A0A3Q0KLK9_SCHMA Loading...

Putative cadherin

AlphaFold DB , UniProt , Accession A0A3Q0KLK9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,456 aa.

						>A0A3Q0KLK9_SCHMA|A0A3Q0KLK9
MKAIVQSKNVIYYVKQLFLLHLFIHFTIISSSIHGRIPRLQVYSTEFSIDENCQIGTEIGTINAIVLPNSMSSSITHSSSNEFGQIIALNYKLGSPSTLFSVDERKGLLVTKADIDAEALCSYVTTLSPDHINNNDESDLMLEPGTSKNNRSKPIPVVDHIKCNSSGDLTVHFDVNAVQIDGSLRAVHHIVVRIHDLNDNGPKFDQIRWHKRLKEALYRAGRRIDLPKARDIDILAEHSRINYRLESWHNDGSSSIIPFKSPFKLEISNSGQPGLILTEDLDAEMETRHRFVLVAYSPNVIDSKNKLNGQAISRESRLEIDIEVADMNDNEPRFSFTVYNISVAENTSVGTVIYELVAHDPDSTSKLTYTMASSLEYQVMSSTFHIEADGHVRLHSSLDYELRHIYSIPVEVTDGEFSARTTLNVQVLDVNDEPPAFELNPKQLIADENSPPGKLIGRVRIRDPDSPSVNGLVECSEPPGLVRRQALNFLPDPTVNPNAEVYDLTTRIMLDREDPENPIPGHLIIYLICSDGVLSSGGMVSHNSDSKIRLTSTMTATLSIRDVNDHKPIFENSIYHMSIQENNPIGEKVVQIRAHDSDEGENARITYSLLDRANFKVDSLTGWITPNVMFDRETRDSYQVTAIALDNGKPRLSSSVLLNITVLDVNDHSPVLASYEADESLLKTNDLPVGRFGLKNLFIVRENMPVNTYMGNILASDKDEGLNAQLRFMLFPDPVYRIHERFRLLPNGSLYTNVELDREEKDHYRLTVVVSDQSLDEPLTTTGTIGIIVLDLNDNQPQFLSPHGLLIPNNTQLSGYKRHMNRGIELYDQPSEDHNYNVAKGNQKRSDQEYQSESSPLTDTNTQSTAPEPVVRLSVYEKPDQVISKLYAEDPDAGDNGAVFYLLEEFYDLSVDKIRPNPLIRVQPETGELILIRHMAPIDLGYHFFKVTASDRGHPRMKIDQKILPLLVEDKPASGGLGQSSLSSSYYVSNITGLGLDEWGPSGGRNILIITALSIVSGILAAILISAVFCVTKPCSRNRHGNRCVNGRHNRLRNRPPTYPGGPDSNNGILVDENGSFINGTMEQQGYPVSNGSHHTTFHRPPGPLNGDVCMDNWLHHVRNSEANYGNMSFPFHSPSNDSKNDISNDQHVLINPRHNNQMENNLNFVQNEAAQVTYENLKNNQLHDIHLSSGLASANLSLSSRNNGQAVAVRVLSQQMNIDRFGEIQDQIFLPRSNRLSGITIGYSTDSMTSTSNSALPAFNIKLDPVNAYCVTKPIPVVSKIICNFNEDQMDSQITENSEALHEANPANSTHFKTNLQDNPLDDRLIRHQGKRLVTTVPKLGTLYNCMTVGHRSNLGVEQIISFEEHASDSGRGGSEEELTVQNYDPHKAETIISNMNPEKDISIWNESTIQNDASLNSNLPDKSDVSLSNPWFETTASPMGSDYQRESRFCMSTP
					

Structure Viewer

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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	31	Very low	40.4	Very low	246 Å²	246	160.8 Å²	160.8	100%	1.212	85%	0.85	S	S	*	*				0	59.2	0	-160.7	174.8	-164.7	0	0	111
2	K	33.4	Very low	40.7	Very low	216 Å²	216	162.1 Å²	162.1	94%	0.939	84%	0.837	S	S	*	*			trans	-165	126.8	170.9	-119.1	175.4	-178	179.2	0	110.2
3	A	38.7	Very low	41.2	Very low	91 Å²	91	165.5 Å²	165.5	75%	0.752	84%	0.835	S	S	*	*			trans	-176.5	163.8	-174.8	0	0	0	0	0	107.4
4	I	41	Very low	41.9	Very low	158 Å²	158	162.9 Å²	162.9	81%	0.81	83%	0.831	S	S	*	*			cis	-160.1	-177	-18.3	-101.9	166	0	0	0	104.3
5	V	42.8	Very low	42.2	Very low	138 Å²	138	161.3 Å²	161.3	84%	0.836	82%	0.816	S	S	*	*			trans	129.6	139	150.1	177.6	0	0	0	0	116.7
6	Q	41.7	Very low	42.8	Very low	175 Å²	175	160.8 Å²	160.8	82%	0.818	81%	0.81	S	S	*	*			trans	-70.8	-178.3	177.3	-79.9	-166.9	54.4	0	0	116
7	S	48.9	Very low	43.1	Very low	93 Å²	93	160 Å²	160	65%	0.65	81%	0.807	S	S	*	*			cis	-174.4	-178.9	-27.1	63.8	0	0	0	0	107.2
8	K	39	Very low	43.4	Very low	210 Å²	210	160.6 Å²	160.6	91%	0.913	80%	0.804	S	S	*	*			trans	-162.8	156.7	169.8	-119.8	169.9	-170.7	179.3	0	116.6
9	N	40.1	Very low	44	Very low	154 Å²	154	159.1 Å²	159.1	82%	0.824	80%	0.798	S	S	*	*			trans	-162.4	-179.4	176.8	-151.3	-20	0	0	0	111.9
10	V	39.7	Very low	44.3	Very low	128 Å²	128	157.9 Å²	157.9	78%	0.776	79%	0.793	S	S	*	*			trans	79.2	96.8	167	-167.2	0	0	0	0	119.3
11	I	47.9	Very low	44.7	Very low	160 Å²	160	157.2 Å²	157.2	82%	0.821	79%	0.788	S	S	*	*			trans	-145.2	-40.3	157.3	-74.6	-166.6	0	0	0	114.8	Y13	I11-Y13 PolarHBondContact O-N 2.94Å
12	Y	44	Very low	45.7	Very low	176 Å²	176	150.7 Å²	150.7	69%	0.69	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-78.5	-15.2	-147.7	-147.5	-107.5	0	0	0	119.2	V14 K15	Y12-V14 VanDerWaalsContact C-N 3.28Å; Y12-V14 PolarHBondContact O-N 2.66Å; Y12-K15 HydrophobicContact CE2-CD 4.45Å
13	Y	48.1	Very low	46.3	Very low	206 Å²	206	148.8 Å²	148.8	81%	0.808	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-67.7	-13.3	-163.3	-103.1	-82.4	0	0	0	117	I11 K15	I11-Y13 PolarHBondContact O-N 2.94Å; Y13-K15 PolarHBondContact O-N 2.9Å
14	V	50.5	Low	47	Very low	130 Å²	130	149.8 Å²	149.8	79%	0.788	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-76.8	-21	-173.7	-176.8	0	0	0	0	113.2	Y12 Q16	Y12-V14 VanDerWaalsContact C-N 3.28Å; Y12-V14 PolarHBondContact O-N 2.66Å; V14-Q16 PolarHBondContact O-N 3.32Å
15	K	45.6	Very low	47.2	Very low	138 Å²	138	149.4 Å²	149.4	60%	0.6	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-72	-22.3	-174.2	-85.2	-174.1	173.3	-177.5	0	115.5	Y12 Y13	Y12-K15 HydrophobicContact CE2-CD 4.45Å; Y13-K15 PolarHBondContact O-N 2.9Å
16	Q	51.8	Low	47.2	Very low	154 Å²	154	151.3 Å²	151.3	72%	0.72	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-79.6	-22.8	-168.3	-87.4	-174.6	-24	0	0	115.9	V14	V14-Q16 PolarHBondContact O-N 3.32Å
17	L	49.2	Very low	47.1	Very low	147 Å²	147	148.6 Å²	148.6	77%	0.77	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-24.9	-177.1	-97.5	71.7	0	0	0	114.5
18	F	48	Very low	46.6	Very low	170 Å²	170	150.8 Å²	150.8	75%	0.746	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-25	-168.3	-144.1	-95.2	0	0	0	114.3
19	L	53.9	Low	46.6	Very low	133 Å²	133	147.9 Å²	147.9	70%	0.696	72%	0.724	S	S	*	*	S	Bend	trans	-77.9	-25.9	179.7	-78.8	163.7	0	0	0	113.2	H21 L22	L19-H21 VanDerWaalsContact C-N 3.26Å; L19-H21 PolarHBondContact O-N 3.2Å; L19-L22 PolarHBondContact O-N 2.85Å
20	L	51.7	Low	46.3	Very low	134 Å²	134	145.9 Å²	145.9	70%	0.702	72%	0.722	S	S	*	*	H	α-helix	trans	-66.4	-27.3	-176	-158.4	72.4	0	0	0	112.9	I24	L20-I24 WeakPolarHBondContact O-CD1 3.24Å
21	H	51.5	Low	45.9	Very low	145 Å²	145	144.3 Å²	144.3	67%	0.671	72%	0.717	S	S	*	*	H	α-helix	trans	-85.6	-19.3	-176	-118.4	-69.8	0	0	0	114.5	L19	L19-H21 VanDerWaalsContact C-N 3.26Å; L19-H21 PolarHBondContact O-N 3.2Å
22	L	53.2	Low	45	Very low	109 Å²	109	141.9 Å²	141.9	57%	0.571	71%	0.714	S	S	*	*	H	α-helix	trans	-82.3	-32	-172	-99.1	158.2	0	0	0	113.6	L19	L19-L22 PolarHBondContact O-N 2.85Å
23	F	44.9	Very low	44.7	Very low	176 Å²	176	141.4 Å²	141.4	77%	0.772	72%	0.721	S	S	*	*	H	α-helix	trans	-77.2	-29.8	179.4	-113.4	-94	0	0	0	113.5	H25	F23-H25 VanDerWaalsContact C-N 3.26Å; F23-H25 PolarHBondContact O-N 3.26Å
24	I	53.9	Low	43.9	Very low	112 Å²	112	140.1 Å²	140.1	57%	0.574	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-21.1	-173.8	-63.6	175.3	0	0	0	112.3	L20	L20-I24 WeakPolarHBondContact O-CD1 3.24Å
25	H	45.7	Very low	42.9	Very low	149 Å²	149	137.4 Å²	137.4	69%	0.69	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-11.1	-175.4	-105.4	-78.1	0	0	0	115.9	F23	F23-H25 VanDerWaalsContact C-N 3.26Å; F23-H25 PolarHBondContact O-N 3.26Å
26	F	41.9	Very low	42.3	Very low	178 Å²	178	143 Å²	143	78%	0.781	74%	0.738	S	S	*	*	S	Bend	trans	-106.4	-3	-163.3	-129.3	-86	0	0	0	116.7
27	T	39.9	Very low	41.4	Very low	118 Å²	118	142.7 Å²	142.7	72%	0.724	74%	0.74	S	S	*	*	S	Bend	trans	-121.9	7.4	-178.2	48	0	0	0	0	115	I29	T27-I29 VanDerWaalsContact C-N 3.33Å
28	I	39.2	Very low	41.2	Very low	140 Å²	140	141.7 Å²	141.7	72%	0.718	74%	0.742	S	S	*	*	S	Bend	trans	-79.4	-13.6	176	-70.3	173.4	0	0	0	112.5
29	I	37.7	Very low	41.1	Very low	148 Å²	148	144.6 Å²	144.6	76%	0.759	75%	0.749	S	S	*	*			trans	-132.9	75.6	-172.9	-46.7	-179.2	0	0	0	112.1	T27	T27-I29 VanDerWaalsContact C-N 3.33Å
30	S	34	Very low	41.4	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	74%	0.738	S	S	*	*			trans	-165.9	57.9	164.4	-162.1	0	0	0	0	111.6
31	S	31.1	Very low	42.2	Very low	96 Å²	96	140 Å²	140	67%	0.671	72%	0.722	S	S	*	*				57.2	70.1	75.6	84.4	0	0	0	0	116
32	S	30.5	Very low	43.4	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	72%	0.716	S	S	*	*			trans	33.5	94.2	142.5	178.1	0	0	0	0	119.1
33	I	35.7	Very low	44.6	Very low	166 Å²	166	135.9 Å²	135.9	85%	0.851	70%	0.703	S	S	*	*			trans	-130.9	128	153.9	-62.3	-176.9	0	0	0	109.6
34	H	31.7	Very low	46.4	Very low	179 Å²	179	131.8 Å²	131.8	83%	0.829	70%	0.697	S	S	*	*			trans	-83.6	148.4	172.3	-73.8	25.9	0	0	0	111.1
35	G	30.2	Very low	47.7	Very low	74 Å²	74	127.8 Å²	127.8	76%	0.763	68%	0.678	S	S	*	*			trans	176.6	62.7	175.4	0	0	0	0	0	118.8	I37	G35-I37 PolarHBondContact O-N 3.34Å
36	R	33.3	Very low	49.6	Very low	255 Å²	255	126.9 Å²	126.9	96%	0.962	67%	0.674	S	S	*	*			trans	-7.5	103.7	167.1	-65.1	175.4	174.6	172.3	-2.8	118.4
37	I	33.1	Very low	51.9	Low	147 Å²	147	119.8 Å²	119.8	75%	0.754	64%	0.642	S	S	*	*			trans	-140.1	136.1	150.8	-58.2	-178.3	0	0	0	107	G35 R39	G35-I37 PolarHBondContact O-N 3.34Å; I37-R39 PolarHBondContact O-N 3.5Å
38	P	43.4	Very low	54.1	Low	126 Å²	126	117.3 Å²	117.3	82%	0.818	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-65.6	132	173.9	27.9	-34.3	0	0	0	110.7
39	R	46.7	Very low	56.5	Low	232 Å²	232	111.3 Å²	111.3	88%	0.875	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-93.6	136.5	179.6	-72.4	-179.4	171.9	171	-4.2	111	I37	I37-R39 PolarHBondContact O-N 3.5Å
40	L	60.2	Low	58.9	Low	90 Å²	90	107.8 Å²	107.8	47%	0.471	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-54.6	135.9	161.8	179.8	68	0	0	0	109.4	L184 V187	L40-L184 HydrophobicContact CD1-CD2 3.9Å; L40-L184 HydrophobicContact CD1-CG 3.77Å; L40-L184 HydrophobicContact CD2-CD2 4.34Å; L40-V187 HydrophobicContact CD1-CG2 4.47Å; L40-V187 HydrophobicContact CD2-CG2 4.31Å
41	Q	69.1	Low	61.2	Low	79 Å²	79	102.7 Å²	102.7	37%	0.369	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	126.9	176.5	-58.9	-173.9	-94.9	0	0	109.7	Y43 R185 A186 V187	Q41-Y43 HydrophobicContact CB-CD2 4.41Å; Q41-Y43 HydrophobicContact CB-CE2 3.65Å; Q41-Y43 PolarHBondContact NE2-OH 2.6Å; Q41-Y43 VanDerWaalsContact NE2-OH 3.15Å; Q41-R185 PolarHBondContact N-O 3.48Å; Q41-A186 HydrophobicContact CB-CB 4.17Å; Q41-A186 CarbonylContact O-C 3.53Å; Q41-A186 WeakPolarHBondContact O-CA 3.05Å; Q41-A186 VanDerWaalsContact O-CB 3.3Å; Q41-A186 WeakPolarHBondContact O-CB 3.43Å; Q41-V187 PolarHBondContact O-N 2.77Å
42	V	75.3	Confident	63.7	Low	89 Å²	89	101.5 Å²	101.5	54%	0.539	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130.1	172.4	-178.4	0	0	0	0	108	V187 H189	V42-V187 WeakPolarHBondContact CA-O 3.47Å; V42-H189 VanDerWaalsContact CG1-CD2 3.49Å; V42-H189 WeakPolarHBondContact CG1-CD2 3.46Å; V42-H189 WeakPolarHBondContact CG1-NE2 3.36Å
43	Y	79.9	Confident	66.2	Low	79 Å²	79	97.3 Å²	97.3	31%	0.31	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150.9	176.7	-63.2	-83.3	0	0	0	109.2	Q41 A186 V187 H188 H189	Q41-Y43 HydrophobicContact CB-CD2 4.41Å; Q41-Y43 HydrophobicContact CB-CE2 3.65Å; Q41-Y43 PolarHBondContact NE2-OH 2.6Å; Q41-Y43 VanDerWaalsContact NE2-OH 3.15Å; Y43-A186 HydrophobicContact CD2-CB 3.95Å; Y43-A186 HydrophobicContact CE2-CB 3.74Å; Y43-V187 PolarHBondContact N-O 3.41Å; Y43-H188 AromaticContact CD2-CD2 3.71Å; Y43-H188 AromaticContact CD2-NE2 3.42Å; Y43-H188 WeakPolarHBondContact CD2-NE2 3.44Å; Y43-H188 AromaticContact CG-CD2 3.83Å; Y43-H188 AromaticContact CG-NE2 3.95Å; Y43-H188 WeakPolarHBondContact O-CA 3.38Å; Y43-H189 PolarHBondContact O-N 3.08Å
44	S	82.2	Confident	68.4	Low	91 Å²	91	96.8 Å²	96.8	64%	0.636	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.4	158.7	-170.8	0	0	0	0	107.6	H189	S44-H189 CarbonylContact C-O 3.58Å; S44-H189 WeakPolarHBondContact CA-O 3.21Å
45	T	81.6	Confident	70.9	Confident	28 Å²	28	92.9 Å²	92.9	17%	0.172	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	113.9	177	-53.7	0	0	0	0	108.9	F47 H189 I190 V191	T45-F47 HydrophobicContact CG2-CD2 4.3Å; T45-F47 HydrophobicContact CG2-CE1 4.19Å; T45-F47 HydrophobicContact CG2-CE2 3.51Å; T45-F47 HydrophobicContact CG2-CZ 3.45Å; T45-F47 VanDerWaalsContact CG2-CZ 3.45Å; T45-H189 PolarHBondContact N-O 2.94Å; T45-I190 WeakPolarHBondContact O-CA 3.43Å; T45-V191 PolarHBondContact O-N 2.95Å
46	E	84.7	Confident	73.4	Confident	130 Å²	130	91.4 Å²	91.4	61%	0.607	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	136.9	-179.6	-172.5	171.7	-169.9	0	0	109.9	V191	E46-V191 CarbonylContact C-O 3.54Å; E46-V191 WeakPolarHBondContact CA-O 3.48Å; E46-V191 HydrophobicContact CG-CB 4.35Å
47	F	89.8	Confident	75.9	Confident	28 Å²	28	81.6 Å²	81.6	12%	0.123	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	166.6	173.6	-58.4	-84	0	0	0	109.9	T45 I59 L109 I190 V191 V192 R193	T45-F47 HydrophobicContact CG2-CD2 4.3Å; T45-F47 HydrophobicContact CG2-CE1 4.19Å; T45-F47 HydrophobicContact CG2-CE2 3.51Å; T45-F47 HydrophobicContact CG2-CZ 3.45Å; T45-F47 VanDerWaalsContact CG2-CZ 3.45Å; F47-I59 HydrophobicContact CB-CG2 3.38Å; F47-I59 HydrophobicContact CD1-CG2 3.97Å; F47-I59 WeakPolarHBondContact CD1-O 3.3Å; F47-I59 HydrophobicContact CD2-CG2 4.17Å; F47-I59 HydrophobicContact CG-CG2 3.6Å; F47-L109 HydrophobicContact CD2-CD1 4.12Å; F47-L109 HydrophobicContact CE2-CD1 3.44Å; F47-L109 VanDerWaalsContact CE2-CD1 3.44Å; F47-L109 HydrophobicContact CZ-CD1 3.96Å; F47-I190 HydrophobicContact CD2-CG2 3.68Å; F47-I190 HydrophobicContact CE2-CD1 4.39Å; F47-I190 HydrophobicContact CE2-CG2 3.79Å; F47-V191 PolarHBondContact N-O 3.21Å; F47-V192 HydrophobicContact CB-CG2 4.43Å; F47-R193 PolarHBondContact O-N 3.03Å
48	S	87.5	Confident	78.5	Confident	67 Å²	67	81.1 Å²	81.1	47%	0.469	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	145.1	174.9	-83.5	0	0	0	0	109.9	R193 H195	S48-R193 WeakPolarHBondContact CA-O 3.46Å; S48-H195 WeakPolarHBondContact CB-NE2 3.16Å; S48-H195 PolarHBondContact OG-NE2 3.13Å
49	I	89.6	Confident	80.5	Confident	14 Å²	14	76.1 Å²	76.1	7%	0.072	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	138.8	170.5	-163.6	162.2	0	0	0	109.9	C53 T57 I59 T111 I115 V192 R193 I194 H195	I49-C53 HydrophobicContact CD1-CB 3.98Å; I49-C53 WeakPolarHBondContact CD1-SG 3.37Å; I49-C53 HydrophobicContact CG1-CB 4.03Å; I49-T57 HydrophobicContact CD1-CG2 3.69Å; I49-I59 HydrophobicContact CD1-CG1 3.91Å; I49-T111 HydrophobicContact CD1-CG2 3.41Å; I49-T111 VanDerWaalsContact CD1-CG2 3.41Å; I49-I115 HydrophobicContact CG2-CD1 4.24Å; I49-V192 HydrophobicContact CG2-CG1 3.76Å; I49-R193 PolarHBondContact N-O 3.46Å; I49-I194 HydrophobicContact CG2-CG1 4.37Å; I49-I194 WeakPolarHBondContact O-CA 3.45Å; I49-H195 PolarHBondContact O-N 2.7Å
50	D	86.4	Confident	82.2	Confident	74 Å²	74	66 Å²	66	40%	0.396	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	145.8	169.5	-53.7	-14.8	0	0	0	108.2	C53	D50-C53 WeakPolarHBondContact O-CB 3.36Å; D50-C53 PolarHBondContact O-SG 2.91Å
51	E	84.2	Confident	83.2	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.019	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	177.8	167.9	74	173.9	123.1	0	0	112.3	C53 I115 A117 I194 H195 D196 L197	E51-C53 PolarHBondContact O-N 3.5Å; E51-I115 HydrophobicContact CB-CG2 4.34Å; E51-A117 HydrophobicContact CB-CB 4.37Å; E51-A117 VanDerWaalsContact CD-CB 3.49Å; E51-A117 HydrophobicContact CG-CB 4.49Å; E51-A117 WeakPolarHBondContact OE1-CB 3.43Å; E51-A117 WeakPolarHBondContact OE2-CB 3.35Å; E51-A117 PolarHBondContact OE2-N 2.89Å; E51-I194 HydrophobicContact CB-CG2 4.01Å; E51-H195 PolarHBondContact N-O 3.02Å; E51-H195 VanDerWaalsContact N-O 3.08Å; E51-D196 WeakPolarHBondContact OE1-CA 3.31Å; E51-L197 HydrophobicContact CG-CB 4.09Å; E51-L197 HydrophobicContact CG-CD1 3.77Å; E51-L197 HydrophobicContact CG-CG 3.81Å; E51-L197 PolarHBondContact OE1-N 2.85Å
52	N	83	Confident	83.7	Confident	72 Å²	72	61.9 Å²	61.9	39%	0.385	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	19.2	-175.3	-78.8	-74.7	0	0	0	113.5	I115 D199 L307	N52-I115 PolarHBondContact N-O 2.87Å; N52-D199 PolarHBondContact ND2-OD2 3.49Å; N52-D199 VanDerWaalsContact ND2-OD2 3.13Å; N52-L307 HydrophobicContact CB-CD1 4.25Å
53	C	81.7	Confident	83.1	Confident	19 Å²	19	63.7 Å²	63.7	13%	0.128	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-73.5	148.2	176.5	55.6	0	0	0	0	111.6	I49 D50 E51	I49-C53 HydrophobicContact CD1-CB 3.98Å; I49-C53 WeakPolarHBondContact CD1-SG 3.37Å; I49-C53 HydrophobicContact CG1-CB 4.03Å; D50-C53 WeakPolarHBondContact O-CB 3.36Å; D50-C53 PolarHBondContact O-SG 2.91Å; E51-C53 PolarHBondContact O-N 3.5Å
54	Q	82.5	Confident	81.9	Confident	156 Å²	156	63.3 Å²	63.3	73%	0.729	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-69.9	146.7	-177.5	-65.5	-173.7	-18.3	0	0	112.2	G56 T57 T111	Q54-G56 PolarHBondContact O-N 3.21Å; Q54-T57 WeakPolarHBondContact O-CB 3.3Å; Q54-T57 PolarHBondContact O-N 2.84Å; Q54-T57 VanDerWaalsContact O-N 3.1Å; Q54-T57 PolarHBondContact O-OG1 2.83Å; Q54-T111 PolarHBondContact O-OG1 2.93Å
55	I	83.9	Confident	80.6	Confident	97 Å²	97	60.9 Å²	60.9	50%	0.497	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	127.2	171	-58.7	177.1	0	0	0	109.4	T111 D114	I55-T111 WeakPolarHBondContact CA-OG1 3.45Å; I55-D114 WeakPolarHBondContact CG1-OD1 3.45Å
56	G	83.2	Confident	78.9	Confident	42 Å²	42	65.7 Å²	65.7	43%	0.433	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	3.7	-174.3	0	0	0	0	0	114.9	Q54 E58 T111	Q54-G56 PolarHBondContact O-N 3.21Å; G56-E58 PolarHBondContact O-N 2.91Å; G56-T111 WeakPolarHBondContact CA-O 3.35Å; G56-T111 PolarHBondContact N-O 3.45Å; G56-T111 PolarHBondContact N-OG1 2.78Å
57	T	86.9	Confident	76.5	Confident	49 Å²	49	66.7 Å²	66.7	30%	0.301	38%	0.383	S	S	.	.			trans	-56.6	128.3	170.8	-71.7	0	0	0	0	110.5	I49 Q54 I59 V110 T111	I49-T57 HydrophobicContact CD1-CG2 3.69Å; Q54-T57 WeakPolarHBondContact O-CB 3.3Å; Q54-T57 PolarHBondContact O-N 2.84Å; Q54-T57 VanDerWaalsContact O-N 3.1Å; Q54-T57 PolarHBondContact O-OG1 2.83Å; T57-I59 PolarHBondContact O-N 3.27Å; T57-V110 VanDerWaalsContact O-CA 3.25Å; T57-V110 WeakPolarHBondContact O-CA 3.38Å; T57-T111 PolarHBondContact N-OG1 2.94Å; T57-T111 PolarHBondContact O-N 3.45Å
58	E	87.4	Confident	73.9	Confident	137 Å²	137	71.1 Å²	71.1	64%	0.64	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	121.4	175.5	-65.5	-169.1	177.6	0	0	111	G56 L108 V110	G56-E58 PolarHBondContact O-N 2.91Å; E58-L108 HydrophobicContact CB-CD1 4.13Å; E58-L108 HydrophobicContact CG-CD1 4.11Å; E58-L108 HydrophobicContact CG-CD2 4.14Å; E58-L108 HydrophobicContact CG-CG 4.48Å; E58-L108 WeakPolarHBondContact OE1-CD2 3.07Å; E58-V110 HydrophobicContact CG-CG1 4.11Å
59	I	84.4	Confident	71.3	Confident	21 Å²	21	76 Å²	76	11%	0.108	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-34.3	-177.6	-63.5	159.5	0	0	0	110.7	F47 I49 T57 F100 L109 T111 V192	F47-I59 HydrophobicContact CB-CG2 3.38Å; F47-I59 HydrophobicContact CD1-CG2 3.97Å; F47-I59 WeakPolarHBondContact CD1-O 3.3Å; F47-I59 HydrophobicContact CD2-CG2 4.17Å; F47-I59 HydrophobicContact CG-CG2 3.6Å; I49-I59 HydrophobicContact CD1-CG1 3.91Å; T57-I59 PolarHBondContact O-N 3.27Å; I59-F100 HydrophobicContact CD1-CD1 3.25Å; I59-F100 HydrophobicContact CD1-CE1 3.47Å; I59-F100 VanDerWaalsContact CD1-CE1 3.47Å; I59-F100 HydrophobicContact CD1-CG 4.31Å; I59-L109 HydrophobicContact CB-CB 4.23Å; I59-L109 PolarHBondContact N-O 2.71Å; I59-T111 HydrophobicContact CD1-CG2 3.97Å; I59-T111 HydrophobicContact CG1-CG2 4.31Å; I59-V192 HydrophobicContact CG2-CG2 4.46Å
60	G	83	Confident	68.5	Low	21 Å²	21	80.3 Å²	80.3	22%	0.216	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.2	169.8	173.2	0	0	0	0	0	113.8	L109	G60-L109 PolarHBondContact O-N 2.88Å
61	T	82	Confident	65.9	Low	76 Å²	76	85 Å²	85	47%	0.466	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	134.8	-179.5	52.3	0	0	0	0	112.6	L108	T61-L108 HydrophobicContact CG2-CB 4.03Å; T61-L108 HydrophobicContact CG2-CD1 3.79Å
62	I	78.3	Confident	63.3	Low	5 Å²	5	89.6 Å²	89.6	3%	0.026	52%	0.521	C	S	.	.	P	Polyproline II helix	trans	-67.9	128.7	170.7	-63.8	165.3	0	0	0	109.8	Y91 V102 G107 L109 V175 H188 I190	I62-Y91 HydrophobicContact CB-CD1 4.45Å; I62-Y91 HydrophobicContact CB-CE1 4.13Å; I62-Y91 HydrophobicContact CD1-CD1 4.39Å; I62-Y91 HydrophobicContact CG2-CD1 4.22Å; I62-Y91 HydrophobicContact CG2-CE1 3.67Å; I62-V102 HydrophobicContact CD1-CG2 4.44Å; I62-G107 WeakPolarHBondContact CG1-O 3.25Å; I62-G107 PolarHBondContact N-O 3.3Å; I62-L109 HydrophobicContact CD1-CD1 4.37Å; I62-L109 HydrophobicContact CG1-CD1 4.39Å; I62-V175 HydrophobicContact CD1-CB 3.7Å; I62-V175 HydrophobicContact CD1-CG1 3.49Å; I62-V175 VanDerWaalsContact CD1-CG1 3.49Å; I62-V175 HydrophobicContact CD1-CG2 3.98Å; I62-H188 VanDerWaalsContact CG2-CD2 3.42Å; I62-H188 WeakPolarHBondContact CG2-CD2 3.4Å; I62-H188 VanDerWaalsContact CG2-NE2 3.34Å; I62-H188 WeakPolarHBondContact CG2-NE2 3.33Å; I62-I190 HydrophobicContact CD1-CD1 4.28Å; I62-I190 HydrophobicContact CG1-CD1 4.44Å
63	N	62.9	Low	60.8	Low	127 Å²	127	90.8 Å²	90.8	68%	0.679	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-70.1	136.8	-170.3	-77.9	-51.9	0	0	0	113.7
64	A	53.9	Low	58.3	Low	72 Å²	72	94.9 Å²	94.9	60%	0.595	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-73.4	141.3	177.8	0	0	0	0	0	112.9	V66	A64-V66 PolarHBondContact O-N 2.96Å
65	I	54.9	Low	55.8	Low	40 Å²	40	94.4 Å²	94.4	21%	0.205	57%	0.565	C	S	.	*			trans	-77.6	112.5	-174.9	-53.6	175.9	0	0	0	111.3	L89 R185 A186	I65-L89 HydrophobicContact CD1-CD1 4Å; I65-L89 HydrophobicContact CG1-CD1 4.36Å; I65-R185 HydrophobicContact CD1-CG 4.18Å; I65-A186 HydrophobicContact CD1-CB 4.3Å
66	V	46.7	Very low	53.2	Low	128 Å²	128	96 Å²	96	78%	0.776	58%	0.58	S	S	*	*			trans	-108.1	140.7	177.6	-178.9	0	0	0	0	111.1	A64	A64-V66 PolarHBondContact O-N 2.96Å
67	L	34.1	Very low	50.6	Low	151 Å²	151	102.7 Å²	102.7	79%	0.791	60%	0.599	S	S	*	*			trans	-90.5	137.3	174.5	-77.5	167.5	0	0	0	111.3
68	P	36.5	Very low	47.8	Very low	122 Å²	122	104.7 Å²	104.7	79%	0.792	62%	0.616	S	S	*	*			trans	-82.8	138.3	-172.9	32.3	-34.9	0	0	0	113.1
69	N	31.6	Very low	44.9	Very low	170 Å²	170	103 Å²	103	91%	0.909	62%	0.618	S	S	*	*			trans	-122.2	161.7	160.9	-113.2	-13.1	0	0	0	109.8
70	S	31.4	Very low	42.3	Very low	103 Å²	103	106.5 Å²	106.5	72%	0.72	65%	0.645	S	S	*	*			trans	-89.9	154.1	-155.5	57.2	0	0	0	0	116.9
71	M	31.8	Very low	39.7	Very low	174 Å²	174	112.5 Å²	112.5	86%	0.857	67%	0.672	S	S	*	*			trans	81.4	118.2	149.5	-82.9	-176.2	166.1	0	0	121
72	S	30.2	Very low	37.2	Very low	99 Å²	99	118.2 Å²	118.2	69%	0.692	69%	0.694	S	S	*	*			trans	65.9	116	131	68.7	0	0	0	0	122
73	S	30.5	Very low	34.9	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	74%	0.735	S	S	*	*			trans	64.7	104.4	130.7	63.9	0	0	0	0	120.7
74	S	29.1	Very low	33.3	Very low	106 Å²	106	124.6 Å²	124.6	74%	0.741	73%	0.732	S	S	*	*				77.8	162.3	128	74.7	0	0	0	0	119.8
75	I	29.9	Very low	32.1	Very low	145 Å²	145	130.6 Å²	130.6	74%	0.744	75%	0.748	S	S	*	*			trans	71.6	100.1	178.4	-50.7	-178.9	0	0	0	114.3
76	T	28.1	Very low	31.3	Very low	131 Å²	131	136.2 Å²	136.2	80%	0.804	78%	0.777	S	S	*	*			trans	-27.3	125.5	156.5	49	0	0	0	0	115.2
77	H	28.7	Very low	31.4	Very low	182 Å²	182	134.7 Å²	134.7	84%	0.843	76%	0.763	S	S	*	*			trans	-144	154	152.2	-111.5	-79.9	0	0	0	111.9
78	S	28	Very low	32.4	Very low	92 Å²	92	130.2 Å²	130.2	64%	0.643	75%	0.748	S	S	*	*			trans	-84.3	161.2	-178.1	57	0	0	0	0	113.2
79	S	27.5	Very low	34	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	72%	0.715	S	S	*	*			trans	65.8	137.8	148.7	54.7	0	0	0	0	120.5
80	S	29.5	Very low	36.3	Very low	95 Å²	95	120.7 Å²	120.7	66%	0.664	69%	0.69	S	S	*	*			trans	62.5	118.4	154.4	56	0	0	0	0	120.1
81	N	28.3	Very low	38.8	Very low	148 Å²	148	116.3 Å²	116.3	79%	0.791	66%	0.658	S	S	*	*			trans	47.9	117.3	131.9	-51.2	-6.3	0	0	0	119.4
82	E	30.2	Very low	41.3	Very low	196 Å²	196	112.7 Å²	112.7	92%	0.916	64%	0.637	S	S	*	*				-154.8	165.5	103.4	-116.8	177.4	-177.5	0	0	112.9
83	F	29.2	Very low	43.8	Very low	206 Å²	206	110.8 Å²	110.8	90%	0.904	62%	0.619	S	S	*	*			trans	-86.3	121	-165.6	-86.9	-114.9	0	0	0	113.6
84	G	28.3	Very low	46	Very low	59 Å²	59	107.9 Å²	107.9	61%	0.608	61%	0.605	S	S	*	*			trans	-92.4	136.9	148.9	0	0	0	0	0	109.9	I86	G84-I86 PolarHBondContact O-N 3.45Å
85	Q	29.4	Very low	48.3	Very low	199 Å²	199	104.7 Å²	104.7	93%	0.93	58%	0.582	S	S	*	*			trans	-65.7	107.3	-175.3	-72.2	178.1	-26	0	0	112.3
86	I	39.3	Very low	50.5	Low	157 Å²	157	102.3 Å²	102.3	81%	0.805	58%	0.576	S	S	*	*			trans	-79.7	121.9	175.9	-57.7	178	0	0	0	109.8	G84 A88	G84-I86 PolarHBondContact O-N 3.45Å; I86-A88 PolarHBondContact O-N 3.3Å
87	I	47.4	Very low	53.1	Low	97 Å²	97	96.3 Å²	96.3	50%	0.497	54%	0.54	S	S	.	.			trans	-80.7	113.9	168.2	-58.7	171.2	0	0	0	107.7
88	A	56.4	Low	55.7	Low	56 Å²	56	88.9 Å²	88.9	46%	0.463	51%	0.507	S	S	.	.			trans	-63.8	146.1	-179.7	0	0	0	0	0	112.5	I86 I180	I86-A88 PolarHBondContact O-N 3.3Å; A88-I180 HydrophobicContact CB-CD1 4.29Å
89	L	69.4	Low	58.5	Low	20 Å²	20	84.9 Å²	84.9	11%	0.105	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.6	179.6	-65	172.2	0	0	0	109.3	I65 V178 Q179 R185	I65-L89 HydrophobicContact CD1-CD1 4Å; I65-L89 HydrophobicContact CG1-CD1 4.36Å; L89-V178 CarbonylContact C-O 3.47Å; L89-V178 WeakPolarHBondContact CA-O 3.49Å; L89-Q179 HydrophobicContact CD2-CB 4.39Å; L89-Q179 HydrophobicContact CD2-CG 3.58Å; L89-R185 HydrophobicContact CD2-CB 4.34Å
90	N	79.7	Confident	61.4	Low	72 Å²	72	80.1 Å²	80.1	39%	0.385	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.1	169.7	-62	-40.6	0	0	0	109.2	E104 V178	N90-E104 CarbonylContact C-O 3.57Å; N90-E104 VanDerWaalsContact CA-O 3.31Å; N90-E104 WeakPolarHBondContact CA-O 3.49Å; N90-V178 PolarHBondContact N-O 3.41Å; N90-V178 PolarHBondContact O-N 2.83Å
91	Y	83.8	Confident	64.2	Low	12 Å²	12	77.5 Å²	77.5	5%	0.047	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	139.2	176.4	-60.7	-87.3	0	0	0	110.6	I62 E104 G107 V175 N176 A177	I62-Y91 HydrophobicContact CB-CD1 4.45Å; I62-Y91 HydrophobicContact CB-CE1 4.13Å; I62-Y91 HydrophobicContact CD1-CD1 4.39Å; I62-Y91 HydrophobicContact CG2-CD1 4.22Å; I62-Y91 HydrophobicContact CG2-CE1 3.67Å; Y91-E104 PolarHBondContact N-O 2.85Å; Y91-E104 VanDerWaalsContact O-CA 3.3Å; Y91-E104 WeakPolarHBondContact O-CA 3.48Å; Y91-G107 VanDerWaalsContact CD2-CA 3.43Å; Y91-V175 HydrophobicContact CD1-CG1 4.4Å; Y91-N176 CarbonylContact C-O 3.58Å; Y91-N176 WeakPolarHBondContact CA-O 3.46Å; Y91-A177 HydrophobicContact CD1-CB 3.92Å; Y91-A177 HydrophobicContact CE1-CB 3.83Å
92	K	83.5	Confident	67	Low	98 Å²	98	71.6 Å²	71.6	43%	0.426	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	142.8	174.6	-67	-177.3	-176.5	-85.1	0	110	G94 E104 V175 N176	K92-G94 PolarHBondContact O-N 2.91Å; K92-E104 IonicContact NZ-OE1 3.37Å; K92-E104 PolarHBondContact NZ-OE1 3.15Å; K92-E104 IonicContact NZ-OE2 3.17Å; K92-V175 CarbonylContact O-C 3.51Å; K92-V175 WeakPolarHBondContact O-CA 3.47Å; K92-N176 PolarHBondContact N-O 2.04Å; K92-N176 PolarHBondContact O-N 3.4Å
93	L	83.8	Confident	69.7	Low	58 Å²	58	64.6 Å²	64.6	30%	0.304	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	128.3	170.5	-81.8	167.6	0	0	0	110.5	S95 V102 F173 D174 V175	L93-S95 WeakPolarHBondContact CB-O 3.35Å; L93-V102 HydrophobicContact CG-CG1 4.19Å; L93-F173 HydrophobicContact CD2-CD2 3.6Å; L93-F173 HydrophobicContact CD2-CE2 3.9Å; L93-D174 CarbonylContact C-O 3.57Å; L93-D174 WeakPolarHBondContact CA-O 3.4Å; L93-V175 HydrophobicContact CD2-CG2 4.16Å
94	G	76	Confident	72.1	Confident	37 Å²	37	59.6 Å²	59.6	38%	0.381	34%	0.344	S	S	.	.	S	Bend	trans	-86.8	-30.6	175.1	0	0	0	0	0	112.8	K92 D174 N176	K92-G94 PolarHBondContact O-N 2.91Å; G94-D174 PolarHBondContact N-O 3.27Å; G94-N176 WeakPolarHBondContact CA-ND2 3.44Å
95	S	77.2	Confident	74.4	Confident	38 Å²	38	66.9 Å²	66.9	27%	0.266	35%	0.354	S	S	.	.	S	Bend	trans	-118.7	151.5	167	62.2	0	0	0	0	110.6	L93 S97 F173 D174	L93-S95 WeakPolarHBondContact CB-O 3.35Å; S95-S97 PolarHBondContact O-N 2.85Å; S95-F173 WeakPolarHBondContact OG-CA 3.34Å; S95-F173 WeakPolarHBondContact OG-CB 3.42Å; S95-D174 PolarHBondContact OG-N 3.04Å
96	P	77.7	Confident	76.8	Confident	95 Å²	95	63.2 Å²	63.2	62%	0.617	33%	0.334	S	S	*	.			trans	-65.6	126.3	174.9	-16.5	30.5	0	0	0	110.4	V158	P96-V158 HydrophobicContact CB-CG1 4.16Å
97	S	82.3	Confident	78.8	Confident	6 Å²	6	55.7 Å²	55.7	4%	0.042	30%	0.296	C	S	.	.			trans	-109.2	138.7	171.5	-178.5	0	0	0	0	111.1	S95 F100 K112 D159	S95-S97 PolarHBondContact O-N 2.85Å; S97-F100 WeakPolarHBondContact OG-CB 3.41Å; S97-F100 PolarHBondContact OG-N 3.06Å; S97-F100 PolarHBondContact OG-O 2.76Å; S97-K112 PolarHBondContact O-NZ 2.97Å; S97-D159 VanDerWaalsContact CA-OD1 3.22Å; S97-D159 WeakPolarHBondContact CA-OD1 3.42Å; S97-D159 WeakPolarHBondContact CB-OD1 3.42Å; S97-D159 PolarHBondContact OG-OD1 3.34Å
98	T	83.4	Confident	80.7	Confident	25 Å²	25	51.7 Å²	51.7	15%	0.153	28%	0.276	C	S	.	.	S	Bend	trans	-95.5	-39.3	171.6	19.6	0	0	0	0	111.5	K112 I155 V157 V158 D159	T98-K112 WeakPolarHBondContact O-CD 3.37Å; T98-K112 WeakPolarHBondContact O-CG 3.22Å; T98-I155 HydrophobicContact CG2-CG2 4.27Å; T98-V157 WeakPolarHBondContact OG1-CA 3.5Å; T98-V158 HydrophobicContact CG2-CB 4.48Å; T98-V158 HydrophobicContact CG2-CG2 4.09Å; T98-V158 PolarHBondContact OG1-N 2.84Å; T98-D159 WeakPolarHBondContact CA-OD2 3.49Å; T98-D159 WeakPolarHBondContact CB-OD2 3.49Å; T98-D159 PolarHBondContact N-OD2 2.76Å; T98-D159 PolarHBondContact OG1-OD2 3.3Å
99	L	85.4	Confident	82.2	Confident	8 Å²	8	49 Å²	49	4%	0.042	25%	0.254	C	S	.	.	S	Bend	trans	-82.8	-21.2	-178.2	-61.1	179.2	0	0	0	113.8	K112 A113 L120 V157 D159 V171	L99-K112 WeakPolarHBondContact O-CB 3.15Å; L99-K112 PolarHBondContact O-N 2.54Å; L99-A113 HydrophobicContact CD2-CB 4.25Å; L99-L120 HydrophobicContact CD1-CD1 4.46Å; L99-L120 HydrophobicContact CD1-CD2 4.31Å; L99-V157 HydrophobicContact CD1-CG1 4.41Å; L99-V157 HydrophobicContact CG-CG1 4.37Å; L99-D159 PolarHBondContact N-OD2 2.98Å; L99-V171 HydrophobicContact CD1-CG1 4.25Å; L99-V171 HydrophobicContact CD1-CG2 4.2Å
100	F	89.7	Confident	83.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	164.2	-172.1	-51.5	-65.7	0	0	0	114.5	I59 S97 V110 T111 K112 I115 V171 F173 V192	I59-F100 HydrophobicContact CD1-CD1 3.25Å; I59-F100 HydrophobicContact CD1-CE1 3.47Å; I59-F100 VanDerWaalsContact CD1-CE1 3.47Å; I59-F100 HydrophobicContact CD1-CG 4.31Å; S97-F100 WeakPolarHBondContact OG-CB 3.41Å; S97-F100 PolarHBondContact OG-N 3.06Å; S97-F100 PolarHBondContact OG-O 2.76Å; F100-V110 WeakPolarHBondContact CA-O 3.42Å; F100-T111 HydrophobicContact CE1-CG2 4.31Å; F100-K112 VanDerWaalsContact O-CD 3.31Å; F100-K112 WeakPolarHBondContact O-CD 3.43Å; F100-I115 HydrophobicContact CE1-CD1 3.91Å; F100-I115 HydrophobicContact CZ-CD1 4.12Å; F100-V171 HydrophobicContact CE2-CB 3.98Å; F100-V171 HydrophobicContact CE2-CG1 3.82Å; F100-V171 HydrophobicContact CE2-CG2 4.48Å; F100-F173 HydrophobicContact CB-CE1 4.03Å; F100-F173 HydrophobicContact CB-CE2 4.47Å; F100-F173 HydrophobicContact CB-CZ 3.85Å; F100-F173 AromaticContact CD2-CD1 3.71Å; F100-F173 HydrophobicContact CD2-CD1 3.71Å; F100-F173 AromaticContact CD2-CE1 3.19Å; F100-F173 HydrophobicContact CD2-CE1 3.19Å; F100-F173 AromaticContact CD2-CZ 3.91Å; F100-F173 HydrophobicContact CD2-CZ 3.91Å; F100-F173 HydrophobicContact CE2-CD1 4.31Å; F100-F173 AromaticContact CE2-CE1 3.83Å; F100-F173 HydrophobicContact CE2-CE1 3.83Å; F100-F173 AromaticContact CG-CE1 3.76Å; F100-F173 HydrophobicContact CG-CE1 3.76Å; F100-F173 HydrophobicContact CG-CZ 4.01Å; F100-V192 HydrophobicContact CD2-CG2 4.42Å; F100-V192 HydrophobicContact CE1-CB 4.48Å; F100-V192 HydrophobicContact CE1-CG1 4.1Å; F100-V192 HydrophobicContact CE1-CG2 4.31Å; F100-V192 HydrophobicContact CE2-CB 3.99Å; F100-V192 HydrophobicContact CE2-CG1 4.39Å; F100-V192 HydrophobicContact CE2-CG2 3.96Å; F100-V192 HydrophobicContact CZ-CB 3.75Å; F100-V192 HydrophobicContact CZ-CG1 3.64Å; F100-V192 HydrophobicContact CZ-CG2 3.91Å
101	S	88.5	Confident	83.6	Confident	40 Å²	40	46.2 Å²	46.2	28%	0.28	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	162.7	171.8	66.6	0	0	0	0	112.3	L109 V110	S101-L109 WeakPolarHBondContact O-CA 3.25Å; S101-V110 PolarHBondContact N-O 2.82Å; S101-V110 PolarHBondContact O-N 2.85Å; S101-V110 VanDerWaalsContact OG-CG2 3.25Å; S101-V110 WeakPolarHBondContact OG-CG2 3.36Å
102	V	87	Confident	83.7	Confident	25 Å²	25	50.7 Å²	50.7	15%	0.152	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.2	-175.5	72.7	0	0	0	0	113.2	I62 L93 E104 L108 L109 V175	I62-V102 HydrophobicContact CD1-CG2 4.44Å; L93-V102 HydrophobicContact CG-CG1 4.19Å; V102-E104 PolarHBondContact O-N 2.86Å; V102-L108 CarbonylContact C-O 3.54Å; V102-L108 VanDerWaalsContact CA-O 3.31Å; V102-L108 WeakPolarHBondContact CA-O 3.31Å; V102-L109 HydrophobicContact CB-CD2 3.81Å; V102-L109 HydrophobicContact CG2-CD2 3.97Å; V102-L109 HydrophobicContact CG2-CG 4.35Å; V102-V175 HydrophobicContact CG1-CG1 4.45Å; V102-V175 HydrophobicContact CG2-CG1 4.31Å
103	D	85.5	Confident	83.8	Confident	49 Å²	49	46.9 Å²	46.9	26%	0.262	25%	0.246	S	C	.	.			trans	-69.7	115.9	169	-178.9	-46.6	0	0	0	109.9	R105 K106 G107 L108	D103-R105 PolarHBondContact O-N 3.43Å; D103-R105 PolarHBondContact OD1-N 3.34Å; D103-K106 HydrophobicContact CB-CB 4.11Å; D103-K106 PolarHBondContact O-N 2.83Å; D103-K106 PolarHBondContact OD1-N 3.45Å; D103-K106 WeakPolarHBondContact OD2-CD 3.31Å; D103-K106 VanDerWaalsContact OD2-CE 3.25Å; D103-K106 WeakPolarHBondContact OD2-CE 3.34Å; D103-K106 WeakPolarHBondContact OD2-CG 3.44Å; D103-K106 IonicContact OD2-NZ 3.73Å; D103-K106 PolarHBondContact OD2-NZ 2.72Å; D103-G107 PolarHBondContact O-N 3.22Å; D103-L108 HydrophobicContact CB-CB 3.87Å; D103-L108 PolarHBondContact N-O 2.91Å
104	E	81.2	Confident	83.8	Confident	100 Å²	100	49.8 Å²	49.8	47%	0.467	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.4	-174.6	-62.5	-161	139.9	0	0	114.7	N90 Y91 K92 V102	N90-E104 CarbonylContact C-O 3.57Å; N90-E104 VanDerWaalsContact CA-O 3.31Å; N90-E104 WeakPolarHBondContact CA-O 3.49Å; Y91-E104 PolarHBondContact N-O 2.85Å; Y91-E104 VanDerWaalsContact O-CA 3.3Å; Y91-E104 WeakPolarHBondContact O-CA 3.48Å; K92-E104 IonicContact NZ-OE1 3.37Å; K92-E104 PolarHBondContact NZ-OE1 3.15Å; K92-E104 IonicContact NZ-OE2 3.17Å; V102-E104 PolarHBondContact O-N 2.86Å
105	R	76.6	Confident	84.2	Confident	213 Å²	213	48.1 Å²	48.1	80%	0.804	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-31.3	-175.8	-62.9	-177.4	-179.2	-178.2	1.1	113.1	D103	D103-R105 PolarHBondContact O-N 3.43Å; D103-R105 PolarHBondContact OD1-N 3.34Å
106	K	78.7	Confident	84.7	Confident	121 Å²	121	49.9 Å²	49.9	53%	0.526	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-24.7	-179	-57.3	-176.1	-158	120.7	0	113.8	D103 L108	D103-K106 HydrophobicContact CB-CB 4.11Å; D103-K106 PolarHBondContact O-N 2.83Å; D103-K106 PolarHBondContact OD1-N 3.45Å; D103-K106 WeakPolarHBondContact OD2-CD 3.31Å; D103-K106 VanDerWaalsContact OD2-CE 3.25Å; D103-K106 WeakPolarHBondContact OD2-CE 3.34Å; D103-K106 WeakPolarHBondContact OD2-CG 3.44Å; D103-K106 IonicContact OD2-NZ 3.73Å; D103-K106 PolarHBondContact OD2-NZ 2.72Å; K106-L108 HydrophobicContact CB-CB 3.95Å; K106-L108 HydrophobicContact CD-CB 4.37Å; K106-L108 HydrophobicContact CD-CD2 4.36Å; K106-L108 PolarHBondContact O-N 2.74Å
107	G	80.7	Confident	85	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.221	C	C	.	.			trans	68	21.4	-165	0	0	0	0	0	112.7	I62 Y91 D103	I62-G107 WeakPolarHBondContact CG1-O 3.25Å; I62-G107 PolarHBondContact N-O 3.3Å; Y91-G107 VanDerWaalsContact CD2-CA 3.43Å; D103-G107 PolarHBondContact O-N 3.22Å
108	L	87.7	Confident	85.2	Confident	13 Å²	13	46.1 Å²	46.1	7%	0.068	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.3	177.4	174.2	67	0	0	0	109.8	E58 T61 V102 D103 K106 V110	E58-L108 HydrophobicContact CB-CD1 4.13Å; E58-L108 HydrophobicContact CG-CD1 4.11Å; E58-L108 HydrophobicContact CG-CD2 4.14Å; E58-L108 HydrophobicContact CG-CG 4.48Å; E58-L108 WeakPolarHBondContact OE1-CD2 3.07Å; T61-L108 HydrophobicContact CG2-CB 4.03Å; T61-L108 HydrophobicContact CG2-CD1 3.79Å; V102-L108 CarbonylContact C-O 3.54Å; V102-L108 VanDerWaalsContact CA-O 3.31Å; V102-L108 WeakPolarHBondContact CA-O 3.31Å; D103-L108 HydrophobicContact CB-CB 3.87Å; D103-L108 PolarHBondContact N-O 2.91Å; K106-L108 HydrophobicContact CB-CB 3.95Å; K106-L108 HydrophobicContact CD-CB 4.37Å; K106-L108 HydrophobicContact CD-CD2 4.36Å; K106-L108 PolarHBondContact O-N 2.74Å; L108-V110 HydrophobicContact CD2-CG1 4.34Å; L108-V110 HydrophobicContact CG-CG1 4.14Å
