-G340 PolarHBondContact N-O 2.58Å; A330-G340 PolarHBondContact O-N 3.44Å
341	K	92.3	Very high	87.2	Confident	106 Å²	106	41.6 Å²	41.6	46%	0.461	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.1	174.5	-57.6	-154.6	177.3	-165.7	0	110.7	E255 I327 L328 V329	E255-K341 IonicContact OE1-NZ 3.21Å; E255-K341 IonicContact OE2-NZ 3.93Å; E255-K341 PolarHBondContact OE2-NZ 2.56Å; I327-K341 HydrophobicContact CG2-CB 3.88Å; I327-K341 HydrophobicContact CG2-CD 4.2Å; I327-K341 HydrophobicContact CG2-CG 4.46Å; L328-K341 CarbonylContact O-C 3.59Å; L328-K341 WeakPolarHBondContact O-CA 3.47Å; V329-K341 HydrophobicContact CG1-CG 4.3Å; V329-K341 HydrophobicContact CG2-CB 4.48Å; V329-K341 HydrophobicContact CG2-CD 3.92Å; V329-K341 HydrophobicContact CG2-CG 3.9Å
342	L	90.7	Very high	86.7	Confident	11 Å²	11	41.6 Å²	41.6	6%	0.058	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	109.6	173.9	178.8	66.9	0	0	0	109.1	F189 V192 L196 F203 P237 I327 L328 I344	F189-L342 HydrophobicContact CB-CD2 4.48Å; F189-L342 HydrophobicContact CD1-CB 4.47Å; F189-L342 HydrophobicContact CD1-CD2 4.19Å; F189-L342 HydrophobicContact CD2-CB 3.7Å; F189-L342 HydrophobicContact CE2-CB 3.93Å; F189-L342 HydrophobicContact CG-CB 4Å; F189-L342 HydrophobicContact CG-CD2 4.26Å; F189-L342 HydrophobicContact CZ-CB 4.41Å; V192-L342 HydrophobicContact CG1-CD1 4.01Å; V192-L342 HydrophobicContact CG1-CD2 4.06Å; V192-L342 HydrophobicContact CG2-CD2 4.27Å; L196-L342 HydrophobicContact CD1-CD1 4.39Å; F203-L342 HydrophobicContact CB-CD1 4.09Å; F203-L342 HydrophobicContact CB-CD2 4.27Å; F203-L342 HydrophobicContact CB-CG 4.27Å; F203-L342 HydrophobicContact CD1-CD2 4.44Å; F203-L342 HydrophobicContact CG-CD2 4.47Å; P237-L342 HydrophobicContact CG-CD2 3.46Å; P237-L342 VanDerWaalsContact CG-CD2 3.46Å; I327-L342 CarbonylContact C-O 3.53Å; I327-L342 WeakPolarHBondContact CA-O 3.46Å; L328-L342 HydrophobicContact CB-CB 4.45Å; L328-L342 PolarHBondContact N-O 3.48Å; L328-L342 PolarHBondContact O-N 3.22Å; L342-I344 HydrophobicContact CD2-CD1 4.24Å; L342-I344 HydrophobicContact CD2-CG1 4.2Å; L342-I344 HydrophobicContact CG-CG1 4.09Å
343	P	90.7	Very high	86.1	Confident	48 Å²	48	42.1 Å²	42.1	31%	0.312	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	134.3	167.2	-19.2	33.5	0	0	0	110.3	E202 F203	E202-P343 HydrophobicContact CB-CB 4.37Å; E202-P343 HydrophobicContact CG-CB 3.92Å; F203-P343 PolarHBondContact N-O 2.75Å
344	I	88.4	Confident	85.9	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.1	-178.5	-59.5	-179.3	0	0	0	108.6	F203 I205 L236 F326 L328 L342	F203-I344 HydrophobicContact CB-CG1 4.38Å; F203-I344 HydrophobicContact CD1-CD1 4.42Å; F203-I344 HydrophobicContact CD1-CG1 4.2Å; F203-I344 HydrophobicContact CD1-CG2 4.36Å; F203-I344 WeakPolarHBondContact O-CA 3.43Å; I205-I344 HydrophobicContact CD1-CG2 3.74Å; I205-I344 HydrophobicContact CG1-CG2 4.13Å; L236-I344 HydrophobicContact CD2-CD1 3.97Å; F326-I344 HydrophobicContact CD2-CB 4.05Å; F326-I344 HydrophobicContact CD2-CD1 4.5Å; F326-I344 HydrophobicContact CD2-CG2 4.47Å; F326-I344 HydrophobicContact CE2-CB 3.7Å; F326-I344 HydrophobicContact CE2-CD1 3.95Å; F326-I344 HydrophobicContact CE2-CG1 4.35Å; F326-I344 HydrophobicContact CE2-CG2 3.67Å; F326-I344 HydrophobicContact CZ-CB 4.18Å; F326-I344 HydrophobicContact CZ-CG2 3.7Å; F326-I344 PolarHBondContact N-O 3.31Å; F326-I344 VanDerWaalsContact N-O 3.14Å; F326-I344 PolarHBondContact O-N 3.23Å; L328-I344 HydrophobicContact CB-CD1 3.76Å; L328-I344 HydrophobicContact CD2-CD1 4.33Å; L342-I344 HydrophobicContact CD2-CD1 4.24Å; L342-I344 HydrophobicContact CD2-CG1 4.2Å; L342-I344 HydrophobicContact CG-CG1 4.09Å
345	R	88.7	Confident	85.9	Confident	49 Å²	49	44.4 Å²	44.4	19%	0.185	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	111.4	170.7	-172.3	164	74.8	104.4	-5.2	108.8	D197 E202 F203 I204 I205 E323 H325 I347	D197-R345 IonicContact OD2-NH2 3.16Å; E202-R345 HydrophobicContact CB-CB 4.35Å; E202-R345 IonicContact OE2-NE 3.52Å; F203-R345 PolarHBondContact O-N 3.37Å; I204-R345 WeakPolarHBondContact CA-O 3.32Å; I205-R345 PolarHBondContact N-O 2.86Å; E323-R345 IonicContact OE2-CZ 2.75Å; E323-R345 IonicContact OE2-NH1 3.88Å; E323-R345 PolarHBondContact OE2-NH1 3.42Å; H325-R345 WeakPolarHBondContact CE1-CD 3.46Å; R345-I347 HydrophobicContact CG-CG1 4.39Å
346	L	87.5	Confident	86.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114.8	176.7	-177.5	68.6	0	0	0	108.8	I205 I207 I234 F262 E323 Y324 F326 I348	I205-L346 HydrophobicContact CB-CD1 3.83Å; I205-L346 HydrophobicContact CG2-CD1 3.74Å; I205-L346 CarbonylContact O-C 2.96Å; I205-L346 WeakPolarHBondContact O-CA 3.47Å; I207-L346 HydrophobicContact CD1-CD1 3.87Å; I207-L346 HydrophobicContact CD1-CD2 4.38Å; I207-L346 HydrophobicContact CD1-CG 4.45Å; I207-L346 HydrophobicContact CG1-CD1 3.99Å; I234-L346 HydrophobicContact CD1-CD1 4.27Å; I234-L346 HydrophobicContact CD1-CD2 4.02Å; I234-L346 HydrophobicContact CG2-CD1 4.5Å; F262-L346 HydrophobicContact CE1-CD2 3.89Å; F262-L346 HydrophobicContact CE2-CD2 4.46Å; F262-L346 HydrophobicContact CZ-CD2 3.59Å; E323-L346 VanDerWaalsContact CA-O 3.3Å; E323-L346 WeakPolarHBondContact CA-O 3.37Å; Y324-L346 HydrophobicContact CD2-CD2 4.4Å; Y324-L346 PolarHBondContact N-O 3.07Å; Y324-L346 PolarHBondContact O-N 2.74Å; F326-L346 HydrophobicContact CE1-CB 3.93Å; F326-L346 HydrophobicContact CE1-CD2 4.39Å; F326-L346 HydrophobicContact CZ-CB 4.23Å; L346-I348 HydrophobicContact CD2-CD1 4.38Å; L346-I348 HydrophobicContact CG-CD1 4.26Å
347	I	85.4	Confident	86.4	Confident	43 Å²	43	38.1 Å²	38.1	22%	0.221	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.7	178.6	-55.3	176.9	0	0	0	108.4	I204 I205 S206 I207 R345	I204-I347 HydrophobicContact CG2-CD1 3.69Å; I204-I347 HydrophobicContact CG2-CG1 4.32Å; I205-I347 PolarHBondContact O-N 2.99Å; S206-I347 WeakPolarHBondContact CA-O 3.31Å; I207-I347 PolarHBondContact N-O 2.75Å; I207-I347 VanDerWaalsContact N-O 3.09Å; R345-I347 HydrophobicContact CG-CG1 4.39Å
348	I	85.2	Confident	86.5	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.015	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.6	174.5	-49.5	-54.8	0	0	0	109.5	I207 E209 L316 K318 S322 Y324 L346	I207-I348 HydrophobicContact CD1-CD1 4.2Å; I207-I348 HydrophobicContact CG1-CD1 4.03Å; I207-I348 CarbonylContact O-C 3.52Å; I207-I348 WeakPolarHBondContact O-CA 3.29Å; E209-I348 HydrophobicContact CB-CG2 3.5Å; E209-I348 VanDerWaalsContact CB-CG2 3.5Å; L316-I348 HydrophobicContact CB-CD1 4.38Å; L316-I348 HydrophobicContact CD1-CD1 4.14Å; K318-I348 HydrophobicContact CB-CB 4.32Å; K318-I348 HydrophobicContact CB-CG2 3.79Å; K318-I348 HydrophobicContact CG-CB 4.23Å; K318-I348 HydrophobicContact CG-CG2 4.18Å; S322-I348 PolarHBondContact O-N 2.79Å; Y324-I348 HydrophobicContact CD2-CD1 4.35Å; Y324-I348 HydrophobicContact CD2-CG1 4.29Å; Y324-I348 HydrophobicContact CE2-CD1 4.12Å; Y324-I348 HydrophobicContact CE2-CG1 3.94Å; L346-I348 HydrophobicContact CD2-CD1 4.38Å; L346-I348 HydrophobicContact CG-CD1 4.26Å
349	E	80.4	Confident	86.4	Confident	70 Å²	70	37.8 Å²	37.8	33%	0.327	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	141	176.8	-56.9	179.8	155.6	0	0	110.7	S206 I207 P208 E209	S206-E349 WeakPolarHBondContact CB-OE1 3.36Å; I207-E349 PolarHBondContact O-N 3.11Å; P208-E349 WeakPolarHBondContact CA-O 3.31Å; E209-E349 PolarHBondContact N-O 2.84Å; E209-E349 VanDerWaalsContact N-O 3.12Å
350	D	82.1	Confident	86.1	Confident	28 Å²	28	39 Å²	39	15%	0.15	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-70.8	131.1	-172.5	-148.4	84.8	0	0	0	111.5	K318 N387 T388 N391	K318-D350 HydrophobicContact CD-CB 3.98Å; K318-D350 WeakPolarHBondContact CD-OD1 3.39Å; K318-D350 IonicContact NZ-OD1 3.81Å; K318-D350 PolarHBondContact NZ-OD1 3.21Å; D350-N387 PolarHBondContact OD1-N 2.9Å; D350-T388 HydrophobicContact CB-CG2 3.3Å; D350-T388 VanDerWaalsContact CG-CG2 3.41Å; D350-T388 PolarHBondContact OD1-N 3.11Å; D350-T388 VanDerWaalsContact OD2-CB 3.26Å; D350-T388 WeakPolarHBondContact OD2-CB 3.41Å; D350-T388 VanDerWaalsContact OD2-CG2 3.29Å; D350-T388 WeakPolarHBondContact OD2-CG2 3.48Å; D350-T388 PolarHBondContact OD2-N 3.48Å; D350-T388 PolarHBondContact OD2-OG1 2.67Å; D350-N391 WeakPolarHBondContact OD2-CB 3.29Å; D350-N391 PolarHBondContact OD2-ND2 2.92Å
351	I	79.8	Confident	85.9	Confident	43 Å²	43	46.4 Å²	46.4	22%	0.221	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-102.8	151.3	160.9	-63.7	179.7	0	0	0	107.7	P208 E209 P211 D353 N391	P208-I351 HydrophobicContact CB-CD1 4.31Å; P208-I351 HydrophobicContact CB-CG1 4.38Å; E209-I351 HydrophobicContact CG-CB 4.16Å; E209-I351 HydrophobicContact CG-CD1 3.97Å; E209-I351 HydrophobicContact CG-CG1 3.99Å; E209-I351 WeakPolarHBondContact O-CD1 3.26Å; E209-I351 PolarHBondContact OE1-N 3.45Å; P211-I351 HydrophobicContact CB-CD1 3.95Å; P211-I351 HydrophobicContact CB-CG2 4.47Å; P211-I351 HydrophobicContact CG-CD1 4.29Å; I351-D353 VanDerWaalsContact C-N 3.31Å; I351-D353 HydrophobicContact CB-CB 4.35Å; I351-D353 HydrophobicContact CG2-CB 3.99Å; I351-D353 PolarHBondContact O-N 3.47Å; I351-D353 VanDerWaalsContact O-N 3.07Å; I351-N391 PolarHBondContact O-ND2 3.11Å
352	N	80.6	Confident	85.7	Confident	16 Å²	16	44.1 Å²	44.1	9%	0.086	22%	0.217	C	C	.	.	S	Bend	trans	-82.4	80	174.5	-164.7	108.6	0	0	0	109.2	D386 N391 D520 G522 L526	N352-D386 WeakPolarHBondContact CA-OD2 3.36Å; N352-N391 HydrophobicContact CB-CB 4.17Å; N352-N391 PolarHBondContact N-ND2 3.45Å; N352-N391 VanDerWaalsContact OD1-CA 3.28Å; N352-N391 WeakPolarHBondContact OD1-CA 3.04Å; N352-N391 WeakPolarHBondContact OD1-CB 3.13Å; N352-N391 VanDerWaalsContact OD1-CG 3.25Å; N352-N391 PolarHBondContact OD1-OD1 2.77Å; N352-D520 PolarHBondContact ND2-OD2 3.46Å; N352-D520 VanDerWaalsContact OD1-CG 3.27Å; N352-D520 PolarHBondContact OD1-OD1 2.84Å; N352-D520 PolarHBondContact OD1-OD2 2.6Å; N352-G522 VanDerWaalsContact OD1-CA 3.25Å; N352-G522 WeakPolarHBondContact OD1-CA 3.25Å; N352-L526 WeakPolarHBondContact ND2-CG 3.18Å; N352-L526 WeakPolarHBondContact O-CD1 3.32Å
353	D	78.2	Confident	85.7	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.07	22%	0.215	C	C	.	.			trans	-116.9	-26.9	-163.7	129.2	-45.8	0	0	0	112.9	T212 I214 I351 D386	T212-D353 WeakPolarHBondContact CB-OD2 3.48Å; T212-D353 VanDerWaalsContact CG2-OD2 3.29Å; T212-D353 WeakPolarHBondContact CG2-OD2 3.34Å; T212-D353 PolarHBondContact N-OD2 2.85Å; T212-D353 PolarHBondContact OG1-OD2 3.14Å; I214-D353 VanDerWaalsContact CD1-O 3.31Å; I214-D353 WeakPolarHBondContact CD1-O 3.33Å; I351-D353 VanDerWaalsContact C-N 3.31Å; I351-D353 HydrophobicContact CB-CB 4.35Å; I351-D353 HydrophobicContact CG2-CB 3.99Å; I351-D353 PolarHBondContact O-N 3.47Å; I351-D353 VanDerWaalsContact O-N 3.07Å; D353-D386 PolarHBondContact N-OD2 3.13Å
354	H	79.2	Confident	85.6	Confident	41 Å²	41	45.9 Å²	45.9	19%	0.19	23%	0.227	C	C	.	.	S	Bend	trans	-86.2	142.2	164.9	-62.6	82	0	0	0	112.2	R385 D386 L526	H354-R385 HydrophobicContact CB-CB 4.02Å; H354-D386 WeakPolarHBondContact CB-OD1 3.19Å; H354-D386 IonicContact CG-OD1 3.29Å; H354-D386 PolarHBondContact N-OD1 2.87Å; H354-D386 PolarHBondContact N-OD2 3.49Å; H354-D386 IonicContact ND1-OD1 2.8Å; H354-D386 PolarHBondContact ND1-OD1 2.93Å; H354-L526 WeakPolarHBondContact O-CD1 3.46Å
355	S	83.5	Confident	85.6	Confident	30 Å²	30	46.3 Å²	46.3	21%	0.21	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-99.6	142	172	61	0	0	0	0	110.7	E357	S355-E357 PolarHBondContact O-N 3.07Å
356	P	88.8	Confident	85.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-50.5	129.1	-177	-27.1	28.5	0	0	0	114	D384 V394 A518 D520 T528	P356-D384 WeakPolarHBondContact CA-OD2 3.17Å; P356-D384 WeakPolarHBondContact CD-OD2 3.18Å; P356-D384 WeakPolarHBondContact CG-OD2 3.26Å; P356-V394 HydrophobicContact CB-CG1 3.92Å; P356-V394 HydrophobicContact CB-CG2 3.97Å; P356-V394 HydrophobicContact CG-CG1 4.24Å; P356-V394 HydrophobicContact CG-CG2 4.22Å; P356-A518 HydrophobicContact CB-CB 3.78Å; P356-A518 HydrophobicContact CG-CB 4.45Å; P356-D520 HydrophobicContact CG-CB 4.46Å; P356-T528 WeakPolarHBondContact O-CB 3.4Å; P356-T528 WeakPolarHBondContact O-CG2 3.2Å; P356-T528 PolarHBondContact O-OG1 2.75Å
357	E	88.7	Confident	85.6	Confident	97 Å²	97	52.7 Å²	52.7	45%	0.453	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	114.7	-174.7	-172.9	173.6	-156.3	0	0	111.1	S355 A382 R383 R385	S355-E357 PolarHBondContact O-N 3.07Å; E357-A382 CarbonylContact O-C 3.58Å; E357-A382 WeakPolarHBondContact O-CA 3.25Å; E357-A382 WeakPolarHBondContact O-CB 3.37Å; E357-R383 PolarHBondContact N-O 3Å; E357-R383 PolarHBondContact O-N 2.76Å; E357-R385 IonicContact OE1-NH2 3.7Å; E357-R385 PolarHBondContact OE1-NH2 2.86Å; E357-R385 IonicContact OE2-CZ 3.13Å; E357-R385 IonicContact OE2-NE 2.66Å; E357-R385 PolarHBondContact OE2-NE 3.13Å; E357-R385 IonicContact OE2-NH2 3.4Å; E357-R385 PolarHBondContact OE2-NH2 3.34Å
358	F	90.9	Very high	85.4	Confident	24 Å²	24	52 Å²	52	11%	0.105	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	148.4	176.6	-78.8	-83.5	0	0	0	112.4	Q360 Y363 F380 S381 A382 F396 I516 A518 T528 V530	F358-Q360 VanDerWaalsContact C-N 3.28Å; F358-Q360 PolarHBondContact O-N 3.39Å; F358-Y363 HydrophobicContact CD1-CE2 4.33Å; F358-F380 HydrophobicContact CE1-CD2 4.1Å; F358-F380 HydrophobicContact CE1-CE2 4.43Å; F358-S381 WeakPolarHBondContact CA-O 3.37Å; F358-A382 HydrophobicContact CD1-CB 3.91Å; F358-A382 HydrophobicContact CE1-CB 4.28Å; F358-A382 HydrophobicContact CG-CB 4.11Å; F358-F396 HydrophobicContact CD1-CE1 4.47Å; F358-F396 HydrophobicContact CE1-CD1 4.1Å; F358-F396 AromaticContact CE1-CE1 3.75Å; F358-F396 HydrophobicContact CE1-CE1 3.75Å; F358-F396 HydrophobicContact CZ-CD1 4.29Å; F358-F396 HydrophobicContact CZ-CE1 4.26Å; F358-I516 HydrophobicContact CE1-CG2 4.33Å; F358-I516 HydrophobicContact CZ-CG2 4.08Å; F358-A518 HydrophobicContact CD2-CB 4.28Å; F358-A518 HydrophobicContact CE1-CB 4.16Å; F358-A518 HydrophobicContact CE2-CB 3.49Å; F358-A518 VanDerWaalsContact CE2-CB 3.49Å; F358-A518 HydrophobicContact CZ-CB 3.43Å; F358-A518 VanDerWaalsContact CZ-CB 3.43Å; F358-T528 HydrophobicContact CD2-CG2 3.91Å; F358-T528 HydrophobicContact CE2-CG2 4.28Å; F358-V530 HydrophobicContact CB-CB 4.35Å; F358-V530 HydrophobicContact CD1-CB 4.15Å; F358-V530 HydrophobicContact CD1-CG1 3.73Å; F358-V530 HydrophobicContact CD2-CB 3.7Å; F358-V530 HydrophobicContact CD2-CG1 3.98Å; F358-V530 HydrophobicContact CE1-CB 4.33Å; F358-V530 HydrophobicContact CE1-CG1 3.54Å; F358-V530 HydrophobicContact CE2-CB 3.88Å; F358-V530 HydrophobicContact CE2-CG1 3.78Å; F358-V530 HydrophobicContact CG-CB 3.83Å; F358-V530 HydrophobicContact CG-CG1 3.94Å; F358-V530 HydrophobicContact CG-CG2 4.47Å; F358-V530 HydrophobicContact CZ-CB 4.18Å; F358-V530 HydrophobicContact CZ-CG1 3.55Å
359	N	89.3	Confident	84.9	Confident	87 Å²	87	52.2 Å²	52.2	47%	0.465	26%	0.256	S	S	.	.	S	Bend	trans	-79.9	1	-177.2	86.8	-92.9	0	0	0	115.5	Y363 S381	N359-Y363 PolarHBondContact OD1-OH 2.96Å; N359-S381 VanDerWaalsContact CG-OG 3.28Å; N359-S381 PolarHBondContact N-O 2.91Å; N359-S381 PolarHBondContact OD1-N 3.03Å; N359-S381 PolarHBondContact OD1-O 3.39Å; N359-S381 PolarHBondContact OD1-OG 3.17Å
360	Q	87.3	Confident	84.9	Confident	99 Å²	99	51.8 Å²	51.8	46%	0.463	26%	0.256	S	S	.	.	S	Bend	trans	-146	150.4	172.8	-59.4	-173.9	6.5	0	0	110.2	F358 F362 Y363 V530	F358-Q360 VanDerWaalsContact C-N 3.28Å; F358-Q360 PolarHBondContact O-N 3.39Å; Q360-F362 VanDerWaalsContact C-N 3.31Å; Q360-F362 PolarHBondContact O-N 3.27Å; Q360-F362 PolarHBondContact OE1-O 3.19Å; Q360-Y363 HydrophobicContact CB-CD1 4.47Å; Q360-Y363 HydrophobicContact CB-CE1 3.95Å; Q360-Y363 HydrophobicContact CB-CE2 4.19Å; Q360-Y363 VanDerWaalsContact CD-CE1 3.44Å; Q360-Y363 HydrophobicContact CG-CD1 4.48Å; Q360-Y363 HydrophobicContact CG-CE1 3.78Å; Q360-V530 WeakPolarHBondContact O-CG2 3.29Å
361	E	87.1	Confident	85	Confident	166 Å²	166	52.1 Å²	52.1	78%	0.776	26%	0.258	S	S	*	.	S	Bend	trans	-69.8	-26	177.6	-65.7	-176.1	167.3	0	0	113.4	P531	E361-P531 WeakPolarHBondContact O-CD 3.34Å
362	F	88.3	Confident	85.3	Confident	57 Å²	57	54.3 Å²	54.3	25%	0.25	28%	0.275	C	S	.	.			trans	-160.4	157.7	174.1	62.5	-85.1	0	0	0	109.4	Q360 T364 L496 P531	Q360-F362 VanDerWaalsContact C-N 3.31Å; Q360-F362 PolarHBondContact O-N 3.27Å; Q360-F362 PolarHBondContact OE1-O 3.19Å; F362-T364 HydrophobicContact CD2-CG2 3.9Å; F362-T364 HydrophobicContact CE2-CG2 3.86Å; F362-L496 HydrophobicContact CD1-CD1 4.23Å; F362-L496 HydrophobicContact CE1-CD1 4.38Å; F362-P531 WeakPolarHBondContact CA-O 3.44Å; F362-P531 HydrophobicContact CB-CB 4.05Å; F362-P531 HydrophobicContact CB-CG 4.15Å
363	Y	90.7	Very high	85.5	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	147	173	-64.5	-89.4	0	0	0	111.2	F358 N359 Q360 F378 F380 V530 P531 V532 I533	F358-Y363 HydrophobicContact CD1-CE2 4.33Å; N359-Y363 PolarHBondContact OD1-OH 2.96Å; Q360-Y363 HydrophobicContact CB-CD1 4.47Å; Q360-Y363 HydrophobicContact CB-CE1 3.95Å; Q360-Y363 HydrophobicContact CB-CE2 4.19Å; Q360-Y363 VanDerWaalsContact CD-CE1 3.44Å; Q360-Y363 HydrophobicContact CG-CD1 4.48Å; Q360-Y363 HydrophobicContact CG-CE1 3.78Å; Y363-F378 VanDerWaalsContact CB-CZ 3.42Å; Y363-F378 AromaticContact CD1-CD2 3.71Å; Y363-F378 HydrophobicContact CD1-CD2 3.71Å; Y363-F378 AromaticContact CD1-CE2 3.71Å; Y363-F378 HydrophobicContact CD1-CE2 3.71Å; Y363-F378 HydrophobicContact CD1-CG 4.5Å; Y363-F378 HydrophobicContact CD1-CZ 4.49Å; Y363-F378 HydrophobicContact CD2-CE2 4.09Å; Y363-F378 HydrophobicContact CE1-CD2 4.43Å; Y363-F378 HydrophobicContact CE1-CE2 4.49Å; Y363-F378 AromaticContact CG-CD2 3.98Å; Y363-F378 HydrophobicContact CG-CD2 3.98Å; Y363-F378 AromaticContact CG-CE2 3.5Å; Y363-F378 HydrophobicContact CG-CE2 3.5Å; Y363-F378 VanDerWaalsContact CG-CE2 3.5Å; Y363-F378 AromaticContact CG-CZ 3.93Å; Y363-F378 HydrophobicContact CG-CZ 3.93Å; Y363-F380 HydrophobicContact CD1-CB 4.25Å; Y363-F380 HydrophobicContact CD2-CB 4.49Å; Y363-F380 HydrophobicContact CE1-CB 3.57Å; Y363-F380 HydrophobicContact CE2-CB 3.86Å; Y363-F380 WeakPolarHBondContact OH-CB 3.39Å; Y363-V530 HydrophobicContact CD2-CB 4.48Å; Y363-V530 HydrophobicContact CD2-CG1 3.95Å; Y363-V530 HydrophobicContact CD2-CG2 3.68Å; Y363-V530 HydrophobicContact CE2-CB 4.38Å; Y363-V530 HydrophobicContact CE2-CG1 3.93Å; Y363-V530 HydrophobicContact CE2-CG2 3.71Å; Y363-P531 PolarHBondContact N-O 2.84Å; Y363-V532 WeakPolarHBondContact O-CA 3.26Å; Y363-I533 PolarHBondContact O-N 3.18Å
364	T	88.3	Confident	85.9	Confident	93 Å²	93	55 Å²	55	57%	0.571	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.8	172.6	64.6	0	0	0	0	111.1	F362 I533	F362-T364 HydrophobicContact CD2-CG2 3.9Å; F362-T364 HydrophobicContact CE2-CG2 3.86Å; T364-I533 VanDerWaalsContact CA-O 3.3Å; T364-I533 WeakPolarHBondContact CA-O 3.2Å; T364-I533 HydrophobicContact CG2-CB 4.35Å
365	G	87.7	Confident	86.3	Confident	10 Å²	10	56.2 Å²	56.2	10%	0.103	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	163.3	178.6	0	0	0	0	0	112.1	I533 L535	G365-I533 PolarHBondContact N-O 3.4Å; G365-L535 PolarHBondContact O-N 3.22Å
366	R	87.6	Confident	86.7	Confident	178 Å²	178	58.6 Å²	58.6	67%	0.672	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.4	175.6	-55.5	-178.1	73.2	144.9	3.7	108.3	L535	R366-L535 WeakPolarHBondContact CA-O 3.31Å; R366-L535 HydrophobicContact CG-CB 4.37Å
367	I	87.9	Confident	86.8	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.5	174.4	64.9	179.2	0	0	0	109.8	I377 F430 I460 I534 L535 I536 T537	I367-I377 HydrophobicContact CG2-CD1 3.78Å; I367-I377 HydrophobicContact CG2-CG1 3.86Å; I367-I377 HydrophobicContact CG2-CG2 4.06Å; I367-F430 HydrophobicContact CD1-CE1 3.88Å; I367-F430 HydrophobicContact CD1-CZ 4.02Å; I367-I460 HydrophobicContact CB-CD1 4.35Å; I367-I460 HydrophobicContact CD1-CD1 4.47Å; I367-I460 HydrophobicContact CG2-CD1 4.17Å; I367-I460 HydrophobicContact CG2-CG1 4.47Å; I367-I534 HydrophobicContact CD1-CG2 3.89Å; I367-I534 HydrophobicContact CG1-CG2 3.79Å; I367-I534 HydrophobicContact CG2-CG2 4.42Å; I367-L535 PolarHBondContact N-O 3.22Å; I367-I536 HydrophobicContact CD1-CG1 4.27Å; I367-I536 HydrophobicContact CG1-CG1 4.16Å; I367-I536 CarbonylContact O-C 3.58Å; I367-I536 WeakPolarHBondContact O-CA 3.38Å; I367-T537 PolarHBondContact O-N 3Å; I367-T537 PolarHBondContact O-OG1 3.03Å
368	S	81.6	Confident	87	Confident	28 Å²	28	56.4 Å²	56.4	20%	0.196	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	151.1	165	177.9	0	0	0	0	110.6	N370 D371 T537 V539	S368-N370 PolarHBondContact O-N 2.95Å; S368-N370 VanDerWaalsContact O-N 3.16Å; S368-N370 PolarHBondContact OG-N 3.22Å; S368-D371 PolarHBondContact N-OD2 3.17Å; S368-D371 WeakPolarHBondContact O-CB 3.15Å; S368-D371 PolarHBondContact O-N 2.69Å; S368-T537 WeakPolarHBondContact CA-O 3.49Å; S368-T537 WeakPolarHBondContact CA-OG1 3.07Å; S368-V539 WeakPolarHBondContact OG-CG2 3.43Å
369	E	75.8	Confident	87	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.037	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.8	171	179	144.3	-170.8	0	0	113.2	Q469 T472 S473 I476 T537	E369-Q469 HydrophobicContact CG-CG 4.2Å; E369-Q469 WeakPolarHBondContact OE1-CA 3.38Å; E369-T472 HydrophobicContact CB-CG2 3.73Å; E369-T472 HydrophobicContact CG-CG2 3.79Å; E369-S473 PolarHBondContact OE1-N 3.35Å; E369-I476 VanDerWaalsContact OE2-CD1 3.28Å; E369-I476 WeakPolarHBondContact OE2-CD1 3.39Å; E369-T537 PolarHBondContact N-O 3.48Å
370	N	79.3	Confident	87.1	Confident	61 Å²	61	56.6 Å²	56.6	33%	0.326	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	8.8	176.8	-84.6	-90.6	0	0	0	114.4	S368 K465 D541	S368-N370 PolarHBondContact O-N 2.95Å; S368-N370 VanDerWaalsContact O-N 3.16Å; S368-N370 PolarHBondContact OG-N 3.22Å; N370-K465 WeakPolarHBondContact OD1-CE 3.45Å; N370-K465 PolarHBondContact OD1-NZ 3.33Å; N370-D541 PolarHBondContact ND2-OD2 2.73Å
371	D	84.4	Confident	87.3	Confident	36 Å²	36	52.4 Å²	52.4	19%	0.193	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-68.9	139.2	174.9	-89.2	-51.4	0	0	0	112.9	S368 H375 I460	S368-D371 PolarHBondContact N-OD2 3.17Å; S368-D371 WeakPolarHBondContact O-CB 3.15Å; S368-D371 PolarHBondContact O-N 2.69Å; D371-H375 HydrophobicContact CB-CB 4.48Å; D371-H375 IonicContact OD1-CE1 3.79Å; D371-H375 PolarHBondContact OD1-CE1 2.99Å; D371-H375 IonicContact OD1-CG 2.7Å; D371-H375 IonicContact OD1-ND1 3.36Å; D371-H375 PolarHBondContact OD1-ND1 3.38Å; D371-H375 IonicContact OD2-CE1 2.64Å; D371-I460 HydrophobicContact CB-CD1 3.44Å; D371-I460 VanDerWaalsContact CB-CD1 3.44Å
372	P	85.8	Confident	87.4	Confident	88 Å²	88	44.6 Å²	44.6	57%	0.571	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-78.1	148.6	-174.2	31.1	-35.8	0	0	0	113.5	G374 H375	P372-G374 PolarHBondContact O-N 3.31Å; P372-H375 VanDerWaalsContact O-CB 3.29Å; P372-H375 WeakPolarHBondContact O-CB 3.35Å; P372-H375 PolarHBondContact O-N 2.8Å
373	G	84.6	Confident	87.3	Confident	29 Å²	29	47.8 Å²	47.8	30%	0.299	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	122.7	173	0	0	0	0	0	112.2	I468	G373-I468 VanDerWaalsContact CA-CD1 3.46Å
374	G	87.2	Confident	87.2	Confident	16 Å²	16	47.6 Å²	47.6	17%	0.165	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.9	0.6	-170.4	0	0	0	0	0	115.3	P372 I460	P372-G374 PolarHBondContact O-N 3.31Å; G374-I460 WeakPolarHBondContact CA-O 3.34Å; G374-I460 PolarHBondContact N-O 3.48Å
375	H	88.3	Confident	87	Confident	65 Å²	65	48.3 Å²	48.3	30%	0.301	24%	0.24	S	C	.	.			trans	-59.3	131.9	167.2	-173.5	120.9	0	0	0	110	D371 P372 I459 I460	D371-H375 HydrophobicContact CB-CB 4.48Å; D371-H375 IonicContact OD1-CE1 3.79Å; D371-H375 PolarHBondContact OD1-CE1 2.99Å; D371-H375 IonicContact OD1-CG 2.7Å; D371-H375 IonicContact OD1-ND1 3.36Å; D371-H375 PolarHBondContact OD1-ND1 3.38Å; D371-H375 IonicContact OD2-CE1 2.64Å; P372-H375 VanDerWaalsContact O-CB 3.29Å; P372-H375 WeakPolarHBondContact O-CB 3.35Å; P372-H375 PolarHBondContact O-N 2.8Å; H375-I459 CarbonylContact O-C 3.5Å; H375-I459 WeakPolarHBondContact O-CA 3.05Å; H375-I459 WeakPolarHBondContact O-CB 3.32Å; H375-I460 HydrophobicContact CB-CD1 4.01Å; H375-I460 HydrophobicContact CB-CG1 4.23Å; H375-I460 PolarHBondContact O-N 3.49Å
376	I	90.8	Very high	86.7	Confident	80 Å²	80	48 Å²	48	41%	0.41	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	118.1	179	-57.3	168.2	0	0	0	109.1	R457 I459	I376-R457 HydrophobicContact CG2-CB 4.41Å; I376-I459 HydrophobicContact CB-CG2 4.47Å; I376-I459 HydrophobicContact CG1-CG2 3.96Å
377	I	91.7	Very high	85.8	Confident	25 Å²	25	44.3 Å²	44.3	13%	0.128	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-48.8	-174	-48.4	178.9	0	0	0	110.5	I367 F430 L458 I460 I534	I367-I377 HydrophobicContact CG2-CD1 3.78Å; I367-I377 HydrophobicContact CG2-CG1 3.86Å; I367-I377 HydrophobicContact CG2-CG2 4.06Å; I377-F430 HydrophobicContact CD1-CD1 3.59Å; I377-F430 HydrophobicContact CD1-CE1 3.38Å; I377-F430 HydrophobicContact CD1-CZ 4.21Å; I377-L458 HydrophobicContact CB-CD2 4.42Å; I377-L458 HydrophobicContact CD1-CD2 4.06Å; I377-L458 HydrophobicContact CD1-CG 4.19Å; I377-L458 PolarHBondContact N-O 2.66Å; I377-I460 HydrophobicContact CD1-CG1 4.06Å; I377-I460 HydrophobicContact CG1-CG1 4.32Å; I377-I534 HydrophobicContact CG2-CD1 3.89Å
378	F	92	Very high	85	Confident	26 Å²	26	46.7 Å²	46.7	11%	0.114	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	163.8	169.6	59.3	-98	0	0	0	111.4	Y363 F380 L458 I516 V532 I534	Y363-F378 VanDerWaalsContact CB-CZ 3.42Å; Y363-F378 AromaticContact CD1-CD2 3.71Å; Y363-F378 HydrophobicContact CD1-CD2 3.71Å; Y363-F378 AromaticContact CD1-CE2 3.71Å; Y363-F378 HydrophobicContact CD1-CE2 3.71Å; Y363-F378 HydrophobicContact CD1-CG 4.5Å; Y363-F378 HydrophobicContact CD1-CZ 4.49Å; Y363-F378 HydrophobicContact CD2-CE2 4.09Å; Y363-F378 HydrophobicContact CE1-CD2 4.43Å; Y363-F378 HydrophobicContact CE1-CE2 4.49Å; Y363-F378 AromaticContact CG-CD2 3.98Å; Y363-F378 HydrophobicContact CG-CD2 3.98Å; Y363-F378 AromaticContact CG-CE2 3.5Å; Y363-F378 HydrophobicContact CG-CE2 3.5Å; Y363-F378 VanDerWaalsContact CG-CE2 3.5Å; Y363-F378 AromaticContact CG-CZ 3.93Å; Y363-F378 HydrophobicContact CG-CZ 3.93Å; F378-F380 HydrophobicContact CD2-CB 4.27Å; F378-F380 AromaticContact CD2-CD1 3.93Å; F378-F380 HydrophobicContact CD2-CD1 3.93Å; F378-F380 HydrophobicContact CE2-CB 4.15Å; F378-F380 AromaticContact CE2-CD1 3.58Å; F378-F380 HydrophobicContact CE2-CD1 3.58Å; F378-F380 HydrophobicContact CE2-CE1 4.38Å; F378-F380 HydrophobicContact CE2-CG 4.22Å; F378-L458 HydrophobicContact CD1-CB 4.49Å; F378-L458 HydrophobicContact CD1-CD2 4.23Å; F378-L458 HydrophobicContact CD2-CB 4.47Å; F378-L458 HydrophobicContact CE1-CB 4.2Å; F378-L458 HydrophobicContact CE1-CD2 3.43Å; F378-L458 VanDerWaalsContact CE1-CD2 3.43Å; F378-L458 HydrophobicContact CE1-CG 4.46Å; F378-L458 HydrophobicContact CE2-CB 4.17Å; F378-L458 HydrophobicContact CZ-CB 4.02Å; F378-L458 HydrophobicContact CZ-CD2 3.63Å; F378-L458 HydrophobicContact CZ-CG 4.44Å; F378-L458 PolarHBondContact O-N 3.47Å; F378-I516 HydrophobicContact CZ-CD1 4.34Å; F378-V532 HydrophobicContact CE1-CG1 3.64Å; F378-V532 HydrophobicContact CZ-CG1 3.64Å; F378-V532 HydrophobicContact CZ-CG2 4.01Å; F378-I534 HydrophobicContact CE1-CD1 4.07Å
379	E	90.9	Very high	84.3	Confident	112 Å²	112	52.8 Å²	52.8	52%	0.523	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	143.9	169.3	-49.9	-165.4	127.7	0	0	109.8	R457	E379-R457 HydrophobicContact CG-CG 4.23Å; E379-R457 IonicContact OE1-CZ 2.84Å; E379-R457 IonicContact OE1-NE 2.71Å; E379-R457 PolarHBondContact OE1-NE 3.13Å; E379-R457 IonicContact OE1-NH2 3.21Å; E379-R457 PolarHBondContact OE1-NH2 3.37Å
380	F	92.2	Very high	84.2	Confident	3 Å²	3	58.6 Å²	58.6	1%	0.013	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	163.2	178.7	60.6	-90.3	0	0	0	110.5	F358 Y363 F378 F396 I432 G456 L458 I516	F358-F380 HydrophobicContact CE1-CD2 4.1Å; F358-F380 HydrophobicContact CE1-CE2 4.43Å; Y363-F380 HydrophobicContact CD1-CB 4.25Å; Y363-F380 HydrophobicContact CD2-CB 4.49Å; Y363-F380 HydrophobicContact CE1-CB 3.57Å; Y363-F380 HydrophobicContact CE2-CB 3.86Å; Y363-F380 WeakPolarHBondContact OH-CB 3.39Å; F378-F380 HydrophobicContact CD2-CB 4.27Å; F378-F380 AromaticContact CD2-CD1 3.93Å; F378-F380 HydrophobicContact CD2-CD1 3.93Å; F378-F380 HydrophobicContact CE2-CB 4.15Å; F378-F380 AromaticContact CE2-CD1 3.58Å; F378-F380 HydrophobicContact CE2-CD1 3.58Å; F378-F380 HydrophobicContact CE2-CE1 4.38Å; F378-F380 HydrophobicContact CE2-CG 4.22Å; F380-F396 HydrophobicContact CD2-CD1 4.4Å; F380-F396 HydrophobicContact CD2-CE1 4.11Å; F380-F396 HydrophobicContact CD2-CE2 4.37Å; F380-F396 HydrophobicContact CD2-CZ 4.11Å; F380-F396 HydrophobicContact CE2-CB 4.27Å; F380-F396 AromaticContact CE2-CD1 3.7Å; F380-F396 HydrophobicContact CE2-CD1 3.7Å; F380-F396 AromaticContact CE2-CD2 3.76Å; F380-F396 HydrophobicContact CE2-CD2 3.76Å; F380-F396 AromaticContact CE2-CE1 3.84Å; F380-F396 HydrophobicContact CE2-CE1 3.84Å; F380-F396 AromaticContact CE2-CE2 3.93Å; F380-F396 HydrophobicContact CE2-CE2 3.93Å; F380-F396 AromaticContact CE2-CG 3.65Å; F380-F396 HydrophobicContact CE2-CG 3.65Å; F380-F396 AromaticContact CE2-CZ 3.97Å; F380-F396 HydrophobicContact CE2-CZ 3.97Å; F380-F396 HydrophobicContact CZ-CD2 4.43Å; F380-F396 HydrophobicContact CZ-CG 4.35Å; F380-I432 HydrophobicContact CE1-CG2 4.4Å; F380-I432 HydrophobicContact CZ-CD1 3.99Å; F380-I432 HydrophobicContact CZ-CG1 4.03Å; F380-I432 HydrophobicContact CZ-CG2 3.7Å; F380-G456 WeakPolarHBondContact CD1-O 3.27Å; F380-G456 PolarHBondContact N-O 2.98Å; F380-G456 PolarHBondContact O-N 3.1Å; F380-G456 VanDerWaalsContact O-O 3.1Å; F380-L458 HydrophobicContact CE1-CB 4.15Å; F380-I516 HydrophobicContact CD1-CD1 4.3Å; F380-I516 HydrophobicContact CE1-CD1 3.81Å; F380-I516 HydrophobicContact CE2-CD1 4.49Å; F380-I516 HydrophobicContact CE2-CG2 4.14Å; F380-I516 HydrophobicContact CZ-CD1 3.92Å; F380-I516 HydrophobicContact CZ-CG2 4.21Å
381	S	91.7	Very high	84.3	Confident	12 Å²	12	56.4 Å²	56.4	8%	0.084	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	156.7	173.4	60.9	0	0	0	0	111.2	F358 N359 V454	F358-S381 WeakPolarHBondContact CA-O 3.37Å; N359-S381 VanDerWaalsContact CG-OG 3.28Å; N359-S381 PolarHBondContact N-O 2.91Å; N359-S381 PolarHBondContact OD1-N 3.03Å; N359-S381 PolarHBondContact OD1-O 3.39Å; N359-S381 PolarHBondContact OD1-OG 3.17Å; S381-V454 WeakPolarHBondContact CA-O 3.4Å; S381-V454 VanDerWaalsContact CB-O 3.26Å; S381-V454 WeakPolarHBondContact CB-O 3.33Å
382	A	87.8	Confident	84	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.008	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	153.7	167.7	0	0	0	0	0	109.2	E357 F358 V394 F396 T453 V454 A518	E357-A382 CarbonylContact O-C 3.58Å; E357-A382 WeakPolarHBondContact O-CA 3.25Å; E357-A382 WeakPolarHBondContact O-CB 3.37Å; F358-A382 HydrophobicContact CD1-CB 3.91Å; F358-A382 HydrophobicContact CE1-CB 4.28Å; F358-A382 HydrophobicContact CG-CB 4.11Å; A382-V394 HydrophobicContact CB-CG1 4.21Å; A382-F396 HydrophobicContact CB-CE1 3.63Å; A382-F396 HydrophobicContact CB-CZ 3.94Å; A382-T453 WeakPolarHBondContact O-CA 3.41Å; A382-V454 PolarHBondContact N-O 2.83Å; A382-V454 VanDerWaalsContact N-O 3.13Å; A382-V454 PolarHBondContact O-N 2.98Å; A382-A518 HydrophobicContact CB-CB 4.08Å
383	R	87.7	Confident	83.8	Confident	124 Å²	124	54.9 Å²	54.9	47%	0.468	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132.7	-176.2	177.3	174.9	-176.1	-134.6	-11	109.7	E357 S452	E357-R383 PolarHBondContact N-O 3Å; E357-R383 PolarHBondContact O-N 2.76Å; R383-S452 WeakPolarHBondContact CA-O 3.48Å; R383-S452 WeakPolarHBondContact CG-OG 3.48Å; R383-S452 PolarHBondContact NE-OG 3.01Å
384	D	87.3	Confident	83.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.258	C	S	.	.			trans	-92.4	159.8	163.8	-134.1	-61.7	0	0	0	112.3	P356 D386 V394 S452	P356-D384 WeakPolarHBondContact CA-OD2 3.17Å; P356-D384 WeakPolarHBondContact CD-OD2 3.18Å; P356-D384 WeakPolarHBondContact CG-OD2 3.26Å; D384-D386 PolarHBondContact OD1-N 2.73Å; D384-V394 HydrophobicContact CB-CG2 3.8Å; D384-S452 PolarHBondContact N-O 2.75Å; D384-S452 VanDerWaalsContact O-CB 3.25Å; D384-S452 WeakPolarHBondContact O-CB 3.5Å; D384-S452 PolarHBondContact O-OG 2.94Å
385	R	84	Confident	83.8	Confident	109 Å²	109	56.8 Å²	56.8	41%	0.411	27%	0.268	S	S	.	.			trans	-106.2	-31.1	178.2	-56.2	-169.2	-173.2	179.3	1.9	112	E319 H354 E357 N387	E319-R385 HydrophobicContact CG-CB 4.2Å; E319-R385 WeakPolarHBondContact CG-O 3.28Å; H354-R385 HydrophobicContact CB-CB 4.02Å; E357-R385 IonicContact OE1-NH2 3.7Å; E357-R385 PolarHBondContact OE1-NH2 2.86Å; E357-R385 IonicContact OE2-CZ 3.13Å; E357-R385 IonicContact OE2-NE 2.66Å; E357-R385 PolarHBondContact OE2-NE 3.13Å; E357-R385 IonicContact OE2-NH2 3.4Å; E357-R385 PolarHBondContact OE2-NH2 3.34Å; R385-N387 PolarHBondContact O-N 2.79Å; R385-N387 PolarHBondContact O-ND2 2.89Å
386	D	82.1	Confident	83.9	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.016	26%	0.256	C	S	.	.			trans	-56.3	125.6	-179.1	-65.4	-5.2	0	0	0	111.1	N352 D353 H354 D384 T388 N391 G392	N352-D386 WeakPolarHBondContact CA-OD2 3.36Å; D353-D386 PolarHBondContact N-OD2 3.13Å; H354-D386 WeakPolarHBondContact CB-OD1 3.19Å; H354-D386 IonicContact CG-OD1 3.29Å; H354-D386 PolarHBondContact N-OD1 2.87Å; H354-D386 PolarHBondContact N-OD2 3.49Å; H354-D386 IonicContact ND1-OD1 2.8Å; H354-D386 PolarHBondContact ND1-OD1 2.93Å; D384-D386 PolarHBondContact OD1-N 2.73Å; D386-T388 PolarHBondContact O-N 3.36Å; D386-N391 HydrophobicContact CB-CB 3.6Å; D386-G392 WeakPolarHBondContact O-CA 3.2Å
387	N	68.5	Low	83.9	Confident	101 Å²	101	55.1 Å²	55.1	54%	0.54	25%	0.254	S	S	.	.			trans	-86.7	6.7	-165.5	-84.1	-81.1	0	0	0	115.6	E319 D350 R385	E319-N387 WeakPolarHBondContact OE1-CB 3.49Å; E319-N387 PolarHBondContact OE1-N 2.81Å; E319-N387 PolarHBondContact OE1-ND2 3.43Å; D350-N387 PolarHBondContact OD1-N 2.9Å; R385-N387 PolarHBondContact O-N 2.79Å; R385-N387 PolarHBondContact O-ND2 2.89Å
388	T	71.4	Confident	83.8	Confident	53 Å²	53	54 Å²	54	33%	0.325	25%	0.248	S	C	.	.	S	Bend	trans	-88.3	161.4	170.9	58.3	0	0	0	0	114.6	D350 D386 E390 N391 G392	D350-T388 HydrophobicContact CB-CG2 3.3Å; D350-T388 VanDerWaalsContact CG-CG2 3.41Å; D350-T388 PolarHBondContact OD1-N 3.11Å; D350-T388 VanDerWaalsContact OD2-CB 3.26Å; D350-T388 WeakPolarHBondContact OD2-CB 3.41Å; D350-T388 VanDerWaalsContact OD2-CG2 3.29Å; D350-T388 WeakPolarHBondContact OD2-CG2 3.48Å; D350-T388 PolarHBondContact OD2-N 3.48Å; D350-T388 PolarHBondContact OD2-OG1 2.67Å; D386-T388 PolarHBondContact O-N 3.36Å; T388-E390 PolarHBondContact O-N 2.62Å; T388-N391 WeakPolarHBondContact OG1-CB 3.34Å; T388-N391 PolarHBondContact OG1-N 2.75Å; T388-N391 PolarHBondContact OG1-ND2 3.02Å; T388-G392 WeakPolarHBondContact O-CA 3.32Å; T388-G392 PolarHBondContact O-N 2.72Å
389	K	66.3	Low	83.3	Confident	156 Å²	156	53.3 Å²	53.3	68%	0.678	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	2.6	174.6	-59.9	-172.4	-177.1	-173.4	0	114.7	I393 L449	K389-I393 WeakPolarHBondContact O-CD1 3.36Å; K389-I393 WeakPolarHBondContact O-CG1 3.39Å; K389-L449 HydrophobicContact CD-CD2 4.08Å; K389-L449 HydrophobicContact CG-CD2 4.16Å
390	E	74.3	Confident	82.4	Confident	130 Å²	130	49.6 Å²	49.6	61%	0.607	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-53.1	179.2	-65.1	-174.9	-179.1	0	0	109.5	T388 N521	T388-E390 PolarHBondContact O-N 2.62Å; E390-N521 CarbonylContact O-C 3.48Å; E390-N521 VanDerWaalsContact O-C 3.3Å; E390-N521 WeakPolarHBondContact O-CA 3.31Å; E390-N521 VanDerWaalsContact O-CB 3.31Å; E390-N521 WeakPolarHBondContact O-CB 3.32Å; E390-N521 PolarHBondContact O-N 2.93Å
391	N	80.7	Confident	81.3	Confident	16 Å²	16	53 Å²	53	9%	0.086	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-46.1	174.4	-54.5	-10	0	0	0	111.3	D350 I351 N352 D386 T388 I393 D520 G522	D350-N391 WeakPolarHBondContact OD2-CB 3.29Å; D350-N391 PolarHBondContact OD2-ND2 2.92Å; I351-N391 PolarHBondContact O-ND2 3.11Å; N352-N391 HydrophobicContact CB-CB 4.17Å; N352-N391 PolarHBondContact N-ND2 3.45Å; N352-N391 VanDerWaalsContact OD1-CA 3.28Å; N352-N391 WeakPolarHBondContact OD1-CA 3.04Å; N352-N391 WeakPolarHBondContact OD1-CB 3.13Å; N352-N391 VanDerWaalsContact OD1-CG 3.25Å; N352-N391 PolarHBondContact OD1-OD1 2.77Å; D386-N391 HydrophobicContact CB-CB 3.6Å; T388-N391 WeakPolarHBondContact OG1-CB 3.34Å; T388-N391 PolarHBondContact OG1-N 2.75Å; T388-N391 PolarHBondContact OG1-ND2 3.02Å; N391-I393 PolarHBondContact O-N 3.35Å; N391-D520 VanDerWaalsContact O-CB 3.26Å; N391-D520 WeakPolarHBondContact O-CB 3.44Å; N391-G522 WeakPolarHBondContact OD1-CA 3.48Å
392	G	78.9	Confident	79.5	Confident	11 Å²	11	58.3 Å²	58.3	11%	0.113	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	0.2	-175.9	0	0	0	0	0	117.3	D386 T388	D386-G392 WeakPolarHBondContact O-CA 3.2Å; T388-G392 WeakPolarHBondContact O-CA 3.32Å; T388-G392 PolarHBondContact O-N 2.72Å
393	I	81.6	Confident	77.9	Confident	80 Å²	80	64.4 Å²	64.4	41%	0.41	31%	0.311	S	S	.	.			trans	-96.8	101.5	-177.4	-60.3	-170.7	0	0	0	111	K389 N391 D520 N521	K389-I393 WeakPolarHBondContact O-CD1 3.36Å; K389-I393 WeakPolarHBondContact O-CG1 3.39Å; N391-I393 PolarHBondContact O-N 3.35Å; I393-D520 CarbonylContact O-C 3.56Å; I393-D520 WeakPolarHBondContact O-CA 3.3Å; I393-N521 PolarHBondContact O-ND2 2.91Å
394	V	84.3	Confident	76	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.024	33%	0.331	C	S	.	.			trans	-72.9	137.9	172.8	-170.2	0	0	0	0	112	P356 A382 D384 F396 V454 A518 Y519	P356-V394 HydrophobicContact CB-CG1 3.92Å; P356-V394 HydrophobicContact CB-CG2 3.97Å; P356-V394 HydrophobicContact CG-CG1 4.24Å; P356-V394 HydrophobicContact CG-CG2 4.22Å; A382-V394 HydrophobicContact CB-CG1 4.21Å; D384-V394 HydrophobicContact CB-CG2 3.8Å; V394-F396 HydrophobicContact CG1-CE1 4.11Å; V394-F396 HydrophobicContact CG1-CZ 4.38Å; V394-V454 HydrophobicContact CB-CB 4.21Å; V394-V454 HydrophobicContact CB-CG2 3.92Å; V394-A518 HydrophobicContact CG1-CB 3.9Å; V394-Y519 CarbonylContact C-O 3.52Å
395	K	86.7	Confident	74.1	Confident	82 Å²	82	74.4 Å²	74.4	36%	0.357	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	154.9	165	-71.4	174	178	169.5	0	110.2	A518 Y519 N521	K395-A518 CarbonylContact O-C 3.55Å; K395-A518 WeakPolarHBondContact O-CA 3.25Å; K395-Y519 HydrophobicContact CB-CD1 4.17Å; K395-Y519 HydrophobicContact CB-CD2 4.26Å; K395-Y519 HydrophobicContact CB-CE1 3.63Å; K395-Y519 HydrophobicContact CB-CE2 3.76Å; K395-Y519 HydrophobicContact CB-CG 4.45Å; K395-Y519 VanDerWaalsContact CB-CZ 3.4Å; K395-Y519 HydrophobicContact CD-CE2 3.79Å; K395-Y519 HydrophobicContact CG-CE2 4.41Å; K395-Y519 PolarHBondContact N-O 3Å; K395-Y519 VanDerWaalsContact O-CD1 3.3Å; K395-Y519 WeakPolarHBondContact O-CD1 3.33Å; K395-Y519 PolarHBondContact O-N 3.31Å; K395-N521 WeakPolarHBondContact CD-OD1 3.43Å; K395-N521 WeakPolarHBondContact CE-ND2 3.36Å; K395-N521 WeakPolarHBondContact CE-OD1 3.11Å; K395-N521 PolarHBondContact NZ-OD1 2.89Å
396	F	91.2	Very high	72.4	Confident	11 Å²	11	74.7 Å²	74.7	5%	0.048	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	149.4	176	-56	-64.9	0	0	0	112.8	F358 F380 A382 V394 I432 Y434 V454 E517 A518	F358-F396 HydrophobicContact CD1-CE1 4.47Å; F358-F396 HydrophobicContact CE1-CD1 4.1Å; F358-F396 AromaticContact CE1-CE1 3.75Å; F358-F396 HydrophobicContact CE1-CE1 3.75Å; F358-F396 HydrophobicContact CZ-CD1 4.29Å; F358-F396 HydrophobicContact CZ-CE1 4.26Å; F380-F396 HydrophobicContact CD2-CD1 4.4Å; F380-F396 HydrophobicContact CD2-CE1 4.11Å; F380-F396 HydrophobicContact CD2-CE2 4.37Å; F380-F396 HydrophobicContact CD2-CZ 4.11Å; F380-F396 HydrophobicContact CE2-CB 4.27Å; F380-F396 AromaticContact CE2-CD1 3.7Å; F380-F396 HydrophobicContact CE2-CD1 3.7Å; F380-F396 AromaticContact CE2-CD2 3.76Å; F380-F396 HydrophobicContact CE2-CD2 3.76Å; F380-F396 AromaticContact CE2-CE1 3.84Å; F380-F396 HydrophobicContact CE2-CE1 3.84Å; F380-F396 AromaticContact CE2-CE2 3.93Å; F380-F396 HydrophobicContact CE2-CE2 3.93Å; F380-F396 AromaticContact CE2-CG 3.65Å; F380-F396 HydrophobicContact CE2-CG 3.65Å; F380-F396 AromaticContact CE2-CZ 3.97Å; F380-F396 HydrophobicContact CE2-CZ 3.97Å; F380-F396 HydrophobicContact CZ-CD2 4.43Å; F380-F396 HydrophobicContact CZ-CG 4.35Å; A382-F396 HydrophobicContact CB-CE1 3.63Å; A382-F396 HydrophobicContact CB-CZ 3.94Å; V394-F396 HydrophobicContact CG1-CE1 4.11Å; V394-F396 HydrophobicContact CG1-CZ 4.38Å; F396-I432 HydrophobicContact CB-CD1 3.82Å; F396-I432 HydrophobicContact CB-CG2 4.21Å; F396-Y434 AromaticContact CD2-CE1 3.71Å; F396-Y434 HydrophobicContact CD2-CE1 3.71Å; F396-Y434 HydrophobicContact CE2-CE1 4.32Å; F396-Y434 PolarHBondContact N-OH 3.49Å; F396-Y434 PolarHBondContact O-OH 2.78Å; F396-V454 HydrophobicContact CE2-CB 4.22Å; F396-V454 HydrophobicContact CE2-CG1 3.92Å; F396-V454 HydrophobicContact CZ-CB 4.45Å; F396-V454 WeakPolarHBondContact CZ-O 3.33Å; F396-E517 CarbonylContact C-O 3.57Å; F396-E517 WeakPolarHBondContact CA-O 3.15Å; F396-A518 HydrophobicContact CD1-CB 3.87Å; F396-A518 HydrophobicContact CE1-CB 3.87Å
397	R	89.8	Confident	70.5	Confident	98 Å²	98	76.5 Å²	76.5	37%	0.37	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	157.8	168.2	66.4	-175.4	-174.9	-159.7	-3	112.4	E517 Y519	R397-E517 HydrophobicContact CG-CB 3.88Å; R397-E517 IonicContact CZ-OE2 2.95Å; R397-E517 PolarHBondContact N-O 3.19Å; R397-E517 IonicContact NE-OE2 2.59Å; R397-E517 PolarHBondContact NE-OE2 3.2Å; R397-E517 IonicContact NH2-OE2 3.36Å; R397-E517 PolarHBondContact NH2-OE2 2.96Å; R397-E517 PolarHBondContact O-N 3.37Å; R397-Y519 HydrophobicContact CB-CE1 4.05Å; R397-Y519 HydrophobicContact CG-CD1 4.12Å; R397-Y519 HydrophobicContact CG-CE1 3.87Å
398	I	89.9	Confident	69.2	Low	1 Å²	1	80.1 Å²	80.1	1%	0.005	40%	0.4	C	S	.	.			trans	-97.9	113.2	163.6	-52.9	-179.1	0	0	0	107.3	G400 Q401 A426 A427 F430 I432 L458 F514	I398-G400 PolarHBondContact O-N 3.45Å; I398-Q401 HydrophobicContact CB-CG 4.24Å; I398-Q401 WeakPolarHBondContact O-CB 3.47Å; I398-Q401 WeakPolarHBondContact O-CG 3.39Å; I398-Q401 PolarHBondContact O-N 3.31Å; I398-Q401 VanDerWaalsContact O-N 3.1Å; I398-A426 HydrophobicContact CG2-CB 4.25Å; I398-A427 HydrophobicContact CG2-CB 4.15Å; I398-F430 HydrophobicContact CD1-CB 3.75Å; I398-I432 HydrophobicContact CD1-CG1 4.24Å; I398-I432 HydrophobicContact CG1-CD1 3.78Å; I398-I432 HydrophobicContact CG1-CG1 3.98Å; I398-L458 HydrophobicContact CD1-CD1 3.94Å; I398-F514 HydrophobicContact CG2-CD2 4.31Å; I398-F514 HydrophobicContact CG2-CE2 4.36Å
399	P	82.2	Confident	68	Low	12 Å²	12	84.4 Å²	84.4	8%	0.078	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	129.4	177.2	-30.2	37.1	0	0	0	112.1	L419 Q423 F515 E517	P399-L419 HydrophobicContact CB-CD2 3.82Å; P399-Q423 HydrophobicContact CB-CG 4.06Å; P399-Q423 WeakPolarHBondContact O-CG 3.36Å; P399-Q423 PolarHBondContact O-NE2 2.87Å; P399-F515 WeakPolarHBondContact CD-O 3.37Å; P399-E517 HydrophobicContact CG-CB 4.23Å; P399-E517 HydrophobicContact CG-CG 3.67Å; P399-E517 WeakPolarHBondContact CG-OE1 3.19Å
400	G	72.8	Confident	66.9	Low	34 Å²	34	82.2 Å²	82.2	35%	0.351	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.6	-19.1	-171.5	0	0	0	0	0	114.1	I398 M402	I398-G400 PolarHBondContact O-N 3.45Å; G400-M402 PolarHBondContact O-N 2.84Å
401	Q	68.3	Low	65.1	Low	74 Å²	74	81.7 Å²	81.7	35%	0.346	42%	0.42	S	S	.	.			trans	-76.5	90.3	171	-64.4	-172.7	-25.9	0	0	110.3	I398 A427 F430	I398-Q401 HydrophobicContact CB-CG 4.24Å; I398-Q401 WeakPolarHBondContact O-CB 3.47Å; I398-Q401 WeakPolarHBondContact O-CG 3.39Å; I398-Q401 PolarHBondContact O-N 3.31Å; I398-Q401 VanDerWaalsContact O-N 3.1Å; Q401-A427 HydrophobicContact CG-CB 3.63Å; Q401-A427 PolarHBondContact NE2-O 2.92Å; Q401-F430 PolarHBondContact NE2-O 2.9Å
402	M	54.7	Low	62.8	Low	125 Å²	125	84.3 Å²	84.3	62%	0.616	45%	0.451	S	S	*	.			trans	-95.7	117.1	172.9	-75.5	-170	171	0	0	111.6	G400 A407 I410	G400-M402 PolarHBondContact O-N 2.84Å; M402-A407 HydrophobicContact SD-CB 3.79Å; M402-I410 HydrophobicContact CE-CD1 4.47Å
403	D	53.2	Low	60.7	Low	129 Å²	129	92.6 Å²	92.6	69%	0.69	49%	0.487	S	S	*	.			trans	-70.1	143.6	156.4	-93.7	-29.7	0	0	0	110.2	N405 E406	D403-N405 PolarHBondContact O-N 2.87Å; D403-E406 PolarHBondContact O-N 3.05Å; D403-E406 VanDerWaalsContact O-N 3.11Å
404	Q	47.7	Very low	58.4	Low	189 Å²	189	100.4 Å²	100.4	88%	0.883	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-13	-170	-64.7	-175	-7	0	0	114.5
405	N	46.8	Very low	56.2	Low	144 Å²	144	107 Å²	107	77%	0.77	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-29.9	179.1	-66.2	-36.8	0	0	0	113.7	D403	D403-N405 PolarHBondContact O-N 2.87Å
406	E	48.5	Very low	53.9	Low	115 Å²	115	114.9 Å²	114.9	54%	0.537	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-83.2	-27.6	-173.8	-63.8	-161.9	150.4	0	0	113.4	D403 K408 I409	D403-E406 PolarHBondContact O-N 3.05Å; D403-E406 VanDerWaalsContact O-N 3.11Å; E406-K408 PolarHBondContact O-N 2.79Å; E406-I409 PolarHBondContact O-N 2.91Å
407	A	42.3	Very low	51.9	Low	41 Å²	41	119.9 Å²	119.9	34%	0.339	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-55.4	-14.7	177.8	0	0	0	0	0	114.1	M402	M402-A407 HydrophobicContact SD-CB 3.79Å
408	K	41.7	Very low	50.3	Low	177 Å²	177	120.7 Å²	120.7	77%	0.77	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-91.6	-14.5	-179.2	-145.5	171.2	-172.2	174.8	0	114.5	E406 T411	E406-K408 PolarHBondContact O-N 2.79Å; K408-T411 PolarHBondContact O-OG1 2.94Å; K408-T411 VanDerWaalsContact O-OG1 3.13Å
409	I	45.3	Very low	49.2	Very low	143 Å²	143	123.3 Å²	123.3	73%	0.733	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-34.3	-179.1	-60.8	178.1	0	0	0	111.2	E406 T411	E406-I409 PolarHBondContact O-N 2.91Å; I409-T411 PolarHBondContact O-N 2.67Å; I409-T411 VanDerWaalsContact O-N 3.13Å
410	I	43.7	Very low	48.8	Very low	110 Å²	110	126.4 Å²	126.4	56%	0.564	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-68.5	-12.6	-178.6	-60.3	173.6	0	0	0	112.6	M402 G412	M402-I410 HydrophobicContact CE-CD1 4.47Å; I410-G412 PolarHBondContact O-N 2.7Å
411	T	36.2	Very low	48.7	Very low	120 Å²	120	129.3 Å²	129.3	74%	0.736	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-70.2	13	-180	57.3	0	0	0	0	115.8	K408 I409	K408-T411 PolarHBondContact O-OG1 2.94Å; K408-T411 VanDerWaalsContact O-OG1 3.13Å; I409-T411 PolarHBondContact O-N 2.67Å; I409-T411 VanDerWaalsContact O-N 3.13Å
412	G	32.2	Very low	49.1	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-112.9	-13	-177.7	0	0	0	0	0	117.2	I410	I410-G412 PolarHBondContact O-N 2.7Å
413	Q	35.6	Very low	50.5	Low	186 Å²	186	120.6 Å²	120.6	87%	0.869	62%	0.615	S	S	*	*	S	Bend	trans	-118.3	158.2	-178.1	-83.4	171.4	-56	0	0	112.8	D415	Q413-D415 PolarHBondContact O-N 3.39Å
414	R	32.9	Very low	51.8	Low	244 Å²	244	118.5 Å²	118.5	92%	0.921	60%	0.604	S	S	*	*	S	Bend	trans	-88.6	-7.8	-151.7	-130	174.1	-167	155.5	3.8	115.7
415	D	38	Very low	53.5	Low	141 Å²	141	109.5 Å²	109.5	75%	0.754	56%	0.562	S	S	*	*			trans	-98.3	93.2	-177.8	-62.3	-60.2	0	0	0	111.3	Q413 I417	Q413-D415 PolarHBondContact O-N 3.39Å; D415-I417 PolarHBondContact O-N 2.66Å
416	R	39.1	Very low	55.4	Low	249 Å²	249	102.7 Å²	102.7	94%	0.94	53%	0.525	S	S	*	.			trans	-67.8	85.1	157	-93.9	-172.8	164.6	-164.7	-4.6	108.2	S418	R416-S418 PolarHBondContact O-N 2.94Å
417	I	49.7	Very low	57.2	Low	115 Å²	115	97.5 Å²	97.5	59%	0.59	50%	0.502	S	S	*	.			trans	-58.8	104.7	166.1	-59.6	177.6	0	0	0	106.8	D415 L419	D415-I417 PolarHBondContact O-N 2.66Å; I417-L419 VanDerWaalsContact C-N 3.33Å; I417-L419 HydrophobicContact CG2-CD2 4.33Å; I417-L419 PolarHBondContact O-N 2.93Å
418	S	55.1	Low	59.2	Low	115 Å²	115	99.5 Å²	99.5	80%	0.804	50%	0.504	S	S	*	.			trans	-73.4	91.6	176.9	-167.6	0	0	0	0	108.1	R416 T420	R416-S418 PolarHBondContact O-N 2.94Å; S418-T420 PolarHBondContact O-N 2.82Å
419	L	67.2	Low	61.3	Low	57 Å²	57	91.2 Å²	91.2	30%	0.298	47%	0.469	S	S	.	.			trans	-52.3	132.4	175.4	-61	176.1	0	0	0	109.1	P399 I417 Q423 L424	P399-L419 HydrophobicContact CB-CD2 3.82Å; I417-L419 VanDerWaalsContact C-N 3.33Å; I417-L419 HydrophobicContact CG2-CD2 4.33Å; I417-L419 PolarHBondContact O-N 2.93Å; L419-Q423 HydrophobicContact CB-CG 4.42Å; L419-Q423 HydrophobicContact CD2-CG 4.04Å; L419-L424 HydrophobicContact CB-CD2 4.04Å; L419-L424 HydrophobicContact CB-CG 4.11Å; L419-L424 HydrophobicContact CD1-CD2 3.75Å
420	T	73.3	Confident	63.6	Low	76 Å²	76	84.4 Å²	84.4	47%	0.466	43%	0.434	S	S	.	.			trans	-66.2	156	175	59.4	0	0	0	0	109.8	S418 S422 Q423 L424	S418-T420 PolarHBondContact O-N 2.82Å; T420-S422 VanDerWaalsContact C-N 3.27Å; T420-S422 PolarHBondContact O-N 3.14Å; T420-Q423 WeakPolarHBondContact O-CA 3.34Å; T420-Q423 WeakPolarHBondContact O-CB 3.46Å; T420-Q423 PolarHBondContact O-N 2.85Å; T420-Q423 WeakPolarHBondContact OG1-CB 3.38Å; T420-Q423 PolarHBondContact OG1-N 2.85Å; T420-L424 PolarHBondContact O-N 3.16Å
421	E	71.5	Confident	65.8	Low	96 Å²	96	80.3 Å²	80.3	45%	0.449	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-38.4	-178.8	-161.9	172	-168.8	0	0	111.7	Q423 L424 I425 I478	E421-Q423 VanDerWaalsContact C-N 3.29Å; E421-Q423 PolarHBondContact O-N 3.02Å; E421-L424 WeakPolarHBondContact O-CB 2.98Å; E421-L424 PolarHBondContact O-N 2.96Å; E421-L424 VanDerWaalsContact O-N 3.15Å; E421-I425 WeakPolarHBondContact O-CG1 3.42Å; E421-I425 PolarHBondContact O-N 2.9Å; E421-I478 HydrophobicContact CB-CG2 3.96Å; E421-I478 VanDerWaalsContact CD-CD1 3.46Å; E421-I478 HydrophobicContact CG-CD1 3.86Å; E421-I478 HydrophobicContact CG-CG1 4.29Å; E421-I478 HydrophobicContact CG-CG2 4.07Å; E421-I478 VanDerWaalsContact OE1-CD1 3.3Å; E421-I478 WeakPolarHBondContact OE1-CD1 3.3Å
422	S	76.4	Confident	68.5	Low	8 Å²	8	75.9 Å²	75.9	6%	0.056	39%	0.386	C	S	.	.	H	α-helix	trans	-57	-37.7	170.2	-52.3	0	0	0	0	113.5	T420 I425 A426 N482 H513	T420-S422 VanDerWaalsContact C-N 3.27Å; T420-S422 PolarHBondContact O-N 3.14Å; S422-I425 PolarHBondContact O-N 2.81Å; S422-A426 WeakPolarHBondContact O-CB 3.23Å; S422-A426 PolarHBondContact O-N 3.1Å; S422-N482 PolarHBondContact OG-ND2 3.13Å; S422-N482 VanDerWaalsContact OG-ND2 3.13Å; S422-H513 WeakPolarHBondContact CB-O 3.33Å
423	Q	83.5	Confident	71.1	Confident	7 Å²	7	75.4 Å²	75.4	3%	0.033	37%	0.365	C	S	.	.	H	α-helix	trans	-70.1	-37.3	177.2	-175.5	64.2	64.6	0	0	111.8	P399 L419 T420 E421 A426 A427 F515	P399-Q423 HydrophobicContact CB-CG 4.06Å; P399-Q423 WeakPolarHBondContact O-CG 3.36Å; P399-Q423 PolarHBondContact O-NE2 2.87Å; L419-Q423 HydrophobicContact CB-CG 4.42Å; L419-Q423 HydrophobicContact CD2-CG 4.04Å; T420-Q423 WeakPolarHBondContact O-CA 3.34Å; T420-Q423 WeakPolarHBondContact O-CB 3.46Å; T420-Q423 PolarHBondContact O-N 2.85Å; T420-Q423 WeakPolarHBondContact OG1-CB 3.38Å; T420-Q423 PolarHBondContact OG1-N 2.85Å; E421-Q423 VanDerWaalsContact C-N 3.29Å; E421-Q423 PolarHBondContact O-N 3.02Å; Q423-A426 PolarHBondContact O-N 3.3Å; Q423-A427 PolarHBondContact O-N 2.96Å; Q423-A427 VanDerWaalsContact O-N 3.13Å; Q423-F515 PolarHBondContact NE2-O 3.48Å; Q423-F515 PolarHBondContact OE1-O 3.45Å
424	L	81.4	Confident	73.4	Confident	85 Å²	85	71.1 Å²	71.1	45%	0.445	34%	0.342	S	S	.	.	H	α-helix	trans	-66.4	-41.9	174	-67.3	172.2	0	0	0	111.8	L419 T420 E421 A427 E428	L419-L424 HydrophobicContact CB-CD2 4.04Å; L419-L424 HydrophobicContact CB-CG 4.11Å; L419-L424 HydrophobicContact CD1-CD2 3.75Å; T420-L424 PolarHBondContact O-N 3.16Å; E421-L424 WeakPolarHBondContact O-CB 2.98Å; E421-L424 PolarHBondContact O-N 2.96Å; E421-L424 VanDerWaalsContact O-N 3.15Å; L424-A427 PolarHBondContact O-N 3Å; L424-E428 PolarHBondContact O-N 3.04Å; L424-E428 VanDerWaalsContact O-N 3.1Å
425	I	82.2	Confident	75.2	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-66.6	-40.7	175.4	-58.3	157.7	0	0	0	111.1	E421 S422 A427 E428 L429 K474 A475 I478	E421-I425 WeakPolarHBondContact O-CG1 3.42Å; E421-I425 PolarHBondContact O-N 2.9Å; S422-I425 PolarHBondContact O-N 2.81Å; I425-A427 VanDerWaalsContact C-N 3.27Å; I425-A427 PolarHBondContact O-N 3.29Å; I425-E428 CarbonylContact O-C 3Å; I425-E428 WeakPolarHBondContact O-CA 3.44Å; I425-E428 WeakPolarHBondContact O-CB 3.36Å; I425-E428 PolarHBondContact O-N 3.4Å; I425-L429 WeakPolarHBondContact O-CB 3.37Å; I425-L429 PolarHBondContact O-N 3.28Å; I425-K474 HydrophobicContact CD1-CG 4.32Å; I425-K474 HydrophobicContact CG1-CD 4.33Å; I425-K474 HydrophobicContact CG1-CG 4.23Å; I425-A475 HydrophobicContact CG2-CB 3.69Å; I425-I478 HydrophobicContact CD1-CB 3.66Å; I425-I478 HydrophobicContact CD1-CD1 3.5Å; I425-I478 VanDerWaalsContact CD1-CD1 3.5Å; I425-I478 HydrophobicContact CD1-CG1 4.15Å; I425-I478 HydrophobicContact CD1-CG2 3.73Å; I425-I478 HydrophobicContact CG1-CD1 4.42Å
426	A	87.1	Confident	76	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.2	-38.1	176.5	0	0	0	0	0	112.2	I398 S422 Q423 E428 F430 F514	I398-A426 HydrophobicContact CG2-CB 4.25Å; S422-A426 WeakPolarHBondContact O-CB 3.23Å; S422-A426 PolarHBondContact O-N 3.1Å; Q423-A426 PolarHBondContact O-N 3.3Å; A426-E428 VanDerWaalsContact C-N 3.31Å; A426-F430 HydrophobicContact CB-CD2 4.11Å; A426-F430 HydrophobicContact CB-CE2 4.49Å; A426-F430 WeakPolarHBondContact O-CB 3.49Å; A426-F430 PolarHBondContact O-N 3.06Å; A426-F514 HydrophobicContact CB-CB 3.67Å; A426-F514 HydrophobicContact CB-CD1 3.58Å; A426-F514 HydrophobicContact CB-CD2 3.52Å; A426-F514 HydrophobicContact CB-CE1 4Å; A426-F514 HydrophobicContact CB-CE2 3.96Å; A426-F514 HydrophobicContact CB-CG 3.31Å; A426-F514 HydrophobicContact CB-CZ 4.18Å
427	A	85.9	Confident	76.5	Confident	6 Å²	6	61.5 Å²	61.5	5%	0.05	31%	0.309	C	S	.	.	H	α-helix	trans	-66.7	-30.6	172	0	0	0	0	0	113.2	I398 Q401 Q423 L424 I425 K461	I398-A427 HydrophobicContact CG2-CB 4.15Å; Q401-A427 HydrophobicContact CG-CB 3.63Å; Q401-A427 PolarHBondContact NE2-O 2.92Å; Q423-A427 PolarHBondContact O-N 2.96Å; Q423-A427 VanDerWaalsContact O-N 3.13Å; L424-A427 PolarHBondContact O-N 3Å; I425-A427 VanDerWaalsContact C-N 3.27Å; I425-A427 PolarHBondContact O-N 3.29Å; A427-K461 PolarHBondContact O-NZ 2.96Å
428	E	85.3	Confident	76	Confident	83 Å²	83	63.5 Å²	63.5	39%	0.388	31%	0.314	S	S	.	.	H	α-helix	trans	-74.6	-48.4	176.7	-169.8	166.1	-150.5	0	0	112.2	L424 I425 A426 K461 A471 K474	L424-E428 PolarHBondContact O-N 3.04Å; L424-E428 VanDerWaalsContact O-N 3.1Å; I425-E428 CarbonylContact O-C 3Å; I425-E428 WeakPolarHBondContact O-CA 3.44Å; I425-E428 WeakPolarHBondContact O-CB 3.36Å; I425-E428 PolarHBondContact O-N 3.4Å; A426-E428 VanDerWaalsContact C-N 3.31Å; E428-K461 WeakPolarHBondContact O-CD 3.36Å; E428-K461 PolarHBondContact O-NZ 3.15Å; E428-A471 HydrophobicContact CG-CB 4.44Å; E428-K474 IonicContact OE1-NZ 3.49Å; E428-K474 IonicContact OE2-NZ 2.73Å; E428-K474 PolarHBondContact OE2-NZ 2.84Å
429	L	86.1	Confident	75.3	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-85.6	-34.4	-171.3	-180	60.5	0	0	0	114.9	I425 K461 I468 A471 A475	I425-L429 WeakPolarHBondContact O-CB 3.37Å; I425-L429 PolarHBondContact O-N 3.28Å; L429-K461 WeakPolarHBondContact O-CB 3.48Å; L429-K461 PolarHBondContact O-N 2.93Å; L429-I468 HydrophobicContact CD1-CG2 4.28Å; L429-A471 HydrophobicContact CB-CB 4.1Å; L429-A471 HydrophobicContact CD1-CB 3.85Å; L429-A471 HydrophobicContact CG-CB 4.5Å; L429-A475 HydrophobicContact CD2-CB 4.38Å
430	F	92.6	Very high	74.1	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	164.8	-175.3	-54.4	-54.9	0	0	0	113.2	I367 I377 I398 Q401 A426 L458 I459 I460 L512 F514 I534	I367-F430 HydrophobicContact CD1-CE1 3.88Å; I367-F430 HydrophobicContact CD1-CZ 4.02Å; I377-F430 HydrophobicContact CD1-CD1 3.59Å; I377-F430 HydrophobicContact CD1-CE1 3.38Å; I377-F430 HydrophobicContact CD1-CZ 4.21Å; I398-F430 HydrophobicContact CD1-CB 3.75Å; Q401-F430 PolarHBondContact NE2-O 2.9Å; A426-F430 HydrophobicContact CB-CD2 4.11Å; A426-F430 HydrophobicContact CB-CE2 4.49Å; A426-F430 WeakPolarHBondContact O-CB 3.49Å; A426-F430 PolarHBondContact O-N 3.06Å; F430-L458 HydrophobicContact CB-CD1 3.82Å; F430-L458 HydrophobicContact CG-CD1 4.27Å; F430-I459 WeakPolarHBondContact CA-O 3.2Å; F430-I460 HydrophobicContact CE1-CG1 4.48Å; F430-L512 HydrophobicContact CE2-CD2 3.77Å; F430-L512 HydrophobicContact CZ-CD2 4.27Å; F430-F514 AromaticContact CD2-CE1 3.77Å; F430-F514 HydrophobicContact CD2-CE1 3.77Å; F430-F514 HydrophobicContact CD2-CE2 4.49Å; F430-F514 AromaticContact CD2-CZ 3.65Å; F430-F514 HydrophobicContact CD2-CZ 3.65Å; F430-F514 HydrophobicContact CE2-CD1 4.42Å; F430-F514 AromaticContact CE2-CE1 3.56Å; F430-F514 HydrophobicContact CE2-CE1 3.56Å; F430-F514 AromaticContact CE2-CZ 3.93Å; F430-F514 HydrophobicContact CE2-CZ 3.93Å; F430-I534 HydrophobicContact CE2-CG1 4.11Å; F430-I534 HydrophobicContact CZ-CB 4.42Å; F430-I534 HydrophobicContact CZ-CG1 4.01Å; F430-I534 HydrophobicContact CZ-CG2 4.21Å
431	S	90.8	Very high	72.5	Confident	24 Å²	24	70.6 Å²	70.6	17%	0.168	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	160.2	166.7	50.7	0	0	0	0	111	I459	S431-I459 PolarHBondContact N-O 2.98Å; S431-I459 VanDerWaalsContact O-CG1 3.3Å; S431-I459 WeakPolarHBondContact O-CG1 3.4Å; S431-I459 PolarHBondContact O-N 3.33Å; S431-I459 WeakPolarHBondContact OG-CD1 3.03Å; S431-I459 VanDerWaalsContact OG-CG1 3.32Å; S431-I459 WeakPolarHBondContact OG-CG1 3.38Å
432	I	91.9	Very high	70.9	Confident	26 Å²	26	69.7 Å²	69.7	13%	0.133	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.3	177.8	-60.1	169.7	0	0	0	108.7	F380 F396 I398 R457 I516	F380-I432 HydrophobicContact CE1-CG2 4.4Å; F380-I432 HydrophobicContact CZ-CD1 3.99Å; F380-I432 HydrophobicContact CZ-CG1 4.03Å; F380-I432 HydrophobicContact CZ-CG2 3.7Å; F396-I432 HydrophobicContact CB-CD1 3.82Å; F396-I432 HydrophobicContact CB-CG2 4.21Å; I398-I432 HydrophobicContact CD1-CG1 4.24Å; I398-I432 HydrophobicContact CG1-CD1 3.78Å; I398-I432 HydrophobicContact CG1-CG1 3.98Å; I432-R457 CarbonylContact C-O 3.59Å; I432-R457 VanDerWaalsContact CA-O 3.32Å; I432-R457 WeakPolarHBondContact CA-O 3.35Å; I432-I516 HydrophobicContact CD1-CG2 3.88Å
433	E	88.3	Confident	68.9	Low	60 Å²	60	78.3 Å²	78.3	28%	0.28	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.2	170.4	-74.6	-171.2	162.9	0	0	110.7	R457 I459 R462	E433-R457 HydrophobicContact CB-CB 4.43Å; E433-R457 PolarHBondContact N-O 2.82Å; E433-R457 WeakPolarHBondContact O-CB 3.42Å; E433-R457 PolarHBondContact O-N 3.01Å; E433-I459 VanDerWaalsContact CD-CD1 3.44Å; E433-I459 HydrophobicContact CG-CD1 3.7Å; E433-I459 HydrophobicContact CG-CG1 4.1Å; E433-I459 HydrophobicContact CG-CG2 4.48Å; E433-I459 WeakPolarHBondContact OE1-CD1 3.26Å; E433-R462 IonicContact OE1-CZ 3.7Å; E433-R462 VanDerWaalsContact OE1-CZ 3.23Å; E433-R462 IonicContact OE1-NE 3.16Å; E433-R462 PolarHBondContact OE1-NE 3.36Å; E433-R462 IonicContact OE1-NH2 3.81Å; E433-R462 PolarHBondContact OE1-NH2 3.25Å; E433-R462 IonicContact OE2-CZ 2.66Å; E433-R462 IonicContact OE2-NH2 3.7Å; E433-R462 PolarHBondContact OE2-NH2 3.41Å
434	Y	83.8	Confident	66.4	Low	96 Å²	96	83.6 Å²	83.6	38%	0.376	42%	0.418	S	S	.	.			trans	-83.4	132.2	169.2	-62.2	-90.9	0	0	0	108.9	F396 Y436 V454 Y455	F396-Y434 AromaticContact CD2-CE1 3.71Å; F396-Y434 HydrophobicContact CD2-CE1 3.71Å; F396-Y434 HydrophobicContact CE2-CE1 4.32Å; F396-Y434 PolarHBondContact N-OH 3.49Å; F396-Y434 PolarHBondContact O-OH 2.78Å; Y434-Y436 PolarHBondContact O-N 2.92Å; Y434-Y436 VanDerWaalsContact O-N 3.12Å; Y434-V454 HydrophobicContact CD1-CG1 4.17Å; Y434-V454 HydrophobicContact CE1-CG1 3.98Å; Y434-Y455 WeakPolarHBondContact CD1-O 3.45Å
435	P	70	Confident	64.2	Low	45 Å²	45	82.8 Å²	82.8	29%	0.292	41%	0.413	S	S	.	.			trans	-71.1	107.3	177.5	28.7	-32.5	0	0	0	110.2	E437 Y455	P435-E437 PolarHBondContact O-N 2.71Å; P435-E437 VanDerWaalsContact O-N 3.14Å; P435-Y455 WeakPolarHBondContact CD-O 3.14Å
436	Y	55.5	Low	61.9	Low	229 Å²	229	91.6 Å²	91.6	90%	0.898	45%	0.454	S	S	*	.			trans	-62.2	113.6	173.8	-71.6	-88.4	0	0	0	111.1	Y434	Y434-Y436 PolarHBondContact O-N 2.92Å; Y434-Y436 VanDerWaalsContact O-N 3.12Å
437	E	48.4	Very low	59.6	Low	158 Å²	158	98.7 Å²	98.7	74%	0.738	49%	0.487	S	S	*	.			trans	-62.6	150.3	158.9	-64.4	-165.7	146.9	0	0	109.9	P435	P435-E437 PolarHBondContact O-N 2.71Å; P435-E437 VanDerWaalsContact O-N 3.14Å
438	K	39.1	Very low	57.1	Low	158 Å²	158	104.3 Å²	104.3	69%	0.687	52%	0.516	S	S	*	.			trans	-69.8	135.7	-171.4	-67.6	173.8	-176	167.5	0	110.3	N440	K438-N440 PolarHBondContact O-N 3.12Å
439	P	41.2	Very low	54.9	Low	120 Å²	120	105.2 Å²	105.2	78%	0.779	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	16.2	-173.6	30.1	-37.5	0	0	0	115.5
440	N	41.7	Very low	53	Low	146 Å²	146	112.9 Å²	112.9	78%	0.781	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-12.7	-173.5	-72.8	12.2	0	0	0	114.6	K438	K438-N440 PolarHBondContact O-N 3.12Å
441	D	40.9	Very low	51.1	Low	131 Å²	131	119.5 Å²	119.5	70%	0.701	59%	0.594	S	S	*	*	S	Bend	trans	-97.7	6.1	-178.9	-64.9	-63.1	0	0	0	112.9
442	V	37.2	Very low	49.9	Very low	77 Å²	77	119.5 Å²	119.5	47%	0.467	59%	0.594	S	S	.	*			trans	-111.9	48.5	-164.2	-168.9	0	0	0	0	112.7	I445	V442-I445 HydrophobicContact CB-CD1 4.36Å; V442-I445 HydrophobicContact CG1-CB 3.93Å; V442-I445 HydrophobicContact CG1-CD1 3.84Å; V442-I445 HydrophobicContact CG1-CG1 3.85Å; V442-I445 HydrophobicContact CG2-CD1 3.85Å; V442-I445 HydrophobicContact CG2-CG1 4.48Å
443	M	33.5	Very low	49.2	Very low	188 Å²	188	120.2 Å²	120.2	93%	0.926	60%	0.6	S	S	*	*	S	Bend	trans	-96.6	3.8	161.7	-92.8	-71.2	-173.6	0	0	113
444	N	32.3	Very low	49	Very low	119 Å²	119	119 Å²	119	64%	0.636	60%	0.597	S	S	*	*	S	Bend	trans	-129	1.2	-176.5	-117.3	51.6	0	0	0	115.2	Q446 E447	N444-Q446 PolarHBondContact O-N 3.2Å; N444-E447 PolarHBondContact O-N 2.94Å
445	I	35.6	Very low	49.1	Very low	68 Å²	68	120.9 Å²	120.9	35%	0.349	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83	63.1	179.4	-49.5	-174	0	0	0	111	V442 N448 L449	V442-I445 HydrophobicContact CB-CD1 4.36Å; V442-I445 HydrophobicContact CG1-CB 3.93Å; V442-I445 HydrophobicContact CG1-CD1 3.84Å; V442-I445 HydrophobicContact CG1-CG1 3.85Å; V442-I445 HydrophobicContact CG2-CD1 3.85Å; V442-I445 HydrophobicContact CG2-CG1 4.48Å; I445-N448 HydrophobicContact CG1-CB 4.36Å; I445-N448 HydrophobicContact CG2-CB 4.02Å; I445-L449 HydrophobicContact CG2-CD1 4.44Å
446	Q	33.4	Very low	50	Low	186 Å²	186	118.8 Å²	118.8	87%	0.869	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-14.5	143.7	-69.4	-166.4	-50.8	0	0	111.6	N444	N444-Q446 PolarHBondContact O-N 3.2Å
447	E	38.9	Very low	51.7	Low	149 Å²	149	111.5 Å²	111.5	70%	0.696	56%	0.561	S	S	*	*	S	Bend	trans	-102.9	-9.3	-175	-60.6	-175.4	137.9	0	0	114.4	N444	N444-E447 PolarHBondContact O-N 2.94Å
448	N	32.9	Very low	53.9	Low	123 Å²	123	104 Å²	104	66%	0.658	53%	0.526	S	S	*	.			trans	-104.4	20.7	-173.4	-97.6	0.3	0	0	0	115.3	I445 H450	I445-N448 HydrophobicContact CG1-CB 4.36Å; I445-N448 HydrophobicContact CG2-CB 4.02Å; N448-H450 PolarHBondContact O-N 3.5Å; N448-H450 VanDerWaalsContact O-N 3.11Å
449	L	39.6	Very low	56.4	Low	102 Å²	102	96.4 Å²	96.4	53%	0.534	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	5.2	176.6	-93.6	88.6	0	0	0	114.8	K389 I445 N451	K389-L449 HydrophobicContact CD-CD2 4.08Å; K389-L449 HydrophobicContact CG-CD2 4.16Å; I445-L449 HydrophobicContact CG2-CD1 4.44Å; L449-N451 PolarHBondContact O-N 2.82Å
450	H	45.4	Very low	58.7	Low	165 Å²	165	90.8 Å²	90.8	76%	0.764	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.9	-176.8	-80.8	-64.6	0	0	0	115.7	N448 S452	N448-H450 PolarHBondContact O-N 3.5Å; N448-H450 VanDerWaalsContact O-N 3.11Å; H450-S452 PolarHBondContact O-N 2.87Å
451	N	53.6	Low	61	Low	139 Å²	139	86.4 Å²	86.4	74%	0.743	43%	0.431	S	S	*	.			trans	-88.6	89.6	170.1	-84.2	-8.5	0	0	0	110.4	L449 T453	L449-N451 PolarHBondContact O-N 2.82Å; N451-T453 PolarHBondContact O-N 2.97Å
452	S	64.9	Low	63.2	Low	25 Å²	25	87.3 Å²	87.3	18%	0.175	42%	0.424	C	S	.	.			trans	-73.7	5	172	63.2	0	0	0	0	114.2	R383 D384 H450	R383-S452 WeakPolarHBondContact CA-O 3.48Å; R383-S452 WeakPolarHBondContact CG-OG 3.48Å; R383-S452 PolarHBondContact NE-OG 3.01Å; D384-S452 PolarHBondContact N-O 2.75Å; D384-S452 VanDerWaalsContact O-CB 3.25Å; D384-S452 WeakPolarHBondContact O-CB 3.5Å; D384-S452 PolarHBondContact O-OG 2.94Å; H450-S452 PolarHBondContact O-N 2.87Å
453	T	77.4	Confident	65.3	Low	40 Å²	40	87.2 Å²	87.2	25%	0.245	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	116.4	174.7	-53	0	0	0	0	110.6	A382 N451 Y455	A382-T453 WeakPolarHBondContact O-CA 3.41Å; N451-T453 PolarHBondContact O-N 2.97Å; T453-Y455 HydrophobicContact CG2-CE2 4.1Å
454	V	83.1	Confident	67.6	Low	36 Å²	36	81 Å²	81	22%	0.218	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	137.1	176.2	-174.4	0	0	0	0	109.8	S381 A382 V394 F396 Y434	S381-V454 WeakPolarHBondContact CA-O 3.4Å; S381-V454 VanDerWaalsContact CB-O 3.26Å; S381-V454 WeakPolarHBondContact CB-O 3.33Å; A382-V454 PolarHBondContact N-O 2.83Å; A382-V454 VanDerWaalsContact N-O 3.13Å; A382-V454 PolarHBondContact O-N 2.98Å; V394-V454 HydrophobicContact CB-CB 4.21Å; V394-V454 HydrophobicContact CB-CG2 3.92Å; F396-V454 HydrophobicContact CE2-CB 4.22Å; F396-V454 HydrophobicContact CE2-CG1 3.92Å; F396-V454 HydrophobicContact CZ-CB 4.45Å; F396-V454 WeakPolarHBondContact CZ-O 3.33Å; Y434-V454 HydrophobicContact CD1-CG1 4.17Å; Y434-V454 HydrophobicContact CE1-CG1 3.98Å
455	Y	87.2	Confident	69.6	Low	134 Å²	134	80 Å²	80	53%	0.525	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	140.1	-178.9	-66.7	-90.3	0	0	0	111.8	Y434 P435 T453	Y434-Y455 WeakPolarHBondContact CD1-O 3.45Å; P435-Y455 WeakPolarHBondContact CD-O 3.14Å; T453-Y455 HydrophobicContact CG2-CE2 4.1Å
456	G	88.3	Confident	71.5	Confident	1 Å²	1	82.3 Å²	82.3	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152	175.2	0	0	0	0	0	111.9	F380	F380-G456 WeakPolarHBondContact CD1-O 3.27Å; F380-G456 PolarHBondContact N-O 2.98Å; F380-G456 PolarHBondContact O-N 3.1Å; F380-G456 VanDerWaalsContact O-O 3.1Å
457	R	91.5	Very high	73.6	Confident	76 Å²	76	79 Å²	79	29%	0.287	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.9	174.6	-63.3	-176.9	159.2	148.4	2.4	109.2	I376 E379 I432 E433 I459	I376-R457 HydrophobicContact CG2-CB 4.41Å; E379-R457 HydrophobicContact CG-CG 4.23Å; E379-R457 IonicContact OE1-CZ 2.84Å; E379-R457 IonicContact OE1-NE 2.71Å; E379-R457 PolarHBondContact OE1-NE 3.13Å; E379-R457 IonicContact OE1-NH2 3.21Å; E379-R457 PolarHBondContact OE1-NH2 3.37Å; I432-R457 CarbonylContact C-O 3.59Å; I432-R457 VanDerWaalsContact CA-O 3.32Å; I432-R457 WeakPolarHBondContact CA-O 3.35Å; E433-R457 HydrophobicContact CB-CB 4.43Å; E433-R457 PolarHBondContact N-O 2.82Å; E433-R457 WeakPolarHBondContact O-CB 3.42Å; E433-R457 PolarHBondContact O-N 3.01Å; R457-I459 HydrophobicContact CB-CG2 4.3Å; R457-I459 PolarHBondContact O-N 3.34Å
458	L	93.7	Very high	75.5	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.2	168.3	-173	71.4	0	0	0	108.1	I377 F378 F380 I398 F430 F514 I516 V532 I534	I377-L458 HydrophobicContact CB-CD2 4.42Å; I377-L458 HydrophobicContact CD1-CD2 4.06Å; I377-L458 HydrophobicContact CD1-CG 4.19Å; I377-L458 PolarHBondContact N-O 2.66Å; F378-L458 HydrophobicContact CD1-CB 4.49Å; F378-L458 HydrophobicContact CD1-CD2 4.23Å; F378-L458 HydrophobicContact CD2-CB 4.47Å; F378-L458 HydrophobicContact CE1-CB 4.2Å; F378-L458 HydrophobicContact CE1-CD2 3.43Å; F378-L458 VanDerWaalsContact CE1-CD2 3.43Å; F378-L458 HydrophobicContact CE1-CG 4.46Å; F378-L458 HydrophobicContact CE2-CB 4.17Å; F378-L458 HydrophobicContact CZ-CB 4.02Å; F378-L458 HydrophobicContact CZ-CD2 3.63Å; F378-L458 HydrophobicContact CZ-CG 4.44Å; F378-L458 PolarHBondContact O-N 3.47Å; F380-L458 HydrophobicContact CE1-CB 4.15Å; I398-L458 HydrophobicContact CD1-CD1 3.94Å; F430-L458 HydrophobicContact CB-CD1 3.82Å; F430-L458 HydrophobicContact CG-CD1 4.27Å; L458-F514 HydrophobicContact CD1-CZ 4.32Å; L458-F514 HydrophobicContact CD2-CZ 3.94Å; L458-I516 HydrophobicContact CD1-CD1 4.24Å; L458-V532 HydrophobicContact CD2-CG1 4.21Å; L458-I534 HydrophobicContact CD2-CD1 4.19Å
459	I	92	Very high	77.3	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	153.6	176.9	68.3	154	0	0	0	111.7	H375 I376 F430 S431 E433 R457 K461 R462	H375-I459 CarbonylContact O-C 3.5Å; H375-I459 WeakPolarHBondContact O-CA 3.05Å; H375-I459 WeakPolarHBondContact O-CB 3.32Å; I376-I459 HydrophobicContact CB-CG2 4.47Å; I376-I459 HydrophobicContact CG1-CG2 3.96Å; F430-I459 WeakPolarHBondContact CA-O 3.2Å; S431-I459 PolarHBondContact N-O 2.98Å; S431-I459 VanDerWaalsContact O-CG1 3.3Å; S431-I459 WeakPolarHBondContact O-CG1 3.4Å; S431-I459 PolarHBondContact O-N 3.33Å; S431-I459 WeakPolarHBondContact OG-CD1 3.03Å; S431-I459 VanDerWaalsContact OG-CG1 3.32Å; S431-I459 WeakPolarHBondContact OG-CG1 3.38Å; E433-I459 VanDerWaalsContact CD-CD1 3.44Å; E433-I459 HydrophobicContact CG-CD1 3.7Å; E433-I459 HydrophobicContact CG-CG1 4.1Å; E433-I459 HydrophobicContact CG-CG2 4.48Å; E433-I459 WeakPolarHBondContact OE1-CD1 3.26Å; R457-I459 HydrophobicContact CB-CG2 4.3Å; R457-I459 PolarHBondContact O-N 3.34Å; I459-K461 PolarHBondContact O-N 3.5Å; I459-R462 HydrophobicContact CD1-CG 4.05Å
460	I	90.4	Very high	79	Confident	2 Å²	2	70 Å²	70	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	127.5	158.5	-56.9	-177.2	0	0	0	107.3	I367 D371 G374 H375 I377 F430 I468	I367-I460 HydrophobicContact CB-CD1 4.35Å; I367-I460 HydrophobicContact CD1-CD1 4.47Å; I367-I460 HydrophobicContact CG2-CD1 4.17Å; I367-I460 HydrophobicContact CG2-CG1 4.47Å; D371-I460 HydrophobicContact CB-CD1 3.44Å; D371-I460 VanDerWaalsContact CB-CD1 3.44Å; G374-I460 WeakPolarHBondContact CA-O 3.34Å; G374-I460 PolarHBondContact N-O 3.48Å; H375-I460 HydrophobicContact CB-CD1 4.01Å; H375-I460 HydrophobicContact CB-CG1 4.23Å; H375-I460 PolarHBondContact O-N 3.49Å; I377-I460 HydrophobicContact CD1-CG1 4.06Å; I377-I460 HydrophobicContact CG1-CG1 4.32Å; F430-I460 HydrophobicContact CE1-CG1 4.48Å; I460-I468 HydrophobicContact CG2-CD1 4.07Å; I460-I468 HydrophobicContact CG2-CG1 4.31Å; I460-I468 HydrophobicContact CG2-CG2 3.97Å
461	K	88.9	Confident	80.4	Confident	53 Å²	53	62.5 Å²	62.5	23%	0.23	29%	0.293	C	S	.	.			trans	-61.8	137.3	-171.3	-162.6	173.8	-169.7	174.4	0	110.9	A427 E428 L429 I459 Q463	A427-K461 PolarHBondContact O-NZ 2.96Å; E428-K461 WeakPolarHBondContact O-CD 3.36Å; E428-K461 PolarHBondContact O-NZ 3.15Å; L429-K461 WeakPolarHBondContact O-CB 3.48Å; L429-K461 PolarHBondContact O-N 2.93Å; I459-K461 PolarHBondContact O-N 3.5Å; K461-Q463 VanDerWaalsContact C-N 3.31Å; K461-Q463 HydrophobicContact CB-CG 4.43Å; K461-Q463 HydrophobicContact CG-CG 4.19Å; K461-Q463 PolarHBondContact O-N 3.06Å
462	R	87.8	Confident	81.5	Confident	151 Å²	151	56 Å²	56	57%	0.57	26%	0.259	S	S	*	.	S	Bend	trans	-72.1	81.9	-176.6	-61.4	-173.8	-168.2	-83.5	-4.6	111.3	E433 I459	E433-R462 IonicContact OE1-CZ 3.7Å; E433-R462 VanDerWaalsContact OE1-CZ 3.23Å; E433-R462 IonicContact OE1-NE 3.16Å; E433-R462 PolarHBondContact OE1-NE 3.36Å; E433-R462 IonicContact OE1-NH2 3.81Å; E433-R462 PolarHBondContact OE1-NH2 3.25Å; E433-R462 IonicContact OE2-CZ 2.66Å; E433-R462 IonicContact OE2-NH2 3.7Å; E433-R462 PolarHBondContact OE2-NH2 3.41Å; I459-R462 HydrophobicContact CD1-CG 4.05Å
463	Q	81.7	Confident	81.8	Confident	75 Å²	75	57 Å²	57	35%	0.35	27%	0.266	S	S	.	.			trans	-124.8	179.6	178.2	-59.5	-164.6	-3.6	0	0	111.1	K461 K467 I468	K461-Q463 VanDerWaalsContact C-N 3.31Å; K461-Q463 HydrophobicContact CB-CG 4.43Å; K461-Q463 HydrophobicContact CG-CG 4.19Å; K461-Q463 PolarHBondContact O-N 3.06Å; Q463-K467 HydrophobicContact CB-CB 4.21Å; Q463-K467 VanDerWaalsContact OE1-CB 3.32Å; Q463-I468 HydrophobicContact CB-CG1 4.3Å
464	S	81.1	Confident	81.6	Confident	57 Å²	57	58.9 Å²	58.9	40%	0.399	27%	0.271	S	S	.	.			trans	-74.6	156.9	172.9	73.4	0	0	0	0	111.1	E466 K467 I468	S464-E466 WeakPolarHBondContact CB-OE2 3.41Å; S464-E466 PolarHBondContact O-N 3.35Å; S464-E466 PolarHBondContact OG-OE2 3.27Å; S464-K467 PolarHBondContact O-N 2.93Å; S464-K467 VanDerWaalsContact O-N 3.14Å; S464-I468 PolarHBondContact O-N 3.04Å
465	K	75.1	Confident	81.2	Confident	99 Å²	99	57.1 Å²	57.1	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-58.3	-39.8	-172	-161.7	-156.5	179.6	-137.2	0	111.9	N370 K467 I468 Q469	N370-K465 WeakPolarHBondContact OD1-CE 3.45Å; N370-K465 PolarHBondContact OD1-NZ 3.33Å; K465-K467 VanDerWaalsContact C-N 3.29Å; K465-K467 PolarHBondContact O-N 3.19Å; K465-I468 PolarHBondContact O-N 2.79Å; K465-I468 VanDerWaalsContact O-N 3.13Å; K465-Q469 PolarHBondContact O-N 2.94Å
466	E	74.1	Confident	80.3	Confident	115 Å²	115	51.3 Å²	51.3	54%	0.537	24%	0.238	S	C	.	.	H	α-helix	trans	-63.3	-36.4	-177	-43.8	73.7	-159.8	0	0	111.2	S464 Q470	S464-E466 WeakPolarHBondContact CB-OE2 3.41Å; S464-E466 PolarHBondContact O-N 3.35Å; S464-E466 PolarHBondContact OG-OE2 3.27Å; E466-Q470 WeakPolarHBondContact O-CB 3.5Å; E466-Q470 WeakPolarHBondContact O-CG 3.37Å; E466-Q470 PolarHBondContact O-N 2.79Å
467	K	77.5	Confident	79.3	Confident	118 Å²	118	53.6 Å²	53.6	51%	0.513	25%	0.254	S	S	.	.	H	α-helix	trans	-73.5	-34.6	176.2	-68	-168.5	174.9	-169.1	0	112.7	Q463 S464 K465 A471	Q463-K467 HydrophobicContact CB-CB 4.21Å; Q463-K467 VanDerWaalsContact OE1-CB 3.32Å; S464-K467 PolarHBondContact O-N 2.93Å; S464-K467 VanDerWaalsContact O-N 3.14Å; K465-K467 VanDerWaalsContact C-N 3.29Å; K465-K467 PolarHBondContact O-N 3.19Å; K467-A471 WeakPolarHBondContact O-CB 3.48Å; K467-A471 PolarHBondContact O-N 3.45Å
468	I	78.5	Confident	78.1	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-49.7	175.8	-64.1	170.1	0	0	0	109.1	G373 L429 I460 Q463 S464 K465 Q470 A471 T472	G373-I468 VanDerWaalsContact CA-CD1 3.46Å; L429-I468 HydrophobicContact CD1-CG2 4.28Å; I460-I468 HydrophobicContact CG2-CD1 4.07Å; I460-I468 HydrophobicContact CG2-CG1 4.31Å; I460-I468 HydrophobicContact CG2-CG2 3.97Å; Q463-I468 HydrophobicContact CB-CG1 4.3Å; S464-I468 PolarHBondContact O-N 3.04Å; K465-I468 PolarHBondContact O-N 2.79Å; K465-I468 VanDerWaalsContact O-N 3.13Å; I468-Q470 PolarHBondContact O-N 3.24Å; I468-A471 PolarHBondContact O-N 3.39Å; I468-A471 VanDerWaalsContact O-N 3.13Å; I468-T472 WeakPolarHBondContact O-CB 3.18Å; I468-T472 PolarHBondContact O-N 3.42Å; I468-T472 PolarHBondContact O-OG1 2.71Å
469	Q	72.2	Confident	76.7	Confident	43 Å²	43	50.4 Å²	50.4	20%	0.201	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-43.4	174.8	-69.5	177.3	-81.7	0	0	112	E369 K465 A471 T472 S473 D541	E369-Q469 HydrophobicContact CG-CG 4.2Å; E369-Q469 WeakPolarHBondContact OE1-CA 3.38Å; K465-Q469 PolarHBondContact O-N 2.94Å; Q469-A471 VanDerWaalsContact C-N 3.3Å; Q469-A471 PolarHBondContact O-N 2.86Å; Q469-T472 PolarHBondContact O-N 2.94Å; Q469-S473 WeakPolarHBondContact O-CB 3.49Å; Q469-S473 PolarHBondContact O-N 2.7Å; Q469-S473 PolarHBondContact O-OG 3.44Å; Q469-D541 PolarHBondContact NE2-OD2 2.81Å
470	Q	73.8	Confident	75.2	Confident	134 Å²	134	53.3 Å²	53.3	63%	0.626	25%	0.254	S	S	*	.	H	α-helix	trans	-61.1	-34.6	174.4	-77.4	172.4	2.1	0	0	113.7	E466 I468 S473 K474	E466-Q470 WeakPolarHBondContact O-CB 3.5Å; E466-Q470 WeakPolarHBondContact O-CG 3.37Å; E466-Q470 PolarHBondContact O-N 2.79Å; I468-Q470 PolarHBondContact O-N 3.24Å; Q470-S473 PolarHBondContact O-OG 2.98Å; Q470-K474 WeakPolarHBondContact O-CB 3.3Å; Q470-K474 PolarHBondContact O-N 2.95Å
471	A	76.4	Confident	73.6	Confident	6 Å²	6	57.1 Å²	57.1	5%	0.05	27%	0.272	C	S	.	.	H	α-helix	trans	-79.6	-31.9	176.3	0	0	0	0	0	112.6	E428 L429 K467 I468 Q469 A475	E428-A471 HydrophobicContact CG-CB 4.44Å; L429-A471 HydrophobicContact CB-CB 4.1Å; L429-A471 HydrophobicContact CD1-CB 3.85Å; L429-A471 HydrophobicContact CG-CB 4.5Å; K467-A471 WeakPolarHBondContact O-CB 3.48Å; K467-A471 PolarHBondContact O-N 3.45Å; I468-A471 PolarHBondContact O-N 3.39Å; I468-A471 VanDerWaalsContact O-N 3.13Å; Q469-A471 VanDerWaalsContact C-N 3.3Å; Q469-A471 PolarHBondContact O-N 2.86Å; A471-A475 WeakPolarHBondContact O-CB 3.42Å; A471-A475 PolarHBondContact O-N 2.97Å
472	T	76.5	Confident	72	Confident	2 Å²	2	58 Å²	58	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-76.5	-51.1	179	-56.7	0	0	0	0	112.4	E369 I468 Q469 K474 A475 I476 I536	E369-T472 HydrophobicContact CB-CG2 3.73Å; E369-T472 HydrophobicContact CG-CG2 3.79Å; I468-T472 WeakPolarHBondContact O-CB 3.18Å; I468-T472 PolarHBondContact O-N 3.42Å; I468-T472 PolarHBondContact O-OG1 2.71Å; Q469-T472 PolarHBondContact O-N 2.94Å; T472-K474 PolarHBondContact O-N 3.21Å; T472-A475 CarbonylContact O-C 3.49Å; T472-A475 WeakPolarHBondContact O-CA 3.13Å; T472-A475 VanDerWaalsContact O-CB 3.25Å; T472-A475 WeakPolarHBondContact O-CB 3.23Å; T472-A475 PolarHBondContact O-N 3.13Å; T472-I476 HydrophobicContact CG2-CD1 4.21Å; T472-I476 WeakPolarHBondContact O-CG1 3.37Å; T472-I476 PolarHBondContact O-N 2.93Å; T472-I536 HydrophobicContact CG2-CD1 4.35Å; T472-I536 HydrophobicContact CG2-CG2 3.52Å
473	S	71	Confident	70.1	Confident	48 Å²	48	54.8 Å²	54.8	34%	0.336	27%	0.271	S	S	.	.	H	α-helix	trans	-54	-39.2	171.8	54.5	0	0	0	0	112.5	E369 Q469 Q470 I476 S477	E369-S473 PolarHBondContact OE1-N 3.35Å; Q469-S473 WeakPolarHBondContact O-CB 3.49Å; Q469-S473 PolarHBondContact O-N 2.7Å; Q469-S473 PolarHBondContact O-OG 3.44Å; Q470-S473 PolarHBondContact O-OG 2.98Å; S473-I476 PolarHBondContact O-N 2.96Å; S473-S477 PolarHBondContact O-N 2.79Å
474	K	73	Confident	68.1	Low	78 Å²	78	52.5 Å²	52.5	34%	0.339	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-46.9	169.4	-177	-177.4	177.5	-172.8	0	112	I425 E428 Q470 T472 I476 S477 I478	I425-K474 HydrophobicContact CD1-CG 4.32Å; I425-K474 HydrophobicContact CG1-CD 4.33Å; I425-K474 HydrophobicContact CG1-CG 4.23Å; E428-K474 IonicContact OE1-NZ 3.49Å; E428-K474 IonicContact OE2-NZ 2.73Å; E428-K474 PolarHBondContact OE2-NZ 2.84Å; Q470-K474 WeakPolarHBondContact O-CB 3.3Å; Q470-K474 PolarHBondContact O-N 2.95Å; T472-K474 PolarHBondContact O-N 3.21Å; K474-I476 PolarHBondContact O-N 3Å; K474-S477 PolarHBondContact O-N 2.72Å; K474-S477 PolarHBondContact O-OG 3.24Å; K474-I478 HydrophobicContact CG-CD1 4.01Å; K474-I478 PolarHBondContact O-N 3.37Å
475	A	74.2	Confident	66.1	Low	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-45.7	175.2	0	0	0	0	0	112.8	I425 L429 A471 T472 I478 A479 L512 I536	I425-A475 HydrophobicContact CG2-CB 3.69Å; L429-A475 HydrophobicContact CD2-CB 4.38Å; A471-A475 WeakPolarHBondContact O-CB 3.42Å; A471-A475 PolarHBondContact O-N 2.97Å; T472-A475 CarbonylContact O-C 3.49Å; T472-A475 WeakPolarHBondContact O-CA 3.13Å; T472-A475 VanDerWaalsContact O-CB 3.25Å; T472-A475 WeakPolarHBondContact O-CB 3.23Å; T472-A475 PolarHBondContact O-N 3.13Å; A475-I478 PolarHBondContact O-N 3.21Å; A475-A479 WeakPolarHBondContact O-CB 3.5Å; A475-A479 PolarHBondContact O-N 3.24Å; A475-L512 HydrophobicContact CB-CD1 4.4Å; A475-L512 HydrophobicContact CB-CD2 4.14Å; A475-I536 HydrophobicContact CB-CD1 3.57Å
476	I	69.4	Low	64.3	Low	12 Å²	12	53 Å²	53	6%	0.062	28%	0.281	C	S	.	.	H	α-helix	trans	-58.9	-47.7	175.7	-67.7	170.2	0	0	0	110.2	E369 T472 S473 K474 I478 A479 R480 I536	E369-I476 VanDerWaalsContact OE2-CD1 3.28Å; E369-I476 WeakPolarHBondContact OE2-CD1 3.39Å; T472-I476 HydrophobicContact CG2-CD1 4.21Å; T472-I476 WeakPolarHBondContact O-CG1 3.37Å; T472-I476 PolarHBondContact O-N 2.93Å; S473-I476 PolarHBondContact O-N 2.96Å; K474-I476 PolarHBondContact O-N 3Å; I476-I478 PolarHBondContact O-N 3.28Å; I476-A479 PolarHBondContact O-N 3.24Å; I476-R480 WeakPolarHBondContact O-CG 3.47Å; I476-R480 PolarHBondContact O-N 3.15Å; I476-R480 VanDerWaalsContact O-N 3.14Å; I476-I536 HydrophobicContact CD1-CG2 3.86Å; I476-I536 HydrophobicContact CG1-CB 4.26Å; I476-I536 HydrophobicContact CG1-CD1 4.3Å; I476-I536 HydrophobicContact CG1-CG2 3.84Å
477	S	65.7	Low	62.2	Low	48 Å²	48	51.3 Å²	51.3	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-58.6	-33.1	-179.7	80.4	0	0	0	0	113.5	S473 K474 Q481	S473-S477 PolarHBondContact O-N 2.79Å; K474-S477 PolarHBondContact O-N 2.72Å; K474-S477 PolarHBondContact O-OG 3.24Å; S477-Q481 WeakPolarHBondContact O-CG 3.32Å; S477-Q481 PolarHBondContact O-N 2.84Å
478	I	66.7	Low	59.9	Low	5 Å²	5	50.3 Å²	50.3	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-96.7	-25.8	-175.7	-74.3	144.8	0	0	0	112.3	E421 I425 K474 A475 I476 R480 Q481 N482	E421-I478 HydrophobicContact CB-CG2 3.96Å; E421-I478 VanDerWaalsContact CD-CD1 3.46Å; E421-I478 HydrophobicContact CG-CD1 3.86Å; E421-I478 HydrophobicContact CG-CG1 4.29Å; E421-I478 HydrophobicContact CG-CG2 4.07Å; E421-I478 VanDerWaalsContact OE1-CD1 3.3Å; E421-I478 WeakPolarHBondContact OE1-CD1 3.3Å; I425-I478 HydrophobicContact CD1-CB 3.66Å; I425-I478 HydrophobicContact CD1-CD1 3.5Å; I425-I478 VanDerWaalsContact CD1-CD1 3.5Å; I425-I478 HydrophobicContact CD1-CG1 4.15Å; I425-I478 HydrophobicContact CD1-CG2 3.73Å; I425-I478 HydrophobicContact CG1-CD1 4.42Å; K474-I478 HydrophobicContact CG-CD1 4.01Å; K474-I478 PolarHBondContact O-N 3.37Å; A475-I478 PolarHBondContact O-N 3.21Å; I476-I478 PolarHBondContact O-N 3.28Å; I478-R480 PolarHBondContact O-N 3.47Å; I478-Q481 PolarHBondContact O-N 3.4Å; I478-N482 PolarHBondContact O-N 3.47Å; I478-N482 PolarHBondContact O-ND2 3.5Å
479	A	64.5	Low	57.5	Low	5 Å²	5	59.6 Å²	59.6	4%	0.041	34%	0.342	C	S	.	.	H	α-helix	trans	-55.5	-41.1	162.5	0	0	0	0	0	111.1	A475 I476 Q483 Q511	A475-A479 WeakPolarHBondContact O-CB 3.5Å; A475-A479 PolarHBondContact O-N 3.24Å; I476-A479 PolarHBondContact O-N 3.24Å; A479-Q483 PolarHBondContact O-NE2 3.34Å; A479-Q511 VanDerWaalsContact CB-O 3.26Å; A479-Q511 WeakPolarHBondContact CB-O 3.3Å
480	R	61	Low	55.5	Low	60 Å²	60	65.8 Å²	65.8	23%	0.226	38%	0.375	C	S	.	.	H	α-helix	trans	-71	-48.1	177.1	-68.7	169	-179.5	-134.9	-12	112.9	I476 I478 N482 Q483 D510 S593	I476-R480 WeakPolarHBondContact O-CG 3.47Å; I476-R480 PolarHBondContact O-N 3.15Å; I476-R480 VanDerWaalsContact O-N 3.14Å; I478-R480 PolarHBondContact O-N 3.47Å; R480-N482 VanDerWaalsContact C-N 3.31Å; R480-N482 PolarHBondContact O-N 3.27Å; R480-Q483 PolarHBondContact O-N 2.96Å; R480-D510 IonicContact CZ-OD1 3.08Å; R480-D510 IonicContact NE-OD1 2.68Å; R480-D510 PolarHBondContact NE-OD1 3.04Å; R480-D510 VanDerWaalsContact NH2-CG 3.29Å; R480-D510 IonicContact NH2-OD1 3.02Å; R480-D510 PolarHBondContact NH2-OD1 2.93Å; R480-D510 IonicContact NH2-OD2 3.61Å; R480-D510 PolarHBondContact NH2-OD2 3.34Å; R480-S593 PolarHBondContact NH1-O 3.31Å; R480-S593 PolarHBondContact NH2-O 3.39Å; R480-S593 PolarHBondContact NH2-OG 2.86Å
481	Q	56.9	Low	53.4	Low	83 Å²	83	62.4 Å²	62.4	39%	0.388	38%	0.377	S	S	.	.	H	α-helix	trans	-57.3	-40.4	179.6	-75.5	177.1	49.8	0	0	113.5	S477 I478 Q483 I484	S477-Q481 WeakPolarHBondContact O-CG 3.32Å; S477-Q481 PolarHBondContact O-N 2.84Å; I478-Q481 PolarHBondContact O-N 3.4Å; Q481-Q483 PolarHBondContact O-N 2.95Å; Q481-I484 PolarHBondContact O-N 3.48Å
482	N	55	Low	51.1	Low	72 Å²	72	67.5 Å²	67.5	39%	0.385	41%	0.412	S	S	.	.	H	α-helix	trans	-67.8	-18.7	-176.6	-76.7	-55.1	0	0	0	114.5	S422 I478 R480 I484 S486	S422-N482 PolarHBondContact OG-ND2 3.13Å; S422-N482 VanDerWaalsContact OG-ND2 3.13Å; I478-N482 PolarHBondContact O-N 3.47Å; I478-N482 PolarHBondContact O-ND2 3.5Å; R480-N482 VanDerWaalsContact C-N 3.31Å; R480-N482 PolarHBondContact O-N 3.27Å; N482-I484 VanDerWaalsContact C-N 3.31Å; N482-I484 PolarHBondContact O-N 3.3Å; N482-S486 PolarHBondContact O-OG 2.92Å
483	Q	47.7	Very low	48.9	Very low	82 Å²	82	71.5 Å²	71.5	38%	0.383	43%	0.433	S	S	.	.	H	α-helix	trans	-70	-30.5	178.3	-71.1	161	45.3	0	0	111.9	A479 R480 Q481 A485 S486 N509	A479-Q483 PolarHBondContact O-NE2 3.34Å; R480-Q483 PolarHBondContact O-N 2.96Å; Q481-Q483 PolarHBondContact O-N 2.95Å; Q483-A485 VanDerWaalsContact C-N 3.33Å; Q483-A485 PolarHBondContact O-N 3.14Å; Q483-S486 PolarHBondContact O-N 3.24Å; Q483-N509 PolarHBondContact NE2-O 2.9Å
484	I	40.3	Very low	47.2	Very low	27 Å²	27	75.9 Å²	75.9	14%	0.138	45%	0.447	C	S	.	.	H	α-helix	trans	-79.1	-19.4	-175.5	-48.4	-173.3	0	0	0	111.8	Q481 N482 W650 Q653 N654	Q481-I484 PolarHBondContact O-N 3.48Å; N482-I484 VanDerWaalsContact C-N 3.31Å; N482-I484 PolarHBondContact O-N 3.3Å; I484-W650 HydrophobicContact CD1-CB 4.49Å; I484-W650 HydrophobicContact CD1-CG 4.38Å; I484-W650 HydrophobicContact CG2-CB 4.39Å; I484-Q653 HydrophobicContact CD1-CB 3.79Å; I484-N654 WeakPolarHBondContact CD1-ND2 3.47Å
485	A	39.5	Very low	45.1	Very low	62 Å²	62	80.2 Å²	80.2	51%	0.512	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-9.5	175.1	0	0	0	0	0	114	Q483 G487	Q483-A485 VanDerWaalsContact C-N 3.33Å; Q483-A485 PolarHBondContact O-N 3.14Å; A485-G487 PolarHBondContact O-N 2.58Å
486	S	36.6	Very low	43.2	Very low	106 Å²	106	85.8 Å²	85.8	74%	0.741	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	33.4	-171.4	-66.8	0	0	0	0	115	N482 Q483	N482-S486 PolarHBondContact O-OG 2.92Å; Q483-S486 PolarHBondContact O-N 3.24Å
487	G	30.3	Very low	41.3	Very low	79 Å²	79	91.6 Å²	91.6	81%	0.814	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-13.8	167.4	0	0	0	0	0	114.3	A485	A485-G487 PolarHBondContact O-N 2.58Å
488	S	28.9	Very low	39.4	Very low	97 Å²	97	97.8 Å²	97.8	68%	0.678	55%	0.547	S	S	*	.	S	Bend	trans	-142.8	97.3	-170.8	56.2	0	0	0	0	113.7
489	K	27.8	Very low	37.6	Very low	202 Å²	202	102.4 Å²	102.4	88%	0.878	58%	0.58	S	S	*	*			trans	39.5	83	162.4	-65.7	-174.8	176.3	-175.7	0	115.9	G491	K489-G491 PolarHBondContact O-N 3.13Å
490	L	30.6	Very low	36.1	Very low	173 Å²	173	107.2 Å²	107.2	91%	0.906	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-57.9	131	135.8	-159.3	74.9	0	0	0	106.5	S492	L490-S492 PolarHBondContact O-N 3.23Å
491	G	29.4	Very low	34.7	Very low	64 Å²	64	111.4 Å²	111.4	66%	0.66	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-55.4	139.2	-169.8	0	0	0	0	0	112.5	K489 N493	K489-G491 PolarHBondContact O-N 3.13Å; G491-N493 PolarHBondContact O-N 3.34Å
492	S	28.2	Very low	33.3	Very low	112 Å²	112	114.9 Å²	114.9	78%	0.783	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	125.3	173	44.5	0	0	0	0	110.1	L490	L490-S492 PolarHBondContact O-N 3.23Å
493	N	31.3	Very low	32	Very low	87 Å²	87	119.2 Å²	119.2	47%	0.465	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	165.6	0.1	152.4	-81	-1.6	0	0	0	113	D218 G491	D218-N493 WeakPolarHBondContact CB-OD1 3.28Å; G491-N493 PolarHBondContact O-N 3.34Å
494	F	34.1	Very low	31.2	Very low	140 Å²	140	123.9 Å²	123.9	61%	0.614	70%	0.697	S	S	*	*			trans	-101.4	88.8	167.7	-88.7	-83.8	0	0	0	112.4	L496 F515 P531	F494-L496 PolarHBondContact O-N 2.96Å; F494-F515 HydrophobicContact CE1-CE1 4.39Å; F494-F515 AromaticContact CE2-CE1 3.93Å; F494-F515 HydrophobicContact CE2-CE1 3.93Å; F494-F515 HydrophobicContact CE2-CZ 4.16Å; F494-F515 AromaticContact CZ-CE1 3.65Å; F494-F515 HydrophobicContact CZ-CE1 3.65Å; F494-F515 HydrophobicContact CZ-CZ 4.33Å; F494-P531 HydrophobicContact CE1-CG 3.79Å; F494-P531 HydrophobicContact CZ-CG 4.33Å
495	H	30	Very low	30.7	Very low	168 Å²	168	129 Å²	129	78%	0.778	72%	0.724	S	S	*	*			trans	-85.8	79.7	170.4	-109.3	-61.8	0	0	0	110.8	H497	H495-H497 PolarHBondContact O-N 3.24Å
496	L	32.3	Very low	30.2	Very low	118 Å²	118	131.1 Å²	131.1	62%	0.618	73%	0.732	S	S	*	*			trans	-72.1	90.3	173.2	-162.2	79.6	0	0	0	110	F362 F494 Q498	F362-L496 HydrophobicContact CD1-CD1 4.23Å; F362-L496 HydrophobicContact CE1-CD1 4.38Å; F494-L496 PolarHBondContact O-N 2.96Å; L496-Q498 PolarHBondContact O-N 3.44Å
497	H	30.1	Very low	29.9	Very low	133 Å²	133	131.3 Å²	131.3	62%	0.616	73%	0.734	S	S	*	*			trans	-86	93.6	-165.5	-134.3	-68	0	0	0	113	H495	H495-H497 PolarHBondContact O-N 3.24Å
498	Q	26.9	Very low	30.7	Very low	178 Å²	178	132 Å²	132	83%	0.832	72%	0.719	S	S	*	*	S	Bend	trans	45.1	75.1	152.5	-62	178.6	-46.2	0	0	117.6	L496	L496-Q498 PolarHBondContact O-N 3.44Å
499	S	28	Very low	31.8	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	71%	0.707	S	S	*	*			trans	-142.4	-17	168.2	64.4	0	0	0	0	116.4	N501	S499-N501 PolarHBondContact O-N 3.31Å
500	I	34.2	Very low	33.6	Very low	105 Å²	105	122 Å²	122	54%	0.538	67%	0.667	S	S	.	*	S	Bend	trans	-75.5	117.1	174.1	-57.9	178.7	0	0	0	109.1	N502	I500-N502 PolarHBondContact O-N 2.82Å
501	N	29.8	Very low	35.7	Very low	148 Å²	148	116.6 Å²	116.6	79%	0.791	64%	0.637	S	S	*	*			trans	-66	121.3	175.8	-89.7	-40.5	0	0	0	110.8	S499 N503	S499-N501 PolarHBondContact O-N 3.31Å; N501-N503 VanDerWaalsContact C-N 3.33Å; N501-N503 PolarHBondContact O-N 3.13Å
502	N	27.7	Very low	38.2	Very low	156 Å²	156	113.6 Å²	113.6	83%	0.834	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	84.4	173.3	-68.5	-37.7	0	0	0	110.9	I500	I500-N502 PolarHBondContact O-N 2.82Å
503	N	29.2	Very low	40.8	Very low	163 Å²	163	112.5 Å²	112.5	87%	0.872	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.1	-1.2	166.9	-100	-25.8	0	0	0	116.2	N501	N501-N503 VanDerWaalsContact C-N 3.33Å; N501-N503 PolarHBondContact O-N 3.13Å
504	E	29.9	Very low	43.6	Very low	180 Å²	180	108.5 Å²	108.5	84%	0.841	57%	0.567	S	S	*	*	S	Bend	trans	-143	21.7	-166.6	-137.3	164.4	-123.1	0	0	116.9
505	L	29.3	Very low	46.2	Very low	135 Å²	135	105 Å²	105	71%	0.707	55%	0.551	S	S	*	*			trans	-108.9	120	167.3	-109.5	75.6	0	0	0	110.9
506	P	28.7	Very low	49.2	Very low	106 Å²	106	97 Å²	97	69%	0.688	51%	0.514	S	S	*	.			trans	-66.2	140.7	167.8	-18.7	32.1	0	0	0	111.3	N508	P506-N508 PolarHBondContact O-N 2.7Å
507	S	31	Very low	52	Low	111 Å²	111	91.8 Å²	91.8	78%	0.776	49%	0.487	S	S	*	.			trans	-81.6	59.3	178.2	59	0	0	0	0	112.5
508	N	46.5	Very low	54.8	Low	94 Å²	94	85.5 Å²	85.5	50%	0.503	46%	0.458	S	S	.	.			trans	-106.5	146.7	169.9	-89	20.3	0	0	0	110.9	P506 D510	P506-N508 PolarHBondContact O-N 2.7Å; N508-D510 PolarHBondContact O-N 2.99Å
509	N	52.7	Low	57.8	Low	81 Å²	81	79.5 Å²	79.5	43%	0.433	43%	0.428	S	S	.	.			trans	-102	26.4	-146.8	-64.8	-21	0	0	0	113.9	Q483	Q483-N509 PolarHBondContact NE2-O 2.9Å
510	D	66.4	Low	60.5	Low	6 Å²	6	74.7 Å²	74.7	3%	0.032	39%	0.394	C	S	.	.			trans	-119.8	50.1	-161.5	-56	-61.4	0	0	0	112.3	R480 N508 I536	R480-D510 IonicContact CZ-OD1 3.08Å; R480-D510 IonicContact NE-OD1 2.68Å; R480-D510 PolarHBondContact NE-OD1 3.04Å; R480-D510 VanDerWaalsContact NH2-CG 3.29Å; R480-D510 IonicContact NH2-OD1 3.02Å; R480-D510 PolarHBondContact NH2-OD1 2.93Å; R480-D510 IonicContact NH2-OD2 3.61Å; R480-D510 PolarHBondContact NH2-OD2 3.34Å; N508-D510 PolarHBondContact O-N 2.99Å; D510-I536 WeakPolarHBondContact CB-O 3.21Å; D510-I536 PolarHBondContact O-N 3.39Å
511	Q	73.8	Confident	62.7	Low	61 Å²	61	72.2 Å²	72.2	29%	0.285	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.1	178.5	-61.5	-176.7	14.2	0	0	112	A479 H513 I533 I534 L535	A479-Q511 VanDerWaalsContact CB-O 3.26Å; A479-Q511 WeakPolarHBondContact CB-O 3.3Å; Q511-H513 PolarHBondContact OE1-NE2 3.03Å; Q511-I533 HydrophobicContact CB-CG2 4.36Å; Q511-I534 CarbonylContact C-O 3.56Å; Q511-I534 WeakPolarHBondContact CA-O 3.35Å; Q511-L535 HydrophobicContact CG-CD1 4.07Å
512	L	82.4	Confident	64.8	Low	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.1	170.5	-177.4	68.3	0	0	0	110	F430 A475 F514 I534 I536	F430-L512 HydrophobicContact CE2-CD2 3.77Å; F430-L512 HydrophobicContact CZ-CD2 4.27Å; A475-L512 HydrophobicContact CB-CD1 4.4Å; A475-L512 HydrophobicContact CB-CD2 4.14Å; L512-F514 HydrophobicContact CG-CD1 4.42Å; L512-I534 PolarHBondContact N-O 2.97Å; L512-I534 PolarHBondContact O-N 2.97Å; L512-I536 HydrophobicContact CB-CD1 4.23Å
513	H	83.5	Confident	66.9	Low	90 Å²	90	66.1 Å²	66.1	42%	0.417	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.8	179.7	-71.6	-114.7	0	0	0	110.6	S422 Q511	S422-H513 WeakPolarHBondContact CB-O 3.33Å; Q511-H513 PolarHBondContact OE1-NE2 3.03Å
514	F	88.9	Confident	68.9	Low	3 Å²	3	63.3 Å²	63.3	1%	0.013	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	-177.6	176.3	71.2	-84.7	0	0	0	111.3	I398 A426 F430 L458 L512 I516 V532 I534	I398-F514 HydrophobicContact CG2-CD2 4.31Å; I398-F514 HydrophobicContact CG2-CE2 4.36Å; A426-F514 HydrophobicContact CB-CB 3.67Å; A426-F514 HydrophobicContact CB-CD1 3.58Å; A426-F514 HydrophobicContact CB-CD2 3.52Å; A426-F514 HydrophobicContact CB-CE1 4Å; A426-F514 HydrophobicContact CB-CE2 3.96Å; A426-F514 HydrophobicContact CB-CG 3.31Å; A426-F514 HydrophobicContact CB-CZ 4.18Å; F430-F514 AromaticContact CD2-CE1 3.77Å; F430-F514 HydrophobicContact CD2-CE1 3.77Å; F430-F514 HydrophobicContact CD2-CE2 4.49Å; F430-F514 AromaticContact CD2-CZ 3.65Å; F430-F514 HydrophobicContact CD2-CZ 3.65Å; F430-F514 HydrophobicContact CE2-CD1 4.42Å; F430-F514 AromaticContact CE2-CE1 3.56Å; F430-F514 HydrophobicContact CE2-CE1 3.56Å; F430-F514 AromaticContact CE2-CZ 3.93Å; F430-F514 HydrophobicContact CE2-CZ 3.93Å; L458-F514 HydrophobicContact CD1-CZ 4.32Å; L458-F514 HydrophobicContact CD2-CZ 3.94Å; L512-F514 HydrophobicContact CG-CD1 4.42Å; F514-I516 HydrophobicContact CE2-CG1 4Å; F514-V532 HydrophobicContact CD1-CB 4.19Å; F514-V532 HydrophobicContact CD1-CG1 4.36Å; F514-V532 HydrophobicContact CD2-CB 4.36Å; F514-V532 HydrophobicContact CE1-CB 3.89Å; F514-V532 HydrophobicContact CE1-CG1 3.63Å; F514-V532 HydrophobicContact CE2-CB 4.05Å; F514-V532 HydrophobicContact CE2-CG1 4.31Å; F514-V532 HydrophobicContact CE2-CG2 4.25Å; F514-V532 HydrophobicContact CG-CB 4.43Å; F514-V532 HydrophobicContact CZ-CB 3.81Å; F514-V532 HydrophobicContact CZ-CG1 3.6Å; F514-V532 HydrophobicContact CZ-CG2 4.33Å; F514-V532 PolarHBondContact N-O 3.11Å; F514-V532 PolarHBondContact O-N 3.32Å; F514-I534 HydrophobicContact CE1-CG1 3.87Å
515	F	89.8	Confident	71.2	Confident	65 Å²	65	58.2 Å²	58.2	29%	0.285	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.8	176.5	-58	-93.8	0	0	0	112.1	P399 Q423 F494 K529 V530 P531	P399-F515 WeakPolarHBondContact CD-O 3.37Å; Q423-F515 PolarHBondContact NE2-O 3.48Å; Q423-F515 PolarHBondContact OE1-O 3.45Å; F494-F515 HydrophobicContact CE1-CE1 4.39Å; F494-F515 AromaticContact CE2-CE1 3.93Å; F494-F515 HydrophobicContact CE2-CE1 3.93Å; F494-F515 HydrophobicContact CE2-CZ 4.16Å; F494-F515 AromaticContact CZ-CE1 3.65Å; F494-F515 HydrophobicContact CZ-CE1 3.65Å; F494-F515 HydrophobicContact CZ-CZ 4.33Å; F515-K529 HydrophobicContact CB-CB 4.36Å; F515-K529 HydrophobicContact CD1-CB 4.22Å; F515-V530 VanDerWaalsContact CA-O 3.27Å; F515-V530 WeakPolarHBondContact CA-O 3.46Å; F515-P531 HydrophobicContact CD1-CB 4.28Å; F515-P531 HydrophobicContact CD1-CG 4.29Å; F515-P531 HydrophobicContact CE1-CB 4.05Å; F515-P531 HydrophobicContact CE1-CG 3.93Å
516	I	92.1	Very high	73.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136.6	162.1	-63.9	172.7	0	0	0	107.7	F358 F378 F380 I432 L458 F514 K529 V530 V532	F358-I516 HydrophobicContact CE1-CG2 4.33Å; F358-I516 HydrophobicContact CZ-CG2 4.08Å; F378-I516 HydrophobicContact CZ-CD1 4.34Å; F380-I516 HydrophobicContact CD1-CD1 4.3Å; F380-I516 HydrophobicContact CE1-CD1 3.81Å; F380-I516 HydrophobicContact CE2-CD1 4.49Å; F380-I516 HydrophobicContact CE2-CG2 4.14Å; F380-I516 HydrophobicContact CZ-CD1 3.92Å; F380-I516 HydrophobicContact CZ-CG2 4.21Å; I432-I516 HydrophobicContact CD1-CG2 3.88Å; L458-I516 HydrophobicContact CD1-CD1 4.24Å; F514-I516 HydrophobicContact CE2-CG1 4Å; I516-K529 WeakPolarHBondContact O-CA 3.4Å; I516-V530 HydrophobicContact CB-CG1 4.02Å; I516-V530 PolarHBondContact N-O 3.25Å; I516-V530 PolarHBondContact O-N 2.9Å; I516-V532 HydrophobicContact CD1-CG2 3.79Å; I516-V532 HydrophobicContact CG1-CG2 3.83Å
517	E	91.4	Very high	76.4	Confident	10 Å²	10	52.3 Å²	52.3	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.7	173.7	-82.9	177.6	-171.5	0	0	110.5	F396 R397 P399 V527 T528 K529	F396-E517 CarbonylContact C-O 3.57Å; F396-E517 WeakPolarHBondContact CA-O 3.15Å; R397-E517 HydrophobicContact CG-CB 3.88Å; R397-E517 IonicContact CZ-OE2 2.95Å; R397-E517 PolarHBondContact N-O 3.19Å; R397-E517 IonicContact NE-OE2 2.59Å; R397-E517 PolarHBondContact NE-OE2 3.2Å; R397-E517 IonicContact NH2-OE2 3.36Å; R397-E517 PolarHBondContact NH2-OE2 2.96Å; R397-E517 PolarHBondContact O-N 3.37Å; P399-E517 HydrophobicContact CG-CB 4.23Å; P399-E517 HydrophobicContact CG-CG 3.67Å; P399-E517 WeakPolarHBondContact CG-OE1 3.19Å; E517-V527 HydrophobicContact CB-CG1 3.98Å; E517-V527 HydrophobicContact CG-CG1 3.78Å; E517-T528 WeakPolarHBondContact CA-O 3.36Å; E517-K529 HydrophobicContact CG-CD 4.04Å; E517-K529 HydrophobicContact CG-CG 3.99Å; E517-K529 VanDerWaalsContact OE1-CE 3.23Å; E517-K529 WeakPolarHBondContact OE1-CE 3.14Å; E517-K529 IonicContact OE1-NZ 2.66Å; E517-K529 PolarHBondContact OE1-NZ 3.34Å
518	A	89.6	Confident	79.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	134.2	162.5	0	0	0	0	0	108.4	P356 F358 A382 V394 K395 F396 V527 T528	P356-A518 HydrophobicContact CB-CB 3.78Å; P356-A518 HydrophobicContact CG-CB 4.45Å; F358-A518 HydrophobicContact CD2-CB 4.28Å; F358-A518 HydrophobicContact CE1-CB 4.16Å; F358-A518 HydrophobicContact CE2-CB 3.49Å; F358-A518 VanDerWaalsContact CE2-CB 3.49Å; F358-A518 HydrophobicContact CZ-CB 3.43Å; F358-A518 VanDerWaalsContact CZ-CB 3.43Å; A382-A518 HydrophobicContact CB-CB 4.08Å; V394-A518 HydrophobicContact CG1-CB 3.9Å; K395-A518 CarbonylContact O-C 3.55Å; K395-A518 WeakPolarHBondContact O-CA 3.25Å; F396-A518 HydrophobicContact CD1-CB 3.87Å; F396-A518 HydrophobicContact CE1-CB 3.87Å; A518-V527 WeakPolarHBondContact O-CA 3.41Å; A518-T528 PolarHBondContact N-O 3.14Å; A518-T528 PolarHBondContact O-N 3.24Å
519	Y	88.6	Confident	81.1	Confident	53 Å²	53	48.5 Å²	48.5	21%	0.208	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	146.1	-178.9	64.9	-80	0	0	0	110.8	V394 K395 R397 L526	V394-Y519 CarbonylContact C-O 3.52Å; K395-Y519 HydrophobicContact CB-CD1 4.17Å; K395-Y519 HydrophobicContact CB-CD2 4.26Å; K395-Y519 HydrophobicContact CB-CE1 3.63Å; K395-Y519 HydrophobicContact CB-CE2 3.76Å; K395-Y519 HydrophobicContact CB-CG 4.45Å; K395-Y519 VanDerWaalsContact CB-CZ 3.4Å; K395-Y519 HydrophobicContact CD-CE2 3.79Å; K395-Y519 HydrophobicContact CG-CE2 4.41Å; K395-Y519 PolarHBondContact N-O 3Å; K395-Y519 VanDerWaalsContact O-CD1 3.3Å; K395-Y519 WeakPolarHBondContact O-CD1 3.33Å; K395-Y519 PolarHBondContact O-N 3.31Å; R397-Y519 HydrophobicContact CB-CE1 4.05Å; R397-Y519 HydrophobicContact CG-CD1 4.12Å; R397-Y519 HydrophobicContact CG-CE1 3.87Å; Y519-L526 WeakPolarHBondContact CA-O 3.47Å
520	D	86	Confident	82.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.235	C	C	.	.			trans	-79.7	-167.5	177.2	63.5	56.6	0	0	0	112.9	N352 P356 N391 I393 G522 P525 L526	N352-D520 PolarHBondContact ND2-OD2 3.46Å; N352-D520 VanDerWaalsContact OD1-CG 3.27Å; N352-D520 PolarHBondContact OD1-OD1 2.84Å; N352-D520 PolarHBondContact OD1-OD2 2.6Å; P356-D520 HydrophobicContact CG-CB 4.46Å; N391-D520 VanDerWaalsContact O-CB 3.26Å; N391-D520 WeakPolarHBondContact O-CB 3.44Å; I393-D520 CarbonylContact O-C 3.56Å; I393-D520 WeakPolarHBondContact O-CA 3.3Å; D520-G522 PolarHBondContact OD1-N 2.84Å; D520-P525 WeakPolarHBondContact OD1-CA 3.2Å; D520-P525 WeakPolarHBondContact OD1-CB 3.41Å; D520-L526 PolarHBondContact N-O 3.48Å; D520-L526 WeakPolarHBondContact OD2-CA 3.02Å; D520-L526 WeakPolarHBondContact OD2-CB 3.29Å; D520-L526 PolarHBondContact OD2-N 3.18Å
521	N	80.2	Confident	84	Confident	54 Å²	54	45.8 Å²	45.8	29%	0.289	24%	0.242	S	C	.	.			trans	-123.7	23.1	170.1	-67.6	-89.1	0	0	0	113.8	E390 I393 K395	E390-N521 CarbonylContact O-C 3.48Å; E390-N521 VanDerWaalsContact O-C 3.3Å; E390-N521 WeakPolarHBondContact O-CA 3.31Å; E390-N521 VanDerWaalsContact O-CB 3.31Å; E390-N521 WeakPolarHBondContact O-CB 3.32Å; E390-N521 PolarHBondContact O-N 2.93Å; I393-N521 PolarHBondContact O-ND2 2.91Å; K395-N521 WeakPolarHBondContact CD-OD1 3.43Å; K395-N521 WeakPolarHBondContact CE-ND2 3.36Å; K395-N521 WeakPolarHBondContact CE-OD1 3.11Å; K395-N521 PolarHBondContact NZ-OD1 2.89Å
522	G	73.1	Confident	84.8	Confident	8 Å²	8	42.9 Å²	42.9	8%	0.082	23%	0.228	C	C	.	.	S	Bend	trans	-69.4	173.3	178.1	0	0	0	0	0	114	N352 N391 D520 T524 P525	N352-G522 VanDerWaalsContact OD1-CA 3.25Å; N352-G522 WeakPolarHBondContact OD1-CA 3.25Å; N391-G522 WeakPolarHBondContact OD1-CA 3.48Å; D520-G522 PolarHBondContact OD1-N 2.84Å; G522-T524 PolarHBondContact O-N 3.48Å; G522-T524 VanDerWaalsContact O-N 3.17Å; G522-P525 WeakPolarHBondContact O-CD 3.35Å; G522-P525 WeakPolarHBondContact O-CG 3.34Å
523	L	72.3	Confident	85	Confident	168 Å²	168	45 Å²	45	88%	0.88	24%	0.239	S	C	*	.	S	Bend	trans	-64.6	-18.2	179.4	-79.3	163.9	0	0	0	114
524	T	71	Confident	85.2	Confident	103 Å²	103	40.7 Å²	40.7	63%	0.632	22%	0.219	S	C	*	.	S	Bend	trans	-140.7	81.2	175.3	47.6	0	0	0	0	109.5	G522 L526	G522-T524 PolarHBondContact O-N 3.48Å; G522-T524 VanDerWaalsContact O-N 3.17Å; T524-L526 PolarHBondContact O-N 3.29Å
525	P	77.2	Confident	84.9	Confident	74 Å²	74	42.7 Å²	42.7	48%	0.481	23%	0.23	S	C	.	.			trans	-61.8	128	-165.1	-26.8	34.4	0	0	0	115	D520 G522	D520-P525 WeakPolarHBondContact OD1-CA 3.2Å; D520-P525 WeakPolarHBondContact OD1-CB 3.41Å; G522-P525 WeakPolarHBondContact O-CD 3.35Å; G522-P525 WeakPolarHBondContact O-CG 3.34Å
526	L	83.3	Confident	84.4	Confident	58 Å²	58	39.7 Å²	39.7	30%	0.304	22%	0.217	S	C	.	.			trans	-84.5	148.5	169.7	-60.9	176.4	0	0	0	109.7	N352 H354 Y519 D520 T524	N352-L526 WeakPolarHBondContact ND2-CG 3.18Å; N352-L526 WeakPolarHBondContact O-CD1 3.32Å; H354-L526 WeakPolarHBondContact O-CD1 3.46Å; Y519-L526 WeakPolarHBondContact CA-O 3.47Å; D520-L526 PolarHBondContact N-O 3.48Å; D520-L526 WeakPolarHBondContact OD2-CA 3.02Å; D520-L526 WeakPolarHBondContact OD2-CB 3.29Å; D520-L526 PolarHBondContact OD2-N 3.18Å; T524-L526 PolarHBondContact O-N 3.29Å
527	V	84.5	Confident	83.5	Confident	58 Å²	58	42.2 Å²	42.2	35%	0.352	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	123.1	-171.5	-172.7	0	0	0	0	110.3	E517 A518	E517-V527 HydrophobicContact CB-CG1 3.98Å; E517-V527 HydrophobicContact CG-CG1 3.78Å; A518-V527 WeakPolarHBondContact O-CA 3.41Å
528	T	87	Confident	82.6	Confident	34 Å²	34	42.3 Å²	42.3	21%	0.209	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	148	172.8	-58.9	0	0	0	0	109.9	P356 F358 E517 A518	P356-T528 WeakPolarHBondContact O-CB 3.4Å; P356-T528 WeakPolarHBondContact O-CG2 3.2Å; P356-T528 PolarHBondContact O-OG1 2.75Å; F358-T528 HydrophobicContact CD2-CG2 3.91Å; F358-T528 HydrophobicContact CE2-CG2 4.28Å; E517-T528 WeakPolarHBondContact CA-O 3.36Å; A518-T528 PolarHBondContact N-O 3.14Å; A518-T528 PolarHBondContact O-N 3.24Å
529	K	89.5	Confident	81.9	Confident	92 Å²	92	43 Å²	43	40%	0.4	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.4	-180	-40.2	-157	-175.6	-154.7	0	110.1	F515 I516 E517	F515-K529 HydrophobicContact CB-CB 4.36Å; F515-K529 HydrophobicContact CD1-CB 4.22Å; I516-K529 WeakPolarHBondContact O-CA 3.4Å; E517-K529 HydrophobicContact CG-CD 4.04Å; E517-K529 HydrophobicContact CG-CG 3.99Å; E517-K529 VanDerWaalsContact OE1-CE 3.23Å; E517-K529 WeakPolarHBondContact OE1-CE 3.14Å; E517-K529 IonicContact OE1-NZ 2.66Å; E517-K529 PolarHBondContact OE1-NZ 3.34Å
530	V	90.9	Very high	81.4	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.9	171.2	68	0	0	0	0	110.3	F358 Q360 Y363 F515 I516	F358-V530 HydrophobicContact CB-CB 4.35Å; F358-V530 HydrophobicContact CD1-CB 4.15Å; F358-V530 HydrophobicContact CD1-CG1 3.73Å; F358-V530 HydrophobicContact CD2-CB 3.7Å; F358-V530 HydrophobicContact CD2-CG1 3.98Å; F358-V530 HydrophobicContact CE1-CB 4.33Å; F358-V530 HydrophobicContact CE1-CG1 3.54Å; F358-V530 HydrophobicContact CE2-CB 3.88Å; F358-V530 HydrophobicContact CE2-CG1 3.78Å; F358-V530 HydrophobicContact CG-CB 3.83Å; F358-V530 HydrophobicContact CG-CG1 3.94Å; F358-V530 HydrophobicContact CG-CG2 4.47Å; F358-V530 HydrophobicContact CZ-CB 4.18Å; F358-V530 HydrophobicContact CZ-CG1 3.55Å; Q360-V530 WeakPolarHBondContact O-CG2 3.29Å; Y363-V530 HydrophobicContact CD2-CB 4.48Å; Y363-V530 HydrophobicContact CD2-CG1 3.95Å; Y363-V530 HydrophobicContact CD2-CG2 3.68Å; Y363-V530 HydrophobicContact CE2-CB 4.38Å; Y363-V530 HydrophobicContact CE2-CG1 3.93Å; Y363-V530 HydrophobicContact CE2-CG2 3.71Å; F515-V530 VanDerWaalsContact CA-O 3.27Å; F515-V530 WeakPolarHBondContact CA-O 3.46Å; I516-V530 HydrophobicContact CB-CG1 4.02Å; I516-V530 PolarHBondContact N-O 3.25Å; I516-V530 PolarHBondContact O-N 2.9Å
531	P	89	Confident	80.9	Confident	26 Å²	26	42.7 Å²	42.7	17%	0.169	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	142.7	172.4	-12.4	25.7	0	0	0	111.6	E361 F362 Y363 F494 F515	E361-P531 WeakPolarHBondContact O-CD 3.34Å; F362-P531 WeakPolarHBondContact CA-O 3.44Å; F362-P531 HydrophobicContact CB-CB 4.05Å; F362-P531 HydrophobicContact CB-CG 4.15Å; Y363-P531 PolarHBondContact N-O 2.84Å; F494-P531 HydrophobicContact CE1-CG 3.79Å; F494-P531 HydrophobicContact CZ-CG 4.33Å; F515-P531 HydrophobicContact CD1-CB 4.28Å; F515-P531 HydrophobicContact CD1-CG 4.29Å; F515-P531 HydrophobicContact CE1-CB 4.05Å; F515-P531 HydrophobicContact CE1-CG 3.93Å
532	V	89.7	Confident	80.6	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.7	173.5	-176.7	0	0	0	0	109.2	Y363 F378 L458 F514 I516 I534	Y363-V532 WeakPolarHBondContact O-CA 3.26Å; F378-V532 HydrophobicContact CE1-CG1 3.64Å; F378-V532 HydrophobicContact CZ-CG1 3.64Å; F378-V532 HydrophobicContact CZ-CG2 4.01Å; L458-V532 HydrophobicContact CD2-CG1 4.21Å; F514-V532 HydrophobicContact CD1-CB 4.19Å; F514-V532 HydrophobicContact CD1-CG1 4.36Å; F514-V532 HydrophobicContact CD2-CB 4.36Å; F514-V532 HydrophobicContact CE1-CB 3.89Å; F514-V532 HydrophobicContact CE1-CG1 3.63Å; F514-V532 HydrophobicContact CE2-CB 4.05Å; F514-V532 HydrophobicContact CE2-CG1 4.31Å; F514-V532 HydrophobicContact CE2-CG2 4.25Å; F514-V532 HydrophobicContact CG-CB 4.43Å; F514-V532 HydrophobicContact CZ-CB 3.81Å; F514-V532 HydrophobicContact CZ-CG1 3.6Å; F514-V532 HydrophobicContact CZ-CG2 4.33Å; F514-V532 PolarHBondContact N-O 3.11Å; F514-V532 PolarHBondContact O-N 3.32Å; I516-V532 HydrophobicContact CD1-CG2 3.79Å; I516-V532 HydrophobicContact CG1-CG2 3.83Å; V532-I534 HydrophobicContact CG1-CD1 3.82Å; V532-I534 HydrophobicContact CG1-CG1 4.1Å
533	I	87.9	Confident	81.2	Confident	44 Å²	44	45.9 Å²	45.9	23%	0.226	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	111.1	178.6	-49.9	175.7	0	0	0	108.7	Y363 T364 G365 Q511	Y363-I533 PolarHBondContact O-N 3.18Å; T364-I533 VanDerWaalsContact CA-O 3.3Å; T364-I533 WeakPolarHBondContact CA-O 3.2Å; T364-I533 HydrophobicContact CG2-CB 4.35Å; G365-I533 PolarHBondContact N-O 3.4Å; Q511-I533 HydrophobicContact CB-CG2 4.36Å
534	I	87.8	Confident	81.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.4	175.5	-56	-55.5	0	0	0	109.3	I367 I377 F378 F430 L458 Q511 L512 F514 V532 I536	I367-I534 HydrophobicContact CD1-CG2 3.89Å; I367-I534 HydrophobicContact CG1-CG2 3.79Å; I367-I534 HydrophobicContact CG2-CG2 4.42Å; I377-I534 HydrophobicContact CG2-CD1 3.89Å; F378-I534 HydrophobicContact CE1-CD1 4.07Å; F430-I534 HydrophobicContact CE2-CG1 4.11Å; F430-I534 HydrophobicContact CZ-CB 4.42Å; F430-I534 HydrophobicContact CZ-CG1 4.01Å; F430-I534 HydrophobicContact CZ-CG2 4.21Å; L458-I534 HydrophobicContact CD2-CD1 4.19Å; Q511-I534 CarbonylContact C-O 3.56Å; Q511-I534 WeakPolarHBondContact CA-O 3.35Å; L512-I534 PolarHBondContact N-O 2.97Å; L512-I534 PolarHBondContact O-N 2.97Å; F514-I534 HydrophobicContact CE1-CG1 3.87Å; V532-I534 HydrophobicContact CG1-CD1 3.82Å; V532-I534 HydrophobicContact CG1-CG1 4.1Å; I534-I536 HydrophobicContact CG2-CG1 4.25Å
535	L	82.8	Confident	82.6	Confident	45 Å²	45	36.6 Å²	36.6	24%	0.236	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	121.1	165.6	-177.6	71.6	0	0	0	108.8	G365 R366 I367 Q511	G365-L535 PolarHBondContact O-N 3.22Å; R366-L535 WeakPolarHBondContact CA-O 3.31Å; R366-L535 HydrophobicContact CG-CB 4.37Å; I367-L535 PolarHBondContact N-O 3.22Å; Q511-L535 HydrophobicContact CG-CD1 4.07Å
536	I	78.6	Confident	83.1	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	118.8	175.5	-54.4	176.7	0	0	0	107.3	I367 T472 A475 I476 D510 L512 I534	I367-I536 HydrophobicContact CD1-CG1 4.27Å; I367-I536 HydrophobicContact CG1-CG1 4.16Å; I367-I536 CarbonylContact O-C 3.58Å; I367-I536 WeakPolarHBondContact O-CA 3.38Å; T472-I536 HydrophobicContact CG2-CD1 4.35Å; T472-I536 HydrophobicContact CG2-CG2 3.52Å; A475-I536 HydrophobicContact CB-CD1 3.57Å; I476-I536 HydrophobicContact CD1-CG2 3.86Å; I476-I536 HydrophobicContact CG1-CB 4.26Å; I476-I536 HydrophobicContact CG1-CD1 4.3Å; I476-I536 HydrophobicContact CG1-CG2 3.84Å; D510-I536 WeakPolarHBondContact CB-O 3.21Å; D510-I536 PolarHBondContact O-N 3.39Å; L512-I536 HydrophobicContact CB-CD1 4.23Å; I534-I536 HydrophobicContact CG2-CG1 4.25Å
537	T	73.7	Confident	83.3	Confident	53 Å²	53	36.3 Å²	36.3	33%	0.325	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	113.2	172.1	60.9	0	0	0	0	109.7	I367 S368 E369	I367-T537 PolarHBondContact O-N 3Å; I367-T537 PolarHBondContact O-OG1 3.03Å; S368-T537 WeakPolarHBondContact CA-O 3.49Å; S368-T537 WeakPolarHBondContact CA-OG1 3.07Å; E369-T537 PolarHBondContact N-O 3.48Å
538	D	72.3	Confident	83.4	Confident	11 Å²	11	36.3 Å²	36.3	6%	0.059	19%	0.188	C	C	.	.			trans	-51.2	156.1	168.3	-171.1	22.7	0	0	0	113.2	S593 T594 L695	D538-S593 WeakPolarHBondContact CB-OG 3.2Å; D538-S593 VanDerWaalsContact OD2-CA 3.27Å; D538-S593 WeakPolarHBondContact OD2-CA 3.45Å; D538-S593 WeakPolarHBondContact OD2-CB 3.48Å; D538-S593 PolarHBondContact OD2-N 3.29Å; D538-S593 PolarHBondContact OD2-OG 3.49Å; D538-T594 HydrophobicContact CB-CG2 4.21Å; D538-T594 PolarHBondContact OD2-N 2.93Å; D538-L695 HydrophobicContact CB-CD2 3.8Å
539	V	74.7	Confident	83.4	Confident	15 Å²	15	37.4 Å²	37.4	9%	0.091	20%	0.196	C	C	.	.			trans	-145.4	136	-179.4	-180	0	0	0	0	106.9	S368 D541 P696	S368-V539 WeakPolarHBondContact OG-CG2 3.43Å; V539-D541 VanDerWaalsContact C-N 3.3Å; V539-D541 PolarHBondContact O-N 2.89Å; V539-P696 HydrophobicContact CG1-CB 4.47Å; V539-P696 WeakPolarHBondContact CG1-O 3.45Å
540	N	78.2	Confident	83.2	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.016	18%	0.182	C	C	.	.			trans	-71.3	80.2	-177.8	-161.5	111.5	0	0	0	111.3	D592 D689 N690 L695 P696	N540-D592 WeakPolarHBondContact CA-OD2 3.22Å; N540-D592 PolarHBondContact ND2-OD2 3.27Å; N540-D689 VanDerWaalsContact ND2-CG 3.29Å; N540-D689 PolarHBondContact ND2-OD1 2.95Å; N540-D689 PolarHBondContact ND2-OD2 2.88Å; N540-N690 WeakPolarHBondContact OD1-CB 3.38Å; N540-L695 HydrophobicContact CB-CB 3.89Å; N540-L695 HydrophobicContact CB-CD1 4.13Å; N540-P696 WeakPolarHBondContact CB-O 3.48Å; N540-P696 PolarHBondContact N-O 3.48Å
541	D	74.7	Confident	82.9	Confident	45 Å²	45	39 Å²	39	24%	0.241	21%	0.207	C	C	.	.			trans	-118.2	3	-179.9	80.7	14.5	0	0	0	116	N370 Q469 V539 D592	N370-D541 PolarHBondContact ND2-OD2 2.73Å; Q469-D541 PolarHBondContact NE2-OD2 2.81Å; V539-D541 VanDerWaalsContact C-N 3.3Å; V539-D541 PolarHBondContact O-N 2.89Å; D541-D592 PolarHBondContact N-OD1 2.86Å; D541-D592 PolarHBondContact N-OD2 3.05Å
542	H	75.3	Confident	82.6	Confident	68 Å²	68	42.2 Å²	42.2	32%	0.315	22%	0.219	S	C	.	.	S	Bend	trans	-110.4	106.9	170.2	-59.6	81.4	0	0	0	112.6	K591 D592	H542-K591 HydrophobicContact CB-CB 3.86Å; H542-D592 VanDerWaalsContact CB-OD1 3.29Å; H542-D592 WeakPolarHBondContact CB-OD1 3.21Å; H542-D592 IonicContact CG-OD1 3.17Å; H542-D592 VanDerWaalsContact N-CG 3.34Å; H542-D592 PolarHBondContact N-OD1 3.05Å; H542-D592 PolarHBondContact N-OD2 3.33Å; H542-D592 IonicContact ND1-OD1 3.2Å; H542-D592 PolarHBondContact ND1-OD1 2.78Å
543	P	84.1	Confident	82.2	Confident	61 Å²	61	46.7 Å²	46.7	40%	0.396	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-69	143.8	178.9	30.1	-35.4	0	0	0	111.9	E545 L700	P543-E545 PolarHBondContact O-N 2.87Å; P543-L700 HydrophobicContact CB-CB 3.88Å; P543-L700 HydrophobicContact CB-CD1 4.12Å
544	P	86.7	Confident	81.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-53.4	126.9	-172.2	-31.6	35.1	0	0	0	115.3	I546 V588 C687 D689 S702	P544-I546 PolarHBondContact O-N 3.32Å; P544-V588 HydrophobicContact CB-CG1 3.84Å; P544-C687 HydrophobicContact CB-CB 4.39Å; P544-D689 HydrophobicContact CG-CB 3.78Å; P544-S702 WeakPolarHBondContact O-CB 3.43Å; P544-S702 PolarHBondContact O-OG 3.45Å
545	E	86.4	Confident	80.4	Confident	76 Å²	76	54.6 Å²	54.6	36%	0.355	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	117.3	179.6	-67.1	-169.6	160.3	0	0	111.2	P543 F547 V588 I589 K591	P543-E545 PolarHBondContact O-N 2.87Å; E545-F547 HydrophobicContact CB-CD2 4.42Å; E545-F547 HydrophobicContact CB-CE2 3.53Å; E545-F547 HydrophobicContact CB-CZ 3.95Å; E545-F547 WeakPolarHBondContact O-CD2 3.43Å; E545-V588 WeakPolarHBondContact O-CA 3.41Å; E545-I589 PolarHBondContact N-O 3.31Å; E545-I589 PolarHBondContact O-N 3.34Å; E545-K591 VanDerWaalsContact CD-CE 3.5Å; E545-K591 IonicContact OE1-NZ 3.87Å; E545-K591 PolarHBondContact OE1-NZ 2.88Å; E545-K591 WeakPolarHBondContact OE2-CE 3.05Å; E545-K591 IonicContact OE2-NZ 2.78Å; E545-K591 PolarHBondContact OE2-NZ 3.07Å
546	I	88.9	Confident	79.2	Confident	29 Å²	29	56.2 Å²	56.2	15%	0.149	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	116.8	-177.1	-53.6	170.8	0	0	0	110.3	P544 I586 V588 I685 C687 A704	P544-I546 PolarHBondContact O-N 3.32Å; I546-I586 HydrophobicContact CG2-CG2 3.89Å; I546-V588 HydrophobicContact CG1-CG1 4.41Å; I546-V588 HydrophobicContact CG1-CG2 4.38Å; I546-V588 HydrophobicContact CG2-CG2 4.39Å; I546-I685 HydrophobicContact CD1-CG2 4.4Å; I546-C687 HydrophobicContact CD1-CB 3.98Å; I546-C687 HydrophobicContact CG1-CB 4.29Å; I546-A704 HydrophobicContact CB-CB 3.9Å; I546-A704 HydrophobicContact CD1-CB 3.96Å; I546-A704 HydrophobicContact CG2-CB 3.74Å
547	F	86.6	Confident	77.8	Confident	97 Å²	97	63.2 Å²	63.2	43%	0.425	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.9	176.2	-58.2	-91.5	0	0	0	110.7	E545 I586 T587 I589	E545-F547 HydrophobicContact CB-CD2 4.42Å; E545-F547 HydrophobicContact CB-CE2 3.53Å; E545-F547 HydrophobicContact CB-CZ 3.95Å; E545-F547 WeakPolarHBondContact O-CD2 3.43Å; F547-I586 WeakPolarHBondContact O-CA 3.46Å; F547-T587 WeakPolarHBondContact CA-O 3.11Å; F547-T587 WeakPolarHBondContact CB-O 3.47Å; F547-T587 PolarHBondContact N-O 3.16Å; F547-T587 PolarHBondContact O-N 3.25Å; F547-I589 HydrophobicContact CD2-CD1 3.98Å; F547-I589 HydrophobicContact CD2-CG1 4.04Å; F547-I589 HydrophobicContact CE2-CB 4.12Å; F547-I589 HydrophobicContact CE2-CD1 3.73Å; F547-I589 HydrophobicContact CE2-CG1 3.94Å
548	I	87.4	Confident	76.3	Confident	58 Å²	58	67.2 Å²	67.2	30%	0.297	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122	-172.9	-56.9	151.8	0	0	0	109.3	Y550 A584 I586 A704 I706	I548-Y550 HydrophobicContact CG2-CD1 4.11Å; I548-Y550 HydrophobicContact CG2-CD2 4.06Å; I548-Y550 HydrophobicContact CG2-CE1 3.76Å; I548-Y550 HydrophobicContact CG2-CE2 3.69Å; I548-Y550 HydrophobicContact CG2-CG 4.28Å; I548-A584 HydrophobicContact CG2-CB 4.36Å; I548-I586 HydrophobicContact CB-CD1 4.36Å; I548-I586 HydrophobicContact CG1-CD1 4.13Å; I548-I586 HydrophobicContact CG2-CD1 3.96Å; I548-A704 HydrophobicContact CD1-CB 4.2Å; I548-I706 HydrophobicContact CD1-CD1 3.48Å; I548-I706 VanDerWaalsContact CD1-CD1 3.48Å; I548-I706 HydrophobicContact CG1-CD1 3.69Å; I548-I706 HydrophobicContact CG2-CD1 4.03Å
549	S	85.2	Confident	74.7	Confident	56 Å²	56	75.7 Å²	75.7	39%	0.392	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	95.6	176.1	-170.5	0	0	0	0	110	A584 Q585	S549-A584 CarbonylContact O-C 3.58Å; S549-A584 VanDerWaalsContact O-CA 3.25Å; S549-A584 WeakPolarHBondContact O-CA 3.27Å; S549-A584 WeakPolarHBondContact O-CB 3.5Å; S549-Q585 PolarHBondContact N-O 2.8Å; S549-Q585 PolarHBondContact O-N 2.84Å
550	Y	86.2	Confident	72.6	Confident	24 Å²	24	82 Å²	82	9%	0.094	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	137.8	178.7	-62	-71.5	0	0	0	111.7	I548 I570 G572 I583 A584 I706 F707	I548-Y550 HydrophobicContact CG2-CD1 4.11Å; I548-Y550 HydrophobicContact CG2-CD2 4.06Å; I548-Y550 HydrophobicContact CG2-CE1 3.76Å; I548-Y550 HydrophobicContact CG2-CE2 3.69Å; I548-Y550 HydrophobicContact CG2-CG 4.28Å; Y550-I570 HydrophobicContact CD2-CG2 4.1Å; Y550-I570 HydrophobicContact CE2-CG2 4.44Å; Y550-I570 WeakPolarHBondContact CE2-O 3.13Å; Y550-G572 VanDerWaalsContact CG-CA 3.45Å; Y550-I583 HydrophobicContact CD1-CG2 4.48Å; Y550-A584 HydrophobicContact CD1-CB 3.88Å; Y550-A584 HydrophobicContact CE1-CB 4.47Å; Y550-I706 HydrophobicContact CE1-CG2 4.04Å; Y550-F707 PolarHBondContact OH-N 2.64Å; Y550-F707 PolarHBondContact OH-O 2.78Å
551	L	84.6	Confident	70.3	Confident	106 Å²	106	88.9 Å²	88.9	56%	0.555	46%	0.455	S	S	*	.	S	Bend	trans	-70.4	-36.7	178.4	-67	-179.4	0	0	0	112.6	M582 I583	L551-M582 HydrophobicContact CD1-CB 3.81Å; L551-M582 HydrophobicContact CD1-CG 3.72Å; L551-M582 HydrophobicContact CD1-SD 4.13Å; L551-I583 PolarHBondContact N-O 2.83Å
552	K	83.5	Confident	68.5	Low	93 Å²	93	94.3 Å²	94.3	40%	0.404	48%	0.483	S	S	.	.	S	Bend	trans	-117.4	97.8	165.4	-66.8	176.6	173.2	-179.4	0	108.1	G572 K573 T575 E711	K552-G572 CarbonylContact O-C 3.45Å; K552-K573 HydrophobicContact CB-CB 3.82Å; K552-K573 WeakPolarHBondContact CB-O 3.28Å; K552-K573 HydrophobicContact CD-CB 4.41Å; K552-K573 PolarHBondContact O-N 2.91Å; K552-T575 PolarHBondContact NZ-OG1 3.25Å; K552-E711 IonicContact NZ-OE2 3.37Å; K552-E711 PolarHBondContact NZ-OE2 2.87Å
553	P	81	Confident	66.3	Low	94 Å²	94	102.3 Å²	102.3	61%	0.61	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	134.9	174.9	30.3	-32.8	0	0	0	111.1	I570 W571	P553-I570 HydrophobicContact CB-CG2 3.88Å; P553-W571 CarbonylContact C-O 3.45Å; P553-W571 WeakPolarHBondContact CA-O 3.34Å
554	T	70.9	Confident	63.8	Low	25 Å²	25	106.6 Å²	106.6	15%	0.153	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	165.7	178.5	-174	0	0	0	0	111	W571 K573 E709	T554-W571 HydrophobicContact CG2-CB 3.46Å; T554-W571 VanDerWaalsContact CG2-CB 3.46Å; T554-W571 PolarHBondContact N-O 2.74Å; T554-W571 PolarHBondContact O-N 2.87Å; T554-K573 HydrophobicContact CG2-CB 4.03Å; T554-K573 HydrophobicContact CG2-CD 4.3Å; T554-K573 HydrophobicContact CG2-CG 4.3Å; T554-E709 WeakPolarHBondContact CB-OE2 3.39Å; T554-E709 HydrophobicContact CG2-CB 3.98Å; T554-E709 WeakPolarHBondContact CG2-OE2 3.42Å; T554-E709 PolarHBondContact OG1-OE2 2.69Å
555	R	65.8	Low	61.1	Low	186 Å²	186	112.9 Å²	112.9	70%	0.702	57%	0.571	S	S	*	*			trans	-121.1	143	178.6	-68.6	-172.5	-175.2	178.2	5.8	109.2	L557	R555-L557 PolarHBondContact O-N 3.03Å
556	P	58	Low	58.6	Low	79 Å²	79	116.4 Å²	116.4	51%	0.513	59%	0.592	S	S	.	*			trans	-60.8	128	175.4	26.2	-33.8	0	0	0	110.5
557	L	49.4	Very low	56.6	Low	148 Å²	148	125 Å²	125	78%	0.775	62%	0.622	S	S	*	*			trans	-81	136.4	173.8	-77.8	159	0	0	0	109.9	R555	R555-L557 PolarHBondContact O-N 3.03Å
558	N	42.9	Very low	55	Low	137 Å²	137	130.8 Å²	130.8	73%	0.733	64%	0.641	S	S	*	*			trans	54.7	74.3	170	-64.8	-10.6	0	0	0	117.7
559	Q	37.3	Very low	53.7	Low	190 Å²	190	133 Å²	133	89%	0.888	65%	0.65	S	S	*	*			trans	-122.4	88.2	136.3	-75.9	-169.5	-12.3	0	0	109.7
560	L	31.6	Very low	53.1	Low	147 Å²	147	135 Å²	135	77%	0.77	66%	0.656	S	S	*	*			trans	-75	149.5	156.3	-82.3	83.2	0	0	0	108.3
561	N	29.4	Very low	52.9	Low	148 Å²	148	135.7 Å²	135.7	79%	0.791	66%	0.658	S	S	*	*			trans	64.6	74.9	179.7	-58.3	-21.4	0	0	0	116.2
562	L	36.3	Very low	52.9	Low	158 Å²	158	130.6 Å²	130.6	83%	0.827	63%	0.632	S	S	*	*			trans	-147.5	124.8	130.3	-139.7	75.6	0	0	0	111.1	N564	L562-N564 PolarHBondContact O-N 3.07Å
563	Y	29.3	Very low	53	Low	236 Å²	236	128.8 Å²	128.8	93%	0.925	62%	0.624	S	S	*	*			trans	-79.2	101.9	169.4	-90	-98.1	0	0	0	109
564	N	33.2	Very low	53.3	Low	151 Å²	151	124.7 Å²	124.7	81%	0.807	60%	0.596	S	S	*	*			trans	-154.8	148.1	151.1	-123.1	-21.3	0	0	0	112.1	L562 D566	L562-N564 PolarHBondContact O-N 3.07Å; N564-D566 PolarHBondContact O-N 2.79Å
565	T	30.2	Very low	54.1	Low	133 Å²	133	125 Å²	125	82%	0.816	60%	0.599	S	S	*	*			trans	-88	98	-174.4	48.8	0	0	0	0	111.4
566	D	33.8	Very low	55	Low	149 Å²	149	116.3 Å²	116.3	80%	0.797	57%	0.566	S	S	*	*			trans	-152.4	174.2	160.6	-128.2	-43	0	0	0	113.8	N564	N564-D566 PolarHBondContact O-N 2.79Å
567	R	45.4	Very low	56.2	Low	209 Å²	209	116.1 Å²	116.1	79%	0.789	56%	0.561	S	S	*	*			trans	-56.5	134.5	-163.3	-60.2	179.5	-175.4	-170.2	0	114.4	Q569	R567-Q569 PolarHBondContact O-N 3.34Å
568	R	52.5	Low	57.7	Low	220 Å²	220	112.9 Å²	112.9	83%	0.83	54%	0.544	S	S	*	.			trans	-59.3	107.3	172.4	-69.1	-179.9	-178.9	162.1	1.1	111	I570	R568-I570 PolarHBondContact O-N 2.98Å
569	Q	61.7	Low	59.4	Low	104 Å²	104	114.2 Å²	114.2	49%	0.486	55%	0.546	S	S	.	.			trans	-74.8	114.5	-179.6	-163.2	169.3	15.6	0	0	111	R567	R567-Q569 PolarHBondContact O-N 3.34Å
570	I	71.2	Confident	61.7	Low	99 Å²	99	112.1 Å²	112.1	51%	0.508	53%	0.53	S	S	.	.			trans	-96.2	138.4	176.1	-57.8	175.4	0	0	0	108.6	Y550 P553 R568	Y550-I570 HydrophobicContact CD2-CG2 4.1Å; Y550-I570 HydrophobicContact CE2-CG2 4.44Å; Y550-I570 WeakPolarHBondContact CE2-O 3.13Å; P553-I570 HydrophobicContact CB-CG2 3.88Å; R568-I570 PolarHBondContact O-N 2.98Å
571	W	83.6	Confident	64.2	Low	37 Å²	37	106.4 Å²	106.4	14%	0.14	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	157.6	-178.5	-69.9	52.1	0	0	0	109.6	P553 T554 F680 F707	P553-W571 CarbonylContact C-O 3.45Å; P553-W571 WeakPolarHBondContact CA-O 3.34Å; T554-W571 HydrophobicContact CG2-CB 3.46Å; T554-W571 VanDerWaalsContact CG2-CB 3.46Å; T554-W571 PolarHBondContact N-O 2.74Å; T554-W571 PolarHBondContact O-N 2.87Å; W571-F680 HydrophobicContact CE3-CD1 4.12Å; W571-F680 HydrophobicContact CH2-CB 4.05Å; W571-F680 HydrophobicContact CH2-CD1 4.12Å; W571-F680 HydrophobicContact CH2-CG 4.12Å; W571-F680 HydrophobicContact CZ3-CB 3.67Å; W571-F680 AromaticContact CZ3-CD1 3.4Å; W571-F680 HydrophobicContact CZ3-CD1 3.4Å; W571-F680 VanDerWaalsContact CZ3-CD1 3.4Å; W571-F680 HydrophobicContact CZ3-CE1 4.26Å; W571-F680 AromaticContact CZ3-CG 3.74Å; W571-F680 HydrophobicContact CZ3-CG 3.74Å; W571-F707 HydrophobicContact CB-CB 4.4Å; W571-F707 HydrophobicContact CD2-CB 3.57Å; W571-F707 HydrophobicContact CD2-CG 4.37Å; W571-F707 HydrophobicContact CE3-CB 3.73Å; W571-F707 HydrophobicContact CG-CB 3.85Å; W571-F707 HydrophobicContact CH2-CD1 4.14Å; W571-F707 HydrophobicContact CZ2-CB 4.46Å; W571-F707 AromaticContact CZ2-CD1 3.93Å; W571-F707 HydrophobicContact CZ2-CD1 3.93Å; W571-F707 HydrophobicContact CZ3-CB 4.23Å
572	G	84.4	Confident	66.9	Low	0 Å²	0	102.1 Å²	102.1	0%	0	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	155.1	166.2	0	0	0	0	0	111.6	Y550 K552 F707 V708 E709	Y550-G572 VanDerWaalsContact CG-CA 3.45Å; K552-G572 CarbonylContact O-C 3.45Å; G572-F707 PolarHBondContact N-O 2.87Å; G572-V708 CarbonylContact O-C 3.57Å; G572-V708 WeakPolarHBondContact O-CA 3.23Å; G572-E709 PolarHBondContact O-N 3.3Å
573	K	85.5	Confident	69.4	Low	54 Å²	54	94.7 Å²	94.7	24%	0.235	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.4	175.6	-146.6	168	-171	-127.5	0	110.1	K552 T554 E709 E711	K552-K573 HydrophobicContact CB-CB 3.82Å; K552-K573 WeakPolarHBondContact CB-O 3.28Å; K552-K573 HydrophobicContact CD-CB 4.41Å; K552-K573 PolarHBondContact O-N 2.91Å; T554-K573 HydrophobicContact CG2-CB 4.03Å; T554-K573 HydrophobicContact CG2-CD 4.3Å; T554-K573 HydrophobicContact CG2-CG 4.3Å; K573-E709 WeakPolarHBondContact CA-O 3.22Å; K573-E709 HydrophobicContact CD-CG 4.43Å; K573-E709 WeakPolarHBondContact CD-OE2 3.34Å; K573-E709 WeakPolarHBondContact CE-OE1 3.36Å; K573-E709 WeakPolarHBondContact CE-OE2 3.29Å; K573-E709 HydrophobicContact CG-CB 4.11Å; K573-E709 HydrophobicContact CG-CG 4.03Å; K573-E709 IonicContact NZ-OE1 2.75Å; K573-E711 HydrophobicContact CD-CG 4.01Å; K573-E711 VanDerWaalsContact CD-OE1 3.25Å; K573-E711 WeakPolarHBondContact CD-OE1 3.39Å; K573-E711 WeakPolarHBondContact CE-OE1 3.39Å; K573-E711 HydrophobicContact CG-CB 4.35Å; K573-E711 HydrophobicContact CG-CG 3.94Å; K573-E711 VanDerWaalsContact NZ-CG 3.32Å; K573-E711 IonicContact NZ-OE1 3.95Å; K573-E711 PolarHBondContact NZ-OE1 2.9Å
574	I	87.4	Confident	72.1	Confident	8 Å²	8	83.5 Å²	83.5	4%	0.041	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127.8	175.7	-177.5	166.8	0	0	0	109.9	L578 I583 L669 V708 E709 I710 E711	I574-L578 HydrophobicContact CG1-CD1 4.46Å; I574-I583 HydrophobicContact CB-CG1 4.3Å; I574-I583 HydrophobicContact CD1-CD1 4.12Å; I574-I583 HydrophobicContact CD1-CG1 3.59Å; I574-I583 HydrophobicContact CG1-CG1 4.46Å; I574-L669 HydrophobicContact CG2-CD1 3.95Å; I574-V708 HydrophobicContact CB-CG1 4.4Å; I574-V708 HydrophobicContact CG2-CG1 3.43Å; I574-V708 VanDerWaalsContact CG2-CG1 3.43Å; I574-E709 PolarHBondContact N-O 2.96Å; I574-I710 CarbonylContact O-C 3.55Å; I574-I710 WeakPolarHBondContact O-CA 3.43Å; I574-E711 PolarHBondContact O-N 3.28Å
575	T	86.1	Confident	74.7	Confident	33 Å²	33	78.2 Å²	78.2	20%	0.202	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	133.9	173.9	-40.8	0	0	0	0	109.7	K552 L578 E711 T713	K552-T575 PolarHBondContact NZ-OG1 3.25Å; T575-L578 WeakPolarHBondContact O-CD1 3.41Å; T575-L578 VanDerWaalsContact O-CG 3.29Å; T575-L578 WeakPolarHBondContact O-CG 3.31Å; T575-E711 VanDerWaalsContact CA-CB 3.5Å; T575-E711 WeakPolarHBondContact CA-O 3.25Å; T575-E711 HydrophobicContact CG2-CB 4.3Å; T575-E711 PolarHBondContact OG1-OE2 2.8Å; T575-T713 HydrophobicContact CG2-CG2 3.45Å; T575-T713 VanDerWaalsContact CG2-CG2 3.45Å
576	E	86.5	Confident	77.5	Confident	3 Å²	3	71.9 Å²	71.9	1%	0.014	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	176.5	178.2	77.8	-164.8	152.7	0	0	112.4	L578 L669 R671 I710 E711 D712 T713	E576-L578 PolarHBondContact O-N 3.32Å; E576-L669 WeakPolarHBondContact CB-O 3.29Å; E576-R671 WeakPolarHBondContact OE2-CB 3.32Å; E576-R671 PolarHBondContact OE2-N 2.86Å; E576-I710 HydrophobicContact CB-CG2 3.7Å; E576-E711 PolarHBondContact N-O 2.89Å; E576-D712 WeakPolarHBondContact OE1-CA 3.33Å; E576-T713 HydrophobicContact CG-CG2 4.05Å; E576-T713 WeakPolarHBondContact CG-OG1 3.46Å; E576-T713 PolarHBondContact OE1-N 2.69Å; E576-T713 PolarHBondContact OE1-OG1 2.93Å
577	N	82.1	Confident	79.9	Confident	75 Å²	75	66.1 Å²	66.1	40%	0.401	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	-9.1	-177.3	-79.1	-52.5	0	0	0	116.2	L669 D715	N577-L669 PolarHBondContact N-O 2.85Å; N577-D715 PolarHBondContact ND2-OD2 2.96Å
578	L	82	Confident	81.8	Confident	80 Å²	80	56.2 Å²	56.2	42%	0.419	26%	0.259	S	S	.	.			trans	-58.9	138.7	163.9	-60.2	-177.1	0	0	0	110	I574 T575 E576 S581 S668	I574-L578 HydrophobicContact CG1-CD1 4.46Å; T575-L578 WeakPolarHBondContact O-CD1 3.41Å; T575-L578 VanDerWaalsContact O-CG 3.29Å; T575-L578 WeakPolarHBondContact O-CG 3.31Å; E576-L578 PolarHBondContact O-N 3.32Å; L578-S581 WeakPolarHBondContact CB-OG 3.18Å; L578-S668 VanDerWaalsContact O-CA 3.23Å; L578-S668 WeakPolarHBondContact O-CA 3.07Å; L578-S668 WeakPolarHBondContact O-CB 3.01Å
579	E	78.6	Confident	83.2	Confident	165 Å²	165	47.6 Å²	47.6	77%	0.771	23%	0.229	S	C	*	.	S	Bend	trans	-68.6	-158.6	171.5	-59.3	-171.9	166.8	0	0	111.4	S581 S665	E579-S581 VanDerWaalsContact O-CB 3.25Å; E579-S581 WeakPolarHBondContact O-CB 3.3Å; E579-S581 PolarHBondContact O-N 3.23Å; E579-S581 PolarHBondContact O-OG 3.29Å; E579-S665 PolarHBondContact O-OG 2.71Å
580	R	85.3	Confident	84	Confident	146 Å²	146	42.7 Å²	42.7	55%	0.551	21%	0.207	S	C	*	.	S	Bend	trans	-51.6	103.8	176.9	165.1	157.6	161.8	-105.8	2.5	111.9	E612 M664 S665	R580-E612 IonicContact CZ-OE1 3.64Å; R580-E612 IonicContact CZ-OE2 2.78Å; R580-E612 IonicContact NE-OE1 3.83Å; R580-E612 PolarHBondContact NE-OE1 3.48Å; R580-E612 IonicContact NH2-OE1 2.71Å; R580-E612 PolarHBondContact NH2-OE1 2.93Å; R580-E612 IonicContact NH2-OE2 3.94Å; R580-E612 PolarHBondContact NH2-OE2 2.85Å; R580-M664 HydrophobicContact CG-CE 3.74Å; R580-S665 WeakPolarHBondContact CA-O 3.17Å; R580-S665 WeakPolarHBondContact CB-O 3.15Å; R580-S665 WeakPolarHBondContact CG-O 3.5Å
581	S	82.7	Confident	84.1	Confident	26 Å²	26	43.1 Å²	43.1	18%	0.182	21%	0.205	C	C	.	.			trans	-131.5	147.7	-164.9	-68.1	0	0	0	0	112.1	L578 E579 M664 S665	L578-S581 WeakPolarHBondContact CB-OG 3.18Å; E579-S581 VanDerWaalsContact O-CB 3.25Å; E579-S581 WeakPolarHBondContact O-CB 3.3Å; E579-S581 PolarHBondContact O-N 3.23Å; E579-S581 PolarHBondContact O-OG 3.29Å; S581-M664 CarbonylContact O-C 3.58Å; S581-M664 VanDerWaalsContact O-CA 3.29Å; S581-M664 WeakPolarHBondContact O-CA 3.41Å; S581-S665 PolarHBondContact N-OG 2.85Å; S581-S665 PolarHBondContact O-N 3.03Å; S581-S665 PolarHBondContact O-OG 2.87Å
582	M	87.6	Confident	83.4	Confident	58 Å²	58	41.5 Å²	41.5	29%	0.286	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	132.7	-179.1	-165.3	171.8	165.9	0	0	110.9	L551 A584 Q585 K662 L663 M664	L551-M582 HydrophobicContact CD1-CB 3.81Å; L551-M582 HydrophobicContact CD1-CG 3.72Å; L551-M582 HydrophobicContact CD1-SD 4.13Å; M582-A584 WeakPolarHBondContact CE-O 3.47Å; M582-Q585 HydrophobicContact CE-CB 4.05Å; M582-K662 HydrophobicContact CE-CB 3.97Å; M582-K662 HydrophobicContact CE-CD 4.45Å; M582-K662 HydrophobicContact CE-CG 3.82Å; M582-K662 HydrophobicContact CG-CB 4.26Å; M582-K662 HydrophobicContact SD-CB 4.01Å; M582-K662 HydrophobicContact SD-CD 3.91Å; M582-K662 HydrophobicContact SD-CG 3.89Å; M582-L663 WeakPolarHBondContact CA-O 3.26Å; M582-M664 VanDerWaalsContact CA-SD 3.51Å; M582-M664 HydrophobicContact CB-CE 4.35Å; M582-M664 HydrophobicContact CB-SD 3.52Å; M582-M664 VanDerWaalsContact CB-SD 3.52Å; M582-M664 HydrophobicContact CG-SD 3.81Å
583	I	87.8	Confident	82.2	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.015	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-45.1	-178.5	-61.9	164	0	0	0	110.4	Y550 L551 I574 F609 L663 V708	Y550-I583 HydrophobicContact CD1-CG2 4.48Å; L551-I583 PolarHBondContact N-O 2.83Å; I574-I583 HydrophobicContact CB-CG1 4.3Å; I574-I583 HydrophobicContact CD1-CD1 4.12Å; I574-I583 HydrophobicContact CD1-CG1 3.59Å; I574-I583 HydrophobicContact CG1-CG1 4.46Å; I583-F609 HydrophobicContact CD1-CD1 3.58Å; I583-F609 HydrophobicContact CD1-CE1 3.49Å; I583-F609 VanDerWaalsContact CD1-CE1 3.49Å; I583-L663 HydrophobicContact CB-CD2 3.98Å; I583-L663 HydrophobicContact CB-CG 4.19Å; I583-L663 HydrophobicContact CD1-CG 4.43Å; I583-L663 HydrophobicContact CG2-CD2 3.99Å; I583-L663 PolarHBondContact N-O 3.03Å; I583-V708 HydrophobicContact CG2-CG1 4.42Å; I583-V708 HydrophobicContact CG2-CG2 4.15Å
584	A	86.3	Confident	80.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	155.8	-177	0	0	0	0	0	111.5	I548 S549 Y550 M582 I586 L663	I548-A584 HydrophobicContact CG2-CB 4.36Å; S549-A584 CarbonylContact O-C 3.58Å; S549-A584 VanDerWaalsContact O-CA 3.25Å; S549-A584 WeakPolarHBondContact O-CA 3.27Å; S549-A584 WeakPolarHBondContact O-CB 3.5Å; Y550-A584 HydrophobicContact CD1-CB 3.88Å; Y550-A584 HydrophobicContact CE1-CB 4.47Å; M582-A584 WeakPolarHBondContact CE-O 3.47Å; A584-I586 HydrophobicContact CB-CD1 3.98Å; A584-L663 HydrophobicContact CB-CB 4.19Å; A584-L663 HydrophobicContact CB-CD2 4.1Å; A584-L663 PolarHBondContact O-N 2.96Å
585	Q	88.1	Confident	79.4	Confident	41 Å²	41	41.8 Å²	41.8	19%	0.192	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	127.3	154.5	178.6	177.8	-26.3	0	0	108	S549 M582 I614 M660	S549-Q585 PolarHBondContact N-O 2.8Å; S549-Q585 PolarHBondContact O-N 2.84Å; M582-Q585 HydrophobicContact CE-CB 4.05Å; Q585-I614 HydrophobicContact CG-CD1 4.47Å; Q585-M660 PolarHBondContact NE2-SD 2.85Å; Q585-M660 VanDerWaalsContact NE2-SD 3.39Å
586	I	88.5	Confident	77.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128	173.3	-48.5	-61.3	0	0	0	107	I546 F547 I548 A584 V588 L611 M660 Y661 L663 I685 I706	I546-I586 HydrophobicContact CG2-CG2 3.89Å; F547-I586 WeakPolarHBondContact O-CA 3.46Å; I548-I586 HydrophobicContact CB-CD1 4.36Å; I548-I586 HydrophobicContact CG1-CD1 4.13Å; I548-I586 HydrophobicContact CG2-CD1 3.96Å; A584-I586 HydrophobicContact CB-CD1 3.98Å; I586-V588 HydrophobicContact CG2-CG2 4.03Å; I586-L611 HydrophobicContact CG1-CD2 3.97Å; I586-M660 CarbonylContact O-C 3.51Å; I586-M660 VanDerWaalsContact O-CA 3.32Å; I586-M660 WeakPolarHBondContact O-CA 3.32Å; I586-Y661 PolarHBondContact N-O 3.49Å; I586-Y661 PolarHBondContact O-N 3.46Å; I586-L663 HydrophobicContact CD1-CB 4.34Å; I586-L663 HydrophobicContact CG1-CB 4.06Å; I586-I685 HydrophobicContact CB-CD1 4.44Å; I586-I685 HydrophobicContact CD1-CD1 3.64Å; I586-I685 HydrophobicContact CG1-CD1 3.64Å; I586-I685 HydrophobicContact CG2-CD1 4.03Å; I586-I706 HydrophobicContact CD1-CD1 4.23Å
587	T	85.2	Confident	76.3	Confident	28 Å²	28	48.7 Å²	48.7	17%	0.172	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125.6	175.9	-58.3	0	0	0	0	107.6	F547 I589 T658 K659 M660	F547-T587 WeakPolarHBondContact CA-O 3.11Å; F547-T587 WeakPolarHBondContact CB-O 3.47Å; F547-T587 PolarHBondContact N-O 3.16Å; F547-T587 PolarHBondContact O-N 3.25Å; T587-I589 HydrophobicContact CG2-CD1 4.41Å; T587-I589 HydrophobicContact CG2-CG1 4.09Å; T587-T658 HydrophobicContact CG2-CG2 3.52Å; T587-K659 WeakPolarHBondContact CA-O 3.5Å; T587-M660 HydrophobicContact CG2-CG 4.32Å
588	V	85.2	Confident	75	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.5	-178	-175.4	0	0	0	0	107.3	P544 E545 I546 I586 I600 T658 K659 Y661 C687	P544-V588 HydrophobicContact CB-CG1 3.84Å; E545-V588 WeakPolarHBondContact O-CA 3.41Å; I546-V588 HydrophobicContact CG1-CG1 4.41Å; I546-V588 HydrophobicContact CG1-CG2 4.38Å; I546-V588 HydrophobicContact CG2-CG2 4.39Å; I586-V588 HydrophobicContact CG2-CG2 4.03Å; V588-I600 HydrophobicContact CG1-CG2 3.93Å; V588-T658 CarbonylContact O-C 3.55Å; V588-T658 WeakPolarHBondContact O-CA 3.49Å; V588-K659 HydrophobicContact CB-CB 4.44Å; V588-K659 PolarHBondContact N-O 2.81Å; V588-K659 PolarHBondContact O-N 3.38Å; V588-Y661 HydrophobicContact CG2-CD2 4.4Å; V588-Y661 HydrophobicContact CG2-CE2 4.37Å; V588-C687 HydrophobicContact CG1-CB 4.33Å
589	I	81.4	Confident	74.6	Confident	40 Å²	40	45.2 Å²	45.2	21%	0.205	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	118.7	-174.6	-54.3	-177	0	0	0	107.7	E545 F547 T587 P656 T658	E545-I589 PolarHBondContact N-O 3.31Å; E545-I589 PolarHBondContact O-N 3.34Å; F547-I589 HydrophobicContact CD2-CD1 3.98Å; F547-I589 HydrophobicContact CD2-CG1 4.04Å; F547-I589 HydrophobicContact CE2-CB 4.12Å; F547-I589 HydrophobicContact CE2-CD1 3.73Å; F547-I589 HydrophobicContact CE2-CG1 3.94Å; T587-I589 HydrophobicContact CG2-CD1 4.41Å; T587-I589 HydrophobicContact CG2-CG1 4.09Å; I589-P656 HydrophobicContact CG2-CB 3.72Å; I589-P656 HydrophobicContact CG2-CG 3.85Å; I589-T658 HydrophobicContact CG1-CG2 4.37Å
590	D	78.2	Confident	74.6	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	145.8	165.3	-147.2	-36.9	0	0	0	110.6	D592 I600 L657	D590-D592 PolarHBondContact OD1-N 3.34Å; D590-I600 HydrophobicContact CB-CD1 3.74Å; D590-I600 HydrophobicContact CB-CG1 4.38Å; D590-L657 HydrophobicContact CB-CB 4.24Å; D590-L657 PolarHBondContact N-O 2.82Å; D590-L657 VanDerWaalsContact N-O 3.14Å