109	L	88.4	Confident	85.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	136.8	175	-71.9	164.5	0	0	0	111.1	F47 I59 G60 I62 S101 V102 F173 V175 I190	F47-L109 HydrophobicContact CD2-CD1 4.12Å; F47-L109 HydrophobicContact CE2-CD1 3.44Å; F47-L109 VanDerWaalsContact CE2-CD1 3.44Å; F47-L109 HydrophobicContact CZ-CD1 3.96Å; I59-L109 HydrophobicContact CB-CB 4.23Å; I59-L109 PolarHBondContact N-O 2.71Å; G60-L109 PolarHBondContact O-N 2.88Å; I62-L109 HydrophobicContact CD1-CD1 4.37Å; I62-L109 HydrophobicContact CG1-CD1 4.39Å; S101-L109 WeakPolarHBondContact O-CA 3.25Å; V102-L109 HydrophobicContact CB-CD2 3.81Å; V102-L109 HydrophobicContact CG2-CD2 3.97Å; V102-L109 HydrophobicContact CG2-CG 4.35Å; L109-F173 HydrophobicContact CD1-CE2 4.46Å; L109-F173 HydrophobicContact CD1-CZ 4.24Å; L109-F173 HydrophobicContact CD2-CE2 3.73Å; L109-F173 HydrophobicContact CD2-CZ 3.91Å; L109-V175 HydrophobicContact CD2-CG2 4.23Å; L109-I190 HydrophobicContact CD1-CD1 4.24Å; L109-I190 HydrophobicContact CD1-CG1 4.22Å; L109-I190 HydrophobicContact CD1-CG2 3.87Å
110	V	89.6	Confident	85.1	Confident	30 Å²	30	47.5 Å²	47.5	18%	0.182	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	152.1	178.3	-52.8	0	0	0	0	112	T57 E58 F100 S101 L108	T57-V110 VanDerWaalsContact O-CA 3.25Å; T57-V110 WeakPolarHBondContact O-CA 3.38Å; E58-V110 HydrophobicContact CG-CG1 4.11Å; F100-V110 WeakPolarHBondContact CA-O 3.42Å; S101-V110 PolarHBondContact N-O 2.82Å; S101-V110 PolarHBondContact O-N 2.85Å; S101-V110 VanDerWaalsContact OG-CG2 3.25Å; S101-V110 WeakPolarHBondContact OG-CG2 3.36Å; L108-V110 HydrophobicContact CD2-CG1 4.34Å; L108-V110 HydrophobicContact CG-CG1 4.14Å
111	T	88.9	Confident	84.7	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	149.2	171.5	58.4	0	0	0	0	111.7	I49 Q54 I55 G56 T57 I59 F100 I115	I49-T111 HydrophobicContact CD1-CG2 3.41Å; I49-T111 VanDerWaalsContact CD1-CG2 3.41Å; Q54-T111 PolarHBondContact O-OG1 2.93Å; I55-T111 WeakPolarHBondContact CA-OG1 3.45Å; G56-T111 WeakPolarHBondContact CA-O 3.35Å; G56-T111 PolarHBondContact N-O 3.45Å; G56-T111 PolarHBondContact N-OG1 2.78Å; T57-T111 PolarHBondContact N-OG1 2.94Å; T57-T111 PolarHBondContact O-N 3.45Å; I59-T111 HydrophobicContact CD1-CG2 3.97Å; I59-T111 HydrophobicContact CG1-CG2 4.31Å; F100-T111 HydrophobicContact CE1-CG2 4.31Å; T111-I115 HydrophobicContact CG2-CD1 4.06Å
112	K	86.6	Confident	84.3	Confident	106 Å²	106	48.9 Å²	48.9	46%	0.461	25%	0.247	S	C	.	.			trans	-127	-17.5	-173.1	175.4	179.8	160.9	-175.6	0	113.4	S97 T98 L99 F100	S97-K112 PolarHBondContact O-NZ 2.97Å; T98-K112 WeakPolarHBondContact O-CD 3.37Å; T98-K112 WeakPolarHBondContact O-CG 3.22Å; L99-K112 WeakPolarHBondContact O-CB 3.15Å; L99-K112 PolarHBondContact O-N 2.54Å; F100-K112 VanDerWaalsContact O-CD 3.31Å; F100-K112 WeakPolarHBondContact O-CD 3.43Å
113	A	84.7	Confident	83.7	Confident	19 Å²	19	51.3 Å²	51.3	16%	0.157	25%	0.254	C	S	.	.	S	Bend	trans	-142	165.7	173.8	0	0	0	0	0	108.9	L99	L99-A113 HydrophobicContact CD2-CB 4.25Å
114	D	83.5	Confident	83	Confident	118 Å²	118	50.7 Å²	50.7	63%	0.631	25%	0.252	S	S	*	.			trans	-63.5	147	170.7	-50.7	-63.6	0	0	0	110	I55	I55-D114 WeakPolarHBondContact CG1-OD1 3.45Å
115	I	85.7	Confident	82.3	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	25%	0.253	C	S	.	.			trans	-120.5	125.6	-178.6	-61.4	-178	0	0	0	108	I49 E51 N52 F100 T111 L120 I194	I49-I115 HydrophobicContact CG2-CD1 4.24Å; E51-I115 HydrophobicContact CB-CG2 4.34Å; N52-I115 PolarHBondContact N-O 2.87Å; F100-I115 HydrophobicContact CE1-CD1 3.91Å; F100-I115 HydrophobicContact CZ-CD1 4.12Å; T111-I115 HydrophobicContact CG2-CD1 4.06Å; I115-L120 HydrophobicContact CG2-CD1 3.95Å; I115-I194 HydrophobicContact CG2-CD1 3.65Å; I115-I194 HydrophobicContact CG2-CG1 3.99Å; I115-I194 HydrophobicContact CG2-CG2 3.75Å
116	D	86.1	Confident	81.5	Confident	75 Å²	75	44.5 Å²	44.5	40%	0.401	25%	0.245	S	C	.	.			trans	-138.3	114.3	-173.1	166.5	-26.6	0	0	0	105.4	E118 A119 L120	D116-E118 PolarHBondContact OD1-N 3.42Å; D116-A119 HydrophobicContact CB-CB 4.05Å; D116-A119 WeakPolarHBondContact OD1-CB 3.33Å; D116-A119 PolarHBondContact OD1-N 2.57Å; D116-A119 WeakPolarHBondContact OD2-CB 3.43Å; D116-L120 WeakPolarHBondContact O-CB 3.24Å; D116-L120 WeakPolarHBondContact O-CD1 3.38Å; D116-L120 WeakPolarHBondContact O-CG 3.38Å; D116-L120 PolarHBondContact O-N 3.1Å; D116-L120 VanDerWaalsContact O-N 3.09Å
117	A	85.6	Confident	80.3	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.2	-47.9	-168.6	0	0	0	0	0	110.6	E51 A119 L120 C121 L169 D196 I234	E51-A117 HydrophobicContact CB-CB 4.37Å; E51-A117 VanDerWaalsContact CD-CB 3.49Å; E51-A117 HydrophobicContact CG-CB 4.49Å; E51-A117 WeakPolarHBondContact OE1-CB 3.43Å; E51-A117 WeakPolarHBondContact OE2-CB 3.35Å; E51-A117 PolarHBondContact OE2-N 2.89Å; A117-A119 VanDerWaalsContact C-N 3.33Å; A117-A119 PolarHBondContact O-N 3.5Å; A117-L120 PolarHBondContact O-N 2.98Å; A117-L120 VanDerWaalsContact O-N 3.15Å; A117-C121 WeakPolarHBondContact O-CB 3.4Å; A117-C121 PolarHBondContact O-N 3.38Å; A117-L169 HydrophobicContact CB-CD2 3.85Å; A117-D196 HydrophobicContact CB-CB 4.39Å; A117-I234 HydrophobicContact CB-CD1 3.7Å
118	E	85.2	Confident	78.3	Confident	23 Å²	23	48.5 Å²	48.5	11%	0.107	28%	0.279	C	S	.	.	H	α-helix	trans	-58.9	-43.9	179.1	-76.2	55.7	-121.3	0	0	110.7	D116 S122 I232 D233 I234	D116-E118 PolarHBondContact OD1-N 3.42Å; E118-S122 WeakPolarHBondContact O-CA 3.25Å; E118-S122 WeakPolarHBondContact O-CB 3.41Å; E118-S122 PolarHBondContact O-N 2.74Å; E118-I232 HydrophobicContact CG-CG1 4.37Å; E118-D233 WeakPolarHBondContact OE1-CA 3.27Å; E118-I234 VanDerWaalsContact OE1-CD1 3.29Å; E118-I234 WeakPolarHBondContact OE1-CD1 3.4Å; E118-I234 WeakPolarHBondContact OE1-CG1 3.15Å; E118-I234 PolarHBondContact OE1-N 3.5Å
119	A	82.5	Confident	75.9	Confident	47 Å²	47	52.9 Å²	52.9	39%	0.388	31%	0.308	S	S	.	.	H	α-helix	trans	-67.4	-38.5	176.8	0	0	0	0	0	112.2	D116 A117 Y123	D116-A119 HydrophobicContact CB-CB 4.05Å; D116-A119 WeakPolarHBondContact OD1-CB 3.33Å; D116-A119 PolarHBondContact OD1-N 2.57Å; D116-A119 WeakPolarHBondContact OD2-CB 3.43Å; A117-A119 VanDerWaalsContact C-N 3.33Å; A117-A119 PolarHBondContact O-N 3.5Å; A119-Y123 VanDerWaalsContact O-CB 3.26Å; A119-Y123 WeakPolarHBondContact O-CB 3.33Å; A119-Y123 PolarHBondContact O-N 3.48Å
120	L	84.1	Confident	73.2	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.073	35%	0.345	C	S	.	.	H	α-helix	trans	-69.5	-43	177.2	-71.7	168.4	0	0	0	111.9	L99 I115 D116 A117 Y123 V124 I161 L169 I194	L99-L120 HydrophobicContact CD1-CD1 4.46Å; L99-L120 HydrophobicContact CD1-CD2 4.31Å; I115-L120 HydrophobicContact CG2-CD1 3.95Å; D116-L120 WeakPolarHBondContact O-CB 3.24Å; D116-L120 WeakPolarHBondContact O-CD1 3.38Å; D116-L120 WeakPolarHBondContact O-CG 3.38Å; D116-L120 PolarHBondContact O-N 3.1Å; D116-L120 VanDerWaalsContact O-N 3.09Å; A117-L120 PolarHBondContact O-N 2.98Å; A117-L120 VanDerWaalsContact O-N 3.15Å; L120-Y123 PolarHBondContact O-N 3.31Å; L120-V124 WeakPolarHBondContact O-CG2 3.26Å; L120-V124 PolarHBondContact O-N 3.05Å; L120-I161 HydrophobicContact CD2-CD1 3.69Å; L120-L169 HydrophobicContact CB-CD1 4.46Å; L120-L169 HydrophobicContact CB-CD2 4.23Å; L120-L169 HydrophobicContact CD1-CD2 4.47Å; L120-I194 HydrophobicContact CD1-CD1 3.65Å
121	C	82.7	Confident	70.4	Confident	7 Å²	7	67 Å²	67	5%	0.047	38%	0.376	C	S	.	.	H	α-helix	trans	-68.4	-36.4	173.1	-83.4	0	0	0	0	112.5	A117 V124 T125 C163 I234	A117-C121 WeakPolarHBondContact O-CB 3.4Å; A117-C121 PolarHBondContact O-N 3.38Å; C121-V124 PolarHBondContact O-N 3.05Å; C121-T125 WeakPolarHBondContact O-CB 3.38Å; C121-T125 WeakPolarHBondContact O-CG2 3.4Å; C121-T125 PolarHBondContact O-N 2.97Å; C121-T125 PolarHBondContact O-OG1 3.47Å; C121-C163 HydrophobicContact CB-CB 4Å; C121-C163 WeakPolarHBondContact CB-SG 3.48Å; C121-C163 WeakPolarHBondContact SG-CB 3.44Å; C121-C163 CovalentContact SG-SG 2.04Å; C121-C163 PolarHBondContact SG-SG 3.02Å; C121-I234 HydrophobicContact CB-CD1 3.77Å; C121-I234 HydrophobicContact CB-CG1 3.92Å; C121-I234 WeakPolarHBondContact SG-CD1 3.48Å
122	S	79.2	Confident	67.5	Low	63 Å²	63	73 Å²	73	44%	0.441	41%	0.407	S	S	.	.	H	α-helix	trans	-64.2	-40.8	172.3	-176	0	0	0	0	111.4	E118 T125 T126	E118-S122 WeakPolarHBondContact O-CA 3.25Å; E118-S122 WeakPolarHBondContact O-CB 3.41Å; E118-S122 PolarHBondContact O-N 2.74Å; S122-T125 WeakPolarHBondContact CA-OG1 3.43Å; S122-T125 PolarHBondContact O-N 2.85Å; S122-T125 PolarHBondContact O-OG1 3.07Å; S122-T126 WeakPolarHBondContact O-CB 3.45Å; S122-T126 WeakPolarHBondContact O-CG2 3.34Å; S122-T126 PolarHBondContact O-N 3.41Å; S122-T126 PolarHBondContact O-OG1 2.94Å
123	Y	74.3	Confident	64.9	Low	76 Å²	76	75.4 Å²	75.4	30%	0.298	43%	0.425	S	S	.	.	H	α-helix	trans	-62.9	-43.7	174	-171.4	-108.1	0	0	0	111.9	A119 L120 T126 L127 V157	A119-Y123 VanDerWaalsContact O-CB 3.26Å; A119-Y123 WeakPolarHBondContact O-CB 3.33Å; A119-Y123 PolarHBondContact O-N 3.48Å; L120-Y123 PolarHBondContact O-N 3.31Å; Y123-T126 PolarHBondContact O-OG1 2.86Å; Y123-L127 HydrophobicContact CD1-CD1 3.83Å; Y123-L127 HydrophobicContact CE1-CD1 3.53Å; Y123-L127 HydrophobicContact CE2-CD1 4.34Å; Y123-L127 HydrophobicContact CG-CD1 4.35Å; Y123-L127 WeakPolarHBondContact O-CB 3.41Å; Y123-L127 WeakPolarHBondContact O-CG 3.41Å; Y123-L127 PolarHBondContact O-N 2.82Å; Y123-L127 VanDerWaalsContact O-N 3.11Å; Y123-V157 HydrophobicContact CE1-CB 4.38Å
124	V	71.9	Confident	62.3	Low	36 Å²	36	81 Å²	81	22%	0.218	45%	0.452	C	S	.	.	H	α-helix	trans	-66.3	-41.9	175.9	172.1	0	0	0	0	112.4	L120 C121 L127 S128 I161 C163	L120-V124 WeakPolarHBondContact O-CG2 3.26Å; L120-V124 PolarHBondContact O-N 3.05Å; C121-V124 PolarHBondContact O-N 3.05Å; V124-L127 PolarHBondContact O-N 2.84Å; V124-S128 PolarHBondContact O-N 2.69Å; V124-I161 HydrophobicContact CG2-CB 3.91Å; V124-I161 HydrophobicContact CG2-CD1 4.45Å; V124-I161 HydrophobicContact CG2-CG2 3.73Å; V124-C163 HydrophobicContact CB-CB 4.34Å; V124-C163 HydrophobicContact CG1-CB 4.25Å
125	T	65.6	Low	59.9	Low	81 Å²	81	81.7 Å²	81.7	50%	0.497	46%	0.456	S	S	.	.	H	α-helix	trans	-76.1	-28.3	-179.4	50.5	0	0	0	0	113.5	C121 S122	C121-T125 WeakPolarHBondContact O-CB 3.38Å; C121-T125 WeakPolarHBondContact O-CG2 3.4Å; C121-T125 PolarHBondContact O-N 2.97Å; C121-T125 PolarHBondContact O-OG1 3.47Å; S122-T125 WeakPolarHBondContact CA-OG1 3.43Å; S122-T125 PolarHBondContact O-N 2.85Å; S122-T125 PolarHBondContact O-OG1 3.07Å
126	T	60.1	Low	57.4	Low	101 Å²	101	88.6 Å²	88.6	62%	0.62	49%	0.493	S	S	*	.	H	α-helix	trans	-77.6	-20.9	171	52.3	0	0	0	0	113.5	S122 Y123	S122-T126 WeakPolarHBondContact O-CB 3.45Å; S122-T126 WeakPolarHBondContact O-CG2 3.34Å; S122-T126 PolarHBondContact O-N 3.41Å; S122-T126 PolarHBondContact O-OG1 2.94Å; Y123-T126 PolarHBondContact O-OG1 2.86Å
127	L	54	Low	54.7	Low	111 Å²	111	94.1 Å²	94.1	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-81.1	-20.4	169.6	-78.2	168.5	0	0	0	113.9	Y123 V124	Y123-L127 HydrophobicContact CD1-CD1 3.83Å; Y123-L127 HydrophobicContact CE1-CD1 3.53Å; Y123-L127 HydrophobicContact CE2-CD1 4.34Å; Y123-L127 HydrophobicContact CG-CD1 4.35Å; Y123-L127 WeakPolarHBondContact O-CB 3.41Å; Y123-L127 WeakPolarHBondContact O-CG 3.41Å; Y123-L127 PolarHBondContact O-N 2.82Å; Y123-L127 VanDerWaalsContact O-N 3.11Å; V124-L127 PolarHBondContact O-N 2.84Å
128	S	38.1	Very low	52.2	Low	95 Å²	95	100 Å²	100	66%	0.664	56%	0.557	S	S	*	*			trans	-142.1	78.9	-173.7	-63.7	0	0	0	0	115.6	V124	V124-S128 PolarHBondContact O-N 2.69Å
129	P	36.7	Very low	49.5	Very low	105 Å²	105	106.9 Å²	106.9	68%	0.682	60%	0.595	S	S	*	*			trans	-128.6	34.8	168.8	41.3	-28	0	0	0	115.9
130	D	32.6	Very low	46.9	Very low	146 Å²	146	112.9 Å²	112.9	78%	0.781	62%	0.619	S	S	*	*	S	Bend	trans	-116.6	114.7	170.9	-100.4	-41.1	0	0	0	113.2
131	H	30.6	Very low	44.2	Very low	180 Å²	180	120.3 Å²	120.3	83%	0.833	66%	0.656	S	S	*	*			trans	43.7	69.9	159.4	-71.1	-36.6	0	0	0	122.1
132	I	28.3	Very low	41.7	Very low	128 Å²	128	127.8 Å²	127.8	66%	0.656	70%	0.695	S	S	*	*			trans	-141.2	127	151.2	-60	-176.9	0	0	0	107.7
133	N	31.1	Very low	39.4	Very low	157 Å²	157	133 Å²	133	84%	0.84	71%	0.712	S	S	*	*	S	Bend	cis	51.3	68.4	-1.9	-88.6	1.1	0	0	0	117.2
134	N	31.1	Very low	37.3	Very low	136 Å²	136	135.3 Å²	135.3	73%	0.727	74%	0.736	S	S	*	*	S	Bend	trans	39.7	104.3	160.1	-59.3	-20.2	0	0	0	118.5
135	N	31.8	Very low	35.1	Very low	133 Å²	133	137 Å²	137	71%	0.711	76%	0.76	S	S	*	*			trans	65.1	107	152.4	-46.1	-7.1	0	0	0	117.2
136	D	33.3	Very low	33.4	Very low	147 Å²	147	140 Å²	140	79%	0.786	78%	0.779	S	S	*	*				175.9	177	106.5	-84.6	-15.7	0	0	0	110.4
137	E	29.9	Very low	31.9	Very low	191 Å²	191	141.1 Å²	141.1	89%	0.893	79%	0.791	S	S	*	*			trans	-81.4	142.9	-169.7	-54.9	170.5	131.7	0	0	114
138	S	33.1	Very low	30.6	Very low	123 Å²	123	145.1 Å²	145.1	86%	0.86	80%	0.804	S	S	*	*			trans	-172.5	138.6	145.4	22.9	0	0	0	0	114.1
139	D	27.9	Very low	30.2	Very low	168 Å²	168	148.1 Å²	148.1	90%	0.898	81%	0.812	S	S	*	*			trans	-78.4	144.7	170.2	-71	-65.1	0	0	0	112.5
140	L	28.8	Very low	29.7	Very low	172 Å²	172	150.5 Å²	150.5	90%	0.901	82%	0.819	S	S	*	*			trans	-152	154.4	160.4	-104.8	168.3	0	0	0	111.3
141	M	27.5	Very low	29.4	Very low	171 Å²	171	154.6 Å²	154.6	84%	0.842	82%	0.824	S	S	*	*			trans	-139.5	175.5	-174.6	-80.1	-161.6	169.3	0	0	112.4
142	L	29	Very low	29.6	Very low	164 Å²	164	151.3 Å²	151.3	86%	0.859	82%	0.821	S	S	*	*			trans	81.8	144.9	174.6	-45.6	162	0	0	0	114.4
143	E	31	Very low	29.8	Very low	173 Å²	173	154.9 Å²	154.9	81%	0.808	83%	0.832	S	S	*	*			cis	-154.8	161.2	-22.8	-111.1	-149.1	165.7	0	0	109.6	G145	E143-G145 PolarHBondContact O-N 3.27Å
144	P	30.1	Very low	30.5	Very low	124 Å²	124	152.2 Å²	152.2	81%	0.805	82%	0.823	S	S	*	*			trans	-88.8	110.3	-165	33.1	-34.7	0	0	0	116
145	G	27	Very low	31.3	Very low	70 Å²	70	151.1 Å²	151.1	72%	0.722	82%	0.816	S	S	*	*			trans	-105.4	85.5	-176.9	0	0	0	0	0	117.1	E143	E143-G145 PolarHBondContact O-N 3.27Å
146	T	29.3	Very low	32.5	Very low	146 Å²	146	149.3 Å²	149.3	90%	0.896	81%	0.811	S	S	*	*			trans	40.8	99.8	157.2	57.7	0	0	0	0	119.8
147	S	28.1	Very low	33.9	Very low	124 Å²	124	143.9 Å²	143.9	87%	0.867	78%	0.784	S	S	*	*			trans	-110.8	145.4	153	-177.7	0	0	0	0	110.9
148	K	28.2	Very low	35.7	Very low	194 Å²	194	139.1 Å²	139.1	84%	0.843	77%	0.768	S	S	*	*			trans	-107	103.5	174.1	-76.4	-178.4	178.4	175.6	0	110.4
149	N	29.5	Very low	37.5	Very low	158 Å²	158	133.8 Å²	133.8	85%	0.845	73%	0.729	S	S	*	*				-168.9	155.1	125.6	-97.7	-28.5	0	0	0	111.8
150	N	25.6	Very low	40.1	Very low	155 Å²	155	131.1 Å²	131.1	83%	0.829	71%	0.711	S	S	*	*			trans	-88.1	114.8	-168.8	-67.5	-39.4	0	0	0	113.1
151	R	27.4	Very low	42.7	Very low	232 Å²	232	124 Å²	124	88%	0.875	67%	0.674	S	S	*	*	S	Bend		-167.3	156	126.8	-97.3	147.5	-167.5	-156.5	1.7	108.6
152	S	32.7	Very low	45.4	Very low	111 Å²	111	121 Å²	121	78%	0.776	66%	0.656	S	S	*	*			trans	29.8	92.5	173.6	36.3	0	0	0	0	116.2	P154	S152-P154 WeakPolarHBondContact O-CD 3.44Å
153	K	33.1	Very low	47.9	Very low	203 Å²	203	114.7 Å²	114.7	88%	0.883	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-56.4	124.1	157.4	-87.4	-168.4	172.5	-170.6	0	107.4	I155	K153-I155 PolarHBondContact O-N 3.03Å
154	P	46.7	Very low	49.9	Very low	101 Å²	101	109.6 Å²	109.6	66%	0.656	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-61.5	139.3	175.6	24.8	-32.5	0	0	0	109.4	S152	S152-P154 WeakPolarHBondContact O-CD 3.44Å
155	I	47.4	Very low	51.5	Low	114 Å²	114	109.7 Å²	109.7	59%	0.585	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-66.7	130.6	170.4	-61.7	174.4	0	0	0	106.3	T98 K153 V157	T98-I155 HydrophobicContact CG2-CG2 4.27Å; K153-I155 PolarHBondContact O-N 3.03Å; I155-V157 PolarHBondContact O-N 3.39Å
156	P	58	Low	53.4	Low	94 Å²	94	110.4 Å²	110.4	61%	0.61	60%	0.601	S	S	*	*			trans	-64.1	106.4	179.1	25.9	-33.6	0	0	0	109.2	V158	P156-V158 PolarHBondContact O-N 3.11Å
157	V	61.4	Low	55.2	Low	34 Å²	34	104.1 Å²	104.1	21%	0.206	57%	0.565	C	S	.	*			trans	-71.5	125.4	-177.9	-174.2	0	0	0	0	109	T98 L99 Y123 I155 D159 I161	T98-V157 WeakPolarHBondContact OG1-CA 3.5Å; L99-V157 HydrophobicContact CD1-CG1 4.41Å; L99-V157 HydrophobicContact CG-CG1 4.37Å; Y123-V157 HydrophobicContact CE1-CB 4.38Å; I155-V157 PolarHBondContact O-N 3.39Å; V157-D159 HydrophobicContact CG1-CB 3.92Å; V157-I161 HydrophobicContact CB-CD1 4.45Å; V157-I161 HydrophobicContact CG1-CD1 3.92Å; V157-I161 HydrophobicContact CG1-CG1 4.47Å
158	V	68	Low	57.3	Low	91 Å²	91	100.5 Å²	100.5	55%	0.552	54%	0.536	S	S	*	.			trans	-98.6	-14.4	179.8	-172	0	0	0	0	111.3	P96 T98 P156	P96-V158 HydrophobicContact CB-CG1 4.16Å; T98-V158 HydrophobicContact CG2-CB 4.48Å; T98-V158 HydrophobicContact CG2-CG2 4.09Å; T98-V158 PolarHBondContact OG1-N 2.84Å; P156-V158 PolarHBondContact O-N 3.11Å
159	D	71.8	Confident	60	Low	11 Å²	11	91.5 Å²	91.5	6%	0.059	50%	0.497	C	S	.	.	S	Bend	trans	-69.1	141.9	176.5	-56.8	-85.7	0	0	0	112.1	S97 T98 L99 V157 I161 V171	S97-D159 VanDerWaalsContact CA-OD1 3.22Å; S97-D159 WeakPolarHBondContact CA-OD1 3.42Å; S97-D159 WeakPolarHBondContact CB-OD1 3.42Å; S97-D159 PolarHBondContact OG-OD1 3.34Å; T98-D159 WeakPolarHBondContact CA-OD2 3.49Å; T98-D159 WeakPolarHBondContact CB-OD2 3.49Å; T98-D159 PolarHBondContact N-OD2 2.76Å; T98-D159 PolarHBondContact OG1-OD2 3.3Å; L99-D159 PolarHBondContact N-OD2 2.98Å; V157-D159 HydrophobicContact CG1-CB 3.92Å; D159-I161 PolarHBondContact O-N 2.8Å; D159-I161 VanDerWaalsContact O-N 3.1Å; D159-V171 HydrophobicContact CB-CG1 3.42Å; D159-V171 VanDerWaalsContact CB-CG1 3.42Å
160	H	81.7	Confident	62.7	Low	112 Å²	112	84.7 Å²	84.7	52%	0.519	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	98.8	176	-177.3	-40.8	0	0	0	110.1	K162 H172	H160-K162 WeakPolarHBondContact CE1-CE 3.38Å; H160-H172 HydrophobicContact CB-CB 4.3Å; H160-H172 PolarHBondContact O-CD2 2.86Å; H160-H172 PolarHBondContact O-N 2.96Å
161	I	83.9	Confident	65.6	Low	22 Å²	22	77.3 Å²	77.3	11%	0.113	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	145.9	174.8	-53.1	158.2	0	0	0	110.5	L120 V124 V157 D159 L169 T170 V171	L120-I161 HydrophobicContact CD2-CD1 3.69Å; V124-I161 HydrophobicContact CG2-CB 3.91Å; V124-I161 HydrophobicContact CG2-CD1 4.45Å; V124-I161 HydrophobicContact CG2-CG2 3.73Å; V157-I161 HydrophobicContact CB-CD1 4.45Å; V157-I161 HydrophobicContact CG1-CD1 3.92Å; V157-I161 HydrophobicContact CG1-CG1 4.47Å; D159-I161 PolarHBondContact O-N 2.8Å; D159-I161 VanDerWaalsContact O-N 3.1Å; I161-L169 HydrophobicContact CG2-CD1 3.55Å; I161-T170 CarbonylContact C-O 3.55Å; I161-T170 WeakPolarHBondContact CA-O 3.5Å; I161-V171 HydrophobicContact CG1-CG2 4.37Å
162	K	84.4	Confident	68.5	Low	107 Å²	107	68.9 Å²	68.9	47%	0.465	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.9	160.4	-64.6	174.8	-177.3	169.3	0	108.2	H160 L169 T170	H160-K162 WeakPolarHBondContact CE1-CE 3.38Å; K162-L169 CarbonylContact O-C 3.59Å; K162-L169 WeakPolarHBondContact O-CA 3.16Å; K162-T170 PolarHBondContact N-O 3.19Å; K162-T170 PolarHBondContact O-N 3.35Å
163	C	81.8	Confident	71.1	Confident	33 Å²	33	63.8 Å²	63.8	22%	0.223	36%	0.356	C	S	.	.			trans	-114.8	142.7	169.2	176.4	0	0	0	0	108.2	C121 V124 L169	C121-C163 HydrophobicContact CB-CB 4Å; C121-C163 WeakPolarHBondContact CB-SG 3.48Å; C121-C163 WeakPolarHBondContact SG-CB 3.44Å; C121-C163 CovalentContact SG-SG 2.04Å; C121-C163 PolarHBondContact SG-SG 3.02Å; V124-C163 HydrophobicContact CB-CB 4.34Å; V124-C163 HydrophobicContact CG1-CB 4.25Å; C163-L169 HydrophobicContact CB-CD1 4.04Å
164	N	72.1	Confident	73.7	Confident	66 Å²	66	56.3 Å²	56.3	35%	0.353	33%	0.326	S	S	.	.			trans	-142.6	162.8	174.5	71.8	30.5	0	0	0	112.2	S166 G167 D168	N164-S166 VanDerWaalsContact CG-OG 3.24Å; N164-S166 PolarHBondContact ND2-OG 3.22Å; N164-S166 PolarHBondContact O-N 2.82Å; N164-S166 WeakPolarHBondContact OD1-CA 3.33Å; N164-S166 PolarHBondContact OD1-N 3.42Å; N164-S166 PolarHBondContact OD1-OG 2.96Å; N164-G167 PolarHBondContact O-N 3.06Å; N164-G167 PolarHBondContact OD1-N 2.89Å; N164-D168 WeakPolarHBondContact ND2-CB 3.1Å; N164-D168 WeakPolarHBondContact OD1-CB 3.37Å; N164-D168 PolarHBondContact OD1-N 2.79Å
165	S	64	Low	75.5	Confident	126 Å²	126	51.5 Å²	51.5	88%	0.881	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	17.7	-178.9	65.1	0	0	0	0	114.7
166	S	66.9	Low	77.4	Confident	84 Å²	84	48.1 Å²	48.1	59%	0.587	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	13.8	172.7	39.2	0	0	0	0	112.2	N164 D168	N164-S166 VanDerWaalsContact CG-OG 3.24Å; N164-S166 PolarHBondContact ND2-OG 3.22Å; N164-S166 PolarHBondContact O-N 2.82Å; N164-S166 WeakPolarHBondContact OD1-CA 3.33Å; N164-S166 PolarHBondContact OD1-N 3.42Å; N164-S166 PolarHBondContact OD1-OG 2.96Å; S166-D168 VanDerWaalsContact C-N 3.3Å; S166-D168 PolarHBondContact O-N 3.03Å
167	G	66.7	Low	78.6	Confident	14 Å²	14	43.7 Å²	43.7	14%	0.144	25%	0.25	C	C	.	.	S	Bend	trans	75.3	13.8	179.1	0	0	0	0	0	114.4	N164 L169	N164-G167 PolarHBondContact O-N 3.06Å; N164-G167 PolarHBondContact OD1-N 2.89Å; G167-L169 PolarHBondContact O-N 3.1Å
168	D	71.1	Confident	79.5	Confident	49 Å²	49	43.5 Å²	43.5	26%	0.262	25%	0.248	S	C	.	.			trans	-89.3	78.8	179.7	-122.1	-48.1	0	0	0	110.2	N164 S166 R193	N164-D168 WeakPolarHBondContact ND2-CB 3.1Å; N164-D168 WeakPolarHBondContact OD1-CB 3.37Å; N164-D168 PolarHBondContact OD1-N 2.79Å; S166-D168 VanDerWaalsContact C-N 3.3Å; S166-D168 PolarHBondContact O-N 3.03Å; D168-R193 IonicContact OD1-CZ 3.78Å; D168-R193 VanDerWaalsContact OD1-CZ 3.27Å; D168-R193 IonicContact OD1-NE 3.28Å; D168-R193 PolarHBondContact OD1-NE 3.34Å; D168-R193 IonicContact OD1-NH2 3.15Å; D168-R193 PolarHBondContact OD1-NH2 2.94Å; D168-R193 IonicContact OD2-CZ 3.83Å; D168-R193 IonicContact OD2-NE 3.53Å; D168-R193 IonicContact OD2-NH2 2.6Å; D168-R193 PolarHBondContact OD2-NH2 2.81Å
169	L	85.4	Confident	79.6	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	112.2	171	-177.9	57.6	0	0	0	109.3	A117 L120 I161 K162 C163 G167 R193 I194	A117-L169 HydrophobicContact CB-CD2 3.85Å; L120-L169 HydrophobicContact CB-CD1 4.46Å; L120-L169 HydrophobicContact CB-CD2 4.23Å; L120-L169 HydrophobicContact CD1-CD2 4.47Å; I161-L169 HydrophobicContact CG2-CD1 3.55Å; K162-L169 CarbonylContact O-C 3.59Å; K162-L169 WeakPolarHBondContact O-CA 3.16Å; C163-L169 HydrophobicContact CB-CD1 4.04Å; G167-L169 PolarHBondContact O-N 3.1Å; L169-R193 WeakPolarHBondContact O-CA 3.39Å; L169-I194 HydrophobicContact CB-CB 4.32Å; L169-I194 HydrophobicContact CD2-CB 3.84Å; L169-I194 HydrophobicContact CD2-CD1 4.05Å; L169-I194 HydrophobicContact CD2-CG2 3.87Å; L169-I194 HydrophobicContact CG-CB 3.94Å; L169-I194 HydrophobicContact CG-CD1 4.11Å; L169-I194 PolarHBondContact O-N 3.49Å
170	T	87.2	Confident	79.5	Confident	16 Å²	16	47.8 Å²	47.8	10%	0.098	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.6	-177.4	55.4	0	0	0	0	112.7	I161 K162 H172 V191 V192 R193	I161-T170 CarbonylContact C-O 3.55Å; I161-T170 WeakPolarHBondContact CA-O 3.5Å; K162-T170 PolarHBondContact N-O 3.19Å; K162-T170 PolarHBondContact O-N 3.35Å; T170-H172 WeakPolarHBondContact CB-NE2 3.34Å; T170-H172 PolarHBondContact OG1-NE2 3.15Å; T170-V191 HydrophobicContact CG2-CG1 4.26Å; T170-V192 CarbonylContact C-O 3.52Å; T170-V192 WeakPolarHBondContact CA-O 3.32Å; T170-R193 HydrophobicContact CG2-CB 4.26Å; T170-R193 HydrophobicContact CG2-CG 4Å
171	V	86.4	Confident	78.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.1	-179.5	-169.3	0	0	0	0	109.8	L99 F100 D159 I161 V191 V192 I194	L99-V171 HydrophobicContact CD1-CG1 4.25Å; L99-V171 HydrophobicContact CD1-CG2 4.2Å; F100-V171 HydrophobicContact CE2-CB 3.98Å; F100-V171 HydrophobicContact CE2-CG1 3.82Å; F100-V171 HydrophobicContact CE2-CG2 4.48Å; D159-V171 HydrophobicContact CB-CG1 3.42Å; D159-V171 VanDerWaalsContact CB-CG1 3.42Å; I161-V171 HydrophobicContact CG1-CG2 4.37Å; V171-V191 WeakPolarHBondContact O-CA 3.29Å; V171-V192 PolarHBondContact N-O 3.09Å; V171-V192 PolarHBondContact O-N 3.46Å; V171-I194 HydrophobicContact CG2-CD1 3.58Å; V171-I194 HydrophobicContact CG2-CG1 4.35Å
172	H	88.1	Confident	78	Confident	54 Å²	54	49.3 Å²	49.3	25%	0.25	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.6	-168.8	-58	-111	0	0	0	111.2	H160 T170 I190	H160-H172 HydrophobicContact CB-CB 4.3Å; H160-H172 PolarHBondContact O-CD2 2.86Å; H160-H172 PolarHBondContact O-N 2.96Å; T170-H172 WeakPolarHBondContact CB-NE2 3.34Å; T170-H172 PolarHBondContact OG1-NE2 3.15Å; H172-I190 WeakPolarHBondContact CA-O 3.24Å
173	F	87.6	Confident	77.5	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	163.2	177.6	66.5	-88.7	0	0	0	112.5	L93 S95 F100 L109 V175 I190 V192	L93-F173 HydrophobicContact CD2-CD2 3.6Å; L93-F173 HydrophobicContact CD2-CE2 3.9Å; S95-F173 WeakPolarHBondContact OG-CA 3.34Å; S95-F173 WeakPolarHBondContact OG-CB 3.42Å; F100-F173 HydrophobicContact CB-CE1 4.03Å; F100-F173 HydrophobicContact CB-CE2 4.47Å; F100-F173 HydrophobicContact CB-CZ 3.85Å; F100-F173 AromaticContact CD2-CD1 3.71Å; F100-F173 HydrophobicContact CD2-CD1 3.71Å; F100-F173 AromaticContact CD2-CE1 3.19Å; F100-F173 HydrophobicContact CD2-CE1 3.19Å; F100-F173 AromaticContact CD2-CZ 3.91Å; F100-F173 HydrophobicContact CD2-CZ 3.91Å; F100-F173 HydrophobicContact CE2-CD1 4.31Å; F100-F173 AromaticContact CE2-CE1 3.83Å; F100-F173 HydrophobicContact CE2-CE1 3.83Å; F100-F173 AromaticContact CG-CE1 3.76Å; F100-F173 HydrophobicContact CG-CE1 3.76Å; F100-F173 HydrophobicContact CG-CZ 4.01Å; L109-F173 HydrophobicContact CD1-CE2 4.46Å; L109-F173 HydrophobicContact CD1-CZ 4.24Å; L109-F173 HydrophobicContact CD2-CE2 3.73Å; L109-F173 HydrophobicContact CD2-CZ 3.91Å; F173-V175 HydrophobicContact CD2-CG2 4.36Å; F173-V175 HydrophobicContact CE2-CG2 4.06Å; F173-I190 HydrophobicContact CD1-CB 4.3Å; F173-I190 HydrophobicContact CD1-CG2 4.5Å; F173-I190 HydrophobicContact CD2-CB 4.01Å; F173-I190 HydrophobicContact CD2-CG1 4.09Å; F173-I190 HydrophobicContact CE1-CB 4.03Å; F173-I190 HydrophobicContact CE1-CG2 3.78Å; F173-I190 HydrophobicContact CE2-CB 3.72Å; F173-I190 HydrophobicContact CE2-CG1 3.73Å; F173-I190 HydrophobicContact CE2-CG2 3.94Å; F173-I190 HydrophobicContact CG-CB 4.3Å; F173-I190 HydrophobicContact CZ-CB 3.74Å; F173-I190 HydrophobicContact CZ-CG1 4.17Å; F173-I190 HydrophobicContact CZ-CG2 3.46Å; F173-I190 VanDerWaalsContact CZ-CG2 3.46Å; F173-I190 PolarHBondContact N-O 2.96Å; F173-I190 WeakPolarHBondContact O-CA 3.34Å; F173-I190 VanDerWaalsContact O-CB 3.24Å; F173-I190 WeakPolarHBondContact O-CB 3.35Å; F173-I190 PolarHBondContact O-N 2.85Å; F173-V192 HydrophobicContact CE1-CG2 3.76Å; F173-V192 HydrophobicContact CZ-CG2 4.32Å
174	D	87.2	Confident	77.1	Confident	47 Å²	47	48.9 Å²	48.9	25%	0.251	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	152.2	-174.4	-74.5	0.6	0	0	0	113.7	L93 G94 S95 H188 H189	L93-D174 CarbonylContact C-O 3.57Å; L93-D174 WeakPolarHBondContact CA-O 3.4Å; G94-D174 PolarHBondContact N-O 3.27Å; S95-D174 PolarHBondContact OG-N 3.04Å; D174-H188 CarbonylContact C-O 3.3Å; D174-H188 WeakPolarHBondContact CA-O 2.99Å; D174-H189 IonicContact OD1-CE1 2.71Å; D174-H189 IonicContact OD1-CG 3.06Å; D174-H189 IonicContact OD1-ND1 3.28Å; D174-H189 PolarHBondContact OD1-ND1 3.42Å; D174-H189 IonicContact OD2-CE1 2.77Å; D174-H189 IonicContact OD2-ND1 2.95Å; D174-H189 PolarHBondContact OD2-ND1 3.4Å
175	V	85.6	Confident	77.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	118	168.4	-177.6	0	0	0	0	112.3	I62 Y91 K92 L93 V102 L109 F173 H188 I190	I62-V175 HydrophobicContact CD1-CB 3.7Å; I62-V175 HydrophobicContact CD1-CG1 3.49Å; I62-V175 VanDerWaalsContact CD1-CG1 3.49Å; I62-V175 HydrophobicContact CD1-CG2 3.98Å; Y91-V175 HydrophobicContact CD1-CG1 4.4Å; K92-V175 CarbonylContact O-C 3.51Å; K92-V175 WeakPolarHBondContact O-CA 3.47Å; L93-V175 HydrophobicContact CD2-CG2 4.16Å; V102-V175 HydrophobicContact CG1-CG1 4.45Å; V102-V175 HydrophobicContact CG2-CG1 4.31Å; L109-V175 HydrophobicContact CD2-CG2 4.23Å; F173-V175 HydrophobicContact CD2-CG2 4.36Å; F173-V175 HydrophobicContact CE2-CG2 4.06Å; V175-H188 PolarHBondContact N-O 3.47Å; V175-H188 PolarHBondContact O-N 2.84Å; V175-H188 PolarHBondContact O-ND1 2.76Å; V175-I190 HydrophobicContact CB-CG1 4.38Å; V175-I190 HydrophobicContact CG2-CD1 4.35Å; V175-I190 HydrophobicContact CG2-CG1 3.82Å
176	N	86	Confident	77.8	Confident	43 Å²	43	42.1 Å²	42.1	23%	0.23	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	134.1	176.7	-70.1	-33	0	0	0	111.7	Y91 K92 G94 V178 L184	Y91-N176 CarbonylContact C-O 3.58Å; Y91-N176 WeakPolarHBondContact CA-O 3.46Å; K92-N176 PolarHBondContact N-O 2.04Å; K92-N176 PolarHBondContact O-N 3.4Å; G94-N176 WeakPolarHBondContact CA-ND2 3.44Å; N176-V178 HydrophobicContact CB-CG2 4.39Å; N176-L184 HydrophobicContact CB-CD1 3.67Å
177	A	83.1	Confident	78.6	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.008	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	120.6	171.5	0	0	0	0	0	110.5	Y91 R185 A186	Y91-A177 HydrophobicContact CD1-CB 3.92Å; Y91-A177 HydrophobicContact CE1-CB 3.83Å; A177-R185 PolarHBondContact O-N 2.74Å; A177-A186 HydrophobicContact CB-CB 4.26Å; A177-A186 PolarHBondContact N-O 2.95Å; A177-A186 PolarHBondContact O-N 2.79Å
178	V	80.1	Confident	79.4	Confident	30 Å²	30	38.5 Å²	38.5	18%	0.182	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.1	-164.7	-168.5	0	0	0	0	110.7	L89 N90 N176 G182 S183 L184	L89-V178 CarbonylContact C-O 3.47Å; L89-V178 WeakPolarHBondContact CA-O 3.49Å; N90-V178 PolarHBondContact N-O 3.41Å; N90-V178 PolarHBondContact O-N 2.83Å; N176-V178 HydrophobicContact CB-CG2 4.39Å; V178-G182 WeakPolarHBondContact CG1-O 3.05Å; V178-S183 WeakPolarHBondContact CA-O 3.47Å; V178-L184 HydrophobicContact CG2-CD1 4.21Å
179	Q	70.4	Confident	80.2	Confident	51 Å²	51	40.1 Å²	40.1	24%	0.238	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	165.9	175.4	-75.7	177.8	-114.4	0	0	112.9	L89 D181 G182 S183 R185	L89-Q179 HydrophobicContact CD2-CB 4.39Å; L89-Q179 HydrophobicContact CD2-CG 3.58Å; Q179-D181 VanDerWaalsContact CB-OD1 3.24Å; Q179-D181 WeakPolarHBondContact CB-OD1 3.4Å; Q179-D181 PolarHBondContact O-N 2.88Å; Q179-G182 PolarHBondContact O-N 2.91Å; Q179-S183 PolarHBondContact N-O 2.87Å; Q179-R185 HydrophobicContact CG-CB 4.24Å
180	I	69.9	Low	80.4	Confident	140 Å²	140	40 Å²	40	72%	0.718	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.2	178.4	-53	175.5	0	0	0	112.1	A88 G182	A88-I180 HydrophobicContact CB-CD1 4.29Å; I180-G182 VanDerWaalsContact C-N 3.3Å
181	D	66	Low	80.5	Confident	113 Å²	113	40.3 Å²	40.3	60%	0.604	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	1.2	176.8	56.7	24.6	0	0	0	114.2	Q179 S183	Q179-D181 VanDerWaalsContact CB-OD1 3.24Å; Q179-D181 WeakPolarHBondContact CB-OD1 3.4Å; Q179-D181 PolarHBondContact O-N 2.88Å; D181-S183 VanDerWaalsContact CG-OG 3.29Å; D181-S183 WeakPolarHBondContact OD1-CB 3.41Å; D181-S183 PolarHBondContact OD1-N 2.87Å; D181-S183 PolarHBondContact OD1-OG 3.03Å
182	G	69.2	Low	80.6	Confident	53 Å²	53	40.3 Å²	40.3	55%	0.546	22%	0.223	S	C	.	.	S	Bend	trans	87.6	-1.5	-176.7	0	0	0	0	0	114.9	V178 Q179 I180 L184	V178-G182 WeakPolarHBondContact CG1-O 3.05Å; Q179-G182 PolarHBondContact O-N 2.91Å; I180-G182 VanDerWaalsContact C-N 3.3Å; G182-L184 PolarHBondContact O-N 2.78Å
183	S	72.8	Confident	80.6	Confident	54 Å²	54	41.4 Å²	41.4	38%	0.378	23%	0.225	S	C	.	.			trans	-66.5	124.1	178.8	-51.5	0	0	0	0	111.3	V178 Q179 D181 R185	V178-S183 WeakPolarHBondContact CA-O 3.47Å; Q179-S183 PolarHBondContact N-O 2.87Å; D181-S183 VanDerWaalsContact CG-OG 3.29Å; D181-S183 WeakPolarHBondContact OD1-CB 3.41Å; D181-S183 PolarHBondContact OD1-N 2.87Å; D181-S183 PolarHBondContact OD1-OG 3.03Å; S183-R185 PolarHBondContact O-N 3.18Å
184	L	73.2	Confident	80.7	Confident	78 Å²	78	41.3 Å²	41.3	41%	0.408	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	116.4	169.1	-176.2	69.6	0	0	0	109	L40 N176 V178 G182 V187	L40-L184 HydrophobicContact CD1-CD2 3.9Å; L40-L184 HydrophobicContact CD1-CG 3.77Å; L40-L184 HydrophobicContact CD2-CD2 4.34Å; N176-L184 HydrophobicContact CB-CD1 3.67Å; V178-L184 HydrophobicContact CG2-CD1 4.21Å; G182-L184 PolarHBondContact O-N 2.78Å; L184-V187 HydrophobicContact CD2-CG2 3.99Å
185	R	72.9	Confident	80.6	Confident	49 Å²	49	42.1 Å²	42.1	19%	0.185	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-36.3	-175.6	-169.4	178.2	-179.8	-176.3	-2.3	112.2	Q41 I65 L89 A177 Q179 S183	Q41-R185 PolarHBondContact N-O 3.48Å; I65-R185 HydrophobicContact CD1-CG 4.18Å; L89-R185 HydrophobicContact CD2-CB 4.34Å; A177-R185 PolarHBondContact O-N 2.74Å; Q179-R185 HydrophobicContact CG-CB 4.24Å; S183-R185 PolarHBondContact O-N 3.18Å
186	A	78.3	Confident	80.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	158.6	174.1	0	0	0	0	0	113.5	Q41 Y43 I65 A177	Q41-A186 HydrophobicContact CB-CB 4.17Å; Q41-A186 CarbonylContact O-C 3.53Å; Q41-A186 WeakPolarHBondContact O-CA 3.05Å; Q41-A186 VanDerWaalsContact O-CB 3.3Å; Q41-A186 WeakPolarHBondContact O-CB 3.43Å; Y43-A186 HydrophobicContact CD2-CB 3.95Å; Y43-A186 HydrophobicContact CE2-CB 3.74Å; I65-A186 HydrophobicContact CD1-CB 4.3Å; A177-A186 HydrophobicContact CB-CB 4.26Å; A177-A186 PolarHBondContact N-O 2.95Å; A177-A186 PolarHBondContact O-N 2.79Å
187	V	84	Confident	80.3	Confident	17 Å²	17	42.2 Å²	42.2	10%	0.103	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.6	167.8	-174.2	0	0	0	0	107.8	L40 Q41 V42 Y43 L184	L40-V187 HydrophobicContact CD1-CG2 4.47Å; L40-V187 HydrophobicContact CD2-CG2 4.31Å; Q41-V187 PolarHBondContact O-N 2.77Å; V42-V187 WeakPolarHBondContact CA-O 3.47Å; Y43-V187 PolarHBondContact N-O 3.41Å; L184-V187 HydrophobicContact CD2-CG2 3.99Å
188	H	84.2	Confident	80.1	Confident	6 Å²	6	43.3 Å²	43.3	3%	0.028	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	111	175.3	-54.6	78.1	0	0	0	108	Y43 I62 D174 V175 I190	Y43-H188 AromaticContact CD2-CD2 3.71Å; Y43-H188 AromaticContact CD2-NE2 3.42Å; Y43-H188 WeakPolarHBondContact CD2-NE2 3.44Å; Y43-H188 AromaticContact CG-CD2 3.83Å; Y43-H188 AromaticContact CG-NE2 3.95Å; Y43-H188 WeakPolarHBondContact O-CA 3.38Å; I62-H188 VanDerWaalsContact CG2-CD2 3.42Å; I62-H188 WeakPolarHBondContact CG2-CD2 3.4Å; I62-H188 VanDerWaalsContact CG2-NE2 3.34Å; I62-H188 WeakPolarHBondContact CG2-NE2 3.33Å; D174-H188 CarbonylContact C-O 3.3Å; D174-H188 WeakPolarHBondContact CA-O 2.99Å; V175-H188 PolarHBondContact N-O 3.47Å; V175-H188 PolarHBondContact O-N 2.84Å; V175-H188 PolarHBondContact O-ND1 2.76Å; H188-I190 HydrophobicContact CB-CD1 3.7Å; H188-I190 PolarHBondContact O-N 2.78Å
189	H	87.8	Confident	80	Confident	82 Å²	82	43 Å²	43	38%	0.38	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	119	165.7	-62.6	-59.3	0	0	0	107.6	V42 Y43 S44 T45 D174	V42-H189 VanDerWaalsContact CG1-CD2 3.49Å; V42-H189 WeakPolarHBondContact CG1-CD2 3.46Å; V42-H189 WeakPolarHBondContact CG1-NE2 3.36Å; Y43-H189 PolarHBondContact O-N 3.08Å; S44-H189 CarbonylContact C-O 3.58Å; S44-H189 WeakPolarHBondContact CA-O 3.21Å; T45-H189 PolarHBondContact N-O 2.94Å; D174-H189 IonicContact OD1-CE1 2.71Å; D174-H189 IonicContact OD1-CG 3.06Å; D174-H189 IonicContact OD1-ND1 3.28Å; D174-H189 PolarHBondContact OD1-ND1 3.42Å; D174-H189 IonicContact OD2-CE1 2.77Å; D174-H189 IonicContact OD2-ND1 2.95Å; D174-H189 PolarHBondContact OD2-ND1 3.4Å
190	I	88.7	Confident	80.4	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129.7	-178.4	-46.3	-56.1	0	0	0	109.1	T45 F47 I62 L109 H172 F173 V175 H188 V192	T45-I190 WeakPolarHBondContact O-CA 3.43Å; F47-I190 HydrophobicContact CD2-CG2 3.68Å; F47-I190 HydrophobicContact CE2-CD1 4.39Å; F47-I190 HydrophobicContact CE2-CG2 3.79Å; I62-I190 HydrophobicContact CD1-CD1 4.28Å; I62-I190 HydrophobicContact CG1-CD1 4.44Å; L109-I190 HydrophobicContact CD1-CD1 4.24Å; L109-I190 HydrophobicContact CD1-CG1 4.22Å; L109-I190 HydrophobicContact CD1-CG2 3.87Å; H172-I190 WeakPolarHBondContact CA-O 3.24Å; F173-I190 HydrophobicContact CD1-CB 4.3Å; F173-I190 HydrophobicContact CD1-CG2 4.5Å; F173-I190 HydrophobicContact CD2-CB 4.01Å; F173-I190 HydrophobicContact CD2-CG1 4.09Å; F173-I190 HydrophobicContact CE1-CB 4.03Å; F173-I190 HydrophobicContact CE1-CG2 3.78Å; F173-I190 HydrophobicContact CE2-CB 3.72Å; F173-I190 HydrophobicContact CE2-CG1 3.73Å; F173-I190 HydrophobicContact CE2-CG2 3.94Å; F173-I190 HydrophobicContact CG-CB 4.3Å; F173-I190 HydrophobicContact CZ-CB 3.74Å; F173-I190 HydrophobicContact CZ-CG1 4.17Å; F173-I190 HydrophobicContact CZ-CG2 3.46Å; F173-I190 VanDerWaalsContact CZ-CG2 3.46Å; F173-I190 PolarHBondContact N-O 2.96Å; F173-I190 WeakPolarHBondContact O-CA 3.34Å; F173-I190 VanDerWaalsContact O-CB 3.24Å; F173-I190 WeakPolarHBondContact O-CB 3.35Å; F173-I190 PolarHBondContact O-N 2.85Å; V175-I190 HydrophobicContact CB-CG1 4.38Å; V175-I190 HydrophobicContact CG2-CD1 4.35Å; V175-I190 HydrophobicContact CG2-CG1 3.82Å; H188-I190 HydrophobicContact CB-CD1 3.7Å; H188-I190 PolarHBondContact O-N 2.78Å; I190-V192 HydrophobicContact CG2-CG2 4.19Å