591	K	72.7	Confident	74.6	Confident	108 Å²	108	33.4 Å²	33.4	47%	0.47	18%	0.18	S	C	.	.			trans	-105.8	-23.9	175.6	-72.4	174.5	-179.5	167.5	0	111.4	H542 E545	H542-K591 HydrophobicContact CB-CB 3.86Å; E545-K591 VanDerWaalsContact CD-CE 3.5Å; E545-K591 IonicContact OE1-NZ 3.87Å; E545-K591 PolarHBondContact OE1-NZ 2.88Å; E545-K591 WeakPolarHBondContact OE2-CE 3.05Å; E545-K591 IonicContact OE2-NZ 2.78Å; E545-K591 PolarHBondContact OE2-NZ 3.07Å
592	D	70.2	Confident	75	Confident	3 Å²	3	32.7 Å²	32.7	2%	0.016	18%	0.175	C	C	.	.	S	Bend	trans	-64.9	139.3	171.7	-67.8	-23.1	0	0	0	108.7	N540 D541 H542 D590 L595 L695	N540-D592 WeakPolarHBondContact CA-OD2 3.22Å; N540-D592 PolarHBondContact ND2-OD2 3.27Å; D541-D592 PolarHBondContact N-OD1 2.86Å; D541-D592 PolarHBondContact N-OD2 3.05Å; H542-D592 VanDerWaalsContact CB-OD1 3.29Å; H542-D592 WeakPolarHBondContact CB-OD1 3.21Å; H542-D592 IonicContact CG-OD1 3.17Å; H542-D592 VanDerWaalsContact N-CG 3.34Å; H542-D592 PolarHBondContact N-OD1 3.05Å; H542-D592 PolarHBondContact N-OD2 3.33Å; H542-D592 IonicContact ND1-OD1 3.2Å; H542-D592 PolarHBondContact ND1-OD1 2.78Å; D590-D592 PolarHBondContact OD1-N 3.34Å; D592-L595 HydrophobicContact CB-CD1 3.49Å; D592-L595 VanDerWaalsContact CB-CD1 3.49Å; D592-L595 WeakPolarHBondContact O-CD1 3.43Å; D592-L695 HydrophobicContact CB-CD1 4.05Å
593	S	58.7	Low	75.1	Confident	18 Å²	18	35.8 Å²	35.8	13%	0.126	19%	0.187	C	C	.	.	S	Bend	trans	-104.3	-13.3	-135.1	88	0	0	0	0	113.3	R480 D538	R480-S593 PolarHBondContact NH1-O 3.31Å; R480-S593 PolarHBondContact NH2-O 3.39Å; R480-S593 PolarHBondContact NH2-OG 2.86Å; D538-S593 WeakPolarHBondContact CB-OG 3.2Å; D538-S593 VanDerWaalsContact OD2-CA 3.27Å; D538-S593 WeakPolarHBondContact OD2-CA 3.45Å; D538-S593 WeakPolarHBondContact OD2-CB 3.48Å; D538-S593 PolarHBondContact OD2-N 3.29Å; D538-S593 PolarHBondContact OD2-OG 3.49Å
594	T	59	Low	75.3	Confident	39 Å²	39	37.5 Å²	37.5	24%	0.239	20%	0.197	C	C	.	.	S	Bend	trans	-121.2	7.8	-179.2	80.4	0	0	0	0	114.9	D538 L695	D538-T594 HydrophobicContact CB-CG2 4.21Å; D538-T594 PolarHBondContact OD2-N 2.93Å; T594-L695 VanDerWaalsContact OG1-CD2 3.3Å; T594-L695 WeakPolarHBondContact OG1-CD2 3.32Å
595	L	56	Low	75.5	Confident	10 Å²	10	41.8 Å²	41.8	5%	0.052	22%	0.22	C	C	.	.			trans	-63.6	148.4	175.9	-65.3	91.9	0	0	0	110.4	D592 D599 L657 D689 N690 L695	D592-L595 HydrophobicContact CB-CD1 3.49Å; D592-L595 VanDerWaalsContact CB-CD1 3.49Å; D592-L595 WeakPolarHBondContact O-CD1 3.43Å; L595-D599 HydrophobicContact CB-CB 4.24Å; L595-D599 HydrophobicContact CD2-CB 3.92Å; L595-L657 HydrophobicContact CB-CD1 4.08Å; L595-L657 WeakPolarHBondContact O-CD1 3.2Å; L595-L657 WeakPolarHBondContact O-CD2 3.49Å; L595-D689 HydrophobicContact CD2-CB 3.87Å; L595-N690 HydrophobicContact CD2-CB 4.32Å; L595-L695 HydrophobicContact CD1-CD1 3.56Å; L595-L695 HydrophobicContact CG-CD1 4.21Å
596	T	54.7	Low	75.4	Confident	51 Å²	51	41.1 Å²	41.1	31%	0.313	22%	0.218	S	C	.	.			trans	-83.5	166	170.6	76.9	0	0	0	0	110.3	S598 D599	T596-S598 PolarHBondContact O-N 2.58Å; T596-S598 WeakPolarHBondContact OG1-CB 3.49Å; T596-S598 PolarHBondContact OG1-N 3.35Å; T596-S598 PolarHBondContact OG1-OG 3.04Å; T596-D599 WeakPolarHBondContact CA-OD2 3.39Å; T596-D599 VanDerWaalsContact CB-OD2 3.27Å; T596-D599 WeakPolarHBondContact CB-OD2 3.42Å; T596-D599 PolarHBondContact N-OD2 2.76Å; T596-D599 PolarHBondContact O-N 2.72Å; T596-D599 PolarHBondContact OG1-OD2 2.71Å
597	Q	52	Low	75.3	Confident	131 Å²	131	46.5 Å²	46.5	61%	0.612	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-4.1	167.8	-72.4	-175.8	3.3	0	0	113.3	L657 K659	Q597-L657 HydrophobicContact CG-CD2 4.23Å; Q597-K659 WeakPolarHBondContact O-CE 3.06Å; Q597-K659 PolarHBondContact O-NZ 2.58Å
598	S	55.5	Low	75.3	Confident	81 Å²	81	48.1 Å²	48.1	57%	0.566	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-33.3	174.8	-31.3	0	0	0	0	112.8	T596	T596-S598 PolarHBondContact O-N 2.58Å; T596-S598 WeakPolarHBondContact OG1-CB 3.49Å; T596-S598 PolarHBondContact OG1-N 3.35Å; T596-S598 PolarHBondContact OG1-OG 3.04Å
599	D	72.8	Confident	75.6	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	26%	0.259	C	S	.	.	S	Bend	trans	-85.5	-19.9	-152.6	-61.3	-57.8	0	0	0	115.3	L595 T596 D689 Q691 H692	L595-D599 HydrophobicContact CB-CB 4.24Å; L595-D599 HydrophobicContact CD2-CB 3.92Å; T596-D599 WeakPolarHBondContact CA-OD2 3.39Å; T596-D599 VanDerWaalsContact CB-OD2 3.27Å; T596-D599 WeakPolarHBondContact CB-OD2 3.42Å; T596-D599 PolarHBondContact N-OD2 2.76Å; T596-D599 PolarHBondContact O-N 2.72Å; T596-D599 PolarHBondContact OG1-OD2 2.71Å; D599-D689 CarbonylContact O-C 3.52Å; D599-Q691 WeakPolarHBondContact O-CG 3.37Å; D599-H692 IonicContact OD1-CE1 3.69Å; D599-H692 IonicContact OD1-CG 2.77Å; D599-H692 IonicContact OD1-ND1 2.71Å; D599-H692 PolarHBondContact OD1-ND1 2.96Å
600	I	78.7	Confident	76	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	27%	0.268	C	S	.	.			trans	-81.5	119.2	174.5	-52.9	165.9	0	0	0	109.1	V588 D590 L657 K659 I688	V588-I600 HydrophobicContact CG1-CG2 3.93Å; D590-I600 HydrophobicContact CB-CD1 3.74Å; D590-I600 HydrophobicContact CB-CG1 4.38Å; I600-L657 HydrophobicContact CD1-CB 4.4Å; I600-K659 HydrophobicContact CB-CD 3.91Å; I600-K659 HydrophobicContact CB-CG 4.33Å; I600-K659 HydrophobicContact CD1-CG 4.33Å; I600-K659 HydrophobicContact CG2-CD 4.31Å; I600-K659 WeakPolarHBondContact O-CD 3.48Å; I600-K659 WeakPolarHBondContact O-CE 3.5Å; I600-K659 PolarHBondContact O-NZ 2.77Å; I600-I688 WeakPolarHBondContact CA-O 3.42Å
601	L	85.7	Confident	76.5	Confident	61 Å²	61	50.9 Å²	50.9	32%	0.319	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	107.3	-179.9	-179.8	60	0	0	0	111.4	C687 I688 Q691	L601-C687 WeakPolarHBondContact O-CA 3.22Å; L601-I688 PolarHBondContact N-O 2.87Å; L601-I688 PolarHBondContact O-N 2.84Å; L601-Q691 HydrophobicContact CB-CG 3.87Å; L601-Q691 HydrophobicContact CD2-CG 4.31Å
602	C	90.3	Very high	77.2	Confident	10 Å²	10	48 Å²	48	7%	0.068	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	141.6	177.5	-59.8	0	0	0	0	113.3	L611 Y661 I685 I686 C687	C602-L611 HydrophobicContact CB-CD1 4.09Å; C602-Y661 HydrophobicContact CB-CD2 4.36Å; C602-Y661 HydrophobicContact CB-CE2 3.66Å; C602-I685 HydrophobicContact CB-CG2 4.46Å; C602-I686 CarbonylContact C-O 3.59Å; C602-I686 VanDerWaalsContact CA-O 3.32Å; C602-I686 WeakPolarHBondContact CA-O 3.46Å; C602-C687 HydrophobicContact CB-CB 4.17Å; C602-C687 WeakPolarHBondContact CB-SG 3.28Å; C602-C687 WeakPolarHBondContact SG-CB 3.33Å; C602-C687 CovalentContact SG-SG 2.04Å; C602-C687 PolarHBondContact SG-SG 3.08Å
603	K	91.1	Very high	77.8	Confident	124 Å²	124	52.2 Å²	52.2	54%	0.539	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	154.4	-179.5	-66.2	173.1	-175.5	160.7	0	111.1	I685 I686	K603-I685 WeakPolarHBondContact O-CA 3.46Å; K603-I686 PolarHBondContact N-O 3.14Å; K603-I686 PolarHBondContact O-N 2.81Å
604	T	91.2	Very high	78.8	Confident	38 Å²	38	53.6 Å²	53.6	23%	0.233	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	150.3	167.8	47.5	0	0	0	0	110.4	D606 F609 L611 L663 F683	T604-D606 PolarHBondContact OG1-O 3.11Å; T604-F609 HydrophobicContact CG2-CB 4.16Å; T604-F609 PolarHBondContact OG1-O 2.95Å; T604-L611 HydrophobicContact CG2-CD1 4.17Å; T604-L611 HydrophobicContact CG2-CG 4.04Å; T604-L663 HydrophobicContact CG2-CD1 4.34Å; T604-F683 HydrophobicContact CG2-CD2 4.39Å; T604-F683 HydrophobicContact CG2-CE2 3.9Å
605	N	89.8	Confident	78.8	Confident	91 Å²	91	57.1 Å²	57.1	49%	0.487	30%	0.304	S	S	.	.	S	Bend	trans	-92.4	-2.7	169.1	66.8	2.4	0	0	0	113.9	F683 S684 I686	N605-F683 WeakPolarHBondContact OD1-CB 3.32Å; N605-S684 PolarHBondContact N-O 3.21Å; N605-S684 VanDerWaalsContact N-O 3.08Å; N605-S684 VanDerWaalsContact ND2-CB 3.28Å; N605-S684 WeakPolarHBondContact ND2-CB 3.32Å; N605-S684 PolarHBondContact ND2-N 3.23Å; N605-S684 PolarHBondContact ND2-OG 3.13Å; N605-S684 PolarHBondContact OD1-N 3.05Å; N605-S684 PolarHBondContact OD1-O 3.19Å; N605-S684 VanDerWaalsContact OD1-O 3.14Å; N605-I686 HydrophobicContact CB-CD1 4.49Å
606	D	86.8	Confident	78.5	Confident	26 Å²	26	59.1 Å²	59.1	14%	0.139	32%	0.315	C	S	.	.	S	Bend	trans	-118.3	122.8	176.8	-177.3	-27.3	0	0	0	110.3	T604 R608 F609 F683	T604-D606 PolarHBondContact OG1-O 3.11Å; D606-R608 PolarHBondContact O-N 3.44Å; D606-R608 VanDerWaalsContact OD1-CB 3.31Å; D606-R608 WeakPolarHBondContact OD1-CB 3.49Å; D606-R608 WeakPolarHBondContact OD1-CG 3.49Å; D606-R608 PolarHBondContact OD1-N 2.8Å; D606-R608 IonicContact OD1-NE 2.77Å; D606-R608 PolarHBondContact OD1-NE 2.89Å; D606-R608 VanDerWaalsContact OD1-NE 3.16Å; D606-R608 IonicContact OD2-CZ 3.43Å; D606-R608 VanDerWaalsContact OD2-CZ 3.29Å; D606-R608 IonicContact OD2-NE 3.21Å; D606-R608 PolarHBondContact OD2-NE 2.66Å; D606-R608 VanDerWaalsContact OD2-NE 3.11Å; D606-R608 IonicContact OD2-NH2 3.56Å; D606-R608 PolarHBondContact OD2-NH2 3.35Å; D606-F609 HydrophobicContact CB-CD2 4Å; D606-F609 HydrophobicContact CB-CE2 4.41Å; D606-F609 PolarHBondContact O-N 3.5Å; D606-F683 HydrophobicContact CB-CB 3.63Å; D606-F683 HydrophobicContact CB-CD2 4.47Å; D606-F683 HydrophobicContact CB-CG 4.11Å
607	S	86.5	Confident	77.8	Confident	113 Å²	113	64.5 Å²	64.5	79%	0.79	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	3.2	-175.8	61.1	0	0	0	0	115.1	F609 I666	S607-F609 VanDerWaalsContact C-N 3.34Å; S607-I666 WeakPolarHBondContact O-CD1 3.49Å
608	R	85.6	Confident	77	Confident	63 Å²	63	66.4 Å²	66.4	24%	0.238	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-16	168.7	-65.6	175.8	-69.9	178.2	2.6	112.5	D606 I666 Q677	D606-R608 PolarHBondContact O-N 3.44Å; D606-R608 VanDerWaalsContact OD1-CB 3.31Å; D606-R608 WeakPolarHBondContact OD1-CB 3.49Å; D606-R608 WeakPolarHBondContact OD1-CG 3.49Å; D606-R608 PolarHBondContact OD1-N 2.8Å; D606-R608 IonicContact OD1-NE 2.77Å; D606-R608 PolarHBondContact OD1-NE 2.89Å; D606-R608 VanDerWaalsContact OD1-NE 3.16Å; D606-R608 IonicContact OD2-CZ 3.43Å; D606-R608 VanDerWaalsContact OD2-CZ 3.29Å; D606-R608 IonicContact OD2-NE 3.21Å; D606-R608 PolarHBondContact OD2-NE 2.66Å; D606-R608 VanDerWaalsContact OD2-NE 3.11Å; D606-R608 IonicContact OD2-NH2 3.56Å; D606-R608 PolarHBondContact OD2-NH2 3.35Å; R608-I666 PolarHBondContact O-N 3.18Å; R608-Q677 VanDerWaalsContact NH1-CD 3.34Å
609	F	90.4	Very high	76.2	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.009	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.2	-173	-52.3	-80.3	0	0	0	112.8	I583 T604 D606 S607 L663 M664 L669 I681 F683	I583-F609 HydrophobicContact CD1-CD1 3.58Å; I583-F609 HydrophobicContact CD1-CE1 3.49Å; I583-F609 VanDerWaalsContact CD1-CE1 3.49Å; T604-F609 HydrophobicContact CG2-CB 4.16Å; T604-F609 PolarHBondContact OG1-O 2.95Å; D606-F609 HydrophobicContact CB-CD2 4Å; D606-F609 HydrophobicContact CB-CE2 4.41Å; D606-F609 PolarHBondContact O-N 3.5Å; S607-F609 VanDerWaalsContact C-N 3.34Å; F609-L663 HydrophobicContact CB-CD1 4.03Å; F609-M664 CarbonylContact C-O 3.52Å; F609-M664 VanDerWaalsContact CA-O 3.27Å; F609-M664 WeakPolarHBondContact CA-O 3.37Å; F609-L669 HydrophobicContact CE1-CD1 4.12Å; F609-L669 HydrophobicContact CZ-CD1 4.37Å; F609-I681 HydrophobicContact CE2-CG2 3.89Å; F609-I681 HydrophobicContact CZ-CD1 4Å; F609-I681 HydrophobicContact CZ-CG2 4.01Å; F609-F683 HydrophobicContact CB-CE2 4.41Å; F609-F683 HydrophobicContact CB-CZ 4.25Å; F609-F683 HydrophobicContact CD1-CE1 4.23Å; F609-F683 HydrophobicContact CD1-CZ 4.39Å; F609-F683 AromaticContact CD2-CD1 3.72Å; F609-F683 HydrophobicContact CD2-CD1 3.72Å; F609-F683 HydrophobicContact CD2-CD2 4.38Å; F609-F683 AromaticContact CD2-CE1 3.65Å; F609-F683 HydrophobicContact CD2-CE1 3.65Å; F609-F683 HydrophobicContact CD2-CE2 4.34Å; F609-F683 HydrophobicContact CD2-CG 4.1Å; F609-F683 AromaticContact CD2-CZ 3.98Å; F609-F683 HydrophobicContact CD2-CZ 3.98Å; F609-F683 HydrophobicContact CE1-CE1 4.25Å; F609-F683 AromaticContact CE2-CD1 3.59Å; F609-F683 HydrophobicContact CE2-CD1 3.59Å; F609-F683 AromaticContact CE2-CE1 3.68Å; F609-F683 HydrophobicContact CE2-CE1 3.68Å; F609-F683 HydrophobicContact CE2-CG 4.29Å; F609-F683 HydrophobicContact CE2-CZ 4.46Å; F609-F683 HydrophobicContact CG-CD1 4.46Å; F609-F683 AromaticContact CG-CE1 3.94Å; F609-F683 HydrophobicContact CG-CE1 3.94Å; F609-F683 HydrophobicContact CG-CE2 4.45Å; F609-F683 AromaticContact CG-CZ 3.94Å; F609-F683 HydrophobicContact CG-CZ 3.94Å; F609-F683 HydrophobicContact CZ-CD1 4.22Å; F609-F683 AromaticContact CZ-CE1 3.99Å; F609-F683 HydrophobicContact CZ-CE1 3.99Å
610	L	90.2	Very high	74.3	Confident	74 Å²	74	75.3 Å²	75.3	39%	0.387	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.8	177.4	-175.8	60.8	0	0	0	110.6	E612 M664 I666	L610-E612 HydrophobicContact CD2-CG 3.75Å; L610-E612 HydrophobicContact CG-CG 3.92Å; L610-M664 PolarHBondContact N-O 2.78Å; L610-M664 PolarHBondContact O-N 2.75Å; L610-I666 HydrophobicContact CB-CD1 3.93Å; L610-I666 HydrophobicContact CB-CG1 3.75Å
611	L	89.7	Confident	72	Confident	23 Å²	23	85.9 Å²	85.9	12%	0.12	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118.5	164.9	-69.7	167.4	0	0	0	108.8	I586 C602 T604 Y661 K662 L663 I685	I586-L611 HydrophobicContact CG1-CD2 3.97Å; C602-L611 HydrophobicContact CB-CD1 4.09Å; T604-L611 HydrophobicContact CG2-CD1 4.17Å; T604-L611 HydrophobicContact CG2-CG 4.04Å; L611-Y661 HydrophobicContact CB-CD1 3.97Å; L611-Y661 HydrophobicContact CB-CG 4.23Å; L611-Y661 HydrophobicContact CD2-CG 4.45Å; L611-K662 WeakPolarHBondContact CA-O 3.24Å; L611-L663 HydrophobicContact CD2-CB 4.33Å; L611-L663 HydrophobicContact CD2-CD1 4.14Å; L611-I685 HydrophobicContact CD1-CD1 4.45Å; L611-I685 HydrophobicContact CD1-CG1 4.4Å; L611-I685 HydrophobicContact CD1-CG2 3.99Å; L611-I685 HydrophobicContact CD2-CD1 4.02Å
612	E	87.3	Confident	69.3	Low	47 Å²	47	90 Å²	90	22%	0.22	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.7	178	-63.1	-178.7	-155.3	0	0	109.7	R580 L610 I614 Y661 K662 M664	R580-E612 IonicContact CZ-OE1 3.64Å; R580-E612 IonicContact CZ-OE2 2.78Å; R580-E612 IonicContact NE-OE1 3.83Å; R580-E612 PolarHBondContact NE-OE1 3.48Å; R580-E612 IonicContact NH2-OE1 2.71Å; R580-E612 PolarHBondContact NH2-OE1 2.93Å; R580-E612 IonicContact NH2-OE2 3.94Å; R580-E612 PolarHBondContact NH2-OE2 2.85Å; L610-E612 HydrophobicContact CD2-CG 3.75Å; L610-E612 HydrophobicContact CG-CG 3.92Å; E612-I614 PolarHBondContact O-N 3.29Å; E612-Y661 CarbonylContact O-C 3.57Å; E612-Y661 WeakPolarHBondContact O-CA 3.35Å; E612-K662 HydrophobicContact CB-CB 4.35Å; E612-K662 PolarHBondContact N-O 2.87Å; E612-K662 PolarHBondContact O-N 3.29Å; E612-M664 HydrophobicContact CG-CG 4.11Å; E612-M664 WeakPolarHBondContact OE1-CG 3.17Å
613	E	82.1	Confident	66.5	Low	91 Å²	91	97.1 Å²	97.1	43%	0.425	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	129	-174.8	-165.7	159.2	-163.3	0	0	111.8	N615 K659 Y661	E613-N615 PolarHBondContact O-N 3.03Å; E613-N615 VanDerWaalsContact O-N 3.11Å; E613-K659 VanDerWaalsContact OE1-CD 3.26Å; E613-K659 WeakPolarHBondContact OE1-CD 3.31Å; E613-K659 WeakPolarHBondContact OE1-CE 3.49Å; E613-K659 IonicContact OE1-NZ 2.72Å; E613-K659 PolarHBondContact OE1-NZ 2.69Å; E613-K659 IonicContact OE2-NZ 2.83Å; E613-Y661 HydrophobicContact CB-CD1 3.96Å; E613-Y661 HydrophobicContact CB-CE1 3.86Å; E613-Y661 HydrophobicContact CG-CD1 4.33Å; E613-Y661 HydrophobicContact CG-CE1 3.98Å
614	I	79.2	Confident	63.6	Low	47 Å²	47	96.5 Å²	96.5	24%	0.241	49%	0.486	C	S	.	.			trans	-86.7	80.8	-180	-53.7	-179	0	0	0	108.1	Q585 E612 N616 M660 K662	Q585-I614 HydrophobicContact CG-CD1 4.47Å; E612-I614 PolarHBondContact O-N 3.29Å; I614-N616 PolarHBondContact O-N 3.14Å; I614-N616 VanDerWaalsContact O-N 3.1Å; I614-M660 HydrophobicContact CB-CB 4.08Å; I614-M660 WeakPolarHBondContact CB-O 3.27Å; I614-M660 HydrophobicContact CD1-CB 4.08Å; I614-M660 HydrophobicContact CG1-CB 4.34Å; I614-M660 HydrophobicContact CG2-CE 4.42Å; I614-M660 PolarHBondContact N-O 3.29Å; I614-K662 HydrophobicContact CD1-CG 3.73Å; I614-K662 HydrophobicContact CG1-CG 3.75Å
615	N	59.6	Low	60.8	Low	113 Å²	113	100.8 Å²	100.8	60%	0.604	52%	0.515	S	S	*	.			trans	-57.2	113.6	176.8	-67.2	-9.8	0	0	0	110.5	E613 H617	E613-N615 PolarHBondContact O-N 3.03Å; E613-N615 VanDerWaalsContact O-N 3.11Å; N615-H617 PolarHBondContact O-N 2.88Å
616	N	50.4	Low	58.1	Low	52 Å²	52	100.7 Å²	100.7	28%	0.278	52%	0.522	S	S	.	.			trans	-68.9	2.1	-174	-78	-46.4	0	0	0	115.2	I614 H618 L619 M660	I614-N616 PolarHBondContact O-N 3.14Å; I614-N616 VanDerWaalsContact O-N 3.1Å; N616-H618 PolarHBondContact O-N 2.79Å; N616-L619 PolarHBondContact O-N 2.85Å; N616-L619 VanDerWaalsContact O-N 3.07Å; N616-M660 WeakPolarHBondContact OD1-CE 3.36Å
617	H	39.5	Very low	55.3	Low	165 Å²	165	105.1 Å²	105.1	76%	0.764	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	15.1	-179	-73.8	-53	0	0	0	116.5	N615	N615-H617 PolarHBondContact O-N 2.88Å
618	H	35.2	Very low	52.6	Low	171 Å²	171	103.5 Å²	103.5	79%	0.792	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.7	0.5	172.2	-83.3	-61.3	0	0	0	114.5	N616 D620	N616-H618 PolarHBondContact O-N 2.79Å; H618-D620 VanDerWaalsContact C-N 3.33Å
619	L	37.2	Very low	49.8	Very low	121 Å²	121	110.7 Å²	110.7	63%	0.634	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-11.7	176.1	-86.2	163.4	0	0	0	114.2	N616 R621	N616-L619 PolarHBondContact O-N 2.85Å; N616-L619 VanDerWaalsContact O-N 3.07Å; L619-R621 PolarHBondContact O-N 2.87Å; L619-R621 VanDerWaalsContact O-N 3.11Å
620	D	33.9	Very low	46.8	Very low	148 Å²	148	119.4 Å²	119.4	79%	0.791	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	14.8	172.5	-60.2	-45.7	0	0	0	113.8	H618	H618-D620 VanDerWaalsContact C-N 3.33Å
621	R	30.2	Very low	43.8	Very low	224 Å²	224	121.5 Å²	121.5	85%	0.845	62%	0.622	S	S	*	*			trans	-135.9	107	168.7	-81.7	-172.3	168	174.3	-3.7	110.7	L619	L619-R621 PolarHBondContact O-N 2.87Å; L619-R621 VanDerWaalsContact O-N 3.11Å
622	L	30	Very low	40.9	Very low	147 Å²	147	130.5 Å²	130.5	77%	0.77	66%	0.655	S	S	*	*			trans	-74.4	-177.1	165.2	-77.7	80.1	0	0	0	110.8
623	D	30.3	Very low	38.2	Very low	160 Å²	160	135.6 Å²	135.6	86%	0.856	68%	0.683	S	S	*	*			trans	86.2	49.8	164.7	-50.6	-25.9	0	0	0	118
624	D	31.7	Very low	35.6	Very low	110 Å²	110	137 Å²	137	59%	0.588	69%	0.694	S	S	*	*			trans	-130.2	112.4	149	-168.3	-37.7	0	0	0	110.7	S626	D624-S626 PolarHBondContact O-N 2.97Å; D624-S626 WeakPolarHBondContact OD1-CB 3.17Å; D624-S626 PolarHBondContact OD1-N 2.85Å; D624-S626 PolarHBondContact OD1-OG 3.39Å
625	P	30.8	Very low	33.3	Very low	128 Å²	128	145 Å²	145	83%	0.831	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-8.1	-179	-21.4	34.1	0	0	0	116.1	T627	P625-T627 PolarHBondContact O-N 3.18Å
626	S	33.2	Very low	31.9	Very low	90 Å²	90	149.3 Å²	149.3	63%	0.629	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-10.2	-165.4	65.4	0	0	0	0	116	D624	D624-S626 PolarHBondContact O-N 2.97Å; D624-S626 WeakPolarHBondContact OD1-CB 3.17Å; D624-S626 PolarHBondContact OD1-N 2.85Å; D624-S626 PolarHBondContact OD1-OG 3.39Å
627	T	29.6	Very low	30.8	Very low	119 Å²	119	152 Å²	152	73%	0.73	76%	0.759	S	S	*	*			trans	-128.8	76.1	-168.1	48	0	0	0	0	114.1	P625	P625-T627 PolarHBondContact O-N 3.18Å
628	S	29.7	Very low	30.3	Very low	79 Å²	79	148.2 Å²	148.2	55%	0.552	75%	0.752	S	S	*	*			trans	-139.8	80.5	173.7	54.3	0	0	0	0	115.3	W630	S628-W630 VanDerWaalsContact C-N 3.31Å; S628-W630 PolarHBondContact O-N 3.07Å
629	F	26.4	Very low	30	Very low	214 Å²	214	146.8 Å²	146.8	94%	0.939	75%	0.75	S	S	*	*			trans	-88	61.6	168.2	-112.7	-89.4	0	0	0	111.8
630	W	27.4	Very low	29.8	Very low	185 Å²	185	146.7 Å²	146.7	70%	0.701	75%	0.75	S	S	*	*	S	Bend	trans	-131.4	131.9	169.5	-72.3	91.5	0	0	0	109.5	S628 R632	S628-W630 VanDerWaalsContact C-N 3.31Å; S628-W630 PolarHBondContact O-N 3.07Å; W630-R632 PolarHBondContact O-N 2.79Å
631	P	27.2	Very low	29.7	Very low	117 Å²	117	146.5 Å²	146.5	76%	0.76	75%	0.747	S	S	*	*			trans	-71.4	97.9	-173	28	-34.4	0	0	0	111.8	N633	P631-N633 VanDerWaalsContact C-N 3.32Å; P631-N633 PolarHBondContact O-N 2.59Å
632	R	27.4	Very low	30.1	Very low	213 Å²	213	142.6 Å²	142.6	80%	0.804	74%	0.743	S	S	*	*			trans	-75.8	77.2	178.8	-168	-170.2	-61.8	-161.2	2	111.2	W630	W630-R632 PolarHBondContact O-N 2.79Å
633	N	31.1	Very low	30.4	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	73%	0.733	S	S	*	*			trans	-68.3	144.2	173.8	-92.1	-10.1	0	0	0	112.1	P631	P631-N633 VanDerWaalsContact C-N 3.32Å; P631-N633 PolarHBondContact O-N 2.59Å
634	N	28	Very low	30.5	Very low	121 Å²	121	139 Å²	139	65%	0.647	72%	0.724	S	S	*	*			trans	-82.7	135.6	-165.9	-58	-66.3	0	0	0	113.5
635	F	29.9	Very low	30.9	Very low	216 Å²	216	138.1 Å²	138.1	95%	0.947	72%	0.723	S	S	*	*			trans	-142.5	152.2	138.2	-98.3	-73.8	0	0	0	110.2
636	Y	30.9	Very low	31.1	Very low	203 Å²	203	137.5 Å²	137.5	80%	0.796	71%	0.708	S	S	*	*			trans	-94.2	145.3	-154.1	-81.7	-100.9	0	0	0	115.8
637	S	26.9	Very low	31.1	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	71%	0.706	S	S	*	*			trans	-29.9	129.4	161.4	154.8	0	0	0	0	116.8
638	S	30	Very low	31.5	Very low	87 Å²	87	138.5 Å²	138.5	61%	0.608	70%	0.695	S	S	*	*				-152.6	134.5	118.8	68.1	0	0	0	0	113.9
639	N	28.4	Very low	31.8	Very low	141 Å²	141	138.4 Å²	138.4	75%	0.754	69%	0.688	S	S	*	*			trans	-29.1	119.2	173.8	-51.4	-25.9	0	0	0	117.6
640	N	32.2	Very low	32.1	Very low	119 Å²	119	133 Å²	133	64%	0.636	66%	0.662	S	S	*	*				-145.4	144.6	125	-148.7	3.9	0	0	0	110
641	I	32.7	Very low	32.5	Very low	143 Å²	143	130.4 Å²	130.4	73%	0.733	65%	0.653	S	S	*	*	S	Bend	trans	-117.4	90.1	-174.3	-58.5	174.8	0	0	0	107.7
642	D	37.6	Very low	33	Very low	142 Å²	142	129.6 Å²	129.6	76%	0.759	64%	0.642	S	S	*	*	S	Bend	trans	-174.5	-26.7	161	-95.4	-27.2	0	0	0	111	K644 T645	D642-K644 VanDerWaalsContact C-N 3.29Å; D642-K644 PolarHBondContact O-N 2.84Å; D642-T645 PolarHBondContact O-OG1 2.88Å
643	S	36.4	Very low	33.5	Very low	79 Å²	79	125.6 Å²	125.6	55%	0.552	63%	0.633	S	S	*	*	H	α-helix	trans	-76.5	-4.3	179.7	55.6	0	0	0	0	115.7	F647	S643-F647 PolarHBondContact O-N 3.26Å
644	K	33.8	Very low	34.1	Very low	154 Å²	154	120.9 Å²	120.9	67%	0.67	61%	0.607	S	S	*	*	H	α-helix	trans	-78.8	-29.5	-172.3	-75.9	-171.1	175	-176.1	0	114.6	D642 I648	D642-K644 VanDerWaalsContact C-N 3.29Å; D642-K644 PolarHBondContact O-N 2.84Å; K644-I648 WeakPolarHBondContact O-CD1 3.44Å; K644-I648 WeakPolarHBondContact O-CG1 3.39Å
645	T	40.2	Very low	34.9	Very low	91 Å²	91	119.5 Å²	119.5	56%	0.558	60%	0.596	S	S	*	*	H	α-helix	trans	-69.2	-56.3	171.7	42.1	0	0	0	0	109.7	D642 F647 I648 D649	D642-T645 PolarHBondContact O-OG1 2.88Å; T645-F647 PolarHBondContact O-N 2.66Å; T645-I648 WeakPolarHBondContact O-CA 3.06Å; T645-I648 WeakPolarHBondContact O-CB 3.33Å; T645-I648 PolarHBondContact O-N 2.88Å; T645-D649 PolarHBondContact O-N 3.36Å; T645-D649 VanDerWaalsContact O-OD2 3.12Å
646	H	34.5	Very low	35.9	Very low	114 Å²	114	112.5 Å²	112.5	53%	0.528	57%	0.572	S	S	.	*	H	α-helix	trans	-51.7	-35.3	179.5	-107.5	-68.3	0	0	0	114.3	W650	H646-W650 WeakPolarHBondContact O-CB 2.97Å; H646-W650 PolarHBondContact O-N 2.76Å
647	F	32.5	Very low	37.2	Very low	131 Å²	131	104.5 Å²	104.5	58%	0.575	54%	0.543	S	S	*	.	H	α-helix	trans	-72.6	-34.6	176.1	-165.8	-92.2	0	0	0	113.2	S643 T645 W650 Y651	S643-F647 PolarHBondContact O-N 3.26Å; T645-F647 PolarHBondContact O-N 2.66Å; F647-W650 HydrophobicContact CE2-CE3 4.39Å; F647-W650 HydrophobicContact CE2-CZ3 4.3Å; F647-W650 HydrophobicContact CZ-CZ3 4.42Å; F647-Y651 WeakPolarHBondContact O-CB 3.21Å; F647-Y651 PolarHBondContact O-N 2.95Å
648	I	39.2	Very low	39.1	Very low	99 Å²	99	100.8 Å²	100.8	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-71.8	-44.4	175	-67.2	169.5	0	0	0	110	K644 T645 Y651 N652	K644-I648 WeakPolarHBondContact O-CD1 3.44Å; K644-I648 WeakPolarHBondContact O-CG1 3.39Å; T645-I648 WeakPolarHBondContact O-CA 3.06Å; T645-I648 WeakPolarHBondContact O-CB 3.33Å; T645-I648 PolarHBondContact O-N 2.88Å; I648-Y651 PolarHBondContact O-N 3.37Å; I648-N652 WeakPolarHBondContact O-CB 3.39Å; I648-N652 VanDerWaalsContact O-CG 3.23Å; I648-N652 PolarHBondContact O-N 3.12Å; I648-N652 PolarHBondContact O-ND2 2.9Å
649	D	34.4	Very low	41.3	Very low	77 Å²	77	97.5 Å²	97.5	41%	0.412	49%	0.49	S	S	.	.	H	α-helix	trans	-63.9	-44.1	178	-60.7	-42.8	0	0	0	111.1	T645 Y651 N652 Q653	T645-D649 PolarHBondContact O-N 3.36Å; T645-D649 VanDerWaalsContact O-OD2 3.12Å; D649-Y651 PolarHBondContact O-N 3.03Å; D649-N652 PolarHBondContact O-N 2.86Å; D649-Q653 WeakPolarHBondContact O-CB 3Å; D649-Q653 VanDerWaalsContact O-CG 3.31Å; D649-Q653 WeakPolarHBondContact O-CG 3.44Å; D649-Q653 PolarHBondContact O-N 2.93Å
650	W	33.6	Very low	43.8	Very low	101 Å²	101	92.6 Å²	92.6	38%	0.383	46%	0.463	S	S	.	.	H	α-helix	trans	-60.6	-42.8	173.2	176.9	92	0	0	0	112.7	I484 H646 F647 N652 Q653 N654	I484-W650 HydrophobicContact CD1-CB 4.49Å; I484-W650 HydrophobicContact CD1-CG 4.38Å; I484-W650 HydrophobicContact CG2-CB 4.39Å; H646-W650 WeakPolarHBondContact O-CB 2.97Å; H646-W650 PolarHBondContact O-N 2.76Å; F647-W650 HydrophobicContact CE2-CE3 4.39Å; F647-W650 HydrophobicContact CE2-CZ3 4.3Å; F647-W650 HydrophobicContact CZ-CZ3 4.42Å; W650-N652 VanDerWaalsContact C-N 3.31Å; W650-N652 PolarHBondContact O-N 3.16Å; W650-Q653 PolarHBondContact O-N 2.89Å; W650-N654 PolarHBondContact NE1-ND2 2.04Å; W650-N654 VanDerWaalsContact NE1-ND2 3.18Å; W650-N654 WeakPolarHBondContact O-CB 3.32Å; W650-N654 PolarHBondContact O-N 2.83Å
651	Y	35.2	Very low	46.4	Very low	130 Å²	130	87.3 Å²	87.3	51%	0.51	43%	0.434	S	S	.	.	H	α-helix	trans	-69.8	-27.4	177.6	-176.9	-103	0	0	0	113	F647 I648 D649 K655	F647-Y651 WeakPolarHBondContact O-CB 3.21Å; F647-Y651 PolarHBondContact O-N 2.95Å; I648-Y651 PolarHBondContact O-N 3.37Å; D649-Y651 PolarHBondContact O-N 3.03Å; Y651-K655 WeakPolarHBondContact O-CB 3.34Å
652	N	37.7	Very low	49	Very low	101 Å²	101	84.6 Å²	84.6	54%	0.54	42%	0.417	S	S	.	.	H	α-helix	trans	-80.7	-31.7	174.4	-72.6	-22.9	0	0	0	112.5	I648 D649 W650	I648-N652 WeakPolarHBondContact O-CB 3.39Å; I648-N652 VanDerWaalsContact O-CG 3.23Å; I648-N652 PolarHBondContact O-N 3.12Å; I648-N652 PolarHBondContact O-ND2 2.9Å; D649-N652 PolarHBondContact O-N 2.86Å; W650-N652 VanDerWaalsContact C-N 3.31Å; W650-N652 PolarHBondContact O-N 3.16Å
653	Q	39.2	Very low	51.6	Low	129 Å²	129	77.8 Å²	77.8	60%	0.603	38%	0.381	S	S	*	.	H	α-helix	trans	-84	-34.8	-179.3	-73.3	174.7	-12.4	0	0	113.8	I484 D649 W650	I484-Q653 HydrophobicContact CD1-CB 3.79Å; D649-Q653 WeakPolarHBondContact O-CB 3Å; D649-Q653 VanDerWaalsContact O-CG 3.31Å; D649-Q653 WeakPolarHBondContact O-CG 3.44Å; D649-Q653 PolarHBondContact O-N 2.93Å; W650-Q653 PolarHBondContact O-N 2.89Å
654	N	42	Very low	54.1	Low	53 Å²	53	75 Å²	75	28%	0.283	36%	0.359	S	S	.	.	S	Bend	trans	-99.3	19.3	179.6	-71.2	-41.6	0	0	0	113.8	I484 W650	I484-N654 WeakPolarHBondContact CD1-ND2 3.47Å; W650-N654 PolarHBondContact NE1-ND2 2.04Å; W650-N654 VanDerWaalsContact NE1-ND2 3.18Å; W650-N654 WeakPolarHBondContact O-CB 3.32Å; W650-N654 PolarHBondContact O-N 2.83Å
655	K	46.3	Very low	56.7	Low	93 Å²	93	67.7 Å²	67.7	40%	0.404	33%	0.328	S	S	.	.			trans	-74.5	121.6	-179.6	-151.8	172.4	-176.8	-179.6	0	109.6	Y651	Y651-K655 WeakPolarHBondContact O-CB 3.34Å
656	P	51	Low	58.8	Low	69 Å²	69	67.5 Å²	67.5	45%	0.448	32%	0.322	S	S	.	.			trans	-62.8	156.5	173.3	30.3	-36.3	0	0	0	109.5	I589 T658	I589-P656 HydrophobicContact CG2-CB 3.72Å; I589-P656 HydrophobicContact CG2-CG 3.85Å; P656-T658 VanDerWaalsContact C-N 3.33Å; P656-T658 WeakPolarHBondContact O-CB 3.4Å; P656-T658 PolarHBondContact O-N 2.82Å; P656-T658 PolarHBondContact O-OG1 2.99Å
657	L	57.2	Low	61	Low	35 Å²	35	65 Å²	65	18%	0.183	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	90.5	-166.9	-76.2	143.8	0	0	0	110.7	D590 L595 Q597 I600	D590-L657 HydrophobicContact CB-CB 4.24Å; D590-L657 PolarHBondContact N-O 2.82Å; D590-L657 VanDerWaalsContact N-O 3.14Å; L595-L657 HydrophobicContact CB-CD1 4.08Å; L595-L657 WeakPolarHBondContact O-CD1 3.2Å; L595-L657 WeakPolarHBondContact O-CD2 3.49Å; Q597-L657 HydrophobicContact CG-CD2 4.23Å; I600-L657 HydrophobicContact CD1-CB 4.4Å
658	T	66.2	Low	63.5	Low	28 Å²	28	61.8 Å²	61.8	17%	0.172	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	97.2	-167	-55.1	0	0	0	0	109.8	T587 V588 I589 P656 M660	T587-T658 HydrophobicContact CG2-CG2 3.52Å; V588-T658 CarbonylContact O-C 3.55Å; V588-T658 WeakPolarHBondContact O-CA 3.49Å; I589-T658 HydrophobicContact CG1-CG2 4.37Å; P656-T658 VanDerWaalsContact C-N 3.33Å; P656-T658 WeakPolarHBondContact O-CB 3.4Å; P656-T658 PolarHBondContact O-N 2.82Å; P656-T658 PolarHBondContact O-OG1 2.99Å; T658-M660 HydrophobicContact CG2-CG 4.23Å
659	K	76.4	Confident	65.6	Low	18 Å²	18	57.4 Å²	57.4	8%	0.078	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	145.7	162.9	-74	-155.7	174.6	-157.8	0	110.4	T587 V588 Q597 I600 E613 Y661	T587-K659 WeakPolarHBondContact CA-O 3.5Å; V588-K659 HydrophobicContact CB-CB 4.44Å; V588-K659 PolarHBondContact N-O 2.81Å; V588-K659 PolarHBondContact O-N 3.38Å; Q597-K659 WeakPolarHBondContact O-CE 3.06Å; Q597-K659 PolarHBondContact O-NZ 2.58Å; I600-K659 HydrophobicContact CB-CD 3.91Å; I600-K659 HydrophobicContact CB-CG 4.33Å; I600-K659 HydrophobicContact CD1-CG 4.33Å; I600-K659 HydrophobicContact CG2-CD 4.31Å; I600-K659 WeakPolarHBondContact O-CD 3.48Å; I600-K659 WeakPolarHBondContact O-CE 3.5Å; I600-K659 PolarHBondContact O-NZ 2.77Å; E613-K659 VanDerWaalsContact OE1-CD 3.26Å; E613-K659 WeakPolarHBondContact OE1-CD 3.31Å; E613-K659 WeakPolarHBondContact OE1-CE 3.49Å; E613-K659 IonicContact OE1-NZ 2.72Å; E613-K659 PolarHBondContact OE1-NZ 2.69Å; E613-K659 IonicContact OE2-NZ 2.83Å; K659-Y661 HydrophobicContact CB-CE2 3.86Å; K659-Y661 HydrophobicContact CD-CE2 4.14Å; K659-Y661 VanDerWaalsContact CD-OH 3.24Å; K659-Y661 WeakPolarHBondContact CD-OH 3.06Å
660	M	81.3	Confident	68	Low	38 Å²	38	56.1 Å²	56.1	19%	0.187	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.2	172.1	-62	-174.8	-61.2	0	0	108.9	Q585 I586 T587 I614 N616 T658	Q585-M660 PolarHBondContact NE2-SD 2.85Å; Q585-M660 VanDerWaalsContact NE2-SD 3.39Å; I586-M660 CarbonylContact O-C 3.51Å; I586-M660 VanDerWaalsContact O-CA 3.32Å; I586-M660 WeakPolarHBondContact O-CA 3.32Å; T587-M660 HydrophobicContact CG2-CG 4.32Å; I614-M660 HydrophobicContact CB-CB 4.08Å; I614-M660 WeakPolarHBondContact CB-O 3.27Å; I614-M660 HydrophobicContact CD1-CB 4.08Å; I614-M660 HydrophobicContact CG1-CB 4.34Å; I614-M660 HydrophobicContact CG2-CE 4.42Å; I614-M660 PolarHBondContact N-O 3.29Å; N616-M660 WeakPolarHBondContact OD1-CE 3.36Å; T658-M660 HydrophobicContact CG2-CG 4.23Å
661	Y	87.2	Confident	70.6	Confident	8 Å²	8	53.9 Å²	53.9	3%	0.031	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.8	177.7	-61.1	-87.1	0	0	0	110.3	I586 V588 C602 L611 E612 E613 K659	I586-Y661 PolarHBondContact N-O 3.49Å; I586-Y661 PolarHBondContact O-N 3.46Å; V588-Y661 HydrophobicContact CG2-CD2 4.4Å; V588-Y661 HydrophobicContact CG2-CE2 4.37Å; C602-Y661 HydrophobicContact CB-CD2 4.36Å; C602-Y661 HydrophobicContact CB-CE2 3.66Å; L611-Y661 HydrophobicContact CB-CD1 3.97Å; L611-Y661 HydrophobicContact CB-CG 4.23Å; L611-Y661 HydrophobicContact CD2-CG 4.45Å; E612-Y661 CarbonylContact O-C 3.57Å; E612-Y661 WeakPolarHBondContact O-CA 3.35Å; E613-Y661 HydrophobicContact CB-CD1 3.96Å; E613-Y661 HydrophobicContact CB-CE1 3.86Å; E613-Y661 HydrophobicContact CG-CD1 4.33Å; E613-Y661 HydrophobicContact CG-CE1 3.98Å; K659-Y661 HydrophobicContact CB-CE2 3.86Å; K659-Y661 HydrophobicContact CD-CE2 4.14Å; K659-Y661 VanDerWaalsContact CD-OH 3.24Å; K659-Y661 WeakPolarHBondContact CD-OH 3.06Å
662	K	87.6	Confident	72.9	Confident	86 Å²	86	49.3 Å²	49.3	37%	0.374	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.3	161	-52.6	-178.1	-178.2	178.7	0	108	M582 L611 E612 I614 M664	M582-K662 HydrophobicContact CE-CB 3.97Å; M582-K662 HydrophobicContact CE-CD 4.45Å; M582-K662 HydrophobicContact CE-CG 3.82Å; M582-K662 HydrophobicContact CG-CB 4.26Å; M582-K662 HydrophobicContact SD-CB 4.01Å; M582-K662 HydrophobicContact SD-CD 3.91Å; M582-K662 HydrophobicContact SD-CG 3.89Å; L611-K662 WeakPolarHBondContact CA-O 3.24Å; E612-K662 HydrophobicContact CB-CB 4.35Å; E612-K662 PolarHBondContact N-O 2.87Å; E612-K662 PolarHBondContact O-N 3.29Å; I614-K662 HydrophobicContact CD1-CG 3.73Å; I614-K662 HydrophobicContact CG1-CG 3.75Å; K662-M664 HydrophobicContact CB-CG 4.01Å; K662-M664 HydrophobicContact CB-SD 3.96Å
663	L	91.7	Very high	74.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	116.8	165.5	176.2	67.5	0	0	0	108.3	M582 I583 A584 I586 T604 F609 L611 F683 I706	M582-L663 WeakPolarHBondContact CA-O 3.26Å; I583-L663 HydrophobicContact CB-CD2 3.98Å; I583-L663 HydrophobicContact CB-CG 4.19Å; I583-L663 HydrophobicContact CD1-CG 4.43Å; I583-L663 HydrophobicContact CG2-CD2 3.99Å; I583-L663 PolarHBondContact N-O 3.03Å; A584-L663 HydrophobicContact CB-CB 4.19Å; A584-L663 HydrophobicContact CB-CD2 4.1Å; A584-L663 PolarHBondContact O-N 2.96Å; I586-L663 HydrophobicContact CD1-CB 4.34Å; I586-L663 HydrophobicContact CG1-CB 4.06Å; T604-L663 HydrophobicContact CG2-CD1 4.34Å; F609-L663 HydrophobicContact CB-CD1 4.03Å; L611-L663 HydrophobicContact CD2-CB 4.33Å; L611-L663 HydrophobicContact CD2-CD1 4.14Å; L663-F683 HydrophobicContact CD1-CE2 4.09Å; L663-F683 HydrophobicContact CD1-CZ 3.73Å; L663-F683 HydrophobicContact CD2-CZ 3.83Å; L663-F683 HydrophobicContact CG-CZ 4.36Å; L663-I706 HydrophobicContact CD2-CG2 4.08Å
664	M	88.9	Confident	75.7	Confident	19 Å²	19	47.7 Å²	47.7	9%	0.094	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.3	-173.4	-60.9	-65.5	-59.8	0	0	111.2	R580 S581 M582 F609 L610 E612 K662	R580-M664 HydrophobicContact CG-CE 3.74Å; S581-M664 CarbonylContact O-C 3.58Å; S581-M664 VanDerWaalsContact O-CA 3.29Å; S581-M664 WeakPolarHBondContact O-CA 3.41Å; M582-M664 VanDerWaalsContact CA-SD 3.51Å; M582-M664 HydrophobicContact CB-CE 4.35Å; M582-M664 HydrophobicContact CB-SD 3.52Å; M582-M664 VanDerWaalsContact CB-SD 3.52Å; M582-M664 HydrophobicContact CG-SD 3.81Å; F609-M664 CarbonylContact C-O 3.52Å; F609-M664 VanDerWaalsContact CA-O 3.27Å; F609-M664 WeakPolarHBondContact CA-O 3.37Å; L610-M664 PolarHBondContact N-O 2.78Å; L610-M664 PolarHBondContact O-N 2.75Å; E612-M664 HydrophobicContact CG-CG 4.11Å; E612-M664 WeakPolarHBondContact OE1-CG 3.17Å; K662-M664 HydrophobicContact CB-CG 4.01Å; K662-M664 HydrophobicContact CB-SD 3.96Å
665	S	88.7	Confident	76.4	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.007	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	143.9	159.4	61.6	0	0	0	0	110.2	E579 R580 S581 S667	E579-S665 PolarHBondContact O-OG 2.71Å; R580-S665 WeakPolarHBondContact CA-O 3.17Å; R580-S665 WeakPolarHBondContact CB-O 3.15Å; R580-S665 WeakPolarHBondContact CG-O 3.5Å; S581-S665 PolarHBondContact N-OG 2.85Å; S581-S665 PolarHBondContact O-N 3.03Å; S581-S665 PolarHBondContact O-OG 2.87Å; S665-S667 WeakPolarHBondContact CB-O 2.82Å; S665-S667 PolarHBondContact OG-O 3Å
666	I	84.3	Confident	76.6	Confident	88 Å²	88	57.7 Å²	57.7	45%	0.451	30%	0.298	S	S	.	.	S	Bend	trans	-91	-38.5	177.9	-64.8	174.4	0	0	0	111.2	S607 R608 L610	S607-I666 WeakPolarHBondContact O-CD1 3.49Å; R608-I666 PolarHBondContact O-N 3.18Å; L610-I666 HydrophobicContact CB-CD1 3.93Å; L610-I666 HydrophobicContact CB-CG1 3.75Å
667	S	81.2	Confident	76.9	Confident	60 Å²	60	55.5 Å²	55.5	42%	0.42	28%	0.282	S	S	.	.	S	Bend	trans	-113.5	178.8	172.2	61.9	0	0	0	0	110.4	S665	S665-S667 WeakPolarHBondContact CB-O 2.82Å; S665-S667 PolarHBondContact OG-O 3Å
668	S	83.2	Confident	77.3	Confident	65 Å²	65	57.3 Å²	57.3	46%	0.455	30%	0.296	S	S	.	.			trans	-58.4	151	154.8	47.3	0	0	0	0	111.1	L578	L578-S668 VanDerWaalsContact O-CA 3.23Å; L578-S668 WeakPolarHBondContact O-CA 3.07Å; L578-S668 WeakPolarHBondContact O-CB 3.01Å
669	L	84.3	Confident	77.7	Confident	6 Å²	6	57.9 Å²	57.9	3%	0.031	30%	0.301	C	S	.	.			trans	-104.9	156.2	163.7	-61.6	176	0	0	0	107.9	I574 E576 N577 F609 I681	I574-L669 HydrophobicContact CG2-CD1 3.95Å; E576-L669 WeakPolarHBondContact CB-O 3.29Å; N577-L669 PolarHBondContact N-O 2.85Å; F609-L669 HydrophobicContact CE1-CD1 4.12Å; F609-L669 HydrophobicContact CZ-CD1 4.37Å; L669-I681 HydrophobicContact CD1-CD1 4.34Å; L669-I681 HydrophobicContact CD2-CD1 4.3Å
670	D	85.9	Confident	77.9	Confident	50 Å²	50	62 Å²	62	27%	0.267	32%	0.319	S	S	.	.			trans	-150.2	125.5	-168.8	158.9	-19.9	0	0	0	104	E672 F673 Q677	D670-E672 PolarHBondContact OD1-N 2.9Å; D670-F673 HydrophobicContact CB-CB 4.31Å; D670-F673 WeakPolarHBondContact OD1-CA 3.22Å; D670-F673 WeakPolarHBondContact OD1-CB 3.25Å; D670-F673 PolarHBondContact OD1-N 2.82Å; D670-F673 WeakPolarHBondContact OD2-CD2 3.41Å; D670-Q677 PolarHBondContact O-NE2 2.99Å
671	R	87.2	Confident	78	Confident	55 Å²	55	60.4 Å²	60.4	21%	0.208	31%	0.311	C	S	.	.	S	Bend	trans	-85.6	-20.6	-172.6	-171.5	-162.1	68.8	125	21	111.9	E576 I710 D712 K760	E576-R671 WeakPolarHBondContact OE2-CB 3.32Å; E576-R671 PolarHBondContact OE2-N 2.86Å; R671-I710 HydrophobicContact CB-CB 4.39Å; R671-I710 HydrophobicContact CB-CG2 3.93Å; R671-I710 HydrophobicContact CG-CB 4.29Å; R671-I710 HydrophobicContact CG-CG2 4.34Å; R671-D712 IonicContact CZ-OD1 3.57Å; R671-D712 IonicContact NE-OD1 3.74Å; R671-D712 PolarHBondContact NE-OD1 3.33Å; R671-D712 IonicContact NH1-OD1 2.83Å; R671-D712 PolarHBondContact NH1-OD1 3.42Å; R671-D712 IonicContact NH2-OD1 3.34Å; R671-D712 PolarHBondContact NH2-OD1 3.15Å; R671-K760 PolarHBondContact NH2-O 2.78Å
672	E	84.3	Confident	78	Confident	33 Å²	33	65.5 Å²	65.5	15%	0.154	33%	0.333	C	S	.	.	S	Bend	trans	-92	-14.8	-174.6	-68.3	60.7	-122	0	0	113.4	D670 S674 K760	D670-E672 PolarHBondContact OD1-N 2.9Å; E672-S674 PolarHBondContact O-N 2.82Å; E672-K760 HydrophobicContact CB-CD 4.17Å; E672-K760 HydrophobicContact CG-CB 3.7Å; E672-K760 HydrophobicContact CG-CD 3.97Å
673	F	73.3	Confident	78	Confident	150 Å²	150	61.7 Å²	61.7	66%	0.658	32%	0.317	S	S	*	.	S	Bend	trans	-49.7	-35.6	-162.9	-166.8	-111.6	0	0	0	115.1	D670	D670-F673 HydrophobicContact CB-CB 4.31Å; D670-F673 WeakPolarHBondContact OD1-CA 3.22Å; D670-F673 WeakPolarHBondContact OD1-CB 3.25Å; D670-F673 PolarHBondContact OD1-N 2.82Å; D670-F673 WeakPolarHBondContact OD2-CD2 3.41Å
674	S	62.2	Low	78	Confident	46 Å²	46	62.1 Å²	62.1	32%	0.322	32%	0.32	S	S	.	.			trans	-172.2	155.4	177.2	-176	0	0	0	0	112.3	E672 K676 Q677	E672-S674 PolarHBondContact O-N 2.82Å; S674-K676 PolarHBondContact O-N 3.11Å; S674-K676 PolarHBondContact OG-N 3.1Å; S674-Q677 PolarHBondContact O-N 2.96Å
675	D	55.7	Low	78.1	Confident	170 Å²	170	61.2 Å²	61.2	91%	0.909	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	-19.9	162.2	-46.5	-52.9	0	0	0	114.5
676	K	51.7	Low	78.3	Confident	186 Å²	186	64 Å²	64	81%	0.809	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-11.3	180	-62.5	175	-175.9	169.4	0	114.2	S674 P678	S674-K676 PolarHBondContact O-N 3.11Å; S674-K676 PolarHBondContact OG-N 3.1Å; K676-P678 WeakPolarHBondContact O-CD 3.25Å
677	Q	57.6	Low	78.6	Confident	24 Å²	24	59.8 Å²	59.8	11%	0.112	31%	0.308	C	S	.	.	S	Bend	trans	-113.4	81.5	174.4	179.1	147.1	-47.8	0	0	107.8	R608 D670 S674	R608-Q677 VanDerWaalsContact NH1-CD 3.34Å; D670-Q677 PolarHBondContact O-NE2 2.99Å; S674-Q677 PolarHBondContact O-N 2.96Å
678	P	65.5	Low	78.9	Confident	72 Å²	72	59.1 Å²	59.1	47%	0.468	30%	0.299	S	S	.	.			trans	-59.5	153.9	172.2	26.9	-35.4	0	0	0	110.2	K676 F680	K676-P678 WeakPolarHBondContact O-CD 3.25Å; P678-F680 PolarHBondContact O-N 3.04Å
679	S	73.7	Confident	79.1	Confident	40 Å²	40	56 Å²	56	28%	0.28	28%	0.277	S	S	.	.	S	Bend	trans	-56.1	-4.2	169	54.3	0	0	0	0	114.7	E709 I710	S679-E709 WeakPolarHBondContact O-CA 3.15Å; S679-I710 PolarHBondContact O-N 2.69Å
680	F	80.8	Confident	78.9	Confident	105 Å²	105	55.8 Å²	55.8	46%	0.461	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	86.9	-176	-64.1	-49	0	0	0	109.3	W571 P678 K682 V708 E709	W571-F680 HydrophobicContact CE3-CD1 4.12Å; W571-F680 HydrophobicContact CH2-CB 4.05Å; W571-F680 HydrophobicContact CH2-CD1 4.12Å; W571-F680 HydrophobicContact CH2-CG 4.12Å; W571-F680 HydrophobicContact CZ3-CB 3.67Å; W571-F680 AromaticContact CZ3-CD1 3.4Å; W571-F680 HydrophobicContact CZ3-CD1 3.4Å; W571-F680 VanDerWaalsContact CZ3-CD1 3.4Å; W571-F680 HydrophobicContact CZ3-CE1 4.26Å; W571-F680 AromaticContact CZ3-CG 3.74Å; W571-F680 HydrophobicContact CZ3-CG 3.74Å; P678-F680 PolarHBondContact O-N 3.04Å; F680-K682 PolarHBondContact O-N 2.63Å; F680-V708 CarbonylContact C-O 3.58Å; F680-V708 WeakPolarHBondContact CA-O 3.41Å; F680-E709 HydrophobicContact CD1-CB 4.19Å; F680-E709 HydrophobicContact CD1-CG 4.32Å; F680-E709 HydrophobicContact CE1-CB 4.2Å; F680-E709 HydrophobicContact CE1-CG 3.91Å
681	I	83.6	Confident	78.4	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	122.7	178	-61.8	173.3	0	0	0	109.5	F609 L669 F683 V708 I710	F609-I681 HydrophobicContact CE2-CG2 3.89Å; F609-I681 HydrophobicContact CZ-CD1 4Å; F609-I681 HydrophobicContact CZ-CG2 4.01Å; L669-I681 HydrophobicContact CD1-CD1 4.34Å; L669-I681 HydrophobicContact CD2-CD1 4.3Å; I681-F683 HydrophobicContact CG2-CD1 4.13Å; I681-V708 HydrophobicContact CB-CB 4.47Å; I681-V708 PolarHBondContact N-O 3.04Å; I681-V708 PolarHBondContact O-N 3.2Å; I681-I710 HydrophobicContact CD1-CD1 3.89Å; I681-I710 HydrophobicContact CD1-CG1 4.37Å; I681-I710 HydrophobicContact CG1-CD1 4.2Å
682	K	86.1	Confident	77.7	Confident	116 Å²	116	59.9 Å²	59.9	50%	0.504	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.5	164.7	-173	-171.8	178.4	-177.4	0	110.1	F680 D705 I706 F707	F680-K682 PolarHBondContact O-N 2.63Å; K682-D705 WeakPolarHBondContact CE-OD2 3.4Å; K682-D705 IonicContact NZ-OD2 3.12Å; K682-D705 PolarHBondContact NZ-OD2 2.85Å; K682-I706 WeakPolarHBondContact CA-O 3.43Å; K682-F707 HydrophobicContact CB-CD1 4.37Å; K682-F707 HydrophobicContact CB-CE1 4.32Å; K682-F707 HydrophobicContact CD-CE1 3.65Å; K682-F707 HydrophobicContact CD-CZ 3.8Å; K682-F707 VanDerWaalsContact CE-CZ 3.5Å; K682-F707 HydrophobicContact CG-CD1 4.15Å; K682-F707 HydrophobicContact CG-CE1 3.75Å; K682-F707 HydrophobicContact CG-CZ 4Å
683	F	89	Confident	77.1	Confident	5 Å²	5	63.4 Å²	63.4	2%	0.022	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	-176.9	166.5	71.1	-85.9	0	0	0	109.4	T604 N605 D606 F609 L663 I681 I685 D705 I706 V708	T604-F683 HydrophobicContact CG2-CD2 4.39Å; T604-F683 HydrophobicContact CG2-CE2 3.9Å; N605-F683 WeakPolarHBondContact OD1-CB 3.32Å; D606-F683 HydrophobicContact CB-CB 3.63Å; D606-F683 HydrophobicContact CB-CD2 4.47Å; D606-F683 HydrophobicContact CB-CG 4.11Å; F609-F683 HydrophobicContact CB-CE2 4.41Å; F609-F683 HydrophobicContact CB-CZ 4.25Å; F609-F683 HydrophobicContact CD1-CE1 4.23Å; F609-F683 HydrophobicContact CD1-CZ 4.39Å; F609-F683 AromaticContact CD2-CD1 3.72Å; F609-F683 HydrophobicContact CD2-CD1 3.72Å; F609-F683 HydrophobicContact CD2-CD2 4.38Å; F609-F683 AromaticContact CD2-CE1 3.65Å; F609-F683 HydrophobicContact CD2-CE1 3.65Å; F609-F683 HydrophobicContact CD2-CE2 4.34Å; F609-F683 HydrophobicContact CD2-CG 4.1Å; F609-F683 AromaticContact CD2-CZ 3.98Å; F609-F683 HydrophobicContact CD2-CZ 3.98Å; F609-F683 HydrophobicContact CE1-CE1 4.25Å; F609-F683 AromaticContact CE2-CD1 3.59Å; F609-F683 HydrophobicContact CE2-CD1 3.59Å; F609-F683 AromaticContact CE2-CE1 3.68Å; F609-F683 HydrophobicContact CE2-CE1 3.68Å; F609-F683 HydrophobicContact CE2-CG 4.29Å; F609-F683 HydrophobicContact CE2-CZ 4.46Å; F609-F683 HydrophobicContact CG-CD1 4.46Å; F609-F683 AromaticContact CG-CE1 3.94Å; F609-F683 HydrophobicContact CG-CE1 3.94Å; F609-F683 HydrophobicContact CG-CE2 4.45Å; F609-F683 AromaticContact CG-CZ 3.94Å; F609-F683 HydrophobicContact CG-CZ 3.94Å; F609-F683 HydrophobicContact CZ-CD1 4.22Å; F609-F683 AromaticContact CZ-CE1 3.99Å; F609-F683 HydrophobicContact CZ-CE1 3.99Å; L663-F683 HydrophobicContact CD1-CE2 4.09Å; L663-F683 HydrophobicContact CD1-CZ 3.73Å; L663-F683 HydrophobicContact CD2-CZ 3.83Å; L663-F683 HydrophobicContact CG-CZ 4.36Å; I681-F683 HydrophobicContact CG2-CD1 4.13Å; F683-I685 HydrophobicContact CE2-CG1 4.25Å; F683-D705 CarbonylContact O-C 3.58Å; F683-D705 WeakPolarHBondContact O-CA 3.2Å; F683-I706 HydrophobicContact CD1-CB 4.12Å; F683-I706 HydrophobicContact CD1-CG2 4.31Å; F683-I706 HydrophobicContact CD2-CB 4.31Å; F683-I706 HydrophobicContact CD2-CG1 4.4Å; F683-I706 HydrophobicContact CE1-CB 3.72Å; F683-I706 HydrophobicContact CE1-CG1 4.45Å; F683-I706 HydrophobicContact CE1-CG2 3.52Å; F683-I706 HydrophobicContact CE2-CB 3.91Å; F683-I706 HydrophobicContact CE2-CG1 3.78Å; F683-I706 HydrophobicContact CE2-CG2 4.33Å; F683-I706 HydrophobicContact CG-CB 4.4Å; F683-I706 HydrophobicContact CZ-CB 3.59Å; F683-I706 HydrophobicContact CZ-CG1 3.82Å; F683-I706 HydrophobicContact CZ-CG2 3.52Å; F683-I706 PolarHBondContact N-O 3.46Å; F683-I706 VanDerWaalsContact N-O 3.13Å; F683-I706 PolarHBondContact O-N 3.27Å; F683-V708 HydrophobicContact CE1-CG2 4.04Å
684	S	90.5	Very high	76.9	Confident	9 Å²	9	62 Å²	62	6%	0.063	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	143.4	179.9	-35.5	0	0	0	0	112	N605 Q703 A704 D705	N605-S684 PolarHBondContact N-O 3.21Å; N605-S684 VanDerWaalsContact N-O 3.08Å; N605-S684 VanDerWaalsContact ND2-CB 3.28Å; N605-S684 WeakPolarHBondContact ND2-CB 3.32Å; N605-S684 PolarHBondContact ND2-N 3.23Å; N605-S684 PolarHBondContact ND2-OG 3.13Å; N605-S684 PolarHBondContact OD1-N 3.05Å; N605-S684 PolarHBondContact OD1-O 3.19Å; N605-S684 VanDerWaalsContact OD1-O 3.14Å; S684-Q703 PolarHBondContact OG-NE2 2.8Å; S684-A704 CarbonylContact C-O 3.56Å; S684-A704 VanDerWaalsContact CA-O 3.31Å; S684-A704 WeakPolarHBondContact CA-O 3.28Å; S684-D705 WeakPolarHBondContact CB-OD1 3.47Å; S684-D705 PolarHBondContact OG-OD1 2.85Å
685	I	92	Very high	77.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	132.4	165.1	-63.9	176.4	0	0	0	107.6	I546 I586 C602 K603 L611 F683 Q703 A704 I706	I546-I685 HydrophobicContact CD1-CG2 4.4Å; I586-I685 HydrophobicContact CB-CD1 4.44Å; I586-I685 HydrophobicContact CD1-CD1 3.64Å; I586-I685 HydrophobicContact CG1-CD1 3.64Å; I586-I685 HydrophobicContact CG2-CD1 4.03Å; C602-I685 HydrophobicContact CB-CG2 4.46Å; K603-I685 WeakPolarHBondContact O-CA 3.46Å; L611-I685 HydrophobicContact CD1-CD1 4.45Å; L611-I685 HydrophobicContact CD1-CG1 4.4Å; L611-I685 HydrophobicContact CD1-CG2 3.99Å; L611-I685 HydrophobicContact CD2-CD1 4.02Å; F683-I685 HydrophobicContact CE2-CG1 4.25Å; I685-Q703 VanDerWaalsContact O-CA 3.32Å; I685-Q703 WeakPolarHBondContact O-CA 3.27Å; I685-A704 PolarHBondContact N-O 2.66Å; I685-A704 PolarHBondContact O-N 3.11Å; I685-I706 HydrophobicContact CD1-CD1 3.8Å; I685-I706 HydrophobicContact CD1-CG1 3.87Å; I685-I706 HydrophobicContact CG1-CD1 4.27Å; I685-I706 HydrophobicContact CG1-CG1 3.85Å
686	I	91.9	Very high	78.1	Confident	59 Å²	59	55.9 Å²	55.9	30%	0.303	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.2	175.2	-57.6	170.6	0	0	0	107.2	C602 K603 N605 I688 S702 Q703	C602-I686 CarbonylContact C-O 3.59Å; C602-I686 VanDerWaalsContact CA-O 3.32Å; C602-I686 WeakPolarHBondContact CA-O 3.46Å; K603-I686 PolarHBondContact N-O 3.14Å; K603-I686 PolarHBondContact O-N 2.81Å; N605-I686 HydrophobicContact CB-CD1 4.49Å; I686-I688 HydrophobicContact CG2-CG1 4.43Å; I686-S702 WeakPolarHBondContact CA-O 3.47Å; I686-Q703 HydrophobicContact CG1-CG 4.34Å
687	C	90.7	Very high	79	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.7	173.4	-65.7	0	0	0	0	109.9	P544 I546 V588 L601 C602 T701 S702	P544-C687 HydrophobicContact CB-CB 4.39Å; I546-C687 HydrophobicContact CD1-CB 3.98Å; I546-C687 HydrophobicContact CG1-CB 4.29Å; V588-C687 HydrophobicContact CG1-CB 4.33Å; L601-C687 WeakPolarHBondContact O-CA 3.22Å; C602-C687 HydrophobicContact CB-CB 4.17Å; C602-C687 WeakPolarHBondContact CB-SG 3.28Å; C602-C687 WeakPolarHBondContact SG-CB 3.33Å; C602-C687 CovalentContact SG-SG 2.04Å; C602-C687 PolarHBondContact SG-SG 3.08Å; C687-T701 WeakPolarHBondContact O-CA 3.46Å; C687-S702 PolarHBondContact N-O 3.47Å; C687-S702 PolarHBondContact O-N 2.75Å
688	I	88.8	Confident	80.1	Confident	46 Å²	46	50.1 Å²	50.1	24%	0.236	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.6	177.7	-39.9	-175.6	0	0	0	107.5	I600 L601 I686 L700 T701	I600-I688 WeakPolarHBondContact CA-O 3.42Å; L601-I688 PolarHBondContact N-O 2.87Å; L601-I688 PolarHBondContact O-N 2.84Å; I686-I688 HydrophobicContact CG2-CG1 4.43Å; I688-L700 WeakPolarHBondContact CA-O 3.34Å; I688-L700 WeakPolarHBondContact CG2-O 3.39Å; I688-T701 HydrophobicContact CD1-CG2 4.39Å; I688-T701 HydrophobicContact CG1-CG2 4.13Å; I688-T701 HydrophobicContact CG2-CG2 4.01Å
689	D	86.8	Confident	81	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.275	C	S	.	.			trans	-86	-170.4	174.6	59.6	33.2	0	0	0	111.8	N540 P544 L595 D599 Q691 S699 L700	N540-D689 VanDerWaalsContact ND2-CG 3.29Å; N540-D689 PolarHBondContact ND2-OD1 2.95Å; N540-D689 PolarHBondContact ND2-OD2 2.88Å; P544-D689 HydrophobicContact CG-CB 3.78Å; L595-D689 HydrophobicContact CD2-CB 3.87Å; D599-D689 CarbonylContact O-C 3.52Å; D689-Q691 PolarHBondContact O-N 2.81Å; D689-Q691 PolarHBondContact O-NE2 2.85Å; D689-S699 WeakPolarHBondContact OD1-CA 3.42Å; D689-S699 WeakPolarHBondContact OD1-CB 3.4Å; D689-L700 VanDerWaalsContact CG-N 3.34Å; D689-L700 PolarHBondContact N-O 2.89Å; D689-L700 PolarHBondContact OD1-N 2.62Å; D689-L700 VanDerWaalsContact OD2-CB 3.22Å; D689-L700 WeakPolarHBondContact OD2-CB 2.94Å; D689-L700 PolarHBondContact OD2-N 3.02Å
690	N	79.9	Confident	81.6	Confident	1 Å²	1	50 Å²	50	1%	0.005	28%	0.275	C	S	.	.			trans	40.1	40.3	159.4	-156.8	10.9	0	0	0	115.8	N540 L595 H692 N693 E694 L695 G698 S699	N540-N690 WeakPolarHBondContact OD1-CB 3.38Å; L595-N690 HydrophobicContact CD2-CB 4.32Å; N690-H692 PolarHBondContact O-N 2.89Å; N690-H692 VanDerWaalsContact O-N 3.12Å; N690-N693 PolarHBondContact O-N 2.85Å; N690-N693 WeakPolarHBondContact OD1-CA 3.47Å; N690-N693 PolarHBondContact OD1-N 2.93Å; N690-E694 PolarHBondContact OD1-N 2.81Å; N690-L695 PolarHBondContact ND2-O 3.18Å; N690-L695 PolarHBondContact OD1-N 3.48Å; N690-G698 PolarHBondContact ND2-O 2.74Å; N690-S699 PolarHBondContact O-OG 2.9Å
691	Q	74.9	Confident	82	Confident	70 Å²	70	49.7 Å²	49.7	33%	0.327	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.7	-172.9	-69.2	-62.6	-88.5	0	0	113.2	D599 L601 D689	D599-Q691 WeakPolarHBondContact O-CG 3.37Å; L601-Q691 HydrophobicContact CB-CG 3.87Å; L601-Q691 HydrophobicContact CD2-CG 4.31Å; D689-Q691 PolarHBondContact O-N 2.81Å; D689-Q691 PolarHBondContact O-NE2 2.85Å
692	H	73.1	Confident	82.3	Confident	121 Å²	121	50.7 Å²	50.7	56%	0.56	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-1.4	179	-57.4	108.5	0	0	0	114	D599 N690 E694	D599-H692 IonicContact OD1-CE1 3.69Å; D599-H692 IonicContact OD1-CG 2.77Å; D599-H692 IonicContact OD1-ND1 2.71Å; D599-H692 PolarHBondContact OD1-ND1 2.96Å; N690-H692 PolarHBondContact O-N 2.89Å; N690-H692 VanDerWaalsContact O-N 3.12Å; H692-E694 HydrophobicContact CB-CG 4.03Å
693	N	72.4	Confident	82.6	Confident	107 Å²	107	51 Å²	51	57%	0.572	29%	0.292	S	S	*	.			trans	55.9	43.8	-175.2	-57.6	-90.2	0	0	0	113.4	N690	N690-N693 PolarHBondContact O-N 2.85Å; N690-N693 WeakPolarHBondContact OD1-CA 3.47Å; N690-N693 PolarHBondContact OD1-N 2.93Å
694	E	68.8	Low	82.5	Confident	121 Å²	121	51.5 Å²	51.5	57%	0.565	30%	0.298	S	S	*	.			trans	-76.4	-31.4	177	-58.9	-162.7	166.9	0	0	111.8	N690 H692	N690-E694 PolarHBondContact OD1-N 2.81Å; H692-E694 HydrophobicContact CB-CG 4.03Å
695	L	71.7	Confident	82.4	Confident	13 Å²	13	53.8 Å²	53.8	7%	0.068	31%	0.309	C	S	.	.	S	Bend	trans	-95.2	144.9	171.6	-81.5	175.2	0	0	0	112.5	D538 N540 D592 T594 L595 N690	D538-L695 HydrophobicContact CB-CD2 3.8Å; N540-L695 HydrophobicContact CB-CB 3.89Å; N540-L695 HydrophobicContact CB-CD1 4.13Å; D592-L695 HydrophobicContact CB-CD1 4.05Å; T594-L695 VanDerWaalsContact OG1-CD2 3.3Å; T594-L695 WeakPolarHBondContact OG1-CD2 3.32Å; L595-L695 HydrophobicContact CD1-CD1 3.56Å; L595-L695 HydrophobicContact CG-CD1 4.21Å; N690-L695 PolarHBondContact ND2-O 3.18Å; N690-L695 PolarHBondContact OD1-N 3.48Å
696	P	69.9	Low	82.2	Confident	74 Å²	74	53.8 Å²	53.8	48%	0.481	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	151.4	163.3	-15.3	29.2	0	0	0	110.8	V539 N540	V539-P696 HydrophobicContact CG1-CB 4.47Å; V539-P696 WeakPolarHBondContact CG1-O 3.45Å; N540-P696 WeakPolarHBondContact CB-O 3.48Å; N540-P696 PolarHBondContact N-O 3.48Å
697	G	71	Confident	82	Confident	63 Å²	63	52.2 Å²	52.2	65%	0.649	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.4	-28.6	179.5	0	0	0	0	0	113.6
698	G	81.1	Confident	81.8	Confident	27 Å²	27	52.2 Å²	52.2	28%	0.278	30%	0.301	S	S	.	.			trans	85.5	-164.6	-169.3	0	0	0	0	0	110.9	N690	N690-G698 PolarHBondContact ND2-O 2.74Å
699	S	85.3	Confident	81.7	Confident	53 Å²	53	51.6 Å²	51.6	37%	0.371	30%	0.297	S	S	.	.			trans	-100.2	134.4	178.2	-35.7	0	0	0	0	112.3	D689 N690	D689-S699 WeakPolarHBondContact OD1-CA 3.42Å; D689-S699 WeakPolarHBondContact OD1-CB 3.4Å; N690-S699 PolarHBondContact O-OG 2.9Å
700	L	86.5	Confident	81.6	Confident	56 Å²	56	51.9 Å²	51.9	29%	0.293	30%	0.298	S	S	.	.			trans	-99.4	163.1	171.3	-48.6	172.4	0	0	0	111	P543 I688 D689	P543-L700 HydrophobicContact CB-CB 3.88Å; P543-L700 HydrophobicContact CB-CD1 4.12Å; I688-L700 WeakPolarHBondContact CA-O 3.34Å; I688-L700 WeakPolarHBondContact CG2-O 3.39Å; D689-L700 VanDerWaalsContact CG-N 3.34Å; D689-L700 PolarHBondContact N-O 2.89Å; D689-L700 PolarHBondContact OD1-N 2.62Å; D689-L700 VanDerWaalsContact OD2-CB 3.22Å; D689-L700 WeakPolarHBondContact OD2-CB 2.94Å; D689-L700 PolarHBondContact OD2-N 3.02Å
701	T	89.2	Confident	81.9	Confident	98 Å²	98	54 Å²	54	60%	0.601	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.7	126.3	-174.4	61.1	0	0	0	0	111.2	C687 I688	C687-T701 WeakPolarHBondContact O-CA 3.46Å; I688-T701 HydrophobicContact CD1-CG2 4.39Å; I688-T701 HydrophobicContact CG1-CG2 4.13Å; I688-T701 HydrophobicContact CG2-CG2 4.01Å
702	S	89.5	Confident	82.3	Confident	25 Å²	25	52.1 Å²	52.1	18%	0.175	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.2	171.3	-79.6	0	0	0	0	111.6	P544 I686 C687	P544-S702 WeakPolarHBondContact O-CB 3.43Å; P544-S702 PolarHBondContact O-OG 3.45Å; I686-S702 WeakPolarHBondContact CA-O 3.47Å; C687-S702 PolarHBondContact N-O 3.47Å; C687-S702 PolarHBondContact O-N 2.75Å
703	Q	90.8	Very high	82.9	Confident	122 Å²	122	48 Å²	48	57%	0.57	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.3	173.1	-177.2	-178.8	-45.8	0	0	110.2	S684 I685 I686 D705	S684-Q703 PolarHBondContact OG-NE2 2.8Å; I685-Q703 VanDerWaalsContact O-CA 3.32Å; I685-Q703 WeakPolarHBondContact O-CA 3.27Å; I686-Q703 HydrophobicContact CG1-CG 4.34Å; Q703-D705 PolarHBondContact NE2-OD1 2.87Å
704	A	88.3	Confident	83.6	Confident	17 Å²	17	44.4 Å²	44.4	14%	0.14	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.9	170.1	0	0	0	0	0	110.4	I546 I548 S684 I685	I546-A704 HydrophobicContact CB-CB 3.9Å; I546-A704 HydrophobicContact CD1-CB 3.96Å; I546-A704 HydrophobicContact CG2-CB 3.74Å; I548-A704 HydrophobicContact CD1-CB 4.2Å; S684-A704 CarbonylContact C-O 3.56Å; S684-A704 VanDerWaalsContact CA-O 3.31Å; S684-A704 WeakPolarHBondContact CA-O 3.28Å; I685-A704 PolarHBondContact N-O 2.66Å; I685-A704 PolarHBondContact O-N 3.11Å
705	D	88.5	Confident	84.5	Confident	56 Å²	56	42.2 Å²	42.2	30%	0.299	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	125.3	177.8	-73.7	-14.2	0	0	0	110.8	K682 F683 S684 Q703 F707	K682-D705 WeakPolarHBondContact CE-OD2 3.4Å; K682-D705 IonicContact NZ-OD2 3.12Å; K682-D705 PolarHBondContact NZ-OD2 2.85Å; F683-D705 CarbonylContact O-C 3.58Å; F683-D705 WeakPolarHBondContact O-CA 3.2Å; S684-D705 WeakPolarHBondContact CB-OD1 3.47Å; S684-D705 PolarHBondContact OG-OD1 2.85Å; Q703-D705 PolarHBondContact NE2-OD1 2.87Å; D705-F707 HydrophobicContact CB-CD2 4.49Å; D705-F707 HydrophobicContact CB-CE2 3.56Å; D705-F707 HydrophobicContact CB-CZ 4.01Å; D705-F707 WeakPolarHBondContact O-CD2 3.29Å; D705-F707 WeakPolarHBondContact O-CE2 3.3Å
706	I	88.2	Confident	85.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137	176.6	-54.5	-62.9	0	0	0	109	I548 Y550 I586 L663 K682 F683 I685 V708	I548-I706 HydrophobicContact CD1-CD1 3.48Å; I548-I706 VanDerWaalsContact CD1-CD1 3.48Å; I548-I706 HydrophobicContact CG1-CD1 3.69Å; I548-I706 HydrophobicContact CG2-CD1 4.03Å; Y550-I706 HydrophobicContact CE1-CG2 4.04Å; I586-I706 HydrophobicContact CD1-CD1 4.23Å; L663-I706 HydrophobicContact CD2-CG2 4.08Å; K682-I706 WeakPolarHBondContact CA-O 3.43Å; F683-I706 HydrophobicContact CD1-CB 4.12Å; F683-I706 HydrophobicContact CD1-CG2 4.31Å; F683-I706 HydrophobicContact CD2-CB 4.31Å; F683-I706 HydrophobicContact CD2-CG1 4.4Å; F683-I706 HydrophobicContact CE1-CB 3.72Å; F683-I706 HydrophobicContact CE1-CG1 4.45Å; F683-I706 HydrophobicContact CE1-CG2 3.52Å; F683-I706 HydrophobicContact CE2-CB 3.91Å; F683-I706 HydrophobicContact CE2-CG1 3.78Å; F683-I706 HydrophobicContact CE2-CG2 4.33Å; F683-I706 HydrophobicContact CG-CB 4.4Å; F683-I706 HydrophobicContact CZ-CB 3.59Å; F683-I706 HydrophobicContact CZ-CG1 3.82Å; F683-I706 HydrophobicContact CZ-CG2 3.52Å; F683-I706 PolarHBondContact N-O 3.46Å; F683-I706 VanDerWaalsContact N-O 3.13Å; F683-I706 PolarHBondContact O-N 3.27Å; I685-I706 HydrophobicContact CD1-CD1 3.8Å; I685-I706 HydrophobicContact CD1-CG1 3.87Å; I685-I706 HydrophobicContact CG1-CD1 4.27Å; I685-I706 HydrophobicContact CG1-CG1 3.85Å; I706-V708 HydrophobicContact CG2-CG2 3.86Å
707	F	87.7	Confident	86.2	Confident	27 Å²	27	42.4 Å²	42.4	12%	0.118	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122.2	178.8	-62.9	-98.9	0	0	0	108.6	Y550 W571 G572 K682 D705	Y550-F707 PolarHBondContact OH-N 2.64Å; Y550-F707 PolarHBondContact OH-O 2.78Å; W571-F707 HydrophobicContact CB-CB 4.4Å; W571-F707 HydrophobicContact CD2-CB 3.57Å; W571-F707 HydrophobicContact CD2-CG 4.37Å; W571-F707 HydrophobicContact CE3-CB 3.73Å; W571-F707 HydrophobicContact CG-CB 3.85Å; W571-F707 HydrophobicContact CH2-CD1 4.14Å; W571-F707 HydrophobicContact CZ2-CB 4.46Å; W571-F707 AromaticContact CZ2-CD1 3.93Å; W571-F707 HydrophobicContact CZ2-CD1 3.93Å; W571-F707 HydrophobicContact CZ3-CB 4.23Å; G572-F707 PolarHBondContact N-O 2.87Å; K682-F707 HydrophobicContact CB-CD1 4.37Å; K682-F707 HydrophobicContact CB-CE1 4.32Å; K682-F707 HydrophobicContact CD-CE1 3.65Å; K682-F707 HydrophobicContact CD-CZ 3.8Å; K682-F707 VanDerWaalsContact CE-CZ 3.5Å; K682-F707 HydrophobicContact CG-CD1 4.15Å; K682-F707 HydrophobicContact CG-CE1 3.75Å; K682-F707 HydrophobicContact CG-CZ 4Å; D705-F707 HydrophobicContact CB-CD2 4.49Å; D705-F707 HydrophobicContact CB-CE2 3.56Å; D705-F707 HydrophobicContact CB-CZ 4.01Å; D705-F707 WeakPolarHBondContact O-CD2 3.29Å; D705-F707 WeakPolarHBondContact O-CE2 3.3Å
708	V	86.3	Confident	87.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	114.7	-176.7	-172.3	0	0	0	0	109.9	G572 I574 I583 F680 I681 F683 I706	G572-V708 CarbonylContact O-C 3.57Å; G572-V708 WeakPolarHBondContact O-CA 3.23Å; I574-V708 HydrophobicContact CB-CG1 4.4Å; I574-V708 HydrophobicContact CG2-CG1 3.43Å; I574-V708 VanDerWaalsContact CG2-CG1 3.43Å; I583-V708 HydrophobicContact CG2-CG1 4.42Å; I583-V708 HydrophobicContact CG2-CG2 4.15Å; F680-V708 CarbonylContact C-O 3.58Å; F680-V708 WeakPolarHBondContact CA-O 3.41Å; I681-V708 HydrophobicContact CB-CB 4.47Å; I681-V708 PolarHBondContact N-O 3.04Å; I681-V708 PolarHBondContact O-N 3.2Å; F683-V708 HydrophobicContact CE1-CG2 4.04Å; I706-V708 HydrophobicContact CG2-CG2 3.86Å
709	E	85.4	Confident	87.8	Confident	33 Å²	33	42.6 Å²	42.6	15%	0.154	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	126.7	164	176.7	-178.2	-178.7	0	0	108.8	T554 G572 K573 I574 S679 F680	T554-E709 WeakPolarHBondContact CB-OE2 3.39Å; T554-E709 HydrophobicContact CG2-CB 3.98Å; T554-E709 WeakPolarHBondContact CG2-OE2 3.42Å; T554-E709 PolarHBondContact OG1-OE2 2.69Å; G572-E709 PolarHBondContact O-N 3.3Å; K573-E709 WeakPolarHBondContact CA-O 3.22Å; K573-E709 HydrophobicContact CD-CG 4.43Å; K573-E709 WeakPolarHBondContact CD-OE2 3.34Å; K573-E709 WeakPolarHBondContact CE-OE1 3.36Å; K573-E709 WeakPolarHBondContact CE-OE2 3.29Å; K573-E709 HydrophobicContact CG-CB 4.11Å; K573-E709 HydrophobicContact CG-CG 4.03Å; K573-E709 IonicContact NZ-OE1 2.75Å; I574-E709 PolarHBondContact N-O 2.96Å; S679-E709 WeakPolarHBondContact O-CA 3.15Å; F680-E709 HydrophobicContact CD1-CB 4.19Å; F680-E709 HydrophobicContact CD1-CG 4.32Å; F680-E709 HydrophobicContact CE1-CB 4.2Å; F680-E709 HydrophobicContact CE1-CG 3.91Å
710	I	86.3	Confident	88.3	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.3	171.8	-53.3	177.7	0	0	0	108	I574 E576 R671 S679 I681 D712	I574-I710 CarbonylContact O-C 3.55Å; I574-I710 WeakPolarHBondContact O-CA 3.43Å; E576-I710 HydrophobicContact CB-CG2 3.7Å; R671-I710 HydrophobicContact CB-CB 4.39Å; R671-I710 HydrophobicContact CB-CG2 3.93Å; R671-I710 HydrophobicContact CG-CB 4.29Å; R671-I710 HydrophobicContact CG-CG2 4.34Å; S679-I710 PolarHBondContact O-N 2.69Å; I681-I710 HydrophobicContact CD1-CD1 3.89Å; I681-I710 HydrophobicContact CD1-CG1 4.37Å; I681-I710 HydrophobicContact CG1-CD1 4.2Å; I710-D712 PolarHBondContact O-N 2.75Å
711	E	84.2	Confident	88.4	Confident	45 Å²	45	42.4 Å²	42.4	21%	0.21	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	103.1	173.6	-125	169.2	-160.6	0	0	109.4	K552 K573 I574 T575 E576	K552-E711 IonicContact NZ-OE2 3.37Å; K552-E711 PolarHBondContact NZ-OE2 2.87Å; K573-E711 HydrophobicContact CD-CG 4.01Å; K573-E711 VanDerWaalsContact CD-OE1 3.25Å; K573-E711 WeakPolarHBondContact CD-OE1 3.39Å; K573-E711 WeakPolarHBondContact CE-OE1 3.39Å; K573-E711 HydrophobicContact CG-CB 4.35Å; K573-E711 HydrophobicContact CG-CG 3.94Å; K573-E711 VanDerWaalsContact NZ-CG 3.32Å; K573-E711 IonicContact NZ-OE1 3.95Å; K573-E711 PolarHBondContact NZ-OE1 2.9Å; I574-E711 PolarHBondContact O-N 3.28Å; T575-E711 VanDerWaalsContact CA-CB 3.5Å; T575-E711 WeakPolarHBondContact CA-O 3.25Å; T575-E711 HydrophobicContact CG2-CB 4.3Å; T575-E711 PolarHBondContact OG1-OE2 2.8Å; E576-E711 PolarHBondContact N-O 2.89Å
712	D	85	Confident	88.5	Confident	31 Å²	31	42.9 Å²	42.9	17%	0.166	23%	0.231	C	C	.	.			trans	-47.1	139.9	168.8	-177.6	88.9	0	0	0	114.1	E576 R671 I710 G762 H765	E576-D712 WeakPolarHBondContact OE1-CA 3.33Å; R671-D712 IonicContact CZ-OD1 3.57Å; R671-D712 IonicContact NE-OD1 3.74Å; R671-D712 PolarHBondContact NE-OD1 3.33Å; R671-D712 IonicContact NH1-OD1 2.83Å; R671-D712 PolarHBondContact NH1-OD1 3.42Å; R671-D712 IonicContact NH2-OD1 3.34Å; R671-D712 PolarHBondContact NH2-OD1 3.15Å; I710-D712 PolarHBondContact O-N 2.75Å; D712-G762 VanDerWaalsContact CG-CA 3.44Å; D712-G762 WeakPolarHBondContact OD1-CA 3.02Å; D712-G762 PolarHBondContact OD1-N 2.88Å; D712-G762 VanDerWaalsContact OD2-CA 3.28Å; D712-G762 WeakPolarHBondContact OD2-CA 3.4Å; D712-G762 PolarHBondContact OD2-N 2.99Å; D712-H765 IonicContact OD2-CE1 4Å; D712-H765 IonicContact OD2-CG 3.35Å; D712-H765 IonicContact OD2-ND1 3.87Å; D712-H765 PolarHBondContact OD2-ND1 2.74Å
713	T	85.2	Confident	88.4	Confident	35 Å²	35	48.9 Å²	48.9	22%	0.215	26%	0.26	C	S	.	.			trans	-130	153.4	176.7	56.5	0	0	0	0	110	T575 E576 D715	T575-T713 HydrophobicContact CG2-CG2 3.45Å; T575-T713 VanDerWaalsContact CG2-CG2 3.45Å; E576-T713 HydrophobicContact CG-CG2 4.05Å; E576-T713 WeakPolarHBondContact CG-OG1 3.46Å; E576-T713 PolarHBondContact OE1-N 2.69Å; E576-T713 PolarHBondContact OE1-OG1 2.93Å; T713-D715 VanDerWaalsContact C-N 3.32Å; T713-D715 PolarHBondContact O-N 3.02Å
714	N	87.6	Confident	88.4	Confident	31 Å²	31	47.1 Å²	47.1	17%	0.166	25%	0.252	C	S	.	.	S	Bend	trans	-82.4	77.4	-178.8	-159.9	108.5	0	0	0	110.4	D761 H765 D811 C812 L827 L829	N714-D761 VanDerWaalsContact C-OD2 3.32Å; N714-D761 VanDerWaalsContact CA-OD2 3.23Å; N714-D761 WeakPolarHBondContact CA-OD2 3.37Å; N714-H765 HydrophobicContact CB-CB 4.1Å; N714-H765 WeakPolarHBondContact OD1-CA 3.44Å; N714-H765 VanDerWaalsContact OD1-CB 3.22Å; N714-H765 WeakPolarHBondContact OD1-CB 3.09Å; N714-H765 PolarHBondContact OD1-CD2 2.78Å; N714-D811 PolarHBondContact ND2-OD2 2.98Å; N714-D811 PolarHBondContact OD1-OD2 2.83Å; N714-C812 PolarHBondContact OD1-SG 3.03Å; N714-L827 PolarHBondContact ND2-O 2.7Å; N714-L829 WeakPolarHBondContact O-CD1 3.34Å
715	D	87.3	Confident	88.7	Confident	74 Å²	74	47.2 Å²	47.2	40%	0.396	25%	0.249	S	C	.	.			trans	-115	-24.3	-168.4	127.4	-52.1	0	0	0	113.3	N577 T713 D761	N577-D715 PolarHBondContact ND2-OD2 2.96Å; T713-D715 VanDerWaalsContact C-N 3.32Å; T713-D715 PolarHBondContact O-N 3.02Å; D715-D761 PolarHBondContact N-OD2 2.85Å
716	N	88	Confident	88.9	Confident	36 Å²	36	47.9 Å²	47.9	19%	0.193	26%	0.255	C	S	.	.	S	Bend	trans	-92.9	146.6	170.2	-63.5	-94.3	0	0	0	110.5	K760 D761 L829	N716-K760 HydrophobicContact CB-CB 4.23Å; N716-D761 VanDerWaalsContact CB-OD1 3.23Å; N716-D761 WeakPolarHBondContact CB-OD1 3.39Å; N716-D761 PolarHBondContact N-OD1 2.88Å; N716-D761 PolarHBondContact N-OD2 3.38Å; N716-D761 PolarHBondContact ND2-OD1 2.78Å; N716-L829 WeakPolarHBondContact O-CD1 3.47Å
717	S	89.4	Confident	89.2	Confident	55 Å²	55	49.4 Å²	49.4	39%	0.385	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-91.3	146.6	169.6	-51.2	0	0	0	0	109.5	V719	S717-V719 WeakPolarHBondContact O-CG2 3.14Å; S717-V719 PolarHBondContact O-N 3.49Å
718	P	93.1	Very high	89.3	Confident	3 Å²	3	53 Å²	53	2%	0.019	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-53	128.9	172.9	-26.3	31.3	0	0	0	111.5	D759 V768 A809 D811 G831	P718-D759 HydrophobicContact CB-CB 4.47Å; P718-D759 WeakPolarHBondContact CD-OD2 3.33Å; P718-D759 HydrophobicContact CG-CB 4.46Å; P718-D759 WeakPolarHBondContact CG-OD2 3.39Å; P718-V768 HydrophobicContact CB-CG2 4.07Å; P718-V768 HydrophobicContact CG-CG2 4.28Å; P718-A809 HydrophobicContact CB-CB 3.65Å; P718-A809 HydrophobicContact CG-CB 4.44Å; P718-D811 HydrophobicContact CG-CB 4.2Å; P718-G831 WeakPolarHBondContact O-CA 3.19Å
719	V	92.5	Very high	89.4	Confident	92 Å²	92	53 Å²	53	56%	0.558	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.8	-178.6	-175.3	0	0	0	0	109.8	S717 A757 S758	S717-V719 WeakPolarHBondContact O-CG2 3.14Å; S717-V719 PolarHBondContact O-N 3.49Å; V719-A757 CarbonylContact O-C 3.5Å; V719-A757 WeakPolarHBondContact O-CA 3.42Å; V719-S758 PolarHBondContact N-O 3.46Å; V719-S758 PolarHBondContact O-N 3.47Å