191	V	88.3	Confident	80.9	Confident	23 Å²	23	37 Å²	37	14%	0.139	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123	170.2	-174.9	0	0	0	0	107.6	T45 E46 F47 T170 V171	T45-V191 PolarHBondContact O-N 2.95Å; E46-V191 CarbonylContact C-O 3.54Å; E46-V191 WeakPolarHBondContact CA-O 3.48Å; E46-V191 HydrophobicContact CG-CB 4.35Å; F47-V191 PolarHBondContact N-O 3.21Å; T170-V191 HydrophobicContact CG2-CG1 4.26Å; V171-V191 WeakPolarHBondContact O-CA 3.29Å
192	V	89.4	Confident	82	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	115.1	171.4	-177.3	0	0	0	0	108.3	F47 I49 I59 F100 T170 V171 F173 I190	F47-V192 HydrophobicContact CB-CG2 4.43Å; I49-V192 HydrophobicContact CG2-CG1 3.76Å; I59-V192 HydrophobicContact CG2-CG2 4.46Å; F100-V192 HydrophobicContact CD2-CG2 4.42Å; F100-V192 HydrophobicContact CE1-CB 4.48Å; F100-V192 HydrophobicContact CE1-CG1 4.1Å; F100-V192 HydrophobicContact CE1-CG2 4.31Å; F100-V192 HydrophobicContact CE2-CB 3.99Å; F100-V192 HydrophobicContact CE2-CG1 4.39Å; F100-V192 HydrophobicContact CE2-CG2 3.96Å; F100-V192 HydrophobicContact CZ-CB 3.75Å; F100-V192 HydrophobicContact CZ-CG1 3.64Å; F100-V192 HydrophobicContact CZ-CG2 3.91Å; T170-V192 CarbonylContact C-O 3.52Å; T170-V192 WeakPolarHBondContact CA-O 3.32Å; V171-V192 PolarHBondContact N-O 3.09Å; V171-V192 PolarHBondContact O-N 3.46Å; F173-V192 HydrophobicContact CE1-CG2 3.76Å; F173-V192 HydrophobicContact CZ-CG2 4.32Å; I190-V192 HydrophobicContact CG2-CG2 4.19Å
193	R	89.2	Confident	82.8	Confident	77 Å²	77	36.3 Å²	36.3	29%	0.291	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.3	172.5	-161.4	172.4	-161.6	-119.4	10.8	108.7	F47 S48 I49 D168 L169 T170	F47-R193 PolarHBondContact O-N 3.03Å; S48-R193 WeakPolarHBondContact CA-O 3.46Å; I49-R193 PolarHBondContact N-O 3.46Å; D168-R193 IonicContact OD1-CZ 3.78Å; D168-R193 VanDerWaalsContact OD1-CZ 3.27Å; D168-R193 IonicContact OD1-NE 3.28Å; D168-R193 PolarHBondContact OD1-NE 3.34Å; D168-R193 IonicContact OD1-NH2 3.15Å; D168-R193 PolarHBondContact OD1-NH2 2.94Å; D168-R193 IonicContact OD2-CZ 3.83Å; D168-R193 IonicContact OD2-NE 3.53Å; D168-R193 IonicContact OD2-NH2 2.6Å; D168-R193 PolarHBondContact OD2-NH2 2.81Å; L169-R193 WeakPolarHBondContact O-CA 3.39Å; T170-R193 HydrophobicContact CG2-CB 4.26Å; T170-R193 HydrophobicContact CG2-CG 4Å
194	I	88.3	Confident	83.7	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.9	175.7	-62.2	164.8	0	0	0	107	I49 E51 I115 L120 L169 V171	I49-I194 HydrophobicContact CG2-CG1 4.37Å; I49-I194 WeakPolarHBondContact O-CA 3.45Å; E51-I194 HydrophobicContact CB-CG2 4.01Å; I115-I194 HydrophobicContact CG2-CD1 3.65Å; I115-I194 HydrophobicContact CG2-CG1 3.99Å; I115-I194 HydrophobicContact CG2-CG2 3.75Å; L120-I194 HydrophobicContact CD1-CD1 3.65Å; L169-I194 HydrophobicContact CB-CB 4.32Å; L169-I194 HydrophobicContact CD2-CB 3.84Å; L169-I194 HydrophobicContact CD2-CD1 4.05Å; L169-I194 HydrophobicContact CD2-CG2 3.87Å; L169-I194 HydrophobicContact CG-CB 3.94Å; L169-I194 HydrophobicContact CG-CD1 4.11Å; L169-I194 PolarHBondContact O-N 3.49Å; V171-I194 HydrophobicContact CG2-CD1 3.58Å; V171-I194 HydrophobicContact CG2-CG1 4.35Å
195	H	85.4	Confident	84.4	Confident	64 Å²	64	35.9 Å²	35.9	30%	0.296	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	119.2	174.7	-61.1	-96.3	0	0	0	109.5	S48 I49 E51	S48-H195 WeakPolarHBondContact CB-NE2 3.16Å; S48-H195 PolarHBondContact OG-NE2 3.13Å; I49-H195 PolarHBondContact O-N 2.7Å; E51-H195 PolarHBondContact N-O 3.02Å; E51-H195 VanDerWaalsContact N-O 3.08Å
196	D	83.7	Confident	85.1	Confident	9 Å²	9	37.7 Å²	37.7	5%	0.048	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-60.3	135.5	167.7	162.6	147.9	0	0	0	110.5	E51 A117 I234 L235 H238	E51-D196 WeakPolarHBondContact OE1-CA 3.31Å; A117-D196 HydrophobicContact CB-CB 4.39Å; D196-I234 VanDerWaalsContact OD1-CA 3.25Å; D196-I234 WeakPolarHBondContact OD1-CA 3.14Å; D196-I234 WeakPolarHBondContact OD1-CB 3.17Å; D196-I234 PolarHBondContact OD1-N 3.03Å; D196-L235 HydrophobicContact CB-CD1 3.83Å; D196-L235 HydrophobicContact CB-CG 3.97Å; D196-L235 PolarHBondContact OD1-N 2.75Å; D196-L235 WeakPolarHBondContact OD2-CD1 3.39Å; D196-H238 PolarHBondContact O-CE1 2.9Å; D196-H238 IonicContact OD2-CE1 3.99Å; D196-H238 PolarHBondContact OD2-CE1 2.82Å; D196-H238 IonicContact OD2-CG 3.16Å; D196-H238 IonicContact OD2-ND1 2.62Å; D196-H238 PolarHBondContact OD2-ND1 2.8Å
197	L	82	Confident	85.4	Confident	37 Å²	37	44.5 Å²	44.5	19%	0.194	22%	0.221	C	C	.	.			trans	-114.4	144.6	177.8	-66.6	175.8	0	0	0	110	E51 D199	E51-L197 HydrophobicContact CG-CB 4.09Å; E51-L197 HydrophobicContact CG-CD1 3.77Å; E51-L197 HydrophobicContact CG-CG 3.81Å; E51-L197 PolarHBondContact OE1-N 2.85Å; L197-D199 HydrophobicContact CB-CB 4.35Å; L197-D199 PolarHBondContact O-N 3.28Å
198	N	78	Confident	85.7	Confident	23 Å²	23	49 Å²	49	12%	0.123	24%	0.236	C	C	.	.			trans	-70.2	70.5	169.6	-169.9	-35.9	0	0	0	110.5	H238 N299 N305	N198-H238 HydrophobicContact CB-CB 3.97Å; N198-H238 PolarHBondContact N-ND1 2.75Å; N198-N299 PolarHBondContact ND2-O 2.68Å; N198-N299 VanDerWaalsContact ND2-O 3.12Å; N198-N305 VanDerWaalsContact C-ND2 3.26Å; N198-N305 PolarHBondContact O-ND2 3.44Å
199	D	77.8	Confident	86.2	Confident	24 Å²	24	50.5 Å²	50.5	13%	0.128	24%	0.242	C	C	.	.			trans	-100.5	-20.6	-172	131.2	-46.3	0	0	0	111.6	N52 L197 L307 I312	N52-D199 PolarHBondContact ND2-OD2 3.49Å; N52-D199 VanDerWaalsContact ND2-OD2 3.13Å; L197-D199 HydrophobicContact CB-CB 4.35Å; L197-D199 PolarHBondContact O-N 3.28Å; D199-L307 WeakPolarHBondContact OD2-CD1 3.3Å; D199-L307 WeakPolarHBondContact OD2-CD2 3.19Å; D199-I312 VanDerWaalsContact O-CD1 3.26Å; D199-I312 WeakPolarHBondContact O-CD1 3.49Å; D199-I312 WeakPolarHBondContact O-CG1 3.48Å
200	N	79.9	Confident	86.4	Confident	44 Å²	44	50.9 Å²	50.9	24%	0.235	24%	0.243	C	C	.	.	S	Bend	trans	-98.4	-155.9	171	-54.5	-86.8	0	0	0	111.7	I232 D233 I312	N200-I232 HydrophobicContact CB-CD1 4.38Å; N200-I232 HydrophobicContact CB-CG1 3.66Å; N200-I232 WeakPolarHBondContact OD1-CD1 3.26Å; N200-D233 WeakPolarHBondContact CB-OD1 3.44Å; N200-D233 PolarHBondContact N-OD1 3.31Å; N200-D233 PolarHBondContact ND2-OD1 3.23Å; N200-I312 WeakPolarHBondContact O-CG2 3.36Å
201	G	80.1	Confident	86.5	Confident	20 Å²	20	55 Å²	55	21%	0.206	26%	0.262	C	S	.	.			trans	172.8	162.9	-176.4	0	0	0	0	0	112.9	K203 D231	G201-K203 PolarHBondContact O-N 2.87Å; G201-D231 VanDerWaalsContact C-CG 3.41Å; G201-D231 VanDerWaalsContact C-OD2 3.32Å; G201-D231 WeakPolarHBondContact CA-OD1 3.49Å; G201-D231 WeakPolarHBondContact CA-OD2 2.93Å; G201-D231 PolarHBondContact N-OD1 3.04Å
202	P	88.1	Confident	86.6	Confident	4 Å²	4	61.6 Å²	61.6	3%	0.026	28%	0.284	C	S	.	.			trans	-71.3	135.7	-163.3	27.1	-34.7	0	0	0	111.3	R230 D231 I241 A295 S316	P202-R230 CarbonylContact C-O 3.54Å; P202-R230 WeakPolarHBondContact CA-O 3.42Å; P202-D231 WeakPolarHBondContact CA-OD2 3.48Å; P202-D231 WeakPolarHBondContact CD-OD2 3.3Å; P202-I241 HydrophobicContact CB-CD1 4.09Å; P202-I241 HydrophobicContact CB-CG1 4.04Å; P202-I241 HydrophobicContact CB-CG2 3.89Å; P202-A295 HydrophobicContact CB-CB 4.15Å; P202-S316 WeakPolarHBondContact O-CB 3.14Å
203	K	87.8	Confident	86.7	Confident	148 Å²	148	61.7 Å²	61.7	64%	0.643	28%	0.284	S	S	*	.	B	Isolated β-bridge	trans	-138.3	130	-171.9	-173.2	174.1	179.8	178.5	0	112.2	G201 A229 R230	G201-K203 PolarHBondContact O-N 2.87Å; K203-A229 CarbonylContact O-C 3.54Å; K203-A229 VanDerWaalsContact O-CA 3.3Å; K203-A229 WeakPolarHBondContact O-CA 3.35Å; K203-A229 WeakPolarHBondContact O-CB 3.37Å; K203-R230 PolarHBondContact N-O 2.85Å; K203-R230 PolarHBondContact O-N 3.18Å
204	F	91.1	Very high	86.6	Confident	12 Å²	12	62.6 Å²	62.6	5%	0.053	29%	0.29	C	S	.	.			trans	-80.8	145.6	168.8	-68.1	-71.3	0	0	0	112	Q206 P227 A229 Y243 L293 A295 S316 L318	F204-Q206 WeakPolarHBondContact CB-O 3.25Å; F204-Q206 PolarHBondContact O-N 3.03Å; F204-P227 WeakPolarHBondContact CE1-O 3.49Å; F204-A229 HydrophobicContact CD1-CB 3.77Å; F204-A229 HydrophobicContact CE1-CB 3.81Å; F204-A229 HydrophobicContact CG-CB 4.21Å; F204-A229 HydrophobicContact CZ-CB 4.27Å; F204-Y243 HydrophobicContact CE1-CD1 4.49Å; F204-Y243 AromaticContact CE1-CE1 3.89Å; F204-Y243 HydrophobicContact CE1-CE1 3.89Å; F204-Y243 HydrophobicContact CZ-CD1 4.13Å; F204-Y243 AromaticContact CZ-CE1 3.91Å; F204-Y243 HydrophobicContact CZ-CE1 3.91Å; F204-L293 HydrophobicContact CE1-CD2 3.81Å; F204-L293 WeakPolarHBondContact CE2-O 3.2Å; F204-L293 HydrophobicContact CZ-CB 4.43Å; F204-L293 HydrophobicContact CZ-CD2 3.61Å; F204-L293 HydrophobicContact CZ-CG 3.9Å; F204-A295 HydrophobicContact CD2-CB 4.46Å; F204-A295 HydrophobicContact CE1-CB 4.39Å; F204-A295 HydrophobicContact CE2-CB 3.68Å; F204-A295 HydrophobicContact CZ-CB 3.63Å; F204-S316 WeakPolarHBondContact CD2-OG 3.43Å; F204-S316 WeakPolarHBondContact CE2-O 3.3Å; F204-S316 PolarHBondContact N-OG 2.9Å; F204-L318 HydrophobicContact CD1-CB 4.31Å; F204-L318 HydrophobicContact CD1-CD2 4.14Å; F204-L318 HydrophobicContact CD2-CB 3.63Å; F204-L318 HydrophobicContact CE1-CB 4.35Å; F204-L318 HydrophobicContact CE1-CD2 4.11Å; F204-L318 HydrophobicContact CE2-CB 3.68Å; F204-L318 HydrophobicContact CG-CB 3.96Å; F204-L318 HydrophobicContact CZ-CB 4.05Å; F204-L318 HydrophobicContact CZ-CD2 4.48Å
205	D	86.8	Confident	86.5	Confident	111 Å²	111	62.9 Å²	62.9	59%	0.594	29%	0.292	S	S	*	.	S	Bend	trans	-71.3	-14.3	174.6	-64.5	-28.3	0	0	0	113.2	R230	D205-R230 IonicContact OD1-CZ 2.72Å; D205-R230 IonicContact OD1-NE 3.57Å; D205-R230 PolarHBondContact OD1-NE 3.31Å; D205-R230 IonicContact OD1-NH2 2.78Å; D205-R230 IonicContact OD2-CZ 3.45Å; D205-R230 VanDerWaalsContact OD2-CZ 3.32Å; D205-R230 IonicContact OD2-NE 2.72Å; D205-R230 PolarHBondContact OD2-NE 2.91Å; D205-R230 VanDerWaalsContact OD2-NE 3.08Å; D205-R230 IonicContact OD2-NH2 3.61Å; D205-R230 PolarHBondContact OD2-NH2 2.8Å
206	Q	87.5	Confident	86.2	Confident	87 Å²	87	61.8 Å²	61.8	41%	0.407	29%	0.294	S	S	.	.			trans	-144.2	154.2	-178.8	70.8	-161.5	-56.1	0	0	111.5	F204 R208 L318	F204-Q206 WeakPolarHBondContact CB-O 3.25Å; F204-Q206 PolarHBondContact O-N 3.03Å; Q206-R208 PolarHBondContact OE1-O 2.77Å; Q206-L318 HydrophobicContact CG-CD1 3.84Å; Q206-L318 WeakPolarHBondContact O-CD1 3.5Å
207	I	86.4	Confident	86	Confident	144 Å²	144	66.5 Å²	66.5	74%	0.738	32%	0.318	S	S	*	.	S	Bend	trans	-88.5	-28.7	-176.7	-58.8	169.6	0	0	0	111.8	E319	I207-E319 PolarHBondContact O-N 3.21Å
208	R	90.3	Very high	86.1	Confident	111 Å²	111	66.3 Å²	66.3	42%	0.419	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	143.9	-177.9	178.1	179.7	-171.6	138.9	-9.1	111	Q206 E319 D321	Q206-R208 PolarHBondContact OE1-O 2.77Å; R208-E319 CarbonylContact C-O 3.59Å; R208-E319 WeakPolarHBondContact CA-O 3.48Å; R208-E319 HydrophobicContact CB-CB 4.04Å; R208-E319 HydrophobicContact CB-CG 4.35Å; R208-E319 WeakPolarHBondContact CD-OE2 3.26Å; R208-E319 HydrophobicContact CG-CB 4.07Å; R208-E319 HydrophobicContact CG-CG 3.83Å; R208-E319 WeakPolarHBondContact CG-OE2 3.22Å; R208-E319 IonicContact CZ-OE1 2.68Å; R208-E319 IonicContact CZ-OE2 3.44Å; R208-E319 IonicContact NE-OE1 3.19Å; R208-E319 PolarHBondContact NE-OE1 3.4Å; R208-E319 IonicContact NE-OE2 3.08Å; R208-E319 VanDerWaalsContact NH1-CD 3.29Å; R208-E319 IonicContact NH1-OE1 3.32Å; R208-E319 PolarHBondContact NH1-OE1 2.92Å; R208-E319 IonicContact NH1-OE2 2.92Å; R208-E319 PolarHBondContact NH1-OE2 2.8Å; R208-E319 VanDerWaalsContact NH1-OE2 3.14Å; R208-E319 IonicContact NH2-OE1 3.68Å; R208-D321 IonicContact CZ-OD2 3.97Å; R208-D321 IonicContact NE-OD2 2.7Å; R208-D321 VanDerWaalsContact NH2-CG 3.27Å; R208-D321 IonicContact NH2-OD1 3.67Å; R208-D321 IonicContact NH2-OD2 3.78Å; R208-D321 PolarHBondContact NH2-OD2 3.5Å
209	W	92.9	Very high	86.4	Confident	38 Å²	38	72.8 Å²	72.8	14%	0.144	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128.3	170.3	-179	98.2	0	0	0	108.3	K211 I224 L226 P227 L318 E319 I320 D321 I322	W209-K211 HydrophobicContact CE3-CB 4.5Å; W209-K211 HydrophobicContact CH2-CB 3.73Å; W209-K211 HydrophobicContact CH2-CD 3.67Å; W209-K211 HydrophobicContact CH2-CG 4.36Å; W209-K211 HydrophobicContact CZ2-CB 4.3Å; W209-K211 HydrophobicContact CZ2-CD 3.81Å; W209-K211 HydrophobicContact CZ3-CB 3.83Å; W209-I224 HydrophobicContact CH2-CG2 3.65Å; W209-I224 HydrophobicContact CZ2-CG2 4.21Å; W209-L226 HydrophobicContact CD2-CD2 4.19Å; W209-L226 HydrophobicContact CE3-CD2 4.03Å; W209-L226 HydrophobicContact CH2-CD2 3.89Å; W209-L226 HydrophobicContact CZ2-CD2 4.04Å; W209-L226 HydrophobicContact CZ3-CD2 3.89Å; W209-P227 HydrophobicContact CB-CG 4.29Å; W209-P227 VanDerWaalsContact CD1-CG 3.41Å; W209-P227 HydrophobicContact CG-CG 4.01Å; W209-L318 HydrophobicContact CB-CD1 4.06Å; W209-L318 HydrophobicContact CB-CD2 4.44Å; W209-E319 PolarHBondContact N-O 3.22Å; W209-I320 HydrophobicContact CB-CD1 4.04Å; W209-I320 HydrophobicContact CD2-CD1 4.46Å; W209-I320 HydrophobicContact CE3-CD1 4.13Å; W209-I320 HydrophobicContact CE3-CG2 3.92Å; W209-I320 HydrophobicContact CG-CD1 4.5Å; W209-I320 HydrophobicContact CZ3-CG2 4.07Å; W209-I320 WeakPolarHBondContact O-CA 3.29Å; W209-D321 PolarHBondContact O-N 3.14Å; W209-I322 HydrophobicContact CZ3-CD1 4.37Å; W209-I322 HydrophobicContact CZ3-CG1 4.09Å
210	H	92.2	Very high	86.8	Confident	89 Å²	89	74 Å²	74	41%	0.412	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	144.2	-177.3	163.2	84.9	0	0	0	110.5	D321 E323	H210-D321 VanDerWaalsContact CA-O 3.25Å; H210-D321 WeakPolarHBondContact CA-O 3.43Å; H210-D321 HydrophobicContact CB-CB 4.49Å; H210-D321 IonicContact CE1-OD2 3.71Å; H210-D321 IonicContact CG-OD2 2.72Å; H210-D321 PolarHBondContact ND1-O 2.85Å; H210-D321 IonicContact ND1-OD2 3.84Å; H210-D321 PolarHBondContact ND1-OD2 2.86Å; H210-E323 IonicContact CE1-OE2 2.69Å
211	K	90.9	Very high	87	Confident	90 Å²	90	74.3 Å²	74.3	39%	0.391	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	134.2	176.1	-159.1	166	-173.5	170.2	0	112.9	W209 L213 D321 I322 E323	W209-K211 HydrophobicContact CE3-CB 4.5Å; W209-K211 HydrophobicContact CH2-CB 3.73Å; W209-K211 HydrophobicContact CH2-CD 3.67Å; W209-K211 HydrophobicContact CH2-CG 4.36Å; W209-K211 HydrophobicContact CZ2-CB 4.3Å; W209-K211 HydrophobicContact CZ2-CD 3.81Å; W209-K211 HydrophobicContact CZ3-CB 3.83Å; K211-L213 HydrophobicContact CD-CD2 4.2Å; K211-L213 HydrophobicContact CG-CD2 4.01Å; K211-D321 PolarHBondContact N-O 2.73Å; K211-I322 WeakPolarHBondContact O-CA 3.37Å; K211-E323 PolarHBondContact O-N 2.85Å
212	R	91.2	Very high	87.4	Confident	160 Å²	160	78.4 Å²	78.4	60%	0.604	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.2	172.2	-159.7	177.6	-158.6	-127.6	-9.3	110.8	E323 A325	R212-E323 CarbonylContact C-O 3.59Å; R212-E323 VanDerWaalsContact CA-O 3.29Å; R212-E323 WeakPolarHBondContact CA-O 3.38Å; R212-E323 HydrophobicContact CB-CB 4.5Å; R212-E323 WeakPolarHBondContact CD-OE1 3.17Å; R212-E323 HydrophobicContact CG-CB 4.21Å; R212-E323 HydrophobicContact CG-CG 4.22Å; R212-E323 IonicContact CZ-OE1 2.69Å; R212-E323 IonicContact NE-OE1 2.66Å; R212-E323 PolarHBondContact NE-OE1 2.53Å; R212-E323 IonicContact NH2-OE1 2.96Å; R212-A325 HydrophobicContact CG-CB 3.92Å
213	L	90.7	Very high	87.5	Confident	3 Å²	3	81.6 Å²	81.6	2%	0.016	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.6	-177.7	-47.7	177.8	0	0	0	109.1	K211 Y218 I224 F263 L281 I322 E323 V324 A325	K211-L213 HydrophobicContact CD-CD2 4.2Å; K211-L213 HydrophobicContact CG-CD2 4.01Å; L213-Y218 HydrophobicContact CB-CD2 3.95Å; L213-Y218 HydrophobicContact CB-CE2 4.11Å; L213-Y218 HydrophobicContact CB-CG 4.21Å; L213-Y218 HydrophobicContact CD1-CD1 4.24Å; L213-Y218 HydrophobicContact CD1-CE1 4.45Å; L213-Y218 HydrophobicContact CD2-CD1 4.35Å; L213-Y218 HydrophobicContact CD2-CE1 3.81Å; L213-Y218 HydrophobicContact CD2-CE2 4.09Å; L213-I224 HydrophobicContact CD1-CD1 3.73Å; L213-I224 HydrophobicContact CD2-CD1 4.45Å; L213-F263 HydrophobicContact CD1-CZ 4.36Å; L213-L281 HydrophobicContact CB-CD1 4.09Å; L213-L281 HydrophobicContact CD1-CD1 3.69Å; L213-I322 HydrophobicContact CD1-CG2 3.52Å; L213-I322 HydrophobicContact CG-CG2 3.97Å; L213-E323 PolarHBondContact N-O 3.12Å; L213-V324 CarbonylContact O-C 3.38Å; L213-A325 VanDerWaalsContact O-CB 3.31Å; L213-A325 WeakPolarHBondContact O-CB 2.95Å; L213-A325 PolarHBondContact O-N 2.8Å
214	K	87.2	Confident	87.6	Confident	95 Å²	95	74.9 Å²	74.9	41%	0.413	36%	0.357	S	S	.	.			trans	-105.6	131.5	173.8	-74.2	175.9	159.9	-75.4	0	109.5	A216 L217 Y218 A325 M327	K214-A216 PolarHBondContact O-N 2.7Å; K214-L217 HydrophobicContact CB-CD1 4.23Å; K214-L217 HydrophobicContact CB-CG 4.36Å; K214-L217 HydrophobicContact CD-CD1 4.16Å; K214-L217 PolarHBondContact O-N 3.08Å; K214-Y218 WeakPolarHBondContact O-CD2 3.19Å; K214-Y218 PolarHBondContact O-N 3.41Å; K214-A325 WeakPolarHBondContact CA-O 3.03Å; K214-A325 HydrophobicContact CG-CB 4.4Å; K214-M327 HydrophobicContact CB-CG 4.1Å; K214-M327 HydrophobicContact CB-SD 4.46Å; K214-M327 HydrophobicContact CD-SD 3.83Å; K214-M327 HydrophobicContact CG-CG 4.37Å; K214-M327 HydrophobicContact CG-SD 4.26Å; K214-M327 PolarHBondContact NZ-SD 3.26Å
215	E	86.9	Confident	87.6	Confident	7 Å²	7	78.6 Å²	78.6	3%	0.033	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-59	-51.6	-169.8	52.7	-88.9	92.8	0	0	113.5	L217 Y218 L281 A283 V324 A325 D326 M327	E215-L217 PolarHBondContact O-N 2.85Å; E215-Y218 PolarHBondContact O-N 2.99Å; E215-L281 HydrophobicContact CB-CB 4.07Å; E215-L281 VanDerWaalsContact CB-O 3.26Å; E215-L281 WeakPolarHBondContact CB-O 3.47Å; E215-A283 WeakPolarHBondContact OE2-CA 3.28Å; E215-A283 WeakPolarHBondContact OE2-CB 3.46Å; E215-A283 PolarHBondContact OE2-N 3Å; E215-V324 HydrophobicContact CB-CG1 4.36Å; E215-A325 VanDerWaalsContact OE1-O 3.06Å; E215-D326 VanDerWaalsContact OE1-CA 3.3Å; E215-D326 WeakPolarHBondContact OE1-CA 3.5Å; E215-D326 PolarHBondContact OE1-N 3.41Å; E215-M327 HydrophobicContact CG-CB 4.49Å; E215-M327 WeakPolarHBondContact OE1-CB 3.38Å; E215-M327 WeakPolarHBondContact OE1-CG 3.47Å; E215-M327 PolarHBondContact OE1-N 3.31Å
216	A	78	Confident	87.9	Confident	42 Å²	42	73.6 Å²	73.6	35%	0.347	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-56.8	-18	-175.2	0	0	0	0	0	113.9	K214 M327	K214-A216 PolarHBondContact O-N 2.7Å; A216-M327 HydrophobicContact CB-CG 4.46Å
217	L	80.1	Confident	88.1	Confident	107 Å²	107	70.4 Å²	70.4	56%	0.56	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-94.9	-18.7	175.4	-58.9	-178	0	0	0	114.1	K214 E215 R222	K214-L217 HydrophobicContact CB-CD1 4.23Å; K214-L217 HydrophobicContact CB-CG 4.36Å; K214-L217 HydrophobicContact CD-CD1 4.16Å; K214-L217 PolarHBondContact O-N 3.08Å; E215-L217 PolarHBondContact O-N 2.85Å; L217-R222 PolarHBondContact O-NH1 3.36Å
218	Y	85.3	Confident	88.3	Confident	34 Å²	34	67.8 Å²	67.8	13%	0.133	32%	0.321	C	S	.	.			trans	-115.6	67	-168	-80.9	-93	0	0	0	112.7	L213 K214 E215 R222 I224 L277 L281	L213-Y218 HydrophobicContact CB-CD2 3.95Å; L213-Y218 HydrophobicContact CB-CE2 4.11Å; L213-Y218 HydrophobicContact CB-CG 4.21Å; L213-Y218 HydrophobicContact CD1-CD1 4.24Å; L213-Y218 HydrophobicContact CD1-CE1 4.45Å; L213-Y218 HydrophobicContact CD2-CD1 4.35Å; L213-Y218 HydrophobicContact CD2-CE1 3.81Å; L213-Y218 HydrophobicContact CD2-CE2 4.09Å; K214-Y218 WeakPolarHBondContact O-CD2 3.19Å; K214-Y218 PolarHBondContact O-N 3.41Å; E215-Y218 PolarHBondContact O-N 2.99Å; Y218-R222 HydrophobicContact CD1-CG 4.27Å; Y218-R222 HydrophobicContact CE1-CG 4.45Å; Y218-I224 HydrophobicContact CD1-CD1 4.21Å; Y218-I224 HydrophobicContact CE1-CD1 4.14Å; Y218-I224 HydrophobicContact CE1-CG1 4.26Å; Y218-L277 HydrophobicContact CD1-CD1 3.94Å; Y218-L277 HydrophobicContact CG-CD1 4.47Å; Y218-L281 HydrophobicContact CG-CD1 4.48Å; Y218-L281 PolarHBondContact O-N 2.76Å
219	R	82.7	Confident	88.3	Confident	158 Å²	158	62.7 Å²	62.7	60%	0.596	30%	0.302	S	S	*	.			trans	-77.1	162.2	174.5	-53.7	-166.9	-175	-147.5	-5.3	113.5	R222 D280	R219-R222 WeakPolarHBondContact O-CB 3.21Å; R219-R222 PolarHBondContact O-N 2.77Å; R219-D280 WeakPolarHBondContact CA-OD1 3.48Å; R219-D280 WeakPolarHBondContact CB-OD1 3.48Å; R219-D280 WeakPolarHBondContact CB-OD2 3.31Å; R219-D280 VanDerWaalsContact CG-OD2 3.29Å; R219-D280 WeakPolarHBondContact CG-OD2 3.42Å
220	A	86.1	Confident	88.1	Confident	50 Å²	50	68.3 Å²	68.3	41%	0.413	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	145.7	178.3	0	0	0	0	0	112.8	R222 D280	A220-R222 PolarHBondContact O-N 2.85Å; A220-D280 WeakPolarHBondContact CB-OD1 3.29Å; A220-D280 PolarHBondContact N-OD1 3.02Å
221	G	85.5	Confident	87.8	Confident	50 Å²	50	65.2 Å²	65.2	52%	0.515	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	-10.4	-173.1	0	0	0	0	0	114.6	R223 I276 L277	G221-R223 PolarHBondContact O-N 3.47Å; G221-I276 WeakPolarHBondContact O-CG1 3.4Å; G221-L277 PolarHBondContact N-O 3.06Å
222	R	88.1	Confident	87.5	Confident	107 Å²	107	66 Å²	66	40%	0.404	32%	0.317	S	S	.	.			trans	-71.6	126.1	175.6	-171.3	168.2	-175.5	-179.8	-0.2	110.8	L217 Y218 R219 A220 L277	L217-R222 PolarHBondContact O-NH1 3.36Å; Y218-R222 HydrophobicContact CD1-CG 4.27Å; Y218-R222 HydrophobicContact CE1-CG 4.45Å; R219-R222 WeakPolarHBondContact O-CB 3.21Å; R219-R222 PolarHBondContact O-N 2.77Å; A220-R222 PolarHBondContact O-N 2.85Å; R222-L277 HydrophobicContact CB-CD1 4.12Å; R222-L277 PolarHBondContact O-N 3.19Å
223	R	90	Very high	87.2	Confident	70 Å²	70	58.6 Å²	58.6	26%	0.264	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	144.2	179	-179.6	175.5	163.6	121.5	5.7	112.2	G221 D225 E266 Q272 L275	G221-R223 PolarHBondContact O-N 3.47Å; R223-D225 IonicContact CZ-OD1 3.35Å; R223-D225 IonicContact NE-OD1 3.38Å; R223-D225 PolarHBondContact NE-OD1 2.93Å; R223-D225 IonicContact NH2-OD1 2.74Å; R223-D225 PolarHBondContact NH2-OD1 3.37Å; R223-E266 IonicContact CZ-OE2 3.71Å; R223-E266 IonicContact NH1-OE2 2.74Å; R223-E266 PolarHBondContact NH1-OE2 2.93Å; R223-Q272 PolarHBondContact NH2-O 3.44Å; R223-Q272 VanDerWaalsContact NH2-O 3.1Å; R223-L275 CarbonylContact C-O 3.46Å; R223-L275 VanDerWaalsContact CA-O 3.31Å; R223-L275 WeakPolarHBondContact CA-O 3.42Å
224	I	90.3	Very high	86.7	Confident	8 Å²	8	60.4 Å²	60.4	4%	0.041	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	103.8	178.6	-56.1	176.1	0	0	0	107.6	W209 L213 Y218 F263 G274 L275 L277	W209-I224 HydrophobicContact CH2-CG2 3.65Å; W209-I224 HydrophobicContact CZ2-CG2 4.21Å; L213-I224 HydrophobicContact CD1-CD1 3.73Å; L213-I224 HydrophobicContact CD2-CD1 4.45Å; Y218-I224 HydrophobicContact CD1-CD1 4.21Å; Y218-I224 HydrophobicContact CE1-CD1 4.14Å; Y218-I224 HydrophobicContact CE1-CG1 4.26Å; I224-F263 HydrophobicContact CD1-CE1 3.91Å; I224-G274 CarbonylContact O-C 3.58Å; I224-G274 VanDerWaalsContact O-CA 3.27Å; I224-G274 WeakPolarHBondContact O-CA 3.27Å; I224-L275 HydrophobicContact CB-CB 4.47Å; I224-L275 PolarHBondContact N-O 3.31Å; I224-L275 PolarHBondContact O-N 2.71Å; I224-L277 HydrophobicContact CD1-CD1 4.42Å
225	D	91.4	Very high	86.3	Confident	90 Å²	90	58.4 Å²	58.4	48%	0.481	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	138.1	179.7	-66.5	-59.8	0	0	0	112.4	R223	R223-D225 IonicContact CZ-OD1 3.35Å; R223-D225 IonicContact NE-OD1 3.38Å; R223-D225 PolarHBondContact NE-OD1 2.93Å; R223-D225 IonicContact NH2-OD1 2.74Å; R223-D225 PolarHBondContact NH2-OD1 3.37Å
226	L	92.4	Very high	85.9	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.026	32%	0.321	C	S	.	.			trans	-105.3	162.1	178.7	-67.2	-170.9	0	0	0	111.4	W209 Q272 P273 L275 L293 I320	W209-L226 HydrophobicContact CD2-CD2 4.19Å; W209-L226 HydrophobicContact CE3-CD2 4.03Å; W209-L226 HydrophobicContact CH2-CD2 3.89Å; W209-L226 HydrophobicContact CZ2-CD2 4.04Å; W209-L226 HydrophobicContact CZ3-CD2 3.89Å; L226-Q272 PolarHBondContact O-NE2 3.49Å; L226-P273 HydrophobicContact CB-CB 4.4Å; L226-P273 HydrophobicContact CB-CG 4.26Å; L226-P273 PolarHBondContact N-O 2.87Å; L226-L275 HydrophobicContact CD1-CD1 4.17Å; L226-L275 HydrophobicContact CD1-CD2 3.84Å; L226-L275 HydrophobicContact CD1-CG 3.75Å; L226-L275 HydrophobicContact CD2-CD1 4.06Å; L226-L275 HydrophobicContact CD2-CG 4.22Å; L226-L275 HydrophobicContact CG-CD1 4.37Å; L226-L275 HydrophobicContact CG-CG 3.99Å; L226-L293 HydrophobicContact CB-CD2 4.26Å; L226-L293 HydrophobicContact CD1-CD1 4.2Å; L226-L293 HydrophobicContact CD1-CD2 3.93Å; L226-L293 HydrophobicContact CD1-CG 4.46Å; L226-I320 HydrophobicContact CD1-CD1 4.06Å; L226-I320 HydrophobicContact CD1-CG1 4.34Å; L226-I320 HydrophobicContact CD2-CD1 3.94Å
227	P	91.4	Very high	85.8	Confident	21 Å²	21	66.2 Å²	66.2	14%	0.136	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-58.3	138.9	172.9	-23.5	35	0	0	0	112.4	F204 W209 P273 L318	F204-P227 WeakPolarHBondContact CE1-O 3.49Å; W209-P227 HydrophobicContact CB-CG 4.29Å; W209-P227 VanDerWaalsContact CD1-CG 3.41Å; W209-P227 HydrophobicContact CG-CG 4.01Å; P227-P273 VanDerWaalsContact O-CG 3.31Å; P227-P273 WeakPolarHBondContact O-CG 3.16Å; P227-L318 HydrophobicContact CB-CD2 3.99Å; P227-L318 HydrophobicContact CG-CD2 3.78Å
228	K	90.6	Very high	85.7	Confident	88 Å²	88	63 Å²	63	38%	0.383	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-89.5	138.5	174.3	-162.5	179.6	172.6	174.7	0	109.3	Y243 S270 G271	K228-Y243 VanDerWaalsContact CG-OH 3.26Å; K228-Y243 WeakPolarHBondContact CG-OH 3.48Å; K228-S270 PolarHBondContact NZ-O 3.27Å; K228-G271 WeakPolarHBondContact CD-O 3.5Å; K228-G271 WeakPolarHBondContact CE-O 3.31Å
229	A	90.5	Very high	85.5	Confident	4 Å²	4	63.2 Å²	63.2	3%	0.033	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-78.1	164.4	168	0	0	0	0	0	110.9	K203 F204 I241 Y243 A295	K203-A229 CarbonylContact O-C 3.54Å; K203-A229 VanDerWaalsContact O-CA 3.3Å; K203-A229 WeakPolarHBondContact O-CA 3.35Å; K203-A229 WeakPolarHBondContact O-CB 3.37Å; F204-A229 HydrophobicContact CD1-CB 3.77Å; F204-A229 HydrophobicContact CE1-CB 3.81Å; F204-A229 HydrophobicContact CG-CB 4.21Å; F204-A229 HydrophobicContact CZ-CB 4.27Å; A229-I241 VanDerWaalsContact C-CD1 3.44Å; A229-I241 HydrophobicContact CB-CD1 3.93Å; A229-I241 HydrophobicContact CB-CG2 4.3Å; A229-I241 VanDerWaalsContact O-CD1 3.27Å; A229-I241 WeakPolarHBondContact O-CD1 3.36Å; A229-Y243 HydrophobicContact CB-CE1 4.06Å; A229-Y243 PolarHBondContact N-OH 2.88Å; A229-A295 HydrophobicContact CB-CB 3.6Å
230	R	88	Confident	85.5	Confident	156 Å²	156	62.6 Å²	62.6	59%	0.589	32%	0.321	S	S	*	.	B	Isolated β-bridge	trans	-122.3	146.6	175.8	-49.7	179.9	-165	-127.7	-0.4	109.5	P202 K203 D205	P202-R230 CarbonylContact C-O 3.54Å; P202-R230 WeakPolarHBondContact CA-O 3.42Å; K203-R230 PolarHBondContact N-O 2.85Å; K203-R230 PolarHBondContact O-N 3.18Å; D205-R230 IonicContact OD1-CZ 2.72Å; D205-R230 IonicContact OD1-NE 3.57Å; D205-R230 PolarHBondContact OD1-NE 3.31Å; D205-R230 IonicContact OD1-NH2 2.78Å; D205-R230 IonicContact OD2-CZ 3.45Å; D205-R230 VanDerWaalsContact OD2-CZ 3.32Å; D205-R230 IonicContact OD2-NE 2.72Å; D205-R230 PolarHBondContact OD2-NE 2.91Å; D205-R230 VanDerWaalsContact OD2-NE 3.08Å; D205-R230 IonicContact OD2-NH2 3.61Å; D205-R230 PolarHBondContact OD2-NH2 2.8Å
231	D	87.4	Confident	85.6	Confident	24 Å²	24	61.8 Å²	61.8	13%	0.128	31%	0.31	C	S	.	.			trans	-130.4	153.1	168.2	-139.5	-30.2	0	0	0	107	G201 P202 I241	G201-D231 VanDerWaalsContact C-CG 3.41Å; G201-D231 VanDerWaalsContact C-OD2 3.32Å; G201-D231 WeakPolarHBondContact CA-OD1 3.49Å; G201-D231 WeakPolarHBondContact CA-OD2 2.93Å; G201-D231 PolarHBondContact N-OD1 3.04Å; P202-D231 WeakPolarHBondContact CA-OD2 3.48Å; P202-D231 WeakPolarHBondContact CD-OD2 3.3Å; D231-I241 HydrophobicContact CB-CD1 4.08Å; D231-I241 HydrophobicContact CB-CG1 4.03Å
232	I	84.7	Confident	85.7	Confident	106 Å²	106	61.5 Å²	61.5	54%	0.544	30%	0.296	S	S	.	.			trans	-118.4	-12.2	-167.2	70	169.9	0	0	0	116	E118 N200	E118-I232 HydrophobicContact CG-CG1 4.37Å; N200-I232 HydrophobicContact CB-CD1 4.38Å; N200-I232 HydrophobicContact CB-CG1 3.66Å; N200-I232 WeakPolarHBondContact OD1-CD1 3.26Å
233	D	84.3	Confident	85.9	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.032	28%	0.28	C	S	.	.			trans	-54.7	145.9	173.7	-49.3	-27.9	0	0	0	111.4	E118 N200 H238 S239	E118-D233 WeakPolarHBondContact OE1-CA 3.27Å; N200-D233 WeakPolarHBondContact CB-OD1 3.44Å; N200-D233 PolarHBondContact N-OD1 3.31Å; N200-D233 PolarHBondContact ND2-OD1 3.23Å; D233-H238 HydrophobicContact CB-CB 3.69Å; D233-H238 WeakPolarHBondContact OD2-CB 3.27Å; D233-S239 VanDerWaalsContact O-CB 3.22Å; D233-S239 WeakPolarHBondContact O-CB 2.95Å
234	I	80.2	Confident	85.9	Confident	41 Å²	41	57.1 Å²	57.1	21%	0.21	28%	0.28	C	S	.	.	S	Bend	trans	-79.9	-36	-175.2	-51.4	135	0	0	0	111.6	A117 E118 C121 D196 A236	A117-I234 HydrophobicContact CB-CD1 3.7Å; E118-I234 VanDerWaalsContact OE1-CD1 3.29Å; E118-I234 WeakPolarHBondContact OE1-CD1 3.4Å; E118-I234 WeakPolarHBondContact OE1-CG1 3.15Å; E118-I234 PolarHBondContact OE1-N 3.5Å; C121-I234 HydrophobicContact CB-CD1 3.77Å; C121-I234 HydrophobicContact CB-CG1 3.92Å; C121-I234 WeakPolarHBondContact SG-CD1 3.48Å; D196-I234 VanDerWaalsContact OD1-CA 3.25Å; D196-I234 WeakPolarHBondContact OD1-CA 3.14Å; D196-I234 WeakPolarHBondContact OD1-CB 3.17Å; D196-I234 PolarHBondContact OD1-N 3.03Å; I234-A236 PolarHBondContact O-N 3.49Å
235	L	78.5	Confident	85.8	Confident	52 Å²	52	58.5 Å²	58.5	27%	0.272	29%	0.287	S	S	.	.	S	Bend	trans	-66.8	121.5	177	-83.9	172.3	0	0	0	110.3	D196 E237 H238 S239	D196-L235 HydrophobicContact CB-CD1 3.83Å; D196-L235 HydrophobicContact CB-CG 3.97Å; D196-L235 PolarHBondContact OD1-N 2.75Å; D196-L235 WeakPolarHBondContact OD2-CD1 3.39Å; L235-E237 PolarHBondContact O-N 2.84Å; L235-H238 HydrophobicContact CB-CB 4.31Å; L235-H238 PolarHBondContact O-N 2.85Å; L235-S239 PolarHBondContact O-N 2.79Å; L235-S239 PolarHBondContact O-OG 2.88Å
236	A	77.7	Confident	85.5	Confident	77 Å²	77	56.5 Å²	56.5	64%	0.636	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-7.1	177.5	0	0	0	0	0	114.4	I234	I234-A236 PolarHBondContact O-N 3.49Å
237	E	76.7	Confident	84.8	Confident	137 Å²	137	58.2 Å²	58.2	64%	0.64	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-25.1	169.4	-62.3	-163.8	178.2	0	0	112.8	L235 N299	L235-E237 PolarHBondContact O-N 2.84Å; E237-N299 PolarHBondContact O-ND2 3.28Å
238	H	78.1	Confident	83.9	Confident	40 Å²	40	61 Å²	61	19%	0.185	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-51.3	176.7	-60.1	164	0	0	0	110.5	D196 N198 D233 L235 R240 S297	D196-H238 PolarHBondContact O-CE1 2.9Å; D196-H238 IonicContact OD2-CE1 3.99Å; D196-H238 PolarHBondContact OD2-CE1 2.82Å; D196-H238 IonicContact OD2-CG 3.16Å; D196-H238 IonicContact OD2-ND1 2.62Å; D196-H238 PolarHBondContact OD2-ND1 2.8Å; N198-H238 HydrophobicContact CB-CB 3.97Å; N198-H238 PolarHBondContact N-ND1 2.75Å; D233-H238 HydrophobicContact CB-CB 3.69Å; D233-H238 WeakPolarHBondContact OD2-CB 3.27Å; L235-H238 HydrophobicContact CB-CB 4.31Å; L235-H238 PolarHBondContact O-N 2.85Å; H238-R240 PolarHBondContact O-N 3.03Å; H238-S297 PolarHBondContact O-OG 2.74Å
239	S	81.6	Confident	82.7	Confident	38 Å²	38	61 Å²	61	27%	0.266	30%	0.296	S	S	.	.	S	Bend	trans	-69.4	14	179.5	65.6	0	0	0	0	116.3	D233 L235 I241	D233-S239 VanDerWaalsContact O-CB 3.22Å; D233-S239 WeakPolarHBondContact O-CB 2.95Å; L235-S239 PolarHBondContact O-N 2.79Å; L235-S239 PolarHBondContact O-OG 2.88Å; S239-I241 PolarHBondContact O-N 3.32Å
240	R	82.2	Confident	81.1	Confident	144 Å²	144	67 Å²	67	54%	0.543	33%	0.328	S	S	.	.			trans	-83.7	111.7	-175.9	-178.3	174.9	174.5	167.2	1.9	111.2	H238 P298	H238-R240 PolarHBondContact O-N 3.03Å; R240-P298 HydrophobicContact CB-CG 4.36Å; R240-P298 HydrophobicContact CG-CG 4.07Å; R240-P298 WeakPolarHBondContact O-CD 3.48Å
241	I	87.7	Confident	79.4	Confident	34 Å²	34	66 Å²	66	17%	0.174	33%	0.334	C	S	.	.			trans	-95.8	122.4	178.7	-43.9	-177.1	0	0	0	111.7	P202 A229 D231 S239 Y243 A295	P202-I241 HydrophobicContact CB-CD1 4.09Å; P202-I241 HydrophobicContact CB-CG1 4.04Å; P202-I241 HydrophobicContact CB-CG2 3.89Å; A229-I241 VanDerWaalsContact C-CD1 3.44Å; A229-I241 HydrophobicContact CB-CD1 3.93Å; A229-I241 HydrophobicContact CB-CG2 4.3Å; A229-I241 VanDerWaalsContact O-CD1 3.27Å; A229-I241 WeakPolarHBondContact O-CD1 3.36Å; D231-I241 HydrophobicContact CB-CD1 4.08Å; D231-I241 HydrophobicContact CB-CG1 4.03Å; S239-I241 PolarHBondContact O-N 3.32Å; I241-Y243 HydrophobicContact CB-CE2 4.4Å; I241-Y243 HydrophobicContact CG2-CE1 4.09Å; I241-Y243 HydrophobicContact CG2-CE2 3.95Å; I241-A295 HydrophobicContact CG2-CB 3.8Å
242	N	88.8	Confident	77.4	Confident	44 Å²	44	69.2 Å²	69.2	24%	0.235	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	158	162.2	-73.3	-10.1	0	0	0	110.5	A295 Y296	N242-A295 WeakPolarHBondContact O-CA 3.49Å; N242-Y296 HydrophobicContact CB-CD1 4.24Å; N242-Y296 HydrophobicContact CB-CD2 4.17Å; N242-Y296 HydrophobicContact CB-CE1 3.76Å; N242-Y296 HydrophobicContact CB-CE2 3.7Å; N242-Y296 HydrophobicContact CB-CG 4.42Å; N242-Y296 VanDerWaalsContact CB-CZ 3.46Å; N242-Y296 PolarHBondContact N-O 2.85Å; N242-Y296 WeakPolarHBondContact O-CD1 3.38Å; N242-Y296 PolarHBondContact O-N 3.08Å
243	Y	91.7	Very high	75.5	Confident	14 Å²	14	68 Å²	68	6%	0.055	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.2	177.3	-60.6	-88.7	0	0	0	111.6	F204 K228 A229 I241 I267 P273 L293 V294 A295	F204-Y243 HydrophobicContact CE1-CD1 4.49Å; F204-Y243 AromaticContact CE1-CE1 3.89Å; F204-Y243 HydrophobicContact CE1-CE1 3.89Å; F204-Y243 HydrophobicContact CZ-CD1 4.13Å; F204-Y243 AromaticContact CZ-CE1 3.91Å; F204-Y243 HydrophobicContact CZ-CE1 3.91Å; K228-Y243 VanDerWaalsContact CG-OH 3.26Å; K228-Y243 WeakPolarHBondContact CG-OH 3.48Å; A229-Y243 HydrophobicContact CB-CE1 4.06Å; A229-Y243 PolarHBondContact N-OH 2.88Å; I241-Y243 HydrophobicContact CB-CE2 4.4Å; I241-Y243 HydrophobicContact CG2-CE1 4.09Å; I241-Y243 HydrophobicContact CG2-CE2 3.95Å; Y243-I267 HydrophobicContact CD2-CD1 4.06Å; Y243-I267 HydrophobicContact CD2-CG1 4.38Å; Y243-P273 HydrophobicContact CD1-CB 4.32Å; Y243-P273 HydrophobicContact CD1-CG 4.31Å; Y243-P273 HydrophobicContact CD2-CB 4.3Å; Y243-P273 HydrophobicContact CE1-CG 4.06Å; Y243-P273 HydrophobicContact CE2-CG 4.35Å; Y243-P273 HydrophobicContact CG-CB 4.19Å; Y243-L293 HydrophobicContact CD1-CD1 4.4Å; Y243-L293 HydrophobicContact CD1-CD2 4.09Å; Y243-L293 HydrophobicContact CD1-CG 4.23Å; Y243-V294 CarbonylContact C-O 3.5Å; Y243-V294 WeakPolarHBondContact CA-O 3.31Å; Y243-A295 HydrophobicContact CD1-CB 3.97Å; Y243-A295 HydrophobicContact CE1-CB 3.78Å
244	R	90	Very high	73.4	Confident	71 Å²	71	73 Å²	73	27%	0.268	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	164.3	167	67.5	178.3	-171.1	-101.2	3.3	111.1	E246 V294 Y296 E315	R244-E246 IonicContact CZ-OE1 2.71Å; R244-E246 IonicContact NE-OE1 3.7Å; R244-E246 PolarHBondContact NE-OE1 2.9Å; R244-E246 IonicContact NH2-OE1 2.82Å; R244-E246 PolarHBondContact NH2-OE1 2.87Å; R244-V294 HydrophobicContact CG-CB 3.91Å; R244-V294 PolarHBondContact N-O 2.88Å; R244-V294 PolarHBondContact O-N 2.94Å; R244-Y296 HydrophobicContact CB-CE1 4.05Å; R244-Y296 HydrophobicContact CG-CD1 4.27Å; R244-Y296 HydrophobicContact CG-CE1 3.94Å; R244-E315 IonicContact CZ-OE1 4Å; R244-E315 IonicContact CZ-OE2 3.07Å; R244-E315 IonicContact NH1-OE1 2.86Å; R244-E315 PolarHBondContact NH1-OE1 3.49Å; R244-E315 IonicContact NH1-OE2 2.89Å; R244-E315 IonicContact NH2-OE1 3.18Å; R244-E315 PolarHBondContact NH2-OE1 2.86Å; R244-E315 IonicContact NH2-OE2 3.88Å; R244-E315 PolarHBondContact NH2-OE2 2.9Å
245	L	88.6	Confident	71.5	Confident	37 Å²	37	73.6 Å²	73.6	19%	0.194	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.1	175.9	-141.4	66.8	0	0	0	109.1	F259 L275 F291 V292 L293	L245-F259 HydrophobicContact CD2-CE1 3.81Å; L245-F259 HydrophobicContact CD2-CZ 4.19Å; L245-L275 HydrophobicContact CD1-CD2 4.2Å; L245-L275 HydrophobicContact CD2-CD2 4.07Å; L245-F291 HydrophobicContact CD1-CD2 3.64Å; L245-F291 HydrophobicContact CD1-CE2 4.01Å; L245-F291 HydrophobicContact CD2-CD2 3.77Å; L245-F291 HydrophobicContact CD2-CE2 4.02Å; L245-F291 HydrophobicContact CD2-CG 4.31Å; L245-F291 HydrophobicContact CG-CD2 3.74Å; L245-F291 HydrophobicContact CG-CE2 4.35Å; L245-F291 HydrophobicContact CG-CG 4.38Å; L245-V292 WeakPolarHBondContact CA-O 3.34Å; L245-L293 HydrophobicContact CD1-CB 4.3Å; L245-L293 HydrophobicContact CD1-CD1 3.82Å