720	F	94.6	Very high	89.4	Confident	14 Å²	14	53.2 Å²	53.2	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	140.1	169.8	-75.5	-84.1	0	0	0	111.2	H722 Y725 V755 H756 A757 Y770 V807 A809 T833	F720-H722 PolarHBondContact O-N 2.94Å; F720-H722 VanDerWaalsContact O-N 3.07Å; F720-Y725 HydrophobicContact CB-CE2 4.17Å; F720-Y725 AromaticContact CD1-CE2 3.94Å; F720-Y725 HydrophobicContact CD1-CE2 3.94Å; F720-Y725 HydrophobicContact CG-CE2 4.43Å; F720-V755 HydrophobicContact CD1-CB 4.35Å; F720-V755 HydrophobicContact CE1-CB 4.04Å; F720-V755 HydrophobicContact CE1-CG2 4.05Å; F720-H756 WeakPolarHBondContact CA-O 3.37Å; F720-H756 VanDerWaalsContact CD1-O 3.3Å; F720-H756 WeakPolarHBondContact CD1-O 3.42Å; F720-A757 HydrophobicContact CB-CB 4.48Å; F720-A757 HydrophobicContact CD1-CB 3.76Å; F720-A757 HydrophobicContact CD2-CB 4.29Å; F720-A757 HydrophobicContact CE1-CB 4Å; F720-A757 HydrophobicContact CG-CB 3.91Å; F720-A757 HydrophobicContact CZ-CB 4.38Å; F720-Y770 HydrophobicContact CE1-CD1 4.04Å; F720-Y770 AromaticContact CE1-CE1 3.94Å; F720-Y770 HydrophobicContact CE1-CE1 3.94Å; F720-Y770 HydrophobicContact CZ-CD1 4.29Å; F720-Y770 HydrophobicContact CZ-CE1 4.48Å; F720-V807 HydrophobicContact CE1-CG1 4.42Å; F720-V807 HydrophobicContact CZ-CB 4.18Å; F720-V807 HydrophobicContact CZ-CG1 3.98Å; F720-A809 HydrophobicContact CD2-CB 4.34Å; F720-A809 HydrophobicContact CE1-CB 4.31Å; F720-A809 HydrophobicContact CE2-CB 3.57Å; F720-A809 HydrophobicContact CZ-CB 3.55Å; F720-T833 HydrophobicContact CB-CG2 4.26Å; F720-T833 HydrophobicContact CD1-CG2 3.5Å; F720-T833 HydrophobicContact CD2-CG2 3.71Å; F720-T833 HydrophobicContact CE1-CG2 3.62Å; F720-T833 HydrophobicContact CE2-CG2 3.79Å; F720-T833 HydrophobicContact CG-CG2 3.56Å; F720-T833 HydrophobicContact CZ-CG2 3.75Å
721	D	90.5	Very high	89.4	Confident	91 Å²	91	53 Å²	53	49%	0.487	28%	0.282	S	S	.	.	S	Bend	trans	-56.7	-28.1	178.2	-57.1	-11.7	0	0	0	113.1	H756	D721-H756 PolarHBondContact N-O 2.89Å; D721-H756 IonicContact OD1-CD2 3.82Å; D721-H756 IonicContact OD2-CD2 2.84Å; D721-H756 IonicContact OD2-CG 3.44Å
722	H	90.2	Very high	89.3	Confident	108 Å²	108	54.4 Å²	54.4	50%	0.5	29%	0.291	S	S	.	.			trans	-134.2	137.8	-178	-58.5	83.1	0	0	0	111.6	F720 E724 Y725 T833	F720-H722 PolarHBondContact O-N 2.94Å; F720-H722 VanDerWaalsContact O-N 3.07Å; H722-E724 VanDerWaalsContact C-N 3.3Å; H722-E724 PolarHBondContact O-N 3.38Å; H722-Y725 HydrophobicContact CB-CD1 4.45Å; H722-Y725 HydrophobicContact CB-CD2 4.13Å; H722-Y725 HydrophobicContact CB-CE1 4.26Å; H722-Y725 HydrophobicContact CB-CE2 3.93Å; H722-Y725 HydrophobicContact CB-CG 4.39Å; H722-Y725 AromaticContact ND1-CE1 3.73Å; H722-Y725 AromaticContact ND1-CZ 3.87Å; H722-Y725 WeakPolarHBondContact O-CE2 3.42Å; H722-T833 PolarHBondContact O-OG1 3.21Å
723	N	86.9	Confident	88.9	Confident	150 Å²	150	54.1 Å²	54.1	80%	0.802	29%	0.289	S	S	*	.	S	Bend	trans	-70.1	-24.6	176.8	-66.7	-11.3	0	0	0	113.5	T833 N834	N723-T833 VanDerWaalsContact C-OG1 3.26Å; N723-T833 PolarHBondContact O-OG1 3.07Å; N723-T833 VanDerWaalsContact O-OG1 3.14Å; N723-N834 PolarHBondContact O-N 3.25Å
724	E	91.3	Very high	88.5	Confident	86 Å²	86	53 Å²	53	40%	0.402	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	124.2	171.8	-176.2	172.1	-174.7	0	0	107.1	H722 N834 R836	H722-E724 VanDerWaalsContact C-N 3.3Å; H722-E724 PolarHBondContact O-N 3.38Å; E724-N834 WeakPolarHBondContact CA-O 3.32Å; E724-N834 HydrophobicContact CB-CB 4.45Å; E724-N834 HydrophobicContact CG-CB 4.22Å; E724-R836 IonicContact OE1-CZ 3.3Å; E724-R836 IonicContact OE1-NE 2.84Å; E724-R836 PolarHBondContact OE1-NE 2.67Å; E724-R836 IonicContact OE1-NH2 3.87Å; E724-R836 PolarHBondContact OE1-NH2 2.87Å
725	Y	93.5	Very high	87.4	Confident	19 Å²	19	60 Å²	60	8%	0.075	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131	170.4	-75	-97.2	0	0	0	109.2	F720 H722 F727 V755 H756 T833 N834 R836	F720-Y725 HydrophobicContact CB-CE2 4.17Å; F720-Y725 AromaticContact CD1-CE2 3.94Å; F720-Y725 HydrophobicContact CD1-CE2 3.94Å; F720-Y725 HydrophobicContact CG-CE2 4.43Å; H722-Y725 HydrophobicContact CB-CD1 4.45Å; H722-Y725 HydrophobicContact CB-CD2 4.13Å; H722-Y725 HydrophobicContact CB-CE1 4.26Å; H722-Y725 HydrophobicContact CB-CE2 3.93Å; H722-Y725 HydrophobicContact CB-CG 4.39Å; H722-Y725 AromaticContact ND1-CE1 3.73Å; H722-Y725 AromaticContact ND1-CZ 3.87Å; H722-Y725 WeakPolarHBondContact O-CE2 3.42Å; Y725-F727 HydrophobicContact CD1-CE1 4.48Å; Y725-F727 HydrophobicContact CD1-CE2 4.34Å; Y725-F727 AromaticContact CD1-CZ 3.75Å; Y725-F727 HydrophobicContact CD1-CZ 3.75Å; Y725-F727 HydrophobicContact CG-CE2 4.33Å; Y725-F727 HydrophobicContact CG-CZ 4.2Å; Y725-V755 HydrophobicContact CD1-CG1 4.13Å; Y725-V755 HydrophobicContact CD2-CB 4.38Å; Y725-V755 HydrophobicContact CD2-CG1 3.79Å; Y725-V755 HydrophobicContact CE1-CG1 4.41Å; Y725-V755 HydrophobicContact CE2-CB 4.16Å; Y725-V755 HydrophobicContact CE2-CG1 4.07Å; Y725-V755 HydrophobicContact CG-CG1 3.81Å; Y725-H756 PolarHBondContact OH-N 2.99Å; Y725-H756 PolarHBondContact OH-O 2.9Å; Y725-T833 HydrophobicContact CD2-CG2 3.89Å; Y725-T833 HydrophobicContact CE2-CG2 4.03Å; Y725-N834 PolarHBondContact N-O 2.84Å; Y725-R836 PolarHBondContact O-N 3.47Å
726	T	94.3	Very high	86.2	Confident	69 Å²	69	62.8 Å²	62.8	42%	0.423	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	119.9	171.3	-57.4	0	0	0	0	109.3	R836 I838	T726-R836 CarbonylContact C-O 3.58Å; T726-R836 WeakPolarHBondContact CA-O 3.31Å; T726-R836 HydrophobicContact CG2-CG 4.25Å; T726-I838 HydrophobicContact CG2-CD1 3.75Å; T726-I838 HydrophobicContact CG2-CG1 4.22Å
727	F	93.7	Very high	84.6	Confident	32 Å²	32	68.5 Å²	68.5	14%	0.14	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	156.9	172	-58.6	-65.7	0	0	0	110.7	Y725 I752 V755 L789 V835 R836 I837 I838	Y725-F727 HydrophobicContact CD1-CE1 4.48Å; Y725-F727 HydrophobicContact CD1-CE2 4.34Å; Y725-F727 AromaticContact CD1-CZ 3.75Å; Y725-F727 HydrophobicContact CD1-CZ 3.75Å; Y725-F727 HydrophobicContact CG-CE2 4.33Å; Y725-F727 HydrophobicContact CG-CZ 4.2Å; F727-I752 HydrophobicContact CB-CG2 3.62Å; F727-I752 HydrophobicContact CD2-CG2 4.31Å; F727-I752 HydrophobicContact CG-CG2 4.07Å; F727-V755 HydrophobicContact CE2-CG1 3.94Å; F727-V755 HydrophobicContact CZ-CG1 4.14Å; F727-L789 HydrophobicContact CD2-CD1 4.05Å; F727-L789 HydrophobicContact CE2-CD1 3.67Å; F727-V835 HydrophobicContact CD2-CG1 3.81Å; F727-V835 HydrophobicContact CE2-CG1 3.96Å; F727-R836 PolarHBondContact N-O 2.85Å; F727-I837 WeakPolarHBondContact O-CA 3.5Å; F727-I838 PolarHBondContact O-N 2.74Å
728	H	90.6	Very high	82.5	Confident	104 Å²	104	70.9 Å²	70.9	48%	0.481	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.4	178.3	-80.7	-95.4	0	0	0	108.7	I838 D840	H728-I838 WeakPolarHBondContact CA-O 3.33Å; H728-D840 WeakPolarHBondContact CB-OD2 3.41Å; H728-D840 IonicContact CE1-OD1 2.64Å; H728-D840 IonicContact CG-OD1 3.1Å; H728-D840 IonicContact CG-OD2 3.09Å; H728-D840 IonicContact ND1-OD1 3.82Å; H728-D840 PolarHBondContact ND1-OD1 2.81Å; H728-D840 IonicContact ND1-OD2 3.99Å
729	L	88.6	Confident	80.5	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	108.7	-177.8	173.7	59.7	0	0	0	109.2	E731 H733 Y750 I752 A791 F795 I837 I838 I839 D840	L729-E731 PolarHBondContact O-N 3.2Å; L729-H733 HydrophobicContact CD1-CB 4.33Å; L729-Y750 HydrophobicContact CD1-CD1 3.42Å; L729-Y750 VanDerWaalsContact CD1-CD1 3.42Å; L729-Y750 HydrophobicContact CD1-CE1 3.45Å; L729-Y750 VanDerWaalsContact CD1-CE1 3.45Å; L729-Y750 HydrophobicContact CD1-CG 4.47Å; L729-I752 HydrophobicContact CD2-CG1 4.33Å; L729-A791 HydrophobicContact CD2-CB 4.04Å; L729-F795 HydrophobicContact CD2-CD2 3.58Å; L729-F795 HydrophobicContact CD2-CE2 3.89Å; L729-F795 HydrophobicContact CD2-CG 4.25Å; L729-I837 HydrophobicContact CB-CG2 3.7Å; L729-I837 HydrophobicContact CD2-CG2 4.31Å; L729-I838 PolarHBondContact N-O 3.42Å; L729-I839 HydrophobicContact CB-CD1 4.1Å; L729-I839 HydrophobicContact CD2-CD1 3.97Å; L729-I839 HydrophobicContact CG-CD1 4.23Å; L729-I839 CarbonylContact O-C 3.57Å; L729-I839 WeakPolarHBondContact O-CA 3.01Å; L729-D840 PolarHBondContact O-N 2.88Å
730	P	85.5	Confident	78.2	Confident	37 Å²	37	82 Å²	82	24%	0.24	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	133.5	169.5	-24.4	34.8	0	0	0	110.5	H733 L842	P730-H733 PolarHBondContact O-ND1 2.99Å; P730-L842 HydrophobicContact CB-CD1 4.36Å; P730-L842 HydrophobicContact CB-CD2 4.48Å
731	E	85.9	Confident	75.6	Confident	1 Å²	1	89.2 Å²	89.2	1%	0.005	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	174.9	178.6	70.6	-165.2	126.4	0	0	113.4	L729 H733 R797 I839 D840 D841 L842	L729-E731 PolarHBondContact O-N 3.2Å; E731-H733 PolarHBondContact O-CE1 3.09Å; E731-H733 PolarHBondContact O-N 2.95Å; E731-H733 VanDerWaalsContact O-N 3.11Å; E731-H733 PolarHBondContact O-ND1 3.45Å; E731-R797 WeakPolarHBondContact OE2-CB 3.48Å; E731-R797 PolarHBondContact OE2-N 2.76Å; E731-I839 HydrophobicContact CB-CG2 3.67Å; E731-D840 PolarHBondContact N-O 3.01Å; E731-D841 WeakPolarHBondContact OE1-CA 3.39Å; E731-L842 HydrophobicContact CG-CB 4.03Å; E731-L842 HydrophobicContact CG-CD1 3.95Å; E731-L842 HydrophobicContact CG-CG 3.96Å; E731-L842 WeakPolarHBondContact O-CD1 3.46Å; E731-L842 PolarHBondContact OE1-N 3.17Å
732	N	82.3	Confident	73.7	Confident	74 Å²	74	91 Å²	91	40%	0.396	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	14.8	-170.8	-73.7	-73.4	0	0	0	114.6	P734 R735 F795 D844	N732-P734 CarbonylContact O-C 3.52Å; N732-R735 WeakPolarHBondContact O-CG 3.2Å; N732-R735 PolarHBondContact O-N 3.18Å; N732-F795 PolarHBondContact N-O 2.9Å; N732-D844 PolarHBondContact ND2-OD2 3.06Å
733	H	75.7	Confident	71.4	Confident	26 Å²	26	92 Å²	92	12%	0.12	46%	0.461	C	S	.	.			trans	-116.2	138.5	176.7	-64.3	84.3	0	0	0	112.7	L729 P730 E731 R735 Y750	L729-H733 HydrophobicContact CD1-CB 4.33Å; P730-H733 PolarHBondContact O-ND1 2.99Å; E731-H733 PolarHBondContact O-CE1 3.09Å; E731-H733 PolarHBondContact O-N 2.95Å; E731-H733 VanDerWaalsContact O-N 3.11Å; E731-H733 PolarHBondContact O-ND1 3.45Å; H733-R735 PolarHBondContact NE2-NE 2.62Å; H733-Y750 HydrophobicContact CB-CD1 4.22Å; H733-Y750 HydrophobicContact CB-CD2 3.83Å; H733-Y750 HydrophobicContact CB-CE1 4.43Å; H733-Y750 HydrophobicContact CB-CE2 4.05Å; H733-Y750 HydrophobicContact CB-CG 3.91Å; H733-Y750 AromaticContact CD2-CD2 3.89Å; H733-Y750 AromaticContact CD2-CE2 3.6Å; H733-Y750 AromaticContact CG-CE2 3.95Å
734	P	75.9	Confident	69.4	Low	10 Å²	10	91 Å²	91	7%	0.065	46%	0.463	C	S	.	.	S	Bend	cis	-63	140	-6.2	26.2	-35.7	0	0	0	113	N732 I736 E748	N732-P734 CarbonylContact O-C 3.52Å; P734-I736 PolarHBondContact O-N 2.89Å; P734-E748 WeakPolarHBondContact CB-O 3.2Å; P734-E748 WeakPolarHBondContact CG-O 3.44Å
735	R	64.8	Low	67.1	Low	179 Å²	179	91.9 Å²	91.9	68%	0.675	48%	0.478	S	S	*	.			trans	-70.2	128.2	175.6	-65.5	179.4	-178.3	-155.5	-6.9	109.3	N732 H733 K737	N732-R735 WeakPolarHBondContact O-CG 3.2Å; N732-R735 PolarHBondContact O-N 3.18Å; H733-R735 PolarHBondContact NE2-NE 2.62Å; R735-K737 PolarHBondContact O-N 2.84Å
736	I	62.4	Low	65.1	Low	132 Å²	132	98.1 Å²	98.1	68%	0.677	51%	0.508	S	S	*	.			trans	-72.2	113.8	175	-58.9	176	0	0	0	108.5	P734 S738 P794	P734-I736 PolarHBondContact O-N 2.89Å; I736-S738 PolarHBondContact O-N 2.87Å; I736-P794 HydrophobicContact CD1-CG 4.19Å; I736-P794 HydrophobicContact CG1-CG 4.42Å
737	K	54.4	Low	63.2	Low	156 Å²	156	100 Å²	100	68%	0.678	52%	0.515	S	S	*	.			trans	-65.2	90.4	172.3	-81.2	-179.9	168.4	168.7	0	110.9	R735 E739 E748	R735-K737 PolarHBondContact O-N 2.84Å; K737-E739 VanDerWaalsContact C-N 3.31Å; K737-E739 PolarHBondContact O-N 2.88Å; K737-E739 VanDerWaalsContact O-N 3.09Å; K737-E748 VanDerWaalsContact CD-OE2 3.27Å; K737-E748 WeakPolarHBondContact CD-OE2 3.18Å; K737-E748 WeakPolarHBondContact CE-OE1 3.49Å; K737-E748 WeakPolarHBondContact CE-OE2 3.37Å; K737-E748 VanDerWaalsContact NZ-CD 3.26Å; K737-E748 IonicContact NZ-OE1 2.75Å; K737-E748 PolarHBondContact NZ-OE1 2.7Å; K737-E748 IonicContact NZ-OE2 3.49Å; K737-E748 PolarHBondContact NZ-OE2 3.16Å
738	S	46	Very low	61.7	Low	106 Å²	106	103.3 Å²	103.3	74%	0.741	53%	0.531	S	S	*	.			trans	-85	50.6	-172	65.8	0	0	0	0	114.5	I736	I736-S738 PolarHBondContact O-N 2.87Å
739	E	49.9	Very low	61	Low	168 Å²	168	105.2 Å²	105.2	79%	0.785	53%	0.533	S	S	*	.	S	Bend	trans	-154.2	118.4	172.3	-114.8	161	-140.2	0	0	114.5	K737	K737-E739 VanDerWaalsContact C-N 3.31Å; K737-E739 PolarHBondContact O-N 2.88Å; K737-E739 VanDerWaalsContact O-N 3.09Å
740	H	44.2	Very low	60.9	Low	160 Å²	160	108.8 Å²	108.8	74%	0.741	55%	0.547	S	S	*	.	S	Bend	trans	54.7	110.9	159.1	-66.7	82.4	0	0	0	121.9	I742	H740-I742 PolarHBondContact O-N 3.45Å
741	N	41.4	Very low	61.1	Low	165 Å²	165	110.2 Å²	110.2	88%	0.882	56%	0.557	S	S	*	*			trans	57.4	49.4	143.8	-72.3	-3.4	0	0	0	119.6
742	I	49.4	Very low	61.3	Low	130 Å²	130	111.1 Å²	111.1	67%	0.667	56%	0.562	S	S	*	*			trans	-118.6	153.7	160.7	-60.7	179.3	0	0	0	109.5	H740 E746	H740-I742 PolarHBondContact O-N 3.45Å; I742-E746 VanDerWaalsContact CG2-OE2 3.3Å; I742-E746 WeakPolarHBondContact CG2-OE2 3.23Å
743	N	42	Very low	61.6	Low	127 Å²	127	108.1 Å²	108.1	68%	0.679	55%	0.548	S	S	*	.			trans	-60.4	149.5	-175.5	-76.6	-53.7	0	0	0	112.3	S745	N743-S745 PolarHBondContact O-N 3.47Å
744	P	44.7	Very low	62.4	Low	131 Å²	131	111.6 Å²	111.6	85%	0.851	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	34.5	174.5	-20.4	34.2	0	0	0	115.6
745	S	44.4	Very low	63.3	Low	103 Å²	103	111.1 Å²	111.1	72%	0.72	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	-20.1	-172.9	-53.5	0	0	0	0	112.9	N743	N743-S745 PolarHBondContact O-N 3.47Å
746	E	50.2	Low	64.7	Low	151 Å²	151	106.1 Å²	106.1	71%	0.706	55%	0.547	S	S	*	.			trans	-103.6	74.3	177.4	-67.6	-177.9	127.1	0	0	110.5	I742 E748	I742-E746 VanDerWaalsContact CG2-OE2 3.3Å; I742-E746 WeakPolarHBondContact CG2-OE2 3.23Å; E746-E748 PolarHBondContact O-N 3.1Å
747	I	54.6	Low	66.1	Low	109 Å²	109	100 Å²	100	56%	0.559	52%	0.516	S	S	*	.			trans	-78.1	113.1	160.1	-61.2	175.7	0	0	0	106.4	R749 V792	I747-R749 PolarHBondContact O-N 3.23Å; I747-V792 HydrophobicContact CG2-CB 4.37Å; I747-V792 WeakPolarHBondContact CG2-O 3.23Å
748	E	62.2	Low	67.9	Low	101 Å²	101	95.4 Å²	95.4	47%	0.472	50%	0.503	S	S	.	.			trans	-59	125.1	174.5	-71.5	-169.5	133.9	0	0	110.1	P734 K737 E746	P734-E748 WeakPolarHBondContact CB-O 3.2Å; P734-E748 WeakPolarHBondContact CG-O 3.44Å; K737-E748 VanDerWaalsContact CD-OE2 3.27Å; K737-E748 WeakPolarHBondContact CD-OE2 3.18Å; K737-E748 WeakPolarHBondContact CE-OE1 3.49Å; K737-E748 WeakPolarHBondContact CE-OE2 3.37Å; K737-E748 VanDerWaalsContact NZ-CD 3.26Å; K737-E748 IonicContact NZ-OE1 2.75Å; K737-E748 PolarHBondContact NZ-OE1 2.7Å; K737-E748 IonicContact NZ-OE2 3.49Å; K737-E748 PolarHBondContact NZ-OE2 3.16Å; E746-E748 PolarHBondContact O-N 3.1Å
749	R	77.6	Confident	70	Confident	143 Å²	143	91.4 Å²	91.4	54%	0.54	47%	0.474	S	S	.	.			trans	-91.5	113.2	-176.6	-58.7	-168.6	-173.6	175.9	1.9	108.8	I747 P751 Q781 Y790 V792	I747-R749 PolarHBondContact O-N 3.23Å; R749-P751 WeakPolarHBondContact O-CD 3.47Å; R749-Q781 VanDerWaalsContact CZ-OE1 3.22Å; R749-Y790 HydrophobicContact CB-CD1 3.57Å; R749-Y790 HydrophobicContact CB-CE1 4.33Å; R749-Y790 HydrophobicContact CB-CG 3.95Å; R749-V792 HydrophobicContact CG-CG1 4.05Å
750	Y	85.4	Confident	71.8	Confident	75 Å²	75	89.7 Å²	89.7	29%	0.294	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	120.7	178	-171.8	-89.5	0	0	0	110.2	L729 H733 I752 Y790 A791	L729-Y750 HydrophobicContact CD1-CD1 3.42Å; L729-Y750 VanDerWaalsContact CD1-CD1 3.42Å; L729-Y750 HydrophobicContact CD1-CE1 3.45Å; L729-Y750 VanDerWaalsContact CD1-CE1 3.45Å; L729-Y750 HydrophobicContact CD1-CG 4.47Å; H733-Y750 HydrophobicContact CB-CD1 4.22Å; H733-Y750 HydrophobicContact CB-CD2 3.83Å; H733-Y750 HydrophobicContact CB-CE1 4.43Å; H733-Y750 HydrophobicContact CB-CE2 4.05Å; H733-Y750 HydrophobicContact CB-CG 3.91Å; H733-Y750 AromaticContact CD2-CD2 3.89Å; H733-Y750 AromaticContact CD2-CE2 3.6Å; H733-Y750 AromaticContact CG-CE2 3.95Å; Y750-I752 PolarHBondContact O-N 3.01Å; Y750-Y790 CarbonylContact O-C 3.51Å; Y750-Y790 VanDerWaalsContact O-CA 3.25Å; Y750-Y790 WeakPolarHBondContact O-CA 3.23Å; Y750-A791 PolarHBondContact N-O 3.26Å; Y750-A791 PolarHBondContact O-N 3.01Å
751	P	89	Confident	73.9	Confident	68 Å²	68	82.6 Å²	82.6	44%	0.442	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	127.2	-179.8	28.1	-32.9	0	0	0	111.2	R749 M788 Y790	R749-P751 WeakPolarHBondContact O-CD 3.47Å; P751-M788 HydrophobicContact CB-CE 3.61Å; P751-Y790 HydrophobicContact CB-CD1 4.3Å; P751-Y790 HydrophobicContact CB-CE1 4.21Å
752	I	90.8	Very high	75.7	Confident	20 Å²	20	75.2 Å²	75.2	10%	0.103	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-49.2	-178.8	-59.9	156.7	0	0	0	110.9	F727 L729 Y750 I780 L789 A791 I837	F727-I752 HydrophobicContact CB-CG2 3.62Å; F727-I752 HydrophobicContact CD2-CG2 4.31Å; F727-I752 HydrophobicContact CG-CG2 4.07Å; L729-I752 HydrophobicContact CD2-CG1 4.33Å; Y750-I752 PolarHBondContact O-N 3.01Å; I752-I780 HydrophobicContact CD1-CD1 3.68Å; I752-L789 HydrophobicContact CB-CB 4.19Å; I752-L789 HydrophobicContact CD1-CB 4.24Å; I752-L789 PolarHBondContact N-O 2.88Å; I752-A791 HydrophobicContact CD1-CB 4.03Å; I752-A791 VanDerWaalsContact CD1-N 3.31Å; I752-A791 HydrophobicContact CG1-CB 4.23Å; I752-I837 HydrophobicContact CD1-CD1 3.83Å; I752-I837 HydrophobicContact CG2-CD1 4.09Å; I752-I837 HydrophobicContact CG2-CG1 4.29Å
753	G	89.5	Confident	77.1	Confident	11 Å²	11	72.6 Å²	72.6	11%	0.113	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.3	161.7	-173.1	0	0	0	0	0	111.7	L789	G753-L789 WeakPolarHBondContact O-CB 3.36Å; G753-L789 PolarHBondContact O-N 2.71Å
754	M	92.8	Very high	78.9	Confident	98 Å²	98	69.5 Å²	69.5	48%	0.483	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.8	-178.7	-167.9	175.5	69.9	0	0	110	N786 M788	M754-N786 VanDerWaalsContact CG-O 3.3Å; M754-N786 WeakPolarHBondContact CG-O 3.43Å; M754-M788 HydrophobicContact CB-SD 3.75Å; M754-M788 HydrophobicContact CG-SD 4.4Å
755	V	93.5	Very high	80.8	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.35	C	S	.	.			trans	-93.2	131.1	162.6	-65.3	0	0	0	0	108.9	F720 Y725 F727 Y770 I782 G787 L789 V807 V835	F720-V755 HydrophobicContact CD1-CB 4.35Å; F720-V755 HydrophobicContact CE1-CB 4.04Å; F720-V755 HydrophobicContact CE1-CG2 4.05Å; Y725-V755 HydrophobicContact CD1-CG1 4.13Å; Y725-V755 HydrophobicContact CD2-CB 4.38Å; Y725-V755 HydrophobicContact CD2-CG1 3.79Å; Y725-V755 HydrophobicContact CE1-CG1 4.41Å; Y725-V755 HydrophobicContact CE2-CB 4.16Å; Y725-V755 HydrophobicContact CE2-CG1 4.07Å; Y725-V755 HydrophobicContact CG-CG1 3.81Å; F727-V755 HydrophobicContact CE2-CG1 3.94Å; F727-V755 HydrophobicContact CZ-CG1 4.14Å; V755-Y770 HydrophobicContact CG2-CD1 4.13Å; V755-Y770 HydrophobicContact CG2-CE1 4.47Å; V755-I782 HydrophobicContact CG2-CD1 3.81Å; V755-G787 WeakPolarHBondContact CG2-O 3.21Å; V755-G787 PolarHBondContact N-O 2.93Å; V755-L789 HydrophobicContact CG1-CD1 4.03Å; V755-V807 HydrophobicContact CG2-CG1 4.21Å; V755-V835 HydrophobicContact CG1-CG2 3.77Å
756	H	93.6	Very high	82.6	Confident	75 Å²	75	61.4 Å²	61.4	35%	0.347	33%	0.327	S	S	.	.			trans	-115.3	137.6	177.7	-169.5	67	0	0	0	110.4	F720 D721 Y725	F720-H756 WeakPolarHBondContact CA-O 3.37Å; F720-H756 VanDerWaalsContact CD1-O 3.3Å; F720-H756 WeakPolarHBondContact CD1-O 3.42Å; D721-H756 PolarHBondContact N-O 2.89Å; D721-H756 IonicContact OD1-CD2 3.82Å; D721-H756 IonicContact OD2-CD2 2.84Å; D721-H756 IonicContact OD2-CG 3.44Å; Y725-H756 PolarHBondContact OH-N 2.99Å; Y725-H756 PolarHBondContact OH-O 2.9Å
757	A	92.4	Very high	84.4	Confident	4 Å²	4	55.3 Å²	55.3	3%	0.033	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.5	168	0	0	0	0	0	109.5	V719 F720 V768 Y770 A809	V719-A757 CarbonylContact O-C 3.5Å; V719-A757 WeakPolarHBondContact O-CA 3.42Å; F720-A757 HydrophobicContact CB-CB 4.48Å; F720-A757 HydrophobicContact CD1-CB 3.76Å; F720-A757 HydrophobicContact CD2-CB 4.29Å; F720-A757 HydrophobicContact CE1-CB 4Å; F720-A757 HydrophobicContact CG-CB 3.91Å; F720-A757 HydrophobicContact CZ-CB 4.38Å; A757-V768 HydrophobicContact CB-CG1 4.35Å; A757-Y770 HydrophobicContact CB-CE1 3.97Å; A757-Y770 PolarHBondContact N-OH 2.79Å; A757-Y770 PolarHBondContact O-OH 3.47Å; A757-A809 HydrophobicContact CB-CB 3.61Å
758	S	91.6	Very high	86	Confident	59 Å²	59	51.1 Å²	51.1	41%	0.413	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.9	169.1	59.7	0	0	0	0	109.2	V719	V719-S758 PolarHBondContact N-O 3.46Å; V719-S758 PolarHBondContact O-N 3.47Å
759	D	91.1	Very high	87.3	Confident	22 Å²	22	46.8 Å²	46.8	12%	0.118	26%	0.261	C	S	.	.			trans	-98.6	152.9	159.6	-158.1	-44.8	0	0	0	108.3	P718 D761 V768	P718-D759 HydrophobicContact CB-CB 4.47Å; P718-D759 WeakPolarHBondContact CD-OD2 3.33Å; P718-D759 HydrophobicContact CG-CB 4.46Å; P718-D759 WeakPolarHBondContact CG-OD2 3.39Å; D759-D761 PolarHBondContact OD1-N 3.32Å; D759-V768 HydrophobicContact CB-CG2 3.65Å
760	K	87.7	Confident	88.1	Confident	131 Å²	131	40.7 Å²	40.7	57%	0.57	24%	0.238	S	C	*	.			trans	-88.8	-26.8	177.2	-68	-174.8	177.6	178.1	0	112.4	R671 E672 N716	R671-K760 PolarHBondContact NH2-O 2.78Å; E672-K760 HydrophobicContact CB-CD 4.17Å; E672-K760 HydrophobicContact CG-CB 3.7Å; E672-K760 HydrophobicContact CG-CD 3.97Å; N716-K760 HydrophobicContact CB-CB 4.23Å
761	D	87.7	Confident	88.3	Confident	11 Å²	11	43.2 Å²	43.2	6%	0.059	25%	0.251	C	S	.	.	S	Bend	trans	-68.9	177.1	-168.6	-63.9	-2.3	0	0	0	112.1	N714 D715 N716 D759 H765 G766	N714-D761 VanDerWaalsContact C-OD2 3.32Å; N714-D761 VanDerWaalsContact CA-OD2 3.23Å; N714-D761 WeakPolarHBondContact CA-OD2 3.37Å; D715-D761 PolarHBondContact N-OD2 2.85Å; N716-D761 VanDerWaalsContact CB-OD1 3.23Å; N716-D761 WeakPolarHBondContact CB-OD1 3.39Å; N716-D761 PolarHBondContact N-OD1 2.88Å; N716-D761 PolarHBondContact N-OD2 3.38Å; N716-D761 PolarHBondContact ND2-OD1 2.78Å; D759-D761 PolarHBondContact OD1-N 3.32Å; D761-H765 HydrophobicContact CB-CB 3.62Å; D761-G766 WeakPolarHBondContact O-CA 3.47Å
762	G	80.3	Confident	88.5	Confident	11 Å²	11	41.4 Å²	41.4	11%	0.113	24%	0.237	C	C	.	.			trans	-102.3	140.3	-163.6	0	0	0	0	0	115.2	D712 I764 H765	D712-G762 VanDerWaalsContact CG-CA 3.44Å; D712-G762 WeakPolarHBondContact OD1-CA 3.02Å; D712-G762 PolarHBondContact OD1-N 2.88Å; D712-G762 VanDerWaalsContact OD2-CA 3.28Å; D712-G762 WeakPolarHBondContact OD2-CA 3.4Å; D712-G762 PolarHBondContact OD2-N 2.99Å; G762-I764 PolarHBondContact O-N 2.82Å; G762-H765 PolarHBondContact O-N 3.01Å
763	G	78.7	Confident	88.3	Confident	74 Å²	74	43.8 Å²	43.8	76%	0.763	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	-101.6	167.4	0	0	0	0	0	112.7
764	I	80.2	Confident	87.8	Confident	62 Å²	62	45.7 Å²	45.7	32%	0.318	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-25.5	178.7	65.3	180	0	0	0	113.4	G762 S767 C812 Q822	G762-I764 PolarHBondContact O-N 2.82Å; I764-S767 WeakPolarHBondContact O-CB 3.08Å; I764-S767 PolarHBondContact O-N 2.75Å; I764-C812 WeakPolarHBondContact O-CA 3.27Å; I764-C812 PolarHBondContact O-N 3.34Å; I764-C812 VanDerWaalsContact O-N 3.15Å; I764-Q822 HydrophobicContact CD1-CG 3.9Å
765	H	83.6	Confident	87.3	Confident	42 Å²	42	43.8 Å²	43.8	19%	0.194	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-57.4	176	-58.6	146.5	0	0	0	108.4	D712 N714 D761 G762 S767 D811 C812	D712-H765 IonicContact OD2-CE1 4Å; D712-H765 IonicContact OD2-CG 3.35Å; D712-H765 IonicContact OD2-ND1 3.87Å; D712-H765 PolarHBondContact OD2-ND1 2.74Å; N714-H765 HydrophobicContact CB-CB 4.1Å; N714-H765 WeakPolarHBondContact OD1-CA 3.44Å; N714-H765 VanDerWaalsContact OD1-CB 3.22Å; N714-H765 WeakPolarHBondContact OD1-CB 3.09Å; N714-H765 PolarHBondContact OD1-CD2 2.78Å; D761-H765 HydrophobicContact CB-CB 3.62Å; G762-H765 PolarHBondContact O-N 3.01Å; H765-S767 PolarHBondContact O-N 2.73Å; H765-D811 WeakPolarHBondContact O-CB 3.43Å; H765-C812 PolarHBondContact O-N 2.79Å
766	G	83.3	Confident	86.1	Confident	23 Å²	23	47.9 Å²	47.9	24%	0.237	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	6.5	173.5	0	0	0	0	0	116.9	D761 V768	D761-G766 WeakPolarHBondContact O-CA 3.47Å; G766-V768 PolarHBondContact O-N 2.87Å
767	S	86.1	Confident	84.9	Confident	23 Å²	23	47 Å²	47	16%	0.161	29%	0.285	C	S	.	.			trans	-88.4	84.9	-179.5	-173.7	0	0	0	0	111.7	I764 H765 D811 T813	I764-S767 WeakPolarHBondContact O-CB 3.08Å; I764-S767 PolarHBondContact O-N 2.75Å; H765-S767 PolarHBondContact O-N 2.73Å; S767-D811 CarbonylContact O-C 3.58Å; S767-T813 PolarHBondContact O-OG1 3.3Å; S767-T813 PolarHBondContact OG-O 3.09Å
768	V	88.8	Confident	84.2	Confident	21 Å²	21	48.6 Å²	48.6	13%	0.127	30%	0.302	C	S	.	.			trans	-68.7	139.4	-179.7	-177.6	0	0	0	0	112.8	P718 A757 D759 G766 Y770 A809 I810	P718-V768 HydrophobicContact CB-CG2 4.07Å; P718-V768 HydrophobicContact CG-CG2 4.28Å; A757-V768 HydrophobicContact CB-CG1 4.35Å; D759-V768 HydrophobicContact CB-CG2 3.65Å; G766-V768 PolarHBondContact O-N 2.87Å; V768-Y770 HydrophobicContact CG1-CE1 4.22Å; V768-Y770 HydrophobicContact CG1-CE2 4.31Å; V768-A809 HydrophobicContact CG1-CB 3.73Å; V768-I810 CarbonylContact C-O 3.55Å; V768-I810 WeakPolarHBondContact CA-O 3.3Å
769	T	90.5	Very high	84	Confident	10 Å²	10	45.9 Å²	45.9	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	152.9	161	54.3	0	0	0	0	112.4	K784 F785 A809 I810 T813	T769-K784 CarbonylContact C-O 3.58Å; T769-K784 WeakPolarHBondContact CA-O 3.43Å; T769-K784 WeakPolarHBondContact CB-O 3.44Å; T769-K784 HydrophobicContact CG2-CD 4.41Å; T769-K784 HydrophobicContact CG2-CG 3.89Å; T769-K784 WeakPolarHBondContact CG2-O 3.43Å; T769-F785 HydrophobicContact CG2-CD1 4.31Å; T769-A809 CarbonylContact O-C 3.59Å; T769-A809 WeakPolarHBondContact O-CA 3.38Å; T769-I810 PolarHBondContact N-O 3.37Å; T769-I810 PolarHBondContact O-N 3.2Å; T769-I810 PolarHBondContact OG1-O 3.48Å; T769-T813 HydrophobicContact CG2-CG2 3.9Å; T769-T813 VanDerWaalsContact CG2-OG1 3.23Å; T769-T813 WeakPolarHBondContact CG2-OG1 3.26Å; T769-T813 WeakPolarHBondContact OG1-CG2 3.32Å
770	Y	93	Very high	83.9	Confident	14 Å²	14	44.9 Å²	44.9	6%	0.055	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	144.3	-172.3	-55	-89.3	0	0	0	112.4	F720 V755 A757 V768 I782 K784 G787 H808 A809	F720-Y770 HydrophobicContact CE1-CD1 4.04Å; F720-Y770 AromaticContact CE1-CE1 3.94Å; F720-Y770 HydrophobicContact CE1-CE1 3.94Å; F720-Y770 HydrophobicContact CZ-CD1 4.29Å; F720-Y770 HydrophobicContact CZ-CE1 4.48Å; V755-Y770 HydrophobicContact CG2-CD1 4.13Å; V755-Y770 HydrophobicContact CG2-CE1 4.47Å; A757-Y770 HydrophobicContact CB-CE1 3.97Å; A757-Y770 PolarHBondContact N-OH 2.79Å; A757-Y770 PolarHBondContact O-OH 3.47Å; V768-Y770 HydrophobicContact CG1-CE1 4.22Å; V768-Y770 HydrophobicContact CG1-CE2 4.31Å; Y770-I782 HydrophobicContact CG-CD1 4.47Å; Y770-K784 PolarHBondContact N-O 3.42Å; Y770-G787 VanDerWaalsContact CD2-N 3.33Å; Y770-H808 WeakPolarHBondContact CA-O 3.18Å; Y770-A809 HydrophobicContact CD1-CB 4.49Å; Y770-A809 HydrophobicContact CE1-CB 4.48Å
771	K	91.1	Very high	84	Confident	128 Å²	128	42.1 Å²	42.1	56%	0.557	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.5	132.8	-179.8	-176.7	-179.3	175.5	-175.3	0	112	H808 I810	K771-H808 PolarHBondContact N-O 3.27Å; K771-H808 PolarHBondContact O-N 2.74Å; K771-I810 HydrophobicContact CB-CD1 4.25Å; K771-I810 HydrophobicContact CD-CD1 4.12Å
772	L	92	Very high	84.2	Confident	30 Å²	30	43.1 Å²	43.1	16%	0.157	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	130.8	169.6	-58.1	178.7	0	0	0	110.7	N775 I780 I782 L789 F805 V807	L772-N775 HydrophobicContact CD1-CB 4.18Å; L772-I780 HydrophobicContact CD1-CB 4.3Å; L772-I780 HydrophobicContact CD1-CG2 4.06Å; L772-I780 HydrophobicContact CD2-CG2 4.35Å; L772-I782 HydrophobicContact CD2-CB 4.06Å; L772-I782 HydrophobicContact CD2-CD1 4.47Å; L772-I782 HydrophobicContact CD2-CG2 4.15Å; L772-I782 HydrophobicContact CG-CB 4.16Å; L772-I782 HydrophobicContact CG-CG2 3.82Å; L772-L789 HydrophobicContact CD2-CD2 4.06Å; L772-F805 HydrophobicContact CD2-CD2 3.88Å; L772-F805 HydrophobicContact CD2-CE2 3.56Å; L772-V807 HydrophobicContact CD2-CG2 4.14Å
773	V	86.7	Confident	84.7	Confident	70 Å²	70	44.6 Å²	44.6	42%	0.424	28%	0.277	S	S	.	.	S	Bend	trans	-80.7	-45.5	174.5	-176.5	0	0	0	0	110.4	Q806 H808	V773-Q806 HydrophobicContact CB-CB 3.89Å; V773-Q806 WeakPolarHBondContact CB-O 3.49Å; V773-Q806 HydrophobicContact CG2-CB 3.8Å; V773-Q806 WeakPolarHBondContact CG2-O 3.4Å; V773-Q806 PolarHBondContact N-O 3.47Å; V773-H808 HydrophobicContact CG2-CB 4.37Å; V773-H808 WeakPolarHBondContact CG2-CD2 3.37Å; V773-H808 VanDerWaalsContact CG2-NE2 3.32Å; V773-H808 WeakPolarHBondContact CG2-NE2 3.41Å
774	S	79.9	Confident	85.1	Confident	52 Å²	52	45.4 Å²	45.4	36%	0.364	26%	0.26	S	S	.	.			trans	-130.6	146.2	175.3	53.8	0	0	0	0	108.8
775	N	81.8	Confident	85.5	Confident	57 Å²	57	48.5 Å²	48.5	31%	0.305	27%	0.271	S	S	.	.			trans	-139	79.8	174.3	-176	-0	0	0	0	106.8	L772 S777 G778 S779 I780	L772-N775 HydrophobicContact CD1-CB 4.18Å; N775-S777 VanDerWaalsContact C-N 3.25Å; N775-S777 PolarHBondContact O-N 2.69Å; N775-S777 VanDerWaalsContact O-N 3.11Å; N775-G778 PolarHBondContact O-N 3.3Å; N775-G778 VanDerWaalsContact O-N 3.14Å; N775-G778 WeakPolarHBondContact OD1-CA 3.13Å; N775-G778 PolarHBondContact OD1-N 2.84Å; N775-S779 PolarHBondContact OD1-N 2.97Å; N775-I780 PolarHBondContact ND2-O 3.29Å; N775-I780 PolarHBondContact OD1-N 2.76Å
776	P	69.1	Low	85.7	Confident	86 Å²	86	49.9 Å²	49.9	56%	0.558	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-35.6	-160.2	-29.9	36.8	0	0	0	115	L803	P776-L803 HydrophobicContact CB-CD1 4.4Å; P776-L803 HydrophobicContact CG-CD1 4.14Å
777	S	68.4	Low	86.1	Confident	56 Å²	56	48.8 Å²	48.8	39%	0.392	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-2.1	-178	-42.2	0	0	0	0	113.6	N775 S779	N775-S777 VanDerWaalsContact C-N 3.25Å; N775-S777 PolarHBondContact O-N 2.69Å; N775-S777 VanDerWaalsContact O-N 3.11Å; S777-S779 PolarHBondContact O-N 3.48Å
778	G	77.5	Confident	86.4	Confident	38 Å²	38	49.7 Å²	49.7	39%	0.392	27%	0.271	S	S	.	.	S	Bend	trans	71.3	3.3	-169	0	0	0	0	0	114.7	N775	N775-G778 PolarHBondContact O-N 3.3Å; N775-G778 VanDerWaalsContact O-N 3.14Å; N775-G778 WeakPolarHBondContact OD1-CA 3.13Å; N775-G778 PolarHBondContact OD1-N 2.84Å
779	S	85.7	Confident	86.6	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.021	27%	0.265	C	S	.	.			trans	-84.2	-11.2	-170.1	55.4	0	0	0	0	115	N775 S777 A791 V792 F795	N775-S779 PolarHBondContact OD1-N 2.97Å; S777-S779 PolarHBondContact O-N 3.48Å; S779-A791 WeakPolarHBondContact O-CA 3.25Å; S779-V792 WeakPolarHBondContact O-CG2 3.47Å; S779-V792 PolarHBondContact O-N 2.83Å; S779-F795 WeakPolarHBondContact OG-CZ 3.25Å
780	I	90.1	Very high	86.6	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	142.3	177.3	-54.9	-61.3	0	0	0	110.7	I752 L772 N775 L789 Y790 F795 L803 F805 I837	I752-I780 HydrophobicContact CD1-CD1 3.68Å; L772-I780 HydrophobicContact CD1-CB 4.3Å; L772-I780 HydrophobicContact CD1-CG2 4.06Å; L772-I780 HydrophobicContact CD2-CG2 4.35Å; N775-I780 PolarHBondContact ND2-O 3.29Å; N775-I780 PolarHBondContact OD1-N 2.76Å; I780-L789 HydrophobicContact CG2-CD2 3.91Å; I780-Y790 CarbonylContact C-O 3.58Å; I780-Y790 WeakPolarHBondContact CA-O 3.44Å; I780-F795 HydrophobicContact CD1-CE2 4.03Å; I780-F795 HydrophobicContact CD1-CZ 3.73Å; I780-F795 HydrophobicContact CG1-CZ 4.43Å; I780-L803 HydrophobicContact CD1-CD2 4Å; I780-L803 HydrophobicContact CG1-CD2 3.63Å; I780-F805 HydrophobicContact CG1-CE1 4.24Å; I780-F805 HydrophobicContact CG2-CE2 4.4Å; I780-F805 HydrophobicContact CG2-CZ 3.98Å; I780-I837 HydrophobicContact CD1-CD1 3.62Å; I780-I837 HydrophobicContact CG1-CD1 4.41Å
781	Q	89.3	Confident	86.4	Confident	72 Å²	72	50 Å²	50	34%	0.336	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	156.9	163	-66.8	-173.5	6.6	0	0	110	R749 L789 Y790 V792	R749-Q781 VanDerWaalsContact CZ-OE1 3.22Å; Q781-L789 WeakPolarHBondContact O-CA 3.47Å; Q781-Y790 PolarHBondContact N-O 2.86Å; Q781-Y790 PolarHBondContact O-N 2.65Å; Q781-V792 HydrophobicContact CB-CG1 4.28Å; Q781-V792 HydrophobicContact CG-CG1 3.78Å; Q781-V792 HydrophobicContact CG-CG2 4.03Å
782	I	93.2	Very high	86.1	Confident	32 Å²	32	44.6 Å²	44.6	16%	0.164	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138	171.7	-162.3	167.5	0	0	0	109.3	V755 Y770 L772 M788 L789 V807	V755-I782 HydrophobicContact CG2-CD1 3.81Å; Y770-I782 HydrophobicContact CG-CD1 4.47Å; L772-I782 HydrophobicContact CD2-CB 4.06Å; L772-I782 HydrophobicContact CD2-CD1 4.47Å; L772-I782 HydrophobicContact CD2-CG2 4.15Å; L772-I782 HydrophobicContact CG-CB 4.16Å; L772-I782 HydrophobicContact CG-CG2 3.82Å; I782-M788 WeakPolarHBondContact CA-O 3.17Å; I782-L789 HydrophobicContact CB-CD2 3.96Å; I782-L789 HydrophobicContact CD1-CD2 3.83Å; I782-L789 HydrophobicContact CD1-CG 4.4Å; I782-L789 HydrophobicContact CG1-CD2 3.85Å; I782-L789 HydrophobicContact CG1-CG 4.38Å; I782-V807 HydrophobicContact CD1-CG1 3.57Å; I782-V807 HydrophobicContact CD1-CG2 4.29Å
783	D	89.3	Confident	85.5	Confident	43 Å²	43	47.8 Å²	47.8	23%	0.23	26%	0.26	C	S	.	.			trans	-69.9	128	166.9	-174.3	-54.6	0	0	0	109.7	F785 N786 G787 M788 Y790	D783-F785 VanDerWaalsContact C-N 3.27Å; D783-F785 PolarHBondContact O-N 3.04Å; D783-F785 PolarHBondContact OD1-N 2.94Å; D783-N786 WeakPolarHBondContact CB-OD1 3.12Å; D783-N786 PolarHBondContact OD1-N 3.23Å; D783-N786 VanDerWaalsContact OD1-N 3.1Å; D783-N786 PolarHBondContact OD1-ND2 3.31Å; D783-N786 PolarHBondContact OD2-ND2 2.96Å; D783-N786 PolarHBondContact OD2-OD1 3.45Å; D783-G787 PolarHBondContact O-N 2.87Å; D783-M788 HydrophobicContact CB-CB 4.22Å; D783-M788 PolarHBondContact N-O 3.25Å; D783-Y790 HydrophobicContact CB-CE2 4.3Å
784	K	88.5	Confident	85.4	Confident	91 Å²	91	47.4 Å²	47.4	40%	0.396	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-29.5	-175.6	-175.7	-178.1	175.6	-119.9	0	112.9	T769 Y770	T769-K784 CarbonylContact C-O 3.58Å; T769-K784 WeakPolarHBondContact CA-O 3.43Å; T769-K784 WeakPolarHBondContact CB-O 3.44Å; T769-K784 HydrophobicContact CG2-CD 4.41Å; T769-K784 HydrophobicContact CG2-CG 3.89Å; T769-K784 WeakPolarHBondContact CG2-O 3.43Å; Y770-K784 PolarHBondContact N-O 3.42Å
785	F	86.9	Confident	85.8	Confident	127 Å²	127	45.5 Å²	45.5	56%	0.557	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-40.9	-166.8	-57.6	-77.5	0	0	0	113.2	T769 D783	T769-F785 HydrophobicContact CG2-CD1 4.31Å; D783-F785 VanDerWaalsContact C-N 3.27Å; D783-F785 PolarHBondContact O-N 3.04Å; D783-F785 PolarHBondContact OD1-N 2.94Å
786	N	89.3	Confident	86.1	Confident	71 Å²	71	46.7 Å²	46.7	38%	0.38	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-9.5	-179.6	61	46	0	0	0	114.1	M754 D783 M788	M754-N786 VanDerWaalsContact CG-O 3.3Å; M754-N786 WeakPolarHBondContact CG-O 3.43Å; D783-N786 WeakPolarHBondContact CB-OD1 3.12Å; D783-N786 PolarHBondContact OD1-N 3.23Å; D783-N786 VanDerWaalsContact OD1-N 3.1Å; D783-N786 PolarHBondContact OD1-ND2 3.31Å; D783-N786 PolarHBondContact OD2-ND2 2.96Å; D783-N786 PolarHBondContact OD2-OD1 3.45Å; N786-M788 VanDerWaalsContact C-N 3.29Å; N786-M788 PolarHBondContact O-N 2.88Å; N786-M788 WeakPolarHBondContact OD1-CB 3.33Å; N786-M788 PolarHBondContact OD1-N 3.23Å
787	G	90.2	Very high	87.1	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.			trans	76.5	12.3	177.7	0	0	0	0	0	114.6	V755 Y770 D783 L789	V755-G787 WeakPolarHBondContact CG2-O 3.21Å; V755-G787 PolarHBondContact N-O 2.93Å; Y770-G787 VanDerWaalsContact CD2-N 3.33Å; D783-G787 PolarHBondContact O-N 2.87Å; G787-L789 PolarHBondContact O-N 3.09Å
788	M	93.3	Very high	88	Confident	41 Å²	41	44.5 Å²	44.5	20%	0.202	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	124.3	177.2	-164	66.6	-164.8	0	0	111.5	P751 M754 I782 D783 N786 Y790	P751-M788 HydrophobicContact CB-CE 3.61Å; M754-M788 HydrophobicContact CB-SD 3.75Å; M754-M788 HydrophobicContact CG-SD 4.4Å; I782-M788 WeakPolarHBondContact CA-O 3.17Å; D783-M788 HydrophobicContact CB-CB 4.22Å; D783-M788 PolarHBondContact N-O 3.25Å; N786-M788 VanDerWaalsContact C-N 3.29Å; N786-M788 PolarHBondContact O-N 2.88Å; N786-M788 WeakPolarHBondContact OD1-CB 3.33Å; N786-M788 PolarHBondContact OD1-N 3.23Å; M788-Y790 HydrophobicContact CB-CE2 3.86Å; M788-Y790 HydrophobicContact CG-CE1 4.35Å; M788-Y790 HydrophobicContact CG-CE2 3.87Å; M788-Y790 WeakPolarHBondContact O-CD2 3.4Å; M788-Y790 WeakPolarHBondContact O-CE2 3.49Å
789	L	92.4	Very high	88.4	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	139.8	175.2	-68.3	163.1	0	0	0	110.9	F727 I752 G753 V755 L772 I780 Q781 I782 G787 F805 V835	F727-L789 HydrophobicContact CD2-CD1 4.05Å; F727-L789 HydrophobicContact CE2-CD1 3.67Å; I752-L789 HydrophobicContact CB-CB 4.19Å; I752-L789 HydrophobicContact CD1-CB 4.24Å; I752-L789 PolarHBondContact N-O 2.88Å; G753-L789 WeakPolarHBondContact O-CB 3.36Å; G753-L789 PolarHBondContact O-N 2.71Å; V755-L789 HydrophobicContact CG1-CD1 4.03Å; L772-L789 HydrophobicContact CD2-CD2 4.06Å; I780-L789 HydrophobicContact CG2-CD2 3.91Å; Q781-L789 WeakPolarHBondContact O-CA 3.47Å; I782-L789 HydrophobicContact CB-CD2 3.96Å; I782-L789 HydrophobicContact CD1-CD2 3.83Å; I782-L789 HydrophobicContact CD1-CG 4.4Å; I782-L789 HydrophobicContact CG1-CD2 3.85Å; I782-L789 HydrophobicContact CG1-CG 4.38Å; G787-L789 PolarHBondContact O-N 3.09Å; L789-F805 HydrophobicContact CD1-CZ 4.24Å; L789-F805 HydrophobicContact CD2-CE2 4.03Å; L789-F805 HydrophobicContact CD2-CZ 4.03Å; L789-V835 HydrophobicContact CD1-CG1 3.85Å; L789-V835 HydrophobicContact CD1-CG2 4.37Å
790	Y	90.8	Very high	88.4	Confident	53 Å²	53	48.9 Å²	48.9	21%	0.208	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139.5	178.2	-61.3	-89.8	0	0	0	112	R749 Y750 P751 I780 Q781 D783 M788	R749-Y790 HydrophobicContact CB-CD1 3.57Å; R749-Y790 HydrophobicContact CB-CE1 4.33Å; R749-Y790 HydrophobicContact CB-CG 3.95Å; Y750-Y790 CarbonylContact O-C 3.51Å; Y750-Y790 VanDerWaalsContact O-CA 3.25Å; Y750-Y790 WeakPolarHBondContact O-CA 3.23Å; P751-Y790 HydrophobicContact CB-CD1 4.3Å; P751-Y790 HydrophobicContact CB-CE1 4.21Å; I780-Y790 CarbonylContact C-O 3.58Å; I780-Y790 WeakPolarHBondContact CA-O 3.44Å; Q781-Y790 PolarHBondContact N-O 2.86Å; Q781-Y790 PolarHBondContact O-N 2.65Å; D783-Y790 HydrophobicContact CB-CE2 4.3Å; M788-Y790 HydrophobicContact CB-CE2 3.86Å; M788-Y790 HydrophobicContact CG-CE1 4.35Å; M788-Y790 HydrophobicContact CG-CE2 3.87Å; M788-Y790 WeakPolarHBondContact O-CD2 3.4Å; M788-Y790 WeakPolarHBondContact O-CE2 3.49Å
791	A	88.9	Confident	88.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	135.7	163.2	0	0	0	0	0	109.4	L729 Y750 I752 S779 F795	L729-A791 HydrophobicContact CD2-CB 4.04Å; Y750-A791 PolarHBondContact N-O 3.26Å; Y750-A791 PolarHBondContact O-N 3.01Å; I752-A791 HydrophobicContact CD1-CB 4.03Å; I752-A791 VanDerWaalsContact CD1-N 3.31Å; I752-A791 HydrophobicContact CG1-CB 4.23Å; S779-A791 WeakPolarHBondContact O-CA 3.25Å; A791-F795 HydrophobicContact CB-CD2 4.33Å; A791-F795 HydrophobicContact CB-CE2 3.93Å
792	V	84.9	Confident	88.3	Confident	14 Å²	14	54.8 Å²	54.8	9%	0.085	28%	0.28	C	S	.	.			trans	-125	7.5	179.1	-59.8	0	0	0	0	113.4	I747 R749 S779 Q781	I747-V792 HydrophobicContact CG2-CB 4.37Å; I747-V792 WeakPolarHBondContact CG2-O 3.23Å; R749-V792 HydrophobicContact CG-CG1 4.05Å; S779-V792 WeakPolarHBondContact O-CG2 3.47Å; S779-V792 PolarHBondContact O-N 2.83Å; Q781-V792 HydrophobicContact CB-CG1 4.28Å; Q781-V792 HydrophobicContact CG-CG1 3.78Å; Q781-V792 HydrophobicContact CG-CG2 4.03Å
793	Q	80.4	Confident	88	Confident	96 Å²	96	53.9 Å²	53.9	45%	0.449	28%	0.275	S	S	.	.	S	Bend	trans	-141.2	142.6	167.1	-65	178.1	-2.4	0	0	107.1	F795	Q793-F795 WeakPolarHBondContact O-CD2 3.41Å
794	P	84.2	Confident	88.1	Confident	62 Å²	62	55.2 Å²	55.2	40%	0.403	28%	0.282	S	S	.	.			trans	-60.1	138.5	174	26.5	-34.1	0	0	0	110.3	I736	I736-P794 HydrophobicContact CD1-CG 4.19Å; I736-P794 HydrophobicContact CG1-CG 4.42Å
795	F	86.8	Confident	88.2	Confident	12 Å²	12	51.1 Å²	51.1	5%	0.053	26%	0.264	C	S	.	.			trans	-93.9	158.2	168	-71.6	-97.5	0	0	0	110.4	L729 N732 S779 I780 A791 Q793 L803 I839	L729-F795 HydrophobicContact CD2-CD2 3.58Å; L729-F795 HydrophobicContact CD2-CE2 3.89Å; L729-F795 HydrophobicContact CD2-CG 4.25Å; N732-F795 PolarHBondContact N-O 2.9Å; S779-F795 WeakPolarHBondContact OG-CZ 3.25Å; I780-F795 HydrophobicContact CD1-CE2 4.03Å; I780-F795 HydrophobicContact CD1-CZ 3.73Å; I780-F795 HydrophobicContact CG1-CZ 4.43Å; A791-F795 HydrophobicContact CB-CD2 4.33Å; A791-F795 HydrophobicContact CB-CE2 3.93Å; Q793-F795 WeakPolarHBondContact O-CD2 3.41Å; F795-L803 HydrophobicContact CE1-CD2 4.06Å; F795-L803 HydrophobicContact CZ-CD2 4.04Å; F795-I839 HydrophobicContact CB-CD1 3.84Å; F795-I839 HydrophobicContact CB-CG1 4.27Å; F795-I839 HydrophobicContact CB-CG2 4.39Å; F795-I839 HydrophobicContact CD1-CD1 3.83Å; F795-I839 HydrophobicContact CD1-CG1 4.31Å; F795-I839 HydrophobicContact CD2-CD1 4.48Å; F795-I839 HydrophobicContact CE1-CD1 4.5Å; F795-I839 HydrophobicContact CG-CD1 3.8Å
796	D	88	Confident	88.4	Confident	83 Å²	83	49 Å²	49	44%	0.444	26%	0.256	S	S	.	.			trans	-140.3	119.9	-174.9	152.6	-15.4	0	0	0	103.6	E798 A799 I800	D796-E798 PolarHBondContact OD1-N 2.92Å; D796-A799 HydrophobicContact CB-CB 4.23Å; D796-A799 VanDerWaalsContact CG-CB 3.47Å; D796-A799 WeakPolarHBondContact OD1-CB 3.32Å; D796-A799 PolarHBondContact OD1-N 2.89Å; D796-I800 PolarHBondContact O-N 2.82Å
797	R	90.3	Very high	88.6	Confident	28 Å²	28	45.6 Å²	45.6	11%	0.106	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-33.8	-168.2	-171.9	-142.4	65.4	127.1	-6.2	111.5	E731 A799 I800 N801 I839 D841 A875 D876	E731-R797 WeakPolarHBondContact OE2-CB 3.48Å; E731-R797 PolarHBondContact OE2-N 2.76Å; R797-A799 PolarHBondContact O-N 3.45Å; R797-I800 CarbonylContact O-C 3.51Å; R797-I800 PolarHBondContact O-N 3.4Å; R797-N801 HydrophobicContact CG-CB 4.28Å; R797-N801 PolarHBondContact O-N 2.86Å; R797-I839 HydrophobicContact CB-CB 4.41Å; R797-I839 HydrophobicContact CB-CG2 3.82Å; R797-I839 HydrophobicContact CG-CB 4.29Å; R797-I839 HydrophobicContact CG-CG2 4.16Å; R797-D841 WeakPolarHBondContact CD-OD1 3.3Å; R797-D841 IonicContact CZ-OD1 3.2Å; R797-D841 IonicContact NE-OD1 3.1Å; R797-D841 PolarHBondContact NE-OD1 2.77Å; R797-D841 VanDerWaalsContact NE-OD1 3.08Å; R797-D841 IonicContact NH1-OD1 2.88Å; R797-D841 PolarHBondContact NH1-OD1 3.41Å; R797-D841 IonicContact NH2-OD1 2.94Å; R797-A875 PolarHBondContact NH2-O 2.85Å; R797-D876 PolarHBondContact NH2-O 2.81Å
798	E	87.9	Confident	88.7	Confident	68 Å²	68	48.1 Å²	48.1	32%	0.318	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-33	174.7	-69.9	55.3	-116.5	0	0	110.7	D796 A875	D796-E798 PolarHBondContact OD1-N 2.92Å; E798-A875 HydrophobicContact CG-CB 3.94Å
799	A	86.6	Confident	88.7	Confident	70 Å²	70	46.1 Å²	46.1	58%	0.579	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-45.4	173.4	0	0	0	0	0	113.4	D796 R797	D796-A799 HydrophobicContact CB-CB 4.23Å; D796-A799 VanDerWaalsContact CG-CB 3.47Å; D796-A799 WeakPolarHBondContact OD1-CB 3.32Å; D796-A799 PolarHBondContact OD1-N 2.89Å; R797-A799 PolarHBondContact O-N 3.45Å
800	I	85.4	Confident	88.6	Confident	63 Å²	63	47.6 Å²	47.6	32%	0.323	25%	0.247	S	C	.	.			trans	-144.4	100.4	-176.9	-52.9	-179.8	0	0	0	111	D796 R797 E802 I839	D796-I800 PolarHBondContact O-N 2.82Å; R797-I800 CarbonylContact O-C 3.51Å; R797-I800 PolarHBondContact O-N 3.4Å; I800-E802 WeakPolarHBondContact CG2-O 3.35Å; I800-I839 WeakPolarHBondContact O-CG1 3.32Å
801	N	87.7	Confident	88.5	Confident	98 Å²	98	45.1 Å²	45.1	52%	0.524	24%	0.237	S	C	.	.	S	Bend	trans	-84	-27.3	178.8	64.8	-16.3	0	0	0	115	R797 I839	R797-N801 HydrophobicContact CG-CB 4.28Å; R797-N801 PolarHBondContact O-N 2.86Å; N801-I839 PolarHBondContact O-N 3.46Å
802	E	89.1	Confident	87.9	Confident	99 Å²	99	45.4 Å²	45.4	46%	0.463	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	139.5	172.6	64.6	169.1	-170.8	0	0	112.7	I800 R836 I837	I800-E802 WeakPolarHBondContact CG2-O 3.35Å; E802-R836 IonicContact OE2-CZ 2.68Å; E802-R836 IonicContact OE2-NH1 2.82Å; E802-R836 PolarHBondContact OE2-NH1 2.99Å; E802-I837 WeakPolarHBondContact CA-O 3.38Å
803	L	87.9	Confident	87	Confident	12 Å²	12	45.5 Å²	45.5	6%	0.063	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.4	169.5	-174.2	71.2	0	0	0	109.9	P776 I780 F795 F805 R836 I837	P776-L803 HydrophobicContact CB-CD1 4.4Å; P776-L803 HydrophobicContact CG-CD1 4.14Å; I780-L803 HydrophobicContact CD1-CD2 4Å; I780-L803 HydrophobicContact CG1-CD2 3.63Å; F795-L803 HydrophobicContact CE1-CD2 4.06Å; F795-L803 HydrophobicContact CZ-CD2 4.04Å; L803-F805 HydrophobicContact CD2-CD1 4.1Å; L803-F805 HydrophobicContact CD2-CE1 4.18Å; L803-F805 HydrophobicContact CG-CD1 4.1Å; L803-R836 WeakPolarHBondContact O-CA 3.46Å; L803-I837 HydrophobicContact CB-CB 4.44Å; L803-I837 HydrophobicContact CD2-CD1 4.48Å; L803-I837 PolarHBondContact N-O 3.48Å; L803-I837 PolarHBondContact O-N 3.45Å
804	I	89.9	Confident	85.9	Confident	72 Å²	72	44.6 Å²	44.6	37%	0.369	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124.6	178.9	-52.9	170.4	0	0	0	109.3	V835	I804-V835 WeakPolarHBondContact CA-O 3.15Å
805	F	91.2	Very high	84.5	Confident	5 Å²	5	48.1 Å²	48.1	2%	0.022	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	174.7	177.1	59.8	-85.1	0	0	0	111.3	L772 I780 L789 L803 V807 V835 I837	L772-F805 HydrophobicContact CD2-CD2 3.88Å; L772-F805 HydrophobicContact CD2-CE2 3.56Å; I780-F805 HydrophobicContact CG1-CE1 4.24Å; I780-F805 HydrophobicContact CG2-CE2 4.4Å; I780-F805 HydrophobicContact CG2-CZ 3.98Å; L789-F805 HydrophobicContact CD1-CZ 4.24Å; L789-F805 HydrophobicContact CD2-CE2 4.03Å; L789-F805 HydrophobicContact CD2-CZ 4.03Å; L803-F805 HydrophobicContact CD2-CD1 4.1Å; L803-F805 HydrophobicContact CD2-CE1 4.18Å; L803-F805 HydrophobicContact CG-CD1 4.1Å; F805-V807 HydrophobicContact CD2-CG2 4.14Å; F805-V807 HydrophobicContact CE2-CG2 3.81Å; F805-V835 HydrophobicContact CD2-CB 4.22Å; F805-V835 HydrophobicContact CE1-CB 4.1Å; F805-V835 HydrophobicContact CE1-CG1 3.9Å; F805-V835 HydrophobicContact CE2-CB 3.75Å; F805-V835 HydrophobicContact CE2-CG1 4.09Å; F805-V835 HydrophobicContact CE2-CG2 4.16Å; F805-V835 HydrophobicContact CZ-CB 3.69Å; F805-V835 HydrophobicContact CZ-CG1 3.53Å; F805-V835 HydrophobicContact CZ-CG2 4.42Å; F805-V835 PolarHBondContact N-O 3.14Å; F805-V835 PolarHBondContact O-N 2.78Å; F805-I837 HydrophobicContact CE1-CD1 3.74Å; F805-I837 HydrophobicContact CE1-CG1 4.07Å; F805-I837 HydrophobicContact CZ-CD1 4.2Å
806	Q	91.7	Very high	82.8	Confident	82 Å²	82	53.3 Å²	53.3	38%	0.383	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	143.8	178.3	-75.3	-178.3	-26	0	0	111.6	V773 T833 N834	V773-Q806 HydrophobicContact CB-CB 3.89Å; V773-Q806 WeakPolarHBondContact CB-O 3.49Å; V773-Q806 HydrophobicContact CG2-CB 3.8Å; V773-Q806 WeakPolarHBondContact CG2-O 3.4Å; V773-Q806 PolarHBondContact N-O 3.47Å; Q806-T833 WeakPolarHBondContact CA-O 3.3Å; Q806-N834 WeakPolarHBondContact CG-OD1 2.99Å; Q806-N834 PolarHBondContact NE2-OD1 2.94Å
807	V	92.9	Very high	80.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.7	172.9	-173	0	0	0	0	108.7	F720 V755 L772 I782 F805 T832 T833 V835	F720-V807 HydrophobicContact CE1-CG1 4.42Å; F720-V807 HydrophobicContact CZ-CB 4.18Å; F720-V807 HydrophobicContact CZ-CG1 3.98Å; V755-V807 HydrophobicContact CG2-CG1 4.21Å; L772-V807 HydrophobicContact CD2-CG2 4.14Å; I782-V807 HydrophobicContact CD1-CG1 3.57Å; I782-V807 HydrophobicContact CD1-CG2 4.29Å; F805-V807 HydrophobicContact CD2-CG2 4.14Å; F805-V807 HydrophobicContact CE2-CG2 3.81Å; V807-T832 WeakPolarHBondContact O-CA 3.47Å; V807-T833 HydrophobicContact CB-CG2 4.37Å; V807-T833 PolarHBondContact N-O 2.88Å; V807-T833 PolarHBondContact O-N 2.83Å; V807-T833 VanDerWaalsContact O-N 3.09Å; V807-V835 HydrophobicContact CG2-CG2 3.59Å
808	H	92.8	Very high	78.5	Confident	52 Å²	52	58 Å²	58	24%	0.241	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.6	165.3	-75.4	-169.3	0	0	0	110.2	Y770 K771 V773 I810 G831	Y770-H808 WeakPolarHBondContact CA-O 3.18Å; K771-H808 PolarHBondContact N-O 3.27Å; K771-H808 PolarHBondContact O-N 2.74Å; V773-H808 HydrophobicContact CG2-CB 4.37Å; V773-H808 WeakPolarHBondContact CG2-CD2 3.37Å; V773-H808 VanDerWaalsContact CG2-NE2 3.32Å; V773-H808 WeakPolarHBondContact CG2-NE2 3.41Å; H808-I810 HydrophobicContact CB-CD1 4.27Å; H808-I810 HydrophobicContact CB-CG1 3.98Å; H808-G831 CarbonylContact C-O 3.57Å; H808-G831 VanDerWaalsContact CA-O 3.28Å; H808-G831 WeakPolarHBondContact CA-O 3.15Å
809	A	92.6	Very high	76	Confident	0 Å²	0	60 Å²	60	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.3	157.6	0	0	0	0	0	107.2	P718 F720 A757 V768 T769 Y770 T830 G831	P718-A809 HydrophobicContact CB-CB 3.65Å; P718-A809 HydrophobicContact CG-CB 4.44Å; F720-A809 HydrophobicContact CD2-CB 4.34Å; F720-A809 HydrophobicContact CE1-CB 4.31Å; F720-A809 HydrophobicContact CE2-CB 3.57Å; F720-A809 HydrophobicContact CZ-CB 3.55Å; A757-A809 HydrophobicContact CB-CB 3.61Å; V768-A809 HydrophobicContact CG1-CB 3.73Å; T769-A809 CarbonylContact O-C 3.59Å; T769-A809 WeakPolarHBondContact O-CA 3.38Å; Y770-A809 HydrophobicContact CD1-CB 4.49Å; Y770-A809 HydrophobicContact CE1-CB 4.48Å; A809-T830 CarbonylContact O-C 3.24Å; A809-T830 VanDerWaalsContact O-CA 3.25Å; A809-T830 WeakPolarHBondContact O-CA 3.04Å; A809-G831 PolarHBondContact N-O 3.19Å; A809-G831 PolarHBondContact O-N 2.8Å
810	I	89.9	Confident	73.7	Confident	31 Å²	31	64.4 Å²	64.4	16%	0.159	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.7	-173	-48.8	178.4	0	0	0	108.8	V768 T769 K771 H808 T830	V768-I810 CarbonylContact C-O 3.55Å; V768-I810 WeakPolarHBondContact CA-O 3.3Å; T769-I810 PolarHBondContact N-O 3.37Å; T769-I810 PolarHBondContact O-N 3.2Å; T769-I810 PolarHBondContact OG1-O 3.48Å; K771-I810 HydrophobicContact CB-CD1 4.25Å; K771-I810 HydrophobicContact CD-CD1 4.12Å; H808-I810 HydrophobicContact CB-CD1 4.27Å; H808-I810 HydrophobicContact CB-CG1 3.98Å; I810-T830 HydrophobicContact CG1-CG2 4.11Å; I810-T830 HydrophobicContact CG2-CG2 4.31Å
811	D	89.1	Confident	71.9	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	40%	0.397	C	S	.	.			trans	-70.2	-168.5	178.5	64.9	7.2	0	0	0	114.6	N714 P718 H765 S767 T813 R828 L829	N714-D811 PolarHBondContact ND2-OD2 2.98Å; N714-D811 PolarHBondContact OD1-OD2 2.83Å; P718-D811 HydrophobicContact CG-CB 4.2Å; H765-D811 WeakPolarHBondContact O-CB 3.43Å; S767-D811 CarbonylContact O-C 3.58Å; D811-T813 WeakPolarHBondContact O-CG2 3.05Å; D811-T813 PolarHBondContact O-N 2.91Å; D811-R828 PolarHBondContact O-NH1 2.74Å; D811-R828 WeakPolarHBondContact OD1-CA 3.41Å; D811-R828 WeakPolarHBondContact OD1-CB 3.46Å; D811-R828 IonicContact OD1-NH1 3.9Å; D811-L829 PolarHBondContact OD1-N 3.5Å; D811-L829 WeakPolarHBondContact OD2-CA 3.28Å; D811-L829 WeakPolarHBondContact OD2-CB 3.35Å; D811-L829 PolarHBondContact OD2-N 2.85Å
812	C	77.2	Confident	70.4	Confident	7 Å²	7	75.9 Å²	75.9	5%	0.047	41%	0.41	C	S	.	.			trans	56.3	43.2	160.7	-84.8	0	0	0	0	114	N714 I764 H765 C823 R828	N714-C812 PolarHBondContact OD1-SG 3.03Å; I764-C812 WeakPolarHBondContact O-CA 3.27Å; I764-C812 PolarHBondContact O-N 3.34Å; I764-C812 VanDerWaalsContact O-N 3.15Å; H765-C812 PolarHBondContact O-N 2.79Å; C812-C823 HydrophobicContact CB-CB 3.65Å; C812-C823 PolarHBondContact SG-SG 3.13Å; C812-R828 HydrophobicContact CB-CG 4.21Å; C812-R828 VanDerWaalsContact CB-NH1 3.34Å; C812-R828 VanDerWaalsContact O-CZ 3.26Å; C812-R828 PolarHBondContact O-NH1 2.74Å; C812-R828 PolarHBondContact O-NH2 3.31Å
813	T	66.2	Low	68.9	Low	16 Å²	16	72.8 Å²	72.8	10%	0.098	40%	0.398	C	S	.	.			trans	-114.5	128.2	-175.2	60.7	0	0	0	0	114.4	S767 T769 D811	S767-T813 PolarHBondContact O-OG1 3.3Å; S767-T813 PolarHBondContact OG-O 3.09Å; T769-T813 HydrophobicContact CG2-CG2 3.9Å; T769-T813 VanDerWaalsContact CG2-OG1 3.23Å; T769-T813 WeakPolarHBondContact CG2-OG1 3.26Å; T769-T813 WeakPolarHBondContact OG1-CG2 3.32Å; D811-T813 WeakPolarHBondContact O-CG2 3.05Å; D811-T813 PolarHBondContact O-N 2.91Å
814	S	57.3	Low	67.6	Low	77 Å²	77	76.6 Å²	76.6	54%	0.538	42%	0.419	S	S	.	.			trans	-74.9	132.8	172.8	-179.1	0	0	0	0	111	N816	S814-N816 VanDerWaalsContact C-N 3.27Å; S814-N816 PolarHBondContact O-N 3.35Å; S814-N816 PolarHBondContact OG-N 3.31Å; S814-N816 PolarHBondContact OG-O 3.14Å
815	L	54.3	Low	66.4	Low	136 Å²	136	81.3 Å²	81.3	71%	0.712	44%	0.439	S	S	*	.	S	Bend	trans	-71.1	-19	171	-80.3	86.2	0	0	0	113.2
816	N	50.4	Low	65	Low	121 Å²	121	85.6 Å²	85.6	65%	0.647	47%	0.47	S	S	*	.	S	Bend	trans	-123	137.8	-179.2	-81.4	-57.3	0	0	0	112.3	S814 T818	S814-N816 VanDerWaalsContact C-N 3.27Å; S814-N816 PolarHBondContact O-N 3.35Å; S814-N816 PolarHBondContact OG-N 3.31Å; S814-N816 PolarHBondContact OG-O 3.14Å; N816-T818 PolarHBondContact O-N 3.11Å
817	G	45.5	Very low	64	Low	92 Å²	92	87.2 Å²	87.2	95%	0.948	48%	0.481	S	S	*	.			trans	-75.2	25.4	-172.8	0	0	0	0	0	116.2
818	T	42.8	Very low	63.5	Low	118 Å²	118	91.3 Å²	91.3	72%	0.724	50%	0.496	S	S	*	.			trans	-73.1	135	174.1	47	0	0	0	0	110.7	N816	N816-T818 PolarHBondContact O-N 3.11Å
819	S	35	Very low	63.2	Low	108 Å²	108	91.2 Å²	91.2	76%	0.755	50%	0.498	S	S	*	.			trans	-72	158.1	-175.9	51.4	0	0	0	0	114.3
820	E	38.1	Very low	63.2	Low	164 Å²	164	94.2 Å²	94.2	77%	0.766	52%	0.516	S	S	*	.	S	Bend	trans	91.5	94.2	166.6	-50.8	-153.9	103.8	0	0	118.7
821	R	48.1	Very low	63.2	Low	233 Å²	233	93 Å²	93	88%	0.879	51%	0.511	S	S	*	.			trans	43.3	83.8	143.4	-48.4	-172.3	-152.2	-155.4	7.1	118.1
822	Q	55.4	Low	63.4	Low	168 Å²	168	97.1 Å²	97.1	79%	0.785	54%	0.536	S	S	*	.	S	Bend	trans	-116.5	-21.6	165.8	-157.3	161.2	-0.5	0	0	115	I764	I764-Q822 HydrophobicContact CD1-CG 3.9Å
823	C	59.2	Low	64.1	Low	34 Å²	34	96.9 Å²	96.9	23%	0.23	54%	0.535	C	S	.	.	S	Bend	trans	-127.7	139.2	167.8	-52.5	0	0	0	0	109.1	C812	C812-C823 HydrophobicContact CB-CB 3.65Å; C812-C823 PolarHBondContact SG-SG 3.13Å
824	D	60.2	Low	65.4	Low	93 Å²	93	98.9 Å²	98.9	50%	0.497	55%	0.545	S	S	.	.			trans	-78.2	138.1	175.1	-163.5	-57	0	0	0	110	S826 L827	D824-S826 VanDerWaalsContact CG-OG 3.25Å; D824-S826 PolarHBondContact O-N 3.27Å; D824-S826 WeakPolarHBondContact OD1-CB 3.35Å; D824-S826 PolarHBondContact OD1-N 3.21Å; D824-S826 PolarHBondContact OD1-OG 3.46Å; D824-L827 HydrophobicContact CB-CB 4.46Å; D824-L827 HydrophobicContact CB-CD1 4.08Å; D824-L827 HydrophobicContact CB-CG 4.17Å; D824-L827 PolarHBondContact O-N 3.48Å; D824-L827 VanDerWaalsContact O-N 3.09Å
825	E	64.2	Low	67	Low	170 Å²	170	95.2 Å²	95.2	79%	0.794	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-63.3	-21.7	178.1	-66.3	-171	151.1	0	0	112.7	L827	E825-L827 VanDerWaalsContact C-N 3.33Å
826	S	62.9	Low	68.9	Low	96 Å²	96	91.6 Å²	91.6	67%	0.671	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-81.2	-5.9	176	63.2	0	0	0	0	115	D824	D824-S826 VanDerWaalsContact CG-OG 3.25Å; D824-S826 PolarHBondContact O-N 3.27Å; D824-S826 WeakPolarHBondContact OD1-CB 3.35Å; D824-S826 PolarHBondContact OD1-N 3.21Å; D824-S826 PolarHBondContact OD1-OG 3.46Å
827	L	69.7	Low	70.8	Confident	116 Å²	116	85.9 Å²	85.9	61%	0.607	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-110.4	1.4	179.7	-64.9	176.7	0	0	0	113.8	N714 D824 E825	N714-L827 PolarHBondContact ND2-O 2.7Å; D824-L827 HydrophobicContact CB-CB 4.46Å; D824-L827 HydrophobicContact CB-CD1 4.08Å; D824-L827 HydrophobicContact CB-CG 4.17Å; D824-L827 PolarHBondContact O-N 3.48Å; D824-L827 VanDerWaalsContact O-N 3.09Å; E825-L827 VanDerWaalsContact C-N 3.33Å
828	R	82	Confident	72.9	Confident	85 Å²	85	84.1 Å²	84.1	32%	0.321	43%	0.434	S	S	.	.			trans	-73	130	177.3	-64.9	177.7	170.9	-72.8	-10.2	111.8	D811 C812	D811-R828 PolarHBondContact O-NH1 2.74Å; D811-R828 WeakPolarHBondContact OD1-CA 3.41Å; D811-R828 WeakPolarHBondContact OD1-CB 3.46Å; D811-R828 IonicContact OD1-NH1 3.9Å; C812-R828 HydrophobicContact CB-CG 4.21Å; C812-R828 VanDerWaalsContact CB-NH1 3.34Å; C812-R828 VanDerWaalsContact O-CZ 3.26Å; C812-R828 PolarHBondContact O-NH1 2.74Å; C812-R828 PolarHBondContact O-NH2 3.31Å
829	L	88.1	Confident	75.2	Confident	51 Å²	51	78.9 Å²	78.9	27%	0.267	40%	0.401	S	S	.	.			trans	-100.6	154.5	171.1	-58.4	178.3	0	0	0	110	N714 N716 D811	N714-L829 WeakPolarHBondContact O-CD1 3.34Å; N716-L829 WeakPolarHBondContact O-CD1 3.47Å; D811-L829 PolarHBondContact OD1-N 3.5Å; D811-L829 WeakPolarHBondContact OD2-CA 3.28Å; D811-L829 WeakPolarHBondContact OD2-CB 3.35Å; D811-L829 PolarHBondContact OD2-N 2.85Å
830	T	90.9	Very high	77.6	Confident	63 Å²	63	76.4 Å²	76.4	39%	0.387	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	120.8	-173.2	61.4	0	0	0	0	112.2	A809 I810	A809-T830 CarbonylContact O-C 3.24Å; A809-T830 VanDerWaalsContact O-CA 3.25Å; A809-T830 WeakPolarHBondContact O-CA 3.04Å; I810-T830 HydrophobicContact CG1-CG2 4.11Å; I810-T830 HydrophobicContact CG2-CG2 4.31Å
831	G	91	Very high	79.9	Confident	6 Å²	6	70.7 Å²	70.7	6%	0.062	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	146.6	163.4	0	0	0	0	0	111.4	P718 H808 A809	P718-G831 WeakPolarHBondContact O-CA 3.19Å; H808-G831 CarbonylContact C-O 3.57Å; H808-G831 VanDerWaalsContact CA-O 3.28Å; H808-G831 WeakPolarHBondContact CA-O 3.15Å; A809-G831 PolarHBondContact N-O 3.19Å; A809-G831 PolarHBondContact O-N 2.8Å
832	T	92.9	Very high	81.6	Confident	85 Å²	85	62.7 Å²	62.7	52%	0.521	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	128.2	175.6	69.7	0	0	0	0	110.7	V807	V807-T832 WeakPolarHBondContact O-CA 3.47Å
833	T	92.9	Very high	82.9	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	155.3	171	-166.2	0	0	0	0	111.4	F720 H722 N723 Y725 Q806 V807 V835	F720-T833 HydrophobicContact CB-CG2 4.26Å; F720-T833 HydrophobicContact CD1-CG2 3.5Å; F720-T833 HydrophobicContact CD2-CG2 3.71Å; F720-T833 HydrophobicContact CE1-CG2 3.62Å; F720-T833 HydrophobicContact CE2-CG2 3.79Å; F720-T833 HydrophobicContact CG-CG2 3.56Å; F720-T833 HydrophobicContact CZ-CG2 3.75Å; H722-T833 PolarHBondContact O-OG1 3.21Å; N723-T833 VanDerWaalsContact C-OG1 3.26Å; N723-T833 PolarHBondContact O-OG1 3.07Å; N723-T833 VanDerWaalsContact O-OG1 3.14Å; Y725-T833 HydrophobicContact CD2-CG2 3.89Å; Y725-T833 HydrophobicContact CE2-CG2 4.03Å; Q806-T833 WeakPolarHBondContact CA-O 3.3Å; V807-T833 HydrophobicContact CB-CG2 4.37Å; V807-T833 PolarHBondContact N-O 2.88Å; V807-T833 PolarHBondContact O-N 2.83Å; V807-T833 VanDerWaalsContact O-N 3.09Å; T833-V835 HydrophobicContact CG2-CG2 4.44Å
834	N	92.2	Very high	84	Confident	57 Å²	57	57.1 Å²	57.1	31%	0.305	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	138.4	169.2	-62.4	-34.8	0	0	0	109	N723 E724 Y725 Q806	N723-N834 PolarHBondContact O-N 3.25Å; E724-N834 WeakPolarHBondContact CA-O 3.32Å; E724-N834 HydrophobicContact CB-CB 4.45Å; E724-N834 HydrophobicContact CG-CB 4.22Å; Y725-N834 PolarHBondContact N-O 2.84Å; Q806-N834 WeakPolarHBondContact CG-OD1 2.99Å; Q806-N834 PolarHBondContact NE2-OD1 2.94Å
835	V	92.2	Very high	85.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.8	168.6	-179.7	0	0	0	0	108.4	F727 V755 L789 I804 F805 V807 T833 I837	F727-V835 HydrophobicContact CD2-CG1 3.81Å; F727-V835 HydrophobicContact CE2-CG1 3.96Å; V755-V835 HydrophobicContact CG1-CG2 3.77Å; L789-V835 HydrophobicContact CD1-CG1 3.85Å; L789-V835 HydrophobicContact CD1-CG2 4.37Å; I804-V835 WeakPolarHBondContact CA-O 3.15Å; F805-V835 HydrophobicContact CD2-CB 4.22Å; F805-V835 HydrophobicContact CE1-CB 4.1Å; F805-V835 HydrophobicContact CE1-CG1 3.9Å; F805-V835 HydrophobicContact CE2-CB 3.75Å; F805-V835 HydrophobicContact CE2-CG1 4.09Å; F805-V835 HydrophobicContact CE2-CG2 4.16Å; F805-V835 HydrophobicContact CZ-CB 3.69Å; F805-V835 HydrophobicContact CZ-CG1 3.53Å; F805-V835 HydrophobicContact CZ-CG2 4.42Å; F805-V835 PolarHBondContact N-O 3.14Å; F805-V835 PolarHBondContact O-N 2.78Å; V807-V835 HydrophobicContact CG2-CG2 3.59Å; T833-V835 HydrophobicContact CG2-CG2 4.44Å; V835-I837 HydrophobicContact CG1-CG1 4.34Å
836	R	92.5	Very high	86.3	Confident	61 Å²	61	49 Å²	49	23%	0.23	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.6	173.7	169.9	-178.4	-65.5	-76.3	-8.4	107.8	E724 Y725 T726 F727 E802 L803 I838	E724-R836 IonicContact OE1-CZ 3.3Å; E724-R836 IonicContact OE1-NE 2.84Å; E724-R836 PolarHBondContact OE1-NE 2.67Å; E724-R836 IonicContact OE1-NH2 3.87Å; E724-R836 PolarHBondContact OE1-NH2 2.87Å; Y725-R836 PolarHBondContact O-N 3.47Å; T726-R836 CarbonylContact C-O 3.58Å; T726-R836 WeakPolarHBondContact CA-O 3.31Å; T726-R836 HydrophobicContact CG2-CG 4.25Å; F727-R836 PolarHBondContact N-O 2.85Å; E802-R836 IonicContact OE2-CZ 2.68Å; E802-R836 IonicContact OE2-NH1 2.82Å; E802-R836 PolarHBondContact OE2-NH1 2.99Å; L803-R836 WeakPolarHBondContact O-CA 3.46Å; R836-I838 HydrophobicContact CG-CG1 4.25Å
837	I	91	Very high	87.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.6	165.7	-53.9	174.6	0	0	0	106.7	F727 L729 I752 I780 E802 L803 F805 V835 I839	F727-I837 WeakPolarHBondContact O-CA 3.5Å; L729-I837 HydrophobicContact CB-CG2 3.7Å; L729-I837 HydrophobicContact CD2-CG2 4.31Å; I752-I837 HydrophobicContact CD1-CD1 3.83Å; I752-I837 HydrophobicContact CG2-CD1 4.09Å; I752-I837 HydrophobicContact CG2-CG1 4.29Å; I780-I837 HydrophobicContact CD1-CD1 3.62Å; I780-I837 HydrophobicContact CG1-CD1 4.41Å; E802-I837 WeakPolarHBondContact CA-O 3.38Å; L803-I837 HydrophobicContact CB-CB 4.44Å; L803-I837 HydrophobicContact CD2-CD1 4.48Å; L803-I837 PolarHBondContact N-O 3.48Å; L803-I837 PolarHBondContact O-N 3.45Å; F805-I837 HydrophobicContact CE1-CD1 3.74Å; F805-I837 HydrophobicContact CE1-CG1 4.07Å; F805-I837 HydrophobicContact CZ-CD1 4.2Å; V835-I837 HydrophobicContact CG1-CG1 4.34Å; I837-I839 HydrophobicContact CG2-CD1 3.96Å
838	I	90.7	Very high	88.5	Confident	56 Å²	56	43.6 Å²	43.6	29%	0.287	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.4	166.1	-61.8	173.6	0	0	0	106.1	T726 F727 H728 L729 R836	T726-I838 HydrophobicContact CG2-CD1 3.75Å; T726-I838 HydrophobicContact CG2-CG1 4.22Å; F727-I838 PolarHBondContact O-N 2.74Å; H728-I838 WeakPolarHBondContact CA-O 3.33Å; L729-I838 PolarHBondContact N-O 3.42Å; R836-I838 HydrophobicContact CG-CG1 4.25Å
839	I	89.9	Confident	89	Confident	7 Å²	7	40.6 Å²	40.6	4%	0.036	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	123.5	171.3	-54.4	-52.5	0	0	0	107.7	L729 E731 F795 R797 I800 N801 I837	L729-I839 HydrophobicContact CB-CD1 4.1Å; L729-I839 HydrophobicContact CD2-CD1 3.97Å; L729-I839 HydrophobicContact CG-CD1 4.23Å; L729-I839 CarbonylContact O-C 3.57Å; L729-I839 WeakPolarHBondContact O-CA 3.01Å; E731-I839 HydrophobicContact CB-CG2 3.67Å; F795-I839 HydrophobicContact CB-CD1 3.84Å; F795-I839 HydrophobicContact CB-CG1 4.27Å; F795-I839 HydrophobicContact CB-CG2 4.39Å; F795-I839 HydrophobicContact CD1-CD1 3.83Å; F795-I839 HydrophobicContact CD1-CG1 4.31Å; F795-I839 HydrophobicContact CD2-CD1 4.48Å; F795-I839 HydrophobicContact CE1-CD1 4.5Å; F795-I839 HydrophobicContact CG-CD1 3.8Å; R797-I839 HydrophobicContact CB-CB 4.41Å; R797-I839 HydrophobicContact CB-CG2 3.82Å; R797-I839 HydrophobicContact CG-CB 4.29Å; R797-I839 HydrophobicContact CG-CG2 4.16Å; I800-I839 WeakPolarHBondContact O-CG1 3.32Å; N801-I839 PolarHBondContact O-N 3.46Å; I837-I839 HydrophobicContact CG2-CD1 3.96Å
840	D	85.9	Confident	89	Confident	57 Å²	57	44.5 Å²	44.5	31%	0.305	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	129.1	179.6	-78	-15	0	0	0	110.3	H728 L729 E731	H728-D840 WeakPolarHBondContact CB-OD2 3.41Å; H728-D840 IonicContact CE1-OD1 2.64Å; H728-D840 IonicContact CG-OD1 3.1Å; H728-D840 IonicContact CG-OD2 3.09Å; H728-D840 IonicContact ND1-OD1 3.82Å; H728-D840 PolarHBondContact ND1-OD1 2.81Å; H728-D840 IonicContact ND1-OD2 3.99Å; L729-D840 PolarHBondContact O-N 2.88Å; E731-D840 PolarHBondContact N-O 3.01Å
841	D	85.2	Confident	88.8	Confident	43 Å²	43	46 Å²	46	23%	0.23	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-59.6	126.5	177.3	-167.8	80.5	0	0	0	112.7	E731 R797 D876 Q877	E731-D841 WeakPolarHBondContact OE1-CA 3.39Å; R797-D841 WeakPolarHBondContact CD-OD1 3.3Å; R797-D841 IonicContact CZ-OD1 3.2Å; R797-D841 IonicContact NE-OD1 3.1Å; R797-D841 PolarHBondContact NE-OD1 2.77Å; R797-D841 VanDerWaalsContact NE-OD1 3.08Å; R797-D841 IonicContact NH1-OD1 2.88Å; R797-D841 PolarHBondContact NH1-OD1 3.41Å; R797-D841 IonicContact NH2-OD1 2.94Å; D841-D876 WeakPolarHBondContact OD1-CA 3.3Å; D841-Q877 HydrophobicContact CB-CB 3.99Å; D841-Q877 VanDerWaalsContact CG-N 3.26Å; D841-Q877 VanDerWaalsContact OD1-CB 3.27Å; D841-Q877 WeakPolarHBondContact OD1-CB 3.49Å; D841-Q877 PolarHBondContact OD1-N 2.8Å; D841-Q877 WeakPolarHBondContact OD2-CB 3.4Å; D841-Q877 PolarHBondContact OD2-N 3.46Å
842	L	84.3	Confident	88.5	Confident	65 Å²	65	49.1 Å²	49.1	34%	0.34	27%	0.271	S	S	.	.			trans	-114.4	148.5	165.9	-62.5	179.1	0	0	0	108.7	P730 E731 D844	P730-L842 HydrophobicContact CB-CD1 4.36Å; P730-L842 HydrophobicContact CB-CD2 4.48Å; E731-L842 HydrophobicContact CG-CB 4.03Å; E731-L842 HydrophobicContact CG-CD1 3.95Å; E731-L842 HydrophobicContact CG-CG 3.96Å; E731-L842 WeakPolarHBondContact O-CD1 3.46Å; E731-L842 PolarHBondContact OE1-N 3.17Å; L842-D844 PolarHBondContact O-N 3.47Å
843	N	82.7	Confident	88.3	Confident	24 Å²	24	50.4 Å²	50.4	13%	0.128	28%	0.275	C	S	.	.	S	Bend	trans	-70.5	103.1	170.8	-176.1	-4.1	0	0	0	109.3	D876 A880 D959 I980 F982	N843-D876 WeakPolarHBondContact CA-OD2 3.37Å; N843-D876 PolarHBondContact OD1-OD2 3.29Å; N843-A880 HydrophobicContact CB-CB 4.27Å; N843-D959 PolarHBondContact ND2-OD1 2.92Å; N843-D959 PolarHBondContact ND2-OD2 2.86Å; N843-D959 PolarHBondContact OD1-OD2 2.84Å; N843-I980 PolarHBondContact ND2-O 3.2Å; N843-F982 WeakPolarHBondContact OD1-CD2 3.18Å; N843-F982 WeakPolarHBondContact OD1-CE2 3.49Å
844	D	83.6	Confident	88.2	Confident	61 Å²	61	51.1 Å²	51.1	33%	0.326	28%	0.277	S	S	.	.			trans	-134.1	-38.7	-167.6	161.2	-62.9	0	0	0	111.2	N732 L842 P846 F982	N732-D844 PolarHBondContact ND2-OD2 3.06Å; L842-D844 PolarHBondContact O-N 3.47Å; D844-P846 WeakPolarHBondContact O-CD 3.33Å; D844-F982 WeakPolarHBondContact O-CE2 3.18Å
845	S	85.4	Confident	88.3	Confident	31 Å²	31	53.1 Å²	53.1	22%	0.217	28%	0.284	C	S	.	.	S	Bend	trans	-106.8	96.9	-170.7	-80.3	0	0	0	0	112.9	D876	S845-D876 WeakPolarHBondContact CB-OD1 3.25Å; S845-D876 PolarHBondContact N-OD1 3.11Å
846	P	85.9	Confident	88.3	Confident	63 Å²	63	54.8 Å²	54.8	41%	0.409	29%	0.292	S	S	.	.			trans	-63.2	152.2	-168.7	27.5	-38.1	0	0	0	114	D844 V848 F982	D844-P846 WeakPolarHBondContact O-CD 3.33Å; P846-V848 WeakPolarHBondContact O-CG2 3.45Å; P846-F982 HydrophobicContact CB-CB 3.59Å; P846-F982 HydrophobicContact CB-CD1 4.48Å; P846-F982 HydrophobicContact CB-CD2 3.98Å; P846-F982 HydrophobicContact CB-CG 3.79Å
847	P	90.1	Very high	88.2	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.019	31%	0.308	C	S	.	.			trans	-50	142.5	174.9	-25	27.3	0	0	0	113.6	D874 I883 A957 D959 A984	P847-D874 WeakPolarHBondContact CD-OD2 3.45Å; P847-D874 VanDerWaalsContact CG-OD2 3.29Å; P847-D874 WeakPolarHBondContact CG-OD2 3.48Å; P847-I883 HydrophobicContact CB-CG1 4.23Å; P847-I883 HydrophobicContact CG-CG1 4.36Å; P847-A957 HydrophobicContact CB-CB 4.09Å; P847-D959 HydrophobicContact CG-CB 3.96Å; P847-A984 HydrophobicContact CB-CB 4.4Å; P847-A984 WeakPolarHBondContact O-CB 3.33Å
848	V	89.1	Confident	88.2	Confident	95 Å²	95	58 Å²	58	58%	0.576	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	119.2	177.6	-175.5	0	0	0	0	110	P846 A872 V873	P846-V848 WeakPolarHBondContact O-CG2 3.45Å; V848-A872 CarbonylContact O-C 3.55Å; V848-A872 WeakPolarHBondContact O-CA 3.21Å; V848-A872 WeakPolarHBondContact O-CB 3.23Å; V848-V873 PolarHBondContact N-O 3.23Å; V848-V873 PolarHBondContact O-N 3.05Å
849	F	92.2	Very high	87.9	Confident	21 Å²	21	60.7 Å²	60.7	9%	0.092	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	141.9	171.7	-81	-79.4	0	0	0	111.6	E851 Y854 V870 W871 A872 Y885 V955 A957 A984 A986	F849-E851 PolarHBondContact O-N 2.87Å; F849-Y854 HydrophobicContact CD1-CE2 4.12Å; F849-V870 HydrophobicContact CD1-CB 4.39Å; F849-V870 HydrophobicContact CE1-CB 4.03Å; F849-V870 HydrophobicContact CE1-CG2 3.79Å; F849-W871 WeakPolarHBondContact CA-O 3.43Å; F849-W871 WeakPolarHBondContact CD1-O 3.33Å; F849-A872 HydrophobicContact CD1-CB 3.96Å; F849-A872 HydrophobicContact CE1-CB 4.26Å; F849-A872 HydrophobicContact CG-CB 4.16Å; F849-Y885 HydrophobicContact CE1-CD1 4.01Å; F849-Y885 AromaticContact CE1-CE1 3.87Å; F849-Y885 HydrophobicContact CE1-CE1 3.87Å; F849-Y885 HydrophobicContact CZ-CD1 4.23Å; F849-Y885 HydrophobicContact CZ-CE1 4.41Å; F849-V955 HydrophobicContact CE1-CG1 4.49Å; F849-V955 WeakPolarHBondContact CE2-O 3.41Å; F849-V955 HydrophobicContact CZ-CB 4.33Å; F849-V955 HydrophobicContact CZ-CG1 4.06Å; F849-V955 WeakPolarHBondContact CZ-O 3.45Å; F849-A957 HydrophobicContact CD2-CB 4.38Å; F849-A957 HydrophobicContact CE1-CB 4.29Å; F849-A957 HydrophobicContact CE2-CB 3.62Å; F849-A957 HydrophobicContact CZ-CB 3.57Å; F849-A984 HydrophobicContact CD2-CB 4.3Å; F849-A984 WeakPolarHBondContact CE2-O 3.4Å; F849-A986 HydrophobicContact CB-CB 3.98Å; F849-A986 HydrophobicContact CD1-CB 3.9Å; F849-A986 HydrophobicContact CD2-CB 3.58Å; F849-A986 HydrophobicContact CE1-CB 4.26Å; F849-A986 HydrophobicContact CE2-CB 3.94Å; F849-A986 HydrophobicContact CG-CB 3.55Å; F849-A986 HydrophobicContact CZ-CB 4.27Å
850	Q	88.5	Confident	87.8	Confident	134 Å²	134	61.2 Å²	61.2	63%	0.626	32%	0.324	S	S	*	.	S	Bend	trans	-59.9	-36.7	176.6	-175.8	-171.7	-56.5	0	0	111.8	W871	Q850-W871 PolarHBondContact N-O 2.83Å
851	E	87.5	Confident	87.4	Confident	95 Å²	95	60.3 Å²	60.3	44%	0.444	33%	0.328	S	S	.	.			trans	-133.3	136.8	177.3	-69.7	169.6	-132.9	0	0	109.2	F849 N853 Y854	F849-E851 PolarHBondContact O-N 2.87Å; E851-N853 VanDerWaalsContact C-N 3.31Å; E851-Y854 HydrophobicContact CB-CD1 4.45Å; E851-Y854 HydrophobicContact CB-CE1 4.03Å; E851-Y854 HydrophobicContact CB-CE2 4.23Å; E851-Y854 PolarHBondContact N-OH 3.39Å; E851-Y854 WeakPolarHBondContact O-CE2 3.1Å
852	A	83.5	Confident	87.2	Confident	70 Å²	70	61 Å²	61	58%	0.579	33%	0.331	S	S	*	.	S	Bend	trans	-72	-27.4	-179.7	0	0	0	0	0	112.8	A986 T987	A852-A986 CarbonylContact O-C 3.54Å; A852-A986 VanDerWaalsContact O-CA 3.3Å; A852-A986 WeakPolarHBondContact O-CA 3.3Å; A852-A986 WeakPolarHBondContact O-CB 3.27Å; A852-T987 PolarHBondContact O-N 3.4Å
853	N	89.8	Confident	86.8	Confident	112 Å²	112	61.5 Å²	61.5	60%	0.599	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	122.5	-178.2	-49.9	-28.9	0	0	0	108.6	E851 T987	E851-N853 VanDerWaalsContact C-N 3.31Å; N853-T987 CarbonylContact C-O 3.57Å; N853-T987 WeakPolarHBondContact CA-O 3.34Å; N853-T987 WeakPolarHBondContact CA-OG1 3.36Å; N853-T987 WeakPolarHBondContact CB-OG1 3.33Å; N853-T987 VanDerWaalsContact CG-OG1 3.3Å; N853-T987 PolarHBondContact OD1-OG1 3.21Å
854	Y	91.1	Very high	86.6	Confident	19 Å²	19	66.6 Å²	66.6	8%	0.075	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	143.9	173.6	-67.1	-91.4	0	0	0	110.6	F849 E851 F856 V870 W871 A986 T987 V988 L989	F849-Y854 HydrophobicContact CD1-CE2 4.12Å; E851-Y854 HydrophobicContact CB-CD1 4.45Å; E851-Y854 HydrophobicContact CB-CE1 4.03Å; E851-Y854 HydrophobicContact CB-CE2 4.23Å; E851-Y854 PolarHBondContact N-OH 3.39Å; E851-Y854 WeakPolarHBondContact O-CE2 3.1Å; Y854-F856 HydrophobicContact CD1-CZ 4.12Å; Y854-F856 HydrophobicContact CG-CZ 4.32Å; Y854-V870 HydrophobicContact CD1-CG1 4.19Å; Y854-V870 HydrophobicContact CD2-CB 4.15Å; Y854-V870 HydrophobicContact CD2-CG1 3.51Å; Y854-V870 HydrophobicContact CE1-CB 4.38Å; Y854-V870 HydrophobicContact CE1-CG1 4.33Å; Y854-V870 HydrophobicContact CE2-CB 3.74Å; Y854-V870 HydrophobicContact CE2-CG1 3.65Å; Y854-V870 HydrophobicContact CG-CG1 3.79Å; Y854-W871 PolarHBondContact OH-N 2.81Å; Y854-W871 PolarHBondContact OH-O 2.81Å; Y854-W871 VanDerWaalsContact OH-O 3.11Å; Y854-A986 HydrophobicContact CD2-CB 4.12Å; Y854-A986 HydrophobicContact CE2-CB 3.96Å; Y854-T987 PolarHBondContact N-O 2.9Å; Y854-V988 WeakPolarHBondContact O-CA 3.33Å; Y854-L989 PolarHBondContact O-N 3.37Å
855	H	92.7	Very high	86.5	Confident	98 Å²	98	66.2 Å²	66.2	45%	0.454	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.9	173.8	176.6	-125.9	0	0	0	110.6	E857 L989 T991	H855-E857 IonicContact CE1-OE1 2.66Å; H855-E857 PolarHBondContact CE1-OE1 2.97Å; H855-L989 WeakPolarHBondContact CA-O 3.39Å; H855-T991 PolarHBondContact NE2-OG1 2.82Å
856	F	93.1	Very high	86.7	Confident	36 Å²	36	70.2 Å²	70.2	16%	0.158	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.8	175.3	-53.5	-62.1	0	0	0	110.4	Y854 V867 I937 V988 L989 I990 T991	Y854-F856 HydrophobicContact CD1-CZ 4.12Å; Y854-F856 HydrophobicContact CG-CZ 4.32Å; F856-V867 HydrophobicContact CB-CG1 3.65Å; F856-V867 HydrophobicContact CD2-CG1 4.24Å; F856-V867 HydrophobicContact CG-CG1 4.13Å; F856-I937 HydrophobicContact CE2-CD1 4.21Å; F856-V988 HydrophobicContact CD2-CG1 3.74Å; F856-V988 HydrophobicContact CE2-CG1 3.78Å; F856-L989 PolarHBondContact N-O 2.76Å; F856-I990 WeakPolarHBondContact O-CA 3.36Å; F856-T991 PolarHBondContact O-N 2.92Å
857	E	91.2	Very high	86.9	Confident	121 Å²	121	68 Å²	68	57%	0.565	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	140.1	178.9	-58.3	-174.1	150.7	0	0	109.6	H855 T991 L993	H855-E857 IonicContact CE1-OE1 2.66Å; H855-E857 PolarHBondContact CE1-OE1 2.97Å; E857-T991 WeakPolarHBondContact CA-O 3.25Å; E857-L993 HydrophobicContact CB-CD1 4.19Å; E857-L993 HydrophobicContact CB-CD2 4.34Å; E857-L993 HydrophobicContact CB-CG 4.33Å
858	V	89.2	Confident	86.9	Confident	8 Å²	8	68 Å²	68	5%	0.048	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	126.8	-173.2	-174.3	0	0	0	0	110.1	V867 L939 L943 I990 T991 V992 L993	V858-V867 HydrophobicContact CG2-CB 4.1Å; V858-V867 HydrophobicContact CG2-CG1 3.49Å; V858-V867 VanDerWaalsContact CG2-CG1 3.49Å; V858-V867 HydrophobicContact CG2-CG2 3.83Å; V858-L939 HydrophobicContact CG1-CD1 3.92Å; V858-L943 HydrophobicContact CB-CD1 4.46Å; V858-L943 HydrophobicContact CG1-CD1 4.35Å; V858-I990 HydrophobicContact CB-CG2 4.4Å; V858-I990 HydrophobicContact CG2-CG2 3.72Å; V858-T991 PolarHBondContact N-O 3.17Å; V858-V992 CarbonylContact O-C 3.58Å; V858-V992 WeakPolarHBondContact O-CA 3.35Å; V858-L993 PolarHBondContact O-N 3.08Å
859	E	85.8	Confident	87.1	Confident	111 Å²	111	67 Å²	67	52%	0.519	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	140.2	170.7	-53.3	170.9	164.7	0	0	110.5	L862 L993	E859-L862 HydrophobicContact CB-CD1 3.76Å; E859-L862 HydrophobicContact CB-CG 4.13Å; E859-L862 HydrophobicContact CG-CD1 4.5Å; E859-L862 WeakPolarHBondContact O-CD1 3.18Å; E859-L862 WeakPolarHBondContact O-CG 3.47Å; E859-L993 HydrophobicContact CG-CD1 4.33Å
860	E	87.1	Confident	87.1	Confident	19 Å²	19	66 Å²	66	9%	0.089	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	171.2	177.4	70	-167.4	131.7	0	0	114.1	L862 R945 V992 L993 D994 H995	E860-L862 PolarHBondContact O-N 2.75Å; E860-R945 WeakPolarHBondContact OE2-CB 2.94Å; E860-R945 PolarHBondContact OE2-N 3.27Å; E860-V992 HydrophobicContact CB-CG1 3.76Å; E860-L993 PolarHBondContact N-O 3.09Å; E860-D994 VanDerWaalsContact OE1-CA 3.28Å; E860-D994 WeakPolarHBondContact OE1-CA 3.48Å; E860-H995 HydrophobicContact CG-CB 3.98Å; E860-H995 PolarHBondContact OE1-N 3.34Å
861	G	77.8	Confident	87.3	Confident	38 Å²	38	65.7 Å²	65.7	39%	0.392	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	-18.4	-175.8	0	0	0	0	0	115.5	R942 L943	G861-R942 WeakPolarHBondContact O-CD 3.44Å; G861-R942 WeakPolarHBondContact O-CG 3.4Å; G861-L943 PolarHBondContact N-O 3.42Å; G861-L943 VanDerWaalsContact N-O 3.08Å
862	L	81.2	Confident	87.4	Confident	58 Å²	58	61.3 Å²	61.3	30%	0.304	32%	0.318	S	S	.	.			trans	-61.4	149.6	174.2	-66.9	-174.5	0	0	0	112.4	E859 E860 V865 L939 R942	E859-L862 HydrophobicContact CB-CD1 3.76Å; E859-L862 HydrophobicContact CB-CG 4.13Å; E859-L862 HydrophobicContact CG-CD1 4.5Å; E859-L862 WeakPolarHBondContact O-CD1 3.18Å; E859-L862 WeakPolarHBondContact O-CG 3.47Å; E860-L862 PolarHBondContact O-N 2.75Å; L862-V865 HydrophobicContact CB-CG2 4Å; L862-V865 HydrophobicContact CD1-CG2 4.22Å; L862-L939 HydrophobicContact CB-CD1 4.27Å; L862-R942 WeakPolarHBondContact O-CA 3.29Å
863	D	76	Confident	87.8	Confident	75 Å²	75	62.4 Å²	62.4	40%	0.401	32%	0.317	S	S	.	.			trans	-139.7	140.5	-176.3	-157.3	-8.2	0	0	0	110.5	V865 R942	D863-V865 PolarHBondContact O-N 2.9Å; D863-R942 HydrophobicContact CB-CG 4.11Å; D863-R942 IonicContact OD2-NE 3.65Å
864	L	77.2	Confident	87.8	Confident	131 Å²	131	58 Å²	58	69%	0.686	29%	0.294	S	S	*	.	S	Bend	trans	55.7	22.6	-178.1	-54.7	177.8	0	0	0	116.6	L939	L864-L939 WeakPolarHBondContact CA-O 3.46Å
865	V	83	Confident	87.7	Confident	53 Å²	53	59.4 Å²	59.4	32%	0.321	31%	0.31	S	S	.	.			trans	-83.7	146.9	-177.7	178.8	0	0	0	0	112.7	L862 D863 V867 H938 L939	L862-V865 HydrophobicContact CB-CG2 4Å; L862-V865 HydrophobicContact CD1-CG2 4.22Å; D863-V865 PolarHBondContact O-N 2.9Å; V865-V867 PolarHBondContact O-N 2.88Å; V865-H938 WeakPolarHBondContact O-CA 3.33Å; V865-L939 HydrophobicContact CB-CD1 4.44Å; V865-L939 PolarHBondContact O-N 2.95Å
866	K	88.8	Confident	87.6	Confident	114 Å²	114	55.2 Å²	55.2	50%	0.496	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	120.2	167.2	169.4	178.5	-179.1	151	0	109.2	L936	K866-L936 HydrophobicContact CD-CD1 3.58Å; K866-L936 HydrophobicContact CG-CD1 3.76Å; K866-L936 VanDerWaalsContact NZ-CD1 3.27Å
867	V	90.5	Very high	87.2	Confident	17 Å²	17	57.7 Å²	57.7	10%	0.103	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-51.5	175.8	176.6	0	0	0	0	111.2	F856 V858 V865 F928 I937 L939 I990	F856-V867 HydrophobicContact CB-CG1 3.65Å; F856-V867 HydrophobicContact CD2-CG1 4.24Å; F856-V867 HydrophobicContact CG-CG1 4.13Å; V858-V867 HydrophobicContact CG2-CB 4.1Å; V858-V867 HydrophobicContact CG2-CG1 3.49Å; V858-V867 VanDerWaalsContact CG2-CG1 3.49Å; V858-V867 HydrophobicContact CG2-CG2 3.83Å; V865-V867 PolarHBondContact O-N 2.88Å; V867-F928 HydrophobicContact CG2-CD1 4.47Å; V867-F928 HydrophobicContact CG2-CE1 4.36Å; V867-I937 HydrophobicContact CB-CG2 4.19Å; V867-I937 PolarHBondContact N-O 3.14Å; V867-L939 HydrophobicContact CG2-CD2 4.18Å; V867-L939 HydrophobicContact CG2-CG 3.91Å; V867-I990 HydrophobicContact CG1-CD1 3.89Å; V867-I990 HydrophobicContact CG1-CG1 4.08Å; V867-I990 HydrophobicContact CG1-CG2 4.15Å
868	G	90.6	Very high	86.8	Confident	4 Å²	4	58 Å²	58	4%	0.041	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	178.7	-166.2	0	0	0	0	0	111.6	I937	G868-I937 PolarHBondContact N-O 3.4Å; G868-I937 PolarHBondContact O-N 2.76Å
869	Q	92.7	Very high	86.3	Confident	73 Å²	73	60.9 Å²	60.9	34%	0.341	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	128.3	-179.2	-171.6	168.8	-5	0	0	109.7	S934 G935 L936	Q869-S934 WeakPolarHBondContact CG-O 3.33Å; Q869-S934 PolarHBondContact NE2-O 2.86Å; Q869-G935 WeakPolarHBondContact CA-O 3.32Å; Q869-L936 HydrophobicContact CB-CD1 4.06Å; Q869-L936 HydrophobicContact CG-CB 4.36Å; Q869-L936 HydrophobicContact CG-CD1 4.27Å
870	V	92.7	Very high	85.9	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.006	30%	0.3	C	S	.	.			trans	-100.6	158.5	174.9	-56.5	0	0	0	0	110.3	F849 Y854 Y885 I930 G935 I937 V955 V988	F849-V870 HydrophobicContact CD1-CB 4.39Å; F849-V870 HydrophobicContact CE1-CB 4.03Å; F849-V870 HydrophobicContact CE1-CG2 3.79Å; Y854-V870 HydrophobicContact CD1-CG1 4.19Å; Y854-V870 HydrophobicContact CD2-CB 4.15Å; Y854-V870 HydrophobicContact CD2-CG1 3.51Å; Y854-V870 HydrophobicContact CE1-CB 4.38Å; Y854-V870 HydrophobicContact CE1-CG1 4.33Å; Y854-V870 HydrophobicContact CE2-CB 3.74Å; Y854-V870 HydrophobicContact CE2-CG1 3.65Å; Y854-V870 HydrophobicContact CG-CG1 3.79Å; V870-Y885 HydrophobicContact CG2-CD1 3.95Å; V870-Y885 HydrophobicContact CG2-CE1 4.21Å; V870-I930 HydrophobicContact CG2-CD1 4.02Å; V870-G935 PolarHBondContact N-O 2.79Å; V870-I937 HydrophobicContact CG1-CD1 4.34Å; V870-V955 HydrophobicContact CG2-CG1 3.95Å; V870-V988 HydrophobicContact CG1-CG2 3.95Å
871	W	91.4	Very high	85.8	Confident	127 Å²	127	56.5 Å²	56.5	48%	0.481	31%	0.307	S	S	.	.			trans	-143.8	137.1	179	-164	-86.3	0	0	0	111.3	F849 Q850 Y854	F849-W871 WeakPolarHBondContact CA-O 3.43Å; F849-W871 WeakPolarHBondContact CD1-O 3.33Å; Q850-W871 PolarHBondContact N-O 2.83Å; Y854-W871 PolarHBondContact OH-N 2.81Å; Y854-W871 PolarHBondContact OH-O 2.81Å; Y854-W871 VanDerWaalsContact OH-O 3.11Å
872	A	90.7	Very high	86.2	Confident	3 Å²	3	58.1 Å²	58.1	3%	0.025	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	157.8	171.4	0	0	0	0	0	110.6	V848 F849 I883 Y885 A957	V848-A872 CarbonylContact O-C 3.55Å; V848-A872 WeakPolarHBondContact O-CA 3.21Å; V848-A872 WeakPolarHBondContact O-CB 3.23Å; F849-A872 HydrophobicContact CD1-CB 3.96Å; F849-A872 HydrophobicContact CE1-CB 4.26Å; F849-A872 HydrophobicContact CG-CB 4.16Å; A872-I883 VanDerWaalsContact C-CD1 3.41Å; A872-I883 HydrophobicContact CB-CD1 3.81Å; A872-I883 VanDerWaalsContact O-CD1 3.27Å; A872-I883 WeakPolarHBondContact O-CD1 3.44Å; A872-Y885 HydrophobicContact CB-CE1 4.05Å; A872-Y885 PolarHBondContact N-OH 2.87Å; A872-A957 HydrophobicContact CB-CB 3.91Å
873	V	90.6	Very high	86.6	Confident	93 Å²	93	56.6 Å²	56.6	56%	0.564	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.3	174.4	-176	0	0	0	0	107.6	V848	V848-V873 PolarHBondContact N-O 3.23Å; V848-V873 PolarHBondContact O-N 3.05Å
874	D	90.7	Very high	87.2	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.102	28%	0.278	C	S	.	.			trans	-132.9	146.8	-177	-171.3	-49.2	0	0	0	106.3	P847 D876 A881 I883 D959	P847-D874 WeakPolarHBondContact CD-OD2 3.45Å; P847-D874 VanDerWaalsContact CG-OD2 3.29Å; P847-D874 WeakPolarHBondContact CG-OD2 3.48Å; D874-D876 PolarHBondContact OD1-N 2.92Å; D874-A881 HydrophobicContact CB-CB 3.96Å; D874-A881 VanDerWaalsContact CG-CA 3.43Å; D874-A881 WeakPolarHBondContact OD1-CA 3.45Å; D874-A881 WeakPolarHBondContact OD1-CB 3.01Å; D874-I883 HydrophobicContact CB-CD1 3.78Å; D874-I883 HydrophobicContact CB-CG1 3.88Å; D874-D959 WeakPolarHBondContact OD2-CB 3.37Å
875	A	89	Confident	87.9	Confident	49 Å²	49	47.7 Å²	47.7	41%	0.405	25%	0.247	S	C	.	.			trans	-98.9	-22.3	-166.7	0	0	0	0	0	114	R797 E798	R797-A875 PolarHBondContact NH2-O 2.85Å; E798-A875 HydrophobicContact CG-CB 3.94Å
876	D	89.7	Confident	88.1	Confident	10 Å²	10	51.6 Å²	51.6	5%	0.053	26%	0.256	C	S	.	.	S	Bend	trans	-63.8	-157.7	-178.2	-52.4	-17.4	0	0	0	112.8	R797 D841 N843 S845 D874 A880 A881	R797-D876 PolarHBondContact NH2-O 2.81Å; D841-D876 WeakPolarHBondContact OD1-CA 3.3Å; N843-D876 WeakPolarHBondContact CA-OD2 3.37Å; N843-D876 PolarHBondContact OD1-OD2 3.29Å; S845-D876 WeakPolarHBondContact CB-OD1 3.25Å; S845-D876 PolarHBondContact N-OD1 3.11Å; D874-D876 PolarHBondContact OD1-N 2.92Å; D876-A880 HydrophobicContact CB-CB 3.63Å; D876-A880 WeakPolarHBondContact OD2-CB 3.42Å; D876-A881 HydrophobicContact CB-CB 4.03Å; D876-A881 WeakPolarHBondContact O-CB 3.35Å
877	Q	84.8	Confident	87.9	Confident	88 Å²	88	48 Å²	48	41%	0.411	24%	0.241	S	C	.	.			trans	-121.6	157.7	178.3	-141.1	177.6	-87.3	0	0	115.2	D841 E879 A880 A881	D841-Q877 HydrophobicContact CB-CB 3.99Å; D841-Q877 VanDerWaalsContact CG-N 3.26Å; D841-Q877 VanDerWaalsContact OD1-CB 3.27Å; D841-Q877 WeakPolarHBondContact OD1-CB 3.49Å; D841-Q877 PolarHBondContact OD1-N 2.8Å; D841-Q877 WeakPolarHBondContact OD2-CB 3.4Å; D841-Q877 PolarHBondContact OD2-N 3.46Å; Q877-E879 PolarHBondContact O-N 2.95Å; Q877-A880 WeakPolarHBondContact O-CB 3.11Å; Q877-A880 PolarHBondContact O-N 3.32Å; Q877-A881 PolarHBondContact O-N 2.9Å
878	D	82.4	Confident	86.9	Confident	126 Å²	126	48.4 Å²	48.4	67%	0.674	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	-91.5	164.2	-72.1	-59.2	0	0	0	117
879	E	79.8	Confident	85.4	Confident	70 Å²	70	50.3 Å²	50.3	33%	0.327	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-20.9	-179	-71.1	-83.9	143.5	0	0	112.9	Q877 R882 N960 R962	Q877-E879 PolarHBondContact O-N 2.95Å; E879-R882 IonicContact OE1-CZ 3.19Å; E879-R882 IonicContact OE1-NH1 3.16Å; E879-R882 PolarHBondContact OE1-NH1 2.99Å; E879-R882 IonicContact OE2-CZ 2.91Å; E879-R882 IonicContact OE2-NH1 2.68Å; E879-R882 PolarHBondContact OE2-NH1 3.34Å; E879-R882 IonicContact OE2-NH2 2.72Å; E879-R882 PolarHBondContact OE2-NH2 2.77Å; E879-N960 VanDerWaalsContact O-CA 3.25Å; E879-N960 WeakPolarHBondContact O-CA 3.45Å; E879-R962 IonicContact OE1-CZ 3.31Å; E879-R962 IonicContact OE1-NH1 3.4Å; E879-R962 PolarHBondContact OE1-NH1 3.11Å; E879-R962 IonicContact OE1-NH2 2.79Å; E879-R962 PolarHBondContact OE1-NH2 2.78Å; E879-R962 WeakPolarHBondContact OE2-CD 3.35Å; E879-R962 IonicContact OE2-CZ 3.42Å; E879-R962 IonicContact OE2-NE 2.7Å; E879-R962 IonicContact OE2-NH1 2.56Å; E879-R962 PolarHBondContact OE2-NH1 3.1Å
880	A	77.5	Confident	83.4	Confident	10 Å²	10	48.5 Å²	48.5	8%	0.083	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-67.8	170.7	0	0	0	0	0	108.3	N843 D876 Q877 R882 D959 N960	N843-A880 HydrophobicContact CB-CB 4.27Å; D876-A880 HydrophobicContact CB-CB 3.63Å; D876-A880 WeakPolarHBondContact OD2-CB 3.42Å; Q877-A880 WeakPolarHBondContact O-CB 3.11Å; Q877-A880 PolarHBondContact O-N 3.32Å; A880-R882 PolarHBondContact O-N 2.76Å; A880-D959 WeakPolarHBondContact O-CB 3.4Å; A880-N960 PolarHBondContact O-N 3.49Å
881	A	84	Confident	80.9	Confident	27 Å²	27	54.8 Å²	54.8	22%	0.223	29%	0.29	C	S	.	.	S	Bend	trans	-62.6	3.5	179.7	0	0	0	0	0	117.1	D874 D876 Q877 I883	D874-A881 HydrophobicContact CB-CB 3.96Å; D874-A881 VanDerWaalsContact CG-CA 3.43Å; D874-A881 WeakPolarHBondContact OD1-CA 3.45Å; D874-A881 WeakPolarHBondContact OD1-CB 3.01Å; D876-A881 HydrophobicContact CB-CB 4.03Å; D876-A881 WeakPolarHBondContact O-CB 3.35Å; Q877-A881 PolarHBondContact O-N 2.9Å; A881-I883 PolarHBondContact O-N 3.14Å; A881-I883 VanDerWaalsContact O-N 3.08Å
882	R	87.2	Confident	78.3	Confident	73 Å²	73	55.2 Å²	55.2	28%	0.275	30%	0.302	S	S	.	.			trans	-86.2	80.6	176.8	-168.3	-154.3	55.4	-131.7	-24.5	112.1	E879 A880 P961 R962	E879-R882 IonicContact OE1-CZ 3.19Å; E879-R882 IonicContact OE1-NH1 3.16Å; E879-R882 PolarHBondContact OE1-NH1 2.99Å; E879-R882 IonicContact OE2-CZ 2.91Å; E879-R882 IonicContact OE2-NH1 2.68Å; E879-R882 PolarHBondContact OE2-NH1 3.34Å; E879-R882 IonicContact OE2-NH2 2.72Å; E879-R882 PolarHBondContact OE2-NH2 2.77Å; A880-R882 PolarHBondContact O-N 2.76Å; R882-P961 WeakPolarHBondContact O-CD 3.37Å; R882-P961 WeakPolarHBondContact O-CG 3.49Å; R882-R962 VanDerWaalsContact NH1-CZ 3.26Å; R882-R962 VanDerWaalsContact NH1-NH2 3.19Å
883	I	88.5	Confident	75.3	Confident	25 Å²	25	62.9 Å²	62.9	13%	0.128	34%	0.343	C	S	.	.			trans	-45.7	142.8	172.8	-64	156.1	0	0	0	113.7	P847 A872 D874 A881 Y885 A957 L958	P847-I883 HydrophobicContact CB-CG1 4.23Å; P847-I883 HydrophobicContact CG-CG1 4.36Å; A872-I883 VanDerWaalsContact C-CD1 3.41Å; A872-I883 HydrophobicContact CB-CD1 3.81Å; A872-I883 VanDerWaalsContact O-CD1 3.27Å; A872-I883 WeakPolarHBondContact O-CD1 3.44Å; D874-I883 HydrophobicContact CB-CD1 3.78Å; D874-I883 HydrophobicContact CB-CG1 3.88Å; A881-I883 PolarHBondContact O-N 3.14Å; A881-I883 VanDerWaalsContact O-N 3.08Å; I883-Y885 HydrophobicContact CG2-CD1 4.3Å; I883-Y885 HydrophobicContact CG2-CD2 4.34Å; I883-Y885 HydrophobicContact CG2-CE1 3.9Å; I883-Y885 HydrophobicContact CG2-CE2 3.95Å; I883-A957 HydrophobicContact CG2-CB 3.88Å; I883-L958 CarbonylContact C-O 3.6Å; I883-L958 VanDerWaalsContact CA-O 3.27Å; I883-L958 WeakPolarHBondContact CA-O 3.18Å
884	S	89.7	Confident	72.4	Confident	13 Å²	13	69.9 Å²	69.9	9%	0.091	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.5	160.8	-172.8	0	0	0	0	112.1	P932 L958	S884-P932 WeakPolarHBondContact CA-O 3.33Å; S884-P932 WeakPolarHBondContact CB-O 3.18Å; S884-P932 PolarHBondContact OG-O 3.08Å; S884-L958 PolarHBondContact N-O 2.88Å; S884-L958 VanDerWaalsContact O-CD1 3.32Å; S884-L958 WeakPolarHBondContact O-CD1 3.47Å; S884-L958 PolarHBondContact O-N 3Å
885	Y	91.3	Very high	69.6	Low	7 Å²	7	75.6 Å²	75.6	3%	0.027	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	141.7	-175.9	-55.3	-86.1	0	0	0	112.7	F849 V870 A872 I883 P932 G935 L956 A957	F849-Y885 HydrophobicContact CE1-CD1 4.01Å; F849-Y885 AromaticContact CE1-CE1 3.87Å; F849-Y885 HydrophobicContact CE1-CE1 3.87Å; F849-Y885 HydrophobicContact CZ-CD1 4.23Å; F849-Y885 HydrophobicContact CZ-CE1 4.41Å; V870-Y885 HydrophobicContact CG2-CD1 3.95Å; V870-Y885 HydrophobicContact CG2-CE1 4.21Å; A872-Y885 HydrophobicContact CB-CE1 4.05Å; A872-Y885 PolarHBondContact N-OH 2.87Å; I883-Y885 HydrophobicContact CG2-CD1 4.3Å; I883-Y885 HydrophobicContact CG2-CD2 4.34Å; I883-Y885 HydrophobicContact CG2-CE1 3.9Å; I883-Y885 HydrophobicContact CG2-CE2 3.95Å; Y885-P932 PolarHBondContact N-O 3.34Å; Y885-P932 VanDerWaalsContact N-O 3.09Å; Y885-P932 VanDerWaalsContact O-CA 3.31Å; Y885-P932 WeakPolarHBondContact O-CA 3.42Å; Y885-G935 VanDerWaalsContact CD2-N 3.31Å; Y885-L956 CarbonylContact C-O 3.55Å; Y885-L956 WeakPolarHBondContact CA-O 3.37Å; Y885-A957 HydrophobicContact CD1-CB 4.33Å; Y885-A957 HydrophobicContact CE1-CB 4.36Å
886	R	86.8	Confident	66.7	Low	135 Å²	135	83.4 Å²	83.4	51%	0.509	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	146.9	175.1	-59.5	-174.8	-170.8	-109.1	0.6	111.3	A888 V955 L956 L958	R886-A888 PolarHBondContact O-N 3.26Å; R886-V955 WeakPolarHBondContact O-CA 3.34Å; R886-V955 WeakPolarHBondContact O-CG1 3.31Å; R886-L956 PolarHBondContact N-O 2.91Å; R886-L956 PolarHBondContact O-N 2.82Å; R886-L958 HydrophobicContact CB-CD1 4.27Å; R886-L958 HydrophobicContact CG-CD1 3.74Å
887	L	86.3	Confident	63.9	Low	37 Å²	37	90 Å²	90	19%	0.194	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	123.3	164.2	-58.9	-178.4	0	0	0	108.3	I924 F928 I930 F953 V955	L887-I924 HydrophobicContact CD1-CG2 4.48Å; L887-F928 HydrophobicContact CD1-CB 4.19Å; L887-I930 HydrophobicContact CD2-CB 4.04Å; L887-I930 HydrophobicContact CD2-CG2 4.12Å; L887-I930 HydrophobicContact CG-CB 4.26Å; L887-I930 HydrophobicContact CG-CG2 3.93Å; L887-F953 HydrophobicContact CD2-CD2 3.93Å; L887-F953 HydrophobicContact CD2-CE2 3.49Å; L887-F953 VanDerWaalsContact CD2-CE2 3.49Å; L887-F953 HydrophobicContact CD2-CZ 4.11Å; L887-V955 HydrophobicContact CD2-CG2 4.16Å
888	A	68.9	Low	61.3	Low	26 Å²	26	91.3 Å²	91.3	22%	0.215	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119.8	173.3	0	0	0	0	0	108.8	R886 V954 L956	R886-A888 PolarHBondContact O-N 3.26Å; A888-V954 CarbonylContact C-O 3.38Å; A888-V954 HydrophobicContact CB-CB 4.47Å; A888-V954 HydrophobicContact CB-CG1 4.45Å; A888-V954 PolarHBondContact N-O 3Å; A888-V954 CarbonylContact O-C 3.53Å; A888-V954 WeakPolarHBondContact O-CB 3.3Å; A888-V954 PolarHBondContact O-N 2.7Å; A888-L956 HydrophobicContact CB-CB 3.89Å
889	V	59.4	Low	58.9	Low	44 Å²	44	90.2 Å²	90.2	27%	0.267	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-96.6	121.1	174.8	-169.4	0	0	0	0	107.5	I891 A921 I924	V889-I891 PolarHBondContact O-N 2.8Å; V889-A921 HydrophobicContact CB-CB 3.67Å; V889-A921 HydrophobicContact CG1-CB 3.64Å; V889-A921 HydrophobicContact CG2-CB 3.91Å; V889-I924 HydrophobicContact CG1-CD1 3.84Å; V889-I924 HydrophobicContact CG2-CB 4.35Å; V889-I924 HydrophobicContact CG2-CD1 3.97Å; V889-I924 HydrophobicContact CG2-CG2 4.33Å
890	G	49.4	Very low	56.6	Low	35 Å²	35	91.7 Å²	91.7	36%	0.361	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-68.9	121.7	-155.6	0	0	0	0	0	114.4
891	I	40.5	Very low	54.5	Low	133 Å²	133	97 Å²	97	68%	0.682	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-86.5	118.2	150.2	-55.9	178	0	0	0	106.2	V889 N893	V889-I891 PolarHBondContact O-N 2.8Å; I891-N893 PolarHBondContact O-N 2.66Å; I891-N893 VanDerWaalsContact O-N 3.15Å
892	N	36.2	Very low	52.2	Low	136 Å²	136	98.4 Å²	98.4	73%	0.727	51%	0.512	S	S	*	.			trans	-51.1	111.7	-164.3	-62.1	-32.9	0	0	0	115.4	R894	N892-R894 PolarHBondContact O-N 2.93Å
893	N	29.3	Very low	49.6	Very low	165 Å²	165	98.6 Å²	98.6	88%	0.882	52%	0.518	S	S	*	.	S	Bend	trans	19.1	66.7	153.8	-65.8	-6.5	0	0	0	117.7	I891	I891-N893 PolarHBondContact O-N 2.66Å; I891-N893 VanDerWaalsContact O-N 3.15Å
894	R	29.1	Very low	46.9	Very low	239 Å²	239	104 Å²	104	90%	0.902	54%	0.541	S	S	*	.			trans	-157.7	35.5	174	-125.5	174.8	-157.2	-160.4	4.4	118.7	N892	N892-R894 PolarHBondContact O-N 2.93Å
895	I	31.6	Very low	44.3	Very low	139 Å²	139	107.9 Å²	107.9	71%	0.713	57%	0.573	S	S	*	*			trans	-125.3	111.7	165.2	-56.4	179.8	0	0	0	109.3	E897	I895-E897 WeakPolarHBondContact CG2-O 3.39Å
896	K	28.4	Very low	41.7	Very low	214 Å²	214	113.9 Å²	113.9	93%	0.93	60%	0.602	S	S	*	*			trans	-121.8	60.1	165.6	-87.7	-159.5	172.1	-161.7	0	108.4
897	E	30.3	Very low	39.3	Very low	148 Å²	148	113.8 Å²	113.8	69%	0.692	61%	0.607	S	S	*	*	S	Bend	trans	-159.7	127.4	176.4	-113.2	160.8	-126.8	0	0	109	I895 V899	I895-E897 WeakPolarHBondContact CG2-O 3.39Å; E897-V899 HydrophobicContact CB-CG2 4.35Å; E897-V899 PolarHBondContact O-N 2.77Å
898	P	31.1	Very low	36.9	Very low	116 Å²	116	114.7 Å²	114.7	75%	0.753	61%	0.614	S	S	*	*			trans	-77.1	88.1	172.6	31.2	-32.2	0	0	0	109.4	N900	P898-N900 PolarHBondContact O-N 3.38Å
899	V	32	Very low	35.4	Very low	102 Å²	102	119.4 Å²	119.4	62%	0.618	63%	0.634	S	S	*	*			trans	-76.1	92.6	178.5	-177	0	0	0	0	109.9	E897 D901	E897-V899 HydrophobicContact CB-CG2 4.35Å; E897-V899 PolarHBondContact O-N 2.77Å; V899-D901 HydrophobicContact CG1-CB 4.4Å; V899-D901 PolarHBondContact O-N 3.29Å
900	N	31.6	Very low	34.3	Very low	102 Å²	102	125.8 Å²	125.8	55%	0.545	66%	0.658	S	S	.	*			trans	-71.5	72.3	170.9	-72.6	-10.7	0	0	0	111.1	P898 E978	P898-N900 PolarHBondContact O-N 3.38Å; N900-E978 WeakPolarHBondContact CB-OE1 3.35Å; N900-E978 PolarHBondContact ND2-OE1 3.46Å; N900-E978 PolarHBondContact ND2-OE2 2.8Å
901	D	33.2	Very low	33.6	Very low	122 Å²	122	128.2 Å²	128.2	65%	0.652	67%	0.67	S	S	*	*			trans	-147.5	123.2	166.8	-148.1	-19.7	0	0	0	113.2	V899 N903	V899-D901 HydrophobicContact CG1-CB 4.4Å; V899-D901 PolarHBondContact O-N 3.29Å; D901-N903 PolarHBondContact O-N 3.34Å
902	G	35.4	Very low	33.3	Very low	56 Å²	56	127.4 Å²	127.4	58%	0.577	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	30.4	-159.1	0	0	0	0	0	116.9	K967	G902-K967 VanDerWaalsContact O-CE 3.23Å; G902-K967 WeakPolarHBondContact O-CE 3.49Å; G902-K967 PolarHBondContact O-NZ 2.92Å
903	N	33.3	Very low	33.4	Very low	77 Å²	77	128.4 Å²	128.4	41%	0.412	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.6	-9.9	-167.3	-93.1	-22	0	0	0	117.2	D901 A905 E906 K967	D901-N903 PolarHBondContact O-N 3.34Å; N903-A905 VanDerWaalsContact C-N 3.28Å; N903-A905 PolarHBondContact O-N 3.41Å; N903-A905 VanDerWaalsContact O-N 3.14Å; N903-E906 PolarHBondContact O-N 2.95Å; N903-E906 VanDerWaalsContact O-N 3.08Å; N903-K967 PolarHBondContact OD1-NZ 3.41Å
904	F	32	Very low	33.9	Very low	139 Å²	139	124.8 Å²	124.8	61%	0.61	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-64.3	-28.2	-167.7	-135.8	-103.9	0	0	0	115	E906 Q907 V908	F904-E906 PolarHBondContact O-N 2.94Å; F904-Q907 PolarHBondContact O-N 3.24Å; F904-V908 HydrophobicContact CD1-CG2 3.48Å; F904-V908 VanDerWaalsContact CD1-CG2 3.48Å; F904-V908 HydrophobicContact CE1-CG2 3.46Å; F904-V908 VanDerWaalsContact CE1-CG2 3.46Å; F904-V908 HydrophobicContact CZ-CG2 4.49Å; F904-V908 PolarHBondContact O-N 3.41Å
905	A	33.6	Very low	34.8	Very low	93 Å²	93	120.9 Å²	120.9	77%	0.769	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-61.4	-14.2	175.9	0	0	0	0	0	114.7	N903 I909	N903-A905 VanDerWaalsContact C-N 3.28Å; N903-A905 PolarHBondContact O-N 3.41Å; N903-A905 VanDerWaalsContact O-N 3.14Å; A905-I909 WeakPolarHBondContact O-CD1 3.21Å
906	E	38.4	Very low	35.7	Very low	133 Å²	133	120.5 Å²	120.5	62%	0.621	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-113.1	-4.2	-177.1	-146.6	166	176.4	0	0	113.4	N903 F904	N903-E906 PolarHBondContact O-N 2.95Å; N903-E906 VanDerWaalsContact O-N 3.08Å; F904-E906 PolarHBondContact O-N 2.94Å
907	Q	35.2	Very low	36.6	Very low	133 Å²	133	112.5 Å²	112.5	62%	0.621	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-26	178.9	-73	-172.9	-20.9	0	0	114.4	F904 I909	F904-Q907 PolarHBondContact O-N 3.24Å; Q907-I909 PolarHBondContact O-N 3.27Å
908	V	35.6	Very low	37.5	Very low	56 Å²	56	113.1 Å²	113.1	34%	0.339	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-66.4	-19.8	175.5	178.2	0	0	0	0	112.9	F904 K910	F904-V908 HydrophobicContact CD1-CG2 3.48Å; F904-V908 VanDerWaalsContact CD1-CG2 3.48Å; F904-V908 HydrophobicContact CE1-CG2 3.46Å; F904-V908 VanDerWaalsContact CE1-CG2 3.46Å; F904-V908 HydrophobicContact CZ-CG2 4.49Å; F904-V908 PolarHBondContact O-N 3.41Å; V908-K910 PolarHBondContact O-N 3.07Å
909	I	38	Very low	38.9	Very low	125 Å²	125	112.4 Å²	112.4	64%	0.641	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-71.9	9	-175.6	-58.2	173.7	0	0	0	113	A905 Q907	A905-I909 WeakPolarHBondContact O-CD1 3.21Å; Q907-I909 PolarHBondContact O-N 3.27Å
910	K	36	Very low	40.5	Very low	178 Å²	178	111.5 Å²	111.5	77%	0.774	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-130.2	4.7	-172.5	-69.5	177.4	-176.6	160.2	0	116.5	V908	V908-K910 PolarHBondContact O-N 3.07Å
911	S	34.9	Very low	41.9	Very low	86 Å²	86	107.8 Å²	107.8	60%	0.601	58%	0.58	S	S	*	*			trans	-94.3	93.3	171.9	47.5	0	0	0	0	111.7	N913	S911-N913 VanDerWaalsContact C-N 3.31Å; S911-N913 PolarHBondContact O-N 2.88Å
912	S	33.4	Very low	43.5	Very low	117 Å²	117	106.6 Å²	106.6	82%	0.818	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	70.4	-175.8	59	0	0	0	0	113.6
913	N	39.4	Very low	45.4	Very low	157 Å²	157	105.8 Å²	105.8	84%	0.84	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.1	-9.7	171.8	-98	-25.2	0	0	0	115.9	S911	S911-N913 VanDerWaalsContact C-N 3.31Å; S911-N913 PolarHBondContact O-N 2.88Å
914	N	39.1	Very low	47.7	Very low	88 Å²	88	102.4 Å²	102.4	47%	0.471	54%	0.536	S	S	.	.			trans	-104.8	42.5	-174.1	-87.8	2	0	0	0	114.4	L917 Y918	N914-L917 HydrophobicContact CB-CB 4.16Å; N914-L917 HydrophobicContact CB-CD2 4.48Å; N914-L917 PolarHBondContact O-N 2.98Å; N914-Y918 PolarHBondContact O-N 2.97Å
915	Q	47.7	Very low	49.9	Very low	157 Å²	157	98.5 Å²	98.5	73%	0.734	52%	0.524	S	S	*	.	H	α-helix	trans	-67.1	-45.6	-177.7	-130.6	166.2	-30.3	0	0	112.4	L917 Y918 D919	Q915-L917 VanDerWaalsContact C-N 3.27Å; Q915-L917 PolarHBondContact O-N 3.12Å; Q915-Y918 WeakPolarHBondContact O-CB 3.18Å; Q915-Y918 PolarHBondContact O-N 3.19Å; Q915-Y918 VanDerWaalsContact O-N 3.09Å; Q915-D919 PolarHBondContact O-N 2.92Å
916	N	51.2	Low	52.1	Low	132 Å²	132	97.2 Å²	97.2	71%	0.706	51%	0.506	S	S	*	.	H	α-helix	trans	-57.4	-39	175.8	-61.4	13.5	0	0	0	112.5	Y918 D919 E920	N916-Y918 VanDerWaalsContact C-N 3.3Å; N916-Y918 PolarHBondContact O-N 3.27Å; N916-D919 PolarHBondContact O-N 3.32Å; N916-E920 PolarHBondContact O-N 3Å
917	L	47.7	Very low	54.3	Low	46 Å²	46	91.9 Å²	91.9	24%	0.241	48%	0.482	C	S	.	.	H	α-helix	trans	-67.3	-32.1	-179.7	-158.1	74.3	0	0	0	111.9	N914 Q915 A921	N914-L917 HydrophobicContact CB-CB 4.16Å; N914-L917 HydrophobicContact CB-CD2 4.48Å; N914-L917 PolarHBondContact O-N 2.98Å; Q915-L917 VanDerWaalsContact C-N 3.27Å; Q915-L917 PolarHBondContact O-N 3.12Å; L917-A921 VanDerWaalsContact O-CB 3.3Å; L917-A921 WeakPolarHBondContact O-CB 3.28Å; L917-A921 PolarHBondContact O-N 3.15Å; L917-A921 VanDerWaalsContact O-N 3.15Å
918	Y	49.3	Very low	56.9	Low	161 Å²	161	85.7 Å²	85.7	63%	0.631	45%	0.453	S	S	*	.	H	α-helix	trans	-72.5	-38.7	171.4	-99.8	-77.6	0	0	0	112.6	N914 Q915 N916 A921 L922	N914-Y918 PolarHBondContact O-N 2.97Å; Q915-Y918 WeakPolarHBondContact O-CB 3.18Å; Q915-Y918 PolarHBondContact O-N 3.19Å; Q915-Y918 VanDerWaalsContact O-N 3.09Å; N916-Y918 VanDerWaalsContact C-N 3.3Å; N916-Y918 PolarHBondContact O-N 3.27Å; Y918-A921 PolarHBondContact O-N 2.68Å; Y918-L922 WeakPolarHBondContact O-CB 3.45Å; Y918-L922 PolarHBondContact O-N 2.83Å
919	D	59.7	Low	59.5	Low	100 Å²	100	88.5 Å²	88.5	54%	0.535	46%	0.462	S	S	.	.	H	α-helix	trans	-68.8	-40.2	178.2	-77.9	-42.2	0	0	0	111.8	Q915 N916 L922 E923	Q915-D919 PolarHBondContact O-N 2.92Å; N916-D919 PolarHBondContact O-N 3.32Å; D919-L922 PolarHBondContact O-N 3.49Å; D919-E923 PolarHBondContact O-N 2.87Å
920	E	64.6	Low	62.1	Low	83 Å²	83	83.3 Å²	83.3	39%	0.388	44%	0.435	S	S	.	.	H	α-helix	trans	-65	-40.4	171.4	-70.2	-158.8	106.9	0	0	112.2	N916 L922 E923 I924 R948	N916-E920 PolarHBondContact O-N 3Å; E920-L922 VanDerWaalsContact C-N 3.29Å; E920-L922 PolarHBondContact O-N 3.08Å; E920-E923 PolarHBondContact O-N 3.31Å; E920-E923 VanDerWaalsContact O-N 3.15Å; E920-I924 WeakPolarHBondContact O-CD1 3.39Å; E920-I924 WeakPolarHBondContact O-CG1 3.33Å; E920-I924 PolarHBondContact O-N 3.03Å; E920-R948 IonicContact OE1-CZ 2.83Å; E920-R948 IonicContact OE1-NH1 2.69Å; E920-R948 PolarHBondContact OE1-NH1 3.39Å; E920-R948 IonicContact OE1-NH2 3.39Å; E920-R948 PolarHBondContact OE1-NH2 3.15Å
921	A	61	Low	64.6	Low	24 Å²	24	77.3 Å²	77.3	20%	0.198	41%	0.412	C	S	.	.	H	α-helix	trans	-62.9	-37.6	176.2	0	0	0	0	0	112.9	V889 L917 Y918 T925	V889-A921 HydrophobicContact CB-CB 3.67Å; V889-A921 HydrophobicContact CG1-CB 3.64Å; V889-A921 HydrophobicContact CG2-CB 3.91Å; L917-A921 VanDerWaalsContact O-CB 3.3Å; L917-A921 WeakPolarHBondContact O-CB 3.28Å; L917-A921 PolarHBondContact O-N 3.15Å; L917-A921 VanDerWaalsContact O-N 3.15Å; Y918-A921 PolarHBondContact O-N 2.68Å; A921-T925 WeakPolarHBondContact O-CB 3.46Å; A921-T925 WeakPolarHBondContact O-CG2 3.39Å; A921-T925 PolarHBondContact O-N 3.01Å; A921-T925 PolarHBondContact O-OG1 3.36Å
922	L	68.7	Low	67.2	Low	97 Å²	97	76.2 Å²	76.2	51%	0.508	40%	0.403	S	S	.	.	H	α-helix	trans	-68.2	-41.2	173.3	-167.8	65.5	0	0	0	110.9	Y918 D919 E920 T925 T926	Y918-L922 WeakPolarHBondContact O-CB 3.45Å; Y918-L922 PolarHBondContact O-N 2.83Å; D919-L922 PolarHBondContact O-N 3.49Å; E920-L922 VanDerWaalsContact C-N 3.29Å; E920-L922 PolarHBondContact O-N 3.08Å; L922-T925 PolarHBondContact O-N 3.34Å; L922-T925 PolarHBondContact O-OG1 2.79Å; L922-T926 VanDerWaalsContact O-CG2 3.3Å; L922-T926 WeakPolarHBondContact O-CG2 3.49Å; L922-T926 PolarHBondContact O-N 3.41Å; L922-T926 PolarHBondContact O-OG1 2.77Å; L922-T926 VanDerWaalsContact O-OG1 3.14Å
923	E	75.3	Confident	69.8	Low	39 Å²	39	81 Å²	81	18%	0.182	40%	0.403	C	S	.	.	H	α-helix	trans	-63.1	-49.1	178.6	-167.7	164.3	-112.5	0	0	111.9	D919 E920 T925 T926 H927 R947 R948 Y951	D919-E923 PolarHBondContact O-N 2.87Å; E920-E923 PolarHBondContact O-N 3.31Å; E920-E923 VanDerWaalsContact O-N 3.15Å; E923-T925 PolarHBondContact O-N 2.68Å; E923-T926 WeakPolarHBondContact CA-OG1 3.33Å; E923-T926 PolarHBondContact O-N 3.01Å; E923-T926 VanDerWaalsContact O-N 3.15Å; E923-T926 PolarHBondContact O-OG1 2.75Å; E923-H927 PolarHBondContact O-N 2.91Å; E923-H927 PolarHBondContact O-ND1 2.71Å; E923-R947 IonicContact OE1-CZ 3.84Å; E923-R947 IonicContact OE1-NE 3.98Å; E923-R947 IonicContact OE1-NH2 3.75Å; E923-R947 PolarHBondContact OE1-NH2 2.87Å; E923-R948 WeakPolarHBondContact OE2-CD 3.43Å; E923-R948 IonicContact OE2-CZ 2.94Å; E923-R948 IonicContact OE2-NE 2.7Å; E923-R948 IonicContact OE2-NH1 3.72Å; E923-R948 PolarHBondContact OE2-NH1 2.81Å; E923-Y951 HydrophobicContact CG-CE1 4.38Å
924	I	81.5	Confident	72.2	Confident	6 Å²	6	74.9 Å²	74.9	3%	0.031	37%	0.372	C	S	.	.	H	α-helix	trans	-57.1	-48.8	176.5	-67.1	155.7	0	0	0	110.7	L887 V889 E920 T926 H927 F928 F953	L887-I924 HydrophobicContact CD1-CG2 4.48Å; V889-I924 HydrophobicContact CG1-CD1 3.84Å; V889-I924 HydrophobicContact CG2-CB 4.35Å; V889-I924 HydrophobicContact CG2-CD1 3.97Å; V889-I924 HydrophobicContact CG2-CG2 4.33Å; E920-I924 WeakPolarHBondContact O-CD1 3.39Å; E920-I924 WeakPolarHBondContact O-CG1 3.33Å; E920-I924 PolarHBondContact O-N 3.03Å; I924-T926 VanDerWaalsContact C-N 3.26Å; I924-T926 PolarHBondContact O-N 2.71Å; I924-H927 PolarHBondContact O-N 2.89Å; I924-F928 PolarHBondContact O-N 3.02Å; I924-F953 HydrophobicContact CD1-CB 3.94Å; I924-F953 HydrophobicContact CG1-CB 4.43Å; I924-F953 HydrophobicContact CG1-CD1 4.39Å; I924-F953 HydrophobicContact CG2-CB 4.03Å; I924-F953 HydrophobicContact CG2-CD1 3.64Å; I924-F953 HydrophobicContact CG2-CE1 4.23Å; I924-F953 HydrophobicContact CG2-CG 3.92Å
925	T	76.5	Confident	74.6	Confident	58 Å²	58	70.7 Å²	70.7	36%	0.356	35%	0.35	S	S	.	.	H	α-helix	trans	-76.6	-7.2	-178.5	59	0	0	0	0	114.3	A921 L922 E923 K940	A921-T925 WeakPolarHBondContact O-CB 3.46Å; A921-T925 WeakPolarHBondContact O-CG2 3.39Å; A921-T925 PolarHBondContact O-N 3.01Å; A921-T925 PolarHBondContact O-OG1 3.36Å; L922-T925 PolarHBondContact O-N 3.34Å; L922-T925 PolarHBondContact O-OG1 2.79Å; E923-T925 PolarHBondContact O-N 2.68Å; T925-K940 PolarHBondContact O-NZ 3.32Å
926	T	80.5	Confident	76.7	Confident	65 Å²	65	64.6 Å²	64.6	40%	0.399	32%	0.322	S	S	.	.	H	α-helix	trans	-83.8	-38.2	165.7	51.4	0	0	0	0	113.2	L922 E923 I924 K940	L922-T926 VanDerWaalsContact O-CG2 3.3Å; L922-T926 WeakPolarHBondContact O-CG2 3.49Å; L922-T926 PolarHBondContact O-N 3.41Å; L922-T926 PolarHBondContact O-OG1 2.77Å; L922-T926 VanDerWaalsContact O-OG1 3.14Å; E923-T926 WeakPolarHBondContact CA-OG1 3.33Å; E923-T926 PolarHBondContact O-N 3.01Å; E923-T926 VanDerWaalsContact O-N 3.15Å; E923-T926 PolarHBondContact O-OG1 2.75Å; I924-T926 VanDerWaalsContact C-N 3.26Å; I924-T926 PolarHBondContact O-N 2.71Å; T926-K940 WeakPolarHBondContact O-CD 3.27Å; T926-K940 WeakPolarHBondContact O-CG 3.4Å
927	H	85.2	Confident	78.7	Confident	22 Å²	22	58.3 Å²	58.3	10%	0.102	29%	0.289	C	S	.	.	H	α-helix	trans	-92.4	-29.2	-175.2	-60.2	95.2	0	0	0	114	E923 I924 L939 K940 R942 L943	E923-H927 PolarHBondContact O-N 2.91Å; E923-H927 PolarHBondContact O-ND1 2.71Å; I924-H927 PolarHBondContact O-N 2.89Å; H927-L939 WeakPolarHBondContact O-CA 3.35Å; H927-K940 PolarHBondContact O-N 3.27Å; H927-R942 PolarHBondContact CD2-O 2.91Å; H927-L943 HydrophobicContact CB-CD2 3.88Å
928	F	90.3	Very high	80.7	Confident	3 Å²	3	59.2 Å²	59.2	1%	0.013	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149.9	-175.7	-55.8	-76.8	0	0	0	113.3	V867 L887 I924 I937 H938 L939 L943 Y951 F953 I990	V867-F928 HydrophobicContact CG2-CD1 4.47Å; V867-F928 HydrophobicContact CG2-CE1 4.36Å; L887-F928 HydrophobicContact CD1-CB 4.19Å; I924-F928 PolarHBondContact O-N 3.02Å; F928-I937 HydrophobicContact CD1-CG2 4.35Å; F928-H938 WeakPolarHBondContact CA-O 3.27Å; F928-L939 HydrophobicContact CD1-CD2 3.97Å; F928-L939 HydrophobicContact CE1-CD2 3.55Å; F928-L939 HydrophobicContact CZ-CD2 4.33Å; F928-L943 HydrophobicContact CE1-CD1 4.29Å; F928-L943 HydrophobicContact CE1-CD2 4.49Å; F928-L943 HydrophobicContact CZ-CD1 3.98Å; F928-L943 HydrophobicContact CZ-CD2 3.95Å; F928-Y951 AromaticContact CE2-CD1 3.68Å; F928-Y951 HydrophobicContact CE2-CD1 3.68Å; F928-Y951 AromaticContact CE2-CD2 3.98Å; F928-Y951 HydrophobicContact CE2-CD2 3.98Å; F928-Y951 HydrophobicContact CE2-CE1 4.21Å; F928-Y951 AromaticContact CE2-CG 3.54Å; F928-Y951 HydrophobicContact CE2-CG 3.54Å; F928-Y951 HydrophobicContact CZ-CD1 4.4Å; F928-Y951 AromaticContact CZ-CD2 3.87Å; F928-Y951 HydrophobicContact CZ-CD2 3.87Å; F928-Y951 HydrophobicContact CZ-CE2 4.4Å; F928-Y951 AromaticContact CZ-CG 3.88Å; F928-Y951 HydrophobicContact CZ-CG 3.88Å; F928-F953 HydrophobicContact CB-CE1 4.33Å; F928-F953 HydrophobicContact CB-CZ 4.41Å; F928-F953 HydrophobicContact CD2-CD1 4.44Å; F928-F953 AromaticContact CD2-CE1 3.72Å; F928-F953 HydrophobicContact CD2-CE1 3.72Å; F928-F953 HydrophobicContact CE2-CE1 4.17Å; F928-F953 AromaticContact CG-CE1 3.91Å; F928-F953 HydrophobicContact CG-CE1 3.91Å; F928-F953 HydrophobicContact CG-CZ 4.3Å; F928-I990 HydrophobicContact CD1-CD1 3.68Å; F928-I990 HydrophobicContact CE1-CD1 3.34Å; F928-I990 HydrophobicContact CE1-CG2 4.27Å; F928-I990 HydrophobicContact CE2-CD1 4.36Å; F928-I990 HydrophobicContact CG-CD1 4.33Å; F928-I990 HydrophobicContact CZ-CB 4.5Å; F928-I990 HydrophobicContact CZ-CD1 3.73Å; F928-I990 HydrophobicContact CZ-CG2 4.3Å
929	Q	89.7	Confident	82.7	Confident	115 Å²	115	51.7 Å²	51.7	54%	0.537	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	138.7	169.4	176.6	175.1	-24.8	0	0	109.9	I937 H938	Q929-I937 WeakPolarHBondContact O-CA 3.47Å; Q929-H938 PolarHBondContact N-O 2.78Å; Q929-H938 PolarHBondContact O-N 2.95Å
930	I	91.5	Very high	83.8	Confident	15 Å²	15	52.2 Å²	52.2	8%	0.077	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	142.4	171.7	-162.8	166.1	0	0	0	111.3	V870 L887 L936 I937 V955	V870-I930 HydrophobicContact CG2-CD1 4.02Å; L887-I930 HydrophobicContact CD2-CB 4.04Å; L887-I930 HydrophobicContact CD2-CG2 4.12Å; L887-I930 HydrophobicContact CG-CB 4.26Å; L887-I930 HydrophobicContact CG-CG2 3.93Å; I930-L936 CarbonylContact C-O 3.56Å; I930-L936 WeakPolarHBondContact CA-O 3.32Å; I930-I937 HydrophobicContact CB-CG1 4.4Å; I930-I937 HydrophobicContact CD1-CG1 3.96Å; I930-I937 HydrophobicContact CG1-CG1 3.98Å; I930-V955 HydrophobicContact CD1-CG1 3.48Å; I930-V955 VanDerWaalsContact CD1-CG1 3.48Å; I930-V955 HydrophobicContact CD1-CG2 4.19Å
931	D	89.2	Confident	84.4	Confident	52 Å²	52	49.1 Å²	49.1	28%	0.278	25%	0.25	S	S	.	.			trans	-72.5	119.5	166.2	177.6	-19.2	0	0	0	109.6	R933 S934 G935 L936	D931-R933 PolarHBondContact O-N 3.17Å; D931-R933 VanDerWaalsContact O-N 3.08Å; D931-R933 PolarHBondContact OD1-N 2.97Å; D931-S934 VanDerWaalsContact CB-OG 3.29Å; D931-S934 WeakPolarHBondContact CB-OG 3.47Å; D931-S934 PolarHBondContact OD1-N 2.78Å; D931-S934 WeakPolarHBondContact OD2-CB 3.44Å; D931-S934 PolarHBondContact OD2-OG 2.77Å; D931-G935 PolarHBondContact O-N 3.41Å; D931-G935 VanDerWaalsContact O-N 3.1Å; D931-L936 HydrophobicContact CB-CB 3.97Å; D931-L936 PolarHBondContact N-O 3.08Å
932	P	89.2	Confident	85.4	Confident	63 Å²	63	55.7 Å²	55.7	41%	0.409	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-1.3	-175.5	31.4	-37.2	0	0	0	114.8	S884 Y885	S884-P932 WeakPolarHBondContact CA-O 3.33Å; S884-P932 WeakPolarHBondContact CB-O 3.18Å; S884-P932 PolarHBondContact OG-O 3.08Å; Y885-P932 PolarHBondContact N-O 3.34Å; Y885-P932 VanDerWaalsContact N-O 3.09Å; Y885-P932 VanDerWaalsContact O-CA 3.31Å; Y885-P932 WeakPolarHBondContact O-CA 3.42Å
933	R	87.7	Confident	86.4	Confident	217 Å²	217	51.3 Å²	51.3	82%	0.819	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.4	-37.9	173.9	-66.4	-179.3	-178.7	160.1	0.6	113.7	D931	D931-R933 PolarHBondContact O-N 3.17Å; D931-R933 VanDerWaalsContact O-N 3.08Å; D931-R933 PolarHBondContact OD1-N 2.97Å
934	S	90.1	Very high	87	Confident	29 Å²	29	52.6 Å²	52.6	20%	0.203	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-6	-173.9	70.9	0	0	0	0	114.7	Q869 D931 L936	Q869-S934 WeakPolarHBondContact CG-O 3.33Å; Q869-S934 PolarHBondContact NE2-O 2.86Å; D931-S934 VanDerWaalsContact CB-OG 3.29Å; D931-S934 WeakPolarHBondContact CB-OG 3.47Å; D931-S934 PolarHBondContact OD1-N 2.78Å; D931-S934 WeakPolarHBondContact OD2-CB 3.44Å; D931-S934 PolarHBondContact OD2-OG 2.77Å; S934-L936 PolarHBondContact O-N 3.42Å; S934-L936 WeakPolarHBondContact OG-CB 3.21Å
935	G	89.8	Confident	87.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.259	C	S	.	.			trans	70.4	12	-177.2	0	0	0	0	0	113.5	Q869 V870 Y885 D931	Q869-G935 WeakPolarHBondContact CA-O 3.32Å; V870-G935 PolarHBondContact N-O 2.79Å; Y885-G935 VanDerWaalsContact CD2-N 3.31Å; D931-G935 PolarHBondContact O-N 3.41Å; D931-G935 VanDerWaalsContact O-N 3.1Å
936	L	93.1	Very high	88	Confident	30 Å²	30	53.7 Å²	53.7	16%	0.157	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	115.1	-170	-177.5	62.1	0	0	0	111.9	K866 Q869 I930 D931 S934 H938	K866-L936 HydrophobicContact CD-CD1 3.58Å; K866-L936 HydrophobicContact CG-CD1 3.76Å; K866-L936 VanDerWaalsContact NZ-CD1 3.27Å; Q869-L936 HydrophobicContact CB-CD1 4.06Å; Q869-L936 HydrophobicContact CG-CB 4.36Å; Q869-L936 HydrophobicContact CG-CD1 4.27Å; I930-L936 CarbonylContact C-O 3.56Å; I930-L936 WeakPolarHBondContact CA-O 3.32Å; D931-L936 HydrophobicContact CB-CB 3.97Å; D931-L936 PolarHBondContact N-O 3.08Å; S934-L936 PolarHBondContact O-N 3.42Å; S934-L936 WeakPolarHBondContact OG-CB 3.21Å; L936-H938 WeakPolarHBondContact CD2-CE1 3.25Å; L936-H938 WeakPolarHBondContact CG-CE1 2.93Å; L936-H938 PolarHBondContact O-ND1 2.8Å
937	I	92.2	Very high	88.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	127.6	-178.4	-56.2	174.8	0	0	0	109.7	F856 V867 G868 V870 F928 Q929 I930 F953 V955 V988	F856-I937 HydrophobicContact CE2-CD1 4.21Å; V867-I937 HydrophobicContact CB-CG2 4.19Å; V867-I937 PolarHBondContact N-O 3.14Å; G868-I937 PolarHBondContact N-O 3.4Å; G868-I937 PolarHBondContact O-N 2.76Å; V870-I937 HydrophobicContact CG1-CD1 4.34Å; F928-I937 HydrophobicContact CD1-CG2 4.35Å; Q929-I937 WeakPolarHBondContact O-CA 3.47Å; I930-I937 HydrophobicContact CB-CG1 4.4Å; I930-I937 HydrophobicContact CD1-CG1 3.96Å; I930-I937 HydrophobicContact CG1-CG1 3.98Å; I937-F953 HydrophobicContact CD1-CE2 4.23Å; I937-F953 HydrophobicContact CD1-CZ 4.34Å; I937-F953 HydrophobicContact CG2-CZ 4.48Å; I937-V955 HydrophobicContact CD1-CG2 4.41Å; I937-V988 HydrophobicContact CD1-CG1 4Å; I937-V988 HydrophobicContact CD1-CG2 4.21Å
938	H	90.3	Very high	88.3	Confident	64 Å²	64	59.3 Å²	59.3	30%	0.296	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	152.2	176.6	-59.6	88	0	0	0	111	V865 F928 Q929 L936	V865-H938 WeakPolarHBondContact O-CA 3.33Å; F928-H938 WeakPolarHBondContact CA-O 3.27Å; Q929-H938 PolarHBondContact N-O 2.78Å; Q929-H938 PolarHBondContact O-N 2.95Å; L936-H938 WeakPolarHBondContact CD2-CE1 3.25Å; L936-H938 WeakPolarHBondContact CG-CE1 2.93Å; L936-H938 PolarHBondContact O-ND1 2.8Å
939	L	89.9	Confident	88.1	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	143.5	160	-71.4	179.8	0	0	0	111	V858 L862 L864 V865 V867 H927 F928 L943	V858-L939 HydrophobicContact CG1-CD1 3.92Å; L862-L939 HydrophobicContact CB-CD1 4.27Å; L864-L939 WeakPolarHBondContact CA-O 3.46Å; V865-L939 HydrophobicContact CB-CD1 4.44Å; V865-L939 PolarHBondContact O-N 2.95Å; V867-L939 HydrophobicContact CG2-CD2 4.18Å; V867-L939 HydrophobicContact CG2-CG 3.91Å; H927-L939 WeakPolarHBondContact O-CA 3.35Å; F928-L939 HydrophobicContact CD1-CD2 3.97Å; F928-L939 HydrophobicContact CE1-CD2 3.55Å; F928-L939 HydrophobicContact CZ-CD2 4.33Å; L939-L943 HydrophobicContact CD2-CD1 3.94Å; L939-L943 HydrophobicContact CD2-CD2 3.86Å; L939-L943 HydrophobicContact CD2-CG 3.74Å
940	K	83.3	Confident	88	Confident	110 Å²	110	60.7 Å²	60.7	48%	0.478	28%	0.281	S	S	.	.	S	Bend	trans	-115.8	-11.9	176	175	177.5	162.4	-171.4	0	112.2	T925 T926 H927	T925-K940 PolarHBondContact O-NZ 3.32Å; T926-K940 WeakPolarHBondContact O-CD 3.27Å; T926-K940 WeakPolarHBondContact O-CG 3.4Å; H927-K940 PolarHBondContact O-N 3.27Å
941	G	77.4	Confident	87.8	Confident	19 Å²	19	60.1 Å²	60.1	20%	0.196	28%	0.278	C	S	.	.	S	Bend	trans	-165.4	174.3	171	0	0	0	0	0	109.3
942	R	82.7	Confident	87.6	Confident	162 Å²	162	63.3 Å²	63.3	61%	0.611	29%	0.291	S	S	*	.			trans	-69.3	145.6	-174.9	-57.4	-179.5	-175.5	-160.3	-6	112.8	G861 L862 D863 H927	G861-R942 WeakPolarHBondContact O-CD 3.44Å; G861-R942 WeakPolarHBondContact O-CG 3.4Å; L862-R942 WeakPolarHBondContact O-CA 3.29Å; D863-R942 HydrophobicContact CB-CG 4.11Å; D863-R942 IonicContact OD2-NE 3.65Å; H927-R942 PolarHBondContact CD2-O 2.91Å
943	L	88.6	Confident	87.5	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.026	27%	0.274	C	S	.	.			trans	-92.4	160.8	164.2	-51.8	-170.9	0	0	0	110.2	V858 G861 H927 F928 L939 Y951 V992	V858-L943 HydrophobicContact CB-CD1 4.46Å; V858-L943 HydrophobicContact CG1-CD1 4.35Å; G861-L943 PolarHBondContact N-O 3.42Å; G861-L943 VanDerWaalsContact N-O 3.08Å; H927-L943 HydrophobicContact CB-CD2 3.88Å; F928-L943 HydrophobicContact CE1-CD1 4.29Å; F928-L943 HydrophobicContact CE1-CD2 4.49Å; F928-L943 HydrophobicContact CZ-CD1 3.98Å; F928-L943 HydrophobicContact CZ-CD2 3.95Å; L939-L943 HydrophobicContact CD2-CD1 3.94Å; L939-L943 HydrophobicContact CD2-CD2 3.86Å; L939-L943 HydrophobicContact CD2-CG 3.74Å; L943-Y951 HydrophobicContact CD1-CD2 4.41Å; L943-Y951 HydrophobicContact CD1-CE2 4.12Å; L943-Y951 HydrophobicContact CD2-CE2 3.86Å; L943-Y951 HydrophobicContact CG-CE2 4.46Å; L943-V992 HydrophobicContact CB-CG1 4.04Å; L943-V992 HydrophobicContact CB-CG2 4.3Å; L943-V992 HydrophobicContact CD1-CG2 3.75Å
944	D	88.7	Confident	87.4	Confident	65 Å²	65	52.1 Å²	52.1	35%	0.348	25%	0.246	S	C	.	.			trans	-152.3	113.7	-172.2	148	3.8	0	0	0	104.5	R947 R948	D944-R947 HydrophobicContact CB-CB 4.4Å; D944-R947 WeakPolarHBondContact OD1-CB 3.29Å; D944-R947 PolarHBondContact OD1-N 3.3Å; D944-R947 VanDerWaalsContact OD2-CB 3.3Å; D944-R947 WeakPolarHBondContact OD2-CB 3.35Å; D944-R948 PolarHBondContact O-N 3.43Å
945	R	89.9	Confident	87.3	Confident	30 Å²	30	50.8 Å²	50.8	11%	0.113	24%	0.236	C	C	.	.	H	α-helix	trans	-83.1	-36.9	-166.7	-176.3	-138.4	60	110.5	-11.3	111.3	E860 R947 R948 A949 V992 D994 P1032	E860-R945 WeakPolarHBondContact OE2-CB 2.94Å; E860-R945 PolarHBondContact OE2-N 3.27Å; R945-R947 PolarHBondContact O-N 3.43Å; R945-R948 CarbonylContact O-C 3.57Å; R945-R948 PolarHBondContact O-N 2.99Å; R945-A949 HydrophobicContact CG-CB 3.87Å; R945-A949 PolarHBondContact O-N 3.05Å; R945-A949 VanDerWaalsContact O-N 3.11Å; R945-V992 HydrophobicContact CB-CB 4.24Å; R945-V992 HydrophobicContact CB-CG1 3.83Å; R945-V992 HydrophobicContact CG-CB 4.26Å; R945-V992 HydrophobicContact CG-CG1 4.34Å; R945-D994 WeakPolarHBondContact CD-OD1 3.27Å; R945-D994 IonicContact CZ-OD1 2.78Å; R945-D994 IonicContact NE-OD1 3.23Å; R945-D994 PolarHBondContact NE-OD1 3.09Å; R945-D994 IonicContact NH1-OD1 2.92Å; R945-D994 IonicContact NH2-OD1 3.81Å; R945-D994 PolarHBondContact NH2-OD1 3.43Å; R945-P1032 PolarHBondContact NH2-O 2.83Å
946	E	89.1	Confident	87.3	Confident	58 Å²	58	52.4 Å²	52.4	27%	0.271	24%	0.244	S	C	.	.	H	α-helix	trans	-58.5	-32.2	174.8	-65.2	59.6	-118.4	0	0	110.2	P1032	E946-P1032 HydrophobicContact CG-CB 3.93Å; E946-P1032 HydrophobicContact CG-CG 4.14Å
947	R	86.5	Confident	87.1	Confident	146 Å²	146	51 Å²	51	55%	0.551	24%	0.237	S	C	*	.	H	α-helix	trans	-82.3	-47.9	170.4	-178	176.2	160.1	-155.6	-11.6	113.9	E923 D944 R945	E923-R947 IonicContact OE1-CZ 3.84Å; E923-R947 IonicContact OE1-NE 3.98Å; E923-R947 IonicContact OE1-NH2 3.75Å; E923-R947 PolarHBondContact OE1-NH2 2.87Å; D944-R947 HydrophobicContact CB-CB 4.4Å; D944-R947 WeakPolarHBondContact OD1-CB 3.29Å; D944-R947 PolarHBondContact OD1-N 3.3Å; D944-R947 VanDerWaalsContact OD2-CB 3.3Å; D944-R947 WeakPolarHBondContact OD2-CB 3.35Å; R945-R947 PolarHBondContact O-N 3.43Å
948	R	85.1	Confident	86.9	Confident	58 Å²	58	51.7 Å²	51.7	22%	0.219	24%	0.241	C	C	.	.	H	α-helix	trans	-153.3	90	-178.5	-170.7	160.2	-173.3	157.2	12	113.6	E920 E923 D944 R945 H950 Y951 V992	E920-R948 IonicContact OE1-CZ 2.83Å; E920-R948 IonicContact OE1-NH1 2.69Å; E920-R948 PolarHBondContact OE1-NH1 3.39Å; E920-R948 IonicContact OE1-NH2 3.39Å; E920-R948 PolarHBondContact OE1-NH2 3.15Å; E923-R948 WeakPolarHBondContact OE2-CD 3.43Å; E923-R948 IonicContact OE2-CZ 2.94Å; E923-R948 IonicContact OE2-NE 2.7Å; E923-R948 IonicContact OE2-NH1 3.72Å; E923-R948 PolarHBondContact OE2-NH1 2.81Å; D944-R948 PolarHBondContact O-N 3.43Å; R945-R948 CarbonylContact O-C 3.57Å; R945-R948 PolarHBondContact O-N 2.99Å; R948-H950 VanDerWaalsContact CG-O 3.25Å; R948-H950 WeakPolarHBondContact CG-O 3.22Å; R948-H950 PolarHBondContact NE-O 2.93Å; R948-H950 PolarHBondContact O-N 2.63Å; R948-H950 VanDerWaalsContact O-N 3.11Å; R948-Y951 HydrophobicContact CB-CE1 4.5Å; R948-Y951 HydrophobicContact CB-CE2 4.27Å; R948-Y951 HydrophobicContact CG-CD1 4.42Å; R948-Y951 HydrophobicContact CG-CD2 4.5Å; R948-Y951 HydrophobicContact CG-CE1 4.05Å; R948-Y951 HydrophobicContact CG-CE2 4.09Å; R948-Y951 WeakPolarHBondContact O-CE2 3.35Å; R948-V992 WeakPolarHBondContact O-CG2 3.38Å
949	A	86.3	Confident	86.7	Confident	42 Å²	42	48.7 Å²	48.7	35%	0.347	23%	0.227	S	C	.	.	S	Bend	trans	-61.1	-15.1	180	0	0	0	0	0	116.8	R945 V992	R945-A949 HydrophobicContact CG-CB 3.87Å; R945-A949 PolarHBondContact O-N 3.05Å; R945-A949 VanDerWaalsContact O-N 3.11Å; A949-V992 PolarHBondContact O-N 2.87Å
950	H	87.4	Confident	86.1	Confident	106 Å²	106	49.7 Å²	49.7	49%	0.491	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	152.6	172.3	65.3	-83.4	0	0	0	113.3	R948 L989 I990	R948-H950 VanDerWaalsContact CG-O 3.25Å; R948-H950 WeakPolarHBondContact CG-O 3.22Å; R948-H950 PolarHBondContact NE-O 2.93Å; R948-H950 PolarHBondContact O-N 2.63Å; R948-H950 VanDerWaalsContact O-N 3.11Å; H950-L989 HydrophobicContact CB-CD1 4.26Å; H950-I990 CarbonylContact C-O 3.56Å; H950-I990 VanDerWaalsContact CA-O 3.27Å; H950-I990 WeakPolarHBondContact CA-O 3.25Å
951	Y	87.8	Confident	85.4	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129	174.3	-62.8	-97.8	0	0	0	109.3	E923 F928 L943 R948 I990 V992	E923-Y951 HydrophobicContact CG-CE1 4.38Å; F928-Y951 AromaticContact CE2-CD1 3.68Å; F928-Y951 HydrophobicContact CE2-CD1 3.68Å; F928-Y951 AromaticContact CE2-CD2 3.98Å; F928-Y951 HydrophobicContact CE2-CD2 3.98Å; F928-Y951 HydrophobicContact CE2-CE1 4.21Å; F928-Y951 AromaticContact CE2-CG 3.54Å; F928-Y951 HydrophobicContact CE2-CG 3.54Å; F928-Y951 HydrophobicContact CZ-CD1 4.4Å; F928-Y951 AromaticContact CZ-CD2 3.87Å; F928-Y951 HydrophobicContact CZ-CD2 3.87Å; F928-Y951 HydrophobicContact CZ-CE2 4.4Å; F928-Y951 AromaticContact CZ-CG 3.88Å; F928-Y951 HydrophobicContact CZ-CG 3.88Å; L943-Y951 HydrophobicContact CD1-CD2 4.41Å; L943-Y951 HydrophobicContact CD1-CE2 4.12Å; L943-Y951 HydrophobicContact CD2-CE2 3.86Å; L943-Y951 HydrophobicContact CG-CE2 4.46Å; R948-Y951 HydrophobicContact CB-CE1 4.5Å; R948-Y951 HydrophobicContact CB-CE2 4.27Å; R948-Y951 HydrophobicContact CG-CD1 4.42Å; R948-Y951 HydrophobicContact CG-CD2 4.5Å; R948-Y951 HydrophobicContact CG-CE1 4.05Å; R948-Y951 HydrophobicContact CG-CE2 4.09Å; R948-Y951 WeakPolarHBondContact O-CE2 3.35Å; Y951-I990 PolarHBondContact N-O 3.4Å; Y951-I990 PolarHBondContact O-N 3.41Å; Y951-V992 HydrophobicContact CD2-CG2 4.07Å; Y951-V992 HydrophobicContact CE2-CG2 3.86Å
952	E	85.4	Confident	84.8	Confident	119 Å²	119	53.2 Å²	53.2	56%	0.556	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.5	173.8	-173.6	-179.3	177.3	0	0	108.5	V988 L989	E952-V988 WeakPolarHBondContact CA-O 3.33Å; E952-L989 HydrophobicContact CB-CD1 4.34Å
953	F	85.6	Confident	83.4	Confident	9 Å²	9	47.1 Å²	47.1	4%	0.039	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	165.4	174.6	55	-105.3	0	0	0	112.1	L887 I924 F928 I937 V955 V988 I990	L887-F953 HydrophobicContact CD2-CD2 3.93Å; L887-F953 HydrophobicContact CD2-CE2 3.49Å; L887-F953 VanDerWaalsContact CD2-CE2 3.49Å; L887-F953 HydrophobicContact CD2-CZ 4.11Å; I924-F953 HydrophobicContact CD1-CB 3.94Å; I924-F953 HydrophobicContact CG1-CB 4.43Å; I924-F953 HydrophobicContact CG1-CD1 4.39Å; I924-F953 HydrophobicContact CG2-CB 4.03Å; I924-F953 HydrophobicContact CG2-CD1 3.64Å; I924-F953 HydrophobicContact CG2-CE1 4.23Å; I924-F953 HydrophobicContact CG2-CG 3.92Å; F928-F953 HydrophobicContact CB-CE1 4.33Å; F928-F953 HydrophobicContact CB-CZ 4.41Å; F928-F953 HydrophobicContact CD2-CD1 4.44Å; F928-F953 AromaticContact CD2-CE1 3.72Å; F928-F953 HydrophobicContact CD2-CE1 3.72Å; F928-F953 HydrophobicContact CE2-CE1 4.17Å; F928-F953 AromaticContact CG-CE1 3.91Å; F928-F953 HydrophobicContact CG-CE1 3.91Å; F928-F953 HydrophobicContact CG-CZ 4.3Å; I937-F953 HydrophobicContact CD1-CE2 4.23Å; I937-F953 HydrophobicContact CD1-CZ 4.34Å; I937-F953 HydrophobicContact CG2-CZ 4.48Å; F953-V955 HydrophobicContact CD2-CG2 4.13Å; F953-V955 HydrophobicContact CE2-CG2 3.88Å; F953-V988 HydrophobicContact CD2-CB 4.06Å; F953-V988 HydrophobicContact CE2-CB 3.75Å; F953-V988 HydrophobicContact CE2-CG1 4.01Å; F953-V988 HydrophobicContact CE2-CG2 4.2Å; F953-V988 HydrophobicContact CZ-CB 4.29Å; F953-V988 HydrophobicContact CZ-CG1 4.09Å; F953-V988 PolarHBondContact N-O 3.4Å; F953-V988 PolarHBondContact O-N 2.84Å; F953-I990 HydrophobicContact CE1-CD1 3.63Å; F953-I990 HydrophobicContact CZ-CD1 3.7Å
954	V	85.5	Confident	81.1	Confident	37 Å²	37	53.3 Å²	53.3	22%	0.224	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	141	175.5	180	0	0	0	0	109.7	A888 T985 A986	A888-V954 CarbonylContact C-O 3.38Å; A888-V954 HydrophobicContact CB-CB 4.47Å; A888-V954 HydrophobicContact CB-CG1 4.45Å; A888-V954 PolarHBondContact N-O 3Å; A888-V954 CarbonylContact O-C 3.53Å; A888-V954 WeakPolarHBondContact O-CB 3.3Å; A888-V954 PolarHBondContact O-N 2.7Å; V954-T985 HydrophobicContact CG1-CG2 3.67Å; V954-A986 CarbonylContact C-O 3.54Å; V954-A986 WeakPolarHBondContact CA-O 3.48Å
955	V	88.6	Confident	78.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	130.9	164.7	-176.8	0	0	0	0	108.6	F849 V870 R886 L887 I930 I937 F953 T985 A986 V988	F849-V955 HydrophobicContact CE1-CG1 4.49Å; F849-V955 WeakPolarHBondContact CE2-O 3.41Å; F849-V955 HydrophobicContact CZ-CB 4.33Å; F849-V955 HydrophobicContact CZ-CG1 4.06Å; F849-V955 WeakPolarHBondContact CZ-O 3.45Å; V870-V955 HydrophobicContact CG2-CG1 3.95Å; R886-V955 WeakPolarHBondContact O-CA 3.34Å; R886-V955 WeakPolarHBondContact O-CG1 3.31Å; L887-V955 HydrophobicContact CD2-CG2 4.16Å; I930-V955 HydrophobicContact CD1-CG1 3.48Å; I930-V955 VanDerWaalsContact CD1-CG1 3.48Å; I930-V955 HydrophobicContact CD1-CG2 4.19Å; I937-V955 HydrophobicContact CD1-CG2 4.41Å; F953-V955 HydrophobicContact CD2-CG2 4.13Å; F953-V955 HydrophobicContact CE2-CG2 3.88Å; V955-T985 WeakPolarHBondContact O-CA 3.3Å; V955-A986 PolarHBondContact N-O 3.32Å; V955-A986 PolarHBondContact O-N 2.83Å; V955-V988 HydrophobicContact CB-CG2 4.4Å; V955-V988 HydrophobicContact CG2-CB 4.49Å; V955-V988 HydrophobicContact CG2-CG2 3.52Å
956	L	89.5	Confident	75.5	Confident	34 Å²	34	61 Å²	61	18%	0.178	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.1	177.8	-165.7	72.4	0	0	0	108.7	Y885 R886 A888 L958 T983 A984 T985	Y885-L956 CarbonylContact C-O 3.55Å; Y885-L956 WeakPolarHBondContact CA-O 3.37Å; R886-L956 PolarHBondContact N-O 2.91Å; R886-L956 PolarHBondContact O-N 2.82Å; A888-L956 HydrophobicContact CB-CB 3.89Å; L956-L958 HydrophobicContact CB-CD1 4.38Å; L956-L958 HydrophobicContact CD2-CD1 3.82Å; L956-L958 HydrophobicContact CD2-CD2 4.04Å; L956-L958 HydrophobicContact CD2-CG 3.85Å; L956-L958 HydrophobicContact CG-CD1 3.97Å; L956-L958 HydrophobicContact CG-CG 4.05Å; L956-T983 HydrophobicContact CD1-CG2 4.32Å; L956-T983 HydrophobicContact CD2-CG2 4.35Å; L956-T983 HydrophobicContact CG-CG2 4.38Å; L956-A984 CarbonylContact C-O 3.49Å; L956-A984 WeakPolarHBondContact CA-O 3.22Å; L956-T985 HydrophobicContact CD1-CG2 3.67Å
957	A	88.8	Confident	72.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.1	160.8	0	0	0	0	0	107.2	P847 F849 A872 I883 Y885 T983 A984	P847-A957 HydrophobicContact CB-CB 4.09Å; F849-A957 HydrophobicContact CD2-CB 4.38Å; F849-A957 HydrophobicContact CE1-CB 4.29Å; F849-A957 HydrophobicContact CE2-CB 3.62Å; F849-A957 HydrophobicContact CZ-CB 3.57Å; A872-A957 HydrophobicContact CB-CB 3.91Å; I883-A957 HydrophobicContact CG2-CB 3.88Å; Y885-A957 HydrophobicContact CD1-CB 4.33Å; Y885-A957 HydrophobicContact CE1-CB 4.36Å; A957-T983 CarbonylContact O-C 3.54Å; A957-T983 WeakPolarHBondContact O-CA 3.3Å; A957-A984 PolarHBondContact N-O 2.94Å; A957-A984 PolarHBondContact O-N 3.37Å
958	L	88.3	Confident	70.2	Confident	16 Å²	16	64.2 Å²	64.2	8%	0.084	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.8	173.3	-47.5	85.9	0	0	0	108.6	I883 S884 R886 L956 T983	I883-L958 CarbonylContact C-O 3.6Å; I883-L958 VanDerWaalsContact CA-O 3.27Å; I883-L958 WeakPolarHBondContact CA-O 3.18Å; S884-L958 PolarHBondContact N-O 2.88Å; S884-L958 VanDerWaalsContact O-CD1 3.32Å; S884-L958 WeakPolarHBondContact O-CD1 3.47Å; S884-L958 PolarHBondContact O-N 3Å; R886-L958 HydrophobicContact CB-CD1 4.27Å; R886-L958 HydrophobicContact CG-CD1 3.74Å; L956-L958 HydrophobicContact CB-CD1 4.38Å; L956-L958 HydrophobicContact CD2-CD1 3.82Å; L956-L958 HydrophobicContact CD2-CD2 4.04Å; L956-L958 HydrophobicContact CD2-CG 3.85Å; L956-L958 HydrophobicContact CG-CD1 3.97Å; L956-L958 HydrophobicContact CG-CG 4.05Å; L958-T983 HydrophobicContact CB-CG2 4.14Å; L958-T983 HydrophobicContact CD2-CG2 3.92Å; L958-T983 HydrophobicContact CG-CG2 3.74Å
959	D	86.4	Confident	67.5	Low	0 Å²	0	65.8 Å²	65.8	0%	0	36%	0.359	C	S	.	.	S	Bend	trans	-69.5	-177.8	165.7	71.1	38.1	0	0	0	111.1	N843 P847 D874 A880 P961 Q981 F982	N843-D959 PolarHBondContact ND2-OD1 2.92Å; N843-D959 PolarHBondContact ND2-OD2 2.86Å; N843-D959 PolarHBondContact OD1-OD2 2.84Å; P847-D959 HydrophobicContact CG-CB 3.96Å; D874-D959 WeakPolarHBondContact OD2-CB 3.37Å; A880-D959 WeakPolarHBondContact O-CB 3.4Å; D959-P961 WeakPolarHBondContact O-CD 3.35Å; D959-Q981 PolarHBondContact O-NE2 2.82Å; D959-Q981 WeakPolarHBondContact OD1-CA 3.4Å; D959-Q981 WeakPolarHBondContact OD1-CG 3.16Å; D959-F982 PolarHBondContact N-O 3.33Å; D959-F982 WeakPolarHBondContact OD2-CA 3.36Å; D959-F982 VanDerWaalsContact OD2-CB 3.28Å; D959-F982 WeakPolarHBondContact OD2-CB 3.35Å; D959-F982 PolarHBondContact OD2-N 2.89Å
960	N	77.5	Confident	64.8	Low	26 Å²	26	67.2 Å²	67.2	14%	0.139	38%	0.378	C	S	.	.			trans	35.7	50.8	163.7	-156.4	-13.7	0	0	0	117.4	E879 A880 R962 S963 V979 Q981	E879-N960 VanDerWaalsContact O-CA 3.25Å; E879-N960 WeakPolarHBondContact O-CA 3.45Å; A880-N960 PolarHBondContact O-N 3.49Å; N960-R962 PolarHBondContact O-N 2.89Å; N960-S963 PolarHBondContact O-N 3.46Å; N960-S963 VanDerWaalsContact O-N 3.12Å; N960-S963 PolarHBondContact O-OG 3.39Å; N960-V979 VanDerWaalsContact ND2-CG1 3.25Å; N960-V979 WeakPolarHBondContact ND2-CG1 3.47Å; N960-Q981 PolarHBondContact O-NE2 2.8Å
961	P	68	Low	62.1	Low	39 Å²	39	72.6 Å²	72.6	25%	0.253	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	18.3	-168.3	33.2	-41.5	0	0	0	114.5	R882 D959	R882-P961 WeakPolarHBondContact O-CD 3.37Å; R882-P961 WeakPolarHBondContact O-CG 3.49Å; D959-P961 WeakPolarHBondContact O-CD 3.35Å
962	R	65.2	Low	59.2	Low	164 Å²	164	81 Å²	81	62%	0.619	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	-2	171	-77	-168.9	-165.1	143.8	10.1	113.5	E879 R882 N960 I964	E879-R962 IonicContact OE1-CZ 3.31Å; E879-R962 IonicContact OE1-NH1 3.4Å; E879-R962 PolarHBondContact OE1-NH1 3.11Å; E879-R962 IonicContact OE1-NH2 2.79Å; E879-R962 PolarHBondContact OE1-NH2 2.78Å; E879-R962 WeakPolarHBondContact OE2-CD 3.35Å; E879-R962 IonicContact OE2-CZ 3.42Å; E879-R962 IonicContact OE2-NE 2.7Å; E879-R962 IonicContact OE2-NH1 2.56Å; E879-R962 PolarHBondContact OE2-NH1 3.1Å; R882-R962 VanDerWaalsContact NH1-CZ 3.26Å; R882-R962 VanDerWaalsContact NH1-NH2 3.19Å; N960-R962 PolarHBondContact O-N 2.89Å; R962-I964 PolarHBondContact O-N 2.84Å
963	S	54	Low	56.4	Low	33 Å²	33	84.6 Å²	84.6	23%	0.231	44%	0.443	C	S	.	.			trans	-62.6	100.2	168.6	54.2	0	0	0	0	110	N960 P965	N960-S963 PolarHBondContact O-N 3.46Å; N960-S963 VanDerWaalsContact O-N 3.12Å; N960-S963 PolarHBondContact O-OG 3.39Å; S963-P965 WeakPolarHBondContact O-CD 3.3Å
964	I	40.1	Very low	53.7	Low	135 Å²	135	92.8 Å²	92.8	69%	0.692	48%	0.481	S	S	*	.			trans	-95.4	114.6	176.3	-59.2	174.7	0	0	0	108.6	R962 T966	R962-I964 PolarHBondContact O-N 2.84Å; I964-T966 HydrophobicContact CG2-CG2 4.02Å; I964-T966 PolarHBondContact O-N 3.49Å
965	P	31.2	Very low	50.9	Low	126 Å²	126	97.7 Å²	97.7	82%	0.818	51%	0.512	S	S	*	.			trans	-70.7	91	173.8	-15.8	31.6	0	0	0	110.1	S963 K967	S963-P965 WeakPolarHBondContact O-CD 3.3Å; P965-K967 VanDerWaalsContact C-N 3.31Å; P965-K967 PolarHBondContact O-N 2.87Å
966	T	30.1	Very low	48	Very low	130 Å²	130	101.4 Å²	101.4	80%	0.798	53%	0.534	S	S	*	.			trans	-79.2	77.4	-179.6	36.7	0	0	0	0	111.3	I964	I964-T966 HydrophobicContact CG2-CG2 4.02Å; I964-T966 PolarHBondContact O-N 3.49Å
967	K	30.8	Very low	45.3	Very low	116 Å²	116	107.2 Å²	107.2	50%	0.504	57%	0.566	S	S	.	*			trans	-62.4	143.2	171.4	-160.5	175.1	-179.6	171.3	0	110.4	G902 N903 P965	G902-K967 VanDerWaalsContact O-CE 3.23Å; G902-K967 WeakPolarHBondContact O-CE 3.49Å; G902-K967 PolarHBondContact O-NZ 2.92Å; N903-K967 PolarHBondContact OD1-NZ 3.41Å; P965-K967 VanDerWaalsContact C-N 3.31Å; P965-K967 PolarHBondContact O-N 2.87Å
968	I	31.8	Very low	43.2	Very low	156 Å²	156	113.8 Å²	113.8	80%	0.8	60%	0.596	S	S	*	*			trans	103.1	122	166.6	-56.2	167.8	0	0	0	117.5
969	A	30.2	Very low	41.6	Very low	91 Å²	91	117.3 Å²	117.3	75%	0.752	62%	0.618	S	S	*	*			trans	72.5	73.7	153.4	0	0	0	0	0	121.2
970	G	29.1	Very low	40.5	Very low	72 Å²	72	121.7 Å²	121.7	74%	0.742	64%	0.641	S	S	*	*				61.4	101	115.6	0	0	0	0	0	120.6
971	Y	30.5	Very low	40.3	Very low	219 Å²	219	124 Å²	124	86%	0.859	65%	0.651	S	S	*	*				-155.8	164.4	113.3	-119.4	-90.9	0	0	0	108.6	R973	Y971-R973 PolarHBondContact O-N 2.7Å
972	Q	25.6	Very low	40.9	Very low	179 Å²	179	125.5 Å²	125.5	84%	0.836	65%	0.653	S	S	*	*			trans	-53	130.5	-166.9	-67.5	153.7	-53.8	0	0	114.2
973	R	28.1	Very low	41.9	Very low	195 Å²	195	121 Å²	121	74%	0.736	65%	0.645	S	S	*	*			trans	-140.2	125.6	165.3	-78.4	-175.6	167.5	-156.8	-1.6	109.2	Y971 T976	Y971-R973 PolarHBondContact O-N 2.7Å; R973-T976 HydrophobicContact CB-CG2 4.42Å; R973-T976 HydrophobicContact CG-CG2 4.5Å; R973-T976 PolarHBondContact NH1-OG1 2.88Å
974	Q	28.3	Very low	43.4	Very low	180 Å²	180	120.5 Å²	120.5	84%	0.841	64%	0.642	S	S	*	*	S	Bend	trans	-85.3	126.1	164.5	-75.9	159.2	-66.8	0	0	108.1
975	T	27.2	Very low	45.7	Very low	141 Å²	141	118.3 Å²	118.3	87%	0.865	64%	0.635	S	S	*	*			trans	41.2	75	167.6	57.3	0	0	0	0	116.3
976	T	27.8	Very low	48.3	Very low	77 Å²	77	112.4 Å²	112.4	47%	0.472	60%	0.597	S	S	.	*			trans	-110.6	113.5	166.2	60.7	0	0	0	0	111.4	R973 E978	R973-T976 HydrophobicContact CB-CG2 4.42Å; R973-T976 HydrophobicContact CG-CG2 4.5Å; R973-T976 PolarHBondContact NH1-OG1 2.88Å; T976-E978 PolarHBondContact O-N 2.81Å
977	N	31.8	Very low	51.1	Low	156 Å²	156	108.2 Å²	108.2	83%	0.834	57%	0.571	S	S	*	*			trans	2.2	102.4	172.9	-58.2	18.1	0	0	0	116.2	V979	N977-V979 PolarHBondContact O-N 3.32Å
978	E	46.2	Very low	53.9	Low	139 Å²	139	102.7 Å²	102.7	65%	0.65	55%	0.547	S	S	*	.			trans	-70.9	123.2	158.9	-61.9	-173	116.2	0	0	108.1	N900 T976 I980	N900-E978 WeakPolarHBondContact CB-OE1 3.35Å; N900-E978 PolarHBondContact ND2-OE1 3.46Å; N900-E978 PolarHBondContact ND2-OE2 2.8Å; T976-E978 PolarHBondContact O-N 2.81Å; E978-I980 PolarHBondContact O-N 2.89Å; E978-I980 VanDerWaalsContact O-N 3.17Å
979	V	53.8	Low	56.7	Low	89 Å²	89	98.4 Å²	98.4	54%	0.539	53%	0.525	S	S	.	.			trans	-82.5	99.7	-176.3	-175	0	0	0	0	108.5	N960 N977	N960-V979 VanDerWaalsContact ND2-CG1 3.25Å; N960-V979 WeakPolarHBondContact ND2-CG1 3.47Å; N977-V979 PolarHBondContact O-N 3.32Å
980	I	64	Low	59.5	Low	92 Å²	92	94 Å²	94	47%	0.472	49%	0.49	S	S	.	.			trans	-57.6	137.4	174.7	-59.8	176.2	0	0	0	109.1	N843 E978 F982	N843-I980 PolarHBondContact ND2-O 3.2Å; E978-I980 PolarHBondContact O-N 2.89Å; E978-I980 VanDerWaalsContact O-N 3.17Å; I980-F982 HydrophobicContact CG2-CD1 4.39Å; I980-F982 HydrophobicContact CG2-CD2 4.47Å; I980-F982 HydrophobicContact CG2-CE1 3.97Å; I980-F982 HydrophobicContact CG2-CE2 4.05Å; I980-F982 HydrophobicContact CG2-CZ 3.79Å
981	Q	72.6	Confident	62.5	Low	76 Å²	76	92.5 Å²	92.5	36%	0.355	47%	0.466	S	S	.	.			trans	-139	114.8	171.5	170.4	170	67.2	0	0	109	D959 N960	D959-Q981 PolarHBondContact O-NE2 2.82Å; D959-Q981 WeakPolarHBondContact OD1-CA 3.4Å; D959-Q981 WeakPolarHBondContact OD1-CG 3.16Å; N960-Q981 PolarHBondContact O-NE2 2.8Å