246	E	85.5	Confident	69.8	Low	47 Å²	47	79.6 Å²	79.6	22%	0.22	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	152.9	177.4	-69.8	-177.2	-172.5	0	0	111.1	R244 F291 V292 V294 R317	R244-E246 IonicContact CZ-OE1 2.71Å; R244-E246 IonicContact NE-OE1 3.7Å; R244-E246 PolarHBondContact NE-OE1 2.9Å; R244-E246 IonicContact NH2-OE1 2.82Å; R244-E246 PolarHBondContact NH2-OE1 2.87Å; E246-F291 WeakPolarHBondContact O-CA 3.2Å; E246-F291 VanDerWaalsContact O-CB 3.28Å; E246-F291 WeakPolarHBondContact O-CB 3.46Å; E246-V292 HydrophobicContact CB-CB 4.37Å; E246-V292 PolarHBondContact N-O 2.7Å; E246-V292 PolarHBondContact O-N 2.86Å; E246-V294 HydrophobicContact CB-CG2 4.44Å; E246-V294 HydrophobicContact CG-CG2 3.96Å; E246-R317 IonicContact OE1-NH2 2.74Å; E246-R317 PolarHBondContact OE1-NH2 2.84Å; E246-R317 IonicContact OE2-CZ 3.27Å; E246-R317 IonicContact OE2-NH1 2.81Å; E246-R317 PolarHBondContact OE2-NH1 3.03Å; E246-R317 IonicContact OE2-NH2 3.03Å; E246-R317 PolarHBondContact OE2-NH2 2.74Å
247	S	75.9	Confident	68.2	Low	42 Å²	42	81.8 Å²	81.8	29%	0.294	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	144.2	174.9	38.8	0	0	0	0	112.3	H249	S247-H249 VanDerWaalsContact CB-CE1 3.49Å; S247-H249 WeakPolarHBondContact CB-CE1 3.38Å; S247-H249 PolarHBondContact O-N 2.93Å; S247-H249 PolarHBondContact OG-CE1 2.89Å; S247-H249 VanDerWaalsContact OG-CE1 3.26Å; S247-H249 PolarHBondContact OG-NE2 2.89Å
248	W	73.6	Confident	67	Low	79 Å²	79	80.6 Å²	80.6	30%	0.299	45%	0.452	S	S	.	.			trans	-75.4	122.7	169.2	-175.5	-91	0	0	0	110.5	N250 R290 V292 E319	W248-N250 PolarHBondContact NE1-OD1 2.94Å; W248-R290 HydrophobicContact CB-CB 3.68Å; W248-R290 WeakPolarHBondContact CB-O 3.42Å; W248-R290 HydrophobicContact CD2-CB 4.07Å; W248-R290 HydrophobicContact CG-CB 3.68Å; W248-V292 HydrophobicContact CE3-CG2 3.87Å; W248-V292 HydrophobicContact CZ3-CG2 4.18Å; W248-E319 HydrophobicContact CE3-CG 4.17Å; W248-E319 HydrophobicContact CH2-CB 4.27Å; W248-E319 HydrophobicContact CH2-CG 3.76Å; W248-E319 WeakPolarHBondContact CH2-OE1 3.43Å; W248-E319 HydrophobicContact CZ3-CB 3.72Å; W248-E319 HydrophobicContact CZ3-CG 3.36Å
249	H	64.5	Low	66.1	Low	88 Å²	88	82.7 Å²	82.7	41%	0.407	46%	0.461	S	S	.	.			trans	-132	117.8	177.7	-66.2	-25.5	0	0	0	109.6	S247	S247-H249 VanDerWaalsContact CB-CE1 3.49Å; S247-H249 WeakPolarHBondContact CB-CE1 3.38Å; S247-H249 PolarHBondContact O-N 2.93Å; S247-H249 PolarHBondContact OG-CE1 2.89Å; S247-H249 VanDerWaalsContact OG-CE1 3.26Å; S247-H249 PolarHBondContact OG-NE2 2.89Å
250	N	56.6	Low	65.4	Low	131 Å²	131	89.1 Å²	89.1	70%	0.701	48%	0.484	S	S	*	.	S	Bend	trans	-70.5	-36.2	175.4	-72.4	-14.8	0	0	0	111.8	W248	W248-N250 PolarHBondContact NE1-OD1 2.94Å
251	D	52.8	Low	65	Low	134 Å²	134	83.2 Å²	83.2	72%	0.717	46%	0.464	S	S	*	.	S	Bend	trans	-113.5	147.3	-179.8	-66.5	-69	0	0	0	110.3	S253	D251-S253 PolarHBondContact O-N 2.83Å
252	G	46.4	Very low	64.8	Low	91 Å²	91	82 Å²	82	94%	0.938	46%	0.459	S	S	*	.	S	Bend	trans	-69.7	29.1	-170.9	0	0	0	0	0	117.1	S254	G252-S254 PolarHBondContact O-N 2.82Å
253	S	44.9	Very low	64.8	Low	81 Å²	81	80.2 Å²	80.2	57%	0.566	45%	0.449	S	S	*	.			trans	-87.8	92.7	177.5	-176.7	0	0	0	0	111.1	D251 S255	D251-S253 PolarHBondContact O-N 2.83Å; S253-S255 PolarHBondContact O-N 2.71Å
254	S	39.1	Very low	64.7	Low	110 Å²	110	85.8 Å²	85.8	77%	0.769	47%	0.473	S	S	*	.			trans	-74.3	69.1	173.2	63	0	0	0	0	111.6	G252	G252-S254 PolarHBondContact O-N 2.82Å
255	S	39.8	Very low	64.8	Low	55 Å²	55	84.2 Å²	84.2	39%	0.385	47%	0.47	S	S	.	.			trans	-78.9	133.6	172.5	63.2	0	0	0	0	110.9	S253 I257	S253-S255 PolarHBondContact O-N 2.71Å; S255-I257 PolarHBondContact O-N 3.1Å
256	I	44.7	Very low	64.9	Low	177 Å²	177	86.3 Å²	86.3	91%	0.908	48%	0.479	S	S	*	.			trans	-79.8	74.5	-176.8	-50.8	175.6	0	0	0	109.4
257	I	43	Very low	65.1	Low	123 Å²	123	87.9 Å²	87.9	63%	0.631	49%	0.488	S	S	*	.			trans	-99.1	128.1	170.5	-57.3	177.3	0	0	0	107.1	S255 F259	S255-I257 PolarHBondContact O-N 3.1Å; I257-F259 PolarHBondContact O-N 2.99Å
258	P	51.9	Low	65.6	Low	113 Å²	113	87.4 Å²	87.4	73%	0.734	49%	0.485	S	S	*	.			trans	-63	125.8	177.3	26.1	-33.4	0	0	0	109.9	K260	P258-K260 VanDerWaalsContact C-N 3.34Å; P258-K260 PolarHBondContact O-N 2.69Å
259	F	59	Low	66	Low	84 Å²	84	92.3 Å²	92.3	37%	0.368	52%	0.517	S	S	.	.			trans	-67.7	88.3	177.8	179.5	-101.9	0	0	0	110.3	L245 I257 S261 F291	L245-F259 HydrophobicContact CD2-CE1 3.81Å; L245-F259 HydrophobicContact CD2-CZ 4.19Å; I257-F259 PolarHBondContact O-N 2.99Å; F259-S261 VanDerWaalsContact CZ-CB 3.43Å; F259-F291 HydrophobicContact CE2-CB 3.78Å; F259-F291 HydrophobicContact CE2-CG 4.45Å; F259-F291 HydrophobicContact CZ-CB 3.62Å; F259-F291 AromaticContact CZ-CD1 3.91Å; F259-F291 HydrophobicContact CZ-CD1 3.91Å; F259-F291 AromaticContact CZ-CG 3.86Å; F259-F291 HydrophobicContact CZ-CG 3.86Å
260	K	66.2	Low	66.9	Low	173 Å²	173	92.1 Å²	92.1	75%	0.752	53%	0.526	S	S	*	.			trans	-78.7	124.9	165.5	-161.7	-159.9	177.6	-139.9	0	107.9	P258 E279	P258-K260 VanDerWaalsContact C-N 3.34Å; P258-K260 PolarHBondContact O-N 2.69Å; K260-E279 IonicContact NZ-OE1 3.83Å; K260-E279 IonicContact NZ-OE2 2.69Å
261	S	75	Confident	68.2	Low	19 Å²	19	87 Å²	87	13%	0.133	50%	0.504	C	S	.	.			trans	-157.7	144.2	-179.8	171.4	0	0	0	0	108.2	F259 F263	F259-S261 VanDerWaalsContact CZ-CB 3.43Å; S261-F263 PolarHBondContact O-N 2.8Å; S261-F263 VanDerWaalsContact O-N 3.12Å; S261-F263 PolarHBondContact OG-N 3.21Å
262	P	83.9	Confident	70	Confident	10 Å²	10	83.4 Å²	83.4	7%	0.065	48%	0.483	C	S	.	.	S	Bend	trans	-67.9	-5.6	173.3	30	-36.3	0	0	0	112.7	L277 T278 E279 L281	P262-L277 HydrophobicContact CB-CD2 4.22Å; P262-L277 CarbonylContact O-C 3.6Å; P262-L277 VanDerWaalsContact O-CA 3.3Å; P262-L277 WeakPolarHBondContact O-CA 3.25Å; P262-T278 PolarHBondContact O-N 3.03Å; P262-T278 PolarHBondContact O-OG1 2.84Å; P262-E279 HydrophobicContact CB-CG 3.59Å; P262-L281 HydrophobicContact CB-CD2 4.34Å; P262-L281 HydrophobicContact CG-CD2 4.04Å
263	F	88.5	Confident	72.2	Confident	5 Å²	5	79.1 Å²	79.1	2%	0.022	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	115.3	-178.5	-59.1	-71.1	0	0	0	113	L213 I224 S261 L275 L277 L281 H289 F291 I322	L213-F263 HydrophobicContact CD1-CZ 4.36Å; I224-F263 HydrophobicContact CD1-CE1 3.91Å; S261-F263 PolarHBondContact O-N 2.8Å; S261-F263 VanDerWaalsContact O-N 3.12Å; S261-F263 PolarHBondContact OG-N 3.21Å; F263-L275 HydrophobicContact CB-CB 4.18Å; F263-L275 HydrophobicContact CB-CD1 4.17Å; F263-L275 HydrophobicContact CB-CD2 4.18Å; F263-L275 HydrophobicContact CB-CG 4.4Å; F263-L275 HydrophobicContact CD1-CB 3.97Å; F263-L275 HydrophobicContact CD1-CD1 4.04Å; F263-L275 HydrophobicContact CG-CB 4.44Å; F263-L275 HydrophobicContact CG-CD1 4.1Å; F263-L277 HydrophobicContact CD1-CD2 3.95Å; F263-L277 HydrophobicContact CD1-CG 4.19Å; F263-L277 HydrophobicContact CE1-CD1 4.49Å; F263-L277 HydrophobicContact CE1-CD2 3.47Å; F263-L277 VanDerWaalsContact CE1-CD2 3.47Å; F263-L277 HydrophobicContact CE1-CG 3.87Å; F263-L277 HydrophobicContact CZ-CD2 4.03Å; F263-L281 HydrophobicContact CZ-CD1 4.47Å; F263-L281 HydrophobicContact CZ-CD2 4.02Å; F263-H289 HydrophobicContact CD2-CB 4.29Å; F263-H289 HydrophobicContact CE2-CB 3.85Å; F263-H289 AromaticContact CE2-CD2 3.49Å; F263-H289 VanDerWaalsContact CE2-CD2 3.49Å; F263-H289 WeakPolarHBondContact CE2-CD2 3.39Å; F263-H289 AromaticContact CE2-CG 3.76Å; F263-F291 HydrophobicContact CB-CE1 4.45Å; F263-F291 HydrophobicContact CB-CZ 4.14Å; F263-F291 AromaticContact CD2-CE1 3.62Å; F263-F291 HydrophobicContact CD2-CE1 3.62Å; F263-F291 AromaticContact CD2-CZ 3.83Å; F263-F291 HydrophobicContact CD2-CZ 3.83Å; F263-F291 HydrophobicContact CE2-CE1 4.26Å; F263-F291 HydrophobicContact CG-CE1 4.29Å; F263-F291 HydrophobicContact CG-CZ 4.08Å; F263-I322 HydrophobicContact CD1-CD1 4.33Å; F263-I322 HydrophobicContact CD2-CD1 4.21Å; F263-I322 HydrophobicContact CE1-CD1 3.87Å; F263-I322 HydrophobicContact CE2-CB 4.49Å; F263-I322 HydrophobicContact CE2-CD1 3.73Å; F263-I322 HydrophobicContact CE2-CG2 4.33Å; F263-I322 HydrophobicContact CG-CD1 4.49Å; F263-I322 HydrophobicContact CZ-CD1 3.55Å; F263-I322 HydrophobicContact CZ-CG2 4Å
264	K	89.3	Confident	74.4	Confident	131 Å²	131	75.2 Å²	75.2	57%	0.57	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.9	170.5	175.1	-178.9	175.7	-174.2	0	110.6	L275 I276 T278	K264-L275 CarbonylContact O-C 3.58Å; K264-L275 WeakPolarHBondContact O-CA 3.2Å; K264-I276 HydrophobicContact CB-CG2 3.99Å; K264-I276 HydrophobicContact CD-CG2 4.37Å; K264-I276 HydrophobicContact CG-CG2 4.35Å; K264-I276 PolarHBondContact N-O 2.82Å; K264-I276 PolarHBondContact O-N 2.69Å; K264-T278 HydrophobicContact CB-CG2 3.63Å; K264-T278 HydrophobicContact CD-CG2 4.22Å
265	L	91.1	Very high	76.9	Confident	39 Å²	39	70 Å²	70	20%	0.204	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	129.4	175	-178.3	64.3	0	0	0	111.2	P273 L293	L265-P273 HydrophobicContact CD1-CB 4.24Å; L265-L293 HydrophobicContact CD1-CD1 3.72Å; L265-L293 HydrophobicContact CD2-CD1 4.06Å
266	E	90.6	Very high	79.3	Confident	81 Å²	81	69.2 Å²	69.2	38%	0.379	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137.5	172.1	-175.7	-176.9	-117.5	0	0	109.5	R223 G274	R223-E266 IonicContact CZ-OE2 3.71Å; R223-E266 IonicContact NH1-OE2 2.74Å; R223-E266 PolarHBondContact NH1-OE2 2.93Å; E266-G274 PolarHBondContact N-O 2.75Å; E266-G274 PolarHBondContact O-N 2.87Å; E266-G274 VanDerWaalsContact O-O 3.07Å
267	I	89.8	Confident	81.4	Confident	79 Å²	79	61 Å²	61	41%	0.405	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.2	175.9	-54.3	168.1	0	0	0	107.5	Y243	Y243-I267 HydrophobicContact CD2-CD1 4.06Å; Y243-I267 HydrophobicContact CD2-CG1 4.38Å
268	S	86.2	Confident	83.6	Confident	33 Å²	33	58.9 Å²	58.9	23%	0.231	32%	0.316	C	S	.	.			trans	-72.1	165.7	177.5	73	0	0	0	0	112.1	S270 G271 Q272	S268-S270 PolarHBondContact O-N 2.91Å; S268-S270 PolarHBondContact OG-N 3.38Å; S268-S270 PolarHBondContact OG-OG 2.77Å; S268-G271 WeakPolarHBondContact O-CA 3.49Å; S268-G271 PolarHBondContact O-N 3.14Å; S268-Q272 PolarHBondContact N-O 2.83Å; S268-Q272 VanDerWaalsContact OG-CB 3.27Å; S268-Q272 WeakPolarHBondContact OG-CB 3.49Å; S268-Q272 PolarHBondContact OG-N 2.74Å; S268-Q272 PolarHBondContact OG-O 2.69Å
269	N	83.7	Confident	85.3	Confident	181 Å²	181	57.3 Å²	57.3	97%	0.968	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-14.8	172.8	-63.8	-3.3	0	0	0	114.1
270	S	82.7	Confident	86.7	Confident	85 Å²	85	57.2 Å²	57.2	59%	0.594	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	6.1	172.5	58.3	0	0	0	0	113.6	K228 S268 Q272	K228-S270 PolarHBondContact NZ-O 3.27Å; S268-S270 PolarHBondContact O-N 2.91Å; S268-S270 PolarHBondContact OG-N 3.38Å; S268-S270 PolarHBondContact OG-OG 2.77Å; S270-Q272 VanDerWaalsContact C-N 3.3Å; S270-Q272 PolarHBondContact O-N 3.44Å
271	G	84.1	Confident	87.7	Confident	23 Å²	23	49.5 Å²	49.5	24%	0.237	27%	0.269	C	S	.	.	S	Bend	trans	69.8	23.6	-174.5	0	0	0	0	0	113.5	K228 S268 P273	K228-G271 WeakPolarHBondContact CD-O 3.5Å; K228-G271 WeakPolarHBondContact CE-O 3.31Å; S268-G271 WeakPolarHBondContact O-CA 3.49Å; S268-G271 PolarHBondContact O-N 3.14Å; G271-P273 WeakPolarHBondContact O-CD 3.32Å
272	Q	89.4	Confident	88.4	Confident	59 Å²	59	51.3 Å²	51.3	28%	0.276	28%	0.278	S	S	.	.			trans	-84.9	114.6	174.9	-167.1	69.9	31.7	0	0	109.4	R223 L226 S268 S270	R223-Q272 PolarHBondContact NH2-O 3.44Å; R223-Q272 VanDerWaalsContact NH2-O 3.1Å; L226-Q272 PolarHBondContact O-NE2 3.49Å; S268-Q272 PolarHBondContact N-O 2.83Å; S268-Q272 VanDerWaalsContact OG-CB 3.27Å; S268-Q272 WeakPolarHBondContact OG-CB 3.49Å; S268-Q272 PolarHBondContact OG-N 2.74Å; S268-Q272 PolarHBondContact OG-O 2.69Å; S270-Q272 VanDerWaalsContact C-N 3.3Å; S270-Q272 PolarHBondContact O-N 3.44Å
273	P	92.5	Very high	88.6	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	144.5	171.7	31	-34.2	0	0	0	110.1	L226 P227 Y243 L265 G271 L293	L226-P273 HydrophobicContact CB-CB 4.4Å; L226-P273 HydrophobicContact CB-CG 4.26Å; L226-P273 PolarHBondContact N-O 2.87Å; P227-P273 VanDerWaalsContact O-CG 3.31Å; P227-P273 WeakPolarHBondContact O-CG 3.16Å; Y243-P273 HydrophobicContact CD1-CB 4.32Å; Y243-P273 HydrophobicContact CD1-CG 4.31Å; Y243-P273 HydrophobicContact CD2-CB 4.3Å; Y243-P273 HydrophobicContact CE1-CG 4.06Å; Y243-P273 HydrophobicContact CE2-CG 4.35Å; Y243-P273 HydrophobicContact CG-CB 4.19Å; L265-P273 HydrophobicContact CD1-CB 4.24Å; G271-P273 WeakPolarHBondContact O-CD 3.32Å; P273-L293 HydrophobicContact CB-CD2 4.27Å; P273-L293 HydrophobicContact CG-CD2 4.23Å
274	G	91.7	Very high	88.5	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	160.7	172	0	0	0	0	0	110.5	I224 E266	I224-G274 CarbonylContact O-C 3.58Å; I224-G274 VanDerWaalsContact O-CA 3.27Å; I224-G274 WeakPolarHBondContact O-CA 3.27Å; E266-G274 PolarHBondContact N-O 2.75Å; E266-G274 PolarHBondContact O-N 2.87Å; E266-G274 VanDerWaalsContact O-O 3.07Å
275	L	91.6	Very high	88.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	135.7	172.1	-55	170.5	0	0	0	108.3	R223 I224 L226 L245 F263 K264 F291 I320 I322	R223-L275 CarbonylContact C-O 3.46Å; R223-L275 VanDerWaalsContact CA-O 3.31Å; R223-L275 WeakPolarHBondContact CA-O 3.42Å; I224-L275 HydrophobicContact CB-CB 4.47Å; I224-L275 PolarHBondContact N-O 3.31Å; I224-L275 PolarHBondContact O-N 2.71Å; L226-L275 HydrophobicContact CD1-CD1 4.17Å; L226-L275 HydrophobicContact CD1-CD2 3.84Å; L226-L275 HydrophobicContact CD1-CG 3.75Å; L226-L275 HydrophobicContact CD2-CD1 4.06Å; L226-L275 HydrophobicContact CD2-CG 4.22Å; L226-L275 HydrophobicContact CG-CD1 4.37Å; L226-L275 HydrophobicContact CG-CG 3.99Å; L245-L275 HydrophobicContact CD1-CD2 4.2Å; L245-L275 HydrophobicContact CD2-CD2 4.07Å; F263-L275 HydrophobicContact CB-CB 4.18Å; F263-L275 HydrophobicContact CB-CD1 4.17Å; F263-L275 HydrophobicContact CB-CD2 4.18Å; F263-L275 HydrophobicContact CB-CG 4.4Å; F263-L275 HydrophobicContact CD1-CB 3.97Å; F263-L275 HydrophobicContact CD1-CD1 4.04Å; F263-L275 HydrophobicContact CG-CB 4.44Å; F263-L275 HydrophobicContact CG-CD1 4.1Å; K264-L275 CarbonylContact O-C 3.58Å; K264-L275 WeakPolarHBondContact O-CA 3.2Å; L275-F291 HydrophobicContact CD1-CE2 3.65Å; L275-F291 HydrophobicContact CD1-CZ 3.51Å; L275-F291 HydrophobicContact CD2-CE2 3.98Å; L275-F291 HydrophobicContact CD2-CZ 4.43Å; L275-F291 HydrophobicContact CG-CE2 4.45Å; L275-I320 HydrophobicContact CD1-CG2 4.47Å; L275-I322 HydrophobicContact CD1-CD1 3.91Å
276	I	90.9	Very high	88	Confident	39 Å²	39	58 Å²	58	20%	0.2	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.1	167.2	-157.5	166.8	0	0	0	108.6	G221 K264	G221-I276 WeakPolarHBondContact O-CG1 3.4Å; K264-I276 HydrophobicContact CB-CG2 3.99Å; K264-I276 HydrophobicContact CD-CG2 4.37Å; K264-I276 HydrophobicContact CG-CG2 4.35Å; K264-I276 PolarHBondContact N-O 2.82Å; K264-I276 PolarHBondContact O-N 2.69Å
277	L	89.5	Confident	87.9	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	129	175.9	-81.6	153.8	0	0	0	110.1	Y218 G221 R222 I224 P262 F263 L281	Y218-L277 HydrophobicContact CD1-CD1 3.94Å; Y218-L277 HydrophobicContact CG-CD1 4.47Å; G221-L277 PolarHBondContact N-O 3.06Å; R222-L277 HydrophobicContact CB-CD1 4.12Å; R222-L277 PolarHBondContact O-N 3.19Å; I224-L277 HydrophobicContact CD1-CD1 4.42Å; P262-L277 HydrophobicContact CB-CD2 4.22Å; P262-L277 CarbonylContact O-C 3.6Å; P262-L277 VanDerWaalsContact O-CA 3.3Å; P262-L277 WeakPolarHBondContact O-CA 3.25Å; F263-L277 HydrophobicContact CD1-CD2 3.95Å; F263-L277 HydrophobicContact CD1-CG 4.19Å; F263-L277 HydrophobicContact CE1-CD1 4.49Å; F263-L277 HydrophobicContact CE1-CD2 3.47Å; F263-L277 VanDerWaalsContact CE1-CD2 3.47Å; F263-L277 HydrophobicContact CE1-CG 3.87Å; F263-L277 HydrophobicContact CZ-CD2 4.03Å; L277-L281 HydrophobicContact CD2-CD1 4.36Å; L277-L281 HydrophobicContact CD2-CD2 3.65Å; L277-L281 HydrophobicContact CD2-CG 3.75Å
278	T	88.1	Confident	87.8	Confident	79 Å²	79	58.1 Å²	58.1	49%	0.485	31%	0.313	S	S	.	.	S	Bend	trans	-98.2	-23.9	178.8	50.1	0	0	0	0	113.7	P262 K264	P262-T278 PolarHBondContact O-N 3.03Å; P262-T278 PolarHBondContact O-OG1 2.84Å; K264-T278 HydrophobicContact CB-CG2 3.63Å; K264-T278 HydrophobicContact CD-CG2 4.22Å
279	E	87.2	Confident	87.9	Confident	79 Å²	79	57.8 Å²	57.8	37%	0.369	31%	0.307	S	S	.	.	S	Bend	trans	-131.9	162.9	173.2	52.9	-152	159.2	0	0	107.1	K260 P262	K260-E279 IonicContact NZ-OE1 3.83Å; K260-E279 IonicContact NZ-OE2 2.69Å; P262-E279 HydrophobicContact CB-CG 3.59Å
280	D	87.9	Confident	88.1	Confident	82 Å²	82	53.7 Å²	53.7	44%	0.439	28%	0.279	S	S	.	.			trans	-67.8	152.7	173.4	-71.7	16.8	0	0	0	108.5	R219 A220	R219-D280 WeakPolarHBondContact CA-OD1 3.48Å; R219-D280 WeakPolarHBondContact CB-OD1 3.48Å; R219-D280 WeakPolarHBondContact CB-OD2 3.31Å; R219-D280 VanDerWaalsContact CG-OD2 3.29Å; R219-D280 WeakPolarHBondContact CG-OD2 3.42Å; A220-D280 WeakPolarHBondContact CB-OD1 3.29Å; A220-D280 PolarHBondContact N-OD1 3.02Å
281	L	88.9	Confident	88.4	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.063	25%	0.251	C	S	.	.			trans	-76	155.9	170.5	-69.1	-177.5	0	0	0	110.8	L213 E215 Y218 P262 F263 L277 V324	L213-L281 HydrophobicContact CB-CD1 4.09Å; L213-L281 HydrophobicContact CD1-CD1 3.69Å; E215-L281 HydrophobicContact CB-CB 4.07Å; E215-L281 VanDerWaalsContact CB-O 3.26Å; E215-L281 WeakPolarHBondContact CB-O 3.47Å; Y218-L281 HydrophobicContact CG-CD1 4.48Å; Y218-L281 PolarHBondContact O-N 2.76Å; P262-L281 HydrophobicContact CB-CD2 4.34Å; P262-L281 HydrophobicContact CG-CD2 4.04Å; F263-L281 HydrophobicContact CZ-CD1 4.47Å; F263-L281 HydrophobicContact CZ-CD2 4.02Å; L277-L281 HydrophobicContact CD2-CD1 4.36Å; L277-L281 HydrophobicContact CD2-CD2 3.65Å; L277-L281 HydrophobicContact CD2-CG 3.75Å; L281-V324 HydrophobicContact CB-CG1 4.36Å; L281-V324 HydrophobicContact CD1-CG2 4.41Å
282	D	88.3	Confident	88.6	Confident	57 Å²	57	49.4 Å²	49.4	31%	0.305	24%	0.244	S	C	.	.			trans	-161.7	112.1	-169.6	174.7	-42	0	0	0	105.7	E284 M285 E286	D282-E284 PolarHBondContact OD1-N 2.69Å; D282-M285 HydrophobicContact CB-CB 4.4Å; D282-M285 WeakPolarHBondContact OD1-CB 3.43Å; D282-M285 WeakPolarHBondContact OD1-CG 3.39Å; D282-M285 PolarHBondContact OD1-N 3.42Å; D282-M285 WeakPolarHBondContact OD2-CE 3.37Å; D282-E286 PolarHBondContact O-N 2.8Å
283	A	87.9	Confident	88.8	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-75.5	-32.2	-175.9	0	0	0	0	0	112.5	E215 M285 E286 T287 V324 D326	E215-A283 WeakPolarHBondContact OE2-CA 3.28Å; E215-A283 WeakPolarHBondContact OE2-CB 3.46Å; E215-A283 PolarHBondContact OE2-N 3Å; A283-M285 VanDerWaalsContact C-N 3.26Å; A283-M285 PolarHBondContact O-N 2.84Å; A283-E286 CarbonylContact O-C 3.54Å; A283-E286 PolarHBondContact O-N 2.81Å; A283-T287 HydrophobicContact CB-CG2 4.45Å; A283-T287 VanDerWaalsContact O-CG2 3.26Å; A283-T287 WeakPolarHBondContact O-CG2 3.4Å; A283-T287 PolarHBondContact O-N 2.82Å; A283-T287 VanDerWaalsContact O-N 3.13Å; A283-V324 HydrophobicContact CB-CB 4.35Å; A283-V324 HydrophobicContact CB-CG1 3.95Å; A283-D326 HydrophobicContact CB-CB 4.33Å
284	E	86.8	Confident	88.7	Confident	68 Å²	68	46.6 Å²	46.6	32%	0.318	23%	0.231	S	C	.	.	H	α-helix	trans	-67.9	-29.3	-176.9	-69.8	50.4	-110.5	0	0	110.5	D282 P361	D282-E284 PolarHBondContact OD1-N 2.69Å; E284-P361 HydrophobicContact CB-CB 4.38Å; E284-P361 HydrophobicContact CG-CB 3.55Å
285	M	85.7	Confident	88.6	Confident	157 Å²	157	46.6 Å²	46.6	77%	0.773	23%	0.231	S	C	*	.	H	α-helix	trans	-80.3	-47.7	166.8	-71	-159.7	-158.2	0	0	113.8	D282 A283	D282-M285 HydrophobicContact CB-CB 4.4Å; D282-M285 WeakPolarHBondContact OD1-CB 3.43Å; D282-M285 WeakPolarHBondContact OD1-CG 3.39Å; D282-M285 PolarHBondContact OD1-N 3.42Å; D282-M285 WeakPolarHBondContact OD2-CE 3.37Å; A283-M285 VanDerWaalsContact C-N 3.26Å; A283-M285 PolarHBondContact O-N 2.84Å
286	E	84.9	Confident	88.4	Confident	95 Å²	95	49.7 Å²	49.7	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-158	92.4	-177.5	-177.2	60.3	-90.4	0	0	113.8	D282 A283 R288 H289 V324	D282-E286 PolarHBondContact O-N 2.8Å; A283-E286 CarbonylContact O-C 3.54Å; A283-E286 PolarHBondContact O-N 2.81Å; E286-R288 PolarHBondContact O-N 3.16Å; E286-R288 PolarHBondContact OE1-N 3.48Å; E286-H289 WeakPolarHBondContact CG-CE1 3.4Å; E286-H289 WeakPolarHBondContact CG-ND1 3.33Å; E286-V324 WeakPolarHBondContact O-CG2 3.26Å
287	T	87.3	Confident	87.9	Confident	84 Å²	84	48.4 Å²	48.4	52%	0.515	24%	0.238	S	C	.	.	S	Bend	trans	-56.1	-19.4	176	63.8	0	0	0	0	115.6	A283 V324	A283-T287 HydrophobicContact CB-CG2 4.45Å; A283-T287 VanDerWaalsContact O-CG2 3.26Å; A283-T287 WeakPolarHBondContact O-CG2 3.4Å; A283-T287 PolarHBondContact O-N 2.82Å; A283-T287 VanDerWaalsContact O-N 3.13Å; T287-V324 PolarHBondContact O-N 2.77Å
288	R	89	Confident	86.9	Confident	80 Å²	80	50.6 Å²	50.6	30%	0.302	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	114.2	-173	-160.1	-175.2	-164.1	107.3	9.5	116.1	E286 R290 D321 I322 E323	E286-R288 PolarHBondContact O-N 3.16Å; E286-R288 PolarHBondContact OE1-N 3.48Å; R288-R290 VanDerWaalsContact NE-NH2 3.1Å; R288-D321 IonicContact CZ-OD1 3.79Å; R288-D321 IonicContact CZ-OD2 2.67Å; R288-D321 IonicContact NE-OD1 3.53Å; R288-D321 PolarHBondContact NE-OD1 3.26Å; R288-D321 IonicContact NE-OD2 2.86Å; R288-D321 IonicContact NH2-OD1 3.21Å; R288-D321 PolarHBondContact NH2-OD1 2.85Å; R288-D321 VanDerWaalsContact NH2-OD1 3.16Å; R288-D321 IonicContact NH2-OD2 2.8Å; R288-D321 PolarHBondContact NH2-OD2 2.76Å; R288-I322 CarbonylContact C-O 3.54Å; R288-I322 WeakPolarHBondContact CA-O 3.44Å; R288-I322 WeakPolarHBondContact CG-O 3.23Å; R288-E323 IonicContact NH1-OE2 3.38Å; R288-E323 PolarHBondContact NH1-OE2 2.92Å; R288-E323 IonicContact NH2-OE2 3.17Å
289	H	87.3	Confident	85.7	Confident	25 Å²	25	50.2 Å²	50.2	12%	0.116	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.5	176.1	-50	-75.6	0	0	0	112.4	F263 E286 F291 I322	F263-H289 HydrophobicContact CD2-CB 4.29Å; F263-H289 HydrophobicContact CE2-CB 3.85Å; F263-H289 AromaticContact CE2-CD2 3.49Å; F263-H289 VanDerWaalsContact CE2-CD2 3.49Å; F263-H289 WeakPolarHBondContact CE2-CD2 3.39Å; F263-H289 AromaticContact CE2-CG 3.76Å; E286-H289 WeakPolarHBondContact CG-CE1 3.4Å; E286-H289 WeakPolarHBondContact CG-ND1 3.33Å; H289-F291 HydrophobicContact CB-CE1 4.07Å; H289-I322 PolarHBondContact N-O 3.24Å; H289-I322 PolarHBondContact O-N 2.95Å
290	R	88.7	Confident	84.1	Confident	96 Å²	96	49.5 Å²	49.5	36%	0.362	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.2	172.5	-64.7	-169.3	-169.3	137.7	12.4	113	W248 R288 I320 D321	W248-R290 HydrophobicContact CB-CB 3.68Å; W248-R290 WeakPolarHBondContact CB-O 3.42Å; W248-R290 HydrophobicContact CD2-CB 4.07Å; W248-R290 HydrophobicContact CG-CB 3.68Å; R288-R290 VanDerWaalsContact NE-NH2 3.1Å; R290-I320 WeakPolarHBondContact CA-O 3.33Å; R290-D321 HydrophobicContact CG-CB 4.34Å; R290-D321 WeakPolarHBondContact CG-OD1 3.4Å; R290-D321 IonicContact CZ-OD1 2.73Å; R290-D321 IonicContact NE-OD1 3.62Å; R290-D321 PolarHBondContact NE-OD1 2.88Å; R290-D321 IonicContact NH2-OD1 3.58Å
291	F	88.6	Confident	82.2	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	172.6	177.2	41.7	-89.4	0	0	0	110.6	L245 E246 F259 F263 L275 H289 I320 I322	L245-F291 HydrophobicContact CD1-CD2 3.64Å; L245-F291 HydrophobicContact CD1-CE2 4.01Å; L245-F291 HydrophobicContact CD2-CD2 3.77Å; L245-F291 HydrophobicContact CD2-CE2 4.02Å; L245-F291 HydrophobicContact CD2-CG 4.31Å; L245-F291 HydrophobicContact CG-CD2 3.74Å; L245-F291 HydrophobicContact CG-CE2 4.35Å; L245-F291 HydrophobicContact CG-CG 4.38Å; E246-F291 WeakPolarHBondContact O-CA 3.2Å; E246-F291 VanDerWaalsContact O-CB 3.28Å; E246-F291 WeakPolarHBondContact O-CB 3.46Å; F259-F291 HydrophobicContact CE2-CB 3.78Å; F259-F291 HydrophobicContact CE2-CG 4.45Å; F259-F291 HydrophobicContact CZ-CB 3.62Å; F259-F291 AromaticContact CZ-CD1 3.91Å; F259-F291 HydrophobicContact CZ-CD1 3.91Å; F259-F291 AromaticContact CZ-CG 3.86Å; F259-F291 HydrophobicContact CZ-CG 3.86Å; F263-F291 HydrophobicContact CB-CE1 4.45Å; F263-F291 HydrophobicContact CB-CZ 4.14Å; F263-F291 AromaticContact CD2-CE1 3.62Å; F263-F291 HydrophobicContact CD2-CE1 3.62Å; F263-F291 AromaticContact CD2-CZ 3.83Å; F263-F291 HydrophobicContact CD2-CZ 3.83Å; F263-F291 HydrophobicContact CE2-CE1 4.26Å; F263-F291 HydrophobicContact CG-CE1 4.29Å; F263-F291 HydrophobicContact CG-CZ 4.08Å; L275-F291 HydrophobicContact CD1-CE2 3.65Å; L275-F291 HydrophobicContact CD1-CZ 3.51Å; L275-F291 HydrophobicContact CD2-CE2 3.98Å; L275-F291 HydrophobicContact CD2-CZ 4.43Å; L275-F291 HydrophobicContact CG-CE2 4.45Å; H289-F291 HydrophobicContact CB-CE1 4.07Å; F291-I320 HydrophobicContact CD2-CB 3.64Å; F291-I320 HydrophobicContact CD2-CG1 3.95Å; F291-I320 HydrophobicContact CD2-CG2 3.98Å; F291-I320 HydrophobicContact CE1-CG2 4.31Å; F291-I320 HydrophobicContact CE2-CB 3.5Å; F291-I320 HydrophobicContact CE2-CG1 3.84Å; F291-I320 HydrophobicContact CE2-CG2 3.3Å; F291-I320 HydrophobicContact CG-CB 4.38Å; F291-I320 HydrophobicContact CZ-CB 4.11Å; F291-I320 HydrophobicContact CZ-CG2 3.48Å; F291-I320 VanDerWaalsContact CZ-CG2 3.48Å; F291-I320 PolarHBondContact N-O 3.23Å; F291-I320 VanDerWaalsContact N-O 3.08Å; F291-I320 PolarHBondContact O-N 3.44Å; F291-I322 HydrophobicContact CE1-CD1 4.43Å; F291-I322 HydrophobicContact CZ-CD1 3.93Å
292	V	89.6	Confident	80.4	Confident	17 Å²	17	58.2 Å²	58.2	10%	0.103	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.4	-178.7	-175.9	0	0	0	0	109.5	L245 E246 W248 V294 R317 L318	L245-V292 WeakPolarHBondContact CA-O 3.34Å; E246-V292 HydrophobicContact CB-CB 4.37Å; E246-V292 PolarHBondContact N-O 2.7Å; E246-V292 PolarHBondContact O-N 2.86Å; W248-V292 HydrophobicContact CE3-CG2 3.87Å; W248-V292 HydrophobicContact CZ3-CG2 4.18Å; V292-V294 HydrophobicContact CG1-CG2 3.96Å; V292-R317 HydrophobicContact CG1-CB 3.91Å; V292-R317 HydrophobicContact CG1-CG 4.27Å; V292-L318 CarbonylContact C-O 3.6Å; V292-L318 WeakPolarHBondContact CA-O 3.26Å
293	L	91.6	Very high	78.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.9	165.7	-174.4	74.7	0	0	0	108.3	F204 L226 Y243 L245 L265 P273 L318 I320	F204-L293 HydrophobicContact CE1-CD2 3.81Å; F204-L293 WeakPolarHBondContact CE2-O 3.2Å; F204-L293 HydrophobicContact CZ-CB 4.43Å; F204-L293 HydrophobicContact CZ-CD2 3.61Å; F204-L293 HydrophobicContact CZ-CG 3.9Å; L226-L293 HydrophobicContact CB-CD2 4.26Å; L226-L293 HydrophobicContact CD1-CD1 4.2Å; L226-L293 HydrophobicContact CD1-CD2 3.93Å; L226-L293 HydrophobicContact CD1-CG 4.46Å; Y243-L293 HydrophobicContact CD1-CD1 4.4Å; Y243-L293 HydrophobicContact CD1-CD2 4.09Å; Y243-L293 HydrophobicContact CD1-CG 4.23Å; L245-L293 HydrophobicContact CD1-CB 4.3Å; L245-L293 HydrophobicContact CD1-CD1 3.82Å; L265-L293 HydrophobicContact CD1-CD1 3.72Å; L265-L293 HydrophobicContact CD2-CD1 4.06Å; P273-L293 HydrophobicContact CB-CD2 4.27Å; P273-L293 HydrophobicContact CG-CD2 4.23Å; L293-L318 HydrophobicContact CB-CB 4.32Å; L293-L318 HydrophobicContact CD2-CD2 4.21Å; L293-L318 PolarHBondContact N-O 3.06Å; L293-L318 PolarHBondContact O-N 3.12Å; L293-I320 HydrophobicContact CB-CD1 4.44Å; L293-I320 HydrophobicContact CB-CG1 4.22Å
294	V	90.7	Very high	76.8	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.6	179.1	-173.4	0	0	0	0	109.5	Y243 R244 E246 V292 E315 S316 R317	Y243-V294 CarbonylContact C-O 3.5Å; Y243-V294 WeakPolarHBondContact CA-O 3.31Å; R244-V294 HydrophobicContact CG-CB 3.91Å; R244-V294 PolarHBondContact N-O 2.88Å; R244-V294 PolarHBondContact O-N 2.94Å; E246-V294 HydrophobicContact CB-CG2 4.44Å; E246-V294 HydrophobicContact CG-CG2 3.96Å; V292-V294 HydrophobicContact CG1-CG2 3.96Å; V294-E315 HydrophobicContact CG1-CB 3.86Å; V294-E315 HydrophobicContact CG1-CG 4.32Å; V294-S316 WeakPolarHBondContact CA-O 3.5Å; V294-R317 HydrophobicContact CG1-CG 4.45Å; V294-R317 HydrophobicContact CG2-CG 4.22Å
295	A	90.8	Very high	75.1	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.1	170.4	0	0	0	0	0	109.3	P202 F204 A229 I241 N242 Y243 E315 S316	P202-A295 HydrophobicContact CB-CB 4.15Å; F204-A295 HydrophobicContact CD2-CB 4.46Å; F204-A295 HydrophobicContact CE1-CB 4.39Å; F204-A295 HydrophobicContact CE2-CB 3.68Å; F204-A295 HydrophobicContact CZ-CB 3.63Å; A229-A295 HydrophobicContact CB-CB 3.6Å; I241-A295 HydrophobicContact CG2-CB 3.8Å; N242-A295 WeakPolarHBondContact O-CA 3.49Å; Y243-A295 HydrophobicContact CD1-CB 3.97Å; Y243-A295 HydrophobicContact CE1-CB 3.78Å; A295-E315 CarbonylContact O-C 3.59Å; A295-E315 WeakPolarHBondContact O-CA 3.44Å; A295-S316 PolarHBondContact N-O 3.33Å; A295-S316 PolarHBondContact O-N 3.26Å
296	Y	87.6	Confident	73.2	Confident	65 Å²	65	67 Å²	67	26%	0.255	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	145.3	-177.3	65.5	-82.2	0	0	0	111.5	N242 R244	N242-Y296 HydrophobicContact CB-CD1 4.24Å; N242-Y296 HydrophobicContact CB-CD2 4.17Å; N242-Y296 HydrophobicContact CB-CE1 3.76Å; N242-Y296 HydrophobicContact CB-CE2 3.7Å; N242-Y296 HydrophobicContact CB-CG 4.42Å; N242-Y296 VanDerWaalsContact CB-CZ 3.46Å; N242-Y296 PolarHBondContact N-O 2.85Å; N242-Y296 WeakPolarHBondContact O-CD1 3.38Å; N242-Y296 PolarHBondContact O-N 3.08Å; R244-Y296 HydrophobicContact CB-CE1 4.05Å; R244-Y296 HydrophobicContact CG-CD1 4.27Å; R244-Y296 HydrophobicContact CG-CE1 3.94Å
297	S	78.9	Confident	71.4	Confident	12 Å²	12	65.7 Å²	65.7	8%	0.084	34%	0.335	C	S	.	.			trans	-82.6	135.5	172.6	-178.1	0	0	0	0	109.6	H238 N299	H238-S297 PolarHBondContact O-OG 2.74Å; S297-N299 VanDerWaalsContact C-N 3.32Å
298	P	69.6	Low	69.3	Low	49 Å²	49	69.3 Å²	69.3	32%	0.318	35%	0.351	S	S	.	.	S	Bend	trans	-76.6	-17.7	-179.6	29.4	-32.3	0	0	0	113.7	R240	R240-P298 HydrophobicContact CB-CG 4.36Å; R240-P298 HydrophobicContact CG-CG 4.07Å; R240-P298 WeakPolarHBondContact O-CD 3.48Å
299	N	62.1	Low	67.3	Low	71 Å²	71	68.4 Å²	68.4	38%	0.38	37%	0.367	S	S	.	.			trans	-110.4	72.5	-162.5	-73.7	-13.1	0	0	0	112	N198 E237 S297	N198-N299 PolarHBondContact ND2-O 2.68Å; N198-N299 VanDerWaalsContact ND2-O 3.12Å; E237-N299 PolarHBondContact O-ND2 3.28Å; S297-N299 VanDerWaalsContact C-N 3.32Å
300	V	53.1	Low	65.3	Low	65 Å²	65	74.6 Å²	74.6	39%	0.394	40%	0.396	S	S	.	.			trans	-126.7	90	179.2	-173.4	0	0	0	0	111.1
301	I	49.1	Very low	63.4	Low	158 Å²	158	74.6 Å²	74.6	81%	0.81	42%	0.416	S	S	*	.			trans	-127.1	-33.8	172.3	-68.2	-178	0	0	0	112.4	S303	I301-S303 PolarHBondContact O-N 2.95Å; I301-S303 PolarHBondContact O-OG 3.41Å
302	D	50.9	Low	61.9	Low	119 Å²	119	76.9 Å²	76.9	64%	0.636	43%	0.428	S	S	*	.			trans	-69.8	128	-171.7	-142.5	-44.2	0	0	0	112.3	K304	D302-K304 VanDerWaalsContact C-N 3.26Å; D302-K304 PolarHBondContact O-N 3.24Å
303	S	48.8	Very low	60.4	Low	117 Å²	117	80.4 Å²	80.4	82%	0.818	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	13.6	-164.4	-62.6	0	0	0	0	113.2	I301	I301-S303 PolarHBondContact O-N 2.95Å; I301-S303 PolarHBondContact O-OG 3.41Å
304	K	52	Low	59.3	Low	142 Å²	142	88.8 Å²	88.8	62%	0.617	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-27.3	-174.1	-68.5	177	175.6	179	0	114.5	D302 K306	D302-K304 VanDerWaalsContact C-N 3.26Å; D302-K304 PolarHBondContact O-N 3.24Å; K304-K306 PolarHBondContact O-N 3.5Å
305	N	49.9	Very low	59	Low	44 Å²	44	91.6 Å²	91.6	24%	0.235	50%	0.498	C	S	.	.			trans	-75.7	94.7	-167.7	-67.1	14	0	0	0	111.4	N198 I312	N198-N305 VanDerWaalsContact C-ND2 3.26Å; N198-N305 PolarHBondContact O-ND2 3.44Å; N305-I312 HydrophobicContact CB-CD1 4.02Å
306	K	47.2	Very low	58.9	Low	166 Å²	166	92.9 Å²	92.9	72%	0.722	51%	0.507	S	S	*	.			trans	-136.1	71.3	176.4	-87.5	-170.7	170.3	-177.9	0	110.6	K304 N308	K304-K306 PolarHBondContact O-N 3.5Å; K306-N308 PolarHBondContact O-N 3.06Å
307	L	46.4	Very low	59.1	Low	68 Å²	68	95.4 Å²	95.4	36%	0.356	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-60.7	121.5	163.3	-101.1	70.1	0	0	0	109.7	N52 D199 G309 Q310	N52-L307 HydrophobicContact CB-CD1 4.25Å; D199-L307 WeakPolarHBondContact OD2-CD1 3.3Å; D199-L307 WeakPolarHBondContact OD2-CD2 3.19Å; L307-G309 PolarHBondContact O-N 2.85Å; L307-Q310 PolarHBondContact O-N 2.77Å
308	N	44	Very low	59.7	Low	161 Å²	161	94.8 Å²	94.8	86%	0.861	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	49.2	24.3	174.3	-65	-53.5	0	0	0	116.2	K306 Q310	K306-N308 PolarHBondContact O-N 3.06Å; N308-Q310 PolarHBondContact O-N 2.95Å
309	G	47.1	Very low	60.7	Low	61 Å²	61	93.9 Å²	93.9	63%	0.629	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	69.7	4.9	-178.1	0	0	0	0	0	115.3	L307	L307-G309 PolarHBondContact O-N 2.85Å
310	Q	44.8	Very low	62.1	Low	155 Å²	155	90.5 Å²	90.5	72%	0.724	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-93.1	124.8	179.5	-168.2	163.8	-10.4	0	0	109.1	L307 N308 I312	L307-Q310 PolarHBondContact O-N 2.77Å; N308-Q310 PolarHBondContact O-N 2.95Å; Q310-I312 PolarHBondContact O-N 3.23Å
311	A	49.4	Very low	63.9	Low	95 Å²	95	87.4 Å²	87.4	79%	0.785	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-71.5	125.2	-178.4	0	0	0	0	0	110.4	S313	A311-S313 PolarHBondContact O-N 2.8Å
312	I	56.3	Low	65.9	Low	49 Å²	49	79.9 Å²	79.9	25%	0.251	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-54.8	133.5	172.2	-61.1	162.9	0	0	0	108.9	D199 N200 N305 Q310 R314	D199-I312 VanDerWaalsContact O-CD1 3.26Å; D199-I312 WeakPolarHBondContact O-CD1 3.49Å; D199-I312 WeakPolarHBondContact O-CG1 3.48Å; N200-I312 WeakPolarHBondContact O-CG2 3.36Å; N305-I312 HydrophobicContact CB-CD1 4.02Å; Q310-I312 PolarHBondContact O-N 3.23Å; I312-R314 PolarHBondContact O-N 3.39Å
313	S	57.9	Low	67.8	Low	91 Å²	91	76.4 Å²	76.4	64%	0.636	41%	0.408	S	S	*	.			trans	-73.9	93.6	178.9	-167.4	0	0	0	0	109.6	A311 E315	A311-S313 PolarHBondContact O-N 2.8Å; S313-E315 PolarHBondContact O-N 2.77Å; S313-E315 PolarHBondContact OG-O 3.4Å
314	R	69.5	Low	69.8	Low	177 Å²	177	71.2 Å²	71.2	67%	0.668	37%	0.371	S	S	*	.	S	Bend	trans	-52.2	-19.5	178.9	-62.4	179.4	175.9	-174.9	-6.8	114.4	I312	I312-R314 PolarHBondContact O-N 3.39Å
315	E	84.7	Confident	71.5	Confident	59 Å²	59	64.7 Å²	64.7	28%	0.276	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	153.3	-179	-47.1	-169	151.9	0	0	111	R244 V294 A295 S313 R317	R244-E315 IonicContact CZ-OE1 4Å; R244-E315 IonicContact CZ-OE2 3.07Å; R244-E315 IonicContact NH1-OE1 2.86Å; R244-E315 PolarHBondContact NH1-OE1 3.49Å; R244-E315 IonicContact NH1-OE2 2.89Å; R244-E315 IonicContact NH2-OE1 3.18Å; R244-E315 PolarHBondContact NH2-OE1 2.86Å; R244-E315 IonicContact NH2-OE2 3.88Å; R244-E315 PolarHBondContact NH2-OE2 2.9Å; V294-E315 HydrophobicContact CG1-CB 3.86Å; V294-E315 HydrophobicContact CG1-CG 4.32Å; A295-E315 CarbonylContact O-C 3.59Å; A295-E315 WeakPolarHBondContact O-CA 3.44Å; S313-E315 PolarHBondContact O-N 2.77Å; S313-E315 PolarHBondContact OG-O 3.4Å; E315-R317 IonicContact OE2-NH2 3.8Å; E315-R317 PolarHBondContact OE2-NH2 3.18Å
316	S	88.6	Confident	73.3	Confident	26 Å²	26	63.6 Å²	63.6	18%	0.182	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	148.4	163	179.6	0	0	0	0	109.9	P202 F204 V294 A295	P202-S316 WeakPolarHBondContact O-CB 3.14Å; F204-S316 WeakPolarHBondContact CD2-OG 3.43Å; F204-S316 WeakPolarHBondContact CE2-O 3.3Å; F204-S316 PolarHBondContact N-OG 2.9Å; V294-S316 WeakPolarHBondContact CA-O 3.5Å; A295-S316 PolarHBondContact N-O 3.33Å; A295-S316 PolarHBondContact O-N 3.26Å
317	R	90.9	Very high	75.1	Confident	118 Å²	118	58.6 Å²	58.6	45%	0.445	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	136.6	-169.1	-65	-178.3	166.5	-98.2	-22	110.3	E246 V292 V294 E315	E246-R317 IonicContact OE1-NH2 2.74Å; E246-R317 PolarHBondContact OE1-NH2 2.84Å; E246-R317 IonicContact OE2-CZ 3.27Å; E246-R317 IonicContact OE2-NH1 2.81Å; E246-R317 PolarHBondContact OE2-NH1 3.03Å; E246-R317 IonicContact OE2-NH2 3.03Å; E246-R317 PolarHBondContact OE2-NH2 2.74Å; V292-R317 HydrophobicContact CG1-CB 3.91Å; V292-R317 HydrophobicContact CG1-CG 4.27Å; V294-R317 HydrophobicContact CG1-CG 4.45Å; V294-R317 HydrophobicContact CG2-CG 4.22Å; E315-R317 IonicContact OE2-NH2 3.8Å; E315-R317 PolarHBondContact OE2-NH2 3.18Å