982	F	81.2	Confident	65.3	Low	69 Å²	69	82.4 Å²	82.4	30%	0.303	43%	0.427	S	S	.	.			trans	-87.2	163.1	169.5	-56.2	-62.9	0	0	0	112	N843 D844 P846 D959 I980	N843-F982 WeakPolarHBondContact OD1-CD2 3.18Å; N843-F982 WeakPolarHBondContact OD1-CE2 3.49Å; D844-F982 WeakPolarHBondContact O-CE2 3.18Å; P846-F982 HydrophobicContact CB-CB 3.59Å; P846-F982 HydrophobicContact CB-CD1 4.48Å; P846-F982 HydrophobicContact CB-CD2 3.98Å; P846-F982 HydrophobicContact CB-CG 3.79Å; D959-F982 PolarHBondContact N-O 3.33Å; D959-F982 WeakPolarHBondContact OD2-CA 3.36Å; D959-F982 VanDerWaalsContact OD2-CB 3.28Å; D959-F982 WeakPolarHBondContact OD2-CB 3.35Å; D959-F982 PolarHBondContact OD2-N 2.89Å; I980-F982 HydrophobicContact CG2-CD1 4.39Å; I980-F982 HydrophobicContact CG2-CD2 4.47Å; I980-F982 HydrophobicContact CG2-CE1 3.97Å; I980-F982 HydrophobicContact CG2-CE2 4.05Å; I980-F982 HydrophobicContact CG2-CZ 3.79Å
983	T	85.9	Confident	68.4	Low	71 Å²	71	76.9 Å²	76.9	44%	0.436	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	141.4	176.6	69.4	0	0	0	0	110.9	L956 A957 L958	L956-T983 HydrophobicContact CD1-CG2 4.32Å; L956-T983 HydrophobicContact CD2-CG2 4.35Å; L956-T983 HydrophobicContact CG-CG2 4.38Å; A957-T983 CarbonylContact O-C 3.54Å; A957-T983 WeakPolarHBondContact O-CA 3.3Å; L958-T983 HydrophobicContact CB-CG2 4.14Å; L958-T983 HydrophobicContact CD2-CG2 3.92Å; L958-T983 HydrophobicContact CG-CG2 3.74Å
984	A	84.5	Confident	71.2	Confident	22 Å²	22	69.4 Å²	69.4	18%	0.182	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	163.2	165.7	0	0	0	0	0	112.1	P847 F849 L956 A957	P847-A984 HydrophobicContact CB-CB 4.4Å; P847-A984 WeakPolarHBondContact O-CB 3.33Å; F849-A984 HydrophobicContact CD2-CB 4.3Å; F849-A984 WeakPolarHBondContact CE2-O 3.4Å; L956-A984 CarbonylContact C-O 3.49Å; L956-A984 WeakPolarHBondContact CA-O 3.22Å; A957-A984 PolarHBondContact N-O 2.94Å; A957-A984 PolarHBondContact O-N 3.37Å
985	T	88.8	Confident	73.9	Confident	89 Å²	89	65.9 Å²	65.9	55%	0.546	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.4	-172.7	51.2	0	0	0	0	111.1	V954 V955 L956	V954-T985 HydrophobicContact CG1-CG2 3.67Å; V955-T985 WeakPolarHBondContact O-CA 3.3Å; L956-T985 HydrophobicContact CD1-CG2 3.67Å
986	A	86.2	Confident	76.8	Confident	2 Å²	2	60.2 Å²	60.2	2%	0.017	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	147.5	165.6	0	0	0	0	0	110.2	F849 A852 Y854 V954 V955	F849-A986 HydrophobicContact CB-CB 3.98Å; F849-A986 HydrophobicContact CD1-CB 3.9Å; F849-A986 HydrophobicContact CD2-CB 3.58Å; F849-A986 HydrophobicContact CE1-CB 4.26Å; F849-A986 HydrophobicContact CE2-CB 3.94Å; F849-A986 HydrophobicContact CG-CB 3.55Å; F849-A986 HydrophobicContact CZ-CB 4.27Å; A852-A986 CarbonylContact O-C 3.54Å; A852-A986 VanDerWaalsContact O-CA 3.3Å; A852-A986 WeakPolarHBondContact O-CA 3.3Å; A852-A986 WeakPolarHBondContact O-CB 3.27Å; Y854-A986 HydrophobicContact CD2-CB 4.12Å; Y854-A986 HydrophobicContact CE2-CB 3.96Å; V954-A986 CarbonylContact C-O 3.54Å; V954-A986 WeakPolarHBondContact CA-O 3.48Å; V955-A986 PolarHBondContact N-O 3.32Å; V955-A986 PolarHBondContact O-N 2.83Å
987	T	88.7	Confident	79.7	Confident	42 Å²	42	61.7 Å²	61.7	26%	0.258	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	146.4	172.2	64.1	0	0	0	0	110.2	A852 N853 Y854	A852-T987 PolarHBondContact O-N 3.4Å; N853-T987 CarbonylContact C-O 3.57Å; N853-T987 WeakPolarHBondContact CA-O 3.34Å; N853-T987 WeakPolarHBondContact CA-OG1 3.36Å; N853-T987 WeakPolarHBondContact CB-OG1 3.33Å; N853-T987 VanDerWaalsContact CG-OG1 3.3Å; N853-T987 PolarHBondContact OD1-OG1 3.21Å; Y854-T987 PolarHBondContact N-O 2.9Å
988	V	89.5	Confident	82.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	119.8	173.4	-179.7	0	0	0	0	108.3	Y854 F856 V870 I937 E952 F953 V955 I990	Y854-V988 WeakPolarHBondContact O-CA 3.33Å; F856-V988 HydrophobicContact CD2-CG1 3.74Å; F856-V988 HydrophobicContact CE2-CG1 3.78Å; V870-V988 HydrophobicContact CG1-CG2 3.95Å; I937-V988 HydrophobicContact CD1-CG1 4Å; I937-V988 HydrophobicContact CD1-CG2 4.21Å; E952-V988 WeakPolarHBondContact CA-O 3.33Å; F953-V988 HydrophobicContact CD2-CB 4.06Å; F953-V988 HydrophobicContact CE2-CB 3.75Å; F953-V988 HydrophobicContact CE2-CG1 4.01Å; F953-V988 HydrophobicContact CE2-CG2 4.2Å; F953-V988 HydrophobicContact CZ-CB 4.29Å; F953-V988 HydrophobicContact CZ-CG1 4.09Å; F953-V988 PolarHBondContact N-O 3.4Å; F953-V988 PolarHBondContact O-N 2.84Å; V955-V988 HydrophobicContact CB-CG2 4.4Å; V955-V988 HydrophobicContact CG2-CB 4.49Å; V955-V988 HydrophobicContact CG2-CG2 3.52Å; V988-I990 HydrophobicContact CG1-CD1 4.38Å; V988-I990 HydrophobicContact CG1-CG1 4.04Å
989	L	90.2	Very high	84.4	Confident	65 Å²	65	52.4 Å²	52.4	34%	0.34	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.6	172.1	178.7	64.3	0	0	0	109.3	Y854 H855 F856 H950 E952	Y854-L989 PolarHBondContact O-N 3.37Å; H855-L989 WeakPolarHBondContact CA-O 3.39Å; F856-L989 PolarHBondContact N-O 2.76Å; H950-L989 HydrophobicContact CB-CD1 4.26Å; E952-L989 HydrophobicContact CB-CD1 4.34Å
990	I	89.9	Confident	86.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	113.9	175.5	-58.1	171.9	0	0	0	108.1	F856 V858 V867 F928 H950 Y951 F953 V988	F856-I990 WeakPolarHBondContact O-CA 3.36Å; V858-I990 HydrophobicContact CB-CG2 4.4Å; V858-I990 HydrophobicContact CG2-CG2 3.72Å; V867-I990 HydrophobicContact CG1-CD1 3.89Å; V867-I990 HydrophobicContact CG1-CG1 4.08Å; V867-I990 HydrophobicContact CG1-CG2 4.15Å; F928-I990 HydrophobicContact CD1-CD1 3.68Å; F928-I990 HydrophobicContact CE1-CD1 3.34Å; F928-I990 HydrophobicContact CE1-CG2 4.27Å; F928-I990 HydrophobicContact CE2-CD1 4.36Å; F928-I990 HydrophobicContact CG-CD1 4.33Å; F928-I990 HydrophobicContact CZ-CB 4.5Å; F928-I990 HydrophobicContact CZ-CD1 3.73Å; F928-I990 HydrophobicContact CZ-CG2 4.3Å; H950-I990 CarbonylContact C-O 3.56Å; H950-I990 VanDerWaalsContact CA-O 3.27Å; H950-I990 WeakPolarHBondContact CA-O 3.25Å; Y951-I990 PolarHBondContact N-O 3.4Å; Y951-I990 PolarHBondContact O-N 3.41Å; F953-I990 HydrophobicContact CE1-CD1 3.63Å; F953-I990 HydrophobicContact CZ-CD1 3.7Å; V988-I990 HydrophobicContact CG1-CD1 4.38Å; V988-I990 HydrophobicContact CG1-CG1 4.04Å
991	T	90.9	Very high	87.5	Confident	39 Å²	39	51.2 Å²	51.2	24%	0.239	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.1	172.7	-54.1	0	0	0	0	109.6	H855 F856 E857 V858 L993	H855-T991 PolarHBondContact NE2-OG1 2.82Å; F856-T991 PolarHBondContact O-N 2.92Å; E857-T991 WeakPolarHBondContact CA-O 3.25Å; V858-T991 PolarHBondContact N-O 3.17Å; T991-L993 HydrophobicContact CG2-CD2 4.48Å
992	V	90.3	Very high	88.2	Confident	7 Å²	7	49.2 Å²	49.2	4%	0.042	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	127.8	171.9	-167.2	0	0	0	0	109.1	V858 E860 L943 R945 R948 A949 Y951	V858-V992 CarbonylContact O-C 3.58Å; V858-V992 WeakPolarHBondContact O-CA 3.35Å; E860-V992 HydrophobicContact CB-CG1 3.76Å; L943-V992 HydrophobicContact CB-CG1 4.04Å; L943-V992 HydrophobicContact CB-CG2 4.3Å; L943-V992 HydrophobicContact CD1-CG2 3.75Å; R945-V992 HydrophobicContact CB-CB 4.24Å; R945-V992 HydrophobicContact CB-CG1 3.83Å; R945-V992 HydrophobicContact CG-CB 4.26Å; R945-V992 HydrophobicContact CG-CG1 4.34Å; R948-V992 WeakPolarHBondContact O-CG2 3.38Å; A949-V992 PolarHBondContact O-N 2.87Å; Y951-V992 HydrophobicContact CD2-CG2 4.07Å; Y951-V992 HydrophobicContact CE2-CG2 3.86Å
993	L	89.6	Confident	88.5	Confident	64 Å²	64	50.2 Å²	50.2	34%	0.335	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	137.3	178.7	-54.3	178	0	0	0	110.6	E857 V858 E859 E860 T991	E857-L993 HydrophobicContact CB-CD1 4.19Å; E857-L993 HydrophobicContact CB-CD2 4.34Å; E857-L993 HydrophobicContact CB-CG 4.33Å; V858-L993 PolarHBondContact O-N 3.08Å; E859-L993 HydrophobicContact CG-CD1 4.33Å; E860-L993 PolarHBondContact N-O 3.09Å; T991-L993 HydrophobicContact CG2-CD2 4.48Å
994	D	87.6	Confident	88.5	Confident	38 Å²	38	49.5 Å²	49.5	20%	0.203	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-72.5	141.8	-173.6	-173.3	88.4	0	0	0	114	E860 R945 L1034 N1037	E860-D994 VanDerWaalsContact OE1-CA 3.28Å; E860-D994 WeakPolarHBondContact OE1-CA 3.48Å; R945-D994 WeakPolarHBondContact CD-OD1 3.27Å; R945-D994 IonicContact CZ-OD1 2.78Å; R945-D994 IonicContact NE-OD1 3.23Å; R945-D994 PolarHBondContact NE-OD1 3.09Å; R945-D994 IonicContact NH1-OD1 2.92Å; R945-D994 IonicContact NH2-OD1 3.81Å; R945-D994 PolarHBondContact NH2-OD1 3.43Å; D994-L1034 HydrophobicContact CB-CB 3.93Å; D994-L1034 WeakPolarHBondContact OD1-CA 3.49Å; D994-L1034 WeakPolarHBondContact OD1-CB 3.43Å; D994-L1034 PolarHBondContact OD1-N 3.33Å; D994-L1034 PolarHBondContact OD2-N 2.88Å; D994-N1037 PolarHBondContact OD2-ND2 2.83Å
995	H	85.7	Confident	88.6	Confident	106 Å²	106	49 Å²	49	49%	0.491	26%	0.264	S	S	.	.			trans	-130.1	148.1	173.7	-139.7	89.3	0	0	0	110.6	E860 D997	E860-H995 HydrophobicContact CG-CB 3.98Å; E860-H995 PolarHBondContact OE1-N 3.34Å; H995-D997 PolarHBondContact O-N 3.02Å
996	N	88.6	Confident	88.4	Confident	21 Å²	21	50.9 Å²	50.9	11%	0.112	27%	0.27	C	S	.	.			trans	-78.2	90.3	177.1	-155.6	58.9	0	0	0	109.6	N1037 D1125 D1130	N996-N1037 HydrophobicContact CB-CB 4.18Å; N996-N1037 PolarHBondContact N-ND2 3.1Å; N996-N1037 WeakPolarHBondContact OD1-CA 3.45Å; N996-N1037 WeakPolarHBondContact OD1-CB 3.45Å; N996-D1125 PolarHBondContact ND2-OD2 3.28Å; N996-D1125 PolarHBondContact OD1-OD2 3.21Å; N996-D1130 PolarHBondContact ND2-O 2.84Å
997	D	88	Confident	88.3	Confident	108 Å²	108	54.7 Å²	54.7	58%	0.578	29%	0.29	S	S	*	.			trans	-119.5	-28.3	-167	159.5	-77.7	0	0	0	111.6	H995 D1033	H995-D997 PolarHBondContact O-N 3.02Å; D997-D1033 PolarHBondContact N-OD2 2.83Å
998	N	87.8	Confident	88	Confident	54 Å²	54	58.7 Å²	58.7	29%	0.289	31%	0.305	S	S	.	.	S	Bend	trans	-104.6	145.8	178.5	-64.5	-88.2	0	0	0	112.7	P1032 D1033 L1132	N998-P1032 HydrophobicContact CB-CG 3.43Å; N998-P1032 VanDerWaalsContact CB-CG 3.43Å; N998-P1032 VanDerWaalsContact CG-CG 3.49Å; N998-D1033 VanDerWaalsContact CB-OD1 3.28Å; N998-D1033 WeakPolarHBondContact CB-OD1 3.39Å; N998-D1033 PolarHBondContact N-OD2 3.3Å; N998-D1033 PolarHBondContact ND2-OD1 2.89Å; N998-L1132 VanDerWaalsContact O-CD1 3.22Å; N998-L1132 WeakPolarHBondContact O-CD1 3.3Å
999	A	88.6	Confident	87.8	Confident	47 Å²	47	61 Å²	61	39%	0.388	32%	0.319	S	S	.	.			trans	-103.3	144.5	-178.2	0	0	0	0	0	112.6	R1001 L1132	A999-R1001 PolarHBondContact O-N 3.04Å; A999-L1132 HydrophobicContact CB-CB 3.86Å
1000	P	91.7	Very high	87.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.323	C	S	.	.			trans	-56.1	109.4	-175.3	-32.4	36	0	0	0	114.1	I1002 D1031 I1040 A1123 D1125 L1132 T1134	P1000-I1002 PolarHBondContact O-N 2.84Å; P1000-D1031 WeakPolarHBondContact CA-OD2 3.3Å; P1000-D1031 WeakPolarHBondContact CD-OD2 3.28Å; P1000-D1031 WeakPolarHBondContact CG-OD2 3.21Å; P1000-I1040 HydrophobicContact CB-CD1 4.14Å; P1000-I1040 HydrophobicContact CB-CG1 4.13Å; P1000-I1040 HydrophobicContact CB-CG2 3.93Å; P1000-I1040 HydrophobicContact CG-CG1 4.3Å; P1000-I1040 HydrophobicContact CG-CG2 4.31Å; P1000-A1123 HydrophobicContact CB-CB 4.48Å; P1000-D1125 HydrophobicContact CG-CB 4.02Å; P1000-L1132 WeakPolarHBondContact CD-O 3.46Å; P1000-T1134 WeakPolarHBondContact O-CB 3.26Å; P1000-T1134 PolarHBondContact O-OG1 2.7Å
1001	R	90.3	Very high	87.4	Confident	156 Å²	156	64.6 Å²	64.6	59%	0.589	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	109	-175.6	-175.3	-173.9	61.4	-135.3	-12.7	111.4	A999 L1003 A1029 T1030	A999-R1001 PolarHBondContact O-N 3.04Å; R1001-L1003 PolarHBondContact O-N 3.2Å; R1001-A1029 CarbonylContact O-C 3.58Å; R1001-A1029 VanDerWaalsContact O-CA 3.26Å; R1001-A1029 WeakPolarHBondContact O-CA 3.36Å; R1001-T1030 WeakPolarHBondContact CB-O 3.42Å; R1001-T1030 PolarHBondContact N-O 3.47Å; R1001-T1030 PolarHBondContact NH2-OG1 2.81Å; R1001-T1030 PolarHBondContact O-N 2.89Å
1002	I	88.7	Confident	87	Confident	34 Å²	34	68 Å²	68	17%	0.174	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.8	175.7	-57	178.4	0	0	0	110.5	P1000 I1027 A1029 A1123 T1134 L1136	P1000-I1002 PolarHBondContact O-N 2.84Å; I1002-I1027 HydrophobicContact CG2-CG2 3.96Å; I1002-A1029 HydrophobicContact CG1-CB 4.12Å; I1002-A1123 HydrophobicContact CD1-CB 3.87Å; I1002-A1123 HydrophobicContact CG1-CB 3.98Å; I1002-T1134 HydrophobicContact CD1-CG2 3.83Å; I1002-T1134 HydrophobicContact CG1-CG2 3.95Å; I1002-L1136 HydrophobicContact CD1-CB 3.73Å; I1002-L1136 HydrophobicContact CD1-CD2 4.4Å; I1002-L1136 HydrophobicContact CG2-CD1 4.4Å; I1002-L1136 HydrophobicContact CG2-CD2 4.2Å
1003	L	88.1	Confident	86.7	Confident	89 Å²	89	67.9 Å²	67.9	47%	0.466	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-32.5	-178.5	-58.5	-175.2	0	0	0	113.3	R1001 R1028 T1030	R1001-L1003 PolarHBondContact O-N 3.2Å; L1003-R1028 PolarHBondContact N-O 3.38Å; L1003-T1030 HydrophobicContact CD1-CG2 3.59Å; L1003-T1030 HydrophobicContact CG-CG2 4.3Å
1004	S	85.9	Confident	86.2	Confident	57 Å²	57	66.3 Å²	66.3	40%	0.399	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	147.6	-176.8	-179.9	0	0	0	0	111	I1027 R1028	S1004-I1027 CarbonylContact O-C 3.54Å; S1004-I1027 VanDerWaalsContact O-CA 3.3Å; S1004-I1027 WeakPolarHBondContact O-CA 3.33Å; S1004-R1028 PolarHBondContact N-O 2.89Å; S1004-R1028 PolarHBondContact O-N 2.89Å
1005	P	85.1	Confident	85.6	Confident	12 Å²	12	68.9 Å²	68.9	8%	0.078	36%	0.36	C	S	.	.	S	Bend	cis	-64.8	166	-15.4	32	-37	0	0	0	111.1	V1009 F1011 F1025 L1136 I1138	P1005-V1009 HydrophobicContact CB-CB 4.5Å; P1005-F1011 HydrophobicContact CB-CE2 4.34Å; P1005-F1011 HydrophobicContact CB-CZ 3.95Å; P1005-F1011 HydrophobicContact CG-CE2 4.3Å; P1005-F1011 HydrophobicContact CG-CZ 4.18Å; P1005-F1025 HydrophobicContact CG-CD2 4.04Å; P1005-F1025 HydrophobicContact CG-CG 4.34Å; P1005-L1136 HydrophobicContact CG-CD2 4.29Å; P1005-I1138 HydrophobicContact CG-CD1 3.57Å; P1005-I1138 HydrophobicContact CG-CG1 4.42Å
1006	L	84.8	Confident	85.3	Confident	128 Å²	128	69.2 Å²	69.2	67%	0.67	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-68.4	155.1	175.4	-67.1	172.6	0	0	0	111.1	V1009	L1006-V1009 HydrophobicContact CB-CG2 3.78Å; L1006-V1009 WeakPolarHBondContact O-CB 3.44Å; L1006-V1009 WeakPolarHBondContact O-CG2 3.47Å; L1006-V1009 PolarHBondContact O-N 3.23Å
1007	N	84.3	Confident	85	Confident	81 Å²	81	71.1 Å²	71.1	43%	0.433	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	139.5	176.4	-164	19.5	0	0	0	111.1	V1009 L1136 V1137	N1007-V1009 VanDerWaalsContact C-N 3.3Å; N1007-V1009 PolarHBondContact O-N 3.29Å; N1007-L1136 HydrophobicContact CB-CD1 4.2Å; N1007-V1137 PolarHBondContact OD1-N 2.76Å; N1007-V1137 PolarHBondContact OD1-O 3.47Å
1008	H	82.6	Confident	84.6	Confident	127 Å²	127	66.8 Å²	66.8	59%	0.588	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	22.4	-173.4	-50.9	-71.7	0	0	0	116.3	V1137	H1008-V1137 VanDerWaalsContact CA-O 3.26Å; H1008-V1137 WeakPolarHBondContact CA-O 3.38Å; H1008-V1137 PolarHBondContact N-O 3.41Å
1009	V	84.7	Confident	84.4	Confident	47 Å²	47	69 Å²	69	29%	0.285	36%	0.362	S	S	.	.			trans	-64.9	147	167.5	167.9	0	0	0	0	111	P1005 L1006 N1007 F1011 R1139	P1005-V1009 HydrophobicContact CB-CB 4.5Å; L1006-V1009 HydrophobicContact CB-CG2 3.78Å; L1006-V1009 WeakPolarHBondContact O-CB 3.44Å; L1006-V1009 WeakPolarHBondContact O-CG2 3.47Å; L1006-V1009 PolarHBondContact O-N 3.23Å; N1007-V1009 VanDerWaalsContact C-N 3.3Å; N1007-V1009 PolarHBondContact O-N 3.29Å; V1009-F1011 HydrophobicContact CB-CE2 4.32Å; V1009-F1011 HydrophobicContact CG1-CD2 4.16Å; V1009-F1011 HydrophobicContact CG1-CE2 3.57Å; V1009-F1011 HydrophobicContact CG1-CZ 3.77Å; V1009-R1139 PolarHBondContact O-N 2.72Å
1010	E	84.8	Confident	84.1	Confident	91 Å²	91	68.9 Å²	68.9	43%	0.425	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.7	174	-177.8	165.6	154.7	0	0	112.1	R1139 A1141	E1010-R1139 CarbonylContact C-O 3.54Å; E1010-R1139 VanDerWaalsContact CA-O 3.29Å; E1010-R1139 WeakPolarHBondContact CA-O 3.47Å; E1010-R1139 HydrophobicContact CB-CB 4.14Å; E1010-R1139 HydrophobicContact CG-CB 4.12Å; E1010-R1139 HydrophobicContact CG-CG 4.25Å; E1010-R1139 IonicContact OE1-NH1 3.13Å; E1010-R1139 PolarHBondContact OE1-NH1 3.2Å; E1010-R1139 WeakPolarHBondContact OE2-CD 3.39Å; E1010-R1139 IonicContact OE2-CZ 2.6Å; E1010-R1139 IonicContact OE2-NH1 2.66Å; E1010-R1139 PolarHBondContact OE2-NH1 2.93Å; E1010-A1141 HydrophobicContact CG-CB 4.44Å; E1010-A1141 VanDerWaalsContact OE1-CB 3.31Å; E1010-A1141 WeakPolarHBondContact OE1-CB 3.36Å
1011	F	87	Confident	83.7	Confident	50 Å²	50	71.5 Å²	71.5	22%	0.219	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.1	171.2	-63.8	-91.3	0	0	0	109.8	P1005 V1009 I1024 F1025 I1138 R1139 V1140 A1141	P1005-F1011 HydrophobicContact CB-CE2 4.34Å; P1005-F1011 HydrophobicContact CB-CZ 3.95Å; P1005-F1011 HydrophobicContact CG-CE2 4.3Å; P1005-F1011 HydrophobicContact CG-CZ 4.18Å; V1009-F1011 HydrophobicContact CB-CE2 4.32Å; V1009-F1011 HydrophobicContact CG1-CD2 4.16Å; V1009-F1011 HydrophobicContact CG1-CE2 3.57Å; V1009-F1011 HydrophobicContact CG1-CZ 3.77Å; F1011-I1024 HydrophobicContact CB-CG2 3.81Å; F1011-I1024 HydrophobicContact CD1-CG2 4.49Å; F1011-I1024 HydrophobicContact CG-CG2 4.05Å; F1011-F1025 HydrophobicContact CD1-CB 4.46Å; F1011-F1025 AromaticContact CD2-CD1 3.69Å; F1011-F1025 HydrophobicContact CD2-CD1 3.69Å; F1011-F1025 HydrophobicContact CD2-CE1 4.26Å; F1011-F1025 HydrophobicContact CD2-CG 4.48Å; F1011-F1025 HydrophobicContact CE1-CB 3.75Å; F1011-F1025 HydrophobicContact CE1-CD1 4.41Å; F1011-F1025 HydrophobicContact CE1-CG 4.47Å; F1011-F1025 HydrophobicContact CE2-CB 4.03Å; F1011-F1025 AromaticContact CE2-CD1 3.51Å; F1011-F1025 HydrophobicContact CE2-CD1 3.51Å; F1011-F1025 HydrophobicContact CE2-CE1 4.24Å; F1011-F1025 AromaticContact CE2-CG 3.89Å; F1011-F1025 HydrophobicContact CE2-CG 3.89Å; F1011-F1025 HydrophobicContact CG-CD1 4.21Å; F1011-F1025 HydrophobicContact CZ-CB 3.5Å; F1011-F1025 AromaticContact CZ-CD1 3.92Å; F1011-F1025 HydrophobicContact CZ-CD1 3.92Å; F1011-F1025 AromaticContact CZ-CG 3.9Å; F1011-F1025 HydrophobicContact CZ-CG 3.9Å; F1011-I1138 HydrophobicContact CD2-CG2 3.48Å; F1011-I1138 VanDerWaalsContact CD2-CG2 3.48Å; F1011-I1138 HydrophobicContact CE2-CD1 4.47Å; F1011-I1138 HydrophobicContact CE2-CG2 3.64Å; F1011-R1139 PolarHBondContact N-O 3.08Å; F1011-V1140 CarbonylContact O-C 3.54Å; F1011-V1140 WeakPolarHBondContact O-CA 3.4Å; F1011-A1141 PolarHBondContact O-N 3Å
1012	M	82.5	Confident	83.5	Confident	110 Å²	110	66 Å²	66	54%	0.542	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.2	173.3	-71.2	175.5	60.2	0	0	110.3	A1141 Q1143	M1012-A1141 CarbonylContact C-O 3.56Å; M1012-A1141 WeakPolarHBondContact CA-O 3.37Å; M1012-Q1143 HydrophobicContact CE-CB 3.98Å; M1012-Q1143 HydrophobicContact CE-CG 3.73Å
1013	L	84.3	Confident	83.5	Confident	5 Å²	5	68.5 Å²	68.5	3%	0.026	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	118.9	169.5	-61.6	178.9	0	0	0	109.8	Q1017 L1018 I1024 L1102 L1106 V1140 A1141 Q1143	L1013-Q1017 HydrophobicContact CB-CB 4.35Å; L1013-Q1017 HydrophobicContact CD2-CB 4.18Å; L1013-L1018 HydrophobicContact CB-CD2 3.89Å; L1013-L1018 HydrophobicContact CD1-CD2 4.3Å; L1013-I1024 HydrophobicContact CD2-CG1 4.48Å; L1013-I1024 HydrophobicContact CD2-CG2 4.35Å; L1013-L1102 HydrophobicContact CD1-CD1 4.29Å; L1013-L1106 HydrophobicContact CD1-CD1 3.89Å; L1013-V1140 HydrophobicContact CD1-CG1 3.63Å; L1013-V1140 HydrophobicContact CD2-CG1 4.49Å; L1013-V1140 HydrophobicContact CG-CG1 3.78Å; L1013-A1141 PolarHBondContact N-O 3.17Å; L1013-Q1143 PolarHBondContact O-N 3.11Å
1014	S	78.2	Confident	83.5	Confident	31 Å²	31	65.2 Å²	65.2	22%	0.217	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-68.8	159.6	169.7	-46.7	0	0	0	0	110.6	D1016 Q1017	S1014-D1016 WeakPolarHBondContact CB-OD1 3.42Å; S1014-D1016 PolarHBondContact O-N 3.23Å; S1014-D1016 VanDerWaalsContact O-N 3.16Å; S1014-Q1017 VanDerWaalsContact CB-OE1 3.23Å; S1014-Q1017 WeakPolarHBondContact O-CA 3.41Å; S1014-Q1017 WeakPolarHBondContact O-CB 3.41Å; S1014-Q1017 PolarHBondContact O-N 3.43Å; S1014-Q1017 PolarHBondContact OG-OE1 2.91Å
1015	P	75.9	Confident	83.7	Confident	92 Å²	92	63.2 Å²	63.2	60%	0.597	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-59.5	-28.4	-176	-26.5	36.4	0	0	0	115.3
1016	D	80.1	Confident	83.9	Confident	114 Å²	114	66 Å²	66	61%	0.61	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-77.5	-19.8	173.4	56.9	-58.7	0	0	0	113.6	S1014 L1018	S1014-D1016 WeakPolarHBondContact CB-OD1 3.42Å; S1014-D1016 PolarHBondContact O-N 3.23Å; S1014-D1016 VanDerWaalsContact O-N 3.16Å; D1016-L1018 VanDerWaalsContact C-N 3.34Å
1017	Q	80.7	Confident	84.3	Confident	61 Å²	61	60 Å²	60	29%	0.285	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-88.8	2.4	-179.7	-67.8	-178.3	-58.9	0	0	113.6	L1013 S1014 I1019 N1022	L1013-Q1017 HydrophobicContact CB-CB 4.35Å; L1013-Q1017 HydrophobicContact CD2-CB 4.18Å; S1014-Q1017 VanDerWaalsContact CB-OE1 3.23Å; S1014-Q1017 WeakPolarHBondContact O-CA 3.41Å; S1014-Q1017 WeakPolarHBondContact O-CB 3.41Å; S1014-Q1017 PolarHBondContact O-N 3.43Å; S1014-Q1017 PolarHBondContact OG-OE1 2.91Å; Q1017-I1019 PolarHBondContact O-N 2.75Å; Q1017-N1022 WeakPolarHBondContact CB-ND2 3.46Å; Q1017-N1022 PolarHBondContact O-ND2 2.93Å
1018	L	81.6	Confident	84.6	Confident	16 Å²	16	64.6 Å²	64.6	8%	0.084	35%	0.351	C	S	.	.			trans	-81.4	18.9	-179.8	-58	-178.9	0	0	0	113.8	L1013 D1016 N1105 L1106 R1142	L1013-L1018 HydrophobicContact CB-CD2 3.89Å; L1013-L1018 HydrophobicContact CD1-CD2 4.3Å; D1016-L1018 VanDerWaalsContact C-N 3.34Å; L1018-N1105 CarbonylContact O-C 3.54Å; L1018-N1105 WeakPolarHBondContact O-CA 3.44Å; L1018-L1106 HydrophobicContact CB-CB 4.09Å; L1018-L1106 HydrophobicContact CD2-CB 4Å; L1018-L1106 HydrophobicContact CD2-CD1 4.07Å; L1018-L1106 HydrophobicContact CG-CB 4.49Å; L1018-L1106 PolarHBondContact O-N 3.45Å; L1018-R1142 HydrophobicContact CD2-CG 4.12Å
1019	I	82	Confident	85	Confident	101 Å²	101	59.4 Å²	59.4	52%	0.518	33%	0.329	S	S	.	.	S	Bend	trans	-105.4	137.4	-172.4	-54.2	175.9	0	0	0	110.7	Q1017 N1022 N1105	Q1017-I1019 PolarHBondContact O-N 2.75Å; I1019-N1022 WeakPolarHBondContact O-CB 3.37Å; I1019-N1022 PolarHBondContact O-N 3.11Å; I1019-N1105 WeakPolarHBondContact CA-OD1 3.26Å
1020	A	83.3	Confident	85.3	Confident	44 Å²	44	59.6 Å²	59.6	36%	0.364	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	140.6	175.7	0	0	0	0	0	112.2	N1022 R1103 N1105	A1020-N1022 VanDerWaalsContact C-N 3.32Å; A1020-R1103 WeakPolarHBondContact CB-O 3.35Å; A1020-N1105 WeakPolarHBondContact CB-OD1 3.45Å; A1020-N1105 PolarHBondContact N-OD1 3Å
1021	G	83	Confident	85.7	Confident	56 Å²	56	56.5 Å²	56.5	58%	0.577	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-9.6	-172.6	0	0	0	0	0	114.4	T1023 L1102	G1021-T1023 PolarHBondContact O-N 3.46Å; G1021-L1102 PolarHBondContact N-O 2.89Å
1022	N	86.4	Confident	85.9	Confident	41 Å²	41	57.2 Å²	57.2	22%	0.219	33%	0.327	C	S	.	.			trans	-68.8	127.5	176	-177.5	36.4	0	0	0	112.2	Q1017 I1019 A1020 Y1101 L1102	Q1017-N1022 WeakPolarHBondContact CB-ND2 3.46Å; Q1017-N1022 PolarHBondContact O-ND2 2.93Å; I1019-N1022 WeakPolarHBondContact O-CB 3.37Å; I1019-N1022 PolarHBondContact O-N 3.11Å; A1020-N1022 VanDerWaalsContact C-N 3.32Å; N1022-Y1101 CarbonylContact O-C 3.58Å; N1022-Y1101 VanDerWaalsContact O-CA 3.3Å; N1022-Y1101 WeakPolarHBondContact O-CA 3.41Å; N1022-Y1101 WeakPolarHBondContact O-CB 3.39Å; N1022-L1102 PolarHBondContact O-N 2.77Å
1023	T	88	Confident	86.3	Confident	85 Å²	85	52.5 Å²	52.5	52%	0.521	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	130.7	177.3	53.3	0	0	0	0	111.4	G1021 I1099	G1021-T1023 PolarHBondContact O-N 3.46Å; T1023-I1099 HydrophobicContact CG2-CG2 3.77Å
1024	I	87.7	Confident	86.5	Confident	20 Å²	20	57.3 Å²	57.3	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-46.8	-176.6	-45.1	178.8	0	0	0	110.5	F1011 L1013 F1091 C1100 L1102 V1140	F1011-I1024 HydrophobicContact CB-CG2 3.81Å; F1011-I1024 HydrophobicContact CD1-CG2 4.49Å; F1011-I1024 HydrophobicContact CG-CG2 4.05Å; L1013-I1024 HydrophobicContact CD2-CG1 4.48Å; L1013-I1024 HydrophobicContact CD2-CG2 4.35Å; I1024-F1091 HydrophobicContact CD1-CD1 3.48Å; I1024-F1091 VanDerWaalsContact CD1-CD1 3.48Å; I1024-F1091 HydrophobicContact CD1-CE1 3.53Å; I1024-C1100 PolarHBondContact N-O 2.81Å; I1024-L1102 HydrophobicContact CD1-CD1 4.45Å; I1024-V1140 HydrophobicContact CD1-CG1 4.34Å; I1024-V1140 HydrophobicContact CG2-CG1 4.39Å; I1024-V1140 HydrophobicContact CG2-CG2 4.14Å
1025	F	90	Very high	86.9	Confident	16 Å²	16	58.2 Å²	58.2	7%	0.07	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	169.7	176.5	54.6	-93.4	0	0	0	111.1	P1005 F1011 I1027 C1100 L1119 I1121 I1138	P1005-F1025 HydrophobicContact CG-CD2 4.04Å; P1005-F1025 HydrophobicContact CG-CG 4.34Å; F1011-F1025 HydrophobicContact CD1-CB 4.46Å; F1011-F1025 AromaticContact CD2-CD1 3.69Å; F1011-F1025 HydrophobicContact CD2-CD1 3.69Å; F1011-F1025 HydrophobicContact CD2-CE1 4.26Å; F1011-F1025 HydrophobicContact CD2-CG 4.48Å; F1011-F1025 HydrophobicContact CE1-CB 3.75Å; F1011-F1025 HydrophobicContact CE1-CD1 4.41Å; F1011-F1025 HydrophobicContact CE1-CG 4.47Å; F1011-F1025 HydrophobicContact CE2-CB 4.03Å; F1011-F1025 AromaticContact CE2-CD1 3.51Å; F1011-F1025 HydrophobicContact CE2-CD1 3.51Å; F1011-F1025 HydrophobicContact CE2-CE1 4.24Å; F1011-F1025 AromaticContact CE2-CG 3.89Å; F1011-F1025 HydrophobicContact CE2-CG 3.89Å; F1011-F1025 HydrophobicContact CG-CD1 4.21Å; F1011-F1025 HydrophobicContact CZ-CB 3.5Å; F1011-F1025 AromaticContact CZ-CD1 3.92Å; F1011-F1025 HydrophobicContact CZ-CD1 3.92Å; F1011-F1025 AromaticContact CZ-CG 3.9Å; F1011-F1025 HydrophobicContact CZ-CG 3.9Å; F1025-I1027 HydrophobicContact CD2-CG1 4.08Å; F1025-I1027 HydrophobicContact CE2-CD1 4.23Å; F1025-I1027 HydrophobicContact CE2-CG1 3.88Å; F1025-C1100 HydrophobicContact CD1-CB 4.26Å; F1025-C1100 HydrophobicContact CD2-CB 3.82Å; F1025-C1100 HydrophobicContact CE1-CB 3.8Å; F1025-C1100 HydrophobicContact CE2-CB 3.31Å; F1025-C1100 HydrophobicContact CG-CB 4.25Å; F1025-C1100 HydrophobicContact CZ-CB 3.29Å; F1025-C1100 VanDerWaalsContact CZ-SG 3.55Å; F1025-C1100 PolarHBondContact O-N 3.23Å; F1025-L1119 HydrophobicContact CE1-CD2 4.44Å; F1025-L1119 HydrophobicContact CZ-CD2 4.37Å; F1025-I1121 HydrophobicContact CE2-CD1 3.87Å; F1025-I1121 HydrophobicContact CZ-CD1 3.75Å; F1025-I1138 HydrophobicContact CD1-CD1 4.28Å; F1025-I1138 HydrophobicContact CD1-CG2 4.27Å; F1025-I1138 HydrophobicContact CD2-CD1 3.91Å; F1025-I1138 HydrophobicContact CE1-CB 4.39Å; F1025-I1138 HydrophobicContact CE1-CD1 3.79Å; F1025-I1138 HydrophobicContact CE1-CG2 3.69Å; F1025-I1138 HydrophobicContact CE2-CD1 3.33Å; F1025-I1138 HydrophobicContact CG-CD1 4.36Å; F1025-I1138 HydrophobicContact CZ-CB 4.37Å; F1025-I1138 HydrophobicContact CZ-CD1 3.27Å; F1025-I1138 HydrophobicContact CZ-CG1 4.41Å; F1025-I1138 HydrophobicContact CZ-CG2 4.16Å
1026	T	90.8	Very high	87.5	Confident	69 Å²	69	59 Å²	59	42%	0.423	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.8	171.7	-51	0	0	0	0	109.4	A1097 I1099	T1026-A1097 WeakPolarHBondContact CG2-O 3.32Å; T1026-I1099 HydrophobicContact CG2-CG1 3.85Å
1027	I	91.8	Very high	87.8	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	32%	0.315	C	S	.	.			trans	-80.9	139.2	175	-52.7	171.1	0	0	0	109	I1002 S1004 F1025 Y1042 V1093 G1098 I1121 L1136	I1002-I1027 HydrophobicContact CG2-CG2 3.96Å; S1004-I1027 CarbonylContact O-C 3.54Å; S1004-I1027 VanDerWaalsContact O-CA 3.3Å; S1004-I1027 WeakPolarHBondContact O-CA 3.33Å; F1025-I1027 HydrophobicContact CD2-CG1 4.08Å; F1025-I1027 HydrophobicContact CE2-CD1 4.23Å; F1025-I1027 HydrophobicContact CE2-CG1 3.88Å; I1027-Y1042 HydrophobicContact CB-CD1 4.17Å; I1027-Y1042 HydrophobicContact CB-CE1 3.93Å; I1027-Y1042 HydrophobicContact CD1-CD1 4.24Å; I1027-Y1042 HydrophobicContact CG2-CD1 3.94Å; I1027-Y1042 HydrophobicContact CG2-CE1 3.48Å; I1027-Y1042 VanDerWaalsContact CG2-CE1 3.48Å; I1027-V1093 HydrophobicContact CD1-CG2 4.31Å; I1027-G1098 WeakPolarHBondContact CG1-O 3.27Å; I1027-G1098 PolarHBondContact N-O 3.19Å; I1027-I1121 HydrophobicContact CD1-CB 4.2Å; I1027-I1121 HydrophobicContact CD1-CD1 3.86Å; I1027-I1121 HydrophobicContact CD1-CG2 3.57Å; I1027-L1136 HydrophobicContact CD1-CD2 3.86Å; I1027-L1136 HydrophobicContact CG1-CD2 3.83Å; I1027-L1136 HydrophobicContact CG2-CD2 4.04Å
1028	R	91.2	Very high	88.1	Confident	177 Å²	177	52.7 Å²	52.7	67%	0.668	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	128	167.7	-71.9	-178.1	166.7	-165.8	-6.2	108.9	L1003 S1004	L1003-R1028 PolarHBondContact N-O 3.38Å; S1004-R1028 PolarHBondContact N-O 2.89Å; S1004-R1028 PolarHBondContact O-N 2.89Å
1029	A	90.6	Very high	88.5	Confident	17 Å²	17	55 Å²	55	14%	0.14	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	164.8	170.2	0	0	0	0	0	110.7	R1001 I1002 I1040 Y1042	R1001-A1029 CarbonylContact O-C 3.58Å; R1001-A1029 VanDerWaalsContact O-CA 3.26Å; R1001-A1029 WeakPolarHBondContact O-CA 3.36Å; I1002-A1029 HydrophobicContact CG1-CB 4.12Å; A1029-I1040 HydrophobicContact CB-CD1 3.67Å; A1029-I1040 HydrophobicContact CB-CG2 4.25Å; A1029-Y1042 HydrophobicContact CB-CE1 4.22Å; A1029-Y1042 PolarHBondContact N-OH 3.2Å
1030	T	92.4	Very high	88.9	Confident	51 Å²	51	51.8 Å²	51.8	31%	0.313	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	139.8	175.1	52.3	0	0	0	0	109.9	R1001 L1003	R1001-T1030 WeakPolarHBondContact CB-O 3.42Å; R1001-T1030 PolarHBondContact N-O 3.47Å; R1001-T1030 PolarHBondContact NH2-OG1 2.81Å; R1001-T1030 PolarHBondContact O-N 2.89Å; L1003-T1030 HydrophobicContact CD1-CG2 3.59Å; L1003-T1030 HydrophobicContact CG-CG2 4.3Å
1031	D	92.8	Very high	89.4	Confident	26 Å²	26	50.8 Å²	50.8	14%	0.139	30%	0.298	C	S	.	.			trans	-130	139.4	177.6	-154.9	-73	0	0	0	108.7	P1000 D1033 I1040	P1000-D1031 WeakPolarHBondContact CA-OD2 3.3Å; P1000-D1031 WeakPolarHBondContact CD-OD2 3.28Å; P1000-D1031 WeakPolarHBondContact CG-OD2 3.21Å; D1031-D1033 PolarHBondContact OD1-N 2.83Å; D1031-I1040 HydrophobicContact CB-CD1 3.96Å; D1031-I1040 HydrophobicContact CB-CG1 3.98Å
1032	P	90.6	Very high	89.9	Confident	66 Å²	66	49.1 Å²	49.1	43%	0.429	27%	0.274	S	S	.	.			trans	-90.2	-14.9	-178.4	35.9	-35.4	0	0	0	115	R945 E946 N998	R945-P1032 PolarHBondContact NH2-O 2.83Å; E946-P1032 HydrophobicContact CG-CB 3.93Å; E946-P1032 HydrophobicContact CG-CG 4.14Å; N998-P1032 HydrophobicContact CB-CG 3.43Å; N998-P1032 VanDerWaalsContact CB-CG 3.43Å; N998-P1032 VanDerWaalsContact CG-CG 3.49Å
1033	D	91.2	Very high	90.1	Very high	10 Å²	10	52.7 Å²	52.7	5%	0.053	29%	0.288	C	S	.	.	S	Bend	trans	-73.4	167.9	-170.8	-63.1	3.6	0	0	0	111.7	D997 N998 D1031 N1037 G1038	D997-D1033 PolarHBondContact N-OD2 2.83Å; N998-D1033 VanDerWaalsContact CB-OD1 3.28Å; N998-D1033 WeakPolarHBondContact CB-OD1 3.39Å; N998-D1033 PolarHBondContact N-OD2 3.3Å; N998-D1033 PolarHBondContact ND2-OD1 2.89Å; D1031-D1033 PolarHBondContact OD1-N 2.83Å; D1033-N1037 HydrophobicContact CB-CB 3.6Å; D1033-G1038 WeakPolarHBondContact O-CA 3.45Å; D1033-G1038 PolarHBondContact O-N 2.75Å
1034	L	88.4	Confident	90.1	Very high	107 Å²	107	50.4 Å²	50.4	56%	0.56	27%	0.273	S	S	*	.			trans	-93.8	139.2	-170.6	-161.9	64.1	0	0	0	114	D994 E1036 N1037	D994-L1034 HydrophobicContact CB-CB 3.93Å; D994-L1034 WeakPolarHBondContact OD1-CA 3.49Å; D994-L1034 WeakPolarHBondContact OD1-CB 3.43Å; D994-L1034 PolarHBondContact OD1-N 3.33Å; D994-L1034 PolarHBondContact OD2-N 2.88Å; L1034-E1036 PolarHBondContact O-N 3.22Å; L1034-N1037 WeakPolarHBondContact O-CB 3.16Å; L1034-N1037 PolarHBondContact O-N 3.15Å
1035	G	86.7	Confident	90.1	Very high	49 Å²	49	53.2 Å²	53.2	51%	0.505	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	-121.1	168.3	0	0	0	0	0	113	N1037 T1039	G1035-N1037 VanDerWaalsContact C-N 3.28Å; G1035-N1037 PolarHBondContact O-N 3.14Å; G1035-T1039 PolarHBondContact O-N 2.94Å; G1035-T1039 PolarHBondContact O-OG1 3.45Å
1036	E	87.6	Confident	89.8	Confident	110 Å²	110	55.8 Å²	55.8	51%	0.514	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-33.6	177.6	-68.8	-166.8	121.4	0	0	112	L1034 T1039 L1126 G1127 K1128	L1034-E1036 PolarHBondContact O-N 3.22Å; E1036-T1039 PolarHBondContact O-N 3.32Å; E1036-L1126 HydrophobicContact CB-CB 4.26Å; E1036-L1126 CarbonylContact O-C 3.58Å; E1036-L1126 WeakPolarHBondContact O-CA 3.3Å; E1036-L1126 WeakPolarHBondContact O-CB 3.28Å; E1036-L1126 PolarHBondContact O-N 2.91Å; E1036-L1126 VanDerWaalsContact O-N 3.17Å; E1036-G1127 PolarHBondContact O-N 3.01Å; E1036-K1128 IonicContact OE1-NZ 3.86Å; E1036-K1128 PolarHBondContact OE1-NZ 3.25Å; E1036-K1128 IonicContact OE2-NZ 2.71Å; E1036-K1128 PolarHBondContact OE2-NZ 3.43Å
1037	N	87.4	Confident	89.4	Confident	21 Å²	21	52.9 Å²	52.9	11%	0.112	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-46.3	179	-65	-10.3	0	0	0	110.7	D994 N996 D1033 L1034 G1035 T1039 D1125 G1127	D994-N1037 PolarHBondContact OD2-ND2 2.83Å; N996-N1037 HydrophobicContact CB-CB 4.18Å; N996-N1037 PolarHBondContact N-ND2 3.1Å; N996-N1037 WeakPolarHBondContact OD1-CA 3.45Å; N996-N1037 WeakPolarHBondContact OD1-CB 3.45Å; D1033-N1037 HydrophobicContact CB-CB 3.6Å; L1034-N1037 WeakPolarHBondContact O-CB 3.16Å; L1034-N1037 PolarHBondContact O-N 3.15Å; G1035-N1037 VanDerWaalsContact C-N 3.28Å; G1035-N1037 PolarHBondContact O-N 3.14Å; N1037-T1039 VanDerWaalsContact C-N 3.3Å; N1037-T1039 PolarHBondContact O-N 3.15Å; N1037-D1125 WeakPolarHBondContact O-CB 3.28Å; N1037-G1127 WeakPolarHBondContact OD1-CA 3.39Å
1038	G	86.3	Confident	88.8	Confident	21 Å²	21	57 Å²	57	22%	0.216	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	3.3	174.3	0	0	0	0	0	117	D1033	D1033-G1038 WeakPolarHBondContact O-CA 3.45Å; D1033-G1038 PolarHBondContact O-N 2.75Å
1039	T	90.3	Very high	88	Confident	65 Å²	65	52.8 Å²	52.8	40%	0.399	29%	0.292	S	S	.	.			trans	-98.4	114.1	-171.1	-66.4	0	0	0	0	112.6	G1035 E1036 N1037 D1125 L1126	G1035-T1039 PolarHBondContact O-N 2.94Å; G1035-T1039 PolarHBondContact O-OG1 3.45Å; E1036-T1039 PolarHBondContact O-N 3.32Å; N1037-T1039 VanDerWaalsContact C-N 3.3Å; N1037-T1039 PolarHBondContact O-N 3.15Å; T1039-D1125 CarbonylContact O-C 3.6Å; T1039-D1125 WeakPolarHBondContact O-CA 3.34Å; T1039-L1126 HydrophobicContact CG2-CD1 3.63Å; T1039-L1126 HydrophobicContact CG2-CG 4.19Å; T1039-L1126 PolarHBondContact O-N 2.85Å
1040	I	91.2	Very high	86.6	Confident	32 Å²	32	55.6 Å²	55.6	16%	0.164	30%	0.304	C	S	.	.			trans	-98.4	134.4	-169.3	-44.3	170.1	0	0	0	113.3	P1000 A1029 D1031 Y1042 A1123 Y1124	P1000-I1040 HydrophobicContact CB-CD1 4.14Å; P1000-I1040 HydrophobicContact CB-CG1 4.13Å; P1000-I1040 HydrophobicContact CB-CG2 3.93Å; P1000-I1040 HydrophobicContact CG-CG1 4.3Å; P1000-I1040 HydrophobicContact CG-CG2 4.31Å; A1029-I1040 HydrophobicContact CB-CD1 3.67Å; A1029-I1040 HydrophobicContact CB-CG2 4.25Å; D1031-I1040 HydrophobicContact CB-CD1 3.96Å; D1031-I1040 HydrophobicContact CB-CG1 3.98Å; I1040-Y1042 HydrophobicContact CG2-CE1 4.39Å; I1040-A1123 HydrophobicContact CG2-CB 4.13Å; I1040-Y1124 CarbonylContact C-O 3.56Å; I1040-Y1124 WeakPolarHBondContact CA-O 3.3Å
1041	E	92.6	Very high	84.4	Confident	24 Å²	24	59.9 Å²	59.9	11%	0.112	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	163.3	166.4	-68.9	-165.4	135.2	0	0	112.9	R1095 A1123 Y1124 L1126	E1041-R1095 CarbonylContact C-O 3.56Å; E1041-R1095 VanDerWaalsContact CA-O 3.3Å; E1041-R1095 WeakPolarHBondContact CA-O 3.4Å; E1041-R1095 HydrophobicContact CB-CG 4.23Å; E1041-R1095 VanDerWaalsContact CD-NH2 3.32Å; E1041-R1095 HydrophobicContact CG-CG 4.35Å; E1041-R1095 IonicContact OE1-CZ 2.98Å; E1041-R1095 IonicContact OE1-NE 2.79Å; E1041-R1095 PolarHBondContact OE1-NE 2.78Å; E1041-R1095 IonicContact OE1-NH2 2.95Å; E1041-R1095 PolarHBondContact OE1-NH2 2.71Å; E1041-R1095 VanDerWaalsContact OE1-NH2 3.1Å; E1041-R1095 IonicContact OE2-CZ 2.62Å; E1041-R1095 IonicContact OE2-NE 3.96Å; E1041-R1095 PolarHBondContact OE2-NE 3.29Å; E1041-R1095 IonicContact OE2-NH2 3.79Å; E1041-R1095 PolarHBondContact OE2-NH2 3.19Å; E1041-A1123 WeakPolarHBondContact O-CA 3.16Å; E1041-Y1124 HydrophobicContact CB-CD2 4.47Å; E1041-Y1124 HydrophobicContact CB-CE1 3.92Å; E1041-Y1124 HydrophobicContact CB-CE2 3.81Å; E1041-Y1124 VanDerWaalsContact CB-CZ 3.49Å; E1041-Y1124 WeakPolarHBondContact CB-OH 3.45Å; E1041-Y1124 PolarHBondContact N-O 2.75Å; E1041-Y1124 PolarHBondContact O-N 2.81Å; E1041-Y1124 WeakPolarHBondContact OE2-CE2 3.5Å; E1041-Y1124 VanDerWaalsContact OE2-CZ 3.31Å; E1041-Y1124 PolarHBondContact OE2-OH 3.42Å; E1041-L1126 HydrophobicContact CG-CD2 4.08Å; E1041-L1126 HydrophobicContact CG-CG 4.46Å
1042	Y	93.2	Very high	81.6	Confident	20 Å²	20	61.8 Å²	61.8	8%	0.078	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.8	-176.6	-54.7	-84.2	0	0	0	113.2	I1027 A1029 I1040 R1095 G1098 L1122 A1123	I1027-Y1042 HydrophobicContact CB-CD1 4.17Å; I1027-Y1042 HydrophobicContact CB-CE1 3.93Å; I1027-Y1042 HydrophobicContact CD1-CD1 4.24Å; I1027-Y1042 HydrophobicContact CG2-CD1 3.94Å; I1027-Y1042 HydrophobicContact CG2-CE1 3.48Å; I1027-Y1042 VanDerWaalsContact CG2-CE1 3.48Å; A1029-Y1042 HydrophobicContact CB-CE1 4.22Å; A1029-Y1042 PolarHBondContact N-OH 3.2Å; I1040-Y1042 HydrophobicContact CG2-CE1 4.39Å; Y1042-R1095 PolarHBondContact N-O 2.94Å; Y1042-R1095 WeakPolarHBondContact O-CA 3.25Å; Y1042-G1098 VanDerWaalsContact CD2-CA 3.5Å; Y1042-L1122 CarbonylContact C-O 3.59Å; Y1042-L1122 VanDerWaalsContact CA-O 3.3Å; Y1042-L1122 WeakPolarHBondContact CA-O 3.39Å; Y1042-A1123 HydrophobicContact CD1-CB 3.81Å; Y1042-A1123 HydrophobicContact CE1-CB 3.82Å
1043	K	90.3	Very high	78.6	Confident	116 Å²	116	63.4 Å²	63.4	50%	0.504	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	124.4	179.4	177.8	-179.9	178.4	-177.1	0	113.2	L1045 I1121 L1122 Y1124	K1043-L1045 HydrophobicContact CD-CD2 4.26Å; K1043-L1045 HydrophobicContact CG-CD2 4.36Å; K1043-L1045 PolarHBondContact O-N 2.84Å; K1043-I1121 CarbonylContact O-C 3.57Å; K1043-I1121 WeakPolarHBondContact O-CA 3.3Å; K1043-I1121 WeakPolarHBondContact O-CG2 3.35Å; K1043-L1122 HydrophobicContact CB-CB 4.36Å; K1043-L1122 PolarHBondContact N-O 2.84Å; K1043-L1122 PolarHBondContact O-N 3.31Å; K1043-Y1124 HydrophobicContact CB-CE1 3.97Å
1044	L	90.1	Very high	75.4	Confident	38 Å²	38	73 Å²	73	20%	0.199	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	120.8	169	-177.4	65.4	0	0	0	108.7	V1047 F1091 V1093 L1119 I1121	L1044-V1047 HydrophobicContact CD1-CG2 4.22Å; L1044-V1047 HydrophobicContact CD2-CG2 4.09Å; L1044-V1047 HydrophobicContact CG-CG2 4.45Å; L1044-F1091 HydrophobicContact CD2-CB 4.12Å; L1044-F1091 WeakPolarHBondContact CD2-O 3.49Å; L1044-V1093 HydrophobicContact CB-CG1 3.88Å; L1044-V1093 VanDerWaalsContact N-CG1 3.28Å; L1044-L1119 HydrophobicContact CD1-CB 4.14Å; L1044-L1119 HydrophobicContact CD1-CG 4.35Å; L1044-I1121 HydrophobicContact CD1-CD1 4.31Å; L1044-I1121 HydrophobicContact CD1-CG1 3.64Å
1045	L	85.9	Confident	72.6	Confident	78 Å²	78	75.9 Å²	75.9	41%	0.408	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-41.8	-177.8	-65.5	179.8	0	0	0	112.3	K1043 R1120 L1122 T1135	K1043-L1045 HydrophobicContact CD-CD2 4.26Å; K1043-L1045 HydrophobicContact CG-CD2 4.36Å; K1043-L1045 PolarHBondContact O-N 2.84Å; L1045-R1120 HydrophobicContact CB-CG 4.32Å; L1045-R1120 WeakPolarHBondContact CB-O 3.49Å; L1045-R1120 HydrophobicContact CD1-CG 4.18Å; L1045-R1120 PolarHBondContact N-O 3.3Å; L1045-L1122 HydrophobicContact CD1-CB 3.99Å; L1045-L1122 HydrophobicContact CD1-CD1 4.37Å; L1045-L1122 HydrophobicContact CD2-CB 4.1Å; L1045-L1122 HydrophobicContact CD2-CD2 4.36Å; L1045-L1122 HydrophobicContact CG-CB 3.96Å; L1045-T1135 HydrophobicContact CD1-CG2 4.08Å
1046	Q	84.1	Confident	69.7	Low	71 Å²	71	82.8 Å²	82.8	33%	0.332	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	151.5	-168.6	-164.6	-173.3	-6.5	0	0	110.4	E1048 R1120	Q1046-E1048 HydrophobicContact CG-CG 4.19Å; Q1046-E1048 VanDerWaalsContact NE2-CG 3.31Å; Q1046-E1048 PolarHBondContact NE2-OE1 2.98Å; Q1046-R1120 HydrophobicContact CB-CB 4.16Å; Q1046-R1120 PolarHBondContact N-O 2.84Å; Q1046-R1120 PolarHBondContact O-N 2.88Å
1047	V	83.7	Confident	66.8	Low	7 Å²	7	81.4 Å²	81.4	4%	0.042	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.5	163.2	-172	0	0	0	0	108.2	L1044 Y1089 F1091 Y1117 M1118 L1119	L1044-V1047 HydrophobicContact CD1-CG2 4.22Å; L1044-V1047 HydrophobicContact CD2-CG2 4.09Å; L1044-V1047 HydrophobicContact CG-CG2 4.45Å; V1047-Y1089 HydrophobicContact CB-CD1 3.64Å; V1047-Y1089 HydrophobicContact CB-CD2 4.3Å; V1047-Y1089 HydrophobicContact CB-CE1 3.99Å; V1047-Y1089 HydrophobicContact CB-CG 3.8Å; V1047-Y1089 HydrophobicContact CG1-CD1 4.47Å; V1047-Y1089 HydrophobicContact CG2-CD1 4.13Å; V1047-Y1089 HydrophobicContact CG2-CD2 4.04Å; V1047-Y1089 HydrophobicContact CG2-CG 3.74Å; V1047-Y1089 WeakPolarHBondContact O-CE1 3.42Å; V1047-F1091 HydrophobicContact CG1-CD2 3.89Å; V1047-F1091 HydrophobicContact CG1-CE2 4.05Å; V1047-F1091 HydrophobicContact CG2-CD2 4.13Å; V1047-Y1117 HydrophobicContact CG1-CD1 3.95Å; V1047-Y1117 HydrophobicContact CG1-CG 4.33Å; V1047-M1118 CarbonylContact C-O 3.54Å; V1047-M1118 VanDerWaalsContact CA-O 3.28Å; V1047-M1118 WeakPolarHBondContact CA-O 3.4Å; V1047-L1119 HydrophobicContact CG1-CD1 4.18Å; V1047-L1119 HydrophobicContact CG1-CG 4.47Å; V1047-L1119 HydrophobicContact CG2-CG 4.23Å
1048	E	78.9	Confident	63.9	Low	91 Å²	91	88.9 Å²	88.9	43%	0.425	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143	178.3	-49.7	175.2	143.2	0	0	110.7	Q1046 Y1117 M1118	Q1046-E1048 HydrophobicContact CG-CG 4.19Å; Q1046-E1048 VanDerWaalsContact NE2-CG 3.31Å; Q1046-E1048 PolarHBondContact NE2-OE1 2.98Å; E1048-Y1117 CarbonylContact O-C 3.55Å; E1048-Y1117 VanDerWaalsContact O-CA 3.31Å; E1048-Y1117 WeakPolarHBondContact O-CA 3.38Å; E1048-M1118 HydrophobicContact CB-CB 4.19Å; E1048-M1118 PolarHBondContact N-O 3.08Å; E1048-M1118 PolarHBondContact O-N 2.74Å
1049	D	74	Confident	61.1	Low	89 Å²	89	92.1 Å²	92.1	48%	0.476	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	138.2	-178	-81.2	9.6	0	0	0	111.8	L1051 P1114 Y1117	D1049-L1051 PolarHBondContact O-N 3.29Å; D1049-P1114 HydrophobicContact CB-CB 3.83Å; D1049-P1114 HydrophobicContact CB-CG 4.32Å; D1049-P1114 WeakPolarHBondContact OD2-CG 3.02Å; D1049-Y1117 WeakPolarHBondContact OD1-CD1 3.4Å; D1049-Y1117 WeakPolarHBondContact OD1-CE1 3.44Å
1050	D	60.1	Low	58.1	Low	76 Å²	76	95.3 Å²	95.3	41%	0.406	51%	0.511	S	S	.	.	S	Bend	trans	-72.6	25.5	-176.8	-153.4	44.7	0	0	0	114.5	A1116 R1139	D1050-A1116 HydrophobicContact CB-CB 3.95Å; D1050-A1116 VanDerWaalsContact CB-O 3.29Å; D1050-A1116 WeakPolarHBondContact CB-O 3.29Å; D1050-A1116 PolarHBondContact N-O 2.84Å; D1050-A1116 VanDerWaalsContact N-O 3.12Å; D1050-R1139 IonicContact OD1-NE 3.98Å; D1050-R1139 IonicContact OD1-NH2 2.7Å; D1050-R1139 IonicContact OD2-CZ 2.95Å; D1050-R1139 IonicContact OD2-NH2 2.71Å; D1050-R1139 PolarHBondContact OD2-NH2 2.86Å
1051	L	46.5	Very low	55.1	Low	140 Å²	140	98.9 Å²	98.9	73%	0.733	54%	0.537	S	S	*	.	S	Bend	trans	-112.3	39.1	180	-86.3	175.3	0	0	0	113.7	D1049	D1049-L1051 PolarHBondContact O-N 3.29Å
1052	G	34.1	Very low	52.1	Low	67 Å²	67	108.3 Å²	108.3	69%	0.691	57%	0.571	S	S	*	*			trans	94.9	142.7	139.6	0	0	0	0	0	119
1053	S	28.2	Very low	48.8	Very low	100 Å²	100	114.2 Å²	114.2	70%	0.699	60%	0.604	S	S	*	*			trans	87.7	87.2	144.4	-166.7	0	0	0	0	119.7
1054	W	24.4	Very low	45.8	Very low	212 Å²	212	113 Å²	113	80%	0.803	61%	0.611	S	S	*	*				51.9	108	125.5	-57.8	104.7	0	0	0	118.7
1055	N	28.6	Very low	42.7	Very low	167 Å²	167	119.9 Å²	119.9	89%	0.893	64%	0.641	S	S	*	*				-150	102.5	127.5	-96.2	-43.4	0	0	0	110.5	A1057	N1055-A1057 PolarHBondContact O-N 2.87Å
1056	F	25.8	Very low	40.2	Very low	194 Å²	194	122.5 Å²	122.5	85%	0.851	66%	0.655	S	S	*	*			trans	-78.2	114.1	162.9	-110.9	-97.8	0	0	0	108
1057	A	27.9	Very low	37.4	Very low	80 Å²	80	125.1 Å²	125.1	66%	0.661	67%	0.671	S	S	*	*			trans	-140.8	126.9	156.1	0	0	0	0	0	105.3	N1055	N1055-A1057 PolarHBondContact O-N 2.87Å
1058	E	26.5	Very low	34.7	Very low	178 Å²	178	132 Å²	132	83%	0.832	70%	0.703	S	S	*	*				56.5	135.6	61.6	-63.9	-162.9	140.4	0	0	113.1
1059	S	26.5	Very low	32.1	Very low	90 Å²	90	138.1 Å²	138.1	63%	0.629	72%	0.722	S	S	*	*			cis	-173.1	172.7	-16.7	59	0	0	0	0	107.6
1060	V	27.3	Very low	29.8	Very low	131 Å²	131	140 Å²	140	79%	0.794	73%	0.732	S	S	*	*			trans	67.8	165.2	152.5	161.5	0	0	0	0	114.1
1061	P	28.7	Very low	28.2	Very low	108 Å²	108	141.1 Å²	141.1	70%	0.701	74%	0.742	S	S	*	*			cis	-106.1	159.5	-8.5	12.6	9.9	0	0	0	115
1062	R	29.4	Very low	27.1	Very low	221 Å²	221	140.3 Å²	140.3	83%	0.834	74%	0.743	S	S	*	*			trans	-93.5	154.2	154	-162.6	-174.9	-57.3	-163.3	1.4	107.9
1063	N	24.6	Very low	26.8	Very low	144 Å²	144	143.5 Å²	143.5	77%	0.77	74%	0.744	S	S	*	*			trans	73.2	160.3	-174.3	-35.8	-33.5	0	0	0	112
1064	S	26.1	Very low	26.6	Very low	92 Å²	92	144 Å²	144	64%	0.643	74%	0.744	S	S	*	*			cis	-153.9	137.1	13.8	55.8	0	0	0	0	114.1
1065	Q	24.9	Very low	26.7	Very low	181 Å²	181	140.9 Å²	140.9	85%	0.846	74%	0.742	S	S	*	*			trans	61.7	-177.2	153.2	-64.7	-176.1	-11.7	0	0	117.1
1066	L	34.2	Very low	26.5	Very low	134 Å²	134	137.4 Å²	137.4	70%	0.702	73%	0.731	S	S	*	*			trans	67.2	110.1	-178.5	-65.9	101.4	0	0	0	114.1
1067	N	25.7	Very low	26.6	Very low	125 Å²	125	136.3 Å²	136.3	67%	0.668	73%	0.729	S	S	*	*				62.8	128.7	70	-61.7	-14.4	0	0	0	109.6
1068	H	25.9	Very low	26.4	Very low	153 Å²	153	141.6 Å²	141.6	71%	0.708	74%	0.742	S	S	*	*			cis	164.4	156.7	6.3	-114.6	-50.9	0	0	0	102
1069	R	24.9	Very low	26.3	Very low	218 Å²	218	138.8 Å²	138.8	82%	0.823	73%	0.733	S	S	*	*			trans	67	157.6	166.1	-61.7	166.1	176.4	163.6	-1.9	113.4
1070	N	25.5	Very low	26.3	Very low	128 Å²	128	141.3 Å²	141.3	68%	0.684	74%	0.735	S	S	*	*			cis	-146.7	152.4	-8.9	-123	9.5	0	0	0	112.2
1071	T	26.2	Very low	26.3	Very low	101 Å²	101	140.2 Å²	140.2	62%	0.62	72%	0.721	S	S	*	*			trans	-2.1	157.1	143.1	59.9	0	0	0	0	121.5
1072	T	24.1	Very low	26	Very low	122 Å²	122	141.4 Å²	141.4	75%	0.748	73%	0.732	S	S	*	*			trans	90.2	152.9	157	78.2	0	0	0	0	118.5
1073	D	26.8	Very low	25.9	Very low	135 Å²	135	138.6 Å²	138.6	72%	0.722	73%	0.725	S	S	*	*			trans	-31.9	134.6	147.2	-42	-99.9	0	0	0	110.2
1074	T	24.6	Very low	25.9	Very low	111 Å²	111	135.8 Å²	135.8	68%	0.681	72%	0.717	S	S	*	*				-179	143.8	76.9	28.1	0	0	0	0	111.5
1075	N	25.7	Very low	26.2	Very low	145 Å²	145	136.6 Å²	136.6	78%	0.775	72%	0.723	S	S	*	*			trans	65.2	158.1	145.4	-63.9	-31.5	0	0	0	122.1
1076	S	25.5	Very low	26.6	Very low	95 Å²	95	133 Å²	133	66%	0.664	71%	0.709	S	S	*	*			trans	66.7	105.6	146.7	47.4	0	0	0	0	121.1
1077	Q	26.9	Very low	27.1	Very low	170 Å²	170	130.9 Å²	130.9	79%	0.794	70%	0.702	S	S	*	*				61.8	106.3	122.5	-63.8	173.6	-43.1	0	0	119.9
1078	M	24.5	Very low	28.6	Very low	192 Å²	192	127.9 Å²	127.9	95%	0.946	69%	0.686	S	S	*	*				-172.4	98.4	129.5	-99.7	168.8	-158.1	0	0	105.6
1079	N	24.4	Very low	30.6	Very low	119 Å²	119	124.3 Å²	124.3	64%	0.636	67%	0.667	S	S	*	*			cis	59	110.4	27.2	-126.1	54.4	0	0	0	114.3
1080	Q	26.1	Very low	33.3	Very low	143 Å²	143	114.9 Å²	114.9	67%	0.668	63%	0.634	S	S	*	*			trans	85.2	113.2	152.7	-66.3	173.1	-90.2	0	0	120.3
1081	E	27.1	Very low	36.3	Very low	108 Å²	108	109.1 Å²	109.1	51%	0.505	60%	0.602	S	S	.	*				77.6	78.9	126.1	-63.4	171.9	-141.5	0	0	118	K1083	E1081-K1083 HydrophobicContact CB-CB 4.4Å; E1081-K1083 HydrophobicContact CB-CG 4.33Å; E1081-K1083 PolarHBondContact O-N 3.23Å; E1081-K1083 IonicContact OE2-NZ 3.07Å; E1081-K1083 PolarHBondContact OE2-NZ 2.84Å
1082	S	23.5	Very low	39.3	Very low	132 Å²	132	105 Å²	105	92%	0.923	58%	0.579	S	S	*	*			trans	-57.9	66.2	132.4	47.7	0	0	0	0	111.4	S1084	S1082-S1084 PolarHBondContact O-N 2.6Å
1083	K	26	Very low	42.5	Very low	162 Å²	162	100.3 Å²	100.3	70%	0.704	55%	0.55	S	S	*	.			trans	-66.5	117.4	173.6	-115.5	-166.1	179.6	95.4	0	108.8	E1081 S1085	E1081-K1083 HydrophobicContact CB-CB 4.4Å; E1081-K1083 HydrophobicContact CB-CG 4.33Å; E1081-K1083 PolarHBondContact O-N 3.23Å; E1081-K1083 IonicContact OE2-NZ 3.07Å; E1081-K1083 PolarHBondContact OE2-NZ 2.84Å; K1083-S1085 PolarHBondContact O-N 3.37Å
1084	S	26.4	Very low	45.6	Very low	85 Å²	85	96.9 Å²	96.9	59%	0.594	53%	0.532	S	S	*	.			trans	-50.1	120.9	176.4	54.1	0	0	0	0	112.6	S1082 N1086	S1082-S1084 PolarHBondContact O-N 2.6Å; S1084-N1086 PolarHBondContact O-N 2.92Å
1085	S	31.2	Very low	48.8	Very low	110 Å²	110	98.3 Å²	98.3	77%	0.769	53%	0.525	S	S	*	.			trans	-67.2	93	140.3	53.2	0	0	0	0	106.5	K1083 V1087	K1083-S1085 PolarHBondContact O-N 3.37Å; S1085-V1087 PolarHBondContact O-N 2.94Å
1086	N	34.3	Very low	51.8	Low	105 Å²	105	96.3 Å²	96.3	56%	0.561	52%	0.518	S	S	*	.			trans	-73.6	73.4	-170.1	-165.4	63	0	0	0	111.6	S1084 D1088	S1084-N1086 PolarHBondContact O-N 2.92Å; N1086-D1088 VanDerWaalsContact C-N 3.3Å; N1086-D1088 PolarHBondContact ND2-OD2 2.98Å; N1086-D1088 PolarHBondContact O-N 2.83Å; N1086-D1088 VanDerWaalsContact O-N 3.13Å
1087	V	44.4	Very low	54.7	Low	89 Å²	89	93.8 Å²	93.8	54%	0.539	50%	0.503	S	S	.	.			trans	-73.4	93.1	160.7	-175.6	0	0	0	0	105.5	S1085 Y1089	S1085-V1087 PolarHBondContact O-N 2.94Å; V1087-Y1089 HydrophobicContact CB-CE1 4.29Å; V1087-Y1089 HydrophobicContact CB-CE2 4.36Å; V1087-Y1089 HydrophobicContact CG1-CD1 4.03Å; V1087-Y1089 HydrophobicContact CG1-CE1 3.48Å; V1087-Y1089 VanDerWaalsContact CG1-CE1 3.48Å; V1087-Y1089 HydrophobicContact CG1-CE2 4.4Å; V1087-Y1089 WeakPolarHBondContact O-CD2 3.45Å; V1087-Y1089 PolarHBondContact O-N 2.94Å
1088	D	57.6	Low	57.6	Low	62 Å²	62	85.7 Å²	85.7	33%	0.332	47%	0.465	S	S	.	.			trans	-78.8	96	-171	-131.4	-24.9	0	0	0	109.9	N1086 R1103	N1086-D1088 VanDerWaalsContact C-N 3.3Å; N1086-D1088 PolarHBondContact ND2-OD2 2.98Å; N1086-D1088 PolarHBondContact O-N 2.83Å; N1086-D1088 VanDerWaalsContact O-N 3.13Å; D1088-R1103 IonicContact OD1-CZ 3.33Å; D1088-R1103 IonicContact OD1-NE 2.74Å; D1088-R1103 IonicContact OD1-NH1 2.78Å; D1088-R1103 PolarHBondContact OD1-NH1 3.43Å; D1088-R1103 IonicContact OD1-NH2 2.64Å; D1088-R1103 PolarHBondContact OD1-NH2 3.11Å; D1088-R1103 IonicContact OD2-CZ 3.95Å; D1088-R1103 IonicContact OD2-NH1 3.18Å; D1088-R1103 IonicContact OD2-NH2 2.84Å; D1088-R1103 PolarHBondContact OD2-NH2 2.93Å
1089	Y	67.2	Low	60.7	Low	78 Å²	78	79.3 Å²	79.3	31%	0.306	43%	0.434	S	S	.	.			trans	-74.9	146	-177.3	-57.9	-68.5	0	0	0	110.9	V1047 V1087 F1091	V1047-Y1089 HydrophobicContact CB-CD1 3.64Å; V1047-Y1089 HydrophobicContact CB-CD2 4.3Å; V1047-Y1089 HydrophobicContact CB-CE1 3.99Å; V1047-Y1089 HydrophobicContact CB-CG 3.8Å; V1047-Y1089 HydrophobicContact CG1-CD1 4.47Å; V1047-Y1089 HydrophobicContact CG2-CD1 4.13Å; V1047-Y1089 HydrophobicContact CG2-CD2 4.04Å; V1047-Y1089 HydrophobicContact CG2-CG 3.74Å; V1047-Y1089 WeakPolarHBondContact O-CE1 3.42Å; V1087-Y1089 HydrophobicContact CB-CE1 4.29Å; V1087-Y1089 HydrophobicContact CB-CE2 4.36Å; V1087-Y1089 HydrophobicContact CG1-CD1 4.03Å; V1087-Y1089 HydrophobicContact CG1-CE1 3.48Å; V1087-Y1089 VanDerWaalsContact CG1-CE1 3.48Å; V1087-Y1089 HydrophobicContact CG1-CE2 4.4Å; V1087-Y1089 WeakPolarHBondContact O-CD2 3.45Å; V1087-Y1089 PolarHBondContact O-N 2.94Å; Y1089-F1091 PolarHBondContact O-N 3.44Å
1090	P	81.1	Confident	63.9	Low	21 Å²	21	73.6 Å²	73.6	14%	0.136	40%	0.404	C	S	.	.	S	Bend	trans	-72.8	19.4	-179.9	30.5	-35.1	0	0	0	113.8	L1102 R1103 E1104 L1106 Y1117	P1090-L1102 CarbonylContact O-C 3.5Å; P1090-L1102 WeakPolarHBondContact O-CA 3.5Å; P1090-L1102 WeakPolarHBondContact O-CD1 3.43Å; P1090-R1103 PolarHBondContact O-N 3.43Å; P1090-E1104 HydrophobicContact CB-CB 4.31Å; P1090-L1106 HydrophobicContact CB-CD2 4.07Å; P1090-L1106 HydrophobicContact CG-CD2 3.94Å; P1090-Y1117 HydrophobicContact CG-CE1 4.36Å
1091	F	89.6	Confident	67	Low	6 Å²	6	71 Å²	71	3%	0.026	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	146.8	-177.8	-57	-77.6	0	0	0	111	I1024 L1044 V1047 Y1089 Y1101 L1102 Y1117 L1119 V1140	I1024-F1091 HydrophobicContact CD1-CD1 3.48Å; I1024-F1091 VanDerWaalsContact CD1-CD1 3.48Å; I1024-F1091 HydrophobicContact CD1-CE1 3.53Å; L1044-F1091 HydrophobicContact CD2-CB 4.12Å; L1044-F1091 WeakPolarHBondContact CD2-O 3.49Å; V1047-F1091 HydrophobicContact CG1-CD2 3.89Å; V1047-F1091 HydrophobicContact CG1-CE2 4.05Å; V1047-F1091 HydrophobicContact CG2-CD2 4.13Å; Y1089-F1091 PolarHBondContact O-N 3.44Å; F1091-Y1101 WeakPolarHBondContact CA-O 3.37Å; F1091-L1102 HydrophobicContact CD1-CD1 3.86Å; F1091-L1102 HydrophobicContact CE1-CD1 3.47Å; F1091-L1102 VanDerWaalsContact CE1-CD1 3.47Å; F1091-L1102 HydrophobicContact CZ-CD1 4.13Å; F1091-Y1117 AromaticContact CE2-CD1 3.79Å; F1091-Y1117 HydrophobicContact CE2-CD1 3.79Å; F1091-Y1117 AromaticContact CE2-CD2 3.62Å; F1091-Y1117 HydrophobicContact CE2-CD2 3.62Å; F1091-Y1117 HydrophobicContact CE2-CE1 4.25Å; F1091-Y1117 HydrophobicContact CE2-CE2 4.12Å; F1091-Y1117 AromaticContact CE2-CG 3.41Å; F1091-Y1117 HydrophobicContact CE2-CG 3.41Å; F1091-Y1117 VanDerWaalsContact CE2-CG 3.41Å; F1091-Y1117 HydrophobicContact CZ-CD1 4.48Å; F1091-Y1117 AromaticContact CZ-CD2 3.47Å; F1091-Y1117 HydrophobicContact CZ-CD2 3.47Å; F1091-Y1117 VanDerWaalsContact CZ-CD2 3.47Å; F1091-Y1117 HydrophobicContact CZ-CE2 4.01Å; F1091-Y1117 AromaticContact CZ-CG 3.73Å; F1091-Y1117 HydrophobicContact CZ-CG 3.73Å; F1091-L1119 HydrophobicContact CB-CD2 4Å; F1091-L1119 HydrophobicContact CB-CG 4.47Å; F1091-L1119 HydrophobicContact CD1-CD1 4.41Å; F1091-L1119 HydrophobicContact CD1-CD2 3.96Å; F1091-L1119 HydrophobicContact CD2-CD1 4.09Å; F1091-L1119 HydrophobicContact CD2-CG 4.34Å; F1091-L1119 HydrophobicContact CE1-CD1 4.42Å; F1091-L1119 HydrophobicContact CE2-CD1 4.1Å; F1091-L1119 HydrophobicContact CG-CD1 4.24Å; F1091-L1119 HydrophobicContact CG-CD2 3.89Å; F1091-L1119 HydrophobicContact CG-CG 4.21Å; F1091-L1119 HydrophobicContact CZ-CD1 4.27Å; F1091-V1140 HydrophobicContact CE1-CB 4.36Å; F1091-V1140 HydrophobicContact CE1-CG1 3.97Å; F1091-V1140 HydrophobicContact CZ-CB 4.39Å; F1091-V1140 HydrophobicContact CZ-CG1 4.2Å
1092	A	89.2	Confident	69.9	Low	16 Å²	16	65.9 Å²	65.9	13%	0.132	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	167.1	171.8	0	0	0	0	0	110.5	C1100 Y1101 R1103	A1092-C1100 VanDerWaalsContact O-CA 3.3Å; A1092-C1100 WeakPolarHBondContact O-CA 3.39Å; A1092-C1100 PolarHBondContact O-SG 3.2Å; A1092-Y1101 HydrophobicContact CB-CD1 4.37Å; A1092-Y1101 HydrophobicContact CB-CD2 4.42Å; A1092-Y1101 HydrophobicContact CB-CE1 3.76Å; A1092-Y1101 HydrophobicContact CB-CE2 3.83Å; A1092-Y1101 VanDerWaalsContact CB-CZ 3.46Å; A1092-Y1101 PolarHBondContact N-O 3.11Å; A1092-Y1101 PolarHBondContact O-N 3.01Å; A1092-R1103 HydrophobicContact CB-CB 4.42Å
1093	V	91.3	Very high	72.8	Confident	22 Å²	22	65 Å²	65	13%	0.133	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	139.1	172.7	71.5	0	0	0	0	110	I1027 L1044 I1099 C1100 I1121	I1027-V1093 HydrophobicContact CD1-CG2 4.31Å; L1044-V1093 HydrophobicContact CB-CG1 3.88Å; L1044-V1093 VanDerWaalsContact N-CG1 3.28Å; V1093-I1099 CarbonylContact C-O 3.59Å; V1093-I1099 VanDerWaalsContact CA-O 3.3Å; V1093-I1099 WeakPolarHBondContact CA-O 3.36Å; V1093-C1100 HydrophobicContact CG2-CB 4.34Å; V1093-I1121 HydrophobicContact CG1-CG2 4.44Å
1094	D	91	Very high	75.5	Confident	63 Å²	63	61.9 Å²	61.9	34%	0.337	33%	0.329	S	S	.	.			trans	-69.3	128.3	171.1	-170.3	-72.3	0	0	0	110.6	T1096 A1097 G1098 I1099	D1094-T1096 VanDerWaalsContact C-N 3.25Å; D1094-T1096 PolarHBondContact O-N 3.08Å; D1094-T1096 PolarHBondContact OD1-N 2.86Å; D1094-T1096 PolarHBondContact OD1-OG1 3.04Å; D1094-A1097 HydrophobicContact CB-CB 4.14Å; D1094-A1097 PolarHBondContact OD1-N 3.43Å; D1094-G1098 WeakPolarHBondContact O-CA 3.15Å; D1094-G1098 PolarHBondContact O-N 3.44Å; D1094-I1099 HydrophobicContact CB-CB 4.24Å; D1094-I1099 PolarHBondContact N-O 2.92Å
1095	R	91	Very high	78.1	Confident	141 Å²	141	63.1 Å²	63.1	53%	0.532	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.7	-174.7	-176	173.7	173.7	-163.4	-9.9	113.9	E1041 Y1042 Y1124	E1041-R1095 CarbonylContact C-O 3.56Å; E1041-R1095 VanDerWaalsContact CA-O 3.3Å; E1041-R1095 WeakPolarHBondContact CA-O 3.4Å; E1041-R1095 HydrophobicContact CB-CG 4.23Å; E1041-R1095 VanDerWaalsContact CD-NH2 3.32Å; E1041-R1095 HydrophobicContact CG-CG 4.35Å; E1041-R1095 IonicContact OE1-CZ 2.98Å; E1041-R1095 IonicContact OE1-NE 2.79Å; E1041-R1095 PolarHBondContact OE1-NE 2.78Å; E1041-R1095 IonicContact OE1-NH2 2.95Å; E1041-R1095 PolarHBondContact OE1-NH2 2.71Å; E1041-R1095 VanDerWaalsContact OE1-NH2 3.1Å; E1041-R1095 IonicContact OE2-CZ 2.62Å; E1041-R1095 IonicContact OE2-NE 3.96Å; E1041-R1095 PolarHBondContact OE2-NE 3.29Å; E1041-R1095 IonicContact OE2-NH2 3.79Å; E1041-R1095 PolarHBondContact OE2-NH2 3.19Å; Y1042-R1095 PolarHBondContact N-O 2.94Å; Y1042-R1095 WeakPolarHBondContact O-CA 3.25Å; R1095-Y1124 PolarHBondContact NE-OH 2.84Å
1096	T	89.4	Confident	80.3	Confident	103 Å²	103	58.5 Å²	58.5	63%	0.632	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	-38.1	-175.6	61.2	0	0	0	0	112.7	D1094	D1094-T1096 VanDerWaalsContact C-N 3.25Å; D1094-T1096 PolarHBondContact O-N 3.08Å; D1094-T1096 PolarHBondContact OD1-N 2.86Å; D1094-T1096 PolarHBondContact OD1-OG1 3.04Å
1097	A	87.2	Confident	81.9	Confident	43 Å²	43	56 Å²	56	36%	0.355	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-10	-178.5	0	0	0	0	0	113.6	T1026 D1094 I1099	T1026-A1097 WeakPolarHBondContact CG2-O 3.32Å; D1094-A1097 HydrophobicContact CB-CB 4.14Å; D1094-A1097 PolarHBondContact OD1-N 3.43Å; A1097-I1099 HydrophobicContact CB-CD1 3.83Å; A1097-I1099 HydrophobicContact CB-CG1 3.88Å; A1097-I1099 PolarHBondContact O-N 3.49Å; A1097-I1099 VanDerWaalsContact O-N 3.13Å
1098	G	86.8	Confident	82.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.			trans	65.1	14.2	179.9	0	0	0	0	0	114.4	I1027 Y1042 D1094 C1100	I1027-G1098 WeakPolarHBondContact CG1-O 3.27Å; I1027-G1098 PolarHBondContact N-O 3.19Å; Y1042-G1098 VanDerWaalsContact CD2-CA 3.5Å; D1094-G1098 WeakPolarHBondContact O-CA 3.15Å; D1094-G1098 PolarHBondContact O-N 3.44Å; G1098-C1100 PolarHBondContact O-N 3.42Å
1099	I	90.8	Very high	83.1	Confident	57 Å²	57	56 Å²	56	29%	0.292	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115	-177.7	-59.2	170.2	0	0	0	108.7	T1023 T1026 V1093 D1094 A1097	T1023-I1099 HydrophobicContact CG2-CG2 3.77Å; T1026-I1099 HydrophobicContact CG2-CG1 3.85Å; V1093-I1099 CarbonylContact C-O 3.59Å; V1093-I1099 VanDerWaalsContact CA-O 3.3Å; V1093-I1099 WeakPolarHBondContact CA-O 3.36Å; D1094-I1099 HydrophobicContact CB-CB 4.24Å; D1094-I1099 PolarHBondContact N-O 2.92Å; A1097-I1099 HydrophobicContact CB-CD1 3.83Å; A1097-I1099 HydrophobicContact CB-CG1 3.88Å; A1097-I1099 PolarHBondContact O-N 3.49Å; A1097-I1099 VanDerWaalsContact O-N 3.13Å
1100	C	90.5	Very high	82.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	131.4	172.4	-172.7	0	0	0	0	110.5	I1024 F1025 A1092 V1093 G1098	I1024-C1100 PolarHBondContact N-O 2.81Å; F1025-C1100 HydrophobicContact CD1-CB 4.26Å; F1025-C1100 HydrophobicContact CD2-CB 3.82Å; F1025-C1100 HydrophobicContact CE1-CB 3.8Å; F1025-C1100 HydrophobicContact CE2-CB 3.31Å; F1025-C1100 HydrophobicContact CG-CB 4.25Å; F1025-C1100 HydrophobicContact CZ-CB 3.29Å; F1025-C1100 VanDerWaalsContact CZ-SG 3.55Å; F1025-C1100 PolarHBondContact O-N 3.23Å; A1092-C1100 VanDerWaalsContact O-CA 3.3Å; A1092-C1100 WeakPolarHBondContact O-CA 3.39Å; A1092-C1100 PolarHBondContact O-SG 3.2Å; V1093-C1100 HydrophobicContact CG2-CB 4.34Å; G1098-C1100 PolarHBondContact O-N 3.42Å
1101	Y	90.6	Very high	81.5	Confident	88 Å²	88	63.2 Å²	63.2	35%	0.345	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	156.8	-175.1	64.4	-85.8	0	0	0	112	N1022 F1091 A1092 R1103	N1022-Y1101 CarbonylContact O-C 3.58Å; N1022-Y1101 VanDerWaalsContact O-CA 3.3Å; N1022-Y1101 WeakPolarHBondContact O-CA 3.41Å; N1022-Y1101 WeakPolarHBondContact O-CB 3.39Å; F1091-Y1101 WeakPolarHBondContact CA-O 3.37Å; A1092-Y1101 HydrophobicContact CB-CD1 4.37Å; A1092-Y1101 HydrophobicContact CB-CD2 4.42Å; A1092-Y1101 HydrophobicContact CB-CE1 3.76Å; A1092-Y1101 HydrophobicContact CB-CE2 3.83Å; A1092-Y1101 VanDerWaalsContact CB-CZ 3.46Å; A1092-Y1101 PolarHBondContact N-O 3.11Å; A1092-Y1101 PolarHBondContact O-N 3.01Å; Y1101-R1103 PolarHBondContact O-N 2.88Å
1102	L	88.5	Confident	79.8	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	120.6	175.4	-157.2	76.7	0	0	0	109.2	L1013 G1021 N1022 I1024 P1090 F1091 E1104 L1106	L1013-L1102 HydrophobicContact CD1-CD1 4.29Å; G1021-L1102 PolarHBondContact N-O 2.89Å; N1022-L1102 PolarHBondContact O-N 2.77Å; I1024-L1102 HydrophobicContact CD1-CD1 4.45Å; P1090-L1102 CarbonylContact O-C 3.5Å; P1090-L1102 WeakPolarHBondContact O-CA 3.5Å; P1090-L1102 WeakPolarHBondContact O-CD1 3.43Å; F1091-L1102 HydrophobicContact CD1-CD1 3.86Å; F1091-L1102 HydrophobicContact CE1-CD1 3.47Å; F1091-L1102 VanDerWaalsContact CE1-CD1 3.47Å; F1091-L1102 HydrophobicContact CZ-CD1 4.13Å; L1102-E1104 VanDerWaalsContact CD2-O 3.24Å; L1102-E1104 WeakPolarHBondContact CD2-O 3.47Å; L1102-E1104 VanDerWaalsContact CG-O 3.29Å; L1102-E1104 WeakPolarHBondContact CG-O 3.46Å; L1102-L1106 HydrophobicContact CD1-CD1 3.73Å; L1102-L1106 HydrophobicContact CD1-CG 4Å; L1102-L1106 HydrophobicContact CD2-CD1 4.32Å; L1102-L1106 HydrophobicContact CD2-CG 4.15Å
1103	R	85.2	Confident	78.5	Confident	115 Å²	115	71.5 Å²	71.5	43%	0.434	38%	0.381	S	S	.	.			trans	-83.7	-32.3	-178.2	-179.2	173	162.7	-162.1	-23.8	112.7	A1020 D1088 P1090 A1092 Y1101	A1020-R1103 WeakPolarHBondContact CB-O 3.35Å; D1088-R1103 IonicContact OD1-CZ 3.33Å; D1088-R1103 IonicContact OD1-NE 2.74Å; D1088-R1103 IonicContact OD1-NH1 2.78Å; D1088-R1103 PolarHBondContact OD1-NH1 3.43Å; D1088-R1103 IonicContact OD1-NH2 2.64Å; D1088-R1103 PolarHBondContact OD1-NH2 3.11Å; D1088-R1103 IonicContact OD2-CZ 3.95Å; D1088-R1103 IonicContact OD2-NH1 3.18Å; D1088-R1103 IonicContact OD2-NH2 2.84Å; D1088-R1103 PolarHBondContact OD2-NH2 2.93Å; P1090-R1103 PolarHBondContact O-N 3.43Å; A1092-R1103 HydrophobicContact CB-CB 4.42Å; Y1101-R1103 PolarHBondContact O-N 2.88Å
1104	E	81.1	Confident	77.4	Confident	95 Å²	95	71.1 Å²	71.1	44%	0.444	38%	0.379	S	S	.	.	S	Bend	trans	-134.4	155.1	-177	-56.8	-163	166	0	0	111.1	P1090 L1102 L1106	P1090-E1104 HydrophobicContact CB-CB 4.31Å; L1102-E1104 VanDerWaalsContact CD2-O 3.24Å; L1102-E1104 WeakPolarHBondContact CD2-O 3.47Å; L1102-E1104 VanDerWaalsContact CG-O 3.29Å; L1102-E1104 WeakPolarHBondContact CG-O 3.46Å; E1104-L1106 PolarHBondContact O-N 2.98Å
1105	N	82	Confident	76.5	Confident	112 Å²	112	76.6 Å²	76.6	60%	0.599	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-66.3	127.1	179	-67.4	-14.8	0	0	0	110.5	L1018 I1019 A1020	L1018-N1105 CarbonylContact O-C 3.54Å; L1018-N1105 WeakPolarHBondContact O-CA 3.44Å; I1019-N1105 WeakPolarHBondContact CA-OD1 3.26Å; A1020-N1105 WeakPolarHBondContact CB-OD1 3.45Å; A1020-N1105 PolarHBondContact N-OD1 3Å
1106	L	77.7	Confident	75.9	Confident	12 Å²	12	69.9 Å²	69.9	6%	0.063	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-81.9	134.3	172.9	-73.1	174.8	0	0	0	110.5	L1013 L1018 P1090 L1102 E1104 Y1117	L1013-L1106 HydrophobicContact CD1-CD1 3.89Å; L1018-L1106 HydrophobicContact CB-CB 4.09Å; L1018-L1106 HydrophobicContact CD2-CB 4Å; L1018-L1106 HydrophobicContact CD2-CD1 4.07Å; L1018-L1106 HydrophobicContact CG-CB 4.49Å; L1018-L1106 PolarHBondContact O-N 3.45Å; P1090-L1106 HydrophobicContact CB-CD2 4.07Å; P1090-L1106 HydrophobicContact CG-CD2 3.94Å; L1102-L1106 HydrophobicContact CD1-CD1 3.73Å; L1102-L1106 HydrophobicContact CD1-CG 4Å; L1102-L1106 HydrophobicContact CD2-CD1 4.32Å; L1102-L1106 HydrophobicContact CD2-CG 4.15Å; E1104-L1106 PolarHBondContact O-N 2.98Å; L1106-Y1117 HydrophobicContact CD1-CE2 4.1Å; L1106-Y1117 HydrophobicContact CD2-CE2 3.81Å; L1106-Y1117 VanDerWaalsContact CD2-OH 3.28Å; L1106-Y1117 WeakPolarHBondContact CD2-OH 3.48Å
1107	P	67.9	Low	75.7	Confident	53 Å²	53	66 Å²	66	34%	0.344	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-67.5	149.7	178.7	28.2	-34.6	0	0	0	111.7	V1111 R1142	P1107-V1111 HydrophobicContact CB-CB 4.21Å; P1107-V1111 HydrophobicContact CB-CG1 4.45Å; P1107-R1142 PolarHBondContact O-NH1 3.48Å
1108	P	64.9	Low	75.7	Confident	83 Å²	83	65.9 Å²	65.9	54%	0.539	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-65.2	154.8	178.2	27.8	-34.9	0	0	0	111.6	N1110 V1111	P1108-N1110 PolarHBondContact O-N 2.87Å; P1108-V1111 HydrophobicContact CG-CG2 4.38Å; P1108-V1111 PolarHBondContact O-N 3.18Å
1109	L	62.2	Low	75.8	Confident	67 Å²	67	65.9 Å²	65.9	35%	0.351	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-6.4	-171.7	-85.3	159.2	0	0	0	116.8	V1111 R1142 Q1143 V1144	L1109-V1111 VanDerWaalsContact C-N 3.31Å; L1109-R1142 HydrophobicContact CD1-CB 4.18Å; L1109-R1142 HydrophobicContact CD2-CB 4.2Å; L1109-R1142 HydrophobicContact CG-CB 4.26Å; L1109-Q1143 WeakPolarHBondContact CD1-O 3.19Å; L1109-V1144 HydrophobicContact CD1-CG2 4.38Å
1110	N	55.2	Low	75.8	Confident	170 Å²	170	67.7 Å²	67.7	91%	0.909	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	5.6	171.2	-82.8	7.8	0	0	0	113.6	P1108	P1108-N1110 PolarHBondContact O-N 2.87Å
1111	V	58.9	Low	75.8	Confident	81 Å²	81	67.7 Å²	67.7	49%	0.491	34%	0.34	S	S	.	.	S	Bend	trans	-118.1	139.7	175	-172.9	0	0	0	0	108.9	P1107 P1108 L1109 G1113	P1107-V1111 HydrophobicContact CB-CB 4.21Å; P1107-V1111 HydrophobicContact CB-CG1 4.45Å; P1108-V1111 HydrophobicContact CG-CG2 4.38Å; P1108-V1111 PolarHBondContact O-N 3.18Å; L1109-V1111 VanDerWaalsContact C-N 3.31Å; V1111-G1113 PolarHBondContact O-N 3.25Å
1112	D	54.4	Low	75.8	Confident	164 Å²	164	64.8 Å²	64.8	88%	0.877	33%	0.33	S	S	*	.	S	Bend	trans	-55.6	133	179.4	-71.9	-48.6	0	0	0	112
1113	G	61.1	Low	76	Confident	32 Å²	32	64.8 Å²	64.8	33%	0.33	33%	0.33	S	S	.	.	S	Bend	trans	165.4	162.5	-179.7	0	0	0	0	0	112.3	V1111 R1142	V1111-G1113 PolarHBondContact O-N 3.25Å; G1113-R1142 VanDerWaalsContact C-NH2 3.34Å; G1113-R1142 PolarHBondContact O-NH2 3.13Å
1114	P	68	Low	76.4	Confident	14 Å²	14	61.1 Å²	61.1	9%	0.091	32%	0.316	C	S	.	.			trans	-64.6	139.1	-173.9	30.9	-40.3	0	0	0	112.1	D1049 Y1117 R1142	D1049-P1114 HydrophobicContact CB-CB 3.83Å; D1049-P1114 HydrophobicContact CB-CG 4.32Å; D1049-P1114 WeakPolarHBondContact OD2-CG 3.02Å; P1114-Y1117 HydrophobicContact CB-CE1 4.41Å; P1114-Y1117 HydrophobicContact CG-CD1 4.21Å; P1114-Y1117 HydrophobicContact CG-CE1 3.42Å; P1114-Y1117 VanDerWaalsContact CG-CE1 3.42Å; P1114-Y1117 HydrophobicContact CG-CE2 4.21Å; P1114-Y1117 VanDerWaalsContact CG-CZ 3.43Å; P1114-Y1117 WeakPolarHBondContact CG-OH 3.47Å; P1114-R1142 VanDerWaalsContact O-CZ 3.3Å; P1114-R1142 PolarHBondContact O-NE 2.85Å; P1114-R1142 VanDerWaalsContact O-NE 3.08Å; P1114-R1142 PolarHBondContact O-NH2 2.81Å
1115	R	73.1	Confident	76.9	Confident	179 Å²	179	56.6 Å²	56.6	68%	0.675	30%	0.295	S	S	*	.	S	Bend	trans	-76.4	-27.7	-176.8	-74.3	-176.3	174.3	178.2	-1.8	113.2	R1142	R1115-R1142 PolarHBondContact O-N 3.42Å
1116	A	77.8	Confident	77.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	168	172.4	0	0	0	0	0	110.7	D1050 R1139 V1140 A1141	D1050-A1116 HydrophobicContact CB-CB 3.95Å; D1050-A1116 VanDerWaalsContact CB-O 3.29Å; D1050-A1116 WeakPolarHBondContact CB-O 3.29Å; D1050-A1116 PolarHBondContact N-O 2.84Å; D1050-A1116 VanDerWaalsContact N-O 3.12Å; A1116-R1139 HydrophobicContact CB-CG 4.2Å; A1116-V1140 CarbonylContact C-O 3.53Å; A1116-V1140 WeakPolarHBondContact CA-O 3.22Å; A1116-V1140 WeakPolarHBondContact CB-O 3.37Å; A1116-A1141 HydrophobicContact CB-CB 3.8Å