318	L	91.9	Very high	77	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.7	176.6	169.4	66.4	0	0	0	109.1	F204 Q206 W209 P227 V292 L293 I320	F204-L318 HydrophobicContact CD1-CB 4.31Å; F204-L318 HydrophobicContact CD1-CD2 4.14Å; F204-L318 HydrophobicContact CD2-CB 3.63Å; F204-L318 HydrophobicContact CE1-CB 4.35Å; F204-L318 HydrophobicContact CE1-CD2 4.11Å; F204-L318 HydrophobicContact CE2-CB 3.68Å; F204-L318 HydrophobicContact CG-CB 3.96Å; F204-L318 HydrophobicContact CZ-CB 4.05Å; F204-L318 HydrophobicContact CZ-CD2 4.48Å; Q206-L318 HydrophobicContact CG-CD1 3.84Å; Q206-L318 WeakPolarHBondContact O-CD1 3.5Å; W209-L318 HydrophobicContact CB-CD1 4.06Å; W209-L318 HydrophobicContact CB-CD2 4.44Å; P227-L318 HydrophobicContact CB-CD2 3.99Å; P227-L318 HydrophobicContact CG-CD2 3.78Å; V292-L318 CarbonylContact C-O 3.6Å; V292-L318 WeakPolarHBondContact CA-O 3.26Å; L293-L318 HydrophobicContact CB-CB 4.32Å; L293-L318 HydrophobicContact CD2-CD2 4.21Å; L293-L318 PolarHBondContact N-O 3.06Å; L293-L318 PolarHBondContact O-N 3.12Å; L318-I320 HydrophobicContact CD2-CD1 3.79Å; L318-I320 HydrophobicContact CG-CD1 3.86Å; L318-I320 PolarHBondContact O-N 2.9Å
319	E	91.1	Very high	79	Confident	29 Å²	29	53.1 Å²	53.1	14%	0.136	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	128.6	168.7	171.2	178.5	-171	0	0	109.8	I207 R208 W209 W248	I207-E319 PolarHBondContact O-N 3.21Å; R208-E319 CarbonylContact C-O 3.59Å; R208-E319 WeakPolarHBondContact CA-O 3.48Å; R208-E319 HydrophobicContact CB-CB 4.04Å; R208-E319 HydrophobicContact CB-CG 4.35Å; R208-E319 WeakPolarHBondContact CD-OE2 3.26Å; R208-E319 HydrophobicContact CG-CB 4.07Å; R208-E319 HydrophobicContact CG-CG 3.83Å; R208-E319 WeakPolarHBondContact CG-OE2 3.22Å; R208-E319 IonicContact CZ-OE1 2.68Å; R208-E319 IonicContact CZ-OE2 3.44Å; R208-E319 IonicContact NE-OE1 3.19Å; R208-E319 PolarHBondContact NE-OE1 3.4Å; R208-E319 IonicContact NE-OE2 3.08Å; R208-E319 VanDerWaalsContact NH1-CD 3.29Å; R208-E319 IonicContact NH1-OE1 3.32Å; R208-E319 PolarHBondContact NH1-OE1 2.92Å; R208-E319 IonicContact NH1-OE2 2.92Å; R208-E319 PolarHBondContact NH1-OE2 2.8Å; R208-E319 VanDerWaalsContact NH1-OE2 3.14Å; R208-E319 IonicContact NH2-OE1 3.68Å; W209-E319 PolarHBondContact N-O 3.22Å; W248-E319 HydrophobicContact CE3-CG 4.17Å; W248-E319 HydrophobicContact CH2-CB 4.27Å; W248-E319 HydrophobicContact CH2-CG 3.76Å; W248-E319 WeakPolarHBondContact CH2-OE1 3.43Å; W248-E319 HydrophobicContact CZ3-CB 3.72Å; W248-E319 HydrophobicContact CZ3-CG 3.36Å
320	I	91.2	Very high	80.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.9	168.2	-52.8	-59.4	0	0	0	108.2	W209 L226 L275 R290 F291 L293 L318 I322	W209-I320 HydrophobicContact CB-CD1 4.04Å; W209-I320 HydrophobicContact CD2-CD1 4.46Å; W209-I320 HydrophobicContact CE3-CD1 4.13Å; W209-I320 HydrophobicContact CE3-CG2 3.92Å; W209-I320 HydrophobicContact CG-CD1 4.5Å; W209-I320 HydrophobicContact CZ3-CG2 4.07Å; W209-I320 WeakPolarHBondContact O-CA 3.29Å; L226-I320 HydrophobicContact CD1-CD1 4.06Å; L226-I320 HydrophobicContact CD1-CG1 4.34Å; L226-I320 HydrophobicContact CD2-CD1 3.94Å; L275-I320 HydrophobicContact CD1-CG2 4.47Å; R290-I320 WeakPolarHBondContact CA-O 3.33Å; F291-I320 HydrophobicContact CD2-CB 3.64Å; F291-I320 HydrophobicContact CD2-CG1 3.95Å; F291-I320 HydrophobicContact CD2-CG2 3.98Å; F291-I320 HydrophobicContact CE1-CG2 4.31Å; F291-I320 HydrophobicContact CE2-CB 3.5Å; F291-I320 HydrophobicContact CE2-CG1 3.84Å; F291-I320 HydrophobicContact CE2-CG2 3.3Å; F291-I320 HydrophobicContact CG-CB 4.38Å; F291-I320 HydrophobicContact CZ-CB 4.11Å; F291-I320 HydrophobicContact CZ-CG2 3.48Å; F291-I320 VanDerWaalsContact CZ-CG2 3.48Å; F291-I320 PolarHBondContact N-O 3.23Å; F291-I320 VanDerWaalsContact N-O 3.08Å; F291-I320 PolarHBondContact O-N 3.44Å; L293-I320 HydrophobicContact CB-CD1 4.44Å; L293-I320 HydrophobicContact CB-CG1 4.22Å; L318-I320 HydrophobicContact CD2-CD1 3.79Å; L318-I320 HydrophobicContact CG-CD1 3.86Å; L318-I320 PolarHBondContact O-N 2.9Å; I320-I322 HydrophobicContact CG2-CD1 4.19Å; I320-I322 HydrophobicContact CG2-CG1 4.07Å
321	D	91.1	Very high	82.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	97.1	-177.6	173.7	64.7	0	0	0	109.5	R208 W209 H210 K211 R288 R290	R208-D321 IonicContact CZ-OD2 3.97Å; R208-D321 IonicContact NE-OD2 2.7Å; R208-D321 VanDerWaalsContact NH2-CG 3.27Å; R208-D321 IonicContact NH2-OD1 3.67Å; R208-D321 IonicContact NH2-OD2 3.78Å; R208-D321 PolarHBondContact NH2-OD2 3.5Å; W209-D321 PolarHBondContact O-N 3.14Å; H210-D321 VanDerWaalsContact CA-O 3.25Å; H210-D321 WeakPolarHBondContact CA-O 3.43Å; H210-D321 HydrophobicContact CB-CB 4.49Å; H210-D321 IonicContact CE1-OD2 3.71Å; H210-D321 IonicContact CG-OD2 2.72Å; H210-D321 PolarHBondContact ND1-O 2.85Å; H210-D321 IonicContact ND1-OD2 3.84Å; H210-D321 PolarHBondContact ND1-OD2 2.86Å; K211-D321 PolarHBondContact N-O 2.73Å; R288-D321 IonicContact CZ-OD1 3.79Å; R288-D321 IonicContact CZ-OD2 2.67Å; R288-D321 IonicContact NE-OD1 3.53Å; R288-D321 PolarHBondContact NE-OD1 3.26Å; R288-D321 IonicContact NE-OD2 2.86Å; R288-D321 IonicContact NH2-OD1 3.21Å; R288-D321 PolarHBondContact NH2-OD1 2.85Å; R288-D321 VanDerWaalsContact NH2-OD1 3.16Å; R288-D321 IonicContact NH2-OD2 2.8Å; R288-D321 PolarHBondContact NH2-OD2 2.76Å; R290-D321 HydrophobicContact CG-CB 4.34Å; R290-D321 WeakPolarHBondContact CG-OD1 3.4Å; R290-D321 IonicContact CZ-OD1 2.73Å; R290-D321 IonicContact NE-OD1 3.62Å; R290-D321 PolarHBondContact NE-OD1 2.88Å; R290-D321 IonicContact NH2-OD1 3.58Å
322	I	91	Very high	84.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	132	-179.1	-66.1	175.5	0	0	0	109.3	W209 K211 L213 F263 L275 R288 H289 F291 I320	W209-I322 HydrophobicContact CZ3-CD1 4.37Å; W209-I322 HydrophobicContact CZ3-CG1 4.09Å; K211-I322 WeakPolarHBondContact O-CA 3.37Å; L213-I322 HydrophobicContact CD1-CG2 3.52Å; L213-I322 HydrophobicContact CG-CG2 3.97Å; F263-I322 HydrophobicContact CD1-CD1 4.33Å; F263-I322 HydrophobicContact CD2-CD1 4.21Å; F263-I322 HydrophobicContact CE1-CD1 3.87Å; F263-I322 HydrophobicContact CE2-CB 4.49Å; F263-I322 HydrophobicContact CE2-CD1 3.73Å; F263-I322 HydrophobicContact CE2-CG2 4.33Å; F263-I322 HydrophobicContact CG-CD1 4.49Å; F263-I322 HydrophobicContact CZ-CD1 3.55Å; F263-I322 HydrophobicContact CZ-CG2 4Å; L275-I322 HydrophobicContact CD1-CD1 3.91Å; R288-I322 CarbonylContact C-O 3.54Å; R288-I322 WeakPolarHBondContact CA-O 3.44Å; R288-I322 WeakPolarHBondContact CG-O 3.23Å; H289-I322 PolarHBondContact N-O 3.24Å; H289-I322 PolarHBondContact O-N 2.95Å; F291-I322 HydrophobicContact CE1-CD1 4.43Å; F291-I322 HydrophobicContact CZ-CD1 3.93Å; I320-I322 HydrophobicContact CG2-CD1 4.19Å; I320-I322 HydrophobicContact CG2-CG1 4.07Å
323	E	90.6	Very high	86.6	Confident	47 Å²	47	49.5 Å²	49.5	22%	0.22	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.8	176.1	-174.4	179.5	125.8	0	0	108.9	H210 K211 R212 L213 R288	H210-E323 IonicContact CE1-OE2 2.69Å; K211-E323 PolarHBondContact O-N 2.85Å; R212-E323 CarbonylContact C-O 3.59Å; R212-E323 VanDerWaalsContact CA-O 3.29Å; R212-E323 WeakPolarHBondContact CA-O 3.38Å; R212-E323 HydrophobicContact CB-CB 4.5Å; R212-E323 WeakPolarHBondContact CD-OE1 3.17Å; R212-E323 HydrophobicContact CG-CB 4.21Å; R212-E323 HydrophobicContact CG-CG 4.22Å; R212-E323 IonicContact CZ-OE1 2.69Å; R212-E323 IonicContact NE-OE1 2.66Å; R212-E323 PolarHBondContact NE-OE1 2.53Å; R212-E323 IonicContact NH2-OE1 2.96Å; L213-E323 PolarHBondContact N-O 3.12Å; R288-E323 IonicContact NH1-OE2 3.38Å; R288-E323 PolarHBondContact NH1-OE2 2.92Å; R288-E323 IonicContact NH2-OE2 3.17Å
324	V	90.4	Very high	88.2	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	137.6	171.2	-164.9	0	0	0	0	107.6	L213 E215 L281 A283 E286 T287	L213-V324 CarbonylContact O-C 3.38Å; E215-V324 HydrophobicContact CB-CG1 4.36Å; L281-V324 HydrophobicContact CB-CG1 4.36Å; L281-V324 HydrophobicContact CD1-CG2 4.41Å; A283-V324 HydrophobicContact CB-CB 4.35Å; A283-V324 HydrophobicContact CB-CG1 3.95Å; E286-V324 WeakPolarHBondContact O-CG2 3.26Å; T287-V324 PolarHBondContact O-N 2.77Å
325	A	87.1	Confident	89	Confident	6 Å²	6	40.5 Å²	40.5	5%	0.05	19%	0.194	C	C	.	.			trans	-122.1	94.6	-177.3	0	0	0	0	0	109.1	R212 L213 K214 E215	R212-A325 HydrophobicContact CG-CB 3.92Å; L213-A325 VanDerWaalsContact O-CB 3.31Å; L213-A325 WeakPolarHBondContact O-CB 2.95Å; L213-A325 PolarHBondContact O-N 2.8Å; K214-A325 WeakPolarHBondContact CA-O 3.03Å; K214-A325 HydrophobicContact CG-CB 4.4Å; E215-A325 VanDerWaalsContact OE1-O 3.06Å
326	D	87.6	Confident	89.2	Confident	20 Å²	20	43.6 Å²	43.6	11%	0.107	21%	0.207	C	C	.	.			trans	-15	133	160.3	178.5	-32.2	0	0	0	114.4	E215 A283 S363 T364	E215-D326 VanDerWaalsContact OE1-CA 3.3Å; E215-D326 WeakPolarHBondContact OE1-CA 3.5Å; E215-D326 PolarHBondContact OE1-N 3.41Å; A283-D326 HydrophobicContact CB-CB 4.33Å; D326-S363 VanDerWaalsContact OD2-C 3.3Å; D326-S363 WeakPolarHBondContact OD2-CA 3.37Å; D326-S363 VanDerWaalsContact OD2-CB 3.23Å; D326-S363 WeakPolarHBondContact OD2-CB 3.31Å; D326-S363 PolarHBondContact OD2-N 2.74Å; D326-S363 PolarHBondContact OD2-OG 3.49Å; D326-T364 HydrophobicContact CB-CG2 4.17Å; D326-T364 VanDerWaalsContact OD1-CB 3.3Å; D326-T364 WeakPolarHBondContact OD1-CB 3.39Å; D326-T364 WeakPolarHBondContact OD1-CG2 3.37Å; D326-T364 PolarHBondContact OD1-OG1 2.71Å; D326-T364 PolarHBondContact OD2-N 2.77Å
327	M	85.3	Confident	89.1	Confident	62 Å²	62	48.6 Å²	48.6	31%	0.305	24%	0.236	S	C	.	.			trans	-140.7	118.4	177.6	-75.3	-72.7	-39.5	0	0	106.4	K214 E215 A216 D329	K214-M327 HydrophobicContact CB-CG 4.1Å; K214-M327 HydrophobicContact CB-SD 4.46Å; K214-M327 HydrophobicContact CD-SD 3.83Å; K214-M327 HydrophobicContact CG-CG 4.37Å; K214-M327 HydrophobicContact CG-SD 4.26Å; K214-M327 PolarHBondContact NZ-SD 3.26Å; E215-M327 HydrophobicContact CG-CB 4.49Å; E215-M327 WeakPolarHBondContact OE1-CB 3.38Å; E215-M327 WeakPolarHBondContact OE1-CG 3.47Å; E215-M327 PolarHBondContact OE1-N 3.31Å; A216-M327 HydrophobicContact CB-CG 4.46Å; M327-D329 PolarHBondContact O-N 3.26Å
328	N	86.1	Confident	89.1	Confident	28 Å²	28	46.2 Å²	46.2	15%	0.15	24%	0.235	C	C	.	.			trans	-50.1	100.1	176.4	-156.4	126.7	0	0	0	111.1	D362 T364 D414 F417	N328-D362 WeakPolarHBondContact CA-OD2 3.24Å; N328-T364 PolarHBondContact N-OG1 3.28Å; N328-D414 PolarHBondContact ND2-OD2 3.13Å; N328-F417 WeakPolarHBondContact ND2-CD2 3.33Å
329	D	85.5	Confident	89.1	Confident	86 Å²	86	46.6 Å²	46.6	46%	0.46	24%	0.236	S	C	.	.			trans	-139.8	-5.8	-176.6	98	-2.8	0	0	0	114.4	M327 D362	M327-D329 PolarHBondContact O-N 3.26Å; D329-D362 PolarHBondContact N-OD2 3.49Å
330	N	86.2	Confident	89.1	Confident	48 Å²	48	50.7 Å²	50.7	26%	0.257	26%	0.259	S	S	.	.	S	Bend	trans	-89	161.1	161.3	-68.5	-82.1	0	0	0	111.3	P361 D362 F417	N330-P361 HydrophobicContact CB-CB 4.32Å; N330-P361 HydrophobicContact CB-CG 3.81Å; N330-D362 WeakPolarHBondContact CB-OD1 2.98Å; N330-D362 PolarHBondContact N-OD2 2.79Å; N330-D362 PolarHBondContact ND2-OD1 2.86Å; N330-F417 WeakPolarHBondContact O-CD2 3.32Å; N330-F417 WeakPolarHBondContact O-CE2 3.3Å
331	E	88.2	Confident	89.2	Confident	89 Å²	89	51.6 Å²	51.6	42%	0.416	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-100.3	143.5	174.5	72.9	-170	169.3	0	0	110.5	R333 F417	E331-R333 HydrophobicContact CG-CG 4.02Å; E331-R333 IonicContact OE1-CZ 2.91Å; E331-R333 IonicContact OE1-NE 3.71Å; E331-R333 PolarHBondContact OE1-NE 3.4Å; E331-R333 IonicContact OE1-NH2 4Å; E331-R333 PolarHBondContact OE1-NH2 3.32Å; E331-F417 HydrophobicContact CB-CB 4.31Å
332	P	92.7	Very high	89.3	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-68.1	135.2	175.6	27.4	-35.2	0	0	0	110.8	L367 V412 A419	P332-L367 HydrophobicContact CB-CD2 3.57Å; P332-L367 HydrophobicContact CG-CD2 4.42Å; P332-V412 HydrophobicContact CB-CG1 4.14Å; P332-V412 HydrophobicContact CG-CG1 4.28Å; P332-A419 WeakPolarHBondContact O-CB 3.18Å
333	R	91.1	Very high	89.5	Confident	147 Å²	147	55.5 Å²	55.5	56%	0.555	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	119.8	-173	-73.6	174.8	174.5	156.5	3	113	E331 A358 H359	E331-R333 HydrophobicContact CG-CG 4.02Å; E331-R333 IonicContact OE1-CZ 2.91Å; E331-R333 IonicContact OE1-NE 3.71Å; E331-R333 PolarHBondContact OE1-NE 3.4Å; E331-R333 IonicContact OE1-NH2 4Å; E331-R333 PolarHBondContact OE1-NH2 3.32Å; R333-A358 CarbonylContact O-C 3.53Å; R333-A358 WeakPolarHBondContact O-CA 3.39Å; R333-H359 PolarHBondContact N-O 2.95Å; R333-H359 PolarHBondContact O-N 2.96Å
334	F	91.1	Very high	89.5	Confident	28 Å²	28	54.7 Å²	54.7	12%	0.123	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	142.9	170.9	-71.4	-72.6	0	0	0	112.1	F336 Y339 A358 Y369 V410 V412 A419 T421	F334-F336 WeakPolarHBondContact CB-O 3.43Å; F334-F336 PolarHBondContact O-N 3.06Å; F334-Y339 HydrophobicContact CB-CE2 4.14Å; F334-Y339 HydrophobicContact CD1-CE2 4.08Å; F334-Y339 HydrophobicContact CG-CE2 4.33Å; F334-A358 HydrophobicContact CD1-CB 3.99Å; F334-A358 HydrophobicContact CE1-CB 4.3Å; F334-A358 HydrophobicContact CG-CB 4.41Å; F334-Y369 HydrophobicContact CE1-CD1 4.04Å; F334-Y369 AromaticContact CE1-CE1 3.9Å; F334-Y369 HydrophobicContact CE1-CE1 3.9Å; F334-Y369 HydrophobicContact CZ-CD1 4.47Å; F334-V410 HydrophobicContact CE1-CG1 4.14Å; F334-V410 HydrophobicContact CZ-CB 4.49Å; F334-V410 HydrophobicContact CZ-CG1 3.82Å; F334-V412 HydrophobicContact CD2-CG1 4.16Å; F334-V412 HydrophobicContact CE1-CB 4.19Å; F334-V412 HydrophobicContact CE1-CG1 4.11Å; F334-V412 HydrophobicContact CE2-CB 4.14Å; F334-V412 HydrophobicContact CE2-CG1 3.5Å; F334-V412 VanDerWaalsContact CE2-CG1 3.5Å; F334-V412 HydrophobicContact CZ-CB 3.61Å; F334-V412 HydrophobicContact CZ-CG1 3.46Å; F334-V412 VanDerWaalsContact CZ-CG1 3.46Å; F334-A419 HydrophobicContact CD2-CB 4.43Å; F334-A419 HydrophobicContact CE2-CB 4.46Å; F334-T421 HydrophobicContact CB-CG2 4.48Å; F334-T421 HydrophobicContact CD1-CG2 3.68Å; F334-T421 HydrophobicContact CD2-CG2 3.6Å; F334-T421 HydrophobicContact CE1-CG2 3.63Å; F334-T421 HydrophobicContact CE2-CG2 3.55Å; F334-T421 HydrophobicContact CG-CG2 3.65Å; F334-T421 HydrophobicContact CZ-CG2 3.57Å
335	S	87.2	Confident	89.6	Confident	50 Å²	50	54.8 Å²	54.8	35%	0.35	29%	0.292	S	S	.	.	S	Bend	trans	-62.6	-25.4	175	-41.1	0	0	0	0	113.2	Y339 V357 H359	S335-Y339 PolarHBondContact N-OH 2.78Å; S335-Y339 VanDerWaalsContact N-OH 3.12Å; S335-V357 PolarHBondContact N-O 2.69Å; S335-V357 PolarHBondContact OG-O 2.81Å; S335-H359 PolarHBondContact OG-NE2 3Å
336	F	87.7	Confident	89.8	Confident	125 Å²	125	59.4 Å²	59.4	55%	0.548	32%	0.316	S	S	.	.			trans	-137.1	146.9	177.8	-57.9	-85.2	0	0	0	112.7	F334 V338 Y339 T421	F334-F336 WeakPolarHBondContact CB-O 3.43Å; F334-F336 PolarHBondContact O-N 3.06Å; F336-V338 VanDerWaalsContact C-N 3.34Å; F336-Y339 HydrophobicContact CB-CD1 4.37Å; F336-Y339 HydrophobicContact CB-CD2 4.38Å; F336-Y339 HydrophobicContact CB-CE1 4.1Å; F336-Y339 HydrophobicContact CB-CE2 4.07Å; F336-Y339 HydrophobicContact CD2-CD1 4.11Å; F336-Y339 AromaticContact CD2-CE1 3.55Å; F336-Y339 HydrophobicContact CD2-CE1 3.55Å; F336-Y339 AromaticContact CD2-CZ 3.99Å; F336-Y339 HydrophobicContact CE2-CE1 4.48Å; F336-Y339 HydrophobicContact CG-CE1 4.29Å; F336-Y339 PolarHBondContact N-OH 2.58Å; F336-Y339 VanDerWaalsContact O-CE2 3.24Å; F336-Y339 WeakPolarHBondContact O-CE2 3.48Å; F336-T421 PolarHBondContact O-OG1 3.11Å; F336-T421 VanDerWaalsContact O-OG1 3.05Å
337	T	86.6	Confident	90	Very high	131 Å²	131	60 Å²	60	80%	0.804	32%	0.32	S	S	*	.	S	Bend	trans	-74.7	-23.7	176.7	49.9	0	0	0	0	113.6	T421	T337-T421 VanDerWaalsContact C-OG1 3.31Å; T337-T421 PolarHBondContact O-OG1 2.73Å; T337-T421 VanDerWaalsContact O-OG1 3.09Å
338	V	91	Very high	90.3	Very high	67 Å²	67	60.7 Å²	60.7	41%	0.406	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	132.1	172.1	-179.5	0	0	0	0	107.3	F336 T422 N424	F336-V338 VanDerWaalsContact C-N 3.34Å; V338-T422 WeakPolarHBondContact CA-O 3.16Å; V338-N424 WeakPolarHBondContact CG1-ND2 3.32Å
339	Y	91.9	Very high	90.6	Very high	8 Å²	8	63.5 Å²	63.5	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.4	171.7	-65.6	-97.6	0	0	0	108.6	F334 S335 F336 Y354 L356 V357 T421 T422 L423 N424	F334-Y339 HydrophobicContact CB-CE2 4.14Å; F334-Y339 HydrophobicContact CD1-CE2 4.08Å; F334-Y339 HydrophobicContact CG-CE2 4.33Å; S335-Y339 PolarHBondContact N-OH 2.78Å; S335-Y339 VanDerWaalsContact N-OH 3.12Å; F336-Y339 HydrophobicContact CB-CD1 4.37Å; F336-Y339 HydrophobicContact CB-CD2 4.38Å; F336-Y339 HydrophobicContact CB-CE1 4.1Å; F336-Y339 HydrophobicContact CB-CE2 4.07Å; F336-Y339 HydrophobicContact CD2-CD1 4.11Å; F336-Y339 AromaticContact CD2-CE1 3.55Å; F336-Y339 HydrophobicContact CD2-CE1 3.55Å; F336-Y339 AromaticContact CD2-CZ 3.99Å; F336-Y339 HydrophobicContact CE2-CE1 4.48Å; F336-Y339 HydrophobicContact CG-CE1 4.29Å; F336-Y339 PolarHBondContact N-OH 2.58Å; F336-Y339 VanDerWaalsContact O-CE2 3.24Å; F336-Y339 WeakPolarHBondContact O-CE2 3.48Å; Y339-Y354 AromaticContact CD1-CE1 3.47Å; Y339-Y354 HydrophobicContact CD1-CE1 3.47Å; Y339-Y354 VanDerWaalsContact CD1-CE1 3.47Å; Y339-Y354 AromaticContact CD1-CZ 3.88Å; Y339-Y354 WeakPolarHBondContact CD1-OH 3.48Å; Y339-Y354 HydrophobicContact CE1-CE1 4.03Å; Y339-Y354 HydrophobicContact CG-CE1 4.21Å; Y339-L356 HydrophobicContact CD2-CD2 4.44Å; Y339-V357 PolarHBondContact OH-O 3.01Å; Y339-T421 HydrophobicContact CD2-CG2 3.9Å; Y339-T421 HydrophobicContact CE2-CG2 3.76Å; Y339-T422 PolarHBondContact N-O 3.11Å; Y339-L423 CarbonylContact O-C 3.52Å; Y339-L423 WeakPolarHBondContact O-CA 3.33Å; Y339-N424 PolarHBondContact O-N 2.77Å
340	N	92.3	Very high	90.8	Very high	115 Å²	115	61.2 Å²	61.2	62%	0.615	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.6	176.9	-64.1	-31.6	0	0	0	108.9	N424	N340-N424 WeakPolarHBondContact CA-O 3.4Å; N340-N424 WeakPolarHBondContact OD1-CB 3.43Å; N340-N424 PolarHBondContact OD1-ND2 3.47Å
341	I	93.4	Very high	91.1	Very high	19 Å²	19	61.4 Å²	61.4	10%	0.097	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	160.8	175.2	69.2	173.1	0	0	0	110.8	V343 I353 Y354 L423 N424 V425 Q426	I341-V343 HydrophobicContact CD1-CG2 3.75Å; I341-V343 HydrophobicContact CG1-CG2 4.12Å; I341-I353 HydrophobicContact CD1-CB 4.23Å; I341-I353 HydrophobicContact CD1-CD1 4Å; I341-I353 HydrophobicContact CD1-CG1 4.07Å; I341-Y354 HydrophobicContact CG2-CD2 3.36Å; I341-Y354 HydrophobicContact CG2-CE2 3.59Å; I341-Y354 HydrophobicContact CG2-CG 3.91Å; I341-L423 HydrophobicContact CD1-CD1 4.21Å; I341-L423 HydrophobicContact CG1-CD1 4.08Å; I341-L423 HydrophobicContact CG2-CD1 3.91Å; I341-N424 PolarHBondContact N-O 2.9Å; I341-V425 HydrophobicContact CD1-CB 4.48Å; I341-V425 HydrophobicContact CD1-CG1 4.19Å; I341-V425 HydrophobicContact CD1-CG2 3.91Å; I341-V425 HydrophobicContact CG1-CB 4.21Å; I341-V425 HydrophobicContact CG1-CG1 4.1Å; I341-V425 HydrophobicContact CG1-CG2 4.01Å; I341-Q426 PolarHBondContact O-N 2.77Å
342	S	93.3	Very high	91.4	Very high	71 Å²	71	60.2 Å²	60.2	50%	0.497	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.9	174.1	-51.5	0	0	0	0	109.4	Q426	S342-Q426 CarbonylContact C-O 3.54Å; S342-Q426 VanDerWaalsContact CA-O 3.28Å; S342-Q426 WeakPolarHBondContact CA-O 3.3Å
343	V	93.9	Very high	91.4	Very high	12 Å²	12	61.5 Å²	61.5	7%	0.073	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124.7	-172.3	-178.7	0	0	0	0	109	I341 T347 I353 L398 V425 Q426 V427 L428	I341-V343 HydrophobicContact CD1-CG2 3.75Å; I341-V343 HydrophobicContact CG1-CG2 4.12Å; V343-T347 HydrophobicContact CG1-CG2 4.15Å; V343-T347 WeakPolarHBondContact CG1-OG1 3.49Å; V343-I353 HydrophobicContact CG1-CG2 4.06Å; V343-I353 HydrophobicContact CG2-CB 4.08Å; V343-I353 HydrophobicContact CG2-CD1 4.48Å; V343-I353 HydrophobicContact CG2-CG2 4.25Å; V343-L398 HydrophobicContact CB-CD1 4.13Å; V343-L398 HydrophobicContact CG1-CD1 3.69Å; V343-V425 HydrophobicContact CB-CG1 4.15Å; V343-V425 HydrophobicContact CG2-CG1 3.84Å; V343-Q426 PolarHBondContact N-O 2.79Å; V343-V427 CarbonylContact O-C 3.5Å; V343-V427 WeakPolarHBondContact O-CA 3.38Å; V343-L428 PolarHBondContact O-N 2.84Å
344	A	91.5	Very high	91.5	Very high	30 Å²	30	58.1 Å²	58.1	25%	0.248	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	139.6	175.4	0	0	0	0	0	110.8	N346 T347 L428 V430	A344-N346 VanDerWaalsContact C-N 3.32Å; A344-N346 PolarHBondContact O-N 2.79Å; A344-T347 WeakPolarHBondContact O-CB 3.39Å; A344-T347 PolarHBondContact O-N 2.81Å; A344-T347 PolarHBondContact O-OG1 2.74Å; A344-L428 WeakPolarHBondContact CA-O 3.46Å; A344-V430 HydrophobicContact CB-CG2 3.95Å
345	E	92.6	Very high	91.6	Very high	9 Å²	9	62.5 Å²	62.5	4%	0.042	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-37.2	-172.7	68.9	-154.7	101.6	0	0	114	T347 L398 Y400 V427 L428 D429 V430	E345-T347 PolarHBondContact O-N 2.69Å; E345-L398 HydrophobicContact CB-CB 4.03Å; E345-Y400 WeakPolarHBondContact OE1-CB 3.43Å; E345-Y400 WeakPolarHBondContact OE2-CB 3.21Å; E345-Y400 PolarHBondContact OE2-N 3.18Å; E345-V427 HydrophobicContact CB-CG1 3.67Å; E345-L428 PolarHBondContact N-O 3.46Å; E345-L428 VanDerWaalsContact N-O 3.11Å; E345-D429 WeakPolarHBondContact OE1-CA 3.28Å; E345-V430 HydrophobicContact CG-CB 4.38Å; E345-V430 PolarHBondContact OE1-N 3.38Å
346	N	89.6	Confident	91.8	Very high	102 Å²	102	60.2 Å²	60.2	55%	0.545	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	7.9	174.1	75	-3.2	0	0	0	114.6	A344 S348	A344-N346 VanDerWaalsContact C-N 3.32Å; A344-N346 PolarHBondContact O-N 2.79Å; N346-S348 PolarHBondContact O-N 3.02Å
347	T	92.7	Very high	92	Very high	32 Å²	32	56.7 Å²	56.7	20%	0.196	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-58.6	127.9	172.6	-65.2	0	0	0	0	110	V343 A344 E345 T351 I353 L394	V343-T347 HydrophobicContact CG1-CG2 4.15Å; V343-T347 WeakPolarHBondContact CG1-OG1 3.49Å; A344-T347 WeakPolarHBondContact O-CB 3.39Å; A344-T347 PolarHBondContact O-N 2.81Å; A344-T347 PolarHBondContact O-OG1 2.74Å; E345-T347 PolarHBondContact O-N 2.69Å; T347-T351 HydrophobicContact CG2-CG2 3.81Å; T347-I353 HydrophobicContact CG2-CG2 4.42Å; T347-L394 HydrophobicContact CG2-CD2 3.88Å; T347-L394 VanDerWaalsContact O-CD2 3.23Å; T347-L394 WeakPolarHBondContact O-CD2 3.45Å
348	S	91.4	Very high	92.2	Very high	78 Å²	78	50.9 Å²	50.9	55%	0.545	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-65.1	136.7	-175.7	54.4	0	0	0	0	113.2	N346 G350 T351	N346-S348 PolarHBondContact O-N 3.02Å; S348-G350 PolarHBondContact O-N 3.36Å; S348-T351 WeakPolarHBondContact O-CB 3.39Å; S348-T351 PolarHBondContact O-N 3.04Å; S348-T351 VanDerWaalsContact O-N 3.14Å; S348-T351 PolarHBondContact O-OG1 2.87Å; S348-T351 PolarHBondContact OG-OG1 3Å
349	V	91.8	Very high	92.1	Very high	87 Å²	87	53 Å²	53	53%	0.527	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	135.1	172.7	-175.8	0	0	0	0	110.8	H395	V349-H395 VanDerWaalsContact CG1-O 3.23Å; V349-H395 WeakPolarHBondContact CG1-O 3.49Å
350	G	90.3	Very high	92.1	Very high	38 Å²	38	54.1 Å²	54.1	39%	0.392	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	-10.4	-174.9	0	0	0	0	0	114.7	S348 L394	S348-G350 PolarHBondContact O-N 3.36Å; G350-L394 WeakPolarHBondContact CA-O 3.02Å; G350-L394 PolarHBondContact N-O 2.66Å
351	T	92.3	Very high	91.9	Very high	51 Å²	51	52 Å²	52	31%	0.313	31%	0.305	S	S	.	.			trans	-65.4	135.7	174.6	-70.4	0	0	0	0	111.6	T347 S348 I353 R393 L394	T347-T351 HydrophobicContact CG2-CG2 3.81Å; S348-T351 WeakPolarHBondContact O-CB 3.39Å; S348-T351 PolarHBondContact O-N 3.04Å; S348-T351 VanDerWaalsContact O-N 3.14Å; S348-T351 PolarHBondContact O-OG1 2.87Å; S348-T351 PolarHBondContact OG-OG1 3Å; T351-I353 HydrophobicContact CG2-CG2 4.45Å; T351-I353 PolarHBondContact O-N 2.75Å; T351-R393 WeakPolarHBondContact O-CA 3.34Å; T351-L394 PolarHBondContact O-N 3.41Å
352	V	94.1	Very high	91.7	Very high	65 Å²	65	51.3 Å²	51.3	39%	0.394	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	115.5	167.6	177.9	0	0	0	0	107.9	Y354 H391 V392 R393	V352-Y354 WeakPolarHBondContact CG1-O 3.49Å; V352-H391 HydrophobicContact CG1-CB 4.2Å; V352-H391 HydrophobicContact CG2-CB 4.5Å; V352-V392 CarbonylContact C-O 3.59Å; V352-V392 WeakPolarHBondContact CA-O 3.37Å; V352-R393 HydrophobicContact CG2-CG 3.87Å
353	I	93.2	Very high	91.1	Very high	26 Å²	26	53 Å²	53	13%	0.133	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-20.6	-179	63	175.4	0	0	0	112.6	I341 V343 T347 T351 F384 V392 L394 V425	I341-I353 HydrophobicContact CD1-CB 4.23Å; I341-I353 HydrophobicContact CD1-CD1 4Å; I341-I353 HydrophobicContact CD1-CG1 4.07Å; V343-I353 HydrophobicContact CG1-CG2 4.06Å; V343-I353 HydrophobicContact CG2-CB 4.08Å; V343-I353 HydrophobicContact CG2-CD1 4.48Å; V343-I353 HydrophobicContact CG2-CG2 4.25Å; T347-I353 HydrophobicContact CG2-CG2 4.42Å; T351-I353 HydrophobicContact CG2-CG2 4.45Å; T351-I353 PolarHBondContact O-N 2.75Å; I353-F384 HydrophobicContact CD1-CD1 3.63Å; I353-F384 HydrophobicContact CD1-CE1 3.58Å; I353-V392 HydrophobicContact CD1-CG1 4.06Å; I353-V392 HydrophobicContact CG1-CB 4.19Å; I353-V392 HydrophobicContact CG1-CG1 3.92Å; I353-V392 WeakPolarHBondContact CG1-O 3.23Å; I353-V392 PolarHBondContact N-O 3.18Å; I353-L394 HydrophobicContact CG2-CB 4.17Å; I353-V425 HydrophobicContact CD1-CG2 4.36Å
354	Y	93.2	Very high	90.3	Very high	77 Å²	77	56.2 Å²	56.2	30%	0.302	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	162	175.3	-153.5	-116	0	0	0	113.4	Y339 I341 V352 L356 V392 L423	Y339-Y354 AromaticContact CD1-CE1 3.47Å; Y339-Y354 HydrophobicContact CD1-CE1 3.47Å; Y339-Y354 VanDerWaalsContact CD1-CE1 3.47Å; Y339-Y354 AromaticContact CD1-CZ 3.88Å; Y339-Y354 WeakPolarHBondContact CD1-OH 3.48Å; Y339-Y354 HydrophobicContact CE1-CE1 4.03Å; Y339-Y354 HydrophobicContact CG-CE1 4.21Å; I341-Y354 HydrophobicContact CG2-CD2 3.36Å; I341-Y354 HydrophobicContact CG2-CE2 3.59Å; I341-Y354 HydrophobicContact CG2-CG 3.91Å; V352-Y354 WeakPolarHBondContact CG1-O 3.49Å; Y354-L356 HydrophobicContact CD1-CD2 4.29Å; Y354-L356 HydrophobicContact CD1-CG 4.46Å; Y354-V392 PolarHBondContact N-O 2.81Å; Y354-V392 PolarHBondContact O-N 2.82Å; Y354-L423 HydrophobicContact CD1-CD1 4.37Å
355	E	93.1	Very high	89.4	Confident	119 Å²	119	56.2 Å²	56.2	56%	0.556	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	112.8	171.7	-174.9	-176.2	168.9	0	0	108
356	L	92.2	Very high	89.1	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	36%	0.361	C	S	.	.			trans	-82.1	126.2	179.3	-69.3	158.9	0	0	0	110.1	Y339 Y354 Y369 I386 G390 V392 V410	Y339-L356 HydrophobicContact CD2-CD2 4.44Å; Y354-L356 HydrophobicContact CD1-CD2 4.29Å; Y354-L356 HydrophobicContact CD1-CG 4.46Å; L356-Y369 HydrophobicContact CB-CD1 4.06Å; L356-Y369 HydrophobicContact CB-CE1 4.11Å; L356-Y369 PolarHBondContact O-OH 2.82Å; L356-I386 HydrophobicContact CD1-CD1 4.34Å; L356-I386 HydrophobicContact CD1-CG2 4.01Å; L356-G390 WeakPolarHBondContact CB-O 3.48Å; L356-G390 PolarHBondContact N-O 2.87Å; L356-V392 HydrophobicContact CD1-CG2 3.39Å; L356-V392 HydrophobicContact CG-CG2 3.77Å; L356-V410 HydrophobicContact CD1-CG1 3.64Å; L356-V410 HydrophobicContact CD1-CG2 4.21Å; L356-V410 HydrophobicContact CD2-CG1 4.33Å; L356-V410 HydrophobicContact CD2-CG2 4.39Å
357	V	90.9	Very high	89.2	Confident	52 Å²	52	60.1 Å²	60.1	32%	0.315	35%	0.345	S	S	.	.			trans	-116.6	122.7	179.1	-175	0	0	0	0	110.6	S335 Y339 H359	S335-V357 PolarHBondContact N-O 2.69Å; S335-V357 PolarHBondContact OG-O 2.81Å; Y339-V357 PolarHBondContact OH-O 3.01Å; V357-H359 WeakPolarHBondContact CG1-CE1 3.22Å
358	A	91.1	Very high	89.2	Confident	9 Å²	9	60.5 Å²	60.5	7%	0.074	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	156.7	162.7	0	0	0	0	0	109.7	R333 F334 L367 Y369 V412	R333-A358 CarbonylContact O-C 3.53Å; R333-A358 WeakPolarHBondContact O-CA 3.39Å; F334-A358 HydrophobicContact CD1-CB 3.99Å; F334-A358 HydrophobicContact CE1-CB 4.3Å; F334-A358 HydrophobicContact CG-CB 4.41Å; A358-L367 HydrophobicContact CB-CD1 4.12Å; A358-Y369 HydrophobicContact CB-CE1 3.95Å; A358-Y369 PolarHBondContact N-OH 3.33Å; A358-V412 HydrophobicContact CB-CG1 4.06Å; A358-V412 HydrophobicContact CB-CG2 4.23Å
359	H	90	Very high	89.3	Confident	112 Å²	112	57.7 Å²	57.7	52%	0.519	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139.4	179	-53.4	-57.9	0	0	0	109.2	R333 S335 V357	R333-H359 PolarHBondContact N-O 2.95Å; R333-H359 PolarHBondContact O-N 2.96Å; S335-H359 PolarHBondContact OG-NE2 3Å; V357-H359 WeakPolarHBondContact CG1-CE1 3.22Å
360	D	91	Very high	89.3	Confident	30 Å²	30	56.5 Å²	56.5	16%	0.16	32%	0.318	C	S	.	.			trans	-134.9	128.9	177.9	-160.3	-43.7	0	0	0	106.9	D362 L367	D360-D362 VanDerWaalsContact C-N 3.25Å; D360-D362 PolarHBondContact OD1-N 2.68Å; D360-L367 HydrophobicContact CB-CD1 4.21Å; D360-L367 HydrophobicContact CB-CD2 3.94Å; D360-L367 HydrophobicContact CB-CG 4.35Å
361	P	88.5	Confident	89.2	Confident	72 Å²	72	55.6 Å²	55.6	47%	0.468	30%	0.304	S	S	.	.	S	Bend	trans	-63.1	-33	174.3	-22.9	35.8	0	0	0	112.9	E284 N330 S363	E284-P361 HydrophobicContact CB-CB 4.38Å; E284-P361 HydrophobicContact CG-CB 3.55Å; N330-P361 HydrophobicContact CB-CB 4.32Å; N330-P361 HydrophobicContact CB-CG 3.81Å; P361-S363 PolarHBondContact O-N 2.83Å
362	D	88.3	Confident	88.8	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.016	29%	0.291	C	S	.	.			trans	-79.1	121.2	-160.5	-60.1	-8.5	0	0	0	110.2	N328 D329 N330 D360 T364 S365	N328-D362 WeakPolarHBondContact CA-OD2 3.24Å; D329-D362 PolarHBondContact N-OD2 3.49Å; N330-D362 WeakPolarHBondContact CB-OD1 2.98Å; N330-D362 PolarHBondContact N-OD2 2.79Å; N330-D362 PolarHBondContact ND2-OD1 2.86Å; D360-D362 VanDerWaalsContact C-N 3.25Å; D360-D362 PolarHBondContact OD1-N 2.68Å; D362-T364 PolarHBondContact O-N 2.95Å; D362-S365 VanDerWaalsContact O-CB 3.3Å; D362-S365 WeakPolarHBondContact O-CB 3.34Å; D362-S365 PolarHBondContact O-N 3.06Å; D362-S365 PolarHBondContact O-OG 3.23Å
363	S	81.5	Confident	87.7	Confident	107 Å²	107	55.2 Å²	55.2	75%	0.748	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-9.8	-179.4	83.3	0	0	0	0	113.5	D326 P361	D326-S363 VanDerWaalsContact OD2-C 3.3Å; D326-S363 WeakPolarHBondContact OD2-CA 3.37Å; D326-S363 VanDerWaalsContact OD2-CB 3.23Å; D326-S363 WeakPolarHBondContact OD2-CB 3.31Å; D326-S363 PolarHBondContact OD2-N 2.74Å; D326-S363 PolarHBondContact OD2-OG 3.49Å; P361-S363 PolarHBondContact O-N 2.83Å
364	T	76.1	Confident	86.4	Confident	80 Å²	80	56 Å²	56	49%	0.491	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-14.5	167.9	57.8	0	0	0	0	114.4	D326 N328 D362	D326-T364 HydrophobicContact CB-CG2 4.17Å; D326-T364 VanDerWaalsContact OD1-CB 3.3Å; D326-T364 WeakPolarHBondContact OD1-CB 3.39Å; D326-T364 WeakPolarHBondContact OD1-CG2 3.37Å; D326-T364 PolarHBondContact OD1-OG1 2.71Å; D326-T364 PolarHBondContact OD2-N 2.77Å; N328-T364 PolarHBondContact N-OG1 3.28Å; D362-T364 PolarHBondContact O-N 2.95Å
365	S	74.2	Confident	85.1	Confident	30 Å²	30	60.5 Å²	60.5	21%	0.21	34%	0.343	C	S	.	.			trans	-63.4	148.6	179.3	70.7	0	0	0	0	112	D362	D362-S365 VanDerWaalsContact O-CB 3.3Å; D362-S365 WeakPolarHBondContact O-CB 3.34Å; D362-S365 PolarHBondContact O-N 3.06Å; D362-S365 PolarHBondContact O-OG 3.23Å
366	K	85.5	Confident	83.8	Confident	154 Å²	154	60.2 Å²	60.2	67%	0.67	34%	0.341	S	S	*	.			trans	-134.9	90.9	164.6	-168.4	-149.7	166.7	-167.7	0	110.7	T368	K366-T368 PolarHBondContact O-N 2.96Å
367	L	91.4	Very high	82.8	Confident	39 Å²	39	65 Å²	65	20%	0.204	36%	0.36	C	S	.	.			trans	-53.6	131.8	179.5	-55	-170.6	0	0	0	112.6	P332 A358 D360 Y369 V412 T413 D414	P332-L367 HydrophobicContact CB-CD2 3.57Å; P332-L367 HydrophobicContact CG-CD2 4.42Å; A358-L367 HydrophobicContact CB-CD1 4.12Å; D360-L367 HydrophobicContact CB-CD1 4.21Å; D360-L367 HydrophobicContact CB-CD2 3.94Å; D360-L367 HydrophobicContact CB-CG 4.35Å; L367-Y369 HydrophobicContact CB-CE2 4.47Å; L367-V412 HydrophobicContact CB-CG2 4.14Å; L367-V412 HydrophobicContact CD2-CG2 4.37Å; L367-T413 CarbonylContact C-O 3.25Å; L367-T413 WeakPolarHBondContact CA-O 3.47Å; L367-D414 HydrophobicContact CD2-CB 4.14Å
368	T	92.6	Very high	81.6	Confident	40 Å²	40	70.2 Å²	70.2	25%	0.245	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127.4	172.7	52.9	0	0	0	0	109.6	K366 A388 V412 T413	K366-T368 PolarHBondContact O-N 2.96Å; T368-A388 WeakPolarHBondContact CA-O 3.46Å; T368-V412 WeakPolarHBondContact O-CA 3.28Å; T368-T413 PolarHBondContact N-O 2.84Å; T368-T413 PolarHBondContact O-N 2.91Å; T368-T413 WeakPolarHBondContact OG1-CG2 3.2Å; T368-T413 PolarHBondContact OG1-O 2.96Å
369	Y	93.9	Very high	80.6	Confident	19 Å²	19	73.8 Å²	73.8	8%	0.075	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.6	-177.9	-57.7	-96	0	0	0	111	F334 L356 A358 L367 A388 D389 V412	F334-Y369 HydrophobicContact CE1-CD1 4.04Å; F334-Y369 AromaticContact CE1-CE1 3.9Å; F334-Y369 HydrophobicContact CE1-CE1 3.9Å; F334-Y369 HydrophobicContact CZ-CD1 4.47Å; L356-Y369 HydrophobicContact CB-CD1 4.06Å; L356-Y369 HydrophobicContact CB-CE1 4.11Å; L356-Y369 PolarHBondContact O-OH 2.82Å; A358-Y369 HydrophobicContact CB-CE1 3.95Å; A358-Y369 PolarHBondContact N-OH 3.33Å; L367-Y369 HydrophobicContact CB-CE2 4.47Å; Y369-A388 PolarHBondContact N-O 3.27Å; Y369-D389 WeakPolarHBondContact CE2-O 3.4Å; Y369-V412 HydrophobicContact CD1-CB 3.87Å; Y369-V412 HydrophobicContact CD1-CG2 3.69Å; Y369-V412 HydrophobicContact CE1-CB 4.07Å; Y369-V412 HydrophobicContact CE1-CG2 3.65Å; Y369-V412 HydrophobicContact CG-CG2 4.17Å
370	T	91.2	Very high	80.2	Confident	61 Å²	61	68.6 Å²	68.6	37%	0.374	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	161.7	-179.3	61.2	0	0	0	0	110.8	E411	T370-E411 PolarHBondContact N-O 2.86Å; T370-E411 PolarHBondContact O-N 2.97Å; T370-E411 PolarHBondContact OG1-O 3.35Å
371	M	88.8	Confident	79.7	Confident	20 Å²	20	69.2 Å²	69.2	10%	0.099	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	124.7	165.7	-172.9	-174.1	-60.3	0	0	108.5	Y377 M380 F384 I386 I408 P409	M371-Y377 HydrophobicContact CB-CD2 4.19Å; M371-Y377 HydrophobicContact CB-CE2 3.94Å; M371-Y377 HydrophobicContact CG-CD2 3.99Å; M371-Y377 HydrophobicContact CG-CE2 4.24Å; M371-Y377 WeakPolarHBondContact O-CE2 3.43Å; M371-Y377 HydrophobicContact SD-CD2 3.94Å; M371-Y377 HydrophobicContact SD-CE2 4.29Å; M371-M380 HydrophobicContact CE-CB 4.03Å; M371-M380 HydrophobicContact SD-CB 3.51Å; M371-M380 VanDerWaalsContact SD-CB 3.51Å; M371-F384 HydrophobicContact CE-CB 4.21Å; M371-F384 VanDerWaalsContact CE-O 3.27Å; M371-F384 WeakPolarHBondContact CE-O 3.18Å; M371-I386 HydrophobicContact CB-CD1 4Å; M371-I408 HydrophobicContact CE-CG2 3.91Å; M371-I408 HydrophobicContact CG-CG2 4.04Å; M371-I408 HydrophobicContact SD-CG2 4.35Å; M371-P409 WeakPolarHBondContact CA-O 3.17Å
372	A	83.6	Confident	79.5	Confident	6 Å²	6	68.7 Å²	68.7	5%	0.05	38%	0.382	C	S	.	.			trans	-66.8	142.2	-173.4	0	0	0	0	0	111.4	S374 P409 E411	A372-S374 PolarHBondContact O-N 3.34Å; A372-P409 HydrophobicContact CB-CB 4.09Å; A372-P409 HydrophobicContact CB-CG 4.46Å; A372-P409 PolarHBondContact N-O 2.85Å; A372-E411 HydrophobicContact CB-CB 3.85Å
373	S	70.4	Confident	79.6	Confident	101 Å²	101	69.2 Å²	69.2	71%	0.706	39%	0.385	S	S	*	.			trans	-70.2	99.8	-177	64.6	0	0	0	0	112.3
374	S	66.1	Low	80.1	Confident	44 Å²	44	64.1 Å²	64.1	31%	0.308	35%	0.35	S	S	.	.			trans	-116.8	172.7	169.3	76	0	0	0	0	110.8	A372 E376 Y377	A372-S374 PolarHBondContact O-N 3.34Å; S374-E376 PolarHBondContact O-N 2.91Å; S374-E376 PolarHBondContact OG-N 3.29Å; S374-Y377 WeakPolarHBondContact O-CB 3.29Å; S374-Y377 PolarHBondContact O-N 2.9Å; S374-Y377 PolarHBondContact OG-N 3.25Å
375	L	66.2	Low	80.9	Confident	171 Å²	171	64.7 Å²	64.7	90%	0.895	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-28.1	171	-165.8	70.1	0	0	0	111.5	Y377	L375-Y377 VanDerWaalsContact C-N 3.3Å
376	E	66.9	Low	81.7	Confident	112 Å²	112	64.1 Å²	64.1	52%	0.523	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-18.1	178.6	-57.3	172.7	123.3	0	0	112.4	S374 Q378 V379 M380	S374-E376 PolarHBondContact O-N 2.91Å; S374-E376 PolarHBondContact OG-N 3.29Å; E376-Q378 PolarHBondContact O-N 2.89Å; E376-V379 PolarHBondContact O-N 2.92Å; E376-M380 HydrophobicContact CB-CG 4.31Å; E376-M380 WeakPolarHBondContact O-CG 3.48Å; E376-M380 PolarHBondContact O-N 2.87Å
377	Y	70.4	Confident	82	Confident	103 Å²	103	59.1 Å²	59.1	40%	0.404	32%	0.32	S	S	.	.	H	α-helix	trans	-45.1	-42.2	-179.7	178.6	-82.2	0	0	0	112.5	M371 S374 L375 V379 M380 S381	M371-Y377 HydrophobicContact CB-CD2 4.19Å; M371-Y377 HydrophobicContact CB-CE2 3.94Å; M371-Y377 HydrophobicContact CG-CD2 3.99Å; M371-Y377 HydrophobicContact CG-CE2 4.24Å; M371-Y377 WeakPolarHBondContact O-CE2 3.43Å; M371-Y377 HydrophobicContact SD-CD2 3.94Å; M371-Y377 HydrophobicContact SD-CE2 4.29Å; S374-Y377 WeakPolarHBondContact O-CB 3.29Å; S374-Y377 PolarHBondContact O-N 2.9Å; S374-Y377 PolarHBondContact OG-N 3.25Å; L375-Y377 VanDerWaalsContact C-N 3.3Å; Y377-V379 VanDerWaalsContact C-N 3.31Å; Y377-V379 PolarHBondContact O-N 3.12Å; Y377-M380 PolarHBondContact O-N 2.99Å; Y377-S381 VanDerWaalsContact O-CB 3.29Å; Y377-S381 WeakPolarHBondContact O-CB 3.25Å; Y377-S381 PolarHBondContact O-N 3.28Å; Y377-S381 PolarHBondContact O-OG 3.4Å
378	Q	65.8	Low	82.1	Confident	162 Å²	162	60.2 Å²	60.2	76%	0.757	34%	0.335	S	S	*	.	H	α-helix	trans	-61.5	-35.4	-179.7	-65.6	-174.7	-4.6	0	0	113.6	E376 S382	E376-Q378 PolarHBondContact O-N 2.89Å; Q378-S382 PolarHBondContact O-OG 2.82Å
379	V	70.4	Confident	82	Confident	84 Å²	84	62.9 Å²	62.9	51%	0.509	35%	0.347	S	S	.	.	H	α-helix	trans	-82.5	-30.6	177.7	-175.7	0	0	0	0	110.9	E376 Y377 S382	E376-V379 PolarHBondContact O-N 2.92Å; Y377-V379 VanDerWaalsContact C-N 3.31Å; Y377-V379 PolarHBondContact O-N 3.12Å; V379-S382 PolarHBondContact O-OG 3.44Å
380	M	80.9	Confident	81.9	Confident	3 Å²	3	62 Å²	62	2%	0.015	34%	0.344	C	S	.	.	H	α-helix	trans	-81.3	-36.8	-178.8	-57.4	-151.3	85.2	0	0	112.3	M371 E376 Y377 S382 T383 F384 Y406 I408	M371-M380 HydrophobicContact CE-CB 4.03Å; M371-M380 HydrophobicContact SD-CB 3.51Å; M371-M380 VanDerWaalsContact SD-CB 3.51Å; E376-M380 HydrophobicContact CB-CG 4.31Å; E376-M380 WeakPolarHBondContact O-CG 3.48Å; E376-M380 PolarHBondContact O-N 2.87Å; Y377-M380 PolarHBondContact O-N 2.99Å; M380-S382 VanDerWaalsContact C-N 3.29Å; M380-S382 PolarHBondContact O-N 2.99Å; M380-T383 PolarHBondContact O-N 2.98Å; M380-T383 VanDerWaalsContact O-N 3.13Å; M380-F384 PolarHBondContact O-N 2.85Å; M380-Y406 HydrophobicContact CE-CD1 4.27Å; M380-I408 HydrophobicContact CE-CB 4.16Å; M380-I408 HydrophobicContact CE-CG1 3.65Å
381	S	80.9	Confident	82	Confident	43 Å²	43	61.7 Å²	61.7	30%	0.301	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-20.5	178.9	62.6	0	0	0	0	113.9	Y377 T383	Y377-S381 VanDerWaalsContact O-CB 3.29Å; Y377-S381 WeakPolarHBondContact O-CB 3.25Å; Y377-S381 PolarHBondContact O-N 3.28Å; Y377-S381 PolarHBondContact O-OG 3.4Å; S381-T383 VanDerWaalsContact C-N 3.34Å
382	S	84.5	Confident	82.2	Confident	61 Å²	61	60.7 Å²	60.7	43%	0.427	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-26.5	169.8	42.5	0	0	0	0	113	Q378 V379 M380 S396	Q378-S382 PolarHBondContact O-OG 2.82Å; V379-S382 PolarHBondContact O-OG 3.44Å; M380-S382 VanDerWaalsContact C-N 3.29Å; M380-S382 PolarHBondContact O-N 2.99Å; S382-S396 PolarHBondContact O-N 3.44Å
383	T	89.7	Confident	82.7	Confident	13 Å²	13	64.8 Å²	64.8	8%	0.08	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-33.5	-175.7	-59.3	0	0	0	0	113.1	M380 S381 L394 H395 S396 L398 Y406	M380-T383 PolarHBondContact O-N 2.98Å; M380-T383 VanDerWaalsContact O-N 3.13Å; S381-T383 VanDerWaalsContact C-N 3.34Å; T383-L394 HydrophobicContact CG2-CD1 4.31Å; T383-H395 PolarHBondContact O-N 3.33Å; T383-S396 WeakPolarHBondContact CA-OG 3.38Å; T383-S396 WeakPolarHBondContact CB-OG 3.39Å; T383-S396 WeakPolarHBondContact CG2-OG 3.41Å; T383-S396 PolarHBondContact O-N 2.87Å; T383-S396 PolarHBondContact OG1-OG 2.88Å; T383-S396 VanDerWaalsContact OG1-OG 3.09Å; T383-L398 HydrophobicContact CG2-CD2 3.74Å; T383-Y406 HydrophobicContact CG2-CE1 4.2Å
384	F	92.7	Very high	83.8	Confident	1 Å²	1	60 Å²	60	0%	0.004	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.8	-178.6	-54.4	-78.5	0	0	0	112	I353 M371 M380 R393 L394 L398 Y406 I408 V425	I353-F384 HydrophobicContact CD1-CD1 3.63Å; I353-F384 HydrophobicContact CD1-CE1 3.58Å; M371-F384 HydrophobicContact CE-CB 4.21Å; M371-F384 VanDerWaalsContact CE-O 3.27Å; M371-F384 WeakPolarHBondContact CE-O 3.18Å; M380-F384 PolarHBondContact O-N 2.85Å; F384-R393 WeakPolarHBondContact CA-O 3.42Å; F384-L394 HydrophobicContact CD1-CD1 4.39Å; F384-L394 HydrophobicContact CE1-CD1 4.12Å; F384-L398 HydrophobicContact CE1-CD2 4.14Å; F384-L398 HydrophobicContact CZ-CD2 3.84Å; F384-Y406 AromaticContact CE2-CD1 3.59Å; F384-Y406 HydrophobicContact CE2-CD1 3.59Å; F384-Y406 HydrophobicContact CE2-CD2 4.19Å; F384-Y406 HydrophobicContact CE2-CE1 4.11Å; F384-Y406 AromaticContact CE2-CG 3.61Å; F384-Y406 HydrophobicContact CE2-CG 3.61Å; F384-Y406 HydrophobicContact CZ-CD1 4.3Å; F384-Y406 HydrophobicContact CZ-CD2 4.08Å; F384-Y406 AromaticContact CZ-CG 3.95Å; F384-Y406 HydrophobicContact CZ-CG 3.95Å; F384-I408 HydrophobicContact CB-CD1 3.96Å; F384-I408 HydrophobicContact CD1-CD1 3.92Å; F384-I408 HydrophobicContact CD2-CD1 3.61Å; F384-I408 HydrophobicContact CD2-CG1 3.99Å; F384-I408 HydrophobicContact CE1-CD1 4.32Å; F384-I408 HydrophobicContact CE2-CD1 4.03Å; F384-I408 HydrophobicContact CE2-CG1 4.29Å; F384-I408 HydrophobicContact CG-CD1 3.54Å; F384-I408 HydrophobicContact CG-CG1 4.39Å; F384-I408 HydrophobicContact CZ-CD1 4.36Å; F384-V425 HydrophobicContact CE1-CG1 4.31Å; F384-V425 HydrophobicContact CE1-CG2 4.09Å; F384-V425 HydrophobicContact CZ-CB 4.22Å; F384-V425 HydrophobicContact CZ-CG1 4.26Å; F384-V425 HydrophobicContact CZ-CG2 4.08Å
385	H	91.9	Very high	85	Confident	91 Å²	91	63.2 Å²	63.2	42%	0.421	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.9	173.2	-179.2	-80.3	0	0	0	109.7	R393 H395	H385-R393 PolarHBondContact N-O 3.44Å; H385-R393 PolarHBondContact O-N 2.78Å; H385-H395 HydrophobicContact CB-CB 4.36Å
386	I	92.7	Very high	86.2	Confident	19 Å²	19	56.8 Å²	56.8	10%	0.097	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	115.3	172.8	-55.3	-174.2	0	0	0	107.7	L356 M371 V392 I408 V410	L356-I386 HydrophobicContact CD1-CD1 4.34Å; L356-I386 HydrophobicContact CD1-CG2 4.01Å; M371-I386 HydrophobicContact CB-CD1 4Å; I386-V392 HydrophobicContact CG1-CG1 4.49Å; I386-V392 HydrophobicContact CG1-CG2 4.31Å; I386-I408 HydrophobicContact CD1-CG2 4.17Å; I386-V410 HydrophobicContact CD1-CG1 4.3Å; I386-V410 HydrophobicContact CD1-CG2 3.87Å
387	E	92	Very high	87.3	Confident	48 Å²	48	55.4 Å²	55.4	22%	0.224	30%	0.296	C	S	.	.			trans	-74.7	148.8	172.1	-66.2	-174.5	128.5	0	0	110.5	D389 G390 H391 R393	E387-D389 VanDerWaalsContact CB-OD1 3.31Å; E387-D389 WeakPolarHBondContact CB-OD1 3.33Å; E387-D389 PolarHBondContact O-N 3.26Å; E387-G390 PolarHBondContact O-N 3.47Å; E387-H391 HydrophobicContact CB-CB 4.28Å; E387-H391 PolarHBondContact N-O 2.88Å; E387-R393 VanDerWaalsContact CD-NH2 3.26Å; E387-R393 IonicContact OE1-CZ 3.01Å; E387-R393 IonicContact OE1-NE 3.14Å; E387-R393 PolarHBondContact OE1-NE 3.4Å; E387-R393 IonicContact OE1-NH2 3.81Å; E387-R393 PolarHBondContact OE1-NH2 3.19Å; E387-R393 IonicContact OE2-CZ 3.7Å; E387-R393 IonicContact OE2-NE 3.61Å; E387-R393 PolarHBondContact OE2-NE 2.79Å; E387-R393 IonicContact OE2-NH2 2.77Å; E387-R393 PolarHBondContact OE2-NH2 3.02Å
388	A	91.8	Very high	88.3	Confident	62 Å²	62	51 Å²	51	51%	0.512	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-9.6	-170.9	0	0	0	0	0	114.4	T368 Y369	T368-A388 WeakPolarHBondContact CA-O 3.46Å; Y369-A388 PolarHBondContact N-O 3.27Å
389	D	91.1	Very high	89.6	Confident	96 Å²	96	46 Å²	46	51%	0.513	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-8.2	175.3	62.9	-5.3	0	0	0	113.9	Y369 E387 H391	Y369-D389 WeakPolarHBondContact CE2-O 3.4Å; E387-D389 VanDerWaalsContact CB-OD1 3.31Å; E387-D389 WeakPolarHBondContact CB-OD1 3.33Å; E387-D389 PolarHBondContact O-N 3.26Å; D389-H391 IonicContact OD1-CG 3.9Å; D389-H391 PolarHBondContact OD1-N 3.09Å; D389-H391 IonicContact OD1-ND1 2.74Å; D389-H391 PolarHBondContact OD1-ND1 2.86Å; D389-H391 IonicContact OD2-CE1 2.78Å; D389-H391 PolarHBondContact OD2-CE1 3.13Å; D389-H391 IonicContact OD2-ND1 2.61Å; D389-H391 PolarHBondContact OD2-ND1 2.84Å
390	G	91.6	Very high	90.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	114.4	-9.4	177.1	0	0	0	0	0	114.5	L356 E387 V392	L356-G390 WeakPolarHBondContact CB-O 3.48Å; L356-G390 PolarHBondContact N-O 2.87Å; E387-G390 PolarHBondContact O-N 3.47Å; G390-V392 PolarHBondContact O-N 3.05Å
391	H	94	Very high	91	Very high	55 Å²	55	46.9 Å²	46.9	26%	0.255	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	121.9	179.1	-64.5	105.6	0	0	0	111.7	V352 E387 D389	V352-H391 HydrophobicContact CG1-CB 4.2Å; V352-H391 HydrophobicContact CG2-CB 4.5Å; E387-H391 HydrophobicContact CB-CB 4.28Å; E387-H391 PolarHBondContact N-O 2.88Å; D389-H391 IonicContact OD1-CG 3.9Å; D389-H391 PolarHBondContact OD1-N 3.09Å; D389-H391 IonicContact OD1-ND1 2.74Å; D389-H391 PolarHBondContact OD1-ND1 2.86Å; D389-H391 IonicContact OD2-CE1 2.78Å; D389-H391 PolarHBondContact OD2-CE1 3.13Å; D389-H391 IonicContact OD2-ND1 2.61Å; D389-H391 PolarHBondContact OD2-ND1 2.84Å
392	V	93.6	Very high	91.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.4	173.7	-173.3	0	0	0	0	108.6	V352 I353 Y354 L356 I386 G390 L423	V352-V392 CarbonylContact C-O 3.59Å; V352-V392 WeakPolarHBondContact CA-O 3.37Å; I353-V392 HydrophobicContact CD1-CG1 4.06Å; I353-V392 HydrophobicContact CG1-CB 4.19Å; I353-V392 HydrophobicContact CG1-CG1 3.92Å; I353-V392 WeakPolarHBondContact CG1-O 3.23Å; I353-V392 PolarHBondContact N-O 3.18Å; Y354-V392 PolarHBondContact N-O 2.81Å; Y354-V392 PolarHBondContact O-N 2.82Å; L356-V392 HydrophobicContact CD1-CG2 3.39Å; L356-V392 HydrophobicContact CG-CG2 3.77Å; I386-V392 HydrophobicContact CG1-CG1 4.49Å; I386-V392 HydrophobicContact CG1-CG2 4.31Å; G390-V392 PolarHBondContact O-N 3.05Å; V392-L423 HydrophobicContact CB-CD2 4.29Å; V392-L423 HydrophobicContact CG1-CD2 4.09Å; V392-L423 HydrophobicContact CG2-CD2 3.81Å
393	R	93.6	Very high	91.6	Very high	92 Å²	92	53 Å²	53	35%	0.347	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.8	177.7	-62.6	-163.8	-168.3	-156.1	18.3	112.6	T351 V352 F384 H385 E387	T351-R393 WeakPolarHBondContact O-CA 3.34Å; V352-R393 HydrophobicContact CG2-CG 3.87Å; F384-R393 WeakPolarHBondContact CA-O 3.42Å; H385-R393 PolarHBondContact N-O 3.44Å; H385-R393 PolarHBondContact O-N 2.78Å; E387-R393 VanDerWaalsContact CD-NH2 3.26Å; E387-R393 IonicContact OE1-CZ 3.01Å; E387-R393 IonicContact OE1-NE 3.14Å; E387-R393 PolarHBondContact OE1-NE 3.4Å; E387-R393 IonicContact OE1-NH2 3.81Å; E387-R393 PolarHBondContact OE1-NH2 3.19Å; E387-R393 IonicContact OE2-CZ 3.7Å; E387-R393 IonicContact OE2-NE 3.61Å; E387-R393 PolarHBondContact OE2-NE 2.79Å; E387-R393 IonicContact OE2-NH2 2.77Å; E387-R393 PolarHBondContact OE2-NH2 3.02Å
394	L	93.5	Very high	91.6	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	127.7	169	-175.4	61.4	0	0	0	110.1	T347 G350 T351 I353 T383 F384 S396 L398	T347-L394 HydrophobicContact CG2-CD2 3.88Å; T347-L394 VanDerWaalsContact O-CD2 3.23Å; T347-L394 WeakPolarHBondContact O-CD2 3.45Å; G350-L394 WeakPolarHBondContact CA-O 3.02Å; G350-L394 PolarHBondContact N-O 2.66Å; T351-L394 PolarHBondContact O-N 3.41Å; I353-L394 HydrophobicContact CG2-CB 4.17Å; T383-L394 HydrophobicContact CG2-CD1 4.31Å; F384-L394 HydrophobicContact CD1-CD1 4.39Å; F384-L394 HydrophobicContact CE1-CD1 4.12Å; L394-S396 WeakPolarHBondContact CD1-O 3.24Å; L394-S396 WeakPolarHBondContact CG-O 3.27Å; L394-L398 HydrophobicContact CD1-CD1 4.24Å; L394-L398 HydrophobicContact CD1-CD2 3.68Å; L394-L398 HydrophobicContact CD1-CG 3.64Å; L394-L398 HydrophobicContact CD2-CD1 4.46Å; L394-L398 HydrophobicContact CD2-CG 4.2Å
395	H	90.8	Very high	91.5	Very high	110 Å²	110	61.2 Å²	61.2	51%	0.509	31%	0.311	S	S	.	.			trans	-115.6	-29.9	-171.6	-164.2	68.4	0	0	0	114.1	V349 T383 H385	V349-H395 VanDerWaalsContact CG1-O 3.23Å; V349-H395 WeakPolarHBondContact CG1-O 3.49Å; T383-H395 PolarHBondContact O-N 3.33Å; H385-H395 HydrophobicContact CB-CB 4.36Å
396	S	90.7	Very high	91.4	Very high	36 Å²	36	57.7 Å²	57.7	25%	0.252	29%	0.294	S	S	.	.	S	Bend	trans	-111	173.6	161.3	70.5	0	0	0	0	109.7	S382 T383 L394	S382-S396 PolarHBondContact O-N 3.44Å; T383-S396 WeakPolarHBondContact CA-OG 3.38Å; T383-S396 WeakPolarHBondContact CB-OG 3.39Å; T383-S396 WeakPolarHBondContact CG2-OG 3.41Å; T383-S396 PolarHBondContact O-N 2.87Å; T383-S396 PolarHBondContact OG1-OG 2.88Å; T383-S396 VanDerWaalsContact OG1-OG 3.09Å; L394-S396 WeakPolarHBondContact CD1-O 3.24Å; L394-S396 WeakPolarHBondContact CG-O 3.27Å
397	S	90.8	Very high	91.3	Very high	83 Å²	83	59.2 Å²	59.2	58%	0.58	31%	0.306	S	S	*	.			trans	-59.8	157.9	159.3	46.2	0	0	0	0	110.6
398	L	92.5	Very high	91.2	Very high	11 Å²	11	56.9 Å²	56.9	6%	0.058	30%	0.296	C	S	.	.			trans	-93.5	168.9	160.9	-63.1	176.9	0	0	0	109.1	V343 E345 T383 F384 L394 Y406 V427	V343-L398 HydrophobicContact CB-CD1 4.13Å; V343-L398 HydrophobicContact CG1-CD1 3.69Å; E345-L398 HydrophobicContact CB-CB 4.03Å; T383-L398 HydrophobicContact CG2-CD2 3.74Å; F384-L398 HydrophobicContact CE1-CD2 4.14Å; F384-L398 HydrophobicContact CZ-CD2 3.84Å; L394-L398 HydrophobicContact CD1-CD1 4.24Å; L394-L398 HydrophobicContact CD1-CD2 3.68Å; L394-L398 HydrophobicContact CD1-CG 3.64Å; L394-L398 HydrophobicContact CD2-CD1 4.46Å; L394-L398 HydrophobicContact CD2-CG 4.2Å; L398-Y406 HydrophobicContact CD2-CE2 4.05Å; L398-V427 HydrophobicContact CB-CG1 4.38Å; L398-V427 HydrophobicContact CD1-CG2 4.36Å
399	D	91.5	Very high	91.1	Very high	57 Å²	57	55.3 Å²	55.3	31%	0.305	28%	0.28	S	S	.	.			trans	-161.7	113.9	-174.2	178.2	-44.4	0	0	0	106	E401 L402 R403	D399-E401 PolarHBondContact OD1-N 3.02Å; D399-L402 HydrophobicContact CB-CB 4.29Å; D399-L402 HydrophobicContact CB-CD1 4.39Å; D399-L402 WeakPolarHBondContact OD1-CB 3.43Å; D399-L402 VanDerWaalsContact OD1-CG 3.24Å; D399-L402 WeakPolarHBondContact OD1-CG 3.47Å; D399-L402 PolarHBondContact OD1-N 3.14Å; D399-L402 WeakPolarHBondContact OD2-CD1 3.32Å; D399-L402 WeakPolarHBondContact OD2-CG 3.38Å; D399-R403 PolarHBondContact O-N 3.03Å; D399-R403 VanDerWaalsContact O-N 3.11Å
400	Y	91.4	Very high	91.1	Very high	45 Å²	45	50.8 Å²	50.8	18%	0.176	26%	0.256	C	S	.	.	H	α-helix	trans	-75.6	-44.3	-173.3	176.3	-100.9	0	0	0	110.9	E345 L402 R403 H404 V427 D429	E345-Y400 WeakPolarHBondContact OE1-CB 3.43Å; E345-Y400 WeakPolarHBondContact OE2-CB 3.21Å; E345-Y400 PolarHBondContact OE2-N 3.18Å; Y400-L402 VanDerWaalsContact C-N 3.31Å; Y400-L402 PolarHBondContact O-N 2.82Å; Y400-R403 CarbonylContact O-C 3.55Å; Y400-R403 PolarHBondContact O-N 3.46Å; Y400-R403 VanDerWaalsContact O-N 3.13Å; Y400-H404 AromaticContact CD1-CE1 3.88Å; Y400-H404 AromaticContact CD1-ND1 3.54Å; Y400-H404 HydrophobicContact CD2-CB 4.18Å; Y400-H404 AromaticContact CD2-ND1 3.43Å; Y400-H404 WeakPolarHBondContact CD2-ND1 3.14Å; Y400-H404 AromaticContact CE1-CE1 3.54Å; Y400-H404 AromaticContact CE1-ND1 3.26Å; Y400-H404 VanDerWaalsContact CE1-ND1 3.26Å; Y400-H404 WeakPolarHBondContact CE1-ND1 3.11Å; Y400-H404 HydrophobicContact CE2-CB 4.02Å; Y400-H404 AromaticContact CE2-CG 3.95Å; Y400-H404 AromaticContact CE2-ND1 3.15Å; Y400-H404 WeakPolarHBondContact CE2-ND1 3.23Å; Y400-H404 AromaticContact CG-ND1 3.62Å; Y400-H404 AromaticContact CZ-CE1 3.73Å; Y400-H404 AromaticContact CZ-ND1 3.06Å; Y400-H404 PolarHBondContact O-CE1 2.95Å; Y400-H404 PolarHBondContact O-N 3.45Å; Y400-H404 VanDerWaalsContact O-N 3.09Å; Y400-H404 PolarHBondContact O-ND1 3.18Å; Y400-V427 HydrophobicContact CD2-CB 4.1Å; Y400-V427 HydrophobicContact CD2-CG1 4.15Å; Y400-D429 HydrophobicContact CD1-CB 3.73Å; Y400-D429 HydrophobicContact CD2-CB 4Å; Y400-D429 HydrophobicContact CE1-CB 3.67Å; Y400-D429 HydrophobicContact CE2-CB 3.92Å; Y400-D429 HydrophobicContact CG-CB 3.91Å
401	E	89.3	Confident	91.1	Very high	60 Å²	60	52.1 Å²	52.1	28%	0.28	26%	0.262	S	S	.	.	H	α-helix	trans	-55.4	-40.1	177.1	-81.9	44.6	-114.8	0	0	112.5	D399 P464	D399-E401 PolarHBondContact OD1-N 3.02Å; E401-P464 HydrophobicContact CG-CB 3.41Å; E401-P464 VanDerWaalsContact CG-CB 3.41Å
402	L	89.3	Confident	91.1	Very high	144 Å²	144	49.5 Å²	49.5	75%	0.754	25%	0.25	S	C	*	.	H	α-helix	trans	-79.2	-42.5	172.4	-68.5	-176.8	0	0	0	112.4	D399 Y400	D399-L402 HydrophobicContact CB-CB 4.29Å; D399-L402 HydrophobicContact CB-CD1 4.39Å; D399-L402 WeakPolarHBondContact OD1-CB 3.43Å; D399-L402 VanDerWaalsContact OD1-CG 3.24Å; D399-L402 WeakPolarHBondContact OD1-CG 3.47Å; D399-L402 PolarHBondContact OD1-N 3.14Å; D399-L402 WeakPolarHBondContact OD2-CD1 3.32Å; D399-L402 WeakPolarHBondContact OD2-CG 3.38Å; Y400-L402 VanDerWaalsContact C-N 3.31Å; Y400-L402 PolarHBondContact O-N 2.82Å
403	R	88.3	Confident	91	Very high	89 Å²	89	51.4 Å²	51.4	34%	0.336	26%	0.262	S	S	.	.	H	α-helix	trans	-157.8	86.6	-174.3	-166.6	163.8	176.8	169.3	5.6	116.3	D399 Y400 I405 Y406 V427	D399-R403 PolarHBondContact O-N 3.03Å; D399-R403 VanDerWaalsContact O-N 3.11Å; Y400-R403 CarbonylContact O-C 3.55Å; Y400-R403 PolarHBondContact O-N 3.46Å; Y400-R403 VanDerWaalsContact O-N 3.13Å; R403-I405 VanDerWaalsContact C-N 3.26Å; R403-I405 WeakPolarHBondContact CG-O 3.47Å; R403-I405 PolarHBondContact NE-O 2.8Å; R403-I405 PolarHBondContact O-N 3.09Å; R403-Y406 HydrophobicContact CB-CE2 3.97Å; R403-Y406 HydrophobicContact CG-CD2 4.2Å; R403-Y406 HydrophobicContact CG-CE1 4.26Å; R403-Y406 HydrophobicContact CG-CE2 3.86Å; R403-Y406 WeakPolarHBondContact O-CE2 3.43Å; R403-V427 VanDerWaalsContact O-CG2 3.28Å; R403-V427 WeakPolarHBondContact O-CG2 3.21Å
404	H	90	Very high	90.9	Very high	93 Å²	93	47.7 Å²	47.7	43%	0.431	25%	0.249	S	C	.	.	S	Bend	trans	-49.3	-28.6	170.5	-40.6	-83.3	0	0	0	117.3	Y400 V427	Y400-H404 AromaticContact CD1-CE1 3.88Å; Y400-H404 AromaticContact CD1-ND1 3.54Å; Y400-H404 HydrophobicContact CD2-CB 4.18Å; Y400-H404 AromaticContact CD2-ND1 3.43Å; Y400-H404 WeakPolarHBondContact CD2-ND1 3.14Å; Y400-H404 AromaticContact CE1-CE1 3.54Å; Y400-H404 AromaticContact CE1-ND1 3.26Å; Y400-H404 VanDerWaalsContact CE1-ND1 3.26Å; Y400-H404 WeakPolarHBondContact CE1-ND1 3.11Å; Y400-H404 HydrophobicContact CE2-CB 4.02Å; Y400-H404 AromaticContact CE2-CG 3.95Å; Y400-H404 AromaticContact CE2-ND1 3.15Å; Y400-H404 WeakPolarHBondContact CE2-ND1 3.23Å; Y400-H404 AromaticContact CG-ND1 3.62Å; Y400-H404 AromaticContact CZ-CE1 3.73Å; Y400-H404 AromaticContact CZ-ND1 3.06Å; Y400-H404 PolarHBondContact O-CE1 2.95Å; Y400-H404 PolarHBondContact O-N 3.45Å; Y400-H404 VanDerWaalsContact O-N 3.09Å; Y400-H404 PolarHBondContact O-ND1 3.18Å; H404-V427 PolarHBondContact O-N 3.09Å
405	I	90.9	Very high	90.5	Very high	93 Å²	93	51 Å²	51	48%	0.477	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	135.3	-176.4	-85.8	179	0	0	0	113.3	R403 V425 Q426	R403-I405 VanDerWaalsContact C-N 3.26Å; R403-I405 WeakPolarHBondContact CG-O 3.47Å; R403-I405 PolarHBondContact NE-O 2.8Å; R403-I405 PolarHBondContact O-N 3.09Å; I405-V425 WeakPolarHBondContact CA-O 3.24Å; I405-Q426 HydrophobicContact CG1-CB 4.39Å; I405-Q426 HydrophobicContact CG1-CG 4.46Å
406	Y	90.6	Very high	90.3	Very high	18 Å²	18	52.9 Å²	52.9	7%	0.071	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.9	168.7	-61.4	-104.7	0	0	0	110.3	M380 T383 F384 L398 R403 N424 V425 V427	M380-Y406 HydrophobicContact CE-CD1 4.27Å; T383-Y406 HydrophobicContact CG2-CE1 4.2Å; F384-Y406 AromaticContact CE2-CD1 3.59Å; F384-Y406 HydrophobicContact CE2-CD1 3.59Å; F384-Y406 HydrophobicContact CE2-CD2 4.19Å; F384-Y406 HydrophobicContact CE2-CE1 4.11Å; F384-Y406 AromaticContact CE2-CG 3.61Å; F384-Y406 HydrophobicContact CE2-CG 3.61Å; F384-Y406 HydrophobicContact CZ-CD1 4.3Å; F384-Y406 HydrophobicContact CZ-CD2 4.08Å; F384-Y406 AromaticContact CZ-CG 3.95Å; F384-Y406 HydrophobicContact CZ-CG 3.95Å; L398-Y406 HydrophobicContact CD2-CE2 4.05Å; R403-Y406 HydrophobicContact CB-CE2 3.97Å; R403-Y406 HydrophobicContact CG-CD2 4.2Å; R403-Y406 HydrophobicContact CG-CE1 4.26Å; R403-Y406 HydrophobicContact CG-CE2 3.86Å; R403-Y406 WeakPolarHBondContact O-CE2 3.43Å; Y406-N424 CarbonylContact O-C 3.3Å; Y406-N424 VanDerWaalsContact O-CA 3.32Å; Y406-N424 WeakPolarHBondContact O-CA 3.18Å; Y406-V425 PolarHBondContact N-O 3.46Å; Y406-V425 PolarHBondContact O-N 3.38Å; Y406-V427 HydrophobicContact CD2-CG2 4.07Å; Y406-V427 HydrophobicContact CE2-CG2 3.84Å
407	S	90.1	Very high	90.2	Very high	50 Å²	50	54.8 Å²	54.8	35%	0.35	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	89.8	177.9	-67.4	0	0	0	0	109.7	P409 N424	S407-P409 WeakPolarHBondContact O-CD 3.38Å; S407-N424 WeakPolarHBondContact CB-OD1 3.33Å; S407-N424 PolarHBondContact OG-OD1 2.79Å
408	I	89.6	Confident	90.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118.9	-172.2	-48.8	169.6	0	0	0	109.3	M371 M380 F384 I386 V410 T422 L423 V425	M371-I408 HydrophobicContact CE-CG2 3.91Å; M371-I408 HydrophobicContact CG-CG2 4.04Å; M371-I408 HydrophobicContact SD-CG2 4.35Å; M380-I408 HydrophobicContact CE-CB 4.16Å; M380-I408 HydrophobicContact CE-CG1 3.65Å; F384-I408 HydrophobicContact CB-CD1 3.96Å; F384-I408 HydrophobicContact CD1-CD1 3.92Å; F384-I408 HydrophobicContact CD2-CD1 3.61Å; F384-I408 HydrophobicContact CD2-CG1 3.99Å; F384-I408 HydrophobicContact CE1-CD1 4.32Å; F384-I408 HydrophobicContact CE2-CD1 4.03Å; F384-I408 HydrophobicContact CE2-CG1 4.29Å; F384-I408 HydrophobicContact CG-CD1 3.54Å; F384-I408 HydrophobicContact CG-CG1 4.39Å; F384-I408 HydrophobicContact CZ-CD1 4.36Å; I386-I408 HydrophobicContact CD1-CG2 4.17Å; I408-V410 HydrophobicContact CG2-CG2 4.4Å; I408-T422 WeakPolarHBondContact O-CA 3.19Å; I408-L423 HydrophobicContact CB-CB 4.34Å; I408-L423 HydrophobicContact CD1-CD2 4.19Å; I408-L423 HydrophobicContact CD1-CG 4.39Å; I408-L423 PolarHBondContact N-O 3.13Å; I408-L423 PolarHBondContact O-N 2.84Å; I408-V425 HydrophobicContact CD1-CG2 3.68Å; I408-V425 HydrophobicContact CG1-CG2 4.36Å
409	P	90	Very high	90.1	Very high	29 Å²	29	54.4 Å²	54.4	19%	0.188	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	122.9	173.9	33.6	-33.5	0	0	0	109.3	M371 A372 S407	M371-P409 WeakPolarHBondContact CA-O 3.17Å; A372-P409 HydrophobicContact CB-CB 4.09Å; A372-P409 HydrophobicContact CB-CG 4.46Å; A372-P409 PolarHBondContact N-O 2.85Å; S407-P409 WeakPolarHBondContact O-CD 3.38Å
410	V	91.8	Very high	90.1	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.2	-174.9	-177.4	0	0	0	0	109.5	F334 L356 I386 I408 R420 T421 L423	F334-V410 HydrophobicContact CE1-CG1 4.14Å; F334-V410 HydrophobicContact CZ-CB 4.49Å; F334-V410 HydrophobicContact CZ-CG1 3.82Å; L356-V410 HydrophobicContact CD1-CG1 3.64Å; L356-V410 HydrophobicContact CD1-CG2 4.21Å; L356-V410 HydrophobicContact CD2-CG1 4.33Å; L356-V410 HydrophobicContact CD2-CG2 4.39Å; I386-V410 HydrophobicContact CD1-CG1 4.3Å; I386-V410 HydrophobicContact CD1-CG2 3.87Å; I408-V410 HydrophobicContact CG2-CG2 4.4Å; V410-R420 VanDerWaalsContact O-CA 3.25Å; V410-R420 WeakPolarHBondContact O-CA 3.38Å; V410-T421 HydrophobicContact CB-CG2 3.83Å; V410-T421 HydrophobicContact CG1-CG2 4.28Å; V410-T421 HydrophobicContact CG2-CG2 4.49Å; V410-T421 PolarHBondContact N-O 2.8Å; V410-T421 PolarHBondContact O-N 2.71Å; V410-L423 HydrophobicContact CG2-CB 4.15Å
411	E	92	Very high	90.2	Very high	28 Å²	28	57.4 Å²	57.4	13%	0.131	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127.5	178.3	178.5	153.7	-131.7	0	0	110.1	T370 A372 S418 A419 R420	T370-E411 PolarHBondContact N-O 2.86Å; T370-E411 PolarHBondContact O-N 2.97Å; T370-E411 PolarHBondContact OG1-O 3.35Å; A372-E411 HydrophobicContact CB-CB 3.85Å; E411-S418 PolarHBondContact OE1-OG 2.95Å; E411-A419 WeakPolarHBondContact CA-O 3.36Å; E411-R420 HydrophobicContact CB-CG 4.17Å; E411-R420 VanDerWaalsContact CD-NE 3.27Å; E411-R420 HydrophobicContact CG-CG 4.2Å; E411-R420 IonicContact OE1-CZ 3.8Å; E411-R420 IonicContact OE1-NE 3.46Å; E411-R420 PolarHBondContact OE1-NE 3.05Å; E411-R420 IonicContact OE1-NH2 3.9Å; E411-R420 PolarHBondContact OE1-NH2 2.63Å; E411-R420 IonicContact OE2-CZ 2.65Å; E411-R420 IonicContact OE2-NE 3.56Å; E411-R420 PolarHBondContact OE2-NE 3.35Å; E411-R420 IonicContact OE2-NH2 3.85Å; E411-R420 PolarHBondContact OE2-NH2 2.8Å
412	V	93	Very high	90.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.9	175.1	68	0	0	0	0	109.5	P332 F334 A358 L367 T368 Y369 S418 A419	P332-V412 HydrophobicContact CB-CG1 4.14Å; P332-V412 HydrophobicContact CG-CG1 4.28Å; F334-V412 HydrophobicContact CD2-CG1 4.16Å; F334-V412 HydrophobicContact CE1-CB 4.19Å; F334-V412 HydrophobicContact CE1-CG1 4.11Å; F334-V412 HydrophobicContact CE2-CB 4.14Å; F334-V412 HydrophobicContact CE2-CG1 3.5Å; F334-V412 VanDerWaalsContact CE2-CG1 3.5Å; F334-V412 HydrophobicContact CZ-CB 3.61Å; F334-V412 HydrophobicContact CZ-CG1 3.46Å; F334-V412 VanDerWaalsContact CZ-CG1 3.46Å; A358-V412 HydrophobicContact CB-CG1 4.06Å; A358-V412 HydrophobicContact CB-CG2 4.23Å; L367-V412 HydrophobicContact CB-CG2 4.14Å; L367-V412 HydrophobicContact CD2-CG2 4.37Å; T368-V412 WeakPolarHBondContact O-CA 3.28Å; Y369-V412 HydrophobicContact CD1-CB 3.87Å; Y369-V412 HydrophobicContact CD1-CG2 3.69Å; Y369-V412 HydrophobicContact CE1-CB 4.07Å; Y369-V412 HydrophobicContact CE1-CG2 3.65Å; Y369-V412 HydrophobicContact CG-CG2 4.17Å; V412-S418 CarbonylContact O-C 3.55Å; V412-S418 VanDerWaalsContact O-CA 3.22Å; V412-S418 WeakPolarHBondContact O-CA 3.28Å; V412-S418 WeakPolarHBondContact O-CB 3.46Å; V412-A419 HydrophobicContact CG1-CB 4.12Å; V412-A419 PolarHBondContact N-O 2.94Å; V412-A419 PolarHBondContact O-N 2.9Å
413	T	92	Very high	90.5	Very high	40 Å²	40	50 Å²	50	25%	0.245	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	142.4	176.1	-178.3	0	0	0	0	111.2	L367 T368 G415 F417	L367-T413 CarbonylContact C-O 3.25Å; L367-T413 WeakPolarHBondContact CA-O 3.47Å; T368-T413 PolarHBondContact N-O 2.84Å; T368-T413 PolarHBondContact O-N 2.91Å; T368-T413 WeakPolarHBondContact OG1-CG2 3.2Å; T368-T413 PolarHBondContact OG1-O 2.96Å; T413-G415 PolarHBondContact OG1-N 2.85Å; T413-F417 WeakPolarHBondContact CA-O 3.48Å; T413-F417 VanDerWaalsContact CB-O 3.28Å; T413-F417 WeakPolarHBondContact CB-O 3.44Å; T413-F417 PolarHBondContact OG1-O 2.8Å
414	D	91.1	Very high	90.7	Very high	14 Å²	14	47.8 Å²	47.8	8%	0.075	26%	0.263	C	S	.	.	S	Bend	trans	-84.7	-28	174.4	52	9.9	0	0	0	112.9	N328 L367 E416 F417	N328-D414 PolarHBondContact ND2-OD2 3.13Å; L367-D414 HydrophobicContact CD2-CB 4.14Å; D414-E416 PolarHBondContact OD1-N 3.03Å; D414-F417 PolarHBondContact OD1-N 2.9Å; D414-F417 WeakPolarHBondContact OD2-CD2 3.32Å
415	G	85.5	Confident	90.8	Very high	71 Å²	71	43.3 Å²	43.3	73%	0.732	24%	0.243	S	C	*	.	S	Bend	trans	134.3	-20.1	-172.2	0	0	0	0	0	114.8	T413	T413-G415 PolarHBondContact OG1-N 2.85Å
416	E	85.1	Confident	90.9	Very high	150 Å²	150	43.6 Å²	43.6	70%	0.701	24%	0.242	S	C	*	.	S	Bend	trans	-131.2	-34.8	-178.4	-171.3	154.6	176.1	0	0	113.2	D414	D414-E416 PolarHBondContact OD1-N 3.03Å
417	F	88.4	Confident	91.1	Very high	76 Å²	76	42.8 Å²	42.8	33%	0.333	24%	0.239	S	C	.	.			trans	-111.4	167.6	173	-56.6	-69.9	0	0	0	112.5	N328 N330 E331 T413 D414	N328-F417 WeakPolarHBondContact ND2-CD2 3.33Å; N330-F417 WeakPolarHBondContact O-CD2 3.32Å; N330-F417 WeakPolarHBondContact O-CE2 3.3Å; E331-F417 HydrophobicContact CB-CB 4.31Å; T413-F417 WeakPolarHBondContact CA-O 3.48Å; T413-F417 VanDerWaalsContact CB-O 3.28Å; T413-F417 WeakPolarHBondContact CB-O 3.44Å; T413-F417 PolarHBondContact OG1-O 2.8Å; D414-F417 PolarHBondContact OD1-N 2.9Å; D414-F417 WeakPolarHBondContact OD2-CD2 3.32Å
418	S	91.2	Very high	91.1	Very high	64 Å²	64	44 Å²	44	45%	0.448	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	143.6	173.7	69.3	0	0	0	0	112.9	E411 V412	E411-S418 PolarHBondContact OE1-OG 2.95Å; V412-S418 CarbonylContact O-C 3.55Å; V412-S418 VanDerWaalsContact O-CA 3.22Å; V412-S418 WeakPolarHBondContact O-CA 3.28Å; V412-S418 WeakPolarHBondContact O-CB 3.46Å
419	A	91.7	Very high	91.1	Very high	21 Å²	21	44.8 Å²	44.8	17%	0.174	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	159.3	174.2	0	0	0	0	0	111.5	P332 F334 E411 V412	P332-A419 WeakPolarHBondContact O-CB 3.18Å; F334-A419 HydrophobicContact CD2-CB 4.43Å; F334-A419 HydrophobicContact CE2-CB 4.46Å; E411-A419 WeakPolarHBondContact CA-O 3.36Å; V412-A419 HydrophobicContact CG1-CB 4.12Å; V412-A419 PolarHBondContact N-O 2.94Å; V412-A419 PolarHBondContact O-N 2.9Å
420	R	91.7	Very high	91	Very high	156 Å²	156	45.2 Å²	45.2	59%	0.589	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	147.1	-175.3	-64.7	-179	177.4	-157.7	-10.6	112.3	V410 E411	V410-R420 VanDerWaalsContact O-CA 3.25Å; V410-R420 WeakPolarHBondContact O-CA 3.38Å; E411-R420 HydrophobicContact CB-CG 4.17Å; E411-R420 VanDerWaalsContact CD-NE 3.27Å; E411-R420 HydrophobicContact CG-CG 4.2Å; E411-R420 IonicContact OE1-CZ 3.8Å; E411-R420 IonicContact OE1-NE 3.46Å; E411-R420 PolarHBondContact OE1-NE 3.05Å; E411-R420 IonicContact OE1-NH2 3.9Å; E411-R420 PolarHBondContact OE1-NH2 2.63Å; E411-R420 IonicContact OE2-CZ 2.65Å; E411-R420 IonicContact OE2-NE 3.56Å; E411-R420 PolarHBondContact OE2-NE 3.35Å; E411-R420 IonicContact OE2-NH2 3.85Å; E411-R420 PolarHBondContact OE2-NH2 2.8Å
421	T	92.5	Very high	90.7	Very high	9 Å²	9	46.4 Å²	46.4	6%	0.055	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	173.9	173.8	-167.8	0	0	0	0	109.4	F334 F336 T337 Y339 V410	F334-T421 HydrophobicContact CB-CG2 4.48Å; F334-T421 HydrophobicContact CD1-CG2 3.68Å; F334-T421 HydrophobicContact CD2-CG2 3.6Å; F334-T421 HydrophobicContact CE1-CG2 3.63Å; F334-T421 HydrophobicContact CE2-CG2 3.55Å; F334-T421 HydrophobicContact CG-CG2 3.65Å; F334-T421 HydrophobicContact CZ-CG2 3.57Å; F336-T421 PolarHBondContact O-OG1 3.11Å; F336-T421 VanDerWaalsContact O-OG1 3.05Å; T337-T421 VanDerWaalsContact C-OG1 3.31Å; T337-T421 PolarHBondContact O-OG1 2.73Å; T337-T421 VanDerWaalsContact O-OG1 3.09Å; Y339-T421 HydrophobicContact CD2-CG2 3.9Å; Y339-T421 HydrophobicContact CE2-CG2 3.76Å; V410-T421 HydrophobicContact CB-CG2 3.83Å; V410-T421 HydrophobicContact CG1-CG2 4.28Å; V410-T421 HydrophobicContact CG2-CG2 4.49Å; V410-T421 PolarHBondContact N-O 2.8Å; V410-T421 PolarHBondContact O-N 2.71Å
422	T	91.6	Very high	90.5	Very high	50 Å²	50	49.1 Å²	49.1	31%	0.307	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130	174.7	-55.5	0	0	0	0	110.1	V338 Y339 I408	V338-T422 WeakPolarHBondContact CA-O 3.16Å; Y339-T422 PolarHBondContact N-O 3.11Å; I408-T422 WeakPolarHBondContact O-CA 3.19Å
423	L	92.7	Very high	90.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	106.9	169.1	171.9	60.2	0	0	0	109.5	Y339 I341 Y354 V392 I408 V410 V425	Y339-L423 CarbonylContact O-C 3.52Å; Y339-L423 WeakPolarHBondContact O-CA 3.33Å; I341-L423 HydrophobicContact CD1-CD1 4.21Å; I341-L423 HydrophobicContact CG1-CD1 4.08Å; I341-L423 HydrophobicContact CG2-CD1 3.91Å; Y354-L423 HydrophobicContact CD1-CD1 4.37Å; V392-L423 HydrophobicContact CB-CD2 4.29Å; V392-L423 HydrophobicContact CG1-CD2 4.09Å; V392-L423 HydrophobicContact CG2-CD2 3.81Å; I408-L423 HydrophobicContact CB-CB 4.34Å; I408-L423 HydrophobicContact CD1-CD2 4.19Å; I408-L423 HydrophobicContact CD1-CG 4.39Å; I408-L423 PolarHBondContact N-O 3.13Å; I408-L423 PolarHBondContact O-N 2.84Å; V410-L423 HydrophobicContact CG2-CB 4.15Å; L423-V425 HydrophobicContact CG-CG2 4.27Å
424	N	92.5	Very high	90.1	Very high	41 Å²	41	54.3 Å²	54.3	22%	0.219	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	119.5	170.9	-61.1	-46.1	0	0	0	109.9	V338 Y339 N340 I341 Y406 S407	V338-N424 WeakPolarHBondContact CG1-ND2 3.32Å; Y339-N424 PolarHBondContact O-N 2.77Å; N340-N424 WeakPolarHBondContact CA-O 3.4Å; N340-N424 WeakPolarHBondContact OD1-CB 3.43Å; N340-N424 PolarHBondContact OD1-ND2 3.47Å; I341-N424 PolarHBondContact N-O 2.9Å; Y406-N424 CarbonylContact O-C 3.3Å; Y406-N424 VanDerWaalsContact O-CA 3.32Å; Y406-N424 WeakPolarHBondContact O-CA 3.18Å; S407-N424 WeakPolarHBondContact CB-OD1 3.33Å; S407-N424 PolarHBondContact OG-OD1 2.79Å
425	V	93	Very high	90.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	109.6	169.9	-170.6	0	0	0	0	107.4	I341 V343 I353 F384 I405 Y406 I408 L423	I341-V425 HydrophobicContact CD1-CB 4.48Å; I341-V425 HydrophobicContact CD1-CG1 4.19Å; I341-V425 HydrophobicContact CD1-CG2 3.91Å; I341-V425 HydrophobicContact CG1-CB 4.21Å; I341-V425 HydrophobicContact CG1-CG1 4.1Å; I341-V425 HydrophobicContact CG1-CG2 4.01Å; V343-V425 HydrophobicContact CB-CG1 4.15Å; V343-V425 HydrophobicContact CG2-CG1 3.84Å; I353-V425 HydrophobicContact CD1-CG2 4.36Å; F384-V425 HydrophobicContact CE1-CG1 4.31Å; F384-V425 HydrophobicContact CE1-CG2 4.09Å; F384-V425 HydrophobicContact CZ-CB 4.22Å; F384-V425 HydrophobicContact CZ-CG1 4.26Å; F384-V425 HydrophobicContact CZ-CG2 4.08Å; I405-V425 WeakPolarHBondContact CA-O 3.24Å; Y406-V425 PolarHBondContact N-O 3.46Å; Y406-V425 PolarHBondContact O-N 3.38Å; I408-V425 HydrophobicContact CD1-CG2 3.68Å; I408-V425 HydrophobicContact CG1-CG2 4.36Å; L423-V425 HydrophobicContact CG-CG2 4.27Å
426	Q	93.8	Very high	90.3	Very high	99 Å²	99	52.3 Å²	52.3	46%	0.463	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120	165.5	-179.3	178.6	-3.6	0	0	108.1	I341 S342 V343 I405	I341-Q426 PolarHBondContact O-N 2.77Å; S342-Q426 CarbonylContact C-O 3.54Å; S342-Q426 VanDerWaalsContact CA-O 3.28Å; S342-Q426 WeakPolarHBondContact CA-O 3.3Å; V343-Q426 PolarHBondContact N-O 2.79Å; I405-Q426 HydrophobicContact CG1-CB 4.39Å; I405-Q426 HydrophobicContact CG1-CG 4.46Å
427	V	93	Very high	90.5	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	134.5	170.1	-171.6	0	0	0	0	108.1	V343 E345 L398 Y400 R403 H404 Y406	V343-V427 CarbonylContact O-C 3.5Å; V343-V427 WeakPolarHBondContact O-CA 3.38Å; E345-V427 HydrophobicContact CB-CG1 3.67Å; L398-V427 HydrophobicContact CB-CG1 4.38Å; L398-V427 HydrophobicContact CD1-CG2 4.36Å; Y400-V427 HydrophobicContact CD2-CB 4.1Å; Y400-V427 HydrophobicContact CD2-CG1 4.15Å; R403-V427 VanDerWaalsContact O-CG2 3.28Å; R403-V427 WeakPolarHBondContact O-CG2 3.21Å; H404-V427 PolarHBondContact O-N 3.09Å; Y406-V427 HydrophobicContact CD2-CG2 4.07Å; Y406-V427 HydrophobicContact CE2-CG2 3.84Å
428	L	90.7	Very high	90.5	Very high	75 Å²	75	48.1 Å²	48.1	39%	0.393	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.9	170.2	-61.6	179.9	0	0	0	108.6	V343 A344 E345	V343-L428 PolarHBondContact O-N 2.84Å; A344-L428 WeakPolarHBondContact CA-O 3.46Å; E345-L428 PolarHBondContact N-O 3.46Å; E345-L428 VanDerWaalsContact N-O 3.11Å
429	D	90.2	Very high	90.3	Very high	17 Å²	17	49 Å²	49	9%	0.091	25%	0.253	C	S	.	.			trans	-43	130.9	167.2	-177.3	-21.4	0	0	0	113.2	E345 Y400 S466 V469	E345-D429 WeakPolarHBondContact OE1-CA 3.28Å; Y400-D429 HydrophobicContact CD1-CB 3.73Å; Y400-D429 HydrophobicContact CD2-CB 4Å; Y400-D429 HydrophobicContact CE1-CB 3.67Å; Y400-D429 HydrophobicContact CE2-CB 3.92Å; Y400-D429 HydrophobicContact CG-CB 3.91Å; D429-S466 WeakPolarHBondContact OD2-CA 3.2Å; D429-S466 WeakPolarHBondContact OD2-CB 3.07Å; D429-S466 PolarHBondContact OD2-N 3.24Å; D429-S466 PolarHBondContact OD2-OG 3.23Å; D429-V469 HydrophobicContact CB-CB 4.22Å; D429-V469 HydrophobicContact CB-CG2 3.77Å; D429-V469 VanDerWaalsContact CG-CG2 3.43Å; D429-V469 WeakPolarHBondContact OD1-CB 3.35Å; D429-V469 WeakPolarHBondContact OD1-CG1 3.27Å; D429-V469 WeakPolarHBondContact OD2-CB 3.35Å; D429-V469 WeakPolarHBondContact OD2-CG2 3.37Å
430	V	87.3	Confident	90.1	Very high	38 Å²	38	51 Å²	51	23%	0.23	26%	0.261	C	S	.	.			trans	-131.7	132.3	169.3	-176.8	0	0	0	0	109.9	A344 E345 D432	A344-V430 HydrophobicContact CB-CG2 3.95Å; E345-V430 HydrophobicContact CG-CB 4.38Å; E345-V430 PolarHBondContact OE1-N 3.38Å; V430-D432 PolarHBondContact O-N 3.29Å
431	N	86.9	Confident	89.8	Confident	24 Å²	24	44.8 Å²	44.8	13%	0.128	24%	0.241	C	C	.	.	S	Bend	trans	-60.9	88.9	177.8	-172.9	150.9	0	0	0	112.4	D465 V469 N470 D531 L550	N431-D465 VanDerWaalsContact CA-OD2 3.27Å; N431-D465 WeakPolarHBondContact CA-OD2 3.26Å; N431-V469 HydrophobicContact CB-CG1 4.07Å; N431-N470 WeakPolarHBondContact OD1-CB 2.91Å; N431-N470 PolarHBondContact OD1-ND2 2.78Å; N431-D531 PolarHBondContact ND2-OD2 2.67Å; N431-D531 VanDerWaalsContact OD1-CG 3.28Å; N431-D531 PolarHBondContact OD1-OD1 2.81Å; N431-D531 PolarHBondContact OD1-OD2 2.97Å; N431-L550 VanDerWaalsContact ND2-CD1 3.29Å; N431-L550 WeakPolarHBondContact ND2-CD1 3.46Å; N431-L550 WeakPolarHBondContact ND2-CG 3.49Å