1117	Y	85.8	Confident	77.5	Confident	20 Å²	20	53.6 Å²	53.6	8%	0.078	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.3	178.4	-61.9	-86.5	0	0	0	109.6	V1047 E1048 D1049 P1090 F1091 L1106 P1114 R1139 V1140	V1047-Y1117 HydrophobicContact CG1-CD1 3.95Å; V1047-Y1117 HydrophobicContact CG1-CG 4.33Å; E1048-Y1117 CarbonylContact O-C 3.55Å; E1048-Y1117 VanDerWaalsContact O-CA 3.31Å; E1048-Y1117 WeakPolarHBondContact O-CA 3.38Å; D1049-Y1117 WeakPolarHBondContact OD1-CD1 3.4Å; D1049-Y1117 WeakPolarHBondContact OD1-CE1 3.44Å; P1090-Y1117 HydrophobicContact CG-CE1 4.36Å; F1091-Y1117 AromaticContact CE2-CD1 3.79Å; F1091-Y1117 HydrophobicContact CE2-CD1 3.79Å; F1091-Y1117 AromaticContact CE2-CD2 3.62Å; F1091-Y1117 HydrophobicContact CE2-CD2 3.62Å; F1091-Y1117 HydrophobicContact CE2-CE1 4.25Å; F1091-Y1117 HydrophobicContact CE2-CE2 4.12Å; F1091-Y1117 AromaticContact CE2-CG 3.41Å; F1091-Y1117 HydrophobicContact CE2-CG 3.41Å; F1091-Y1117 VanDerWaalsContact CE2-CG 3.41Å; F1091-Y1117 HydrophobicContact CZ-CD1 4.48Å; F1091-Y1117 AromaticContact CZ-CD2 3.47Å; F1091-Y1117 HydrophobicContact CZ-CD2 3.47Å; F1091-Y1117 VanDerWaalsContact CZ-CD2 3.47Å; F1091-Y1117 HydrophobicContact CZ-CE2 4.01Å; F1091-Y1117 AromaticContact CZ-CG 3.73Å; F1091-Y1117 HydrophobicContact CZ-CG 3.73Å; L1106-Y1117 HydrophobicContact CD1-CE2 4.1Å; L1106-Y1117 HydrophobicContact CD2-CE2 3.81Å; L1106-Y1117 VanDerWaalsContact CD2-OH 3.28Å; L1106-Y1117 WeakPolarHBondContact CD2-OH 3.48Å; P1114-Y1117 HydrophobicContact CB-CE1 4.41Å; P1114-Y1117 HydrophobicContact CG-CD1 4.21Å; P1114-Y1117 HydrophobicContact CG-CE1 3.42Å; P1114-Y1117 VanDerWaalsContact CG-CE1 3.42Å; P1114-Y1117 HydrophobicContact CG-CE2 4.21Å; P1114-Y1117 VanDerWaalsContact CG-CZ 3.43Å; P1114-Y1117 WeakPolarHBondContact CG-OH 3.47Å; Y1117-R1139 CarbonylContact O-C 3.53Å; Y1117-R1139 WeakPolarHBondContact O-CA 3.49Å; Y1117-V1140 PolarHBondContact N-O 3.43Å; Y1117-V1140 PolarHBondContact O-N 2.82Å
1118	M	87	Confident	77.8	Confident	42 Å²	42	57 Å²	57	21%	0.207	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	107.3	173.4	-65.6	-62.9	-60.5	0	0	109.4	V1047 E1048 V1137 I1138 R1139	V1047-M1118 CarbonylContact C-O 3.54Å; V1047-M1118 VanDerWaalsContact CA-O 3.28Å; V1047-M1118 WeakPolarHBondContact CA-O 3.4Å; E1048-M1118 HydrophobicContact CB-CB 4.19Å; E1048-M1118 PolarHBondContact N-O 3.08Å; E1048-M1118 PolarHBondContact O-N 2.74Å; M1118-V1137 HydrophobicContact CE-CG1 3.54Å; M1118-I1138 CarbonylContact C-O 3.53Å; M1118-I1138 WeakPolarHBondContact CA-O 3.34Å; M1118-R1139 HydrophobicContact CE-CB 4.42Å; M1118-R1139 HydrophobicContact SD-CB 3.55Å; M1118-R1139 VanDerWaalsContact SD-CB 3.55Å; M1118-R1139 HydrophobicContact SD-CG 3.55Å; M1118-R1139 VanDerWaalsContact SD-CG 3.55Å
1119	L	89.8	Confident	78.1	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.1	179.3	-72.4	65.4	0	0	0	109.1	F1025 L1044 V1047 F1091 V1137 I1138 V1140	F1025-L1119 HydrophobicContact CE1-CD2 4.44Å; F1025-L1119 HydrophobicContact CZ-CD2 4.37Å; L1044-L1119 HydrophobicContact CD1-CB 4.14Å; L1044-L1119 HydrophobicContact CD1-CG 4.35Å; V1047-L1119 HydrophobicContact CG1-CD1 4.18Å; V1047-L1119 HydrophobicContact CG1-CG 4.47Å; V1047-L1119 HydrophobicContact CG2-CG 4.23Å; F1091-L1119 HydrophobicContact CB-CD2 4Å; F1091-L1119 HydrophobicContact CB-CG 4.47Å; F1091-L1119 HydrophobicContact CD1-CD1 4.41Å; F1091-L1119 HydrophobicContact CD1-CD2 3.96Å; F1091-L1119 HydrophobicContact CD2-CD1 4.09Å; F1091-L1119 HydrophobicContact CD2-CG 4.34Å; F1091-L1119 HydrophobicContact CE1-CD1 4.42Å; F1091-L1119 HydrophobicContact CE2-CD1 4.1Å; F1091-L1119 HydrophobicContact CG-CD1 4.24Å; F1091-L1119 HydrophobicContact CG-CD2 3.89Å; F1091-L1119 HydrophobicContact CG-CG 4.21Å; F1091-L1119 HydrophobicContact CZ-CD1 4.27Å; L1119-V1137 CarbonylContact O-C 3.55Å; L1119-V1137 VanDerWaalsContact O-CA 3.31Å; L1119-V1137 WeakPolarHBondContact O-CA 3.16Å; L1119-I1138 PolarHBondContact N-O 2.82Å; L1119-I1138 PolarHBondContact O-N 3.01Å; L1119-V1140 HydrophobicContact CD1-CB 4.12Å; L1119-V1140 HydrophobicContact CD1-CG2 3.72Å; L1119-V1140 HydrophobicContact CD2-CG2 4.3Å
1120	R	90.1	Very high	78.8	Confident	94 Å²	94	61.3 Å²	61.3	36%	0.355	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.1	169.6	-178.2	-175.1	-70.5	-85	1.3	109.5	L1045 Q1046 L1136 V1137	L1045-R1120 HydrophobicContact CB-CG 4.32Å; L1045-R1120 WeakPolarHBondContact CB-O 3.49Å; L1045-R1120 HydrophobicContact CD1-CG 4.18Å; L1045-R1120 PolarHBondContact N-O 3.3Å; Q1046-R1120 HydrophobicContact CB-CB 4.16Å; Q1046-R1120 PolarHBondContact N-O 2.84Å; Q1046-R1120 PolarHBondContact O-N 2.88Å; R1120-L1136 CarbonylContact C-O 3.48Å; R1120-L1136 WeakPolarHBondContact CA-O 3.15Å; R1120-V1137 HydrophobicContact CB-CG2 4.36Å; R1120-V1137 HydrophobicContact CG-CG2 4.14Å
1121	I	90.3	Very high	80.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.6	-175.8	-55.1	172.8	0	0	0	109.3	F1025 I1027 K1043 L1044 V1093 T1135 L1136	F1025-I1121 HydrophobicContact CE2-CD1 3.87Å; F1025-I1121 HydrophobicContact CZ-CD1 3.75Å; I1027-I1121 HydrophobicContact CD1-CB 4.2Å; I1027-I1121 HydrophobicContact CD1-CD1 3.86Å; I1027-I1121 HydrophobicContact CD1-CG2 3.57Å; K1043-I1121 CarbonylContact O-C 3.57Å; K1043-I1121 WeakPolarHBondContact O-CA 3.3Å; K1043-I1121 WeakPolarHBondContact O-CG2 3.35Å; L1044-I1121 HydrophobicContact CD1-CD1 4.31Å; L1044-I1121 HydrophobicContact CD1-CG1 3.64Å; V1093-I1121 HydrophobicContact CG1-CG2 4.44Å; I1121-T1135 CarbonylContact O-C 3.47Å; I1121-T1135 WeakPolarHBondContact O-CA 3.47Å; I1121-L1136 PolarHBondContact N-O 3.37Å; I1121-L1136 PolarHBondContact O-N 2.66Å
1122	L	91.7	Very high	81.7	Confident	27 Å²	27	54 Å²	54	14%	0.141	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	139.9	173.1	-168.4	69.6	0	0	0	109.4	Y1042 K1043 L1045 Y1124 N1133 T1135	Y1042-L1122 CarbonylContact C-O 3.59Å; Y1042-L1122 VanDerWaalsContact CA-O 3.3Å; Y1042-L1122 WeakPolarHBondContact CA-O 3.39Å; K1043-L1122 HydrophobicContact CB-CB 4.36Å; K1043-L1122 PolarHBondContact N-O 2.84Å; K1043-L1122 PolarHBondContact O-N 3.31Å; L1045-L1122 HydrophobicContact CD1-CB 3.99Å; L1045-L1122 HydrophobicContact CD1-CD1 4.37Å; L1045-L1122 HydrophobicContact CD2-CB 4.1Å; L1045-L1122 HydrophobicContact CD2-CD2 4.36Å; L1045-L1122 HydrophobicContact CG-CB 3.96Å; L1122-Y1124 HydrophobicContact CD2-CD1 3.63Å; L1122-Y1124 HydrophobicContact CD2-CE1 4.38Å; L1122-Y1124 HydrophobicContact CD2-CG 4.17Å; L1122-Y1124 HydrophobicContact CG-CD1 3.93Å; L1122-N1133 HydrophobicContact CD1-CB 3.78Å; L1122-N1133 WeakPolarHBondContact CD1-OD1 3.35Å; L1122-N1133 HydrophobicContact CG-CB 4.29Å; L1122-T1135 HydrophobicContact CD1-CG2 3.56Å
1123	A	92.4	Very high	83.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.4	155	0	0	0	0	0	107.4	P1000 I1002 I1040 E1041 Y1042 N1133 T1134	P1000-A1123 HydrophobicContact CB-CB 4.48Å; I1002-A1123 HydrophobicContact CD1-CB 3.87Å; I1002-A1123 HydrophobicContact CG1-CB 3.98Å; I1040-A1123 HydrophobicContact CG2-CB 4.13Å; E1041-A1123 WeakPolarHBondContact O-CA 3.16Å; Y1042-A1123 HydrophobicContact CD1-CB 3.81Å; Y1042-A1123 HydrophobicContact CE1-CB 3.82Å; A1123-N1133 CarbonylContact O-C 3.56Å; A1123-N1133 VanDerWaalsContact O-CA 3.25Å; A1123-N1133 WeakPolarHBondContact O-CA 3.5Å; A1123-N1133 WeakPolarHBondContact O-CB 3.04Å; A1123-T1134 PolarHBondContact N-O 2.82Å; A1123-T1134 PolarHBondContact O-N 2.93Å
1124	Y	92.8	Very high	84.7	Confident	38 Å²	38	50.9 Å²	50.9	15%	0.149	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.2	-176.7	62.1	-81.3	0	0	0	109.9	I1040 E1041 K1043 R1095 L1122 L1132	I1040-Y1124 CarbonylContact C-O 3.56Å; I1040-Y1124 WeakPolarHBondContact CA-O 3.3Å; E1041-Y1124 HydrophobicContact CB-CD2 4.47Å; E1041-Y1124 HydrophobicContact CB-CE1 3.92Å; E1041-Y1124 HydrophobicContact CB-CE2 3.81Å; E1041-Y1124 VanDerWaalsContact CB-CZ 3.49Å; E1041-Y1124 WeakPolarHBondContact CB-OH 3.45Å; E1041-Y1124 PolarHBondContact N-O 2.75Å; E1041-Y1124 PolarHBondContact O-N 2.81Å; E1041-Y1124 WeakPolarHBondContact OE2-CE2 3.5Å; E1041-Y1124 VanDerWaalsContact OE2-CZ 3.31Å; E1041-Y1124 PolarHBondContact OE2-OH 3.42Å; K1043-Y1124 HydrophobicContact CB-CE1 3.97Å; R1095-Y1124 PolarHBondContact NE-OH 2.84Å; L1122-Y1124 HydrophobicContact CD2-CD1 3.63Å; L1122-Y1124 HydrophobicContact CD2-CE1 4.38Å; L1122-Y1124 HydrophobicContact CD2-CG 4.17Å; L1122-Y1124 HydrophobicContact CG-CD1 3.93Å; Y1124-L1132 WeakPolarHBondContact CA-O 3.5Å
1125	D	92.5	Very high	85.7	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.267	C	S	.	.			trans	-79.4	-168.1	178.8	62.3	40.3	0	0	0	112.7	N996 P1000 N1037 T1039 G1127 S1131 L1132	N996-D1125 PolarHBondContact ND2-OD2 3.28Å; N996-D1125 PolarHBondContact OD1-OD2 3.21Å; P1000-D1125 HydrophobicContact CG-CB 4.02Å; N1037-D1125 WeakPolarHBondContact O-CB 3.28Å; T1039-D1125 CarbonylContact O-C 3.6Å; T1039-D1125 WeakPolarHBondContact O-CA 3.34Å; D1125-G1127 PolarHBondContact OD1-N 2.84Å; D1125-S1131 PolarHBondContact O-OG 2.9Å; D1125-S1131 WeakPolarHBondContact OD1-CA 3.28Å; D1125-S1131 WeakPolarHBondContact OD1-CB 3.19Å; D1125-S1131 PolarHBondContact OD1-OG 3.2Å; D1125-L1132 PolarHBondContact N-O 3.32Å; D1125-L1132 VanDerWaalsContact N-O 3.1Å; D1125-L1132 PolarHBondContact OD1-N 3.49Å; D1125-L1132 VanDerWaalsContact OD2-CA 3.31Å; D1125-L1132 WeakPolarHBondContact OD2-CA 3.41Å; D1125-L1132 VanDerWaalsContact OD2-CB 3.24Å; D1125-L1132 WeakPolarHBondContact OD2-CB 3.04Å; D1125-L1132 PolarHBondContact OD2-N 3.26Å
1126	L	89.8	Confident	86.5	Confident	56 Å²	56	44.7 Å²	44.7	29%	0.293	24%	0.236	S	C	.	.			trans	-116.4	16.4	166.8	-64.7	-178.9	0	0	0	112.9	E1036 T1039 E1041 K1128	E1036-L1126 HydrophobicContact CB-CB 4.26Å; E1036-L1126 CarbonylContact O-C 3.58Å; E1036-L1126 WeakPolarHBondContact O-CA 3.3Å; E1036-L1126 WeakPolarHBondContact O-CB 3.28Å; E1036-L1126 PolarHBondContact O-N 2.91Å; E1036-L1126 VanDerWaalsContact O-N 3.17Å; T1039-L1126 HydrophobicContact CG2-CD1 3.63Å; T1039-L1126 HydrophobicContact CG2-CG 4.19Å; T1039-L1126 PolarHBondContact O-N 2.85Å; E1041-L1126 HydrophobicContact CG-CD2 4.08Å; E1041-L1126 HydrophobicContact CG-CG 4.46Å; L1126-K1128 PolarHBondContact O-NZ 3.18Å; L1126-K1128 VanDerWaalsContact O-NZ 3.11Å
1127	G	80.9	Confident	87	Confident	5 Å²	5	45.4 Å²	45.4	5%	0.052	24%	0.24	C	C	.	.			trans	-66	157	-174.3	0	0	0	0	0	113.8	E1036 N1037 D1125	E1036-G1127 PolarHBondContact O-N 3.01Å; N1037-G1127 WeakPolarHBondContact OD1-CA 3.39Å; D1125-G1127 PolarHBondContact OD1-N 2.84Å
1128	K	75.2	Confident	87.1	Confident	124 Å²	124	44.5 Å²	44.5	54%	0.539	24%	0.237	S	C	.	.	S	Bend	trans	-140.2	139.6	-176.9	-60.7	179	-165.2	63.6	0	109.7	E1036 L1126	E1036-K1128 IonicContact OE1-NZ 3.86Å; E1036-K1128 PolarHBondContact OE1-NZ 3.25Å; E1036-K1128 IonicContact OE2-NZ 2.71Å; E1036-K1128 PolarHBondContact OE2-NZ 3.43Å; L1126-K1128 PolarHBondContact O-NZ 3.18Å; L1126-K1128 VanDerWaalsContact O-NZ 3.11Å
1129	P	70.3	Confident	87.2	Confident	119 Å²	119	45.6 Å²	45.6	77%	0.773	24%	0.238	S	C	*	.	S	Bend	cis	-79.2	-30.9	11	30.8	-35.9	0	0	0	114.9
1130	D	78.1	Confident	87	Confident	122 Å²	122	45.6 Å²	45.6	65%	0.652	24%	0.239	S	C	*	.	S	Bend	trans	-107.1	127.3	-176.5	-72.5	-58.1	0	0	0	110.8	N996	N996-D1130 PolarHBondContact ND2-O 2.84Å
1131	S	85.2	Confident	86.5	Confident	49 Å²	49	41.6 Å²	41.6	34%	0.343	23%	0.226	S	C	.	.			trans	-92.8	119.4	177.1	174.2	0	0	0	0	111.1	D1125 N1133	D1125-S1131 PolarHBondContact O-OG 2.9Å; D1125-S1131 WeakPolarHBondContact OD1-CA 3.28Å; D1125-S1131 WeakPolarHBondContact OD1-CB 3.19Å; D1125-S1131 PolarHBondContact OD1-OG 3.2Å; S1131-N1133 PolarHBondContact O-ND2 3.36Å
1132	L	88.5	Confident	85.9	Confident	49 Å²	49	42.2 Å²	42.2	26%	0.257	23%	0.228	S	C	.	.			trans	-84	151.6	-179.1	-56.3	174.8	0	0	0	110.4	N998 A999 P1000 Y1124 D1125	N998-L1132 VanDerWaalsContact O-CD1 3.22Å; N998-L1132 WeakPolarHBondContact O-CD1 3.3Å; A999-L1132 HydrophobicContact CB-CB 3.86Å; P1000-L1132 WeakPolarHBondContact CD-O 3.46Å; Y1124-L1132 WeakPolarHBondContact CA-O 3.5Å; D1125-L1132 PolarHBondContact N-O 3.32Å; D1125-L1132 VanDerWaalsContact N-O 3.1Å; D1125-L1132 PolarHBondContact OD1-N 3.49Å; D1125-L1132 VanDerWaalsContact OD2-CA 3.31Å; D1125-L1132 WeakPolarHBondContact OD2-CA 3.41Å; D1125-L1132 VanDerWaalsContact OD2-CB 3.24Å; D1125-L1132 WeakPolarHBondContact OD2-CB 3.04Å; D1125-L1132 PolarHBondContact OD2-N 3.26Å
1133	N	90.2	Very high	84.7	Confident	86 Å²	86	45 Å²	45	46%	0.46	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	154.4	-169.1	62.6	88.9	0	0	0	114.6	L1122 A1123 S1131	L1122-N1133 HydrophobicContact CD1-CB 3.78Å; L1122-N1133 WeakPolarHBondContact CD1-OD1 3.35Å; L1122-N1133 HydrophobicContact CG-CB 4.29Å; A1123-N1133 CarbonylContact O-C 3.56Å; A1123-N1133 VanDerWaalsContact O-CA 3.25Å; A1123-N1133 WeakPolarHBondContact O-CA 3.5Å; A1123-N1133 WeakPolarHBondContact O-CB 3.04Å; S1131-N1133 PolarHBondContact O-ND2 3.36Å
1134	T	88.6	Confident	83	Confident	44 Å²	44	49.7 Å²	49.7	27%	0.27	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.3	177.3	-66	0	0	0	0	109.6	P1000 I1002 A1123	P1000-T1134 WeakPolarHBondContact O-CB 3.26Å; P1000-T1134 PolarHBondContact O-OG1 2.7Å; I1002-T1134 HydrophobicContact CD1-CG2 3.83Å; I1002-T1134 HydrophobicContact CG1-CG2 3.95Å; A1123-T1134 PolarHBondContact N-O 2.82Å; A1123-T1134 PolarHBondContact O-N 2.93Å
1135	T	89.5	Confident	80.7	Confident	60 Å²	60	51.5 Å²	51.5	37%	0.368	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	148.3	175.6	55.8	0	0	0	0	113.2	L1045 I1121 L1122	L1045-T1135 HydrophobicContact CD1-CG2 4.08Å; I1121-T1135 CarbonylContact O-C 3.47Å; I1121-T1135 WeakPolarHBondContact O-CA 3.47Å; L1122-T1135 HydrophobicContact CD1-CG2 3.56Å
1136	L	89.2	Confident	77.8	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.8	-178.7	-178.8	64	0	0	0	108.9	I1002 P1005 N1007 I1027 R1120 I1121 I1138	I1002-L1136 HydrophobicContact CD1-CB 3.73Å; I1002-L1136 HydrophobicContact CD1-CD2 4.4Å; I1002-L1136 HydrophobicContact CG2-CD1 4.4Å; I1002-L1136 HydrophobicContact CG2-CD2 4.2Å; P1005-L1136 HydrophobicContact CG-CD2 4.29Å; N1007-L1136 HydrophobicContact CB-CD1 4.2Å; I1027-L1136 HydrophobicContact CD1-CD2 3.86Å; I1027-L1136 HydrophobicContact CG1-CD2 3.83Å; I1027-L1136 HydrophobicContact CG2-CD2 4.04Å; R1120-L1136 CarbonylContact C-O 3.48Å; R1120-L1136 WeakPolarHBondContact CA-O 3.15Å; I1121-L1136 PolarHBondContact N-O 3.37Å; I1121-L1136 PolarHBondContact O-N 2.66Å; L1136-I1138 HydrophobicContact CD1-CD1 4.48Å; L1136-I1138 HydrophobicContact CD1-CG1 4.45Å; L1136-I1138 HydrophobicContact CD2-CD1 3.71Å; L1136-I1138 HydrophobicContact CD2-CG1 4.49Å; L1136-I1138 HydrophobicContact CG-CD1 3.85Å; L1136-I1138 HydrophobicContact CG-CG1 4.1Å
1137	V	89	Confident	74.8	Confident	15 Å²	15	61 Å²	61	9%	0.091	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	130.4	178.2	177.6	0	0	0	0	108.8	N1007 H1008 M1118 L1119 R1120	N1007-V1137 PolarHBondContact OD1-N 2.76Å; N1007-V1137 PolarHBondContact OD1-O 3.47Å; H1008-V1137 VanDerWaalsContact CA-O 3.26Å; H1008-V1137 WeakPolarHBondContact CA-O 3.38Å; H1008-V1137 PolarHBondContact N-O 3.41Å; M1118-V1137 HydrophobicContact CE-CG1 3.54Å; L1119-V1137 CarbonylContact O-C 3.55Å; L1119-V1137 VanDerWaalsContact O-CA 3.31Å; L1119-V1137 WeakPolarHBondContact O-CA 3.16Å; R1120-V1137 HydrophobicContact CB-CG2 4.36Å; R1120-V1137 HydrophobicContact CG-CG2 4.14Å
1138	I	88	Confident	72.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	138.7	-172.7	-70.9	166.5	0	0	0	109.9	P1005 F1011 F1025 M1118 L1119 L1136 V1140	P1005-I1138 HydrophobicContact CG-CD1 3.57Å; P1005-I1138 HydrophobicContact CG-CG1 4.42Å; F1011-I1138 HydrophobicContact CD2-CG2 3.48Å; F1011-I1138 VanDerWaalsContact CD2-CG2 3.48Å; F1011-I1138 HydrophobicContact CE2-CD1 4.47Å; F1011-I1138 HydrophobicContact CE2-CG2 3.64Å; F1025-I1138 HydrophobicContact CD1-CD1 4.28Å; F1025-I1138 HydrophobicContact CD1-CG2 4.27Å; F1025-I1138 HydrophobicContact CD2-CD1 3.91Å; F1025-I1138 HydrophobicContact CE1-CB 4.39Å; F1025-I1138 HydrophobicContact CE1-CD1 3.79Å; F1025-I1138 HydrophobicContact CE1-CG2 3.69Å; F1025-I1138 HydrophobicContact CE2-CD1 3.33Å; F1025-I1138 HydrophobicContact CG-CD1 4.36Å; F1025-I1138 HydrophobicContact CZ-CB 4.37Å; F1025-I1138 HydrophobicContact CZ-CD1 3.27Å; F1025-I1138 HydrophobicContact CZ-CG1 4.41Å; F1025-I1138 HydrophobicContact CZ-CG2 4.16Å; M1118-I1138 CarbonylContact C-O 3.53Å; M1118-I1138 WeakPolarHBondContact CA-O 3.34Å; L1119-I1138 PolarHBondContact N-O 2.82Å; L1119-I1138 PolarHBondContact O-N 3.01Å; L1136-I1138 HydrophobicContact CD1-CD1 4.48Å; L1136-I1138 HydrophobicContact CD1-CG1 4.45Å; L1136-I1138 HydrophobicContact CD2-CD1 3.71Å; L1136-I1138 HydrophobicContact CD2-CG1 4.49Å; L1136-I1138 HydrophobicContact CG-CD1 3.85Å; L1136-I1138 HydrophobicContact CG-CG1 4.1Å; I1138-V1140 HydrophobicContact CG2-CG2 4.23Å
1139	R	88.1	Confident	70.2	Confident	65 Å²	65	65.9 Å²	65.9	25%	0.245	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	137	172.8	-166.7	161.6	-178.2	-92.9	-2.3	110.3	V1009 E1010 F1011 D1050 A1116 Y1117 M1118	V1009-R1139 PolarHBondContact O-N 2.72Å; E1010-R1139 CarbonylContact C-O 3.54Å; E1010-R1139 VanDerWaalsContact CA-O 3.29Å; E1010-R1139 WeakPolarHBondContact CA-O 3.47Å; E1010-R1139 HydrophobicContact CB-CB 4.14Å; E1010-R1139 HydrophobicContact CG-CB 4.12Å; E1010-R1139 HydrophobicContact CG-CG 4.25Å; E1010-R1139 IonicContact OE1-NH1 3.13Å; E1010-R1139 PolarHBondContact OE1-NH1 3.2Å; E1010-R1139 WeakPolarHBondContact OE2-CD 3.39Å; E1010-R1139 IonicContact OE2-CZ 2.6Å; E1010-R1139 IonicContact OE2-NH1 2.66Å; E1010-R1139 PolarHBondContact OE2-NH1 2.93Å; F1011-R1139 PolarHBondContact N-O 3.08Å; D1050-R1139 IonicContact OD1-NE 3.98Å; D1050-R1139 IonicContact OD1-NH2 2.7Å; D1050-R1139 IonicContact OD2-CZ 2.95Å; D1050-R1139 IonicContact OD2-NH2 2.71Å; D1050-R1139 PolarHBondContact OD2-NH2 2.86Å; A1116-R1139 HydrophobicContact CB-CG 4.2Å; Y1117-R1139 CarbonylContact O-C 3.53Å; Y1117-R1139 WeakPolarHBondContact O-CA 3.49Å; M1118-R1139 HydrophobicContact CE-CB 4.42Å; M1118-R1139 HydrophobicContact SD-CB 3.55Å; M1118-R1139 VanDerWaalsContact SD-CB 3.55Å; M1118-R1139 HydrophobicContact SD-CG 3.55Å; M1118-R1139 VanDerWaalsContact SD-CG 3.55Å
1140	V	86.6	Confident	68.2	Low	1 Å²	1	67.2 Å²	67.2	1%	0.006	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	111.4	175	-179.7	0	0	0	0	108.7	F1011 L1013 I1024 F1091 A1116 Y1117 L1119 I1138	F1011-V1140 CarbonylContact O-C 3.54Å; F1011-V1140 WeakPolarHBondContact O-CA 3.4Å; L1013-V1140 HydrophobicContact CD1-CG1 3.63Å; L1013-V1140 HydrophobicContact CD2-CG1 4.49Å; L1013-V1140 HydrophobicContact CG-CG1 3.78Å; I1024-V1140 HydrophobicContact CD1-CG1 4.34Å; I1024-V1140 HydrophobicContact CG2-CG1 4.39Å; I1024-V1140 HydrophobicContact CG2-CG2 4.14Å; F1091-V1140 HydrophobicContact CE1-CB 4.36Å; F1091-V1140 HydrophobicContact CE1-CG1 3.97Å; F1091-V1140 HydrophobicContact CZ-CB 4.39Å; F1091-V1140 HydrophobicContact CZ-CG1 4.2Å; A1116-V1140 CarbonylContact C-O 3.53Å; A1116-V1140 WeakPolarHBondContact CA-O 3.22Å; A1116-V1140 WeakPolarHBondContact CB-O 3.37Å; Y1117-V1140 PolarHBondContact N-O 3.43Å; Y1117-V1140 PolarHBondContact O-N 2.82Å; L1119-V1140 HydrophobicContact CD1-CB 4.12Å; L1119-V1140 HydrophobicContact CD1-CG2 3.72Å; L1119-V1140 HydrophobicContact CD2-CG2 4.3Å; I1138-V1140 HydrophobicContact CG2-CG2 4.23Å
1141	A	80.4	Confident	65.9	Low	10 Å²	10	66.3 Å²	66.3	8%	0.083	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	150.8	-171	0	0	0	0	0	112.8	E1010 F1011 M1012 L1013 A1116	E1010-A1141 HydrophobicContact CG-CB 4.44Å; E1010-A1141 VanDerWaalsContact OE1-CB 3.31Å; E1010-A1141 WeakPolarHBondContact OE1-CB 3.36Å; F1011-A1141 PolarHBondContact O-N 3Å; M1012-A1141 CarbonylContact C-O 3.56Å; M1012-A1141 WeakPolarHBondContact CA-O 3.37Å; L1013-A1141 PolarHBondContact N-O 3.17Å; A1116-A1141 HydrophobicContact CB-CB 3.8Å
1142	R	77.9	Confident	63.1	Low	13 Å²	13	71.8 Å²	71.8	5%	0.049	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.3	176.5	-61.8	-170.9	-75.1	150.4	3.1	110.8	L1018 P1107 L1109 G1113 P1114 R1115	L1018-R1142 HydrophobicContact CD2-CG 4.12Å; P1107-R1142 PolarHBondContact O-NH1 3.48Å; L1109-R1142 HydrophobicContact CD1-CB 4.18Å; L1109-R1142 HydrophobicContact CD2-CB 4.2Å; L1109-R1142 HydrophobicContact CG-CB 4.26Å; G1113-R1142 VanDerWaalsContact C-NH2 3.34Å; G1113-R1142 PolarHBondContact O-NH2 3.13Å; P1114-R1142 VanDerWaalsContact O-CZ 3.3Å; P1114-R1142 PolarHBondContact O-NE 2.85Å; P1114-R1142 VanDerWaalsContact O-NE 3.08Å; P1114-R1142 PolarHBondContact O-NH2 2.81Å; R1115-R1142 PolarHBondContact O-N 3.42Å
1143	Q	66.4	Low	60.3	Low	86 Å²	86	72.6 Å²	72.6	40%	0.402	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-67.3	128.5	-172.5	-176.8	179.5	25.6	0	0	114.1	M1012 L1013 L1109	M1012-Q1143 HydrophobicContact CE-CB 3.98Å; M1012-Q1143 HydrophobicContact CE-CG 3.73Å; L1013-Q1143 PolarHBondContact O-N 3.11Å; L1109-Q1143 WeakPolarHBondContact CD1-O 3.19Å
1144	V	55.8	Low	57.4	Low	98 Å²	98	76.4 Å²	76.4	59%	0.594	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-102.1	149.9	175.6	-177.2	0	0	0	0	111	L1109	L1109-V1144 HydrophobicContact CD1-CG2 4.38Å
1145	G	43.9	Very low	54.5	Low	75 Å²	75	80.2 Å²	80.2	77%	0.773	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-62.2	149.1	-179.7	0	0	0	0	0	114.7
1146	S	31.3	Very low	51.7	Low	104 Å²	104	87.3 Å²	87.3	73%	0.727	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-77.6	138.3	-165.7	55.3	0	0	0	0	116
1147	N	28.7	Very low	48.6	Very low	153 Å²	153	91.7 Å²	91.7	82%	0.818	54%	0.539	S	S	*	.				172.3	153.9	117.5	-85.6	-16.8	0	0	0	112
1148	A	30.8	Very low	45.8	Very low	90 Å²	90	96.9 Å²	96.9	74%	0.744	57%	0.566	S	S	*	*			trans	59.3	129.4	177.2	0	0	0	0	0	115.2
1149	D	28.4	Very low	42.8	Very low	140 Å²	140	107 Å²	107	75%	0.749	60%	0.604	S	S	*	*			cis	134.1	110.8	9.7	-97.7	-44	0	0	0	106.4
1150	I	27.5	Very low	40	Very low	147 Å²	147	111.8 Å²	111.8	75%	0.754	63%	0.632	S	S	*	*			trans	39.2	109.1	136.2	-50.1	167.7	0	0	0	117.3
1151	S	29.3	Very low	37.3	Very low	103 Å²	103	118.5 Å²	118.5	72%	0.72	67%	0.669	S	S	*	*				-172.7	127.5	121	33.5	0	0	0	0	116.2
1152	N	27.5	Very low	34.8	Very low	165 Å²	165	123 Å²	123	88%	0.882	71%	0.705	S	S	*	*			trans	52.1	116.3	136.8	-55	-22.9	0	0	0	122
1153	G	28.4	Very low	32.3	Very low	66 Å²	66	131 Å²	131	68%	0.68	74%	0.741	S	S	*	*			trans	161.5	138.2	138.9	0	0	0	0	0	116.3
1154	I	29.9	Very low	30.4	Very low	165 Å²	165	134.1 Å²	134.1	85%	0.846	76%	0.755	S	S	*	*			trans	68.9	125.7	147.9	-60.5	170.2	0	0	0	116.2
1155	L	28.1	Very low	28.9	Very low	125 Å²	125	139.5 Å²	139.5	65%	0.654	77%	0.766	S	S	*	*			cis	-157	171.1	-5.8	-118.5	177	0	0	0	111.2
1156	Y	29.8	Very low	28	Very low	209 Å²	209	147.7 Å²	147.7	82%	0.82	77%	0.774	S	S	*	*			trans	59.3	95.4	169.3	-65	-61.5	0	0	0	119.9
1157	S	25.9	Very low	27.8	Very low	96 Å²	96	150.5 Å²	150.5	67%	0.671	78%	0.775	S	S	*	*			trans	-109.6	176.1	164	53	0	0	0	0	111.2
1158	N	28.9	Very low	27.7	Very low	123 Å²	123	149.2 Å²	149.2	66%	0.658	78%	0.775	S	S	*	*			trans	106.7	141.3	159.7	-58.6	-58.5	0	0	0	117.8
1159	R	25.7	Very low	27.6	Very low	213 Å²	213	148 Å²	148	80%	0.804	77%	0.771	S	S	*	*			cis	-177.8	116.7	-28.9	-119.2	-178	-170.3	173.6	1	107.8
1160	I	29.4	Very low	27.5	Very low	165 Å²	165	151.7 Å²	151.7	85%	0.846	78%	0.775	S	S	*	*			trans	-139.3	103.2	144.6	-62.2	-171.5	0	0	0	108.8
1161	N	29	Very low	27.5	Very low	143 Å²	143	151.3 Å²	151.3	77%	0.765	77%	0.773	S	S	*	*			trans	20.7	109.8	152.2	-56.4	-11.7	0	0	0	119.1
1162	A	28.3	Very low	27.4	Very low	103 Å²	103	154.8 Å²	154.8	85%	0.851	78%	0.778	S	S	*	*			trans	-70.6	141.4	158.5	0	0	0	0	0	111.8
1163	K	26.6	Very low	27.2	Very low	183 Å²	183	151.8 Å²	151.8	80%	0.796	77%	0.766	S	S	*	*			trans	-144.4	150	145	-87.4	-167.7	168.6	-109.5	0	107.1
1164	E	25.3	Very low	27	Very low	150 Å²	150	156.1 Å²	156.1	70%	0.701	77%	0.768	S	S	*	*			cis	177.5	123.5	-13.5	175.9	163.8	-160.8	0	0	102.5	R1166	E1164-R1166 PolarHBondContact O-N 2.64Å
1165	Y	24.1	Very low	26.7	Very low	211 Å²	211	155.1 Å²	155.1	83%	0.827	76%	0.76	S	S	*	*			trans	-40.3	129.5	-173	-88.2	-114.1	0	0	0	115.5
1166	R	26.1	Very low	26.6	Very low	247 Å²	247	159 Å²	159	93%	0.932	77%	0.767	S	S	*	*			trans	-153.5	99.7	140	-111.5	169.7	-162	-167.3	3.8	112.9	E1164	E1164-R1166 PolarHBondContact O-N 2.64Å
1167	Q	26.1	Very low	26.5	Very low	163 Å²	163	155.8 Å²	155.8	76%	0.762	76%	0.763	S	S	*	*			trans	-65.8	165.7	147.9	-70.2	-178.8	-0.2	0	0	109
1168	P	26.9	Very low	26.4	Very low	126 Å²	126	160.5 Å²	160.5	82%	0.818	77%	0.772	S	S	*	*			cis	-98.1	171.7	12	39.9	-35.2	0	0	0	113.7
1169	G	27.6	Very low	26.5	Very low	64 Å²	64	160.6 Å²	160.6	66%	0.66	78%	0.78	S	S	*	*			cis	106.7	166.7	7	0	0	0	0	0	113.1
1170	R	27.8	Very low	26.5	Very low	219 Å²	219	155.1 Å²	155.1	83%	0.826	77%	0.774	S	S	*	*			trans	72.4	63.2	-170.5	-157.2	175.1	-168.3	159.8	2	114.2	E1172	R1170-E1172 PolarHBondContact O-N 2.94Å
1171	I	25.7	Very low	26.4	Very low	138 Å²	138	154.8 Å²	154.8	71%	0.708	77%	0.774	S	S	*	*			trans	-56	126.8	162.9	-71.3	170	0	0	0	109.8	T1173	I1171-T1173 PolarHBondContact O-N 3.35Å
1172	E	28.3	Very low	26.4	Very low	177 Å²	177	157.4 Å²	157.4	83%	0.827	78%	0.781	S	S	*	*			trans	17.4	88.3	151.9	-67.4	114.4	-130.8	0	0	117.7	R1170	R1170-E1172 PolarHBondContact O-N 2.94Å
1173	T	23.2	Very low	26.4	Very low	102 Å²	102	160.1 Å²	160.1	63%	0.626	78%	0.776	S	S	*	*			trans	-136.4	147.4	154.3	35.1	0	0	0	0	108.1	I1171	I1171-T1173 PolarHBondContact O-N 3.35Å
1174	Q	23.8	Very low	26.4	Very low	156 Å²	156	157.8 Å²	157.8	73%	0.729	77%	0.772	S	S	*	*			trans	72.1	143.7	177.7	-47.1	-170.4	-80.7	0	0	115.3
1175	Q	24	Very low	26.4	Very low	145 Å²	145	155.8 Å²	155.8	68%	0.678	78%	0.775	S	S	*	*			cis	-166.1	139.2	-28.3	-123.9	158.6	-41.9	0	0	108.3
1176	Y	26.1	Very low	26.6	Very low	206 Å²	206	154.6 Å²	154.6	81%	0.808	78%	0.777	S	S	*	*			trans	44	139.2	138.2	-83.1	-111.8	0	0	0	122.3
1177	L	27.1	Very low	26.8	Very low	141 Å²	141	147.7 Å²	147.7	74%	0.738	77%	0.767	S	S	*	*			trans	80.7	105.8	151.2	-64.9	155.8	0	0	0	119.1
1178	F	25.2	Very low	26.9	Very low	195 Å²	195	147 Å²	147	86%	0.855	77%	0.768	S	S	*	*				0.9	143.7	126.6	-51.9	-80	0	0	0	117.4
1179	P	30	Very low	27	Very low	126 Å²	126	146.3 Å²	146.3	82%	0.818	76%	0.762	S	S	*	*				-140.6	174.9	88.6	39.6	-26.3	0	0	0	116.9
1180	S	26.4	Very low	27.1	Very low	98 Å²	98	152.4 Å²	152.4	69%	0.685	77%	0.77	S	S	*	*			trans	-44.9	146.7	-179.4	51.3	0	0	0	0	120
1181	N	25.8	Very low	27.1	Very low	157 Å²	157	148.3 Å²	148.3	84%	0.84	77%	0.769	S	S	*	*			trans	28.5	124.8	134.8	-50.8	6.1	0	0	0	120.1
1182	E	29.6	Very low	27.2	Very low	198 Å²	198	144.8 Å²	144.8	93%	0.925	77%	0.767	S	S	*	*			trans	-152.6	176.7	135.3	-132.3	163	-151.6	0	0	111.5
1183	H	28.2	Very low	27.3	Very low	160 Å²	160	142.1 Å²	142.1	74%	0.741	76%	0.763	S	S	*	*			trans	-97.9	148.1	-156.7	-94.7	-101.5	0	0	0	116.7
1184	D	26.7	Very low	27.6	Very low	134 Å²	134	147.8 Å²	147.8	72%	0.717	77%	0.773	S	S	*	*			trans	57.1	158	136.8	-55.7	-18.8	0	0	0	125
1185	S	26.6	Very low	27.9	Very low	108 Å²	108	145.8 Å²	145.8	76%	0.755	77%	0.771	S	S	*	*			trans	81.3	89.1	155.3	63.3	0	0	0	0	121.4
1186	E	28	Very low	28.3	Very low	186 Å²	186	144.2 Å²	144.2	87%	0.869	78%	0.777	S	S	*	*				66.4	147.7	109.1	-160.1	166.4	-139.2	0	0	123.1
1187	S	28.6	Very low	28.5	Very low	103 Å²	103	139.7 Å²	139.7	72%	0.72	78%	0.781	S	S	*	*			trans	93.1	118.5	158.4	75.5	0	0	0	0	121.9
1188	D	29.1	Very low	28.7	Very low	148 Å²	148	136.8 Å²	136.8	79%	0.791	79%	0.786	S	S	*	*				84.9	108.9	126.3	-76.5	15.4	0	0	0	127.1
1189	V	29.1	Very low	29	Very low	112 Å²	112	137 Å²	137	68%	0.679	79%	0.79	S	S	*	*				86.8	87.7	118	178.7	0	0	0	0	121.3
1190	K	28.9	Very low	29.1	Very low	192 Å²	192	135.3 Å²	135.3	84%	0.835	79%	0.786	S	S	*	*				70.3	141.7	105.5	-139.3	-179.8	-168.1	169.6	0	122.3
1191	V	28.3	Very low	29.7	Very low	132 Å²	132	142.6 Å²	142.6	80%	0.8	80%	0.799	S	S	*	*			trans	100.7	107.6	152.5	-169.3	0	0	0	0	120
1192	G	29	Very low	30.3	Very low	65 Å²	65	140.9 Å²	140.9	67%	0.67	79%	0.788	S	S	*	*			trans	99.6	158.5	134.7	0	0	0	0	0	119.5
1193	T	30.7	Very low	31.4	Very low	120 Å²	120	134.9 Å²	134.9	74%	0.736	77%	0.768	S	S	*	*			cis	-167.6	135.5	-18.3	20.2	0	0	0	0	112.1
1194	W	28.7	Very low	32.7	Very low	221 Å²	221	133.5 Å²	133.5	84%	0.837	77%	0.766	S	S	*	*			trans	75.8	117.5	142.7	-73.9	47	0	0	0	123.5
1195	T	30.2	Very low	33.9	Very low	114 Å²	114	135.3 Å²	135.3	70%	0.699	77%	0.768	S	S	*	*			trans	54.6	132.4	130.5	68.6	0	0	0	0	121.4
1196	S	31.1	Very low	35.5	Very low	113 Å²	113	133.2 Å²	133.2	79%	0.79	75%	0.75	S	S	*	*				178.3	156.2	64.1	43.7	0	0	0	0	114.5
1197	A	30.7	Very low	37.5	Very low	110 Å²	110	129.5 Å²	129.5	91%	0.909	73%	0.734	S	S	*	*			trans	47.2	121.5	154.7	0	0	0	0	0	122.6
1198	G	32.5	Very low	39.2	Very low	81 Å²	81	129.2 Å²	129.2	84%	0.835	73%	0.728	S	S	*	*			trans	170.2	99.8	163	0	0	0	0	0	113
1199	Q	30.9	Very low	41	Very low	199 Å²	199	126.3 Å²	126.3	93%	0.93	72%	0.715	S	S	*	*			trans	-93.5	162.6	-171.5	-70.4	177.3	-66.2	0	0	114.9
1200	A	31.4	Very low	43	Very low	90 Å²	90	124.9 Å²	124.9	74%	0.744	70%	0.703	S	S	*	*			trans	80.5	85.2	151.4	0	0	0	0	0	119.7
1201	R	39.3	Very low	45.2	Very low	252 Å²	252	120.7 Å²	120.7	95%	0.951	69%	0.689	S	S	*	*				-159.2	130.1	98.1	-99.9	168.9	-174.3	-174.1	0.8	110.4
1202	I	39.7	Very low	47.3	Very low	121 Å²	121	117.1 Å²	117.1	62%	0.621	67%	0.67	S	S	*	*			trans	-92	128.6	-179.9	-66.3	179	0	0	0	107.3	T1206 I1210	I1202-T1206 WeakPolarHBondContact CG2-OG1 3.43Å; I1202-I1210 HydrophobicContact CD1-CD1 4.42Å; I1202-I1210 HydrophobicContact CG2-CD1 4.46Å
1203	S	52.8	Low	49.6	Very low	72 Å²	72	117.2 Å²	117.2	50%	0.503	66%	0.658	S	S	.	*			trans	-86.2	162	178.6	63.6	0	0	0	0	111.5	K1205 T1206 M1207	S1203-K1205 VanDerWaalsContact C-N 3.25Å; S1203-K1205 PolarHBondContact O-N 2.85Å; S1203-T1206 PolarHBondContact N-OG1 2.85Å; S1203-T1206 WeakPolarHBondContact O-CA 3.15Å; S1203-T1206 PolarHBondContact O-N 3.1Å; S1203-T1206 PolarHBondContact O-OG1 3.36Å; S1203-T1206 PolarHBondContact OG-OG1 2.85Å; S1203-M1207 PolarHBondContact O-N 2.95Å; S1203-M1207 VanDerWaalsContact O-N 3.08Å
1204	D	55	Low	51.9	Low	130 Å²	130	114.9 Å²	114.9	70%	0.695	64%	0.643	S	S	*	*	H	α-helix	trans	-59.3	-34.2	-173.1	-55.3	-65	0	0	0	113	T1206 M1207 V1208	D1204-T1206 VanDerWaalsContact C-N 3.27Å; D1204-T1206 PolarHBondContact O-N 3.41Å; D1204-M1207 PolarHBondContact O-N 2.83Å; D1204-V1208 WeakPolarHBondContact O-CG2 3.2Å; D1204-V1208 PolarHBondContact O-N 2.73Å
1205	K	51.9	Low	54.2	Low	172 Å²	172	110.9 Å²	110.9	75%	0.748	63%	0.632	S	S	*	*	H	α-helix	trans	-54.6	-42.2	171.5	-72.8	-168.5	174.8	-172.5	0	112.1	S1203 V1209	S1203-K1205 VanDerWaalsContact C-N 3.25Å; S1203-K1205 PolarHBondContact O-N 2.85Å; K1205-V1209 WeakPolarHBondContact O-CG2 3.14Å; K1205-V1209 PolarHBondContact O-N 2.86Å
1206	T	60	Low	56.4	Low	64 Å²	64	109.7 Å²	109.7	39%	0.393	62%	0.62	S	S	.	*	H	α-helix	trans	-77.3	-26.2	175	29.3	0	0	0	0	114	I1202 S1203 D1204 V1209 I1210	I1202-T1206 WeakPolarHBondContact CG2-OG1 3.43Å; S1203-T1206 PolarHBondContact N-OG1 2.85Å; S1203-T1206 WeakPolarHBondContact O-CA 3.15Å; S1203-T1206 PolarHBondContact O-N 3.1Å; S1203-T1206 PolarHBondContact O-OG1 3.36Å; S1203-T1206 PolarHBondContact OG-OG1 2.85Å; D1204-T1206 VanDerWaalsContact C-N 3.27Å; D1204-T1206 PolarHBondContact O-N 3.41Å; T1206-V1209 PolarHBondContact O-N 2.71Å; T1206-I1210 VanDerWaalsContact O-CG1 3.28Å; T1206-I1210 WeakPolarHBondContact O-CG1 3.18Å; T1206-I1210 PolarHBondContact O-N 3.46Å
1207	M	68.9	Low	58.8	Low	108 Å²	108	109.5 Å²	109.5	53%	0.532	61%	0.61	S	S	.	*	H	α-helix	trans	-66.3	-41.1	169.9	-166.3	-175.5	-170.6	0	0	111.2	S1203 D1204 V1209 I1210 L1211	S1203-M1207 PolarHBondContact O-N 2.95Å; S1203-M1207 VanDerWaalsContact O-N 3.08Å; D1204-M1207 PolarHBondContact O-N 2.83Å; M1207-V1209 PolarHBondContact O-N 2.79Å; M1207-I1210 PolarHBondContact O-N 2.59Å; M1207-L1211 HydrophobicContact CE-CD1 4.33Å; M1207-L1211 HydrophobicContact CG-CD1 4.13Å; M1207-L1211 HydrophobicContact CG-CG 4.45Å; M1207-L1211 WeakPolarHBondContact O-CB 3.44Å; M1207-L1211 WeakPolarHBondContact O-CG 3.12Å; M1207-L1211 PolarHBondContact O-N 2.83Å
1208	V	64.4	Low	61.4	Low	98 Å²	98	109.1 Å²	109.1	59%	0.594	59%	0.592	S	S	*	*	H	α-helix	trans	-61.8	-41.3	174.6	173.6	0	0	0	0	111.3	D1204 L1211 S1212	D1204-V1208 WeakPolarHBondContact O-CG2 3.2Å; D1204-V1208 PolarHBondContact O-N 2.73Å; V1208-L1211 PolarHBondContact O-N 3.28Å; V1208-S1212 WeakPolarHBondContact O-CB 3.43Å; V1208-S1212 PolarHBondContact O-N 3.02Å
1209	V	66.9	Low	63.7	Low	86 Å²	86	109.1 Å²	109.1	52%	0.521	57%	0.573	S	S	.	*	H	α-helix	trans	-64.6	-39.2	174.3	173	0	0	0	0	112.1	K1205 T1206 M1207 T1213	K1205-V1209 WeakPolarHBondContact O-CG2 3.14Å; K1205-V1209 PolarHBondContact O-N 2.86Å; T1206-V1209 PolarHBondContact O-N 2.71Å; M1207-V1209 PolarHBondContact O-N 2.79Å; V1209-T1213 HydrophobicContact CG1-CG2 4.45Å; V1209-T1213 WeakPolarHBondContact O-CB 3.33Å; V1209-T1213 WeakPolarHBondContact O-CG2 3.25Å; V1209-T1213 PolarHBondContact O-N 3.28Å; V1209-T1213 PolarHBondContact O-OG1 3.1Å
1210	I	72	Confident	66	Low	83 Å²	83	104.2 Å²	104.2	43%	0.426	55%	0.552	S	S	.	*	H	α-helix	trans	-66.6	-45.2	175.8	-70.1	164.8	0	0	0	111	I1202 T1206 M1207 T1213 V1214	I1202-I1210 HydrophobicContact CD1-CD1 4.42Å; I1202-I1210 HydrophobicContact CG2-CD1 4.46Å; T1206-I1210 VanDerWaalsContact O-CG1 3.28Å; T1206-I1210 WeakPolarHBondContact O-CG1 3.18Å; T1206-I1210 PolarHBondContact O-N 3.46Å; M1207-I1210 PolarHBondContact O-N 2.59Å; I1210-T1213 WeakPolarHBondContact CA-OG1 3.33Å; I1210-T1213 PolarHBondContact O-N 2.87Å; I1210-T1213 PolarHBondContact O-OG1 2.59Å; I1210-T1213 VanDerWaalsContact O-OG1 3.11Å; I1210-V1214 HydrophobicContact CG2-CG2 4.49Å; I1210-V1214 WeakPolarHBondContact O-CB 3.24Å; I1210-V1214 VanDerWaalsContact O-CG2 3.26Å; I1210-V1214 WeakPolarHBondContact O-CG2 3.42Å; I1210-V1214 PolarHBondContact O-N 3.07Å
1211	L	75.5	Confident	68.3	Low	103 Å²	103	103.3 Å²	103.3	54%	0.539	54%	0.538	S	S	.	.	H	α-helix	trans	-65.5	-39.6	177.1	-69.8	171.1	0	0	0	111.8	M1207 V1208 F1215	M1207-L1211 HydrophobicContact CE-CD1 4.33Å; M1207-L1211 HydrophobicContact CG-CD1 4.13Å; M1207-L1211 HydrophobicContact CG-CG 4.45Å; M1207-L1211 WeakPolarHBondContact O-CB 3.44Å; M1207-L1211 WeakPolarHBondContact O-CG 3.12Å; M1207-L1211 PolarHBondContact O-N 2.83Å; V1208-L1211 PolarHBondContact O-N 3.28Å; L1211-F1215 VanDerWaalsContact O-CB 3.28Å; L1211-F1215 WeakPolarHBondContact O-CB 3.33Å; L1211-F1215 PolarHBondContact O-N 2.86Å
1212	S	72.5	Confident	70.4	Confident	57 Å²	57	94.8 Å²	94.8	40%	0.399	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-51.1	173.9	176.2	0	0	0	0	111.9	V1208 V1214 F1215 I1216	V1208-S1212 WeakPolarHBondContact O-CB 3.43Å; V1208-S1212 PolarHBondContact O-N 3.02Å; S1212-V1214 PolarHBondContact O-N 2.68Å; S1212-F1215 PolarHBondContact O-N 2.93Å; S1212-I1216 WeakPolarHBondContact O-CB 3.11Å; S1212-I1216 VanDerWaalsContact O-CG1 3.3Å; S1212-I1216 WeakPolarHBondContact O-CG1 3.11Å; S1212-I1216 PolarHBondContact O-N 2.88Å
1213	T	75.9	Confident	72.2	Confident	67 Å²	67	92.7 Å²	92.7	41%	0.411	50%	0.503	S	S	.	.	H	α-helix	trans	-66.3	-36.9	179.9	48.5	0	0	0	0	112.5	V1209 I1210 L1217	V1209-T1213 HydrophobicContact CG1-CG2 4.45Å; V1209-T1213 WeakPolarHBondContact O-CB 3.33Å; V1209-T1213 WeakPolarHBondContact O-CG2 3.25Å; V1209-T1213 PolarHBondContact O-N 3.28Å; V1209-T1213 PolarHBondContact O-OG1 3.1Å; I1210-T1213 WeakPolarHBondContact CA-OG1 3.33Å; I1210-T1213 PolarHBondContact O-N 2.87Å; I1210-T1213 PolarHBondContact O-OG1 2.59Å; I1210-T1213 VanDerWaalsContact O-OG1 3.11Å; T1213-L1217 WeakPolarHBondContact O-CB 3.3Å; T1213-L1217 WeakPolarHBondContact O-CG 3.42Å; T1213-L1217 PolarHBondContact O-N 3.17Å
1214	V	80.3	Confident	73.5	Confident	72 Å²	72	92.9 Å²	92.9	44%	0.436	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-41.9	171.5	169.6	0	0	0	0	111.5	I1210 S1212 L1217 L1218	I1210-V1214 HydrophobicContact CG2-CG2 4.49Å; I1210-V1214 WeakPolarHBondContact O-CB 3.24Å; I1210-V1214 VanDerWaalsContact O-CG2 3.26Å; I1210-V1214 WeakPolarHBondContact O-CG2 3.42Å; I1210-V1214 PolarHBondContact O-N 3.07Å; S1212-V1214 PolarHBondContact O-N 2.68Å; V1214-L1217 PolarHBondContact O-N 2.83Å; V1214-L1218 HydrophobicContact CG1-CD1 4.01Å; V1214-L1218 WeakPolarHBondContact O-CB 3.31Å; V1214-L1218 WeakPolarHBondContact O-CG 3.45Å; V1214-L1218 PolarHBondContact O-N 3.44Å
1215	F	75.4	Confident	74.7	Confident	136 Å²	136	91.7 Å²	91.7	60%	0.596	49%	0.494	S	S	*	.	H	α-helix	trans	-65.7	-42.8	176.7	-170	-97.1	0	0	0	111.8	L1211 S1212 L1218 L1219	L1211-F1215 VanDerWaalsContact O-CB 3.28Å; L1211-F1215 WeakPolarHBondContact O-CB 3.33Å; L1211-F1215 PolarHBondContact O-N 2.86Å; S1212-F1215 PolarHBondContact O-N 2.93Å; F1215-L1218 PolarHBondContact O-N 2.79Å; F1215-L1219 HydrophobicContact CD1-CD1 4.4Å; F1215-L1219 HydrophobicContact CE1-CD1 3.74Å; F1215-L1219 HydrophobicContact CZ-CD1 4.33Å; F1215-L1219 VanDerWaalsContact O-CB 3.3Å; F1215-L1219 WeakPolarHBondContact O-CB 3.3Å; F1215-L1219 PolarHBondContact O-N 2.82Å
1216	I	77.4	Confident	75.8	Confident	89 Å²	89	89.2 Å²	89.2	46%	0.456	49%	0.488	S	S	.	.	H	α-helix	trans	-63.4	-40.5	175.1	-69.6	165.6	0	0	0	110.9	S1212 L1219 L1220	S1212-I1216 WeakPolarHBondContact O-CB 3.11Å; S1212-I1216 VanDerWaalsContact O-CG1 3.3Å; S1212-I1216 WeakPolarHBondContact O-CG1 3.11Å; S1212-I1216 PolarHBondContact O-N 2.88Å; I1216-L1219 PolarHBondContact O-N 2.75Å; I1216-L1220 HydrophobicContact CG2-CD1 3.94Å; I1216-L1220 HydrophobicContact CG2-CG 4.44Å; I1216-L1220 WeakPolarHBondContact O-CB 3.3Å; I1216-L1220 WeakPolarHBondContact O-CG 3.46Å; I1216-L1220 PolarHBondContact O-N 2.8Å
1217	L	81.5	Confident	76.4	Confident	109 Å²	109	91.1 Å²	91.1	57%	0.571	50%	0.496	S	S	*	.	H	α-helix	trans	-66.7	-38.6	174.7	-79.6	165.8	0	0	0	112.5	T1213 V1214 T1221	T1213-L1217 WeakPolarHBondContact O-CB 3.3Å; T1213-L1217 WeakPolarHBondContact O-CG 3.42Å; T1213-L1217 PolarHBondContact O-N 3.17Å; V1214-L1217 PolarHBondContact O-N 2.83Å; L1217-T1221 WeakPolarHBondContact O-CB 3.4Å; L1217-T1221 VanDerWaalsContact O-CG2 3.3Å; L1217-T1221 WeakPolarHBondContact O-CG2 3.26Å; L1217-T1221 PolarHBondContact O-N 2.82Å; L1217-T1221 PolarHBondContact O-OG1 2.81Å
1218	L	84.4	Confident	76.7	Confident	102 Å²	102	90.7 Å²	90.7	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-66.4	-37.7	172.6	-74.7	169.1	0	0	0	111.9	V1214 F1215 T1221 T1222	V1214-L1218 HydrophobicContact CG1-CD1 4.01Å; V1214-L1218 WeakPolarHBondContact O-CB 3.31Å; V1214-L1218 WeakPolarHBondContact O-CG 3.45Å; V1214-L1218 PolarHBondContact O-N 3.44Å; F1215-L1218 PolarHBondContact O-N 2.79Å; L1218-T1221 WeakPolarHBondContact CA-OG1 3.29Å; L1218-T1221 PolarHBondContact O-OG1 2.84Å; L1218-T1222 WeakPolarHBondContact O-CB 3.31Å; L1218-T1222 WeakPolarHBondContact O-CG2 3.32Å; L1218-T1222 PolarHBondContact O-N 3.22Å; L1218-T1222 PolarHBondContact O-OG1 2.91Å
1219	L	81.1	Confident	77.2	Confident	81 Å²	81	89.4 Å²	89.4	42%	0.424	49%	0.487	S	S	.	.	H	α-helix	trans	-73.4	-40.3	179.2	-156.5	152.9	0	0	0	111.2	F1215 I1216 T1222 I1223	F1215-L1219 HydrophobicContact CD1-CD1 4.4Å; F1215-L1219 HydrophobicContact CE1-CD1 3.74Å; F1215-L1219 HydrophobicContact CZ-CD1 4.33Å; F1215-L1219 VanDerWaalsContact O-CB 3.3Å; F1215-L1219 WeakPolarHBondContact O-CB 3.3Å; F1215-L1219 PolarHBondContact O-N 2.82Å; I1216-L1219 PolarHBondContact O-N 2.75Å; L1219-T1222 WeakPolarHBondContact CA-OG1 3.44Å; L1219-T1222 PolarHBondContact O-OG1 3.34Å; L1219-T1222 VanDerWaalsContact O-OG1 3.08Å; L1219-I1223 HydrophobicContact CD2-CD1 3.56Å; L1219-I1223 HydrophobicContact CD2-CG1 4.23Å; L1219-I1223 WeakPolarHBondContact O-CB 3.48Å; L1219-I1223 WeakPolarHBondContact O-CG1 3.07Å; L1219-I1223 PolarHBondContact O-N 3.45Å
1220	L	80.1	Confident	77.2	Confident	96 Å²	96	94.2 Å²	94.2	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-64.8	-46.1	171.4	-79.2	169.5	0	0	0	111.9	I1216 T1222 I1223 V1224	I1216-L1220 HydrophobicContact CG2-CD1 3.94Å; I1216-L1220 HydrophobicContact CG2-CG 4.44Å; I1216-L1220 WeakPolarHBondContact O-CB 3.3Å; I1216-L1220 WeakPolarHBondContact O-CG 3.46Å; I1216-L1220 PolarHBondContact O-N 2.8Å; L1220-T1222 VanDerWaalsContact C-N 3.34Å; L1220-T1222 PolarHBondContact O-N 2.92Å; L1220-I1223 PolarHBondContact O-N 2.85Å; L1220-V1224 WeakPolarHBondContact O-CB 3.36Å; L1220-V1224 VanDerWaalsContact O-CG2 3.3Å; L1220-V1224 WeakPolarHBondContact O-CG2 3.36Å; L1220-V1224 PolarHBondContact O-N 3.19Å
1221	T	80.4	Confident	76.6	Confident	72 Å²	72	97.9 Å²	97.9	44%	0.442	51%	0.505	S	S	.	.	H	α-helix	trans	-68.1	-31.9	178.8	50.8	0	0	0	0	112.5	L1217 L1218 L1225	L1217-T1221 WeakPolarHBondContact O-CB 3.4Å; L1217-T1221 VanDerWaalsContact O-CG2 3.3Å; L1217-T1221 WeakPolarHBondContact O-CG2 3.26Å; L1217-T1221 PolarHBondContact O-N 2.82Å; L1217-T1221 PolarHBondContact O-OG1 2.81Å; L1218-T1221 WeakPolarHBondContact CA-OG1 3.29Å; L1218-T1221 PolarHBondContact O-OG1 2.84Å; T1221-L1225 VanDerWaalsContact O-CB 3.27Å; T1221-L1225 WeakPolarHBondContact O-CB 3.3Å; T1221-L1225 WeakPolarHBondContact O-CG 3.3Å; T1221-L1225 PolarHBondContact O-N 3.39Å
1222	T	81.7	Confident	76	Confident	72 Å²	72	101.3 Å²	101.3	44%	0.442	51%	0.511	S	S	.	.	H	α-helix	trans	-73.2	-37.3	171.4	49.9	0	0	0	0	112.9	L1218 L1219 L1220 L1225 L1226	L1218-T1222 WeakPolarHBondContact O-CB 3.31Å; L1218-T1222 WeakPolarHBondContact O-CG2 3.32Å; L1218-T1222 PolarHBondContact O-N 3.22Å; L1218-T1222 PolarHBondContact O-OG1 2.91Å; L1219-T1222 WeakPolarHBondContact CA-OG1 3.44Å; L1219-T1222 PolarHBondContact O-OG1 3.34Å; L1219-T1222 VanDerWaalsContact O-OG1 3.08Å; L1220-T1222 VanDerWaalsContact C-N 3.34Å; L1220-T1222 PolarHBondContact O-N 2.92Å; T1222-L1225 PolarHBondContact O-N 2.69Å; T1222-L1226 WeakPolarHBondContact O-CB 3.16Å; T1222-L1226 VanDerWaalsContact O-CG 3.25Å; T1222-L1226 WeakPolarHBondContact O-CG 3.46Å; T1222-L1226 PolarHBondContact O-N 3.04Å
1223	I	77.5	Confident	75.2	Confident	78 Å²	78	109 Å²	109	40%	0.4	53%	0.531	S	S	.	.	H	α-helix	trans	-62.5	-46.2	169.7	-73.8	176.1	0	0	0	110.8	L1219 L1220 L1225 L1226 L1227	L1219-I1223 HydrophobicContact CD2-CD1 3.56Å; L1219-I1223 HydrophobicContact CD2-CG1 4.23Å; L1219-I1223 WeakPolarHBondContact O-CB 3.48Å; L1219-I1223 WeakPolarHBondContact O-CG1 3.07Å; L1219-I1223 PolarHBondContact O-N 3.45Å; L1220-I1223 PolarHBondContact O-N 2.85Å; I1223-L1225 VanDerWaalsContact C-N 3.34Å; I1223-L1225 PolarHBondContact O-N 2.94Å; I1223-L1226 PolarHBondContact O-N 2.79Å; I1223-L1227 HydrophobicContact CG2-CD1 3.87Å; I1223-L1227 HydrophobicContact CG2-CG 4.34Å; I1223-L1227 WeakPolarHBondContact O-CB 3.31Å; I1223-L1227 WeakPolarHBondContact O-CG 3.47Å; I1223-L1227 PolarHBondContact O-N 2.89Å
1224	V	80.8	Confident	73.7	Confident	76 Å²	76	112.7 Å²	112.7	46%	0.461	55%	0.548	S	S	.	.	H	α-helix	trans	-63.7	-38.6	176.8	169.7	0	0	0	0	111	L1220 L1227 L1228	L1220-V1224 WeakPolarHBondContact O-CB 3.36Å; L1220-V1224 VanDerWaalsContact O-CG2 3.3Å; L1220-V1224 WeakPolarHBondContact O-CG2 3.36Å; L1220-V1224 PolarHBondContact O-N 3.19Å; V1224-L1227 PolarHBondContact O-N 2.99Å; V1224-L1228 HydrophobicContact CG1-CD1 3.82Å; V1224-L1228 HydrophobicContact CG1-CG 4.3Å; V1224-L1228 VanDerWaalsContact O-CB 3.25Å; V1224-L1228 WeakPolarHBondContact O-CB 3.4Å; V1224-L1228 WeakPolarHBondContact O-CG 3.39Å; V1224-L1228 PolarHBondContact O-N 2.81Å
1225	L	79.5	Confident	72.1	Confident	104 Å²	104	114.7 Å²	114.7	55%	0.545	56%	0.556	S	S	.	*	H	α-helix	trans	-65.5	-41.1	172	-87.2	163.7	0	0	0	112.5	T1221 T1222 I1223 L1228 V1229	T1221-L1225 VanDerWaalsContact O-CB 3.27Å; T1221-L1225 WeakPolarHBondContact O-CB 3.3Å; T1221-L1225 WeakPolarHBondContact O-CG 3.3Å; T1221-L1225 PolarHBondContact O-N 3.39Å; T1222-L1225 PolarHBondContact O-N 2.69Å; I1223-L1225 VanDerWaalsContact C-N 3.34Å; I1223-L1225 PolarHBondContact O-N 2.94Å; L1225-L1228 PolarHBondContact O-N 3.29Å; L1225-V1229 VanDerWaalsContact O-CB 3.3Å; L1225-V1229 WeakPolarHBondContact O-CB 3.48Å; L1225-V1229 WeakPolarHBondContact O-CG2 3.48Å; L1225-V1229 PolarHBondContact O-N 2.88Å
1226	L	75.8	Confident	70.6	Confident	120 Å²	120	113.5 Å²	113.5	63%	0.628	55%	0.554	S	S	*	*	H	α-helix	trans	-66	-40.7	176.2	-75.5	167.8	0	0	0	111.5	T1222 I1223 V1229 R1230	T1222-L1226 WeakPolarHBondContact O-CB 3.16Å; T1222-L1226 VanDerWaalsContact O-CG 3.25Å; T1222-L1226 WeakPolarHBondContact O-CG 3.46Å; T1222-L1226 PolarHBondContact O-N 3.04Å; I1223-L1226 PolarHBondContact O-N 2.79Å; L1226-V1229 PolarHBondContact O-N 2.79Å; L1226-R1230 WeakPolarHBondContact O-CB 3.46Å; L1226-R1230 PolarHBondContact O-N 3.16Å
1227	L	72.7	Confident	68.5	Low	105 Å²	105	120.4 Å²	120.4	55%	0.55	58%	0.575	S	S	.	*	H	α-helix	trans	-64.7	-46.4	172.7	-72.2	172.5	0	0	0	111.1	I1223 V1224 V1229 R1230 Y1231	I1223-L1227 HydrophobicContact CG2-CD1 3.87Å; I1223-L1227 HydrophobicContact CG2-CG 4.34Å; I1223-L1227 WeakPolarHBondContact O-CB 3.31Å; I1223-L1227 WeakPolarHBondContact O-CG 3.47Å; I1223-L1227 PolarHBondContact O-N 2.89Å; V1224-L1227 PolarHBondContact O-N 2.99Å; L1227-V1229 VanDerWaalsContact C-N 3.31Å; L1227-V1229 PolarHBondContact O-N 2.83Å; L1227-R1230 CarbonylContact O-C 3.55Å; L1227-R1230 PolarHBondContact O-N 2.8Å; L1227-R1230 VanDerWaalsContact O-N 3.14Å; L1227-Y1231 WeakPolarHBondContact O-CB 3.44Å; L1227-Y1231 PolarHBondContact O-N 3.21Å
1228	L	75.4	Confident	66.3	Low	98 Å²	98	122.7 Å²	122.7	51%	0.513	59%	0.587	S	S	.	*	H	α-helix	trans	-65	-30.9	175.3	-74.8	171.4	0	0	0	112.9	V1224 L1225 R1232	V1224-L1228 HydrophobicContact CG1-CD1 3.82Å; V1224-L1228 HydrophobicContact CG1-CG 4.3Å; V1224-L1228 VanDerWaalsContact O-CB 3.25Å; V1224-L1228 WeakPolarHBondContact O-CB 3.4Å; V1224-L1228 WeakPolarHBondContact O-CG 3.39Å; V1224-L1228 PolarHBondContact O-N 2.81Å; L1225-L1228 PolarHBondContact O-N 3.29Å; L1228-R1232 WeakPolarHBondContact O-CB 3.47Å; L1228-R1232 VanDerWaalsContact O-CG 3.29Å; L1228-R1232 WeakPolarHBondContact O-CG 3.37Å; L1228-R1232 PolarHBondContact O-N 3.49Å
1229	V	75	Confident	63.9	Low	71 Å²	71	124.9 Å²	124.9	43%	0.43	60%	0.598	S	S	.	*	H	α-helix	trans	-71.6	-38.8	171.4	164.9	0	0	0	0	110.9	L1225 L1226 L1227 R1233	L1225-V1229 VanDerWaalsContact O-CB 3.3Å; L1225-V1229 WeakPolarHBondContact O-CB 3.48Å; L1225-V1229 WeakPolarHBondContact O-CG2 3.48Å; L1225-V1229 PolarHBondContact O-N 2.88Å; L1226-V1229 PolarHBondContact O-N 2.79Å; L1227-V1229 VanDerWaalsContact C-N 3.31Å; L1227-V1229 PolarHBondContact O-N 2.83Å; V1229-R1233 WeakPolarHBondContact O-CB 3.32Å; V1229-R1233 WeakPolarHBondContact O-CG 3.17Å; V1229-R1233 PolarHBondContact O-N 2.88Å
1230	R	65.6	Low	61.7	Low	187 Å²	187	126.4 Å²	126.4	71%	0.706	61%	0.613	S	S	*	*	H	α-helix	trans	-68.6	-39.5	175.5	-156.3	169.6	-171.4	167.1	0.3	111.4	L1226 L1227 R1233 L1234	L1226-R1230 WeakPolarHBondContact O-CB 3.46Å; L1226-R1230 PolarHBondContact O-N 3.16Å; L1227-R1230 CarbonylContact O-C 3.55Å; L1227-R1230 PolarHBondContact O-N 2.8Å; L1227-R1230 VanDerWaalsContact O-N 3.14Å; R1230-R1233 PolarHBondContact O-N 2.89Å; R1230-L1234 PolarHBondContact O-N 2.79Å
1231	Y	61	Low	59.5	Low	160 Å²	160	130.1 Å²	130.1	63%	0.627	63%	0.632	S	S	*	*	H	α-helix	trans	-68.9	-45.6	173.9	-139.2	-101.7	0	0	0	111.2	L1227 R1233 L1234 L1235	L1227-Y1231 WeakPolarHBondContact O-CB 3.44Å; L1227-Y1231 PolarHBondContact O-N 3.21Å; Y1231-R1233 VanDerWaalsContact C-N 3.28Å; Y1231-R1233 PolarHBondContact O-N 2.91Å; Y1231-L1234 CarbonylContact O-C 3.16Å; Y1231-L1234 WeakPolarHBondContact O-CA 3.35Å; Y1231-L1234 PolarHBondContact O-N 2.96Å; Y1231-L1235 HydrophobicContact CD1-CD1 3.83Å; Y1231-L1235 HydrophobicContact CE1-CD1 3.42Å; Y1231-L1235 VanDerWaalsContact CE1-CD1 3.42Å; Y1231-L1235 WeakPolarHBondContact O-CB 3.24Å; Y1231-L1235 PolarHBondContact O-N 2.85Å
1232	R	61.8	Low	57.2	Low	175 Å²	175	135.2 Å²	135.2	66%	0.66	65%	0.651	S	S	*	*	H	α-helix	trans	-60.6	-33.7	172.5	-82.6	-170.6	151.2	-170.8	-6.4	112.9	L1228 L1234 I1236	L1228-R1232 WeakPolarHBondContact O-CB 3.47Å; L1228-R1232 VanDerWaalsContact O-CG 3.29Å; L1228-R1232 WeakPolarHBondContact O-CG 3.37Å; L1228-R1232 PolarHBondContact O-N 3.49Å; R1232-L1234 PolarHBondContact O-N 2.79Å; R1232-I1236 HydrophobicContact CB-CD1 4.06Å; R1232-I1236 HydrophobicContact CB-CG1 4.35Å; R1232-I1236 HydrophobicContact CG-CD1 3.65Å; R1232-I1236 HydrophobicContact CG-CG1 4.29Å; R1232-I1236 WeakPolarHBondContact O-CB 3.29Å; R1232-I1236 PolarHBondContact O-N 2.82Å
1233	R	55.1	Low	54.9	Low	218 Å²	218	140.5 Å²	140.5	82%	0.823	67%	0.671	S	S	*	*	H	α-helix	trans	-71.1	-15.4	172.8	-80	-177.4	174.6	-166.9	-0.7	114	V1229 R1230 Y1231	V1229-R1233 WeakPolarHBondContact O-CB 3.32Å; V1229-R1233 WeakPolarHBondContact O-CG 3.17Å; V1229-R1233 PolarHBondContact O-N 2.88Å; R1230-R1233 PolarHBondContact O-N 2.89Å; Y1231-R1233 VanDerWaalsContact C-N 3.28Å; Y1231-R1233 PolarHBondContact O-N 2.91Å
1234	L	45.3	Very low	52.8	Low	146 Å²	146	141.4 Å²	141.4	76%	0.764	68%	0.684	S	S	*	*	H	α-helix	trans	-103.7	-16.8	174.9	-73.4	165.6	0	0	0	113.6	R1230 Y1231 R1232	R1230-L1234 PolarHBondContact O-N 2.79Å; Y1231-L1234 CarbonylContact O-C 3.16Å; Y1231-L1234 WeakPolarHBondContact O-CA 3.35Å; Y1231-L1234 PolarHBondContact O-N 2.96Å; R1232-L1234 PolarHBondContact O-N 2.79Å
1235	L	46.1	Very low	50.5	Low	113 Å²	113	145.4 Å²	145.4	59%	0.592	70%	0.702	S	S	*	*	H	α-helix	trans	-125.5	5.8	-174.1	-110.2	156.1	0	0	0	115.2	Y1231	Y1231-L1235 HydrophobicContact CD1-CD1 3.83Å; Y1231-L1235 HydrophobicContact CE1-CD1 3.42Å; Y1231-L1235 VanDerWaalsContact CE1-CD1 3.42Å; Y1231-L1235 WeakPolarHBondContact O-CB 3.24Å; Y1231-L1235 PolarHBondContact O-N 2.85Å
1236	I	43.9	Very low	48.2	Very low	111 Å²	111	144.1 Å²	144.1	57%	0.569	71%	0.707	S	S	*	*			trans	-123.2	73	171	-50.8	-174.6	0	0	0	110.9	R1232	R1232-I1236 HydrophobicContact CB-CD1 4.06Å; R1232-I1236 HydrophobicContact CB-CG1 4.35Å; R1232-I1236 HydrophobicContact CG-CD1 3.65Å; R1232-I1236 HydrophobicContact CG-CG1 4.29Å; R1232-I1236 WeakPolarHBondContact O-CB 3.29Å; R1232-I1236 PolarHBondContact O-N 2.82Å
1237	R	34.5	Very low	46	Very low	235 Å²	235	143.4 Å²	143.4	89%	0.887	71%	0.71	S	S	*	*			trans	-151.5	41.1	148	-134.8	178.3	-171.3	-161.3	-0.5	115.5	I1239	R1237-I1239 PolarHBondContact O-N 2.7Å; R1237-I1239 VanDerWaalsContact O-N 3.17Å
1238	N	34.3	Very low	44.2	Very low	156 Å²	156	145.9 Å²	145.9	83%	0.834	72%	0.724	S	S	*	*			trans	-71.1	100.9	162	-78.5	-1.8	0	0	0	110.2
1239	I	35.3	Very low	42.1	Very low	149 Å²	149	144.7 Å²	144.7	76%	0.764	74%	0.736	S	S	*	*			trans	-140.8	120.8	156.1	-58.9	-176.4	0	0	0	107.4	R1237	R1237-I1239 PolarHBondContact O-N 2.7Å; R1237-I1239 VanDerWaalsContact O-N 3.17Å
1240	P	33.1	Very low	40.3	Very low	113 Å²	113	146.7 Å²	146.7	73%	0.734	75%	0.75	S	S	*	*			trans	-90.3	170.8	178.7	37.5	-35.8	0	0	0	112.3
1241	L	34.4	Very low	38.7	Very low	174 Å²	174	144.7 Å²	144.7	91%	0.911	75%	0.753	S	S	*	*			trans	-149.9	138.2	155.5	-144.1	77.1	0	0	0	110.6
1242	E	32.8	Very low	37.2	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	76%	0.76	S	S	*	*			trans	-95.9	156.8	-179.8	-55.2	171.9	112.3	0	0	112.2
1243	Q	33.1	Very low	35.6	Very low	183 Å²	183	143 Å²	143	86%	0.855	77%	0.768	S	S	*	*			trans	-174.8	107.3	134.7	-103.6	159.6	25.9	0	0	108.8
1244	S	33.2	Very low	34.5	Very low	97 Å²	97	136.7 Å²	136.7	68%	0.678	76%	0.763	S	S	*	*				83.9	133.5	94.6	71.7	0	0	0	0	113.4
1245	L	31.5	Very low	33.8	Very low	159 Å²	159	136.4 Å²	136.4	83%	0.832	76%	0.762	S	S	*	*			cis	-156.9	161.5	9.6	-150.5	78.2	0	0	0	111
1246	A	31.3	Very low	33	Very low	78 Å²	78	140 Å²	140	65%	0.645	78%	0.775	S	S	*	*			trans	16.4	149	142.3	0	0	0	0	0	121.7
1247	C	30.7	Very low	32.4	Very low	104 Å²	104	137.9 Å²	137.9	70%	0.703	78%	0.781	S	S	*	*			cis	-164.1	168.2	5.6	-117.7	0	0	0	0	112.3
1248	D	34	Very low	32.2	Very low	157 Å²	157	133.6 Å²	133.6	84%	0.84	77%	0.769	S	S	*	*			trans	47.5	142.6	148.4	-51.7	-22.1	0	0	0	123.5
1249	G	32.2	Very low	32.2	Very low	74 Å²	74	128.9 Å²	128.9	76%	0.763	75%	0.752	S	S	*	*			trans	130.4	127.6	148.7	0	0	0	0	0	116.5
1250	P	37.7	Very low	32	Very low	113 Å²	113	125.3 Å²	125.3	73%	0.734	74%	0.737	S	S	*	*			trans	-109	179.6	-178.5	42	-35.5	0	0	0	115.1
1251	D	30.7	Very low	31.9	Very low	144 Å²	144	123.3 Å²	123.3	77%	0.77	74%	0.736	S	S	*	*			trans	75.7	121.3	153.4	-63	-36.4	0	0	0	122.7
1252	S	29.7	Very low	31.8	Very low	110 Å²	110	124.8 Å²	124.8	77%	0.769	74%	0.736	S	S	*	*			trans	86.9	133.1	138.5	78.5	0	0	0	0	122.1
1253	K	29.1	Very low	32.1	Very low	189 Å²	189	121.5 Å²	121.5	82%	0.822	73%	0.73	S	S	*	*			trans	17.2	125.5	146.7	-58.2	172.5	-179.5	171.7	0	118.9
1254	A	30.8	Very low	32	Very low	86 Å²	86	121.6 Å²	121.6	71%	0.711	73%	0.733	S	S	*	*				156	148.1	104.6	0	0	0	0	0	115.6
1255	N	31.1	Very low	32.1	Very low	140 Å²	140	121.9 Å²	121.9	75%	0.749	73%	0.734	S	S	*	*			trans	61.5	117.2	147.8	-59.2	5.4	0	0	0	123.3
1256	E	29.8	Very low	32.3	Very low	188 Å²	188	119 Å²	119	88%	0.879	73%	0.725	S	S	*	*				52.3	130.2	123.7	-56.1	179.3	158.5	0	0	122.3
1257	G	30.5	Very low	32.3	Very low	67 Å²	67	120.8 Å²	120.8	69%	0.691	73%	0.728	S	S	*	*			trans	151.8	82.5	148.7	0	0	0	0	0	121
1258	F	31.2	Very low	32.4	Very low	146 Å²	146	123 Å²	123	64%	0.64	73%	0.728	S	S	*	*				30.6	130.9	119.8	-91.5	-105.2	0	0	0	121.2	V1388	F1258-V1388 HydrophobicContact CB-CG1 3.6Å; F1258-V1388 HydrophobicContact CD1-CB 4.09Å; F1258-V1388 HydrophobicContact CD1-CG1 3.74Å; F1258-V1388 WeakPolarHBondContact CD1-O 3.49Å; F1258-V1388 WeakPolarHBondContact CE1-O 3.35Å; F1258-V1388 HydrophobicContact CG-CG1 4.18Å
1259	A	33.5	Very low	32.3	Very low	56 Å²	56	121.1 Å²	121.1	46%	0.463	72%	0.718	S	S	.	*			trans	154.4	96.5	-165.4	0	0	0	0	0	116.4	V1388 P1390	A1259-V1388 HydrophobicContact CB-CB 4.35Å; A1259-V1388 HydrophobicContact CB-CG1 3.48Å; A1259-V1388 VanDerWaalsContact CB-CG1 3.48Å; A1259-P1390 VanDerWaalsContact O-CD 3.3Å; A1259-P1390 WeakPolarHBondContact O-CD 3.49Å; A1259-P1390 WeakPolarHBondContact O-CG 3.42Å
1260	V	31.8	Very low	32.3	Very low	75 Å²	75	123.6 Å²	123.6	46%	0.455	71%	0.714	S	S	.	*			trans	-80.7	147.3	-177.4	146.3	0	0	0	0	115.4	S1387 N1389	V1260-S1387 WeakPolarHBondContact CG2-O 3.46Å; V1260-N1389 WeakPolarHBondContact CA-O 3.48Å; V1260-N1389 HydrophobicContact CG2-CB 3.8Å; V1260-N1389 VanDerWaalsContact CG2-O 3.3Å; V1260-N1389 WeakPolarHBondContact CG2-O 3.46Å
1261	G	31.1	Very low	32	Very low	70 Å²	70	124.2 Å²	124.2	72%	0.722	71%	0.711	S	S	*	*			trans	-154.7	144.5	155.6	0	0	0	0	0	112.4
1262	K	33	Very low	31.9	Very low	206 Å²	206	124.4 Å²	124.4	90%	0.896	71%	0.711	S	S	*	*			trans	-140.7	166.5	180	-105.4	-151.7	170.9	-173.5	0	112.7
1263	P	38.2	Very low	31.8	Very low	110 Å²	110	122.5 Å²	122.5	71%	0.714	71%	0.71	S	S	*	*			trans	-109.7	177	-147.9	42.3	-39.3	0	0	0	116
1264	M	31.2	Very low	31.9	Very low	185 Å²	185	122.9 Å²	122.9	91%	0.911	71%	0.711	S	S	*	*			trans	-135.1	142.1	156.1	-73.3	-175	68.6	0	0	111.8
1265	S	34.3	Very low	31.8	Very low	102 Å²	102	125 Å²	125	71%	0.713	71%	0.711	S	S	*	*			trans	-110	179.3	153.2	71.1	0	0	0	0	107.1
1266	P	36.7	Very low	31.6	Very low	99 Å²	99	121.2 Å²	121.2	64%	0.643	70%	0.704	S	S	*	*				-156.1	-160.1	53.1	38.5	-12.7	0	0	0	116.1
1267	T	32.2	Very low	31.4	Very low	115 Å²	115	121 Å²	121	71%	0.706	70%	0.701	S	S	*	*			trans	70.3	150.1	153.6	53.8	0	0	0	0	118.8
1268	Q	31.1	Very low	31.3	Very low	151 Å²	151	126.3 Å²	126.3	71%	0.706	71%	0.705	S	S	*	*			cis	-163.9	163.8	-1.6	-126.7	177.1	5.4	0	0	112.6
1269	N	31.8	Very low	31.1	Very low	118 Å²	118	123.4 Å²	123.4	63%	0.631	70%	0.7	S	S	*	*			trans	69.5	155.1	145.9	-66.1	-9.5	0	0	0	119
1270	N	32.4	Very low	30.8	Very low	126 Å²	126	128.3 Å²	128.3	67%	0.674	71%	0.713	S	S	*	*			cis	-156.4	152.9	1.6	-122.4	-1.7	0	0	0	115
1271	L	31	Very low	30.7	Very low	126 Å²	126	130.8 Å²	130.8	66%	0.66	73%	0.728	S	S	*	*			trans	51.2	117.6	149.2	-91.4	78.6	0	0	0	123.8
1272	N	29.2	Very low	30.6	Very low	147 Å²	147	132.9 Å²	132.9	79%	0.786	73%	0.727	S	S	*	*				50.9	113	114	-55.1	5	0	0	0	120.9
1273	G	28.6	Very low	30.5	Very low	71 Å²	71	129.6 Å²	129.6	73%	0.732	72%	0.724	S	S	*	*			trans	-71.7	-154.5	162.2	0	0	0	0	0	116.3
1274	F	30	Very low	30.2	Very low	196 Å²	196	126.8 Å²	126.8	86%	0.86	71%	0.71	S	S	*	*			trans	-155.3	167.7	171.5	-129.2	-102.4	0	0	0	111.5
1275	N	28.5	Very low	30.5	Very low	132 Å²	132	123.1 Å²	123.1	71%	0.706	70%	0.7	S	S	*	*			trans	-37.6	159.5	179.9	-47	-14.8	0	0	0	116.9
1276	G	28	Very low	30.3	Very low	59 Å²	59	129.8 Å²	129.8	61%	0.608	71%	0.71	S	S	*	*			cis	108.8	138.5	8	0	0	0	0	0	113.4
1277	F	26.1	Very low	30.4	Very low	183 Å²	183	130.5 Å²	130.5	80%	0.803	71%	0.712	S	S	*	*			trans	65.8	158.7	-173	-58.2	-93.4	0	0	0	113.7	T1279	F1277-T1279 HydrophobicContact CD1-CG2 4.13Å
1278	F	27.1	Very low	30.4	Very low	179 Å²	179	136.7 Å²	136.7	79%	0.785	72%	0.722	S	S	*	*			cis	-115.4	150.9	9.2	-79.8	-116	0	0	0	109.2
1279	T	27.9	Very low	30.6	Very low	86 Å²	86	132.9 Å²	132.9	53%	0.528	72%	0.724	S	S	.	*				54.6	149.7	61.2	84.1	0	0	0	0	113.3	F1277	F1277-T1279 HydrophobicContact CD1-CG2 4.13Å
1280	E	27.4	Very low	30.5	Very low	159 Å²	159	132.2 Å²	132.2	74%	0.743	73%	0.729	S	S	*	*			cis	-139.8	-151.7	13.1	-130.4	140.3	128.4	0	0	108.8
1281	V	29.8	Very low	30.4	Very low	127 Å²	127	132.7 Å²	132.7	77%	0.77	74%	0.736	S	S	*	*			cis	-158.5	173.7	26.8	-153.7	0	0	0	0	110.4
1282	V	27.5	Very low	30.3	Very low	113 Å²	113	131.7 Å²	131.7	69%	0.685	74%	0.74	S	S	*	*			trans	84.6	76.4	164.9	-159.8	0	0	0	0	116.8
1283	T	31.1	Very low	30.7	Very low	137 Å²	137	130.5 Å²	130.5	84%	0.84	74%	0.74	S	S	*	*	P	Polyproline II helix		-57.1	135.8	126	47.4	0	0	0	0	109.7
1284	A	32.3	Very low	30.8	Very low	51 Å²	51	133.2 Å²	133.2	42%	0.421	74%	0.742	S	S	.	*	P	Polyproline II helix	trans	-54.1	154.3	166.9	0	0	0	0	0	111.2	V1287	A1284-V1287 HydrophobicContact CB-CG2 3.85Å; A1284-V1287 VanDerWaalsContact CB-N 3.34Å
1285	P	37.7	Very low	30.8	Very low	109 Å²	109	130.1 Å²	130.1	71%	0.708	74%	0.739	S	S	*	*	S	Bend	cis	-79.4	133.7	29.5	-17.6	33.8	0	0	0	114.1
1286	W	30.9	Very low	30.9	Very low	242 Å²	242	134.3 Å²	134.3	92%	0.917	75%	0.747	S	S	*	*	S	Bend	cis	-142.9	71.6	17.8	-57	72.3	0	0	0	114.1
1287	V	38.7	Very low	31.3	Very low	113 Å²	113	136.4 Å²	136.4	69%	0.685	75%	0.749	S	S	*	*			trans	68.2	133.3	145.9	178.2	0	0	0	0	121.5	A1284	A1284-V1287 HydrophobicContact CB-CG2 3.85Å; A1284-V1287 VanDerWaalsContact CB-N 3.34Å
1288	R	30.4	Very low	31.7	Very low	245 Å²	245	134.1 Å²	134.1	93%	0.925	75%	0.75	S	S	*	*			trans	95.3	130.7	163.5	-80.8	166.2	-178.5	-170.2	0.9	120.9
1289	G	36.3	Very low	32.3	Very low	72 Å²	72	131 Å²	131	74%	0.742	75%	0.749	S	S	*	*			trans	77.9	166.9	150.9	0	0	0	0	0	118.9
1290	S	30.4	Very low	32.3	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	76%	0.761	S	S	*	*				172.7	134.2	-51.9	44.8	0	0	0	0	110.7
1291	T	29.1	Very low	32.4	Very low	135 Å²	135	131.1 Å²	131.1	83%	0.828	76%	0.759	S	S	*	*			trans	65.5	155.2	172.6	69	0	0	0	0	114.9
1292	S	30.1	Very low	32.4	Very low	105 Å²	105	135.4 Å²	135.4	73%	0.734	76%	0.762	S	S	*	*			cis	-146	-139.4	20.8	-58.3	0	0	0	0	113.6
1293	P	36.8	Very low	32.8	Very low	123 Å²	123	135 Å²	135	80%	0.799	76%	0.762	S	S	*	*				-132.9	-152.5	-125.5	39.8	-15	0	0	0	117.2
1294	V	29.9	Very low	32.8	Very low	127 Å²	127	135.5 Å²	135.5	77%	0.77	77%	0.765	S	S	*	*			trans	128.6	106.2	147.8	173.7	0	0	0	0	120.3
1295	V	29.9	Very low	32.6	Very low	131 Å²	131	139.4 Å²	139.4	79%	0.794	78%	0.778	S	S	*	*			trans	81.3	147.5	134.5	172	0	0	0	0	126.2
1296	Y	31.3	Very low	32.3	Very low	221 Å²	221	144 Å²	144	87%	0.867	78%	0.783	S	S	*	*			trans	-84.5	-160.2	-179	-80.2	-85.6	0	0	0	114.3
1297	P	36.5	Very low	32.3	Very low	103 Å²	103	139.2 Å²	139.2	67%	0.669	78%	0.775	S	S	*	*			cis	-150.3	172.1	8.5	44.1	-21.9	0	0	0	122.5
1298	T	33.8	Very low	31.9	Very low	134 Å²	134	140 Å²	140	82%	0.822	78%	0.78	S	S	*	*			trans	74.5	157	145.7	45.2	0	0	0	0	124.5
1299	P	39.6	Very low	31.9	Very low	115 Å²	115	131.6 Å²	131.6	75%	0.747	77%	0.769	S	S	*	*			trans	-128.4	179.1	-157.9	45.2	-31.1	0	0	0	117.6
1300	C	28	Very low	31.7	Very low	117 Å²	117	135.5 Å²	135.5	79%	0.791	77%	0.772	S	S	*	*			trans	-173.2	145.6	147.7	-103.6	0	0	0	0	116.8
1301	N	30.6	Very low	31.7	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	76%	0.76	S	S	*	*			trans	64.8	109.6	146.2	-67.7	-13.1	0	0	0	125.4
1302	Y	29.7	Very low	31.7	Very low	217 Å²	217	136.6 Å²	136.6	85%	0.851	75%	0.752	S	S	*	*				72	161.2	126.2	-74.3	-53.4	0	0	0	122
1303	P	35.5	Very low	31.6	Very low	104 Å²	104	135.6 Å²	135.6	68%	0.675	74%	0.744	S	S	*	*			trans	-133.6	171.1	-140.5	43.2	-26	0	0	0	117.1
1304	T	30.7	Very low	31.3	Very low	148 Å²	148	141.2 Å²	141.2	91%	0.908	75%	0.75	S	S	*	*			trans	-169.6	-178.6	141.8	10.5	0	0	0	0	112.2
1305	I	29	Very low	31.3	Very low	133 Å²	133	138.6 Å²	138.6	68%	0.682	75%	0.748	S	S	*	*			trans	-125.6	161.7	-154.4	-45.7	175	0	0	0	112.8
1306	Y	31	Very low	31.3	Very low	207 Å²	207	137.4 Å²	137.4	81%	0.812	75%	0.745	S	S	*	*			trans	94.7	87.4	162.4	-61	-73.5	0	0	0	118.4
1307	N	31.7	Very low	31.2	Very low	141 Å²	141	134.6 Å²	134.6	75%	0.754	74%	0.743	S	S	*	*				76.9	137.9	66.2	-158.9	10.5	0	0	0	117.1
1308	T	30.7	Very low	31	Very low	128 Å²	128	134.4 Å²	134.4	79%	0.785	75%	0.75	S	S	*	*			trans	83.4	136.1	165.5	72.3	0	0	0	0	121.5
1309	G	29.9	Very low	31	Very low	69 Å²	69	135.4 Å²	135.4	71%	0.711	75%	0.751	S	S	*	*			trans	135.4	71.6	168.9	0	0	0	0	0	116.4
1310	I	31.2	Very low	30.8	Very low	154 Å²	154	134.4 Å²	134.4	79%	0.79	74%	0.744	S	S	*	*				99.8	109.8	78	-76.5	172.8	0	0	0	115.9
1311	N	30.8	Very low	30.9	Very low	92 Å²	92	133.5 Å²	133.5	49%	0.492	73%	0.731	S	S	.	*			trans	77	134.9	142.3	-89.1	-31	0	0	0	126.7
1312	R	29.6	Very low	30.7	Very low	171 Å²	171	130.2 Å²	130.2	65%	0.645	72%	0.722	S	S	*	*			trans	74.8	147	138	-72.5	173.9	175.9	178.5	-1.7	119.4	G1374 V1375	R1312-G1374 PolarHBondContact NH2-O 2.92Å; R1312-V1375 PolarHBondContact NH2-O 2.92Å
1313	S	28.5	Very low	30.5	Very low	83 Å²	83	123.7 Å²	123.7	58%	0.58	71%	0.707	S	S	*	*			cis	-175.7	166.3	-11.6	54.7	0	0	0	0	113
1314	R	30.2	Very low	30.1	Very low	241 Å²	241	128.2 Å²	128.2	91%	0.909	71%	0.711	S	S	*	*			trans	74.2	147	168.1	-52.8	163.3	-178.7	177.9	-1.5	114.2
1315	G	29.1	Very low	30.6	Very low	72 Å²	72	125.9 Å²	125.9	74%	0.742	70%	0.701	S	S	*	*			cis	167.4	170.4	-0.6	0	0	0	0	0	110.8
1316	C	30.5	Very low	30.9	Very low	107 Å²	107	124.8 Å²	124.8	72%	0.723	70%	0.702	S	S	*	*			cis	-164.2	147.2	-5.2	-94.8	0	0	0	0	111.1
1317	I	29.9	Very low	30.9	Very low	162 Å²	162	120.2 Å²	120.2	83%	0.831	70%	0.696	S	S	*	*			trans	42.1	115.6	140.1	-53.6	156.8	0	0	0	119.5
1318	A	31	Very low	30.8	Very low	98 Å²	98	118.9 Å²	118.9	81%	0.81	69%	0.693	S	S	*	*				-168.8	138	128.8	0	0	0	0	0	114.9
1319	N	33.4	Very low	30.7	Very low	156 Å²	156	117.9 Å²	117.9	83%	0.834	69%	0.687	S	S	*	*			trans	-63.5	178.8	168.5	-127.3	-4.9	0	0	0	113.1
1320	P	35.5	Very low	30.6	Very low	93 Å²	93	122.1 Å²	122.1	60%	0.604	69%	0.693	S	S	*	*			cis	-134.4	-170.7	-9.7	42.4	-25.3	0	0	0	114
1321	N	29.9	Very low	30.4	Very low	98 Å²	98	118.5 Å²	118.5	52%	0.524	68%	0.68	S	S	.	*			trans	42.2	121.4	155.6	-75	2.3	0	0	0	119.9	N1459	N1321-N1459 PolarHBondContact ND2-OD1 2.62Å; N1321-N1459 VanDerWaalsContact ND2-OD1 3.1Å
1322	A	27.5	Very low	30.2	Very low	60 Å²	60	122.4 Å²	122.4	50%	0.496	69%	0.693	S	S	.	*			trans	82.4	139.3	144.6	0	0	0	0	0	120.1	L1456	A1322-L1456 HydrophobicContact CB-CD2 3.41Å; A1322-L1456 VanDerWaalsContact CB-CD2 3.41Å
1323	C	25.8	Very low	30.4	Very low	80 Å²	80	116.6 Å²	116.6	54%	0.541	68%	0.678	S	S	.	*			trans	65.5	110.2	141.2	-70.7	0	0	0	0	121.6
1324	W	25.7	Very low	30.7	Very low	200 Å²	200	116.3 Å²	116.3	76%	0.758	67%	0.674	S	S	*	*			trans	94.6	120.7	131	-66.4	20.2	0	0	0	118
1325	S	41.5	Very low	30.8	Very low	99 Å²	99	108.2 Å²	108.2	69%	0.692	65%	0.652	S	S	*	*			trans	-55	164.9	150.8	56.2	0	0	0	0	112.1
1326	P	35.3	Very low	30.9	Very low	110 Å²	110	108.2 Å²	108.2	71%	0.714	64%	0.64	S	S	*	*				-129.4	170.3	107.1	41	-34.1	0	0	0	110.7
1327	T	30.9	Very low	30.8	Very low	111 Å²	111	109.6 Å²	109.6	68%	0.681	64%	0.641	S	S	*	*			cis	-155.8	133	9.4	-8	0	0	0	0	109.1
1328	T	29.3	Very low	30.9	Very low	113 Å²	113	109.5 Å²	109.5	69%	0.693	64%	0.636	S	S	*	*				48.3	143.4	128.6	63.5	0	0	0	0	120.9
1329	T	29	Very low	30.8	Very low	107 Å²	107	112.2 Å²	112.2	66%	0.656	63%	0.632	S	S	*	*			cis	-166.6	176.5	11.7	8.2	0	0	0	0	107.8
1330	L	27.3	Very low	30.7	Very low	158 Å²	158	111.7 Å²	111.7	83%	0.827	63%	0.629	S	S	*	*			cis	-122.5	-145	13.7	-93.9	99.9	0	0	0	111.1
1331	C	27.7	Very low	30.4	Very low	78 Å²	78	113.6 Å²	113.6	53%	0.527	63%	0.63	S	S	.	*				-157.2	166.8	-91	-83.8	0	0	0	0	108.9
1332	K	27.2	Very low	30.3	Very low	174 Å²	174	116.7 Å²	116.7	76%	0.757	64%	0.635	S	S	*	*			cis	-163.4	144.9	-10.9	-103.9	167.6	-179.6	167.8	0	105.1
1333	S	33.3	Very low	30.3	Very low	49 Å²	49	119 Å²	119	34%	0.343	63%	0.633	S	S	.	*				73.4	159.9	61.5	97.5	0	0	0	0	115.6	Q1450 L1451	S1333-Q1450 VanDerWaalsContact C-OE1 3.22Å; S1333-L1451 VanDerWaalsContact CA-CD1 3.4Å
1334	P	35.4	Very low	30.3	Very low	77 Å²	77	118.7 Å²	118.7	50%	0.5	63%	0.631	S	S	.	*			cis	-145.4	137.7	7.2	36.6	-12.8	0	0	0	120.8	Q1450	P1334-Q1450 VanDerWaalsContact CD-OE1 3.29Å
1335	T	31.1	Very low	30.3	Very low	71 Å²	71	114.4 Å²	114.4	44%	0.436	62%	0.621	S	S	.	*			trans	62.8	159.2	142.4	58	0	0	0	0	125.3	Q1450 L1451	T1335-Q1450 CarbonylContact C-O 3.59Å; T1335-Q1450 VanDerWaalsContact CA-C 3.48Å; T1335-Q1450 WeakPolarHBondContact CA-O 3.19Å; T1335-Q1450 VanDerWaalsContact N-CB 3.28Å; T1335-Q1450 PolarHBondContact O-N 3.05Å; T1335-L1451 WeakPolarHBondContact CA-O 3.31Å; T1335-L1451 HydrophobicContact CG2-CB 4.23Å
1336	S	30.7	Very low	29.5	Very low	71 Å²	71	117 Å²	117	50%	0.497	62%	0.622	S	S	.	*			trans	89.8	156.1	160.4	89.3	0	0	0	0	117.4	Q1450	S1336-Q1450 PolarHBondContact N-O 2.95Å; S1336-Q1450 PolarHBondContact O-N 2.79Å
1337	N	29.7	Very low	29.5	Very low	137 Å²	137	115 Å²	115	73%	0.733	61%	0.609	S	S	*	*			cis	-167	173.7	-19.9	-112.1	-2.8	0	0	0	111.1
1338	H	32.1	Very low	29.6	Very low	160 Å²	160	114 Å²	114	74%	0.741	60%	0.604	S	S	*	*			trans	64.4	161	169.3	-71.8	-82.7	0	0	0	117.2
1339	E	28.5	Very low	29.6	Very low	155 Å²	155	112.7 Å²	112.7	72%	0.724	60%	0.596	S	S	*	*			cis	-160.6	-169.6	-40.2	-153.5	164.3	-170.8	0	0	107.3
1340	D	30.5	Very low	29.5	Very low	144 Å²	144	111 Å²	111	77%	0.77	59%	0.585	S	S	*	*			trans	54	108.3	175.5	-77.4	-2	0	0	0	117.4
1341	Q	29.1	Very low	29.4	Very low	134 Å²	134	108.9 Å²	108.9	63%	0.626	57%	0.572	S	S	*	*			cis	52.9	111.2	27.3	-95.9	-170.2	78	0	0	111.1
1342	R	29.1	Very low	29.5	Very low	163 Å²	163	113.4 Å²	113.4	62%	0.615	58%	0.58	S	S	*	*				171.8	154.7	59.9	-106.5	159.1	-176.7	-176.1	9.9	112
1343	K	27.2	Very low	29.6	Very low	107 Å²	107	112.4 Å²	112.4	47%	0.465	58%	0.578	S	S	.	*			trans	67.1	160	140.4	-68.8	170.7	-174.6	-176.8	0	117.1
1344	C	25.7	Very low	29.4	Very low	75 Å²	75	114.5 Å²	114.5	51%	0.507	59%	0.592	S	S	.	*			cis	-136	143.4	9.5	-109.6	0	0	0	0	109
1345	M	25.3	Very low	29.4	Very low	109 Å²	109	115.8 Å²	115.8	54%	0.537	60%	0.603	S	S	.	*				53.9	133.9	77.8	-64.9	175.9	163.4	0	0	113.3	S1766	M1345-S1766 PolarHBondContact N-O 2.74Å
1346	Q	26.1	Very low	29.7	Very low	153 Å²	153	117.5 Å²	117.5	72%	0.715	62%	0.615	S	S	*	*			cis	-161.2	164.9	18.9	-124.9	152.2	1.3	0	0	113.5