432	D	86.6	Confident	89.6	Confident	85 Å²	85	52.2 Å²	52.2	46%	0.455	27%	0.273	S	S	.	.			trans	-131.6	-15	176	70.6	14.6	0	0	0	116.1	V430	V430-D432 PolarHBondContact O-N 3.29Å
433	E	86.7	Confident	89.5	Confident	98 Å²	98	57.4 Å²	57.4	46%	0.458	29%	0.293	S	S	.	.	S	Bend	trans	-88.4	133.2	164.5	-81.9	-69	157.3	0	0	111.9	P464 L550	E433-P464 HydrophobicContact CB-CB 4.38Å; E433-P464 HydrophobicContact CB-CG 3.83Å; E433-P464 HydrophobicContact CG-CG 4.27Å; E433-L550 WeakPolarHBondContact O-CD1 3.16Å
434	P	89.4	Confident	89.4	Confident	52 Å²	52	57.8 Å²	57.8	34%	0.338	30%	0.295	S	S	.	.			trans	-87.2	159	177.4	34.4	-35.6	0	0	0	113	A436 L550	P434-A436 PolarHBondContact O-N 3.05Å; P434-L550 HydrophobicContact CB-CB 3.94Å; P434-L550 HydrophobicContact CB-CD1 4.22Å
435	P	91.4	Very high	89.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.313	C	S	.	.			trans	-49.1	111.4	179.5	-29.7	31.3	0	0	0	114.6	I461 D463 V473 D531 S552	P435-I461 HydrophobicContact CB-CD1 3.69Å; P435-I461 HydrophobicContact CB-CG1 4.21Å; P435-D463 WeakPolarHBondContact CA-OD1 3.5Å; P435-D463 VanDerWaalsContact CD-OD1 3.25Å; P435-D463 WeakPolarHBondContact CD-OD1 3.23Å; P435-D463 WeakPolarHBondContact CG-OD1 3.41Å; P435-D463 VanDerWaalsContact N-OD1 3.1Å; P435-V473 HydrophobicContact CB-CG1 4.39Å; P435-V473 HydrophobicContact CB-CG2 4.16Å; P435-V473 HydrophobicContact CG-CG2 4.45Å; P435-D531 HydrophobicContact CG-CB 4.25Å; P435-S552 WeakPolarHBondContact O-CB 3.42Å; P435-S552 PolarHBondContact O-OG 2.77Å
436	A	90.1	Very high	89.3	Confident	42 Å²	42	61.4 Å²	61.4	35%	0.347	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	123.6	-170.9	0	0	0	0	0	112.5	P434 E438 I461 R462	P434-A436 PolarHBondContact O-N 3.05Å; A436-E438 PolarHBondContact O-N 2.85Å; A436-I461 WeakPolarHBondContact O-CA 3.15Å; A436-I461 WeakPolarHBondContact O-CG1 3.17Å; A436-R462 WeakPolarHBondContact CA-O 3.36Å; A436-R462 PolarHBondContact N-O 2.5Å; A436-R462 PolarHBondContact O-N 2.91Å
437	F	89.2	Confident	89.2	Confident	29 Å²	29	58.8 Å²	58.8	13%	0.127	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	86.4	176	-68.7	-85.3	0	0	0	111.7	L439 N440 V459 R460 I461 L527 S552 M554	F437-L439 PolarHBondContact O-N 3.21Å; F437-N440 HydrophobicContact CB-CB 3.85Å; F437-V459 HydrophobicContact CD1-CG1 3.66Å; F437-V459 HydrophobicContact CE1-CG1 3.87Å; F437-R460 CarbonylContact C-O 3.57Å; F437-R460 WeakPolarHBondContact CA-O 3.26Å; F437-I461 HydrophobicContact CD1-CB 3.88Å; F437-I461 HydrophobicContact CD1-CD1 3.97Å; F437-I461 HydrophobicContact CD1-CG1 3.99Å; F437-I461 HydrophobicContact CD2-CD1 4.28Å; F437-I461 HydrophobicContact CE1-CB 4.09Å; F437-I461 HydrophobicContact CE1-CD1 3.62Å; F437-I461 HydrophobicContact CE1-CG1 4.13Å; F437-I461 HydrophobicContact CE2-CD1 3.94Å; F437-I461 HydrophobicContact CG-CD1 4.29Å; F437-I461 HydrophobicContact CG-CG1 4.24Å; F437-I461 HydrophobicContact CZ-CD1 3.6Å; F437-I461 HydrophobicContact CZ-CG1 4.49Å; F437-L527 HydrophobicContact CE1-CD2 4.36Å; F437-S552 WeakPolarHBondContact CD2-OG 3.22Å; F437-S552 VanDerWaalsContact CE2-OG 3.29Å; F437-S552 WeakPolarHBondContact CE2-OG 3.45Å; F437-M554 HydrophobicContact CD1-CB 4.19Å; F437-M554 HydrophobicContact CD2-CB 4.48Å; F437-M554 HydrophobicContact CE1-CB 3.66Å; F437-M554 HydrophobicContact CE2-CB 3.99Å; F437-M554 HydrophobicContact CZ-CB 3.55Å
438	E	87.5	Confident	89.1	Confident	110 Å²	110	59 Å²	59	51%	0.514	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	-38.3	174.3	-69.9	-172.3	168.7	0	0	113.3	A436 R460 R462	A436-E438 PolarHBondContact O-N 2.85Å; E438-R460 HydrophobicContact CB-CB 4.43Å; E438-R460 HydrophobicContact CB-CG 4.37Å; E438-R460 PolarHBondContact N-O 3.01Å; E438-R460 VanDerWaalsContact N-O 3.1Å; E438-R460 IonicContact OE1-NH1 3.17Å; E438-R460 WeakPolarHBondContact OE2-CD 3.34Å; E438-R460 IonicContact OE2-CZ 3.66Å; E438-R460 IonicContact OE2-NE 3.44Å; E438-R460 PolarHBondContact OE2-NE 3.04Å; E438-R460 IonicContact OE2-NH1 4Å; E438-R460 PolarHBondContact OE2-NH1 3.36Å; E438-R462 WeakPolarHBondContact OE1-CD 3.46Å
439	L	88.3	Confident	89	Confident	82 Å²	82	58.5 Å²	58.5	43%	0.429	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	97.1	176.6	-173.9	67.5	0	0	0	109.2	F437 P441 R458 V459 R460	F437-L439 PolarHBondContact O-N 3.21Å; L439-P441 WeakPolarHBondContact O-CD 3.29Å; L439-R458 HydrophobicContact CD2-CB 3.92Å; L439-R458 HydrophobicContact CD2-CG 3.92Å; L439-R458 WeakPolarHBondContact CD2-O 3.4Å; L439-V459 WeakPolarHBondContact O-CA 3.3Å; L439-R460 HydrophobicContact CB-CB 3.74Å; L439-R460 PolarHBondContact N-O 3.47Å; L439-R460 PolarHBondContact O-N 3.4Å
440	N	86.5	Confident	88.9	Confident	62 Å²	62	57.8 Å²	57.8	33%	0.332	30%	0.298	S	S	.	.			trans	-118.8	88.8	-176.8	-168.6	-15.2	0	0	0	110.7	F437 K442	F437-N440 HydrophobicContact CB-CB 3.85Å; N440-K442 PolarHBondContact O-N 3.16Å
441	P	87.1	Confident	89	Confident	27 Å²	27	59.9 Å²	59.9	18%	0.175	31%	0.313	C	S	.	.			trans	-72.9	90.9	-179.9	29.7	-34.8	0	0	0	111	L439 Q443 L444 L504 M554 A556	L439-P441 WeakPolarHBondContact O-CD 3.29Å; P441-Q443 PolarHBondContact O-N 2.89Å; P441-Q443 VanDerWaalsContact O-N 3.16Å; P441-L444 HydrophobicContact CB-CD2 3.72Å; P441-L444 HydrophobicContact CB-CG 4.32Å; P441-L444 HydrophobicContact CG-CD2 3.85Å; P441-L444 HydrophobicContact CG-CG 4.44Å; P441-L504 HydrophobicContact CG-CD1 4.39Å; P441-M554 HydrophobicContact CG-CE 3.78Å; P441-A556 WeakPolarHBondContact O-CB 3.11Å
442	K	87.5	Confident	89.1	Confident	164 Å²	164	62.8 Å²	62.8	71%	0.713	33%	0.332	S	S	*	.	S	Bend	trans	-54.4	-32.7	178.7	-65.4	-176.8	178.8	179.2	0	113.7	N440 T557	N440-K442 PolarHBondContact O-N 3.16Å; K442-T557 PolarHBondContact O-N 2.81Å
443	Q	88.7	Confident	89.2	Confident	159 Å²	159	61.1 Å²	61.1	74%	0.743	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.2	172.8	-70.9	178.9	-13.4	0	0	109.1	P441 T557	P441-Q443 PolarHBondContact O-N 2.89Å; P441-Q443 VanDerWaalsContact O-N 3.16Å; Q443-T557 WeakPolarHBondContact CA-O 3.44Å
444	L	91.9	Very high	89.5	Confident	8 Å²	8	59.8 Å²	59.8	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.4	172.6	-67.4	167.9	0	0	0	107.5	P441 I456 L487 L504 I525 A556 T557 L558 S559	P441-L444 HydrophobicContact CB-CD2 3.72Å; P441-L444 HydrophobicContact CB-CG 4.32Å; P441-L444 HydrophobicContact CG-CD2 3.85Å; P441-L444 HydrophobicContact CG-CG 4.44Å; L444-I456 HydrophobicContact CB-CG2 4.07Å; L444-I456 HydrophobicContact CD2-CG2 4.41Å; L444-L487 HydrophobicContact CD1-CD1 3.93Å; L444-L504 HydrophobicContact CD1-CD1 3.6Å; L444-L504 HydrophobicContact CD2-CD1 4.22Å; L444-I525 HydrophobicContact CD1-CG1 4.49Å; L444-A556 HydrophobicContact CD1-CB 4.03Å; L444-A556 HydrophobicContact CG-CB 4.43Å; L444-T557 PolarHBondContact N-O 3.2Å; L444-L558 HydrophobicContact CB-CB 4.42Å; L444-L558 HydrophobicContact CB-CD1 3.84Å; L444-L558 WeakPolarHBondContact O-CA 3.3Å; L444-S559 PolarHBondContact O-N 2.78Å
445	I	91.6	Very high	89.6	Confident	116 Å²	116	62 Å²	62	60%	0.595	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.8	177.4	-57.4	175.8	0	0	0	108.2	S559 R561	I445-S559 WeakPolarHBondContact CA-O 3.31Å; I445-R561 HydrophobicContact CG2-CB 4.49Å
446	A	91.9	Very high	89.7	Confident	2 Å²	2	63.3 Å²	63.3	2%	0.017	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	138.2	172.3	0	0	0	0	0	109.2	I456 L510 L558 S559 I560 R561	A446-I456 HydrophobicContact CB-CD1 3.58Å; A446-I456 HydrophobicContact CB-CG1 4.14Å; A446-I456 HydrophobicContact CB-CG2 4.12Å; A446-L510 HydrophobicContact CB-CD1 3.46Å; A446-L510 VanDerWaalsContact CB-CD1 3.46Å; A446-L558 HydrophobicContact CB-CD1 3.89Å; A446-S559 PolarHBondContact N-O 2.61Å; A446-S559 VanDerWaalsContact N-O 3.08Å; A446-I560 CarbonylContact O-C 3.55Å; A446-I560 VanDerWaalsContact O-CA 3.31Å; A446-I560 WeakPolarHBondContact O-CA 3.41Å; A446-R561 PolarHBondContact O-N 2.91Å
447	D	90.9	Very high	89.7	Confident	44 Å²	44	62.1 Å²	62.1	24%	0.235	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	147.2	165.6	-31.3	-87.6	0	0	0	109	S450 K454 R561 V563	D447-S450 VanDerWaalsContact O-CB 3.24Å; D447-S450 WeakPolarHBondContact O-CB 3.43Å; D447-S450 PolarHBondContact O-OG 3.16Å; D447-K454 IonicContact OD2-NZ 3.83Å; D447-K454 PolarHBondContact OD2-NZ 3.38Å; D447-R561 IonicContact OD1-CZ 3.48Å; D447-R561 IonicContact OD1-NH1 3.88Å; D447-R561 PolarHBondContact OD1-NH1 3.16Å; D447-R561 IonicContact OD1-NH2 3.73Å; D447-R561 PolarHBondContact OD1-NH2 3.49Å; D447-V563 HydrophobicContact CB-CG2 4.15Å
448	E	90	Very high	89.9	Confident	5 Å²	5	66.3 Å²	66.3	2%	0.023	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	174.4	163.1	75	-165.1	134.8	0	0	112.2	S450 R512 I560 R561 D562 V563	E448-S450 PolarHBondContact O-N 2.92Å; E448-R512 WeakPolarHBondContact OE2-CB 3.31Å; E448-R512 PolarHBondContact OE2-N 2.84Å; E448-I560 HydrophobicContact CB-CG2 3.59Å; E448-R561 PolarHBondContact N-O 3.18Å; E448-D562 WeakPolarHBondContact OE1-CA 3.26Å; E448-V563 HydrophobicContact CG-CB 3.86Å; E448-V563 HydrophobicContact CG-CG2 4.09Å; E448-V563 PolarHBondContact OE1-N 3.42Å
449	N	88.8	Confident	90.1	Very high	65 Å²	65	61.1 Å²	61.1	35%	0.348	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	10.9	-166.1	-76.1	-78.5	0	0	0	113.8	P451 M509 L510 D565	N449-P451 WeakPolarHBondContact O-CD 3.23Å; N449-M509 WeakPolarHBondContact OD1-CE 3.38Å; N449-L510 PolarHBondContact N-O 2.96Å; N449-D565 PolarHBondContact ND2-OD2 2.82Å
450	S	88.6	Confident	90.4	Very high	2 Å²	2	61 Å²	61	1%	0.014	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-58.9	116.8	172.5	-78.9	0	0	0	0	109.6	D447 E448 K454 M509	D447-S450 VanDerWaalsContact O-CB 3.24Å; D447-S450 WeakPolarHBondContact O-CB 3.43Å; D447-S450 PolarHBondContact O-OG 3.16Å; E448-S450 PolarHBondContact O-N 2.92Å; S450-K454 VanDerWaalsContact OG-CD 3.24Å; S450-K454 WeakPolarHBondContact OG-CD 3.39Å; S450-K454 PolarHBondContact OG-NZ 3.32Å; S450-M509 WeakPolarHBondContact O-CA 3.42Å
451	P	88.7	Confident	90.6	Very high	82 Å²	82	58.1 Å²	58.1	53%	0.532	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-66.9	153	-177.6	28.1	-35.5	0	0	0	110.7	N449 G453 K454 T506	N449-P451 WeakPolarHBondContact O-CD 3.23Å; P451-G453 PolarHBondContact O-N 3.23Å; P451-K454 WeakPolarHBondContact O-CB 2.9Å; P451-K454 PolarHBondContact O-N 3.33Å; P451-T506 PolarHBondContact O-OG1 2.98Å
452	P	89	Confident	90.8	Very high	84 Å²	84	61.6 Å²	61.6	55%	0.545	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	137.9	173.8	-26.3	34	0	0	0	112.6	T506	P452-T506 CarbonylContact C-O 3.52Å; P452-T506 WeakPolarHBondContact CA-O 3.32Å; P452-T506 WeakPolarHBondContact CA-OG1 3.37Å
453	G	89.8	Confident	90.9	Very high	51 Å²	51	54.8 Å²	54.8	53%	0.526	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	-1.1	-177.9	0	0	0	0	0	115.7	P451 L455 T506	P451-G453 PolarHBondContact O-N 3.23Å; G453-L455 PolarHBondContact O-N 2.77Å; G453-T506 PolarHBondContact N-O 2.86Å; G453-T506 PolarHBondContact N-OG1 2.93Å; G453-T506 VanDerWaalsContact N-OG1 3.07Å
454	K	91.7	Very high	91	Very high	69 Å²	69	49.9 Å²	49.9	30%	0.3	27%	0.268	S	S	.	.			trans	-68.1	125.7	172.9	-174.9	-175.4	178.7	173.8	0	110	D447 S450 P451 I456 T505 T506	D447-K454 IonicContact OD2-NZ 3.83Å; D447-K454 PolarHBondContact OD2-NZ 3.38Å; S450-K454 VanDerWaalsContact OG-CD 3.24Å; S450-K454 WeakPolarHBondContact OG-CD 3.39Å; S450-K454 PolarHBondContact OG-NZ 3.32Å; P451-K454 WeakPolarHBondContact O-CB 2.9Å; P451-K454 PolarHBondContact O-N 3.33Å; K454-I456 HydrophobicContact CB-CD1 4.42Å; K454-I456 HydrophobicContact CD-CD1 4Å; K454-I456 HydrophobicContact CG-CD1 4Å; K454-I456 PolarHBondContact O-N 3.32Å; K454-T505 CarbonylContact O-C 3.57Å; K454-T505 WeakPolarHBondContact O-CA 3.46Å; K454-T506 HydrophobicContact CB-CG2 4.42Å; K454-T506 PolarHBondContact N-OG1 3.21Å; K454-T506 PolarHBondContact O-N 3.07Å
455	L	92.7	Very high	90.8	Very high	98 Å²	98	49.8 Å²	49.8	51%	0.513	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	123.5	175.7	-174.9	70.2	0	0	0	110.5	G453 G457 D503 T505	G453-L455 PolarHBondContact O-N 2.77Å; L455-G457 WeakPolarHBondContact CD1-O 3.48Å; L455-D503 HydrophobicContact CD1-CB 3.7Å; L455-T505 HydrophobicContact CB-CG2 4.45Å; L455-T505 HydrophobicContact CD1-CG2 4.13Å
456	I	92.6	Very high	90.5	Very high	28 Å²	28	45 Å²	45	14%	0.144	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-28.5	-178.9	-54.1	-50.9	0	0	0	111.6	L444 A446 K454 L487 L504 T506 L558	L444-I456 HydrophobicContact CB-CG2 4.07Å; L444-I456 HydrophobicContact CD2-CG2 4.41Å; A446-I456 HydrophobicContact CB-CD1 3.58Å; A446-I456 HydrophobicContact CB-CG1 4.14Å; A446-I456 HydrophobicContact CB-CG2 4.12Å; K454-I456 HydrophobicContact CB-CD1 4.42Å; K454-I456 HydrophobicContact CD-CD1 4Å; K454-I456 HydrophobicContact CG-CD1 4Å; K454-I456 PolarHBondContact O-N 3.32Å; I456-L487 HydrophobicContact CG1-CD2 4Å; I456-L504 PolarHBondContact N-O 2.91Å; I456-T506 HydrophobicContact CD1-CG2 4.1Å; I456-T506 HydrophobicContact CG1-CG2 4Å; I456-L558 HydrophobicContact CG2-CD1 4.01Å
457	G	91.6	Very high	90	Very high	18 Å²	18	49 Å²	49	19%	0.186	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.4	-173	179.4	0	0	0	0	0	112.6	L455 L504	L455-G457 WeakPolarHBondContact CD1-O 3.48Å; G457-L504 PolarHBondContact N-O 2.92Å; G457-L504 WeakPolarHBondContact O-CB 3.42Å; G457-L504 PolarHBondContact O-N 3.17Å
458	R	93.4	Very high	89.4	Confident	117 Å²	117	51.6 Å²	51.6	44%	0.442	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	144.3	178.2	177.7	173.1	-73	166.9	-0	109.8	L439 V501 Y502 D503	L439-R458 HydrophobicContact CD2-CB 3.92Å; L439-R458 HydrophobicContact CD2-CG 3.92Å; L439-R458 WeakPolarHBondContact CD2-O 3.4Å; R458-V501 HydrophobicContact CG-CG1 3.73Å; R458-Y502 WeakPolarHBondContact CA-O 3.4Å; R458-D503 IonicContact CZ-OD1 2.78Å; R458-D503 IonicContact CZ-OD2 3.18Å; R458-D503 IonicContact NE-OD1 2.93Å; R458-D503 PolarHBondContact NE-OD1 2.8Å; R458-D503 IonicContact NE-OD2 2.89Å; R458-D503 VanDerWaalsContact NH2-CG 3.29Å; R458-D503 IonicContact NH2-OD1 3.8Å; R458-D503 PolarHBondContact NH2-OD1 3.17Å; R458-D503 IonicContact NH2-OD2 3.48Å; R458-D503 PolarHBondContact NH2-OD2 3.03Å
459	V	91.9	Very high	88.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	140.5	171.1	-171.5	0	0	0	0	108.2	F437 L439 V501 Y502 L504 M554	F437-V459 HydrophobicContact CD1-CG1 3.66Å; F437-V459 HydrophobicContact CE1-CG1 3.87Å; L439-V459 WeakPolarHBondContact O-CA 3.3Å; V459-V501 WeakPolarHBondContact O-CA 3.44Å; V459-Y502 PolarHBondContact N-O 3.37Å; V459-Y502 PolarHBondContact O-N 2.83Å; V459-L504 HydrophobicContact CG2-CD1 3.8Å; V459-L504 HydrophobicContact CG2-CD2 3.79Å; V459-L504 HydrophobicContact CG2-CG 3.89Å; V459-M554 HydrophobicContact CB-SD 4.17Å; V459-M554 HydrophobicContact CG1-SD 3.62Å; V459-M554 HydrophobicContact CG2-CE 3.73Å; V459-M554 HydrophobicContact CG2-SD 3.4Å; V459-M554 WeakPolarHBondContact CG2-SD 3.18Å
460	R	93.5	Very high	88.6	Confident	80 Å²	80	50.8 Å²	50.8	30%	0.302	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	130.7	168	-173	167.4	-170.3	-144.3	9	108.9	F437 E438 L439 E500 V501	F437-R460 CarbonylContact C-O 3.57Å; F437-R460 WeakPolarHBondContact CA-O 3.26Å; E438-R460 HydrophobicContact CB-CB 4.43Å; E438-R460 HydrophobicContact CB-CG 4.37Å; E438-R460 PolarHBondContact N-O 3.01Å; E438-R460 VanDerWaalsContact N-O 3.1Å; E438-R460 IonicContact OE1-NH1 3.17Å; E438-R460 WeakPolarHBondContact OE2-CD 3.34Å; E438-R460 IonicContact OE2-CZ 3.66Å; E438-R460 IonicContact OE2-NE 3.44Å; E438-R460 PolarHBondContact OE2-NE 3.04Å; E438-R460 IonicContact OE2-NH1 4Å; E438-R460 PolarHBondContact OE2-NH1 3.36Å; L439-R460 HydrophobicContact CB-CB 3.74Å; L439-R460 PolarHBondContact N-O 3.47Å; L439-R460 PolarHBondContact O-N 3.4Å; R460-E500 VanDerWaalsContact CA-O 3.32Å; R460-E500 WeakPolarHBondContact CA-O 3.25Å; R460-E500 IonicContact NE-OE2 3.17Å; R460-E500 IonicContact NH2-OE2 3.88Å; R460-V501 HydrophobicContact CB-CG2 4.41Å; R460-V501 HydrophobicContact CG-CG2 4Å
461	I	91.1	Very high	88.3	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.5	178.6	-165.7	176.4	0	0	0	110.1	P435 A436 F437 V473 E500 C529	P435-I461 HydrophobicContact CB-CD1 3.69Å; P435-I461 HydrophobicContact CB-CG1 4.21Å; A436-I461 WeakPolarHBondContact O-CA 3.15Å; A436-I461 WeakPolarHBondContact O-CG1 3.17Å; F437-I461 HydrophobicContact CD1-CB 3.88Å; F437-I461 HydrophobicContact CD1-CD1 3.97Å; F437-I461 HydrophobicContact CD1-CG1 3.99Å; F437-I461 HydrophobicContact CD2-CD1 4.28Å; F437-I461 HydrophobicContact CE1-CB 4.09Å; F437-I461 HydrophobicContact CE1-CD1 3.62Å; F437-I461 HydrophobicContact CE1-CG1 4.13Å; F437-I461 HydrophobicContact CE2-CD1 3.94Å; F437-I461 HydrophobicContact CG-CD1 4.29Å; F437-I461 HydrophobicContact CG-CG1 4.24Å; F437-I461 HydrophobicContact CZ-CD1 3.6Å; F437-I461 HydrophobicContact CZ-CG1 4.49Å; I461-V473 HydrophobicContact CD1-CG1 4.08Å; I461-V473 HydrophobicContact CG2-CG1 4.34Å; I461-E500 PolarHBondContact N-O 2.74Å; I461-C529 HydrophobicContact CD1-CB 3.42Å; I461-C529 VanDerWaalsContact CD1-CB 3.42Å; I461-C529 WeakPolarHBondContact CD1-SG 3.44Å
462	R	90.4	Very high	88.2	Confident	100 Å²	100	51 Å²	51	38%	0.377	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	151.5	175.5	-70.2	-176.2	155.8	-153.9	-18.5	109.6	A436 E438 E500	A436-R462 WeakPolarHBondContact CA-O 3.36Å; A436-R462 PolarHBondContact N-O 2.5Å; A436-R462 PolarHBondContact O-N 2.91Å; E438-R462 WeakPolarHBondContact OE1-CD 3.46Å; R462-E500 IonicContact CZ-OE2 3.39Å; R462-E500 IonicContact NE-OE2 3.35Å; R462-E500 PolarHBondContact NE-OE2 3.4Å; R462-E500 IonicContact NH2-OE1 2.75Å; R462-E500 PolarHBondContact NH2-OE1 2.97Å; R462-E500 IonicContact NH2-OE2 2.91Å; R462-E500 PolarHBondContact NH2-OE2 3.28Å
463	D	90.6	Very high	88.1	Confident	21 Å²	21	47.7 Å²	47.7	11%	0.112	27%	0.266	C	S	.	.			trans	-90.3	144.9	158	-90.1	-46.3	0	0	0	109	P435 V473	P435-D463 WeakPolarHBondContact CA-OD1 3.5Å; P435-D463 VanDerWaalsContact CD-OD1 3.25Å; P435-D463 WeakPolarHBondContact CD-OD1 3.23Å; P435-D463 WeakPolarHBondContact CG-OD1 3.41Å; P435-D463 VanDerWaalsContact N-OD1 3.1Å; D463-V473 HydrophobicContact CB-CG2 4.27Å; D463-V473 VanDerWaalsContact OD2-CG2 3.27Å; D463-V473 WeakPolarHBondContact OD2-CG2 3.44Å
464	P	89.7	Confident	88.1	Confident	56 Å²	56	46.9 Å²	46.9	36%	0.364	25%	0.248	S	C	.	.	S	Bend	trans	-69.2	-44.8	165.8	-19.1	35.1	0	0	0	112	E401 E433	E401-P464 HydrophobicContact CG-CB 3.41Å; E401-P464 VanDerWaalsContact CG-CB 3.41Å; E433-P464 HydrophobicContact CB-CB 4.38Å; E433-P464 HydrophobicContact CB-CG 3.83Å; E433-P464 HydrophobicContact CG-CG 4.27Å
465	D	89.3	Confident	88.1	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.027	23%	0.234	C	C	.	.	S	Bend	trans	-48.2	157.1	-176.6	-53.5	14.2	0	0	0	114	N431 G471	N431-D465 VanDerWaalsContact CA-OD2 3.27Å; N431-D465 WeakPolarHBondContact CA-OD2 3.26Å; D465-G471 WeakPolarHBondContact O-CA 3.39Å
466	S	85	Confident	87.9	Confident	16 Å²	16	41.6 Å²	41.6	11%	0.112	23%	0.228	C	C	.	.			trans	-72	151.9	174.2	78.9	0	0	0	0	112.6	D429 S468 V469 N470 G471	D429-S466 WeakPolarHBondContact OD2-CA 3.2Å; D429-S466 WeakPolarHBondContact OD2-CB 3.07Å; D429-S466 PolarHBondContact OD2-N 3.24Å; D429-S466 PolarHBondContact OD2-OG 3.23Å; S466-S468 PolarHBondContact O-N 3.05Å; S466-S468 PolarHBondContact OG-N 2.69Å; S466-S468 PolarHBondContact OG-OG 3.38Å; S466-V469 CarbonylContact O-C 3.53Å; S466-V469 WeakPolarHBondContact O-CA 3.29Å; S466-V469 PolarHBondContact O-N 3.11Å; S466-V469 PolarHBondContact OG-N 2.87Å; S466-N470 PolarHBondContact O-N 2.82Å; S466-G471 PolarHBondContact O-N 2.96Å
467	P	81.9	Confident	87.6	Confident	86 Å²	86	40.7 Å²	40.7	56%	0.558	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-54.8	-24.9	171.8	-31.9	38.5	0	0	0	115.5	L472	P467-L472 HydrophobicContact CB-CD1 4.02Å; P467-L472 HydrophobicContact CB-CD2 4.02Å; P467-L472 HydrophobicContact CB-CG 3.77Å; P467-L472 HydrophobicContact CG-CD2 4.15Å; P467-L472 HydrophobicContact CG-CG 4.35Å
468	S	77.6	Confident	87.2	Confident	98 Å²	98	40.9 Å²	40.9	69%	0.685	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-68.2	-39.4	171.9	8.2	0	0	0	0	111.9	S466 K547	S466-S468 PolarHBondContact O-N 3.05Å; S466-S468 PolarHBondContact OG-N 2.69Å; S466-S468 PolarHBondContact OG-OG 3.38Å; S468-K547 PolarHBondContact O-NZ 3.15Å
469	V	80.2	Confident	86.2	Confident	31 Å²	31	41.5 Å²	41.5	19%	0.188	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-109.1	49.3	-175.4	-164.2	0	0	0	0	109.4	D429 N431 S466 G471 K547	D429-V469 HydrophobicContact CB-CB 4.22Å; D429-V469 HydrophobicContact CB-CG2 3.77Å; D429-V469 VanDerWaalsContact CG-CG2 3.43Å; D429-V469 WeakPolarHBondContact OD1-CB 3.35Å; D429-V469 WeakPolarHBondContact OD1-CG1 3.27Å; D429-V469 WeakPolarHBondContact OD2-CB 3.35Å; D429-V469 WeakPolarHBondContact OD2-CG2 3.37Å; N431-V469 HydrophobicContact CB-CG1 4.07Å; S466-V469 CarbonylContact O-C 3.53Å; S466-V469 WeakPolarHBondContact O-CA 3.29Å; S466-V469 PolarHBondContact O-N 3.11Å; S466-V469 PolarHBondContact OG-N 2.87Å; V469-G471 VanDerWaalsContact C-N 3.32Å; V469-G471 PolarHBondContact O-N 2.76Å; V469-K547 VanDerWaalsContact CA-NZ 3.29Å
470	N	80.7	Confident	85.1	Confident	22 Å²	22	44.7 Å²	44.7	12%	0.118	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	75	-2.3	167.4	-94.9	12.6	0	0	0	116.9	N431 S466 L472 D531 G532 K547	N431-N470 WeakPolarHBondContact OD1-CB 2.91Å; N431-N470 PolarHBondContact OD1-ND2 2.78Å; S466-N470 PolarHBondContact O-N 2.82Å; N470-L472 PolarHBondContact O-N 3.12Å; N470-D531 HydrophobicContact CB-CB 4.13Å; N470-D531 PolarHBondContact ND2-OD1 3.29Å; N470-G532 WeakPolarHBondContact O-CA 3.38Å; N470-G532 PolarHBondContact O-N 2.81Å; N470-G532 VanDerWaalsContact OD1-CA 3.29Å; N470-G532 WeakPolarHBondContact OD1-CA 3.49Å; N470-K547 WeakPolarHBondContact ND2-CE 3.48Å; N470-K547 VanDerWaalsContact OD1-CE 3.3Å; N470-K547 WeakPolarHBondContact OD1-CE 3.38Å; N470-K547 PolarHBondContact OD1-NZ 3.15Å
471	G	82.9	Confident	84	Confident	12 Å²	12	43.4 Å²	43.4	12%	0.124	27%	0.273	C	S	.	.			trans	-67.1	37.7	175.2	0	0	0	0	0	117	D465 S466 V469	D465-G471 WeakPolarHBondContact O-CA 3.39Å; S466-G471 PolarHBondContact O-N 2.96Å; V469-G471 VanDerWaalsContact C-N 3.32Å; V469-G471 PolarHBondContact O-N 2.76Å
472	L	85.7	Confident	82.9	Confident	76 Å²	76	46 Å²	46	40%	0.398	29%	0.288	S	S	.	.	S	Bend	trans	-119.4	97.7	167.7	-70.5	176.4	0	0	0	108	P467 N470 G532 V533	P467-L472 HydrophobicContact CB-CD1 4.02Å; P467-L472 HydrophobicContact CB-CD2 4.02Å; P467-L472 HydrophobicContact CB-CG 3.77Å; P467-L472 HydrophobicContact CG-CD2 4.15Å; P467-L472 HydrophobicContact CG-CG 4.35Å; N470-L472 PolarHBondContact O-N 3.12Å; L472-G532 CarbonylContact O-C 3.58Å; L472-G532 PolarHBondContact O-N 3.38Å; L472-V533 HydrophobicContact CB-CG2 3.6Å; L472-V533 HydrophobicContact CD1-CG2 3.89Å; L472-V533 HydrophobicContact CG-CG2 4.41Å
473	V	88.5	Confident	81.7	Confident	16 Å²	16	52.7 Å²	52.7	10%	0.097	31%	0.313	C	S	.	.			trans	-60.5	136.1	-179.8	-173.9	0	0	0	0	112.4	P435 I461 D463 C475 N498 C529	P435-V473 HydrophobicContact CB-CG1 4.39Å; P435-V473 HydrophobicContact CB-CG2 4.16Å; P435-V473 HydrophobicContact CG-CG2 4.45Å; I461-V473 HydrophobicContact CD1-CG1 4.08Å; I461-V473 HydrophobicContact CG2-CG1 4.34Å; D463-V473 HydrophobicContact CB-CG2 4.27Å; D463-V473 VanDerWaalsContact OD2-CG2 3.27Å; D463-V473 WeakPolarHBondContact OD2-CG2 3.44Å; V473-C475 VanDerWaalsContact CG1-SG 3.58Å; V473-N498 WeakPolarHBondContact O-CA 3.29Å; V473-C529 HydrophobicContact CG1-CB 3.67Å
474	E	89.1	Confident	80.6	Confident	33 Å²	33	59.9 Å²	59.9	15%	0.154	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112	163.1	-68.3	-176.2	148.2	0	0	109.8	P497 C529 S530 G532 V533 L534 R549	E474-P497 HydrophobicContact CB-CB 4.49Å; E474-C529 WeakPolarHBondContact O-CA 3.29Å; E474-S530 PolarHBondContact N-O 2.86Å; E474-S530 PolarHBondContact O-N 2.89Å; E474-G532 VanDerWaalsContact OE2-O 3.09Å; E474-V533 HydrophobicContact CG-CG2 4.49Å; E474-V533 WeakPolarHBondContact OE1-CA 3.47Å; E474-L534 PolarHBondContact OE1-N 3.1Å; E474-L534 PolarHBondContact OE2-N 2.78Å; E474-R549 IonicContact OE2-CZ 3.18Å; E474-R549 IonicContact OE2-NH1 2.71Å; E474-R549 PolarHBondContact OE2-NH1 2.81Å; E474-R549 IonicContact OE2-NH2 2.69Å; E474-R549 PolarHBondContact OE2-NH2 3.46Å; E474-R549 VanDerWaalsContact OE2-NH2 3.07Å
475	C	91.4	Very high	79.9	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.014	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	151.1	177.9	-68.4	0	0	0	0	113.8	V473 P497 Y502 L527 I528 C529	V473-C475 VanDerWaalsContact CG1-SG 3.58Å; C475-P497 PolarHBondContact N-O 2.69Å; C475-P497 WeakPolarHBondContact O-CB 3.08Å; C475-Y502 HydrophobicContact CB-CE2 3.97Å; C475-L527 HydrophobicContact CB-CD1 4.33Å; C475-L527 HydrophobicContact CB-CD2 4.45Å; C475-L527 HydrophobicContact CB-CG 4.43Å; C475-I528 CarbonylContact C-O 3.54Å; C475-I528 WeakPolarHBondContact CA-O 3.43Å; C475-C529 HydrophobicContact CB-CB 4.09Å; C475-C529 WeakPolarHBondContact CB-SG 3.45Å; C475-C529 WeakPolarHBondContact SG-CB 3.48Å; C475-C529 CovalentContact SG-SG 2.04Å; C475-C529 PolarHBondContact SG-SG 2.87Å
476	S	89.4	Confident	79.7	Confident	55 Å²	55	57.5 Å²	57.5	39%	0.385	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	149.7	179.5	61.9	0	0	0	0	113.7	I528	S476-I528 PolarHBondContact N-O 2.84Å; S476-I528 PolarHBondContact O-N 2.82Å; S476-I528 VanDerWaalsContact O-N 3.07Å
477	E	86.1	Confident	79.9	Confident	9 Å²	9	56.7 Å²	56.7	4%	0.042	32%	0.318	C	S	.	.			trans	-78.8	136.2	166.5	-69.9	-165.7	-114	0	0	110.6	V482 Q485 F489 R507	E477-V482 HydrophobicContact CB-CG2 3.95Å; E477-Q485 WeakPolarHBondContact OE2-CB 3.27Å; E477-Q485 VanDerWaalsContact OE2-CG 3.29Å; E477-Q485 WeakPolarHBondContact OE2-CG 3.34Å; E477-F489 HydrophobicContact CG-CD2 3.79Å; E477-F489 HydrophobicContact CG-CE2 3.67Å; E477-R507 IonicContact OE1-CZ 3.3Å; E477-R507 IonicContact OE1-NH2 3.61Å; E477-R507 PolarHBondContact OE1-NH2 2.72Å; E477-R507 IonicContact OE2-NH2 3.35Å; E477-R507 PolarHBondContact OE2-NH2 2.74Å
478	P	81.8	Confident	80.2	Confident	21 Å²	21	54.6 Å²	54.6	14%	0.136	30%	0.302	C	S	.	.			trans	-57.7	130.1	177.3	-27	36.4	0	0	0	111.9	G480 L481 V482 I528	P478-G480 PolarHBondContact O-N 3.25Å; P478-L481 HydrophobicContact CB-CB 4.35Å; P478-L481 HydrophobicContact CB-CD1 4.1Å; P478-L481 HydrophobicContact CB-CG 4.24Å; P478-L481 HydrophobicContact CG-CD1 4.05Å; P478-L481 PolarHBondContact O-N 3.18Å; P478-V482 WeakPolarHBondContact O-CG2 3.5Å; P478-V482 PolarHBondContact O-N 2.95Å; P478-I528 HydrophobicContact CB-CD1 4.48Å; P478-I528 HydrophobicContact CG-CD1 3.85Å; P478-I528 HydrophobicContact CG-CG1 4.07Å
479	P	73.8	Confident	80.8	Confident	130 Å²	130	50.1 Å²	50.1	84%	0.844	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.2	-171.2	-30.6	36.1	0	0	0	116.3
480	G	69.5	Low	81.3	Confident	68 Å²	68	52.7 Å²	52.7	70%	0.701	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-16	174.6	0	0	0	0	0	114.8	P478	P478-G480 PolarHBondContact O-N 3.25Å
481	L	70.2	Confident	81.8	Confident	53 Å²	53	54 Å²	54	28%	0.277	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-21.6	-174.9	-64.9	-179.2	0	0	0	114	P478 R483 R484 Q485 Y526	P478-L481 HydrophobicContact CB-CB 4.35Å; P478-L481 HydrophobicContact CB-CD1 4.1Å; P478-L481 HydrophobicContact CB-CG 4.24Å; P478-L481 HydrophobicContact CG-CD1 4.05Å; P478-L481 PolarHBondContact O-N 3.18Å; L481-R483 PolarHBondContact O-N 3.25Å; L481-R484 CarbonylContact O-C 3.57Å; L481-R484 WeakPolarHBondContact O-CA 3.48Å; L481-R484 PolarHBondContact O-N 3Å; L481-Q485 WeakPolarHBondContact O-CB 2.9Å; L481-Q485 PolarHBondContact O-N 2.62Å; L481-Y526 HydrophobicContact CD1-CD2 3.33Å; L481-Y526 HydrophobicContact CD1-CE2 4.03Å; L481-Y526 HydrophobicContact CD1-CG 3.71Å
482	V	67	Low	82	Confident	55 Å²	55	56.1 Å²	56.1	33%	0.333	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-27.2	-178.2	-167.2	0	0	0	0	114.3	E477 P478	E477-V482 HydrophobicContact CB-CG2 3.95Å; P478-V482 WeakPolarHBondContact O-CG2 3.5Å; P478-V482 PolarHBondContact O-N 2.95Å
483	R	64.5	Low	82.1	Confident	242 Å²	242	52.6 Å²	52.6	91%	0.913	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-6.4	177.2	-66.7	-171.3	177.1	-163.5	-0.4	115.8	L481	L481-R483 PolarHBondContact O-N 3.25Å
484	R	68.6	Low	81.9	Confident	172 Å²	172	56.5 Å²	56.5	65%	0.649	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.1	-6.6	-176.8	-74.1	-174.6	157.3	-165.5	-9.7	113.4	L481 A486 E516	L481-R484 CarbonylContact O-C 3.57Å; L481-R484 WeakPolarHBondContact O-CA 3.48Å; L481-R484 PolarHBondContact O-N 3Å; R484-A486 PolarHBondContact O-N 3.1Å; R484-A486 VanDerWaalsContact O-N 3.16Å; R484-E516 IonicContact CZ-OE2 2.92Å; R484-E516 IonicContact NE-OE2 3.88Å; R484-E516 IonicContact NH2-OE2 3.79Å; R484-E516 PolarHBondContact NH2-OE2 3.28Å
485	Q	75	Confident	81.8	Confident	5 Å²	5	60.6 Å²	60.6	2%	0.023	33%	0.334	C	S	.	.			trans	-70.9	103.8	176.2	-165.5	109.6	-15.2	0	0	109.2	E477 L481 L487 F489 R507 Y526	E477-Q485 WeakPolarHBondContact OE2-CB 3.27Å; E477-Q485 VanDerWaalsContact OE2-CG 3.29Å; E477-Q485 WeakPolarHBondContact OE2-CG 3.34Å; L481-Q485 WeakPolarHBondContact O-CB 2.9Å; L481-Q485 PolarHBondContact O-N 2.62Å; Q485-L487 WeakPolarHBondContact CG-O 3.37Å; Q485-L487 PolarHBondContact O-N 3.35Å; Q485-L487 VanDerWaalsContact O-N 3.15Å; Q485-F489 HydrophobicContact CG-CE2 4.48Å; Q485-R507 VanDerWaalsContact O-CD 3.31Å; Q485-R507 WeakPolarHBondContact O-CD 3.47Å; Q485-R507 PolarHBondContact O-NE 2.72Å; Q485-Y526 VanDerWaalsContact NE2-N 3.19Å; Q485-Y526 PolarHBondContact NE2-O 3.08Å
486	A	84.3	Confident	81.6	Confident	5 Å²	5	63.8 Å²	63.8	4%	0.041	35%	0.351	C	S	.	.	S	Bend	trans	-68	-12.2	-174.3	0	0	0	0	0	114.6	R484 R507 I508 L510 L523	R484-A486 PolarHBondContact O-N 3.1Å; R484-A486 VanDerWaalsContact O-N 3.16Å; A486-R507 WeakPolarHBondContact O-CB 3.12Å; A486-R507 PolarHBondContact O-N 2.78Å; A486-I508 HydrophobicContact CB-CD1 4.26Å; A486-I508 HydrophobicContact CB-CG1 4.28Å; A486-L510 HydrophobicContact CB-CD2 3.92Å; A486-L523 HydrophobicContact CB-CD1 3.52Å
487	L	89.5	Confident	81.4	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	142.6	170.5	-54.3	-176	0	0	0	111	L444 I456 Q485 L504 T505 T506 R507 I525 L558	L444-L487 HydrophobicContact CD1-CD1 3.93Å; I456-L487 HydrophobicContact CG1-CD2 4Å; Q485-L487 WeakPolarHBondContact CG-O 3.37Å; Q485-L487 PolarHBondContact O-N 3.35Å; Q485-L487 VanDerWaalsContact O-N 3.15Å; L487-L504 HydrophobicContact CD1-CB 4.09Å; L487-T505 CarbonylContact C-O 3.52Å; L487-T505 WeakPolarHBondContact CA-O 3.38Å; L487-T505 WeakPolarHBondContact CB-O 3.37Å; L487-T506 HydrophobicContact CD2-CG2 4.11Å; L487-R507 PolarHBondContact O-NH2 3.19Å; L487-I525 HydrophobicContact CB-CD1 4.21Å; L487-I525 HydrophobicContact CD1-CD1 4.05Å; L487-I525 HydrophobicContact CD1-CG1 3.94Å; L487-I525 HydrophobicContact CG-CD1 3.81Å; L487-I525 HydrophobicContact CG-CG1 4.28Å; L487-L558 HydrophobicContact CD1-CD2 4.32Å; L487-L558 HydrophobicContact CD2-CD2 4.03Å; L487-L558 HydrophobicContact CG-CD2 4.11Å
488	N	88.8	Confident	81.5	Confident	42 Å²	42	66 Å²	66	23%	0.225	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	142.4	158.9	-68.5	-44.5	0	0	0	108.7	T505 R507	N488-T505 PolarHBondContact N-O 3.06Å; N488-T505 PolarHBondContact O-N 2.04Å; N488-R507 VanDerWaalsContact OD1-CG 3.26Å; N488-R507 WeakPolarHBondContact OD1-CG 3.46Å; N488-R507 PolarHBondContact OD1-NE 2.89Å; N488-R507 PolarHBondContact OD1-NH1 3.16Å
489	F	89.9	Confident	81.7	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.018	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	137.8	155.5	-55.2	-93.3	0	0	0	108.1	E477 Q485 P491 D492 P493 Y502 D503 L504 I525 Y526 L527	E477-F489 HydrophobicContact CG-CD2 3.79Å; E477-F489 HydrophobicContact CG-CE2 3.67Å; Q485-F489 HydrophobicContact CG-CE2 4.48Å; F489-P491 CarbonylContact C-O 3.57Å; F489-P491 VanDerWaalsContact C-O 3.31Å; F489-P491 CarbonylContact O-C 3.59Å; F489-P491 VanDerWaalsContact O-O 3.14Å; F489-D492 PolarHBondContact O-N 3.2Å; F489-P493 HydrophobicContact CB-CG 3.89Å; F489-P493 HydrophobicContact CD2-CG 4.18Å; F489-P493 HydrophobicContact CG-CG 4.16Å; F489-Y502 HydrophobicContact CB-CD1 3.86Å; F489-Y502 HydrophobicContact CB-CG 4.25Å; F489-Y502 HydrophobicContact CD1-CG 4.42Å; F489-D503 CarbonylContact C-O 3.25Å; F489-L504 HydrophobicContact CD1-CD2 3.26Å; F489-L504 HydrophobicContact CE1-CD2 3.43Å; F489-L504 VanDerWaalsContact CE1-CD2 3.43Å; F489-L504 HydrophobicContact CG-CD2 4.14Å; F489-L504 HydrophobicContact CZ-CD2 4.41Å; F489-I525 HydrophobicContact CE1-CG2 4.48Å; F489-I525 HydrophobicContact CZ-CG2 3.94Å; F489-Y526 WeakPolarHBondContact CZ-O 3.47Å; F489-L527 HydrophobicContact CD1-CD1 4.23Å; F489-L527 HydrophobicContact CD1-CD2 4.19Å; F489-L527 HydrophobicContact CD2-CD1 4.31Å; F489-L527 HydrophobicContact CE1-CB 3.87Å; F489-L527 HydrophobicContact CE1-CD1 3.98Å; F489-L527 HydrophobicContact CE1-CD2 3.95Å; F489-L527 HydrophobicContact CE1-CG 4.15Å; F489-L527 HydrophobicContact CE2-CD1 4.06Å; F489-L527 HydrophobicContact CG-CD1 4.41Å; F489-L527 HydrophobicContact CZ-CB 3.79Å; F489-L527 HydrophobicContact CZ-CD1 3.9Å; F489-L527 HydrophobicContact CZ-CG 4.3Å
490	L	90	Very high	82.4	Confident	85 Å²	85	64 Å²	64	45%	0.445	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.7	173.6	-65.1	-179.7	0	0	0	109.4	Y502 D503 T505	L490-Y502 WeakPolarHBondContact O-CA 3.09Å; L490-D503 HydrophobicContact CB-CB 4.38Å; L490-D503 PolarHBondContact N-O 3.4Å; L490-D503 PolarHBondContact O-N 2.91Å; L490-T505 HydrophobicContact CD1-CG2 3.73Å; L490-T505 WeakPolarHBondContact CD1-OG1 3.4Å
491	P	92.1	Very high	83.5	Confident	49 Å²	49	63.1 Å²	63.1	32%	0.318	32%	0.322	S	S	.	.	S	Bend	cis	-66.4	162.4	-0.5	31.8	-37	0	0	0	112.9	F489 P493 N496 A499 Y502	F489-P491 CarbonylContact C-O 3.57Å; F489-P491 VanDerWaalsContact C-O 3.31Å; F489-P491 CarbonylContact O-C 3.59Å; F489-P491 VanDerWaalsContact O-O 3.14Å; P491-P493 WeakPolarHBondContact O-CD 3.44Å; P491-N496 HydrophobicContact CB-CB 4.02Å; P491-N496 HydrophobicContact CG-CB 4.01Å; P491-A499 HydrophobicContact CG-CB 3.58Å; P491-Y502 HydrophobicContact CG-CD1 4.37Å; P491-Y502 HydrophobicContact CG-CE1 4.17Å; P491-Y502 WeakPolarHBondContact O-CD1 3.15Å; P491-Y502 VanDerWaalsContact O-CE1 3.3Å; P491-Y502 WeakPolarHBondContact O-CE1 3.39Å
492	D	86.7	Confident	84.6	Confident	57 Å²	57	60.6 Å²	60.6	31%	0.305	31%	0.308	S	S	.	.			trans	-65.3	123.6	175.3	-175.1	-44.8	0	0	0	109.7	F489 T494 V495 N496	F489-D492 PolarHBondContact O-N 3.2Å; D492-T494 PolarHBondContact O-N 2.74Å; D492-T494 VanDerWaalsContact O-N 3.15Å; D492-T494 WeakPolarHBondContact OD1-CA 3.45Å; D492-T494 WeakPolarHBondContact OD1-CB 3.43Å; D492-T494 PolarHBondContact OD1-N 2.77Å; D492-T494 PolarHBondContact OD1-OG1 3.1Å; D492-V495 HydrophobicContact CB-CB 4.18Å; D492-V495 HydrophobicContact CB-CG2 3.96Å; D492-V495 WeakPolarHBondContact O-CA 3.37Å; D492-V495 PolarHBondContact O-N 3.07Å; D492-N496 PolarHBondContact O-N 3.38Å
493	P	88.5	Confident	85.9	Confident	2 Å²	2	60 Å²	60	1%	0.013	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22	-178.1	-23.3	33.2	0	0	0	113.6	F489 P491 V495 P497 Y502 L527	F489-P493 HydrophobicContact CB-CG 3.89Å; F489-P493 HydrophobicContact CD2-CG 4.18Å; F489-P493 HydrophobicContact CG-CG 4.16Å; P491-P493 WeakPolarHBondContact O-CD 3.44Å; P493-V495 VanDerWaalsContact C-N 3.3Å; P493-P497 WeakPolarHBondContact O-CA 3.08Å; P493-P497 VanDerWaalsContact O-CB 3.31Å; P493-P497 WeakPolarHBondContact O-CB 3.4Å; P493-P497 WeakPolarHBondContact O-CD 3.43Å; P493-P497 VanDerWaalsContact O-N 3.15Å; P493-Y502 HydrophobicContact CB-CE1 4.23Å; P493-Y502 HydrophobicContact CG-CD1 4.23Å; P493-Y502 HydrophobicContact CG-CE1 3.77Å; P493-L527 HydrophobicContact CB-CD1 4.49Å; P493-L527 HydrophobicContact CG-CD1 3.97Å
494	T	84.6	Confident	87.3	Confident	97 Å²	97	48.5 Å²	48.5	60%	0.595	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.8	174.3	71.2	0	0	0	0	113.1	D492	D492-T494 PolarHBondContact O-N 2.74Å; D492-T494 VanDerWaalsContact O-N 3.15Å; D492-T494 WeakPolarHBondContact OD1-CA 3.45Å; D492-T494 WeakPolarHBondContact OD1-CB 3.43Å; D492-T494 PolarHBondContact OD1-N 2.77Å; D492-T494 PolarHBondContact OD1-OG1 3.1Å