1347	T	34.8	Very low	29.8	Very low	70 Å²	70	119.4 Å²	119.4	43%	0.429	63%	0.629	S	S	.	*			trans	-59.4	165.6	172.9	54.8	0	0	0	0	114.3	P1767	T1347-P1767 WeakPolarHBondContact CA-O 3.38Å; T1347-P1767 HydrophobicContact CG2-CG 3.8Å; T1347-P1767 VanDerWaalsContact CG2-O 3.26Å; T1347-P1767 WeakPolarHBondContact CG2-O 3.38Å; T1347-P1767 PolarHBondContact N-O 3.26Å
1348	P	33.1	Very low	29.7	Very low	90 Å²	90	122 Å²	122	58%	0.584	64%	0.636	S	S	*	*				-150.5	110.9	100.4	35.6	-16	0	0	0	117.7	K1769 D1770	P1348-K1769 CarbonylContact C-O 3.3Å; P1348-K1769 CarbonylContact O-C 3.6Å; P1348-K1769 VanDerWaalsContact O-O 3.07Å; P1348-D1770 PolarHBondContact O-N 3.44Å
1349	T	28.6	Very low	29.6	Very low	85 Å²	85	117.7 Å²	117.7	52%	0.521	63%	0.634	S	S	.	*				56.2	149.9	128.6	17.2	0	0	0	0	124.9	K1769 D1770	T1349-K1769 PolarHBondContact N-O 2.6Å; T1349-D1770 WeakPolarHBondContact O-CB 3.2Å
1350	T	27	Very low	29.8	Very low	72 Å²	72	120.6 Å²	120.6	44%	0.442	65%	0.645	S	S	.	*			trans	79.5	110.7	149	44.7	0	0	0	0	123.4	S1771	T1350-S1771 PolarHBondContact O-OG 3.08Å; T1350-S1771 VanDerWaalsContact O-OG 3.13Å
1351	M	26	Very low	29.5	Very low	112 Å²	112	123.7 Å²	123.7	55%	0.552	65%	0.646	S	S	*	*				41.2	140.9	118.7	-45.1	-171.5	-60.8	0	0	119.2
1352	Y	28.1	Very low	29.6	Very low	173 Å²	173	125.5 Å²	125.5	68%	0.678	66%	0.658	S	S	*	*			cis	-171	159.2	42.4	-112.2	-53.8	0	0	0	112.7
1353	H	30.2	Very low	29.6	Very low	154 Å²	154	123.8 Å²	123.8	71%	0.713	66%	0.661	S	S	*	*			trans	62.6	152.6	148.7	-76.9	-52.7	0	0	0	121
1354	S	28.9	Very low	30.1	Very low	92 Å²	92	123.2 Å²	123.2	64%	0.643	67%	0.668	S	S	*	*			cis	-161.5	133.6	-1.1	40.9	0	0	0	0	115.3
1355	S	34.6	Very low	30	Very low	105 Å²	105	124.5 Å²	124.5	73%	0.734	67%	0.674	S	S	*	*				68.5	163.8	126.1	-59	0	0	0	0	122.2
1356	P	39.2	Very low	30	Very low	106 Å²	106	129.1 Å²	129.1	69%	0.688	69%	0.691	S	S	*	*			cis	-142.7	144.5	-34.7	34.9	-16.8	0	0	0	116.7
1357	S	31.9	Very low	30	Very low	112 Å²	112	125.6 Å²	125.6	78%	0.783	70%	0.696	S	S	*	*				175.3	119.1	129.5	34	0	0	0	0	108.2
1358	H	27.7	Very low	29.7	Very low	191 Å²	191	128.7 Å²	128.7	88%	0.884	72%	0.715	S	S	*	*				58.2	101.5	67.4	-70.1	54.5	0	0	0	111.9
1359	G	30	Very low	29.3	Very low	69 Å²	69	130.9 Å²	130.9	71%	0.711	73%	0.726	S	S	*	*			trans	-160.5	-77.6	-170.2	0	0	0	0	0	115.1
1360	F	33.1	Very low	29.3	Very low	216 Å²	216	131.7 Å²	131.7	95%	0.947	74%	0.736	S	S	*	*			trans	-166.6	149.5	164.4	-112.2	-79.7	0	0	0	110.1
1361	R	24.5	Very low	29.4	Very low	209 Å²	209	133.4 Å²	133.4	79%	0.789	75%	0.75	S	S	*	*			trans	-156.7	111.8	-176.3	-177.2	-169.3	-171.7	-158.3	4.5	111.7	L1363	R1361-L1363 HydrophobicContact CG-CD1 4.4Å
1362	I	31.8	Very low	29.5	Very low	172 Å²	172	133.6 Å²	133.6	88%	0.882	76%	0.761	S	S	*	*			trans	-127.8	123	151.9	-59.5	-176.7	0	0	0	107.9
1363	L	27.4	Very low	29.7	Very low	127 Å²	127	132 Å²	132	67%	0.665	77%	0.769	S	S	*	*			trans	-148.9	158	-175.7	-90.7	173.7	0	0	0	105	R1361	R1361-L1363 HydrophobicContact CG-CD1 4.4Å
1364	P	37.5	Very low	29.9	Very low	96 Å²	96	127.2 Å²	127.2	62%	0.623	76%	0.762	S	S	*	*			cis	-138.1	-157.9	-37.7	28.3	-5.4	0	0	0	111.5
1365	T	25	Very low	30.1	Very low	102 Å²	102	127.6 Å²	127.6	63%	0.626	76%	0.76	S	S	*	*			trans	94.1	147.7	146.4	75.1	0	0	0	0	122.7
1366	F	24.4	Very low	30.1	Very low	205 Å²	205	125.9 Å²	125.9	90%	0.899	76%	0.759	S	S	*	*			trans	62.3	142	150.2	-58.9	-53.1	0	0	0	121.3
1367	G	26.3	Very low	29.9	Very low	79 Å²	79	127.6 Å²	127.6	81%	0.814	76%	0.762	S	S	*	*			trans	153.2	88.3	161.3	0	0	0	0	0	115.1
1368	V	27.7	Very low	29.8	Very low	136 Å²	136	128.5 Å²	128.5	82%	0.824	76%	0.758	S	S	*	*			trans	-103.4	158.9	165.8	-175.6	0	0	0	0	108.8
1369	T	25.4	Very low	29.9	Very low	136 Å²	136	130.6 Å²	130.6	83%	0.834	76%	0.758	S	S	*	*			trans	110.4	-177	167.2	72.3	0	0	0	0	116.8
1370	S	28.3	Very low	29.8	Very low	102 Å²	102	133.2 Å²	133.2	71%	0.713	76%	0.755	S	S	*	*				-156.8	153.9	-126.3	55.1	0	0	0	0	118.2
1371	S	29.2	Very low	29.7	Very low	107 Å²	107	131.1 Å²	131.1	75%	0.748	75%	0.746	S	S	*	*			trans	93.3	127.7	142.8	78.9	0	0	0	0	123.3
1372	C	28	Very low	30	Very low	116 Å²	116	128.1 Å²	128.1	78%	0.784	75%	0.746	S	S	*	*			trans	75	109.6	133.1	-70.1	0	0	0	0	126.3
1373	V	32.6	Very low	30	Very low	139 Å²	139	125.1 Å²	125.1	84%	0.842	74%	0.74	S	S	*	*			trans	82.7	129.4	131.3	-179.9	0	0	0	0	121
1374	G	33.8	Very low	30.4	Very low	54 Å²	54	124.5 Å²	124.5	56%	0.557	74%	0.744	S	S	*	*			trans	-147.7	-64.4	-175.6	0	0	0	0	0	122.9	R1312	R1312-G1374 PolarHBondContact NH2-O 2.92Å
1375	V	33.8	Very low	30.2	Very low	101 Å²	101	126.1 Å²	126.1	61%	0.612	75%	0.751	S	S	*	*			trans	61.4	119.2	179.6	-174.9	0	0	0	0	121.2	R1312	R1312-V1375 PolarHBondContact NH2-O 2.92Å
1376	G	35.2	Very low	30.5	Very low	68 Å²	68	125.2 Å²	125.2	70%	0.701	75%	0.749	S	S	*	*			trans	117.6	146.3	149.6	0	0	0	0	0	116.8
1377	N	33.7	Very low	30.7	Very low	143 Å²	143	118.4 Å²	118.4	77%	0.765	73%	0.727	S	S	*	*			cis	-166	152.9	-2.1	-134.1	18.5	0	0	0	114.2
1378	N	30.8	Very low	31	Very low	131 Å²	131	118.2 Å²	118.2	70%	0.701	71%	0.71	S	S	*	*			trans	76.6	140.1	152.1	-63.4	-17.6	0	0	0	124.9
1379	R	30.6	Very low	31.3	Very low	235 Å²	235	115.6 Å²	115.6	89%	0.887	69%	0.691	S	S	*	*			trans	91.2	138.7	157.3	-54.8	-161.3	177.1	-179.1	-0.5	118.9
1380	L	27.7	Very low	31.7	Very low	124 Å²	124	112 Å²	112	65%	0.649	67%	0.67	S	S	*	*			cis	-173.6	159	-30.9	-128.6	155.8	0	0	0	109.3
1381	F	29.1	Very low	31.7	Very low	172 Å²	172	110.8 Å²	110.8	75%	0.754	66%	0.662	S	S	*	*			trans	69.2	147.4	173.9	-52.4	-76.3	0	0	0	117.1
1382	D	30.9	Very low	31.6	Very low	146 Å²	146	115.1 Å²	115.1	78%	0.781	67%	0.668	S	S	*	*			cis	-157.2	168.5	-40.4	-122.6	-27	0	0	0	110.7
1383	S	32.4	Very low	31.6	Very low	108 Å²	108	116 Å²	116	76%	0.755	67%	0.669	S	S	*	*			trans	-96	172.5	-176.4	-52.5	0	0	0	0	113.8
1384	P	36.5	Very low	31.4	Very low	115 Å²	115	112.4 Å²	112.4	75%	0.747	66%	0.661	S	S	*	*				-155.7	158.4	90.2	40.7	-21.9	0	0	0	118.8
1385	V	32.3	Very low	31.1	Very low	129 Å²	129	118 Å²	118	78%	0.782	68%	0.677	S	S	*	*			trans	53.7	135.4	136.6	171.5	0	0	0	0	120.6
1386	S	31	Very low	31	Very low	83 Å²	83	119 Å²	119	58%	0.58	69%	0.686	S	S	*	*			cis	-175	-170.8	-14.7	72.5	0	0	0	0	108.2
1387	S	30.1	Very low	30.6	Very low	62 Å²	62	119.6 Å²	119.6	43%	0.434	69%	0.692	S	S	.	*			cis	-151.3	-109.6	-5.5	52.4	0	0	0	0	110.2	V1260	V1260-S1387 WeakPolarHBondContact CG2-O 3.46Å
1388	V	31.1	Very low	30.2	Very low	76 Å²	76	116 Å²	116	46%	0.461	69%	0.689	S	S	.	*			trans	90.6	31.7	150.2	-92.9	0	0	0	0	123.8	F1258 A1259	F1258-V1388 HydrophobicContact CB-CG1 3.6Å; F1258-V1388 HydrophobicContact CD1-CB 4.09Å; F1258-V1388 HydrophobicContact CD1-CG1 3.74Å; F1258-V1388 WeakPolarHBondContact CD1-O 3.49Å; F1258-V1388 WeakPolarHBondContact CE1-O 3.35Å; F1258-V1388 HydrophobicContact CG-CG1 4.18Å; A1259-V1388 HydrophobicContact CB-CB 4.35Å; A1259-V1388 HydrophobicContact CB-CG1 3.48Å; A1259-V1388 VanDerWaalsContact CB-CG1 3.48Å
1389	N	34.1	Very low	30	Very low	81 Å²	81	119.3 Å²	119.3	43%	0.433	70%	0.697	S	S	.	*			trans	-178.6	123	-176.8	168.6	127	0	0	0	115.8	V1260	V1260-N1389 WeakPolarHBondContact CA-O 3.48Å; V1260-N1389 HydrophobicContact CG2-CB 3.8Å; V1260-N1389 VanDerWaalsContact CG2-O 3.3Å; V1260-N1389 WeakPolarHBondContact CG2-O 3.46Å
1390	P	33.9	Very low	29.7	Very low	60 Å²	60	114.9 Å²	114.9	39%	0.39	69%	0.69	S	S	.	*			trans	-144.3	-147	136.2	52.7	-38.7	0	0	0	108	A1259	A1259-P1390 VanDerWaalsContact O-CD 3.3Å; A1259-P1390 WeakPolarHBondContact O-CD 3.49Å; A1259-P1390 WeakPolarHBondContact O-CG 3.42Å
1391	S	28.6	Very low	29.6	Very low	77 Å²	77	115.4 Å²	115.4	54%	0.538	69%	0.692	S	S	.	*			cis	175.4	176.6	-39.7	55.6	0	0	0	0	109.6
1392	F	27.5	Very low	29.6	Very low	198 Å²	198	116.2 Å²	116.2	87%	0.868	70%	0.699	S	S	*	*			trans	73.6	141.3	172.3	-62.4	-68.2	0	0	0	115.8
1393	T	28.7	Very low	29.2	Very low	133 Å²	133	115.2 Å²	115.2	82%	0.816	69%	0.693	S	S	*	*			cis	-130.9	175.5	-3.1	51.6	0	0	0	0	110.5
1394	G	27.3	Very low	29	Very low	65 Å²	65	120.4 Å²	120.4	67%	0.67	70%	0.698	S	S	*	*			cis	131.3	36.9	-13.9	0	0	0	0	0	119.6
1395	L	27.3	Very low	28.4	Very low	171 Å²	171	119.8 Å²	119.8	90%	0.895	70%	0.696	S	S	*	*			trans	64.3	-177.3	167.4	-68.6	163.2	0	0	0	115.2
1396	P	32.6	Very low	28.1	Very low	122 Å²	122	120.9 Å²	120.9	79%	0.792	70%	0.697	S	S	*	*				-130.4	168	-50.2	34.3	-20.1	0	0	0	114.5
1397	G	26.7	Very low	27.8	Very low	81 Å²	81	123 Å²	123	84%	0.835	70%	0.698	S	S	*	*			trans	108.2	134.5	136.6	0	0	0	0	0	120.4
1398	G	26	Very low	27.7	Very low	68 Å²	68	128.1 Å²	128.1	70%	0.701	72%	0.72	S	S	*	*				98.4	104.3	122.4	0	0	0	0	0	120.9
1399	F	25.1	Very low	27.6	Very low	200 Å²	200	129.2 Å²	129.2	88%	0.877	72%	0.723	S	S	*	*			trans	79.9	125.9	134.4	-70.8	-68.6	0	0	0	123.5
1400	I	25.2	Very low	27.4	Very low	141 Å²	141	133.5 Å²	133.5	72%	0.723	75%	0.746	S	S	*	*			trans	99.9	100.9	132.8	-73.3	165.4	0	0	0	120.1
1401	L	24.9	Very low	27.3	Very low	135 Å²	135	136.8 Å²	136.8	71%	0.707	76%	0.76	S	S	*	*			trans	50.1	114.7	136.2	-56.2	175.1	0	0	0	120.5
1402	Q	28.7	Very low	27.4	Very low	189 Å²	189	139.4 Å²	139.4	88%	0.883	77%	0.769	S	S	*	*				-140.9	131.9	114.5	-114.7	177.6	10.5	0	0	110.6
1403	N	23.4	Very low	27.5	Very low	125 Å²	125	136.6 Å²	136.6	67%	0.668	76%	0.763	S	S	*	*			trans	-95.4	119.6	-178.5	-68.5	-0.3	0	0	0	110.9
1404	Y	27.8	Very low	27.6	Very low	218 Å²	218	137.3 Å²	137.3	86%	0.855	76%	0.761	S	S	*	*			trans	-141.8	104.5	143.1	-73.3	-80.1	0	0	0	104.4
1405	S	24.1	Very low	27.7	Very low	101 Å²	101	142.1 Å²	142.1	71%	0.706	77%	0.766	S	S	*	*				71.2	128.5	50	-165.4	0	0	0	0	111.9
1406	L	25.6	Very low	27.8	Very low	152 Å²	152	137.8 Å²	137.8	80%	0.796	76%	0.763	S	S	*	*			trans	82.4	113.7	-170.6	-52.4	175.9	0	0	0	114.4
1407	Q	25.6	Very low	27.6	Very low	129 Å²	129	138.5 Å²	138.5	60%	0.603	76%	0.76	S	S	*	*			cis	158.8	89.8	-16.6	167.6	175.6	14.3	0	0	104.5	D1409	Q1407-D1409 HydrophobicContact CG-CB 4.13Å; Q1407-D1409 VanDerWaalsContact CG-CG 3.43Å; Q1407-D1409 VanDerWaalsContact CG-OD2 3.22Å; Q1407-D1409 WeakPolarHBondContact CG-OD2 3.03Å; Q1407-D1409 PolarHBondContact NE2-OD2 3.37Å
1408	D	27	Very low	27.7	Very low	169 Å²	169	138 Å²	138	90%	0.904	76%	0.755	S	S	*	*			trans	-95.2	78.3	164.2	-66.3	-43.4	0	0	0	106
1409	D	30	Very low	27.7	Very low	99 Å²	99	141.2 Å²	141.2	53%	0.529	76%	0.755	S	S	.	*			trans	-88.7	111.2	174	-70.9	-9.1	0	0	0	108.3	Q1407 D1411	Q1407-D1409 HydrophobicContact CG-CB 4.13Å; Q1407-D1409 VanDerWaalsContact CG-CG 3.43Å; Q1407-D1409 VanDerWaalsContact CG-OD2 3.22Å; Q1407-D1409 WeakPolarHBondContact CG-OD2 3.03Å; Q1407-D1409 PolarHBondContact NE2-OD2 3.37Å; D1409-D1411 PolarHBondContact O-N 2.81Å
1410	D	30	Very low	27.7	Very low	171 Å²	171	140.8 Å²	140.8	91%	0.914	75%	0.753	S	S	*	*			trans	-74.7	73.3	162.7	-74.9	-52.1	0	0	0	108.9
1411	D	31.5	Very low	27.7	Very low	128 Å²	128	142 Å²	142	68%	0.684	76%	0.755	S	S	*	*			trans	-115.1	109.3	174.2	-88	-11	0	0	0	110.7	D1409	D1409-D1411 PolarHBondContact O-N 2.81Å
1412	D	30.5	Very low	27.7	Very low	133 Å²	133	141.8 Å²	141.8	71%	0.711	76%	0.755	S	S	*	*			trans	47.6	132.7	138.1	-58.2	-12	0	0	0	123.3
1413	D	30.2	Very low	27.8	Very low	139 Å²	139	140.2 Å²	140.2	74%	0.743	75%	0.751	S	S	*	*			trans	50.1	119.7	134.4	-56.1	-17	0	0	0	120.9
1414	D	30.4	Very low	28.1	Very low	147 Å²	147	139.2 Å²	139.2	79%	0.786	75%	0.75	S	S	*	*				-171.4	169.3	74.6	-127.9	-23.2	0	0	0	116.2
1415	E	29.1	Very low	28.5	Very low	166 Å²	166	134.5 Å²	134.5	78%	0.776	75%	0.746	S	S	*	*			trans	-27.6	139.2	180	-60.7	-177.1	139.9	0	0	121
1416	G	30.4	Very low	28.6	Very low	81 Å²	81	135.7 Å²	135.7	84%	0.835	74%	0.744	S	S	*	*			trans	-152.1	41.4	178.7	0	0	0	0	0	117.1
1417	N	28	Very low	28.8	Very low	136 Å²	136	134.5 Å²	134.5	73%	0.727	74%	0.739	S	S	*	*			trans	-29	136.6	-179.1	-73.5	-73.1	0	0	0	119.5
1418	G	29.4	Very low	29.1	Very low	70 Å²	70	135.6 Å²	135.6	72%	0.722	74%	0.744	S	S	*	*			trans	151.3	68.2	163.3	0	0	0	0	0	115.5
1419	I	25.4	Very low	29.4	Very low	137 Å²	137	133.3 Å²	133.3	70%	0.703	73%	0.731	S	S	*	*				57.3	96.2	76.3	-56.3	178.4	0	0	0	113.9
1420	F	25.3	Very low	29.6	Very low	191 Å²	191	134.3 Å²	134.3	84%	0.838	74%	0.736	S	S	*	*			trans	54	162.6	134.8	-92	-98.1	0	0	0	122.1
1421	Q	25.2	Very low	29.5	Very low	165 Å²	165	132 Å²	132	77%	0.771	72%	0.723	S	S	*	*			trans	70.2	149.5	160.9	-73.6	-177.6	-35.8	0	0	116.4
1422	D	24.9	Very low	29.5	Very low	131 Å²	131	134 Å²	134	70%	0.701	73%	0.726	S	S	*	*			cis	-160.1	-160.4	-15.8	-126.1	-31.5	0	0	0	108.9
1423	I	29.8	Very low	29.3	Very low	156 Å²	156	132.5 Å²	132.5	80%	0.8	72%	0.722	S	S	*	*			trans	91.9	111.7	153.8	-48.1	-175.3	0	0	0	116.8
1424	T	30.1	Very low	29.1	Very low	104 Å²	104	133.4 Å²	133.4	64%	0.638	72%	0.723	S	S	*	*			trans	-86.2	164.9	168.3	56.7	0	0	0	0	112.2
1425	P	35.3	Very low	28.9	Very low	120 Å²	120	134 Å²	134	78%	0.779	72%	0.719	S	S	*	*				-132.6	129	101.7	9.6	12.1	0	0	0	111.7
1426	N	27.8	Very low	28.8	Very low	125 Å²	125	131 Å²	131	67%	0.668	71%	0.712	S	S	*	*				88.9	133.4	69.8	-78.8	-14.6	0	0	0	114.5
1427	N	29.8	Very low	28.6	Very low	128 Å²	128	133.1 Å²	133.1	68%	0.684	70%	0.704	S	S	*	*			trans	69.9	142.6	160.9	-62.5	17	0	0	0	116.8
1428	E	30.6	Very low	28.6	Very low	151 Å²	151	132 Å²	132	71%	0.706	70%	0.699	S	S	*	*			cis	-162.6	166	-5.7	-111.4	172.5	-160.3	0	0	106.2
1429	I	34.2	Very low	28.5	Very low	122 Å²	122	134.3 Å²	134.3	63%	0.626	69%	0.691	S	S	*	*			cis	-158.6	149.1	19.4	-141.1	161.4	0	0	0	110.7
1430	N	33.2	Very low	28.6	Very low	119 Å²	119	136.4 Å²	136.4	64%	0.636	69%	0.69	S	S	*	*			trans	52.7	115	158.1	-68.9	-41.2	0	0	0	121.3
1431	N	29.5	Very low	28.6	Very low	123 Å²	123	134.6 Å²	134.6	66%	0.658	68%	0.684	S	S	*	*				73	137.5	77.8	-76.7	-54.1	0	0	0	114.4
1432	K	30.3	Very low	28.7	Very low	169 Å²	169	131.7 Å²	131.7	74%	0.735	68%	0.677	S	S	*	*			cis	-157.8	129	21.5	-129.8	157.9	-169.9	171.9	0	114.4
1433	T	26.6	Very low	28.6	Very low	103 Å²	103	132 Å²	132	63%	0.632	68%	0.678	S	S	*	*			trans	41.8	132.4	135.3	63.4	0	0	0	0	122.6
1434	M	25.7	Very low	28.5	Very low	157 Å²	157	132.7 Å²	132.7	77%	0.773	68%	0.678	S	S	*	*			trans	67.6	151.6	134.6	-72.2	-176.5	-178.2	0	0	118
1435	K	26.8	Very low	28.5	Very low	160 Å²	160	134.8 Å²	134.8	70%	0.696	69%	0.685	S	S	*	*			cis	-155.9	128	21.9	-128.5	149.4	-179.3	175.9	0	108.4
1436	T	25.5	Very low	28.5	Very low	103 Å²	103	133.8 Å²	133.8	63%	0.632	68%	0.679	S	S	*	*				62.9	142.8	111.3	67.4	0	0	0	0	118.6
1437	N	27	Very low	28.4	Very low	125 Å²	125	137 Å²	137	67%	0.668	69%	0.687	S	S	*	*			trans	70.4	116.6	139	-70.5	22	0	0	0	116.4
1438	N	27.6	Very low	28.3	Very low	113 Å²	113	134.8 Å²	134.8	60%	0.604	68%	0.681	S	S	*	*				111.6	160.4	84.2	-84.7	8.7	0	0	0	109.5
1439	E	27.9	Very low	28.1	Very low	119 Å²	119	133.9 Å²	133.9	56%	0.556	68%	0.677	S	S	*	*			cis	-150.1	144.7	-0.5	-126.6	162.6	127	0	0	112.9
1440	R	26.5	Very low	27.8	Very low	180 Å²	180	131.3 Å²	131.3	68%	0.679	66%	0.663	S	S	*	*				43.6	133.6	129.2	-79.3	178.1	-174.4	157.2	-11.6	121.5
1441	Q	27	Very low	27.4	Very low	154 Å²	154	128.7 Å²	128.7	72%	0.72	65%	0.648	S	S	*	*				81	159.4	124.4	-73.8	173.7	-12	0	0	119.1
1442	T	25.7	Very low	27.2	Very low	103 Å²	103	131 Å²	131	63%	0.632	65%	0.653	S	S	*	*			cis	-153.2	161.2	4.7	-4.7	0	0	0	0	111.3
1443	L	24.6	Very low	27.3	Very low	138 Å²	138	126.7 Å²	126.7	72%	0.723	64%	0.644	S	S	*	*			trans	67.4	152.8	153.7	-96	55.8	0	0	0	116.6
1444	Q	27.6	Very low	27.4	Very low	170 Å²	170	128.9 Å²	128.9	79%	0.794	65%	0.645	S	S	*	*			cis	-148.4	148.1	2.5	-149.6	145.3	12.8	0	0	112.1
1445	N	30.2	Very low	27.7	Very low	148 Å²	148	125.6 Å²	125.6	79%	0.791	64%	0.637	S	S	*	*			trans	-67.6	172.6	163	-125.3	-12.3	0	0	0	109.8
1446	P	35	Very low	27.8	Very low	99 Å²	99	123 Å²	123	64%	0.643	63%	0.631	S	S	*	*			cis	-147.9	169.5	26.1	44.2	-24.8	0	0	0	119.1
1447	K	26.2	Very low	28.1	Very low	193 Å²	193	120.8 Å²	120.8	84%	0.839	62%	0.622	S	S	*	*			trans	60	157.1	138.5	-76.1	176.2	-179.3	-171.2	0	120.2
1448	S	25.7	Very low	28.3	Very low	81 Å²	81	120.7 Å²	120.7	57%	0.566	62%	0.622	S	S	*	*			cis	-174.8	146.3	-15.1	47.8	0	0	0	0	110.3
1449	E	27.4	Very low	28.4	Very low	133 Å²	133	120.2 Å²	120.2	62%	0.621	62%	0.62	S	S	*	*			trans	59.5	141.8	140.9	-65.6	-178.9	124.8	0	0	120.4
1450	Q	27.6	Very low	28.5	Very low	67 Å²	67	120.5 Å²	120.5	31%	0.313	62%	0.624	S	S	.	*			cis	-175.3	-172.7	-2.1	-120.4	165.2	5.6	0	0	114.9	S1333 P1334 T1335 S1336	S1333-Q1450 VanDerWaalsContact C-OE1 3.22Å; P1334-Q1450 VanDerWaalsContact CD-OE1 3.29Å; T1335-Q1450 CarbonylContact C-O 3.59Å; T1335-Q1450 VanDerWaalsContact CA-C 3.48Å; T1335-Q1450 WeakPolarHBondContact CA-O 3.19Å; T1335-Q1450 VanDerWaalsContact N-CB 3.28Å; T1335-Q1450 PolarHBondContact O-N 3.05Å; S1336-Q1450 PolarHBondContact N-O 2.95Å; S1336-Q1450 PolarHBondContact O-N 2.79Å
1451	L	24.7	Very low	28.7	Very low	64 Å²	64	119.5 Å²	119.5	34%	0.335	63%	0.627	S	S	.	*			trans	14.1	145.7	166.3	-54.2	-156.3	0	0	0	126.5	S1333 T1335	S1333-L1451 VanDerWaalsContact CA-CD1 3.4Å; T1335-L1451 WeakPolarHBondContact CA-O 3.31Å; T1335-L1451 HydrophobicContact CG2-CB 4.23Å
1452	F	26.2	Very low	28.7	Very low	171 Å²	171	116.5 Å²	116.5	75%	0.75	62%	0.622	S	S	*	*				60.6	145	127.2	-79.6	-141.2	0	0	0	120.5
1453	S	32.2	Very low	28.9	Very low	80 Å²	80	118.2 Å²	118.2	56%	0.559	62%	0.623	S	S	*	*			cis	161.1	172.9	-4.6	64.1	0	0	0	0	105.4
1454	K	28.1	Very low	29.1	Very low	148 Å²	148	117.8 Å²	117.8	64%	0.643	62%	0.621	S	S	*	*			trans	69.6	118.5	174.1	-63.6	177.9	178.5	-179.1	0	113.6
1455	S	31.8	Very low	29.1	Very low	88 Å²	88	119.4 Å²	119.4	62%	0.615	63%	0.625	S	S	*	*				59.7	133.3	59.4	88.5	0	0	0	0	111.6
1456	L	28.4	Very low	29.2	Very low	107 Å²	107	118.6 Å²	118.6	56%	0.56	63%	0.625	S	S	*	*			cis	-166.2	166.4	32.5	-164.4	83.5	0	0	0	109.6	A1322	A1322-L1456 HydrophobicContact CB-CD2 3.41Å; A1322-L1456 VanDerWaalsContact CB-CD2 3.41Å
1457	A	33.5	Very low	29.2	Very low	55 Å²	55	119.3 Å²	119.3	46%	0.455	63%	0.63	S	S	.	*			trans	25.4	140.1	150.9	0	0	0	0	0	121.6
1458	N	29.6	Very low	29.3	Very low	123 Å²	123	118.4 Å²	118.4	66%	0.658	63%	0.629	S	S	*	*				-167.3	126.2	109.9	-97.3	-33.4	0	0	0	113.7
1459	N	30.3	Very low	29.5	Very low	104 Å²	104	120.5 Å²	120.5	56%	0.556	64%	0.64	S	S	*	*				66.2	153.4	129.4	-58.8	-15.9	0	0	0	120	N1321	N1321-N1459 PolarHBondContact ND2-OD1 2.62Å; N1321-N1459 VanDerWaalsContact ND2-OD1 3.1Å
1460	L	29.9	Very low	29.5	Very low	124 Å²	124	120.8 Å²	120.8	65%	0.649	65%	0.646	S	S	*	*			cis	-155.7	149.9	0.5	-152.5	72	0	0	0	111.5
1461	H	31.2	Very low	29.5	Very low	160 Å²	160	126.3 Å²	126.3	74%	0.741	67%	0.674	S	S	*	*			trans	60	152.3	153	-81.3	10.2	0	0	0	118.3
1462	C	27.5	Very low	29.6	Very low	90 Å²	90	129.1 Å²	129.1	61%	0.608	69%	0.694	S	S	*	*			cis	-162	164.7	7.6	-117.9	0	0	0	0	107.9
1463	Q	28.8	Very low	29.8	Very low	140 Å²	140	131.1 Å²	131.1	65%	0.654	70%	0.703	S	S	*	*			cis	-166.1	170.7	-10.2	-137.2	178	40.1	0	0	109.1
1464	N	29.1	Very low	29.5	Very low	128 Å²	128	132.1 Å²	132.1	68%	0.684	71%	0.71	S	S	*	*			trans	41.1	114.2	150.8	-58.8	-17.3	0	0	0	119.4
1465	K	28.1	Very low	29.5	Very low	205 Å²	205	135.2 Å²	135.2	89%	0.891	72%	0.724	S	S	*	*				-164.6	168	62.6	-112.4	172.4	179.7	-179.7	0	113.3
1466	V	32.6	Very low	29.3	Very low	130 Å²	130	135.8 Å²	135.8	79%	0.788	73%	0.727	S	S	*	*			trans	-152.3	161.6	-162.5	159.4	0	0	0	0	107.6
1467	P	33.6	Very low	29.2	Very low	114 Å²	114	135.9 Å²	135.9	74%	0.74	74%	0.737	S	S	*	*			cis	-126	-173	10.9	22.3	3.8	0	0	0	116.8
1468	E	28.6	Very low	28.8	Very low	174 Å²	174	141 Å²	141	81%	0.813	76%	0.756	S	S	*	*			trans	-79.3	165.2	-177.8	-53.4	114.6	130.8	0	0	116.7
1469	P	30.4	Very low	28.6	Very low	125 Å²	125	143.6 Å²	143.6	81%	0.812	76%	0.762	S	S	*	*			trans	-98.9	125	153.1	35	-24.9	0	0	0	111.7
1470	D	28.4	Very low	28.4	Very low	140 Å²	140	148.6 Å²	148.6	75%	0.749	77%	0.773	S	S	*	*			trans	-105.5	125	174.9	-172.5	13.3	0	0	0	111.3
1471	M	27	Very low	28.1	Very low	182 Å²	182	149 Å²	149	90%	0.897	78%	0.781	S	S	*	*			trans	-111.2	82.3	-176.5	-81.1	-158.6	-177.9	0	0	111.9	K1473	M1471-K1473 PolarHBondContact O-N 2.86Å
1472	T	27.6	Very low	28	Very low	124 Å²	124	145.4 Å²	145.4	76%	0.761	78%	0.778	S	S	*	*			trans	-86.6	91.8	173.6	35.9	0	0	0	0	112.4
1473	K	28.5	Very low	28	Very low	213 Å²	213	148 Å²	148	93%	0.926	79%	0.785	S	S	*	*			trans	-94.9	105.2	161	-86.8	-172	175.8	-178.9	0	110.6	M1471	M1471-K1473 PolarHBondContact O-N 2.86Å
1474	S	26.9	Very low	27.9	Very low	101 Å²	101	146.2 Å²	146.2	71%	0.706	79%	0.787	S	S	*	*			trans	-94.8	139	155.1	62.5	0	0	0	0	109.8
1475	F	27	Very low	27.8	Very low	213 Å²	213	146.6 Å²	146.6	93%	0.934	79%	0.789	S	S	*	*			trans	-144.2	112.8	139.5	-104.4	-72.1	0	0	0	110.4
1476	S	27.7	Very low	27.8	Very low	99 Å²	99	145.1 Å²	145.1	69%	0.692	79%	0.785	S	S	*	*			trans	-73	172.8	156.7	56.2	0	0	0	0	108.4
1477	S	26.6	Very low	27.7	Very low	110 Å²	110	147.2 Å²	147.2	77%	0.769	79%	0.786	S	S	*	*			cis	-172.9	174	39.4	49.2	0	0	0	0	111.9
1478	L	24.8	Very low	27.6	Very low	162 Å²	162	148.6 Å²	148.6	85%	0.848	79%	0.786	S	S	*	*			trans	-91.3	151.7	169.2	-76.1	146.4	0	0	0	111.8
1479	K	25.8	Very low	27.5	Very low	178 Å²	178	146.6 Å²	146.6	77%	0.774	78%	0.781	S	S	*	*			trans	97.6	111.3	157.3	-60.5	173.4	179.1	173.8	0	120.5
1480	R	26.4	Very low	27.6	Very low	209 Å²	209	146.9 Å²	146.9	79%	0.789	78%	0.776	S	S	*	*			trans	65.3	154	142.4	-50.9	-179.2	-175.5	-168.7	0.4	116.7
1481	T	24.6	Very low	27.9	Very low	133 Å²	133	150.7 Å²	150.7	82%	0.816	78%	0.782	S	S	*	*			cis	-151.9	179	13.1	-24.4	0	0	0	0	110.6
1482	A	29.1	Very low	27.9	Very low	83 Å²	83	149.8 Å²	149.8	69%	0.686	77%	0.772	S	S	*	*			trans	-69.3	174.4	170	0	0	0	0	0	112.3
1483	I	27.4	Very low	28.2	Very low	146 Å²	146	150.4 Å²	150.4	75%	0.749	77%	0.771	S	S	*	*			cis	-145.6	163.9	26.3	-59.4	167.4	0	0	0	106.5
1484	S	26.8	Very low	28.3	Very low	101 Å²	101	148.7 Å²	148.7	71%	0.706	77%	0.766	S	S	*	*			cis	-129.3	-167.2	21.8	63.6	0	0	0	0	112.2
1485	L	26.5	Very low	28.7	Very low	137 Å²	137	151.4 Å²	151.4	72%	0.717	77%	0.771	S	S	*	*			cis	81.1	127.7	14.5	-120.3	177.3	0	0	0	118
1486	E	26.9	Very low	28.8	Very low	173 Å²	173	149.1 Å²	149.1	81%	0.808	77%	0.769	S	S	*	*			trans	56.5	129.6	176.2	-83	156.5	-152.3	0	0	116
1487	E	31.1	Very low	28.7	Very low	175 Å²	175	148.1 Å²	148.1	82%	0.818	76%	0.762	S	S	*	*			cis	-136.9	-176.7	-0.6	-75.6	-178.4	133.3	0	0	108
1488	L	31.6	Very low	28.7	Very low	142 Å²	142	151.1 Å²	151.1	74%	0.743	76%	0.761	S	S	*	*			cis	-155.5	172.8	24.3	-163.3	70.9	0	0	0	110.9
1489	N	27.5	Very low	28.9	Very low	132 Å²	132	149.5 Å²	149.5	71%	0.706	75%	0.754	S	S	*	*			trans	-82.4	179.3	-171.4	-64.1	-70.9	0	0	0	116.6
1490	D	31	Very low	29.1	Very low	131 Å²	131	152.1 Å²	152.1	70%	0.701	76%	0.76	S	S	*	*			trans	75	126.7	164.9	-54.8	-42.3	0	0	0	115.5
1491	Y	34.3	Very low	29.1	Very low	221 Å²	221	147 Å²	147	87%	0.867	76%	0.756	S	S	*	*			cis	-118.1	155.6	38.5	-108.8	-112.8	0	0	0	116.8
1492	K	28	Very low	29.2	Very low	162 Å²	162	151.4 Å²	151.4	70%	0.704	76%	0.758	S	S	*	*			trans	-88.9	162.6	160	-62.6	168.7	179.6	156.8	0	109
1493	D	33.3	Very low	28.9	Very low	138 Å²	138	153.4 Å²	153.4	74%	0.738	76%	0.756	S	S	*	*				-156.1	158.3	87.8	-87.3	-27.7	0	0	0	114.8
1494	E	30.7	Very low	29	Very low	176 Å²	176	152.7 Å²	152.7	82%	0.822	76%	0.759	S	S	*	*			trans	1.4	147.6	156.7	-43.3	-165.9	129.6	0	0	119.7
1495	I	35.3	Very low	29	Very low	158 Å²	158	157.4 Å²	157.4	81%	0.81	76%	0.761	S	S	*	*			cis	-137.1	129.5	27.3	-61.4	164.5	0	0	0	110.8
1496	N	28.8	Very low	29	Very low	165 Å²	165	159.8 Å²	159.8	88%	0.882	77%	0.766	S	S	*	*			trans	-153.5	91.5	164.3	-166.3	-6.1	0	0	0	112
1497	S	26	Very low	28.9	Very low	78 Å²	78	158.4 Å²	158.4	55%	0.545	76%	0.759	S	S	.	*			trans	-163	153.3	166.1	85.3	0	0	0	0	114.2
1498	K	27.6	Very low	28.7	Very low	173 Å²	173	157.3 Å²	157.3	75%	0.752	76%	0.758	S	S	*	*			trans	79.9	111.5	151.8	-67.2	161.2	-164.1	151.2	0	119.8
1499	N	27.5	Very low	28.4	Very low	129 Å²	129	154.2 Å²	154.2	69%	0.69	75%	0.754	S	S	*	*				72.2	110	126.1	-53.9	-8.7	0	0	0	118.9
1500	Y	31.4	Very low	28.2	Very low	233 Å²	233	156.9 Å²	156.9	91%	0.914	76%	0.762	S	S	*	*				-145.3	97.7	102.8	-112.1	-73.8	0	0	0	112.2
1501	S	25.3	Very low	28	Very low	101 Å²	101	154.5 Å²	154.5	71%	0.706	76%	0.755	S	S	*	*			trans	-94.2	123.1	158.5	-46.9	0	0	0	0	108.4
1502	R	26.5	Very low	27.6	Very low	225 Å²	225	151.4 Å²	151.4	85%	0.849	75%	0.754	S	S	*	*			trans	171.6	143.8	143.1	-98.5	158.9	-177.3	-166.2	-0.2	112.7
1503	L	24.6	Very low	27.5	Very low	125 Å²	125	150.5 Å²	150.5	65%	0.654	76%	0.755	S	S	*	*			trans	36.5	119.5	138.7	-57	162.6	0	0	0	116.5	R1505	L1503-R1505 HydrophobicContact CD2-CB 4.2Å; L1503-R1505 HydrophobicContact CD2-CG 3.99Å
1504	V	29.5	Very low	27	Very low	132 Å²	132	155 Å²	155	80%	0.8	76%	0.762	S	S	*	*				-107.4	130.5	65	179.5	0	0	0	0	113.9	F1506	V1504-F1506 HydrophobicContact CG1-CD2 3.84Å; V1504-F1506 HydrophobicContact CG1-CE2 4.33Å
1505	R	25.4	Very low	26.8	Very low	199 Å²	199	154.8 Å²	154.8	75%	0.751	76%	0.761	S	S	*	*			trans	-96.1	124	156.6	-81.3	177.2	175.2	167.7	-3.1	108.3	L1503	L1503-R1505 HydrophobicContact CD2-CB 4.2Å; L1503-R1505 HydrophobicContact CD2-CG 3.99Å
1506	F	27.5	Very low	26.5	Very low	187 Å²	187	154.6 Å²	154.6	82%	0.82	76%	0.762	S	S	*	*			trans	-113.7	123	138.3	-90.9	-93.5	0	0	0	104.7	V1504	V1504-F1506 HydrophobicContact CG1-CD2 3.84Å; V1504-F1506 HydrophobicContact CG1-CE2 4.33Å
1507	Q	25.3	Very low	26.6	Very low	144 Å²	144	154.1 Å²	154.1	67%	0.673	76%	0.759	S	S	*	*			cis	64.8	108.3	37.1	-150.3	166.8	-33.3	0	0	108
1508	L	26.1	Very low	26.9	Very low	152 Å²	152	155.3 Å²	155.3	80%	0.796	77%	0.765	S	S	*	*			cis	-126.8	158.5	31.9	-61.9	138.8	0	0	0	110.4
1509	A	24.9	Very low	27	Very low	78 Å²	78	152.4 Å²	152.4	65%	0.645	76%	0.762	S	S	*	*			cis	70.4	67.7	32.6	0	0	0	0	0	114.7
1510	Q	24.3	Very low	27.1	Very low	188 Å²	188	154 Å²	154	88%	0.879	77%	0.765	S	S	*	*			trans	-108.7	115.9	135.4	-72	179.9	-21.2	0	0	106.1
1511	S	25.7	Very low	27	Very low	81 Å²	81	148 Å²	148	57%	0.566	75%	0.748	S	S	*	*				71.7	85.7	51.5	83.2	0	0	0	0	112.2
1512	D	25.8	Very low	27.1	Very low	156 Å²	156	149.8 Å²	149.8	83%	0.834	75%	0.749	S	S	*	*			trans	64.5	177.7	145.4	-48.1	-58.5	0	0	0	114.2
1513	I	25.4	Very low	27.2	Very low	143 Å²	143	143.8 Å²	143.8	73%	0.733	74%	0.739	S	S	*	*			cis	-134.1	128.9	10.6	-64.1	165.6	0	0	0	108.3
1514	R	23.9	Very low	27.3	Very low	232 Å²	232	144.9 Å²	144.9	88%	0.875	74%	0.744	S	S	*	*	S	Bend	trans	-82.3	112.2	150.9	-103.6	-165.4	-177.6	-173	1.4	107.7	N1516	R1514-N1516 PolarHBondContact O-N 2.81Å
1515	E	26.1	Very low	27	Very low	171 Å²	171	143.7 Å²	143.7	80%	0.799	74%	0.741	S	S	*	*			trans	30.7	88.3	150.2	-63.5	166.8	131.8	0	0	116.1
1516	N	28.9	Very low	27	Very low	155 Å²	155	139.6 Å²	139.6	83%	0.829	74%	0.743	S	S	*	*			trans	-132.2	133.8	133	-94.9	-57.6	0	0	0	109.4	R1514	R1514-N1516 PolarHBondContact O-N 2.81Å
1517	D	30.1	Very low	26.9	Very low	155 Å²	155	141 Å²	141	83%	0.829	74%	0.743	S	S	*	*			trans	-54.2	167.8	172.2	-105.8	-36.6	0	0	0	112.9
1518	P	33.7	Very low	26.9	Very low	103 Å²	103	139.4 Å²	139.4	67%	0.669	74%	0.739	S	S	*	*			cis	-135.3	-168.8	13.2	36	-14.7	0	0	0	115.9
1519	T	29.8	Very low	26.8	Very low	111 Å²	111	137.6 Å²	137.6	68%	0.681	73%	0.727	S	S	*	*			trans	77.4	99.6	172.8	65.7	0	0	0	0	113.6
1520	H	29.7	Very low	27	Very low	163 Å²	163	145.1 Å²	145.1	76%	0.755	74%	0.74	S	S	*	*				73.3	127.2	81.5	-71.2	10.5	0	0	0	111.7
1521	N	29	Very low	27	Very low	107 Å²	107	142.6 Å²	142.6	57%	0.572	73%	0.728	S	S	*	*			cis	-160.5	153.9	4.1	-116	-11.7	0	0	0	111.6
1522	I	27.6	Very low	27.1	Very low	139 Å²	139	145 Å²	145	71%	0.713	74%	0.74	S	S	*	*				31	130.3	114.2	-74.2	172.6	0	0	0	115.7
1523	P	27.6	Very low	27.3	Very low	99 Å²	99	144.5 Å²	144.5	64%	0.643	74%	0.736	S	S	*	*			cis	-158.6	-172.7	0.3	46.1	-24.4	0	0	0	119.8
1524	I	26.3	Very low	27.4	Very low	148 Å²	148	143.2 Å²	143.2	76%	0.759	74%	0.735	S	S	*	*				37.1	124.4	128.7	-62.7	162.1	0	0	0	119.9
1525	S	23.5	Very low	27.5	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	72%	0.723	S	S	*	*			trans	19.9	124.6	150.7	78.5	0	0	0	0	121.1
1526	S	26.4	Very low	27.7	Very low	113 Å²	113	136.6 Å²	136.6	79%	0.79	72%	0.722	S	S	*	*				-152.1	144.7	119.4	55.2	0	0	0	0	107.1
1527	R	24.2	Very low	27.8	Very low	217 Å²	217	136.7 Å²	136.7	82%	0.819	72%	0.717	S	S	*	*			cis	68.5	145.1	33.8	-151.4	-153	169.1	127.9	3.5	111.7
1528	N	25.7	Very low	27.7	Very low	111 Å²	111	139.5 Å²	139.5	59%	0.594	72%	0.716	S	S	*	*			trans	70.1	107.7	177.6	-60.7	28.8	0	0	0	113.1
1529	E	25	Very low	27.6	Very low	114 Å²	114	137.4 Å²	137.4	53%	0.533	71%	0.712	S	S	.	*				87.2	103.3	61.7	-74.8	167.2	138.8	0	0	113.3	Q1531	E1529-Q1531 HydrophobicContact CB-CG 4.08Å; E1529-Q1531 HydrophobicContact CG-CG 4Å; E1529-Q1531 PolarHBondContact OE1-NE2 3.21Å
1530	Y	28	Very low	27.7	Very low	236 Å²	236	137.9 Å²	137.9	93%	0.925	71%	0.711	S	S	*	*				-145.7	89.2	123	-88.7	-75.1	0	0	0	105.3
1531	Q	25.3	Very low	27.9	Very low	134 Å²	134	137.2 Å²	137.2	63%	0.626	71%	0.713	S	S	*	*				48.4	94.2	69.7	-68.6	-159	15.4	0	0	114.1	E1529	E1529-Q1531 HydrophobicContact CB-CG 4.08Å; E1529-Q1531 HydrophobicContact CG-CG 4Å; E1529-Q1531 PolarHBondContact OE1-NE2 3.21Å
1532	T	27	Very low	28.2	Very low	133 Å²	133	138.2 Å²	138.2	82%	0.816	72%	0.718	S	S	*	*			trans	173.1	130.9	133.1	40.2	0	0	0	0	107.5
1533	L	29.4	Very low	28.3	Very low	144 Å²	144	137.6 Å²	137.6	75%	0.754	72%	0.717	S	S	*	*			cis	-149.8	141.8	1.7	-100.4	151.8	0	0	0	110.2
1534	T	27.5	Very low	28.5	Very low	117 Å²	117	143.6 Å²	143.6	72%	0.718	73%	0.726	S	S	*	*			trans	12.5	144	143.4	55.8	0	0	0	0	120
1535	S	27.8	Very low	28.7	Very low	89 Å²	89	142.6 Å²	142.6	62%	0.622	72%	0.722	S	S	*	*			cis	174.1	150.2	5.5	41.5	0	0	0	0	107.6
1536	F	29	Very low	28.9	Very low	175 Å²	175	144 Å²	144	77%	0.768	72%	0.72	S	S	*	*				-178.4	140	80.4	-110.7	-91.6	0	0	0	110.7
1537	H	32	Very low	29.1	Very low	157 Å²	157	144.1 Å²	144.1	73%	0.727	71%	0.712	S	S	*	*			trans	36.1	163.4	144.9	-74.4	-128	0	0	0	123.9
1538	R	28.2	Very low	29.3	Very low	214 Å²	214	141.8 Å²	141.8	81%	0.808	71%	0.708	S	S	*	*			cis	173.2	153.9	-36.6	-150.5	179.5	-177.1	161	3.9	107.5
1539	G	30.2	Very low	29.6	Very low	58 Å²	58	142.6 Å²	142.6	60%	0.598	72%	0.717	S	S	*	*			trans	117.9	108.2	-177.1	0	0	0	0	0	110.6
1540	D	31.9	Very low	29.7	Very low	121 Å²	121	142.3 Å²	142.3	65%	0.647	73%	0.727	S	S	*	*			cis	67.6	130.3	27.4	-29.3	-40.3	0	0	0	111.1
1541	D	34.8	Very low	30	Very low	149 Å²	149	136 Å²	136	80%	0.797	72%	0.715	S	S	*	*			cis	-148.2	170.6	-4.7	-85.6	-39.9	0	0	0	107.6
1542	D	34.9	Very low	30.2	Very low	128 Å²	128	136.7 Å²	136.7	68%	0.684	72%	0.723	S	S	*	*			cis	-140.6	176.4	7.8	-172	19.8	0	0	0	110.6
1543	N	29.6	Very low	30.2	Very low	127 Å²	127	139.3 Å²	139.3	68%	0.679	72%	0.723	S	S	*	*			trans	-78.4	171.3	176.9	-55.8	-99.7	0	0	0	113.9
1544	R	31.7	Very low	30.1	Very low	225 Å²	225	137.7 Å²	137.7	85%	0.849	72%	0.723	S	S	*	*				174.6	142.4	121.2	-92.2	-167.5	-178.1	-172.3	0.7	111
1545	L	30.6	Very low	30.1	Very low	126 Å²	126	137.1 Å²	137.1	66%	0.66	72%	0.723	S	S	*	*			cis	-162.6	138.4	-22.5	-120.4	178.6	0	0	0	108
1546	L	28	Very low	30	Very low	136 Å²	136	143.3 Å²	143.3	71%	0.712	73%	0.733	S	S	*	*			trans	18.9	130.8	152.4	-92.6	60.7	0	0	0	119.4
1547	N	29.7	Very low	29.8	Very low	116 Å²	116	140.8 Å²	140.8	62%	0.62	73%	0.725	S	S	*	*				-171	146.3	68.4	-100.5	-60.8	0	0	0	114.9
1548	K	29.6	Very low	29.6	Very low	168 Å²	168	143.4 Å²	143.4	73%	0.73	73%	0.729	S	S	*	*			trans	54.5	98.5	134.4	-67	173.5	-175	179.6	0	119
1549	T	30.5	Very low	29.5	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	72%	0.722	S	S	*	*				93.4	122.4	78.7	54.6	0	0	0	0	114.4
1550	S	28	Very low	29.4	Very low	107 Å²	107	141 Å²	141	75%	0.748	73%	0.726	S	S	*	*			trans	-52.1	169.4	152	49.5	0	0	0	0	111.9
1551	P	34.9	Very low	29.2	Very low	104 Å²	104	142.5 Å²	142.5	68%	0.675	73%	0.729	S	S	*	*			cis	-156.1	-177.3	36.4	45.8	-23.7	0	0	0	120
1552	L	29.3	Very low	28.7	Very low	148 Å²	148	142.9 Å²	142.9	78%	0.775	73%	0.726	S	S	*	*			trans	51.5	114.1	138.6	-75.8	165.3	0	0	0	122.2
1553	F	26.3	Very low	28.5	Very low	188 Å²	188	145.5 Å²	145.5	83%	0.825	73%	0.734	S	S	*	*				77	158	117.6	-126.6	-110.9	0	0	0	121.9
1554	C	27.1	Very low	28.3	Very low	111 Å²	111	147.8 Å²	147.8	75%	0.75	74%	0.741	S	S	*	*			trans	78.6	135.9	161.7	-94.7	0	0	0	0	122.8
1555	S	27.6	Very low	28.2	Very low	104 Å²	104	142.8 Å²	142.8	73%	0.727	74%	0.737	S	S	*	*			trans	72.7	108.3	147.2	-167.8	0	0	0	0	118.5
1556	W	25.6	Very low	28.2	Very low	220 Å²	220	143 Å²	143	83%	0.833	74%	0.737	S	S	*	*				83.6	124.6	64.4	-93.6	-2.3	0	0	0	116.4
1557	M	25.9	Very low	28.2	Very low	122 Å²	122	143.6 Å²	143.6	60%	0.601	74%	0.737	S	S	*	*			trans	64.3	131.7	141.1	-79.5	-167.6	-84.8	0	0	123.1
1558	R	27.2	Very low	27.9	Very low	211 Å²	211	142.6 Å²	142.6	80%	0.796	74%	0.739	S	S	*	*			trans	76.5	102.6	139.9	-72.2	176.4	-176.4	-179.5	1	120.7
1559	S	25.5	Very low	27.8	Very low	97 Å²	97	143 Å²	143	68%	0.678	74%	0.741	S	S	*	*				65.3	158.3	113.7	78.2	0	0	0	0	122.4
1560	D	28	Very low	27.6	Very low	125 Å²	125	144.2 Å²	144.2	67%	0.668	74%	0.742	S	S	*	*			trans	83.8	106.2	157.1	-65.5	-66.3	0	0	0	121.1
1561	Q	28.1	Very low	27.6	Very low	153 Å²	153	144.8 Å²	144.8	72%	0.715	74%	0.737	S	S	*	*			trans	84.7	117.7	134	-63.8	-178.6	23.8	0	0	121.4
1562	Q	25.7	Very low	27.4	Very low	156 Å²	156	146.2 Å²	146.2	73%	0.729	75%	0.746	S	S	*	*				47.6	118.1	129.1	-53.3	-178.2	6.3	0	0	119.2
1563	Q	29.2	Very low	27.3	Very low	184 Å²	184	148.4 Å²	148.4	86%	0.86	75%	0.745	S	S	*	*				-167.9	152.4	90.9	-96.6	166.9	17.7	0	0	111.4
1564	Q	25.5	Very low	27.4	Very low	175 Å²	175	144.9 Å²	144.9	82%	0.818	74%	0.735	S	S	*	*			trans	-83.1	166.9	167.5	-67	-176.6	-12.2	0	0	110.1
1565	P	31	Very low	27.4	Very low	119 Å²	119	147.2 Å²	147.2	77%	0.773	74%	0.735	S	S	*	*				-143.9	134	105.4	35.1	-20.2	0	0	0	116.1
1566	I	29.7	Very low	27.4	Very low	130 Å²	130	149.4 Å²	149.4	67%	0.667	74%	0.738	S	S	*	*				45.4	107.1	121.6	-64.8	175.7	0	0	0	119
1567	E	27	Very low	27.6	Very low	150 Å²	150	146.6 Å²	146.6	70%	0.701	74%	0.739	S	S	*	*			trans	65.5	119.1	130.5	-60.1	175.9	177.7	0	0	123.2
1568	S	25.4	Very low	27.6	Very low	94 Å²	94	145.4 Å²	145.4	66%	0.657	74%	0.742	S	S	*	*			trans	81.3	162.7	132.5	75.4	0	0	0	0	120.4
1569	F	25.7	Very low	27.7	Very low	178 Å²	178	144 Å²	144	78%	0.781	74%	0.741	S	S	*	*			trans	64.8	104.9	-176	-60.4	-87.9	0	0	0	114.7
1570	L	27.6	Very low	27.9	Very low	153 Å²	153	145 Å²	145	80%	0.801	74%	0.743	S	S	*	*				77.4	108.7	81.1	-90.2	162.1	0	0	0	114.7
1571	N	27	Very low	27.9	Very low	119 Å²	119	146.4 Å²	146.4	64%	0.636	75%	0.746	S	S	*	*			trans	53.7	99.5	141.8	-165.4	30.3	0	0	0	119.5	Y1573	N1571-Y1573 PolarHBondContact O-N 3.49Å
1572	P	31.5	Very low	28	Very low	134 Å²	134	146.4 Å²	146.4	87%	0.87	75%	0.75	S	S	*	*			trans	-85.9	84.2	167.4	35.2	-31.7	0	0	0	111.6
1573	Y	27.9	Very low	28.1	Very low	193 Å²	193	147 Å²	147	76%	0.757	75%	0.75	S	S	*	*			trans	-114.4	129.9	158.7	-121.6	-77.6	0	0	0	109.1	N1571	N1571-Y1573 PolarHBondContact O-N 3.49Å
1574	D	27.8	Very low	28.2	Very low	115 Å²	115	143.7 Å²	143.7	62%	0.615	75%	0.747	S	S	*	*			trans	61.4	127.8	163.9	-99.8	39.5	0	0	0	121.1
1575	Q	27.7	Very low	28.4	Very low	160 Å²	160	140.3 Å²	140.3	75%	0.748	74%	0.743	S	S	*	*			trans	71.3	154.2	150.9	-55.2	171.2	46.2	0	0	115.6
1576	L	27.6	Very low	28.3	Very low	150 Å²	150	144.1 Å²	144.1	79%	0.785	75%	0.747	S	S	*	*			cis	-152.6	151.6	27	-169.6	70.5	0	0	0	112.5
1577	N	27.9	Very low	28.5	Very low	161 Å²	161	142.5 Å²	142.5	86%	0.861	75%	0.746	S	S	*	*			trans	-67.6	146.9	172.9	-119.3	-44.9	0	0	0	112.9
1578	C	26.7	Very low	28.7	Very low	97 Å²	97	142.3 Å²	142.3	66%	0.655	75%	0.749	S	S	*	*			trans	-141	91.2	176.3	-150	0	0	0	0	115.1
1579	K	28.7	Very low	28.8	Very low	180 Å²	180	144.1 Å²	144.1	78%	0.783	75%	0.752	S	S	*	*			trans	69.6	146.5	149.9	-64.1	166.4	-172.3	163.2	0	116.6
1580	T	29.9	Very low	29	Very low	119 Å²	119	141.5 Å²	141.5	73%	0.73	75%	0.746	S	S	*	*			cis	-156	147.7	19.2	-16.9	0	0	0	0	114.2
1581	Q	27.7	Very low	29.1	Very low	155 Å²	155	140 Å²	140	72%	0.724	74%	0.739	S	S	*	*			trans	59.7	108	154.5	-50.3	-142.6	36.5	0	0	122.4
1582	L	30.1	Very low	29.2	Very low	153 Å²	153	140.3 Å²	140.3	80%	0.801	74%	0.74	S	S	*	*				175.5	88.7	115.3	-92.6	167.1	0	0	0	109.2
1583	K	29.4	Very low	29	Very low	168 Å²	168	140.4 Å²	140.4	73%	0.73	73%	0.734	S	S	*	*				76.5	117.4	100.3	-79.4	-169.2	-179.2	176	0	116.8
1584	S	29.9	Very low	29	Very low	114 Å²	114	137.1 Å²	137.1	80%	0.797	74%	0.738	S	S	*	*			trans	63	147.7	155.9	44.1	0	0	0	0	120.3
1585	S	30.4	Very low	29.1	Very low	105 Å²	105	134.4 Å²	134.4	73%	0.734	74%	0.738	S	S	*	*			cis	-176.1	141.6	-24	49.8	0	0	0	0	111.7
1586	K	29	Very low	29	Very low	198 Å²	198	135.3 Å²	135.3	86%	0.861	74%	0.739	S	S	*	*			trans	26.4	158.3	142	-70.2	-172.8	176.6	-175.7	0	121.9
1587	P	33.3	Very low	28.9	Very low	97 Å²	97	135.2 Å²	135.2	63%	0.63	74%	0.735	S	S	*	*			cis	-141.6	-164.4	-35.6	42.7	-24.5	0	0	0	112.5
1588	N	30.6	Very low	28.8	Very low	146 Å²	146	133.7 Å²	133.7	78%	0.781	73%	0.727	S	S	*	*			trans	64.4	125.7	164.7	-61.7	-4.8	0	0	0	116.7
1589	N	27.8	Very low	28.9	Very low	132 Å²	132	137.2 Å²	137.2	71%	0.706	73%	0.733	S	S	*	*			cis	68	84.7	47.8	-166.6	52.7	0	0	0	114.2
1590	N	29.7	Very low	28.9	Very low	123 Å²	123	133.9 Å²	133.9	66%	0.658	73%	0.728	S	S	*	*				-179.8	151.3	122.6	-95.6	-13.4	0	0	0	113.5
1591	N	30.6	Very low	28.8	Very low	122 Å²	122	133.4 Å²	133.4	65%	0.652	73%	0.725	S	S	*	*			trans	63.9	106.7	145	-65.9	-7.2	0	0	0	121.8
1592	N	29.1	Very low	28.9	Very low	124 Å²	124	131.6 Å²	131.6	66%	0.663	73%	0.725	S	S	*	*				77.3	117.3	111.9	-58.1	-12	0	0	0	120.9
1593	N	27.8	Very low	29	Very low	137 Å²	137	129.3 Å²	129.3	73%	0.733	72%	0.717	S	S	*	*				66	107.1	123.1	-60.9	-3.8	0	0	0	120
1594	S	27	Very low	29.1	Very low	123 Å²	123	127.5 Å²	127.5	86%	0.86	72%	0.716	S	S	*	*				77.3	174.3	120.4	81.9	0	0	0	0	117.7
1595	G	29.5	Very low	29.3	Very low	58 Å²	58	127.7 Å²	127.7	60%	0.598	71%	0.708	S	S	*	*			trans	101.4	96.8	-153.7	0	0	0	0	0	107.2
1596	K	26.9	Very low	29.5	Very low	180 Å²	180	128.2 Å²	128.2	78%	0.783	70%	0.702	S	S	*	*				56.3	98.1	79.3	-65.4	-172.1	175.2	-178.9	0	110
1597	Q	25.2	Very low	29.7	Very low	148 Å²	148	122.7 Å²	122.7	69%	0.692	68%	0.682	S	S	*	*				91	137	92.1	-84.8	175.2	-45	0	0	110.5
1598	N	26.1	Very low	29.8	Very low	129 Å²	129	122.2 Å²	122.2	69%	0.69	67%	0.674	S	S	*	*			trans	29.6	119.4	137.7	-44.8	-8.6	0	0	0	116.5
1599	H	29.2	Very low	29.9	Very low	171 Å²	171	119.5 Å²	119.5	79%	0.792	66%	0.66	S	S	*	*				-159	111.7	116.5	-107.6	-69.9	0	0	0	112.4
1600	T	27.8	Very low	30.1	Very low	110 Å²	110	117.7 Å²	117.7	68%	0.675	65%	0.65	S	S	*	*			trans	69.2	157.3	135.6	47.5	0	0	0	0	119.2
1601	T	28.7	Very low	30.1	Very low	108 Å²	108	115.5 Å²	115.5	66%	0.663	65%	0.645	S	S	*	*			cis	-153.5	136.9	13.7	-9.8	0	0	0	0	111.3
1602	T	28.6	Very low	30.1	Very low	117 Å²	117	114.7 Å²	114.7	72%	0.718	65%	0.648	S	S	*	*			trans	45.3	151.8	135.3	61.2	0	0	0	0	121.6
1603	T	32.3	Very low	30.1	Very low	105 Å²	105	111.6 Å²	111.6	64%	0.644	65%	0.646	S	S	*	*			cis	-165.7	148.4	26.8	-12.3	0	0	0	0	111.1
1604	N	30.8	Very low	30.2	Very low	131 Å²	131	108.6 Å²	108.6	70%	0.701	65%	0.647	S	S	*	*			trans	44.6	146.3	137.2	-62.1	7.4	0	0	0	121
1605	N	34.3	Very low	30.5	Very low	118 Å²	118	107.7 Å²	107.7	63%	0.631	65%	0.647	S	S	*	*			cis	-170.4	178.1	2.3	-105.1	-2.7	0	0	0	106.6
1606	N	35.4	Very low	30.6	Very low	115 Å²	115	109 Å²	109	62%	0.615	66%	0.661	S	S	*	*			cis	-156.3	156.4	1.7	-115.8	-11.9	0	0	0	106.3
1607	N	34	Very low	30.9	Very low	83 Å²	83	104.3 Å²	104.3	44%	0.444	66%	0.663	S	S	.	*				55.1	137.5	66.9	-58.8	-48.1	0	0	0	115
1608	N	34.4	Very low	31.2	Very low	86 Å²	86	101.4 Å²	101.4	46%	0.46	67%	0.673	S	S	.	*			cis	-161.1	166.8	6.6	-117.4	-20.9	0	0	0	112.3	K1702	N1608-K1702 WeakPolarHBondContact O-CE 3.32Å; N1608-K1702 PolarHBondContact O-NZ 2.82Å
1609	N	33.2	Very low	31.4	Very low	89 Å²	89	99 Å²	99	48%	0.476	68%	0.678	S	S	.	*			trans	35.3	147.6	139.8	-53.4	-17.1	0	0	0	121.9	K1702	N1609-K1702 WeakPolarHBondContact O-CE 3.29Å; N1609-K1702 PolarHBondContact O-NZ 3.12Å
1610	N	31.2	Very low	31.3	Very low	94 Å²	94	95 Å²	95	50%	0.503	68%	0.683	S	S	.	*			cis	-162	-172.9	-12.4	-97.8	-16.5	0	0	0	108.1
1611	S	30.1	Very low	31.4	Very low	78 Å²	78	92.6 Å²	92.6	55%	0.545	68%	0.681	S	S	.	*			trans	16.1	145	146.2	57.2	0	0	0	0	121.4
1612	S	29.7	Very low	31.5	Very low	104 Å²	104	96.5 Å²	96.5	73%	0.727	69%	0.691	S	S	*	*			cis	-179.1	157	10.6	41.6	0	0	0	0	114.1
1613	G	30.1	Very low	31.5	Very low	60 Å²	60	95 Å²	95	62%	0.619	69%	0.686	S	S	*	*			trans	123.5	123.1	138.4	0	0	0	0	0	119.5
1614	G	30.4	Very low	31.3	Very low	74 Å²	74	96.5 Å²	96.5	76%	0.763	69%	0.69	S	S	*	*			trans	74.1	170.1	155.9	0	0	0	0	0	118.5
1615	A	32.7	Very low	31	Very low	103 Å²	103	96.3 Å²	96.3	85%	0.851	69%	0.689	S	S	*	*			cis	-167.8	136.8	-23.5	0	0	0	0	0	111.1
1616	G	32.1	Very low	30.7	Very low	86 Å²	86	98.1 Å²	98.1	89%	0.887	70%	0.699	S	S	*	*			trans	75.9	159.7	168.6	0	0	0	0	0	116.6
1617	G	32.1	Very low	30.2	Very low	81 Å²	81	97.2 Å²	97.2	84%	0.835	70%	0.701	S	S	*	*			cis	162.6	119.8	-11.1	0	0	0	0	0	114.6
1618	G	31.8	Very low	29.8	Very low	87 Å²	87	97.6 Å²	97.6	90%	0.897	71%	0.711	S	S	*	*			trans	79.7	154.4	170.7	0	0	0	0	0	115.6
1619	G	30.1	Very low	29.3	Very low	78 Å²	78	99.5 Å²	99.5	80%	0.804	72%	0.721	S	S	*	*			cis	166	138.6	-8	0	0	0	0	0	113.5
1620	G	28.5	Very low	29	Very low	87 Å²	87	102.9 Å²	102.9	90%	0.897	74%	0.737	S	S	*	*			trans	79.5	147.9	178.3	0	0	0	0	0	114.3
1621	G	28	Very low	28.6	Very low	61 Å²	61	105.1 Å²	105.1	63%	0.629	74%	0.744	S	S	*	*			cis	151.9	159.7	-4.2	0	0	0	0	0	112.5
1622	H	32.5	Very low	28.5	Very low	189 Å²	189	107.8 Å²	107.8	88%	0.875	76%	0.757	S	S	*	*			trans	74.9	119.2	-169.1	-49.9	84.7	0	0	0	112.7
1623	S	27.2	Very low	28.3	Very low	86 Å²	86	109.1 Å²	109.1	60%	0.601	76%	0.755	S	S	*	*			cis	79.1	100.5	41.7	-171.4	0	0	0	0	113.1
1624	N	28.9	Very low	28.1	Very low	136 Å²	136	115.1 Å²	115.1	73%	0.727	76%	0.764	S	S	*	*				-168.6	133	113.5	-85.8	-22.3	0	0	0	106.9
1625	N	25.2	Very low	28	Very low	127 Å²	127	116.6 Å²	116.6	68%	0.679	76%	0.761	S	S	*	*				67.3	140.2	67.4	-69.3	-35.2	0	0	0	112.7
1626	N	26.5	Very low	27.8	Very low	157 Å²	157	119 Å²	119	84%	0.84	76%	0.759	S	S	*	*			trans	73.4	146.6	-174	-50.2	-16.2	0	0	0	114.1
1627	S	25.1	Very low	27.5	Very low	95 Å²	95	122 Å²	122	66%	0.664	75%	0.753	S	S	*	*			cis	-176.3	-171	-25.3	52.2	0	0	0	0	107
1628	S	26.4	Very low	27.2	Very low	92 Å²	92	128 Å²	128	64%	0.643	76%	0.757	S	S	*	*			trans	54.3	101.6	148.3	51.5	0	0	0	0	118.3
1629	N	24.3	Very low	27	Very low	125 Å²	125	130.7 Å²	130.7	67%	0.668	75%	0.746	S	S	*	*				25.2	126.2	121.2	-48.6	-0.5	0	0	0	117.9
1630	I	25.3	Very low	26.7	Very low	161 Å²	161	134.3 Å²	134.3	83%	0.826	75%	0.746	S	S	*	*				-161.5	147.4	121.8	-102.2	151.1	0	0	0	109
1631	H	24.6	Very low	26.6	Very low	140 Å²	140	136 Å²	136	65%	0.648	73%	0.73	S	S	*	*			trans	-68	149	176	-80.8	-111.4	0	0	0	111.4
1632	T	26.8	Very low	26.4	Very low	134 Å²	134	138.7 Å²	138.7	82%	0.822	74%	0.737	S	S	*	*			trans	-139.6	115	148.9	-23.8	0	0	0	0	107.4
1633	I	26.1	Very low	26.2	Very low	133 Å²	133	137 Å²	137	68%	0.682	73%	0.734	S	S	*	*			trans	-93	128.4	-174.6	-65.6	168.4	0	0	0	107.6	P1635	I1633-P1635 VanDerWaalsContact O-CD 3.23Å; I1633-P1635 WeakPolarHBondContact O-CD 3.28Å
1634	F	24.7	Very low	26.2	Very low	185 Å²	185	138.9 Å²	138.9	81%	0.811	74%	0.742	S	S	*	*			trans	-83.4	114.5	162.6	-75.2	-97.7	0	0	0	108.4
1635	P	29.9	Very low	26.1	Very low	106 Å²	106	141.1 Å²	141.1	69%	0.688	75%	0.747	S	S	*	*			trans	-82.4	107	158.7	32.1	-28.4	0	0	0	107.9	I1633 I1637	I1633-P1635 VanDerWaalsContact O-CD 3.23Å; I1633-P1635 WeakPolarHBondContact O-CD 3.28Å; P1635-I1637 PolarHBondContact O-N 2.74Å; P1635-I1637 VanDerWaalsContact O-N 3.15Å
1636	D	26.8	Very low	26.2	Very low	153 Å²	153	140 Å²	140	82%	0.818	75%	0.75	S	S	*	*			trans	-61.7	120.1	177.3	-85.8	-45	0	0	0	110.7	F1638	D1636-F1638 PolarHBondContact O-N 2.9Å
1637	I	27.6	Very low	26.1	Very low	148 Å²	148	141 Å²	141	76%	0.759	75%	0.749	S	S	*	*			trans	-68.3	129.3	180	-66	168.4	0	0	0	108.7	P1635 Q1639	P1635-I1637 PolarHBondContact O-N 2.74Å; P1635-I1637 VanDerWaalsContact O-N 3.15Å; I1637-Q1639 VanDerWaalsContact C-N 3.28Å; I1637-Q1639 PolarHBondContact O-N 3.02Å
1638	F	25.2	Very low	26.1	Very low	208 Å²	208	145.2 Å²	145.2	91%	0.912	76%	0.763	S	S	*	*			trans	-65.1	84.9	170.3	-104.6	-90.3	0	0	0	110.5	D1636 L1640	D1636-F1638 PolarHBondContact O-N 2.9Å; F1638-L1640 PolarHBondContact O-N 2.79Å; F1638-L1640 VanDerWaalsContact O-N 3.11Å
1639	Q	26.4	Very low	26.1	Very low	144 Å²	144	145.2 Å²	145.2	67%	0.673	76%	0.763	S	S	*	*			trans	-69	106.2	170.8	-76	-160.1	-0.6	0	0	110.4	I1637 Q1641	I1637-Q1639 VanDerWaalsContact C-N 3.28Å; I1637-Q1639 PolarHBondContact O-N 3.02Å; Q1639-Q1641 VanDerWaalsContact C-N 3.25Å; Q1639-Q1641 HydrophobicContact CB-CG 4.28Å; Q1639-Q1641 PolarHBondContact O-N 2.98Å; Q1639-Q1641 VanDerWaalsContact OE1-NE2 3.16Å
1640	L	25.4	Very low	26.3	Very low	153 Å²	153	145.8 Å²	145.8	80%	0.801	77%	0.767	S	S	*	*			trans	-71.8	84.4	154.8	-76.7	167.8	0	0	0	108.8	F1638 P1642	F1638-L1640 PolarHBondContact O-N 2.79Å; F1638-L1640 VanDerWaalsContact O-N 3.11Å; L1640-P1642 WeakPolarHBondContact O-CD 3.42Å
1641	Q	25.8	Very low	26.3	Very low	122 Å²	122	144.7 Å²	144.7	57%	0.57	76%	0.762	S	S	*	*			trans	-74.1	126.7	167.2	-73.6	-168.2	-13.9	0	0	110.4	Q1639 L1643	Q1639-Q1641 VanDerWaalsContact C-N 3.25Å; Q1639-Q1641 HydrophobicContact CB-CG 4.28Å; Q1639-Q1641 PolarHBondContact O-N 2.98Å; Q1639-Q1641 VanDerWaalsContact OE1-NE2 3.16Å; Q1641-L1643 PolarHBondContact O-N 3.13Å
1642	P	24.5	Very low	26.7	Very low	118 Å²	118	146 Å²	146	77%	0.766	77%	0.769	S	S	*	*			trans	-80.5	103.3	166.2	31.7	-30.5	0	0	0	109.4	L1640	L1640-P1642 WeakPolarHBondContact O-CD 3.42Å
1643	L	26.7	Very low	26.7	Very low	154 Å²	154	147 Å²	147	81%	0.806	76%	0.764	S	S	*	*			trans	-97.4	98.2	175.7	-79.5	171	0	0	0	111.3	Q1641	Q1641-L1643 PolarHBondContact O-N 3.13Å
1644	T	27.3	Very low	26.7	Very low	126 Å²	126	148.3 Å²	148.3	77%	0.773	77%	0.771	S	S	*	*			trans	-103.1	128.4	167.3	43.4	0	0	0	0	110.5
1645	H	27.7	Very low	26.8	Very low	182 Å²	182	144.5 Å²	144.5	84%	0.843	77%	0.767	S	S	*	*			trans	44.7	126.4	159	-94.1	-93.7	0	0	0	122.4
1646	S	26.2	Very low	26.6	Very low	105 Å²	105	144.5 Å²	144.5	73%	0.734	77%	0.769	S	S	*	*			trans	96	156.2	137.3	82	0	0	0	0	120
1647	Q	26.2	Very low	26.8	Very low	177 Å²	177	142 Å²	142	83%	0.827	76%	0.763	S	S	*	*			trans	66.8	60.4	176	-57.7	-162.9	-22.1	0	0	117.4
1648	L	25	Very low	26.9	Very low	183 Å²	183	142.1 Å²	142.1	96%	0.958	76%	0.76	S	S	*	*			trans	-115.1	84.6	139.5	-104.8	169.4	0	0	0	109.3
1649	S	25.2	Very low	27	Very low	92 Å²	92	138.9 Å²	138.9	64%	0.643	75%	0.752	S	S	*	*			trans	-123.2	102.3	163.7	57.2	0	0	0	0	108
1650	D	28.4	Very low	27.2	Very low	138 Å²	138	139.8 Å²	139.8	74%	0.738	76%	0.761	S	S	*	*			trans	-174.5	101.4	131.7	-94.8	-29	0	0	0	111.9
1651	N	26.7	Very low	27.2	Very low	138 Å²	138	136.7 Å²	136.7	74%	0.738	75%	0.751	S	S	*	*				41.4	88.6	125.5	-56	-51.4	0	0	0	119.1
1652	H	31.5	Very low	27.2	Very low	168 Å²	168	139 Å²	139	78%	0.778	76%	0.762	S	S	*	*				-130.8	117.3	123.6	-86.5	-72.7	0	0	0	106.4
1653	E	27.4	Very low	27.3	Very low	153 Å²	153	139.6 Å²	139.6	72%	0.715	76%	0.763	S	S	*	*				59.8	101.3	87.3	-65.7	-178.3	149.2	0	0	110.6
1654	I	26.8	Very low	27.3	Very low	162 Å²	162	139 Å²	139	83%	0.831	76%	0.761	S	S	*	*				53.8	102.4	52.7	-47	177.1	0	0	0	112.1
1655	S	25.5	Very low	27.4	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	76%	0.756	S	S	*	*				178.2	147.7	125.6	43.9	0	0	0	0	113.2
1656	S	26.9	Very low	27.3	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	75%	0.748	S	S	*	*			trans	65.2	152	157	71.4	0	0	0	0	118.6
1657	C	29.3	Very low	27.3	Very low	100 Å²	100	140.4 Å²	140.4	68%	0.676	74%	0.74	S	S	*	*			cis	-109.8	122.8	-5.9	-86.4	0	0	0	0	108.6
1658	E	31	Very low	27.2	Very low	150 Å²	150	139.8 Å²	139.8	70%	0.701	74%	0.74	S	S	*	*				75.5	107.6	97.9	-69.1	175.1	131.8	0	0	113
1659	N	28	Very low	27.2	Very low	141 Å²	141	135.9 Å²	135.9	75%	0.754	73%	0.727	S	S	*	*				69.6	109.1	77.7	-67.6	-29.4	0	0	0	113
1660	L	28.9	Very low	27.2	Very low	162 Å²	162	135.3 Å²	135.3	85%	0.848	72%	0.72	S	S	*	*				-149.5	121.8	115.8	-118.5	68.6	0	0	0	105.5
1661	C	26.3	Very low	27.3	Very low	89 Å²	89	134.5 Å²	134.5	60%	0.601	72%	0.715	S	S	*	*				62.9	103.9	94.6	-61.6	0	0	0	0	111.9
1662	Q	25.8	Very low	27.5	Very low	171 Å²	171	135.8 Å²	135.8	80%	0.799	71%	0.713	S	S	*	*				84.1	152.8	81.1	-81.7	176.8	-16	0	0	111.7
1663	T	27	Very low	27.3	Very low	129 Å²	129	133.4 Å²	133.4	79%	0.791	71%	0.713	S	S	*	*			trans	66.5	131.2	-159.2	65	0	0	0	0	112.2
1664	D	26.7	Very low	27.4	Very low	141 Å²	141	134.2 Å²	134.2	75%	0.754	72%	0.722	S	S	*	*			cis	-101.9	161.7	-4.4	-68	-51	0	0	0	110.9
1665	E	28.8	Very low	27.7	Very low	145 Å²	145	135.3 Å²	135.3	68%	0.678	72%	0.721	S	S	*	*			cis	66.7	136.9	39.4	-70.7	-141.8	172.3	0	0	114.2
1666	F	26.3	Very low	28.1	Very low	152 Å²	152	139.1 Å²	139.1	67%	0.667	72%	0.724	S	S	*	*			cis	-160.6	-173.8	-30.5	-132.3	-157	0	0	0	111
1667	Y	26	Very low	28.2	Very low	146 Å²	146	141 Å²	141	57%	0.573	73%	0.725	S	S	*	*			trans	-40	140.4	148.5	-73.5	-106.4	0	0	0	111.8
1668	M	23.4	Very low	28.1	Very low	165 Å²	165	142.4 Å²	142.4	81%	0.813	73%	0.726	S	S	*	*				-155.5	107.7	105.6	-72.1	-44.4	154	0	0	106.9
1669	S	24.8	Very low	28.1	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	72%	0.721	S	S	*	*	S	Bend	cis	-149.7	155	46.6	116.4	0	0	0	0	111
1670	T	25.5	Very low	28.2	Very low	81 Å²	81	139.9 Å²	139.9	50%	0.497	72%	0.717	S	S	.	*			cis	-162.6	166.8	-9.6	20.9	0	0	0	0	108.1
1671	I	30.5	Very low	28.4	Very low	121 Å²	121	138.7 Å²	138.7	62%	0.621	71%	0.712	S	S	*	*			trans	63.8	112.9	149.3	-75.6	160.1	0	0	0	116.4
1672	K	31.5	Very low	28.6	Very low	164 Å²	164	140 Å²	140	71%	0.713	71%	0.713	S	S	*	*			cis	-154.8	141	5.5	-89.8	152	-169.2	127.7	0	109.2
1673	P	26.6	Very low	28.8	Very low	119 Å²	119	137.5 Å²	137.5	77%	0.773	71%	0.705	S	S	*	*			trans	-74.8	161.3	169.7	32.5	-35.7	0	0	0	112.2	K1675	P1673-K1675 PolarHBondContact O-N 2.8Å
1674	N	30.7	Very low	28.9	Very low	170 Å²	170	135.6 Å²	135.6	91%	0.909	69%	0.694	S	S	*	*			trans	-78.6	121.3	-175.4	-139.2	-14	0	0	0	112.1	K1676	N1674-K1676 PolarHBondContact O-N 3.06Å
1675	K	32.4	Very low	29.2	Very low	185 Å²	185	135.2 Å²	135.2	80%	0.804	69%	0.691	S	S	*	*			trans	-68.7	106.4	-175.2	-81.5	178.1	172.7	174.8	0	113.1	P1673	P1673-K1675 PolarHBondContact O-N 2.8Å
1676	K	34.3	Very low	29.1	Very low	183 Å²	183	135.1 Å²	135.1	80%	0.796	69%	0.693	S	S	*	*				156.1	124.9	115.5	-85.4	163	177.8	-176.2	0	110	N1674	N1674-K1676 PolarHBondContact O-N 3.06Å
1677	L	28.3	Very low	29.1	Very low	147 Å²	147	131.9 Å²	131.9	77%	0.77	68%	0.681	S	S	*	*				86.9	100.2	50.7	-170	132.5	0	0	0	113.2
1678	N	28.1	Very low	29.1	Very low	130 Å²	130	133.4 Å²	133.4	70%	0.695	69%	0.691	S	S	*	*			trans	86	142	144.4	-99.9	11.1	0	0	0	123.3
1679	N	30.5	Very low	29.2	Very low	110 Å²	110	130 Å²	130	59%	0.588	68%	0.68	S	S	*	*			trans	78.7	93.8	142.3	-70.9	1.4	0	0	0	120
1680	N	30.2	Very low	29.1	Very low	127 Å²	127	132.5 Å²	132.5	68%	0.679	69%	0.686	S	S	*	*				87.3	148.8	115.1	-62	-14.4	0	0	0	118.7
1681	N	32.9	Very low	29.1	Very low	137 Å²	137	133.5 Å²	133.5	73%	0.733	70%	0.696	S	S	*	*			trans	72.7	115.6	170.5	-62.5	-34.9	0	0	0	113.7
1682	N	30.4	Very low	28.8	Very low	117 Å²	117	132.2 Å²	132.2	63%	0.626	70%	0.698	S	S	*	*				63.7	94.7	75.5	-68.5	-56.7	0	0	0	109.3
1683	N	30.7	Very low	28.5	Very low	119 Å²	119	128.8 Å²	128.8	64%	0.636	69%	0.694	S	S	*	*				82.4	125.1	77.6	-74.9	-30.9	0	0	0	110.1
1684	T	28.7	Very low	28.5	Very low	89 Å²	89	129.8 Å²	129.8	55%	0.546	69%	0.693	S	S	.	*				77.2	113.6	-109	64.5	0	0	0	0	109.7	I1687	T1684-I1687 HydrophobicContact CG2-CD1 4.22Å; T1684-I1687 HydrophobicContact CG2-CG1 4.17Å
1685	D	32.1	Very low	28.3	Very low	132 Å²	132	130.6 Å²	130.6	71%	0.706	69%	0.689	S	S	*	*			cis	-131.8	136	18.9	-86.9	-27.1	0	0	0	112	I1687	D1685-I1687 WeakPolarHBondContact OD1-CD1 3.28Å
1686	M	27.4	Very low	28.2	Very low	143 Å²	143	128.8 Å²	128.8	70%	0.704	69%	0.687	S	S	*	*			cis	56.9	-175	4.7	-70.2	-171.7	-89.8	0	0	113.5
1687	I	26.9	Very low	27.8	Very low	84 Å²	84	127 Å²	127	43%	0.431	68%	0.683	S	S	.	*			cis	-114.9	147.7	-13.3	-34.5	100.1	0	0	0	104	T1684 D1685 T1689	T1684-I1687 HydrophobicContact CG2-CD1 4.22Å; T1684-I1687 HydrophobicContact CG2-CG1 4.17Å; D1685-I1687 WeakPolarHBondContact OD1-CD1 3.28Å; I1687-T1689 HydrophobicContact CG2-CG2 4.01Å
1688	F	25.2	Very low	28	Very low	178 Å²	178	125.3 Å²	125.3	78%	0.781	68%	0.681	S	S	*	*				-148.2	125.8	50.4	-78.3	-98	0	0	0	108.8
1689	T	25	Very low	28	Very low	94 Å²	94	123.1 Å²	123.1	58%	0.577	67%	0.672	S	S	*	*				46.8	113.2	86.8	71	0	0	0	0	112.2	I1687	I1687-T1689 HydrophobicContact CG2-CG2 4.01Å
1690	N	24.1	Very low	27.9	Very low	152 Å²	152	121.7 Å²	121.7	81%	0.813	66%	0.664	S	S	*	*				63.3	135.9	80.1	-170	15.4	0	0	0	112.3
1691	S	24.7	Very low	27.9	Very low	102 Å²	102	121.6 Å²	121.6	71%	0.713	66%	0.664	S	S	*	*			trans	65.9	156.6	-161.8	94.1	0	0	0	0	113.2
1692	S	24.7	Very low	27.5	Very low	94 Å²	94	121.3 Å²	121.3	66%	0.657	66%	0.656	S	S	*	*			cis	-169.3	154.3	-28.4	48.5	0	0	0	0	110
1693	S	25.2	Very low	27.3	Very low	92 Å²	92	118.4 Å²	118.4	64%	0.643	64%	0.644	S	S	*	*			trans	68.4	150	150.4	83.7	0	0	0	0	119.1
1694	N	26.7	Very low	27.1	Very low	141 Å²	141	117.8 Å²	117.8	75%	0.754	64%	0.641	S	S	*	*			trans	32.5	107	130.7	-49.9	-21.1	0	0	0	117.6
1695	K	26.7	Very low	27.1	Very low	187 Å²	187	118.1 Å²	118.1	81%	0.813	64%	0.638	S	S	*	*				-175.4	136.8	91	-95.3	-179.9	-179.1	175.5	0	114.1
1696	L	28.8	Very low	26.9	Very low	147 Å²	147	117.5 Å²	117.5	77%	0.77	64%	0.635	S	S	*	*			trans	43.4	95.8	141.6	-79	82.9	0	0	0	118.8
1697	M	27	Very low	27	Very low	145 Å²	145	118.2 Å²	118.2	71%	0.714	64%	0.636	S	S	*	*				-9.9	142.2	108.8	-99.5	-169.5	179	0	0	115.8	T1699	M1697-T1699 HydrophobicContact CB-CG2 4.36Å
1698	P	32	Very low	27.2	Very low	112 Å²	112	119.8 Å²	119.8	73%	0.727	65%	0.645	S	S	*	*				-76.8	126.3	109.1	31.8	-29.2	0	0	0	108.6
1699	T	27.8	Very low	27.5	Very low	83 Å²	83	117 Å²	117	51%	0.509	64%	0.639	S	S	.	*			cis	55.5	119.8	47.5	80.8	0	0	0	0	111.2	M1697	M1697-T1699 HydrophobicContact CB-CG2 4.36Å
1700	L	28.7	Very low	27.8	Very low	80 Å²	80	119.5 Å²	119.5	42%	0.419	65%	0.648	S	S	.	*			cis	-133.8	151.6	12	-67.4	89.7	0	0	0	108.7
1701	N	29.7	Very low	28.1	Very low	126 Å²	126	118.4 Å²	118.4	67%	0.674	64%	0.642	S	S	*	*			cis	67.6	64.1	17.3	-145.1	14.7	0	0	0	116.3
1702	K	25.6	Very low	28.3	Very low	130 Å²	130	119.9 Å²	119.9	57%	0.565	64%	0.642	S	S	*	*			trans	-117.8	111.4	138.2	-96.6	-176.5	156.9	166.8	0	106.3	N1608 N1609	N1608-K1702 WeakPolarHBondContact O-CE 3.32Å; N1608-K1702 PolarHBondContact O-NZ 2.82Å; N1609-K1702 WeakPolarHBondContact O-CE 3.29Å; N1609-K1702 PolarHBondContact O-NZ 3.12Å
1703	C	25.6	Very low	28.5	Very low	56 Å²	56	122 Å²	122	38%	0.378	65%	0.647	S	S	.	*				71	129.1	77	-70.5	0	0	0	0	112
1704	N	27.4	Very low	28.7	Very low	107 Å²	107	125.1 Å²	125.1	57%	0.572	65%	0.651	S	S	*	*			cis	-170.5	-171.4	5	-122.3	3.6	0	0	0	110.9
1705	I	27.8	Very low	28.6	Very low	95 Å²	95	122.5 Å²	122.5	49%	0.487	64%	0.643	S	S	.	*			trans	79.3	130.1	148.3	-75.2	138.3	0	0	0	116.7
1706	L	27.1	Very low	28.5	Very low	120 Å²	120	121.4 Å²	121.4	63%	0.628	65%	0.646	S	S	*	*			cis	-159.5	125.3	-15.6	-102	168.5	0	0	0	107.6
1707	H	31	Very low	28.4	Very low	157 Å²	157	119.9 Å²	119.9	73%	0.727	64%	0.644	S	S	*	*			trans	58	-178.1	139.3	-73.3	-122.2	0	0	0	116.4
1708	N	30.3	Very low	28.3	Very low	117 Å²	117	120 Å²	120	63%	0.626	65%	0.648	S	S	*	*			cis	-144.8	160.4	-17.4	-120.8	4.7	0	0	0	105
1709	N	31.1	Very low	28	Very low	121 Å²	121	123.7 Å²	123.7	65%	0.647	65%	0.648	S	S	*	*			cis	-155	145.8	8.5	-140.7	-7.8	0	0	0	108.5
1710	N	32.1	Very low	28.3	Very low	145 Å²	145	126 Å²	126	78%	0.775	67%	0.665	S	S	*	*			trans	-72.7	140.8	153.2	-87.3	-24.8	0	0	0	108.3
1711	N	31	Very low	28.2	Very low	129 Å²	129	126.3 Å²	126.3	69%	0.69	67%	0.671	S	S	*	*			trans	-176.3	121	139	-92.5	-28.5	0	0	0	107.2
1712	N	28.9	Very low	28	Very low	133 Å²	133	126 Å²	126	71%	0.711	67%	0.673	S	S	*	*				47.6	96.7	74.2	-69.1	-21.2	0	0	0	112
1713	N	27.5	Very low	28.1	Very low	140 Å²	140	125.6 Å²	125.6	75%	0.749	68%	0.677	S	S	*	*				176.1	147	118.2	-88.5	-18.9	0	0	0	111.7
1714	H	29.5	Very low	28.2	Very low	157 Å²	157	130.5 Å²	130.5	73%	0.727	69%	0.694	S	S	*	*			trans	57.2	119.6	164	-59.4	-54.2	0	0	0	117.3
1715	S	25.2	Very low	28.3	Very low	86 Å²	86	130.7 Å²	130.7	60%	0.601	70%	0.703	S	S	*	*				63.5	106.1	55.4	83.9	0	0	0	0	113
1716	L	24.3	Very low	28.4	Very low	164 Å²	164	131.4 Å²	131.4	86%	0.859	71%	0.712	S	S	*	*			trans	70.3	154.7	-171.1	-68.8	85.3	0	0	0	114.2
1717	P	27.4	Very low	28.8	Very low	114 Å²	114	133.5 Å²	133.5	74%	0.74	72%	0.718	S	S	*	*			cis	-112	164	4.1	40	-30.7	0	0	0	115.7
1718	N	25	Very low	28.9	Very low	148 Å²	148	132 Å²	132	79%	0.791	72%	0.716	S	S	*	*			trans	-66.5	138.2	159.4	-66.8	-36.8	0	0	0	110.3
1719	Y	25.9	Very low	29.1	Very low	189 Å²	189	133.3 Å²	133.3	74%	0.741	72%	0.722	S	S	*	*			trans	56	144.3	163.1	-69.8	-73.2	0	0	0	117.6	T1721	Y1719-T1721 HydrophobicContact CD1-CG2 3.44Å; Y1719-T1721 VanDerWaalsContact CD1-CG2 3.44Å; Y1719-T1721 HydrophobicContact CE1-CG2 3.67Å; Y1719-T1721 HydrophobicContact CG-CG2 4.09Å
1720	P	33.7	Very low	29	Very low	133 Å²	133	131.7 Å²	131.7	86%	0.864	72%	0.72	S	S	*	*				-116.3	133.2	92.3	32.8	-33.7	0	0	0	112.4
1721	T	25.8	Very low	29	Very low	86 Å²	86	131.3 Å²	131.3	53%	0.528	72%	0.718	S	S	.	*			trans	-76.4	162.4	162	47.9	0	0	0	0	110.7	Y1719	Y1719-T1721 HydrophobicContact CD1-CG2 3.44Å; Y1719-T1721 VanDerWaalsContact CD1-CG2 3.44Å; Y1719-T1721 HydrophobicContact CE1-CG2 3.67Å; Y1719-T1721 HydrophobicContact CG-CG2 4.09Å
1722	T	26.3	Very low	29	Very low	118 Å²	118	130.4 Å²	130.4	72%	0.724	72%	0.72	S	S	*	*			trans	72.8	156.1	142.8	42	0	0	0	0	120.5
1723	N	27.6	Very low	29.1	Very low	123 Å²	123	131 Å²	131	66%	0.658	72%	0.723	S	S	*	*			trans	89.6	130.7	163.5	-68.2	8.4	0	0	0	117.3
1724	E	28.3	Very low	29.2	Very low	158 Å²	158	131.2 Å²	131.2	74%	0.738	72%	0.724	S	S	*	*			cis	-156.5	178	3.8	-133.8	153.1	-161.4	0	0	115.9
1725	C	29.5	Very low	29.4	Very low	112 Å²	112	129.4 Å²	129.4	76%	0.757	73%	0.726	S	S	*	*			trans	89.3	118	169.6	-61	0	0	0	0	119.1
1726	T	29.9	Very low	29.4	Very low	109 Å²	109	130.2 Å²	130.2	67%	0.669	73%	0.727	S	S	*	*			cis	-166.7	163	-24.2	-0	0	0	0	0	110.6
1727	H	35.5	Very low	29.7	Very low	164 Å²	164	129 Å²	129	76%	0.759	72%	0.722	S	S	*	*			trans	80.3	142.5	178.3	-56.1	-65.5	0	0	0	116.9
1728	N	32.9	Very low	29.6	Very low	127 Å²	127	129.5 Å²	129.5	68%	0.679	72%	0.719	S	S	*	*			cis	-177.5	152.6	-26.2	-101.6	-3.8	0	0	0	105
1729	L	34.6	Very low	29.9	Very low	144 Å²	144	129.1 Å²	129.1	75%	0.754	71%	0.714	S	S	*	*			cis	-157.4	161.2	-2.9	-124.2	164.1	0	0	0	108.1
1730	S	28.4	Very low	29.9	Very low	86 Å²	86	126.3 Å²	126.3	60%	0.601	71%	0.711	S	S	*	*			trans	-88.9	164.7	178.9	56.8	0	0	0	0	113.7
1731	N	32.4	Very low	29.6	Very low	137 Å²	137	128.3 Å²	128.3	73%	0.733	71%	0.707	S	S	*	*				167.1	148.9	120.1	-83.3	-11.3	0	0	0	114.7
1732	C	30.1	Very low	29.6	Very low	110 Å²	110	129.7 Å²	129.7	74%	0.743	72%	0.719	S	S	*	*			trans	64.2	154.9	156.4	-68	0	0	0	0	119.1
1733	N	32.1	Very low	29.6	Very low	145 Å²	145	128.3 Å²	128.3	78%	0.775	72%	0.715	S	S	*	*			cis	-168.2	167.8	-37.2	-115.2	-30.4	0	0	0	108.5
1734	L	28.2	Very low	29.7	Very low	146 Å²	146	128.8 Å²	128.8	76%	0.764	72%	0.717	S	S	*	*			trans	-45.6	154.1	165.8	-81.7	157.8	0	0	0	113.6	T1736	L1734-T1736 HydrophobicContact CD2-CG2 4.49Å
1735	P	33.9	Very low	29.6	Very low	119 Å²	119	128.7 Å²	128.7	77%	0.773	72%	0.717	S	S	*	*			cis	-141.7	-177.6	48.6	42.5	-23.9	0	0	0	118.6
1736	T	26.2	Very low	29.4	Very low	102 Å²	102	131 Å²	131	63%	0.626	71%	0.714	S	S	*	*			trans	-73.6	-168.8	177.3	53.7	0	0	0	0	113.6	L1734	L1734-T1736 HydrophobicContact CD2-CG2 4.49Å
1737	N	29.4	Very low	29.3	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	72%	0.723	S	S	*	*			trans	86.1	137.9	166.9	-56.6	13.3	0	0	0	114.3
1738	D	27.1	Very low	28.9	Very low	124 Å²	124	129.3 Å²	129.3	66%	0.663	72%	0.722	S	S	*	*			cis	-167.2	-178.7	-16.7	-144.1	-39.8	0	0	0	109.3
1739	M	29.8	Very low	28.6	Very low	140 Å²	140	131.5 Å²	131.5	69%	0.69	73%	0.728	S	S	*	*			trans	55.6	108.9	153.4	-63.3	-71.3	168.8	0	0	118.3
1740	N	26.6	Very low	28.2	Very low	130 Å²	130	131.5 Å²	131.5	70%	0.695	72%	0.724	S	S	*	*				70.6	133.9	84.7	-90.5	-56	0	0	0	117.5
1741	K	27.1	Very low	28.3	Very low	175 Å²	175	133.9 Å²	133.9	76%	0.761	72%	0.724	S	S	*	*			trans	66.5	112.8	152.7	-66.1	172.4	-179.6	174.9	0	119.3
1742	S	25.9	Very low	28.2	Very low	114 Å²	114	136 Å²	136	80%	0.797	73%	0.727	S	S	*	*				74.3	159.5	123.8	89.2	0	0	0	0	116.7
1743	S	27.1	Very low	28.2	Very low	89 Å²	89	135.1 Å²	135.1	62%	0.622	72%	0.721	S	S	*	*			cis	-158.9	171.7	-2.4	48.9	0	0	0	0	109.3
1744	N	27.9	Very low	28.2	Very low	134 Å²	134	137 Å²	137	72%	0.717	72%	0.723	S	S	*	*			trans	49.1	110.7	143.7	-64.2	-17.6	0	0	0	119
1745	Q	27	Very low	28.4	Very low	155 Å²	155	135.4 Å²	135.4	72%	0.724	72%	0.719	S	S	*	*				82.2	141.3	80.9	-165.6	-161.6	85.8	0	0	113.1
1746	K	26.5	Very low	28.1	Very low	160 Å²	160	135.2 Å²	135.2	70%	0.696	72%	0.716	S	S	*	*			trans	82.2	113.5	176.3	-52.7	-160.9	178.8	-179.7	0	113.7
1747	I	26	Very low	28.2	Very low	166 Å²	166	139.8 Å²	139.8	85%	0.851	72%	0.722	S	S	*	*				67	114.5	86.6	-61.4	156.8	0	0	0	110.8
1748	G	27	Very low	28.2	Very low	73 Å²	73	140.1 Å²	140.1	75%	0.753	72%	0.718	S	S	*	*			trans	171.5	62.2	-177.2	0	0	0	0	0	115.2
1749	E	26.9	Very low	28.2	Very low	173 Å²	173	139.1 Å²	139.1	81%	0.808	72%	0.721	S	S	*	*			trans	18	124.1	149	-66.1	-177.8	163.2	0	0	122
1750	E	27.3	Very low	28.2	Very low	144 Å²	144	141.2 Å²	141.2	67%	0.673	73%	0.727	S	S	*	*				59.2	112	116.8	-153.6	-152	-119.9	0	0	119.7
1751	K	29.1	Very low	28.3	Very low	135 Å²	135	142.4 Å²	142.4	59%	0.587	73%	0.73	S	S	*	*				-179.2	126.5	108.8	-92.2	150.6	-152.8	65	0	115.2
1752	K	30.8	Very low	28.4	Very low	183 Å²	183	139.7 Å²	139.7	80%	0.796	73%	0.727	S	S	*	*			trans	65.3	151	136.5	-63	170.6	-177.1	175	0	118.8
1753	S	30.6	Very low	28.6	Very low	90 Å²	90	139.5 Å²	139.5	63%	0.629	72%	0.722	S	S	*	*			cis	-172.2	139.2	-20.3	52.8	0	0	0	0	109
1754	K	32.9	Very low	28.8	Very low	186 Å²	186	140.9 Å²	140.9	81%	0.809	72%	0.721	S	S	*	*				165.8	168.4	108	-93.6	176.7	179.2	179.2	0	108.5
1755	T	31.6	Very low	29	Very low	112 Å²	112	139.4 Å²	139.4	69%	0.687	71%	0.712	S	S	*	*			cis	-173	149.2	-41.5	28.1	0	0	0	0	104.2
1756	T	28	Very low	29.6	Very low	114 Å²	114	136.3 Å²	136.3	70%	0.699	71%	0.708	S	S	*	*			cis	-170.7	155.4	10.4	15.6	0	0	0	0	106.9
1757	R	27.8	Very low	30.1	Very low	199 Å²	199	131.9 Å²	131.9	75%	0.751	70%	0.696	S	S	*	*			cis	-169.3	147.4	-5.7	-133.1	-177.3	173	160.8	-2.3	109.2
1758	H	28.9	Very low	30.5	Very low	146 Å²	146	132 Å²	132	68%	0.676	69%	0.69	S	S	*	*			trans	59.7	139	155.8	-56.1	-34.4	0	0	0	119.4
1759	S	28.5	Very low	30.9	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	68%	0.68	S	S	*	*			cis	99	127.6	16.1	-55.8	0	0	0	0	116.8
1760	K	29.3	Very low	31.3	Very low	184 Å²	184	129.2 Å²	129.2	80%	0.8	66%	0.658	S	S	*	*			trans	92.3	121.4	150.5	-75.3	-176.7	171.7	-169.8	0	121.9
1761	M	27.3	Very low	31.6	Very low	155 Å²	155	126.6 Å²	126.6	76%	0.764	66%	0.655	S	S	*	*				85.9	121.8	125.5	-73.5	174	128.8	0	0	122.5
1762	V	29.8	Very low	31.9	Very low	117 Å²	117	124.8 Å²	124.8	71%	0.709	66%	0.659	S	S	*	*				75.4	100.7	125	177.2	0	0	0	0	119.4
1763	T	30.3	Very low	32	Very low	110 Å²	110	123.7 Å²	123.7	68%	0.675	66%	0.661	S	S	*	*				78.5	122	127.1	-56.4	0	0	0	0	122.4
1764	L	31.8	Very low	32.3	Very low	118 Å²	118	126.5 Å²	126.5	62%	0.618	67%	0.668	S	S	*	*			trans	68.5	134.3	150.2	-76.4	171.1	0	0	0	124.2
1765	I	30.8	Very low	32.4	Very low	103 Å²	103	123.3 Å²	123.3	53%	0.528	66%	0.66	S	S	.	*			trans	86.1	137.3	157.4	-37.5	-148.7	0	0	0	119.1
1766	S	39.7	Very low	32.4	Very low	90 Å²	90	123.9 Å²	123.9	63%	0.629	66%	0.659	S	S	*	*			trans	-79.2	-166.9	175.7	-33.4	0	0	0	0	113.2	M1345	M1345-S1766 PolarHBondContact N-O 2.74Å
1767	P	38.7	Very low	32.7	Very low	68 Å²	68	126 Å²	126	44%	0.442	66%	0.66	S	S	.	*			cis	-143.4	168.7	-2.4	39	-17.8	0	0	0	119.2	T1347	T1347-P1767 WeakPolarHBondContact CA-O 3.38Å; T1347-P1767 HydrophobicContact CG2-CG 3.8Å; T1347-P1767 VanDerWaalsContact CG2-O 3.26Å; T1347-P1767 WeakPolarHBondContact CG2-O 3.38Å; T1347-P1767 PolarHBondContact N-O 3.26Å
1768	K	34.4	Very low	32.9	Very low	168 Å²	168	124.6 Å²	124.6	73%	0.73	66%	0.659	S	S	*	*			trans	43	134.2	144.4	-85.5	-175.3	177.4	175.9	0	125.4
1769	K	34.8	Very low	33	Very low	124 Å²	124	123.5 Å²	123.5	54%	0.539	66%	0.659	S	S	.	*			trans	73.4	155.6	145.4	-69.8	-165.6	151.9	-68.8	0	118.1	P1348 T1349	P1348-K1769 CarbonylContact C-O 3.3Å; P1348-K1769 CarbonylContact O-C 3.6Å; P1348-K1769 VanDerWaalsContact O-O 3.07Å; T1349-K1769 PolarHBondContact N-O 2.6Å
1770	D	35.6	Very low	33.1	Very low	64 Å²	64	124.2 Å²	124.2	34%	0.342	65%	0.654	S	S	.	*			cis	-160.9	152.8	-11.7	-109.4	-3.8	0	0	0	112.7	P1348 T1349	P1348-D1770 PolarHBondContact O-N 3.44Å; T1349-D1770 WeakPolarHBondContact O-CB 3.2Å
1771	S	34	Very low	33.1	Very low	88 Å²	88	121 Å²	121	62%	0.615	65%	0.65	S	S	*	*			trans	65.2	162.4	150.1	97.6	0	0	0	0	120.6	T1350	T1350-S1771 PolarHBondContact O-OG 3.08Å; T1350-S1771 VanDerWaalsContact O-OG 3.13Å
1772	S	33.5	Very low	33.3	Very low	97 Å²	97	120.9 Å²	120.9	68%	0.678	65%	0.647	S	S	*	*			cis	-158.2	147.3	-4.6	58.8	0	0	0	0	113.5
1773	L	34.1	Very low	33.2	Very low	160 Å²	160	121.8 Å²	121.8	84%	0.838	65%	0.648	S	S	*	*			trans	42.1	143	142.6	-60.1	165.8	0	0	0	121.2
1774	I	37.1	Very low	33.4	Very low	150 Å²	150	128 Å²	128	77%	0.769	68%	0.675	S	S	*	*				-162.6	141.9	66.2	-85.9	179.8	0	0	0	112.7
1775	N	33.9	Very low	33.5	Very low	119 Å²	119	128.5 Å²	128.5	64%	0.636	68%	0.678	S	S	*	*			trans	40.5	133.1	151.9	-73.9	47.4	0	0	0	127.2
1776	D	31.5	Very low	33.6	Very low	124 Å²	124	129.8 Å²	129.8	66%	0.663	69%	0.686	S	S	*	*				93.5	120	124.6	-68.9	-22.2	0	0	0	124.8
1777	H	35.2	Very low	33.3	Very low	159 Å²	159	132.1 Å²	132.1	74%	0.736	69%	0.689	S	S	*	*			trans	80.3	125.5	138.8	-87	-44.1	0	0	0	122.8
1778	K	31.7	Very low	33	Very low	168 Å²	168	135.8 Å²	135.8	73%	0.73	70%	0.703	S	S	*	*			trans	84.6	108.3	137.2	-78.5	-174.6	175.9	-175.8	0	119.4
1779	N	30.8	Very low	32.9	Very low	124 Å²	124	133.8 Å²	133.8	66%	0.663	70%	0.702	S	S	*	*				86.3	144.2	121.1	-89.5	58.9	0	0	0	120.4
1780	D	30.8	Very low	32.8	Very low	119 Å²	119	134.5 Å²	134.5	64%	0.636	71%	0.712	S	S	*	*			trans	70.2	96	143.2	-55.8	-20.5	0	0	0	119.8
1781	T	29.2	Very low	32.6	Very low	115 Å²	115	139.5 Å²	139.5	71%	0.706	74%	0.739	S	S	*	*				101.7	131.5	116.8	56.1	0	0	0	0	121.2
1782	H	30.5	Very low	32.4	Very low	153 Å²	153	143.5 Å²	143.5	71%	0.708	75%	0.748	S	S	*	*			trans	75.6	109	140.9	-77.9	-53.6	0	0	0	121.4
1783	N	28.1	Very low	32.4	Very low	137 Å²	137	147.3 Å²	147.3	73%	0.733	75%	0.754	S	S	*	*			trans	74.9	141.1	142.5	-43.8	-13.2	0	0	0	114.6
1784	I	35.1	Very low	32.2	Very low	240 Å²	240	146.2 Å²	146.2	100%	1.231	75%	0.747	S	S	*	*			cis	-118.3	0	18.9	-66.7	164.9	0	0	0	110.6

Retrieved 1,784 of 1,784 residues in 395.9 ms (Link to these results)

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