495	V	85.2	Confident	88.4	Confident	120 Å²	120	40.7 Å²	40.7	73%	0.727	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-35.6	179	-178	0	0	0	0	111.5	D492 P493	D492-V495 HydrophobicContact CB-CB 4.18Å; D492-V495 HydrophobicContact CB-CG2 3.96Å; D492-V495 WeakPolarHBondContact O-CA 3.37Å; D492-V495 PolarHBondContact O-N 3.07Å; P493-V495 VanDerWaalsContact C-N 3.3Å
496	N	87.6	Confident	89.2	Confident	69 Å²	69	40.5 Å²	40.5	37%	0.369	23%	0.23	S	C	.	.			trans	-137.5	80.3	173.5	-173.6	13.8	0	0	0	110.3	P491 D492 N498 Y502	P491-N496 HydrophobicContact CB-CB 4.02Å; P491-N496 HydrophobicContact CG-CB 4.01Å; D492-N496 PolarHBondContact O-N 3.38Å; N496-N498 PolarHBondContact O-N 2.86Å; N496-Y502 PolarHBondContact O-OH 2.84Å; N496-Y502 VanDerWaalsContact O-OH 3.07Å
497	P	86.5	Confident	89.3	Confident	39 Å²	39	43.2 Å²	43.2	25%	0.253	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.4	179.1	18.5	-25.4	0	0	0	113.6	E474 C475 P493 Y502	E474-P497 HydrophobicContact CB-CB 4.49Å; C475-P497 PolarHBondContact N-O 2.69Å; C475-P497 WeakPolarHBondContact O-CB 3.08Å; P493-P497 WeakPolarHBondContact O-CA 3.08Å; P493-P497 VanDerWaalsContact O-CB 3.31Å; P493-P497 WeakPolarHBondContact O-CB 3.4Å; P493-P497 WeakPolarHBondContact O-CD 3.43Å; P493-P497 VanDerWaalsContact O-N 3.15Å; P497-Y502 PolarHBondContact O-OH 3.37Å
498	N	87.5	Confident	89.1	Confident	71 Å²	71	47.4 Å²	47.4	38%	0.38	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	25.2	-171.8	-56.8	58.4	0	0	0	113.3	V473 N496 V533	V473-N498 WeakPolarHBondContact O-CA 3.29Å; N496-N498 PolarHBondContact O-N 2.86Å; N498-V533 WeakPolarHBondContact ND2-CG2 3.25Å
499	A	86.9	Confident	89.1	Confident	15 Å²	15	50.4 Å²	50.4	12%	0.124	28%	0.275	C	S	.	.			trans	-83.9	124.2	178.7	0	0	0	0	0	111.9	P491 V501 Y502	P491-A499 HydrophobicContact CG-CB 3.58Å; A499-V501 PolarHBondContact O-N 3.12Å; A499-Y502 HydrophobicContact CB-CD1 4.48Å; A499-Y502 HydrophobicContact CB-CE1 3.86Å; A499-Y502 HydrophobicContact CB-CE2 4.25Å; A499-Y502 WeakPolarHBondContact O-CE2 3.43Å
500	E	88.1	Confident	89	Confident	93 Å²	93	50.4 Å²	50.4	44%	0.435	28%	0.275	S	S	.	.	S	Bend	trans	-59.3	-26.6	172.9	-68.9	-171.8	-143.2	0	0	113.4	R460 I461 R462	R460-E500 VanDerWaalsContact CA-O 3.32Å; R460-E500 WeakPolarHBondContact CA-O 3.25Å; R460-E500 IonicContact NE-OE2 3.17Å; R460-E500 IonicContact NH2-OE2 3.88Å; I461-E500 PolarHBondContact N-O 2.74Å; R462-E500 IonicContact CZ-OE2 3.39Å; R462-E500 IonicContact NE-OE2 3.35Å; R462-E500 PolarHBondContact NE-OE2 3.4Å; R462-E500 IonicContact NH2-OE1 2.75Å; R462-E500 PolarHBondContact NH2-OE1 2.97Å; R462-E500 IonicContact NH2-OE2 2.91Å; R462-E500 PolarHBondContact NH2-OE2 3.28Å
501	V	92.4	Very high	89	Confident	51 Å²	51	49.8 Å²	49.8	31%	0.309	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	130.6	-170.1	179.1	0	0	0	0	109.9	R458 V459 R460 A499	R458-V501 HydrophobicContact CG-CG1 3.73Å; V459-V501 WeakPolarHBondContact O-CA 3.44Å; R460-V501 HydrophobicContact CB-CG2 4.41Å; R460-V501 HydrophobicContact CG-CG2 4Å; A499-V501 PolarHBondContact O-N 3.12Å
502	Y	93.1	Very high	89	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.4	173.8	-65.5	-79.7	0	0	0	110.4	R458 V459 C475 F489 L490 P491 P493 N496 P497 A499 L527	R458-Y502 WeakPolarHBondContact CA-O 3.4Å; V459-Y502 PolarHBondContact N-O 3.37Å; V459-Y502 PolarHBondContact O-N 2.83Å; C475-Y502 HydrophobicContact CB-CE2 3.97Å; F489-Y502 HydrophobicContact CB-CD1 3.86Å; F489-Y502 HydrophobicContact CB-CG 4.25Å; F489-Y502 HydrophobicContact CD1-CG 4.42Å; L490-Y502 WeakPolarHBondContact O-CA 3.09Å; P491-Y502 HydrophobicContact CG-CD1 4.37Å; P491-Y502 HydrophobicContact CG-CE1 4.17Å; P491-Y502 WeakPolarHBondContact O-CD1 3.15Å; P491-Y502 VanDerWaalsContact O-CE1 3.3Å; P491-Y502 WeakPolarHBondContact O-CE1 3.39Å; P493-Y502 HydrophobicContact CB-CE1 4.23Å; P493-Y502 HydrophobicContact CG-CD1 4.23Å; P493-Y502 HydrophobicContact CG-CE1 3.77Å; N496-Y502 PolarHBondContact O-OH 2.84Å; N496-Y502 VanDerWaalsContact O-OH 3.07Å; P497-Y502 PolarHBondContact O-OH 3.37Å; A499-Y502 HydrophobicContact CB-CD1 4.48Å; A499-Y502 HydrophobicContact CB-CE1 3.86Å; A499-Y502 HydrophobicContact CB-CE2 4.25Å; A499-Y502 WeakPolarHBondContact O-CE2 3.43Å; Y502-L527 HydrophobicContact CD2-CD2 3.99Å; Y502-L527 HydrophobicContact CE2-CD2 4.24Å
503	D	93.9	Very high	89.1	Confident	42 Å²	42	47.4 Å²	47.4	23%	0.225	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	126	170.1	-89.1	-20.8	0	0	0	110.2	L455 R458 F489 L490	L455-D503 HydrophobicContact CD1-CB 3.7Å; R458-D503 IonicContact CZ-OD1 2.78Å; R458-D503 IonicContact CZ-OD2 3.18Å; R458-D503 IonicContact NE-OD1 2.93Å; R458-D503 PolarHBondContact NE-OD1 2.8Å; R458-D503 IonicContact NE-OD2 2.89Å; R458-D503 VanDerWaalsContact NH2-CG 3.29Å; R458-D503 IonicContact NH2-OD1 3.8Å; R458-D503 PolarHBondContact NH2-OD1 3.17Å; R458-D503 IonicContact NH2-OD2 3.48Å; R458-D503 PolarHBondContact NH2-OD2 3.03Å; F489-D503 CarbonylContact C-O 3.25Å; L490-D503 HydrophobicContact CB-CB 4.38Å; L490-D503 PolarHBondContact N-O 3.4Å; L490-D503 PolarHBondContact O-N 2.91Å
504	L	93.5	Very high	88.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	108.7	-177.8	-57.7	-177.8	0	0	0	109.6	P441 L444 I456 G457 V459 L487 F489 M554	P441-L504 HydrophobicContact CG-CD1 4.39Å; L444-L504 HydrophobicContact CD1-CD1 3.6Å; L444-L504 HydrophobicContact CD2-CD1 4.22Å; I456-L504 PolarHBondContact N-O 2.91Å; G457-L504 PolarHBondContact N-O 2.92Å; G457-L504 WeakPolarHBondContact O-CB 3.42Å; G457-L504 PolarHBondContact O-N 3.17Å; V459-L504 HydrophobicContact CG2-CD1 3.8Å; V459-L504 HydrophobicContact CG2-CD2 3.79Å; V459-L504 HydrophobicContact CG2-CG 3.89Å; L487-L504 HydrophobicContact CD1-CB 4.09Å; F489-L504 HydrophobicContact CD1-CD2 3.26Å; F489-L504 HydrophobicContact CE1-CD2 3.43Å; F489-L504 VanDerWaalsContact CE1-CD2 3.43Å; F489-L504 HydrophobicContact CG-CD2 4.14Å; F489-L504 HydrophobicContact CZ-CD2 4.41Å; L504-M554 HydrophobicContact CD1-CE 4.35Å
505	T	92.6	Very high	88.6	Confident	9 Å²	9	51.5 Å²	51.5	6%	0.055	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	152	-179.9	56.2	0	0	0	0	111.7	K454 L455 L487 N488 L490 R507	K454-T505 CarbonylContact O-C 3.57Å; K454-T505 WeakPolarHBondContact O-CA 3.46Å; L455-T505 HydrophobicContact CB-CG2 4.45Å; L455-T505 HydrophobicContact CD1-CG2 4.13Å; L487-T505 CarbonylContact C-O 3.52Å; L487-T505 WeakPolarHBondContact CA-O 3.38Å; L487-T505 WeakPolarHBondContact CB-O 3.37Å; N488-T505 PolarHBondContact N-O 3.06Å; N488-T505 PolarHBondContact O-N 2.04Å; L490-T505 HydrophobicContact CD1-CG2 3.73Å; L490-T505 WeakPolarHBondContact CD1-OG1 3.4Å; T505-R507 PolarHBondContact O-N 2.77Å
506	T	90.8	Very high	88.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	125.3	175.5	42.6	0	0	0	0	112.1	P451 P452 G453 K454 I456 L487 L510	P451-T506 PolarHBondContact O-OG1 2.98Å; P452-T506 CarbonylContact C-O 3.52Å; P452-T506 WeakPolarHBondContact CA-O 3.32Å; P452-T506 WeakPolarHBondContact CA-OG1 3.37Å; G453-T506 PolarHBondContact N-O 2.86Å; G453-T506 PolarHBondContact N-OG1 2.93Å; G453-T506 VanDerWaalsContact N-OG1 3.07Å; K454-T506 HydrophobicContact CB-CG2 4.42Å; K454-T506 PolarHBondContact N-OG1 3.21Å; K454-T506 PolarHBondContact O-N 3.07Å; I456-T506 HydrophobicContact CD1-CG2 4.1Å; I456-T506 HydrophobicContact CG1-CG2 4Å; L487-T506 HydrophobicContact CD2-CG2 4.11Å; T506-L510 HydrophobicContact CG2-CD1 3.86Å; T506-L510 HydrophobicContact CG2-CG 3.97Å
507	R	87.1	Confident	87.4	Confident	62 Å²	62	49.9 Å²	49.9	23%	0.234	26%	0.263	C	S	.	.	S	Bend	trans	-81.1	-37.8	175.2	-174.6	-177.5	-52.3	-101.6	22.1	111.7	E477 Q485 A486 L487 N488 T505	E477-R507 IonicContact OE1-CZ 3.3Å; E477-R507 IonicContact OE1-NH2 3.61Å; E477-R507 PolarHBondContact OE1-NH2 2.72Å; E477-R507 IonicContact OE2-NH2 3.35Å; E477-R507 PolarHBondContact OE2-NH2 2.74Å; Q485-R507 VanDerWaalsContact O-CD 3.31Å; Q485-R507 WeakPolarHBondContact O-CD 3.47Å; Q485-R507 PolarHBondContact O-NE 2.72Å; A486-R507 WeakPolarHBondContact O-CB 3.12Å; A486-R507 PolarHBondContact O-N 2.78Å; L487-R507 PolarHBondContact O-NH2 3.19Å; N488-R507 VanDerWaalsContact OD1-CG 3.26Å; N488-R507 WeakPolarHBondContact OD1-CG 3.46Å; N488-R507 PolarHBondContact OD1-NE 2.89Å; N488-R507 PolarHBondContact OD1-NH1 3.16Å; T505-R507 PolarHBondContact O-N 2.77Å
508	I	85.4	Confident	86.5	Confident	89 Å²	89	53.8 Å²	53.8	46%	0.456	29%	0.288	S	S	.	.	S	Bend	trans	-123.1	170.1	179.2	57	173.8	0	0	0	109.4	A486 L510	A486-I508 HydrophobicContact CB-CD1 4.26Å; A486-I508 HydrophobicContact CB-CG1 4.28Å; I508-L510 HydrophobicContact CG1-CD2 4.48Å
509	M	87.7	Confident	85.7	Confident	105 Å²	105	52.7 Å²	52.7	52%	0.517	28%	0.281	S	S	.	.			trans	-67.4	133.6	161.6	-163	171.4	88.7	0	0	107.7	N449 S450	N449-M509 WeakPolarHBondContact OD1-CE 3.38Å; S450-M509 WeakPolarHBondContact O-CA 3.42Å
510	L	88.8	Confident	85	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.016	30%	0.303	C	S	.	.			trans	-84	145.5	178.3	-60.8	-179.3	0	0	0	110.6	A446 N449 A486 T506 I508 L558	A446-L510 HydrophobicContact CB-CD1 3.46Å; A446-L510 VanDerWaalsContact CB-CD1 3.46Å; N449-L510 PolarHBondContact N-O 2.96Å; A486-L510 HydrophobicContact CB-CD2 3.92Å; T506-L510 HydrophobicContact CG2-CD1 3.86Å; T506-L510 HydrophobicContact CG2-CG 3.97Å; I508-L510 HydrophobicContact CG1-CD2 4.48Å; L510-L558 HydrophobicContact CD1-CD2 4.33Å
511	D	89.8	Confident	84.7	Confident	73 Å²	73	51.9 Å²	51.9	39%	0.39	28%	0.284	S	S	.	.			trans	-146.2	123.1	-172.4	173.9	-33.5	0	0	0	105	E513 D514 I560	D511-E513 PolarHBondContact OD1-N 3.34Å; D511-E513 VanDerWaalsContact OD1-N 3.12Å; D511-D514 HydrophobicContact CB-CB 4.35Å; D511-D514 PolarHBondContact OD1-N 2.98Å; D511-I560 WeakPolarHBondContact O-CD1 3.31Å
512	R	91.8	Very high	84.3	Confident	22 Å²	22	53.2 Å²	53.2	8%	0.083	29%	0.286	C	S	.	.	S	Bend	trans	-83.6	-30.3	-174.7	-168.1	-159.8	68	103.6	9.6	111.4	E448 G521 I560 D562 S597 D598 E599	E448-R512 WeakPolarHBondContact OE2-CB 3.31Å; E448-R512 PolarHBondContact OE2-N 2.84Å; R512-G521 VanDerWaalsContact CG-CA 3.44Å; R512-G521 PolarHBondContact O-N 2.95Å; R512-G521 VanDerWaalsContact O-N 3.15Å; R512-I560 HydrophobicContact CB-CB 4.39Å; R512-I560 HydrophobicContact CB-CG2 3.88Å; R512-I560 HydrophobicContact CG-CB 4.29Å; R512-I560 HydrophobicContact CG-CG2 4.25Å; R512-D562 IonicContact CZ-OD1 2.82Å; R512-D562 IonicContact NE-OD1 3.95Å; R512-D562 PolarHBondContact NE-OD1 3.42Å; R512-D562 IonicContact NH2-OD1 3.82Å; R512-S597 PolarHBondContact NH2-O 2.54Å; R512-D598 PolarHBondContact NH2-O 2.79Å; R512-E599 IonicContact CZ-OE2 3.44Å; R512-E599 IonicContact NH1-OE2 3.75Å; R512-E599 PolarHBondContact NH1-OE2 2.83Å
513	E	89.3	Confident	83.9	Confident	34 Å²	34	54.4 Å²	54.4	16%	0.159	29%	0.293	C	S	.	.	S	Bend	trans	-81.4	-17.5	-176.4	-69.3	62.7	-132.3	0	0	114.2	D511 P515 H566 S597	D511-E513 PolarHBondContact OD1-N 3.34Å; D511-E513 VanDerWaalsContact OD1-N 3.12Å; E513-P515 WeakPolarHBondContact O-CD 3.19Å; E513-H566 IonicContact OE2-CE1 2.85Å; E513-H566 PolarHBondContact OE2-CE1 2.84Å; E513-H566 IonicContact OE2-ND1 2.86Å; E513-S597 VanDerWaalsContact CG-CB 3.45Å
514	D	84.5	Confident	83.4	Confident	55 Å²	55	55.7 Å²	55.7	29%	0.294	30%	0.299	S	S	.	.			trans	-46.2	112.7	-174.8	174.2	7	0	0	0	112	D511 E516 N517	D511-D514 HydrophobicContact CB-CB 4.35Å; D511-D514 PolarHBondContact OD1-N 2.98Å; D514-E516 PolarHBondContact O-N 3.18Å; D514-E516 PolarHBondContact OD1-N 2.99Å; D514-N517 VanDerWaalsContact O-CB 3.25Å; D514-N517 WeakPolarHBondContact O-CB 3.34Å; D514-N517 PolarHBondContact O-N 2.81Å; D514-N517 PolarHBondContact O-ND2 3.02Å
515	P	79.2	Confident	83.1	Confident	129 Å²	129	55.8 Å²	55.8	84%	0.838	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-2.2	-174.2	31.6	-37	0	0	0	114.2	E513	E513-P515 WeakPolarHBondContact O-CD 3.19Å
516	E	74.2	Confident	82.9	Confident	127 Å²	127	58.5 Å²	58.5	59%	0.593	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-14.5	164.3	-73.3	-153.8	-160.6	0	0	112.7	R484 D514 P518	R484-E516 IonicContact CZ-OE2 2.92Å; R484-E516 IonicContact NE-OE2 3.88Å; R484-E516 IonicContact NH2-OE2 3.79Å; R484-E516 PolarHBondContact NH2-OE2 3.28Å; D514-E516 PolarHBondContact O-N 3.18Å; D514-E516 PolarHBondContact OD1-N 2.99Å; E516-P518 WeakPolarHBondContact O-CD 3.3Å
517	N	71.7	Confident	82.9	Confident	29 Å²	29	58.5 Å²	58.5	16%	0.155	31%	0.309	C	S	.	.	S	Bend	trans	-75.6	122.8	178.9	-66.2	-30.2	0	0	0	111.7	D514 I519 L523	D514-N517 VanDerWaalsContact O-CB 3.25Å; D514-N517 WeakPolarHBondContact O-CB 3.34Å; D514-N517 PolarHBondContact O-N 2.81Å; D514-N517 PolarHBondContact O-ND2 3.02Å; N517-I519 PolarHBondContact O-N 3.25Å; N517-I519 VanDerWaalsContact O-N 3.1Å; N517-L523 VanDerWaalsContact OD1-CD2 3.31Å; N517-L523 WeakPolarHBondContact OD1-CD2 3.5Å
518	P	68.5	Low	83	Confident	120 Å²	120	58.7 Å²	58.7	78%	0.779	31%	0.314	S	S	*	.	S	Bend	trans	-64.6	-17.1	-179.3	-23.1	34.3	0	0	0	114.7	E516	E516-P518 WeakPolarHBondContact O-CD 3.3Å
519	I	70.7	Confident	83.3	Confident	48 Å²	48	54.5 Å²	54.5	25%	0.246	29%	0.292	C	S	.	.	S	Bend	trans	-140.6	118.6	176.9	-48.7	164.5	0	0	0	105.4	N517 G521 H522 V1278	N517-I519 PolarHBondContact O-N 3.25Å; N517-I519 VanDerWaalsContact O-N 3.1Å; I519-G521 PolarHBondContact O-N 2.85Å; I519-H522 HydrophobicContact CB-CB 4Å; I519-H522 HydrophobicContact CG2-CB 3.82Å; I519-H522 PolarHBondContact O-N 3.07Å; I519-V1278 HydrophobicContact CD1-CB 4.08Å; I519-V1278 HydrophobicContact CD1-CG1 3.8Å; I519-V1278 HydrophobicContact CD1-CG2 4.15Å
520	P	72.8	Confident	83.4	Confident	89 Å²	89	50.5 Å²	50.5	58%	0.578	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	138.3	175.7	-27.2	35.8	0	0	0	111.3	H522	P520-H522 PolarHBondContact O-N 2.8Å
521	G	80	Confident	83.3	Confident	3 Å²	3	50.4 Å²	50.4	3%	0.031	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	2.3	-178.3	0	0	0	0	0	117.7	R512 I519 I560	R512-G521 VanDerWaalsContact CG-CA 3.44Å; R512-G521 PolarHBondContact O-N 2.95Å; R512-G521 VanDerWaalsContact O-N 3.15Å; I519-G521 PolarHBondContact O-N 2.85Å; G521-I560 PolarHBondContact O-N 3.01Å
522	H	84.2	Confident	82.4	Confident	79 Å²	79	46.9 Å²	46.9	37%	0.366	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	112.5	-175.3	-68.5	-53.2	0	0	0	113.4	I519 P520 L558 S559	I519-H522 HydrophobicContact CB-CB 4Å; I519-H522 HydrophobicContact CG2-CB 3.82Å; I519-H522 PolarHBondContact O-N 3.07Å; P520-H522 PolarHBondContact O-N 2.8Å; H522-L558 WeakPolarHBondContact CA-O 3.18Å; H522-S559 PolarHBondContact CE1-OG 2.85Å; H522-S559 PolarHBondContact ND1-OG 2.65Å
523	L	84.5	Confident	80.8	Confident	25 Å²	25	48.5 Å²	48.5	13%	0.131	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	152.1	178.1	-70.7	175.8	0	0	0	111.5	A486 N517 T557 L558 I560	A486-L523 HydrophobicContact CB-CD1 3.52Å; N517-L523 VanDerWaalsContact OD1-CD2 3.31Å; N517-L523 WeakPolarHBondContact OD1-CD2 3.5Å; L523-T557 CarbonylContact O-C 3.55Å; L523-T557 WeakPolarHBondContact O-CA 3.22Å; L523-L558 HydrophobicContact CB-CB 4.19Å; L523-L558 HydrophobicContact CB-CD2 4.47Å; L523-L558 HydrophobicContact CD1-CD2 4.36Å; L523-L558 PolarHBondContact N-O 3.21Å; L523-L558 PolarHBondContact O-N 2.66Å; L523-I560 HydrophobicContact CD1-CD1 4.02Å; L523-I560 HydrophobicContact CG-CD1 4.44Å
524	I	84	Confident	79.1	Confident	69 Å²	69	52.6 Å²	52.6	35%	0.354	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	121.4	177	-47	176.3	0	0	0	109.5	Y526 A556	I524-Y526 HydrophobicContact CB-CD2 4.34Å; I524-Y526 HydrophobicContact CB-CE2 3.71Å; I524-Y526 HydrophobicContact CG2-CD2 3.89Å; I524-Y526 HydrophobicContact CG2-CE1 4.5Å; I524-Y526 HydrophobicContact CG2-CE2 3.31Å; I524-A556 WeakPolarHBondContact CA-O 3.39Å
525	I	88.2	Confident	77.2	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.5	179	-52.1	-57.8	0	0	0	108.3	L444 L487 F489 T555 A556 L558	L444-I525 HydrophobicContact CD1-CG1 4.49Å; L487-I525 HydrophobicContact CB-CD1 4.21Å; L487-I525 HydrophobicContact CD1-CD1 4.05Å; L487-I525 HydrophobicContact CD1-CG1 3.94Å; L487-I525 HydrophobicContact CG-CD1 3.81Å; L487-I525 HydrophobicContact CG-CG1 4.28Å; F489-I525 HydrophobicContact CE1-CG2 4.48Å; F489-I525 HydrophobicContact CZ-CG2 3.94Å; I525-T555 WeakPolarHBondContact O-CA 3.41Å; I525-A556 HydrophobicContact CB-CB 4.39Å; I525-A556 PolarHBondContact N-O 2.69Å; I525-A556 PolarHBondContact O-N 3.47Å; I525-L558 HydrophobicContact CD1-CD2 4.44Å; I525-L558 HydrophobicContact CG1-CB 4.14Å
526	Y	88	Confident	75.2	Confident	66 Å²	66	54.6 Å²	54.6	26%	0.259	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136	-176.3	-73.1	-95.3	0	0	0	112	L481 Q485 F489 I524 M554 T555	L481-Y526 HydrophobicContact CD1-CD2 3.33Å; L481-Y526 HydrophobicContact CD1-CE2 4.03Å; L481-Y526 HydrophobicContact CD1-CG 3.71Å; Q485-Y526 VanDerWaalsContact NE2-N 3.19Å; Q485-Y526 PolarHBondContact NE2-O 3.08Å; F489-Y526 WeakPolarHBondContact CZ-O 3.47Å; I524-Y526 HydrophobicContact CB-CD2 4.34Å; I524-Y526 HydrophobicContact CB-CE2 3.71Å; I524-Y526 HydrophobicContact CG2-CD2 3.89Å; I524-Y526 HydrophobicContact CG2-CE1 4.5Å; I524-Y526 HydrophobicContact CG2-CE2 3.31Å; Y526-M554 WeakPolarHBondContact CA-O 3.32Å; Y526-T555 HydrophobicContact CD1-CG2 3.66Å; Y526-T555 HydrophobicContact CE1-CG2 3.5Å; Y526-T555 VanDerWaalsContact CE1-CG2 3.5Å
527	L	90.8	Very high	73.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.1	165.7	-169.9	67.2	0	0	0	108.7	F437 C475 F489 P493 Y502 T553 M554	F437-L527 HydrophobicContact CE1-CD2 4.36Å; C475-L527 HydrophobicContact CB-CD1 4.33Å; C475-L527 HydrophobicContact CB-CD2 4.45Å; C475-L527 HydrophobicContact CB-CG 4.43Å; F489-L527 HydrophobicContact CD1-CD1 4.23Å; F489-L527 HydrophobicContact CD1-CD2 4.19Å; F489-L527 HydrophobicContact CD2-CD1 4.31Å; F489-L527 HydrophobicContact CE1-CB 3.87Å; F489-L527 HydrophobicContact CE1-CD1 3.98Å; F489-L527 HydrophobicContact CE1-CD2 3.95Å; F489-L527 HydrophobicContact CE1-CG 4.15Å; F489-L527 HydrophobicContact CE2-CD1 4.06Å; F489-L527 HydrophobicContact CG-CD1 4.41Å; F489-L527 HydrophobicContact CZ-CB 3.79Å; F489-L527 HydrophobicContact CZ-CD1 3.9Å; F489-L527 HydrophobicContact CZ-CG 4.3Å; P493-L527 HydrophobicContact CB-CD1 4.49Å; P493-L527 HydrophobicContact CG-CD1 3.97Å; Y502-L527 HydrophobicContact CD2-CD2 3.99Å; Y502-L527 HydrophobicContact CE2-CD2 4.24Å; L527-T553 WeakPolarHBondContact O-CA 3.37Å; L527-M554 HydrophobicContact CB-CB 4.28Å; L527-M554 PolarHBondContact N-O 3.43Å; L527-M554 VanDerWaalsContact N-O 3.17Å; L527-M554 PolarHBondContact O-N 3.48Å
528	I	90	Very high	71.5	Confident	65 Å²	65	53.8 Å²	53.8	33%	0.333	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	129	175.4	-58.4	179.4	0	0	0	107.8	C475 S476 P478 T553	C475-I528 CarbonylContact C-O 3.54Å; C475-I528 WeakPolarHBondContact CA-O 3.43Å; S476-I528 PolarHBondContact N-O 2.84Å; S476-I528 PolarHBondContact O-N 2.82Å; S476-I528 VanDerWaalsContact O-N 3.07Å; P478-I528 HydrophobicContact CB-CD1 4.48Å; P478-I528 HydrophobicContact CG-CD1 3.85Å; P478-I528 HydrophobicContact CG-CG1 4.07Å; I528-T553 HydrophobicContact CG1-CG2 4.11Å; I528-T553 HydrophobicContact CG2-CG2 4.35Å
529	C	91.1	Very high	69.7	Low	1 Å²	1	56.1 Å²	56.1	1%	0.007	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	139	177.1	-56	0	0	0	0	110.2	I461 V473 E474 C475 T551 S552	I461-C529 HydrophobicContact CD1-CB 3.42Å; I461-C529 VanDerWaalsContact CD1-CB 3.42Å; I461-C529 WeakPolarHBondContact CD1-SG 3.44Å; V473-C529 HydrophobicContact CG1-CB 3.67Å; E474-C529 WeakPolarHBondContact O-CA 3.29Å; C475-C529 HydrophobicContact CB-CB 4.09Å; C475-C529 WeakPolarHBondContact CB-SG 3.45Å; C475-C529 WeakPolarHBondContact SG-CB 3.48Å; C475-C529 CovalentContact SG-SG 2.04Å; C475-C529 PolarHBondContact SG-SG 2.87Å; C529-T551 CarbonylContact O-C 3.57Å; C529-T551 WeakPolarHBondContact O-CA 3.31Å; C529-S552 PolarHBondContact N-O 3.01Å; C529-S552 PolarHBondContact O-N 3.16Å
530	S	89.1	Confident	68	Low	22 Å²	22	59.6 Å²	59.6	15%	0.154	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	150.4	174.9	64.1	0	0	0	0	110.6	E474 R549 L550	E474-S530 PolarHBondContact N-O 2.86Å; E474-S530 PolarHBondContact O-N 2.89Å; S530-R549 PolarHBondContact OG-NH1 3.33Å; S530-L550 WeakPolarHBondContact CA-O 3.47Å
531	D	87.1	Confident	66.2	Low	0 Å²	0	60 Å²	60	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	-65.4	166.8	165.3	75.1	44.5	0	0	0	111.5	N431 P435 N470 R549 L550	N431-D531 PolarHBondContact ND2-OD2 2.67Å; N431-D531 VanDerWaalsContact OD1-CG 3.28Å; N431-D531 PolarHBondContact OD1-OD1 2.81Å; N431-D531 PolarHBondContact OD1-OD2 2.97Å; P435-D531 HydrophobicContact CG-CB 4.25Å; N470-D531 HydrophobicContact CB-CB 4.13Å; N470-D531 PolarHBondContact ND2-OD1 3.29Å; D531-R549 VanDerWaalsContact O-CD 3.23Å; D531-R549 WeakPolarHBondContact O-CD 3.4Å; D531-R549 PolarHBondContact O-NE 2.73Å; D531-R549 PolarHBondContact O-NH1 2.94Å; D531-R549 VanDerWaalsContact OD1-CA 3.29Å; D531-R549 WeakPolarHBondContact OD1-CA 3.29Å; D531-R549 WeakPolarHBondContact OD1-CG 3.36Å; D531-L550 PolarHBondContact N-O 2.93Å; D531-L550 VanDerWaalsContact N-O 3.12Å; D531-L550 WeakPolarHBondContact OD2-CA 3.44Å; D531-L550 VanDerWaalsContact OD2-CB 3.23Å; D531-L550 WeakPolarHBondContact OD2-CB 3.33Å; D531-L550 PolarHBondContact OD2-N 3.41Å
532	G	70.1	Confident	64	Low	0 Å²	0	68.3 Å²	68.3	0%	0	41%	0.413	C	S	.	.	S	Bend	trans	74.5	132	170.4	0	0	0	0	0	115.2	N470 L472 E474 R549	N470-G532 WeakPolarHBondContact O-CA 3.38Å; N470-G532 PolarHBondContact O-N 2.81Å; N470-G532 VanDerWaalsContact OD1-CA 3.29Å; N470-G532 WeakPolarHBondContact OD1-CA 3.49Å; L472-G532 CarbonylContact O-C 3.58Å; L472-G532 PolarHBondContact O-N 3.38Å; E474-G532 VanDerWaalsContact OE2-O 3.09Å; G532-R549 PolarHBondContact O-NH1 2.83Å; G532-R549 VanDerWaalsContact O-NH1 3.1Å; G532-R549 PolarHBondContact O-NH2 2.85Å
533	V	59.8	Low	61.8	Low	55 Å²	55	70.8 Å²	70.8	33%	0.333	43%	0.429	S	S	.	.			trans	-80.7	136	172.3	173.2	0	0	0	0	111.9	L472 E474 N498 S535 R549	L472-V533 HydrophobicContact CB-CG2 3.6Å; L472-V533 HydrophobicContact CD1-CG2 3.89Å; L472-V533 HydrophobicContact CG-CG2 4.41Å; E474-V533 HydrophobicContact CG-CG2 4.49Å; E474-V533 WeakPolarHBondContact OE1-CA 3.47Å; N498-V533 WeakPolarHBondContact ND2-CG2 3.25Å; V533-S535 PolarHBondContact O-N 2.76Å; V533-R549 VanDerWaalsContact C-NH2 3.31Å
534	L	52.9	Low	59.4	Low	120 Å²	120	75 Å²	75	63%	0.628	46%	0.46	S	S	*	.			trans	-72	80	168.9	-112.7	151.8	0	0	0	109.2	E474 S536 R549	E474-L534 PolarHBondContact OE1-N 3.1Å; E474-L534 PolarHBondContact OE2-N 2.78Å; L534-S536 PolarHBondContact O-N 2.72Å; L534-S536 PolarHBondContact O-OG 2.91Å; L534-R549 VanDerWaalsContact N-NH2 3.13Å
535	S	44.2	Very low	57.3	Low	97 Å²	97	79.3 Å²	79.3	68%	0.678	48%	0.484	S	S	*	.			trans	-48	98.1	-178.7	-73.7	0	0	0	0	112.1	V533 G537 G538	V533-S535 PolarHBondContact O-N 2.76Å; S535-G537 PolarHBondContact O-N 2.86Å; S535-G538 PolarHBondContact O-N 2.8Å
536	S	38.2	Very low	55.2	Low	129 Å²	129	84.3 Å²	84.3	90%	0.902	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	101.8	-166.9	-74.2	0	0	0	0	112.3	L534	L534-S536 PolarHBondContact O-N 2.72Å; L534-S536 PolarHBondContact O-OG 2.91Å
537	G	35.1	Very low	53.7	Low	81 Å²	81	85.3 Å²	85.3	84%	0.835	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.8	4.8	172	0	0	0	0	0	116.6	S535	S535-G537 PolarHBondContact O-N 2.86Å
538	G	31.7	Very low	52.5	Low	59 Å²	59	91.4 Å²	91.4	61%	0.608	56%	0.556	S	S	*	*			trans	-72.9	134.6	174.2	0	0	0	0	0	113.1	S535	S535-G538 PolarHBondContact O-N 2.8Å
539	M	31.7	Very low	52	Low	168 Å²	168	92.4 Å²	92.4	83%	0.828	56%	0.556	S	S	*	*			trans	-65.8	132.9	175.9	-79.3	167.5	58	0	0	111.7	S541	M539-S541 PolarHBondContact O-N 3.15Å
540	V	34.1	Very low	51.7	Low	121 Å²	121	94.6 Å²	94.6	73%	0.733	57%	0.567	S	S	*	*			trans	-69	103.1	176	180	0	0	0	0	110	H542	V540-H542 PolarHBondContact O-N 2.61Å
541	S	35.2	Very low	51.7	Low	99 Å²	99	97.8 Å²	97.8	69%	0.692	59%	0.586	S	S	*	*			trans	-75.9	111.6	165.3	-172	0	0	0	0	109	M539 N543	M539-S541 PolarHBondContact O-N 3.15Å; S541-N543 PolarHBondContact O-N 2.83Å
542	H	34	Very low	51.9	Low	176 Å²	176	99 Å²	99	82%	0.815	59%	0.594	S	S	*	*			trans	-71.9	87.6	174.1	-83.8	-88.4	0	0	0	110.7	V540	V540-H542 PolarHBondContact O-N 2.61Å
543	N	37.8	Very low	52.9	Low	131 Å²	131	102.9 Å²	102.9	70%	0.701	62%	0.618	S	S	*	*			trans	-135.9	145.4	158.5	-94.2	-30	0	0	0	110	S541 D545	S541-N543 PolarHBondContact O-N 2.83Å; N543-D545 PolarHBondContact O-N 3Å; N543-D545 VanDerWaalsContact O-N 3.16Å
544	S	35.1	Very low	54.2	Low	114 Å²	114	100.4 Å²	100.4	80%	0.797	60%	0.603	S	S	*	*	S	Bend	trans	-93.8	37.4	-149	58.2	0	0	0	0	116.3
545	D	40	Very low	56	Low	160 Å²	160	98.1 Å²	98.1	86%	0.856	59%	0.594	S	S	*	*			trans	-128.7	69.1	165.7	-79.7	-57	0	0	0	108.8	N543 K547	N543-D545 PolarHBondContact O-N 3Å; N543-D545 VanDerWaalsContact O-N 3.16Å; D545-K547 PolarHBondContact O-N 3.45Å
546	S	43.6	Very low	58.1	Low	107 Å²	107	93.6 Å²	93.6	75%	0.748	56%	0.562	S	S	*	*			trans	-75.9	78	179.1	-60.2	0	0	0	0	110.4	I548	S546-I548 PolarHBondContact O-N 3.2Å
547	K	55.7	Low	60.6	Low	87 Å²	87	90.4 Å²	90.4	38%	0.378	54%	0.538	S	S	.	.			trans	3.6	95.8	167.2	-161.5	179.9	-179.2	-164.2	0	113.1	S468 V469 N470 D545 R549	S468-K547 PolarHBondContact O-NZ 3.15Å; V469-K547 VanDerWaalsContact CA-NZ 3.29Å; N470-K547 WeakPolarHBondContact ND2-CE 3.48Å; N470-K547 VanDerWaalsContact OD1-CE 3.3Å; N470-K547 WeakPolarHBondContact OD1-CE 3.38Å; N470-K547 PolarHBondContact OD1-NZ 3.15Å; D545-K547 PolarHBondContact O-N 3.45Å; K547-R549 PolarHBondContact O-N 3.5Å; K547-R549 VanDerWaalsContact O-N 3.11Å
548	I	66.6	Low	63.2	Low	128 Å²	128	86.5 Å²	86.5	66%	0.656	50%	0.498	S	S	*	.			trans	-63.5	113.1	-170.4	-61	174	0	0	0	108.5	S546 L550	S546-I548 PolarHBondContact O-N 3.2Å; I548-L550 PolarHBondContact O-N 2.74Å
549	R	79.4	Confident	66.1	Low	85 Å²	85	85.6 Å²	85.6	32%	0.321	48%	0.482	S	S	.	.			trans	-70.9	122.2	171	-67.7	-171.2	174.2	-154.5	0.6	110.5	E474 S530 D531 G532 V533 L534 K547	E474-R549 IonicContact OE2-CZ 3.18Å; E474-R549 IonicContact OE2-NH1 2.71Å; E474-R549 PolarHBondContact OE2-NH1 2.81Å; E474-R549 IonicContact OE2-NH2 2.69Å; E474-R549 PolarHBondContact OE2-NH2 3.46Å; E474-R549 VanDerWaalsContact OE2-NH2 3.07Å; S530-R549 PolarHBondContact OG-NH1 3.33Å; D531-R549 VanDerWaalsContact O-CD 3.23Å; D531-R549 WeakPolarHBondContact O-CD 3.4Å; D531-R549 PolarHBondContact O-NE 2.73Å; D531-R549 PolarHBondContact O-NH1 2.94Å; D531-R549 VanDerWaalsContact OD1-CA 3.29Å; D531-R549 WeakPolarHBondContact OD1-CA 3.29Å; D531-R549 WeakPolarHBondContact OD1-CG 3.36Å; G532-R549 PolarHBondContact O-NH1 2.83Å; G532-R549 VanDerWaalsContact O-NH1 3.1Å; G532-R549 PolarHBondContact O-NH2 2.85Å; V533-R549 VanDerWaalsContact C-NH2 3.31Å; L534-R549 VanDerWaalsContact N-NH2 3.13Å; K547-R549 PolarHBondContact O-N 3.5Å; K547-R549 VanDerWaalsContact O-N 3.11Å
550	L	85.2	Confident	68.9	Low	48 Å²	48	77.9 Å²	77.9	25%	0.251	44%	0.444	S	S	.	.			trans	-77	155	164	-53.2	177.1	0	0	0	109.7	N431 E433 P434 S530 D531 I548	N431-L550 VanDerWaalsContact ND2-CD1 3.29Å; N431-L550 WeakPolarHBondContact ND2-CD1 3.46Å; N431-L550 WeakPolarHBondContact ND2-CG 3.49Å; E433-L550 WeakPolarHBondContact O-CD1 3.16Å; P434-L550 HydrophobicContact CB-CB 3.94Å; P434-L550 HydrophobicContact CB-CD1 4.22Å; S530-L550 WeakPolarHBondContact CA-O 3.47Å; D531-L550 PolarHBondContact N-O 2.93Å; D531-L550 VanDerWaalsContact N-O 3.12Å; D531-L550 WeakPolarHBondContact OD2-CA 3.44Å; D531-L550 VanDerWaalsContact OD2-CB 3.23Å; D531-L550 WeakPolarHBondContact OD2-CB 3.33Å; D531-L550 PolarHBondContact OD2-N 3.41Å; I548-L550 PolarHBondContact O-N 2.74Å
551	T	88.4	Confident	71.6	Confident	88 Å²	88	78.6 Å²	78.6	54%	0.54	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	135.4	-175.4	63	0	0	0	0	111	C529	C529-T551 CarbonylContact O-C 3.57Å; C529-T551 WeakPolarHBondContact O-CA 3.31Å
552	S	90.6	Very high	74.3	Confident	25 Å²	25	74.9 Å²	74.9	18%	0.175	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	145	179.4	-165.6	0	0	0	0	110.4	P435 F437 C529	P435-S552 WeakPolarHBondContact O-CB 3.42Å; P435-S552 PolarHBondContact O-OG 2.77Å; F437-S552 WeakPolarHBondContact CD2-OG 3.22Å; F437-S552 VanDerWaalsContact CE2-OG 3.29Å; F437-S552 WeakPolarHBondContact CE2-OG 3.45Å; C529-S552 PolarHBondContact N-O 3.01Å; C529-S552 PolarHBondContact O-N 3.16Å
553	T	90.8	Very high	77.1	Confident	83 Å²	83	69 Å²	69	51%	0.509	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120.9	-175.5	63.4	0	0	0	0	111.6	L527 I528	L527-T553 WeakPolarHBondContact O-CA 3.37Å; I528-T553 HydrophobicContact CG1-CG2 4.11Å; I528-T553 HydrophobicContact CG2-CG2 4.35Å
554	M	89.1	Confident	79.8	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	134.1	168.1	172.6	-178.6	173.5	0	0	109.8	F437 P441 V459 L504 Y526 L527 A556	F437-M554 HydrophobicContact CD1-CB 4.19Å; F437-M554 HydrophobicContact CD2-CB 4.48Å; F437-M554 HydrophobicContact CE1-CB 3.66Å; F437-M554 HydrophobicContact CE2-CB 3.99Å; F437-M554 HydrophobicContact CZ-CB 3.55Å; P441-M554 HydrophobicContact CG-CE 3.78Å; V459-M554 HydrophobicContact CB-SD 4.17Å; V459-M554 HydrophobicContact CG1-SD 3.62Å; V459-M554 HydrophobicContact CG2-CE 3.73Å; V459-M554 HydrophobicContact CG2-SD 3.4Å; V459-M554 WeakPolarHBondContact CG2-SD 3.18Å; L504-M554 HydrophobicContact CD1-CE 4.35Å; Y526-M554 WeakPolarHBondContact CA-O 3.32Å; L527-M554 HydrophobicContact CB-CB 4.28Å; L527-M554 PolarHBondContact N-O 3.43Å; L527-M554 VanDerWaalsContact N-O 3.17Å; L527-M554 PolarHBondContact O-N 3.48Å; M554-A556 HydrophobicContact CE-CB 3.56Å
555	T	89.7	Confident	82.5	Confident	73 Å²	73	61.3 Å²	61.3	45%	0.448	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122.6	165.8	57.4	0	0	0	0	109.1	I525 Y526	I525-T555 WeakPolarHBondContact O-CA 3.41Å; Y526-T555 HydrophobicContact CD1-CG2 3.66Å; Y526-T555 HydrophobicContact CE1-CG2 3.5Å; Y526-T555 VanDerWaalsContact CE1-CG2 3.5Å
556	A	89.4	Confident	85	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.9	177	0	0	0	0	0	110.7	P441 L444 I524 I525 M554	P441-A556 WeakPolarHBondContact O-CB 3.11Å; L444-A556 HydrophobicContact CD1-CB 4.03Å; L444-A556 HydrophobicContact CG-CB 4.43Å; I524-A556 WeakPolarHBondContact CA-O 3.39Å; I525-A556 HydrophobicContact CB-CB 4.39Å; I525-A556 PolarHBondContact N-O 2.69Å; I525-A556 PolarHBondContact O-N 3.47Å; M554-A556 HydrophobicContact CE-CB 3.56Å
557	T	89.8	Confident	87.3	Confident	62 Å²	62	57 Å²	57	38%	0.38	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	113.8	172	-53.7	0	0	0	0	109.1	K442 Q443 L444 L523	K442-T557 PolarHBondContact O-N 2.81Å; Q443-T557 WeakPolarHBondContact CA-O 3.44Å; L444-T557 PolarHBondContact N-O 3.2Å; L523-T557 CarbonylContact O-C 3.55Å; L523-T557 WeakPolarHBondContact O-CA 3.22Å
558	L	90.2	Very high	89.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	111.6	167.6	173.9	62.5	0	0	0	108.6	L444 A446 I456 L487 L510 H522 L523 I525	L444-L558 HydrophobicContact CB-CB 4.42Å; L444-L558 HydrophobicContact CB-CD1 3.84Å; L444-L558 WeakPolarHBondContact O-CA 3.3Å; A446-L558 HydrophobicContact CB-CD1 3.89Å; I456-L558 HydrophobicContact CG2-CD1 4.01Å; L487-L558 HydrophobicContact CD1-CD2 4.32Å; L487-L558 HydrophobicContact CD2-CD2 4.03Å; L487-L558 HydrophobicContact CG-CD2 4.11Å; L510-L558 HydrophobicContact CD1-CD2 4.33Å; H522-L558 WeakPolarHBondContact CA-O 3.18Å; L523-L558 HydrophobicContact CB-CB 4.19Å; L523-L558 HydrophobicContact CB-CD2 4.47Å; L523-L558 HydrophobicContact CD1-CD2 4.36Å; L523-L558 PolarHBondContact N-O 3.21Å; L523-L558 PolarHBondContact O-N 2.66Å; I525-L558 HydrophobicContact CD1-CD2 4.44Å; I525-L558 HydrophobicContact CG1-CB 4.14Å
559	S	91	Very high	90.6	Very high	40 Å²	40	51.7 Å²	51.7	28%	0.28	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	119.8	166.5	-153.5	0	0	0	0	108.9	L444 I445 A446 H522	L444-S559 PolarHBondContact O-N 2.78Å; I445-S559 WeakPolarHBondContact CA-O 3.31Å; A446-S559 PolarHBondContact N-O 2.61Å; A446-S559 VanDerWaalsContact N-O 3.08Å; H522-S559 PolarHBondContact CE1-OG 2.85Å; H522-S559 PolarHBondContact ND1-OG 2.65Å
560	I	91.4	Very high	91.4	Very high	6 Å²	6	48.6 Å²	48.6	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	126.5	169.5	-53.4	177.9	0	0	0	106.7	A446 E448 D511 R512 G521 L523	A446-I560 CarbonylContact O-C 3.55Å; A446-I560 VanDerWaalsContact O-CA 3.31Å; A446-I560 WeakPolarHBondContact O-CA 3.41Å; E448-I560 HydrophobicContact CB-CG2 3.59Å; D511-I560 WeakPolarHBondContact O-CD1 3.31Å; R512-I560 HydrophobicContact CB-CB 4.39Å; R512-I560 HydrophobicContact CB-CG2 3.88Å; R512-I560 HydrophobicContact CG-CB 4.29Å; R512-I560 HydrophobicContact CG-CG2 4.25Å; G521-I560 PolarHBondContact O-N 3.01Å; L523-I560 HydrophobicContact CD1-CD1 4.02Å; L523-I560 HydrophobicContact CG-CD1 4.44Å
561	R	91.4	Very high	91.8	Very high	135 Å²	135	50.7 Å²	50.7	51%	0.509	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.3	175	-163.3	-169.2	78.8	-125.8	-8.4	109.7	I445 A446 D447 E448	I445-R561 HydrophobicContact CG2-CB 4.49Å; A446-R561 PolarHBondContact O-N 2.91Å; D447-R561 IonicContact OD1-CZ 3.48Å; D447-R561 IonicContact OD1-NH1 3.88Å; D447-R561 PolarHBondContact OD1-NH1 3.16Å; D447-R561 IonicContact OD1-NH2 3.73Å; D447-R561 PolarHBondContact OD1-NH2 3.49Å; E448-R561 PolarHBondContact N-O 3.18Å
562	D	92.2	Very high	91.9	Very high	22 Å²	22	50.3 Å²	50.3	12%	0.118	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-48.3	138.1	174	-170.3	84.8	0	0	0	114.5	E448 R512 D598 E599 N602	E448-D562 WeakPolarHBondContact OE1-CA 3.26Å; R512-D562 IonicContact CZ-OD1 2.82Å; R512-D562 IonicContact NE-OD1 3.95Å; R512-D562 PolarHBondContact NE-OD1 3.42Å; R512-D562 IonicContact NH2-OD1 3.82Å; D562-D598 WeakPolarHBondContact OD1-CA 3.17Å; D562-E599 HydrophobicContact CB-CB 3.79Å; D562-E599 VanDerWaalsContact CG-CB 3.45Å; D562-E599 VanDerWaalsContact CG-N 3.31Å; D562-E599 VanDerWaalsContact OD1-CB 3.32Å; D562-E599 WeakPolarHBondContact OD1-CB 3.19Å; D562-E599 PolarHBondContact OD1-N 3.17Å; D562-E599 PolarHBondContact OD2-N 2.92Å; D562-N602 WeakPolarHBondContact OD2-CB 3.17Å; D562-N602 VanDerWaalsContact OD2-CG 3.28Å; D562-N602 PolarHBondContact OD2-ND2 2.78Å
563	V	92.1	Very high	91.9	Very high	53 Å²	53	54.6 Å²	54.6	32%	0.321	29%	0.292	S	S	.	.			trans	-145.7	107.8	179.3	178.8	0	0	0	0	109.7	D447 E448 D565	D447-V563 HydrophobicContact CB-CG2 4.15Å; E448-V563 HydrophobicContact CG-CB 3.86Å; E448-V563 HydrophobicContact CG-CG2 4.09Å; E448-V563 PolarHBondContact OE1-N 3.42Å; V563-D565 PolarHBondContact O-N 2.8Å
564	N	94	Very high	92	Very high	11 Å²	11	54 Å²	54	6%	0.059	29%	0.285	C	S	.	.	S	Bend	trans	-47.5	97	-170.6	-153.2	117.5	0	0	0	115.1	H566 D598 N602 D646 G648	N564-H566 PolarHBondContact ND2-O 2.87Å; N564-D598 VanDerWaalsContact CA-OD2 3.23Å; N564-D598 WeakPolarHBondContact CA-OD2 3.01Å; N564-N602 WeakPolarHBondContact CA-ND2 3.16Å; N564-N602 HydrophobicContact CB-CB 4.03Å; N564-N602 WeakPolarHBondContact CB-ND2 3.31Å; N564-N602 PolarHBondContact N-ND2 3.39Å; N564-N602 WeakPolarHBondContact OD1-CA 3.26Å; N564-N602 WeakPolarHBondContact OD1-CB 3.48Å; N564-N602 VanDerWaalsContact OD1-CG 3.29Å; N564-N602 PolarHBondContact OD1-O 3.45Å; N564-D646 PolarHBondContact ND2-OD2 3.14Å; N564-G648 WeakPolarHBondContact OD1-CA 3.26Å
565	D	91.8	Very high	92.2	Very high	72 Å²	72	54.7 Å²	54.7	39%	0.385	29%	0.287	S	S	.	.			trans	-134.2	-21.7	-178.3	88.4	-16.4	0	0	0	114.2	N449 V563 D598	N449-D565 PolarHBondContact ND2-OD2 2.82Å; V563-D565 PolarHBondContact O-N 2.8Å; D565-D598 PolarHBondContact N-OD2 3.35Å
566	H	92	Very high	92.3	Very high	59 Å²	59	57.9 Å²	57.9	27%	0.273	30%	0.297	S	S	.	.			trans	-75.8	161.7	157.4	-57.4	79.3	0	0	0	110.3	E513 N564 D596 D598 L652	E513-H566 IonicContact OE2-CE1 2.85Å; E513-H566 PolarHBondContact OE2-CE1 2.84Å; E513-H566 IonicContact OE2-ND1 2.86Å; N564-H566 PolarHBondContact ND2-O 2.87Å; H566-D596 WeakPolarHBondContact CB-OD1 3.19Å; H566-D598 WeakPolarHBondContact CB-OD1 3.47Å; H566-D598 IonicContact CG-OD1 3.53Å; H566-D598 PolarHBondContact N-OD1 2.89Å; H566-D598 PolarHBondContact N-OD2 2.88Å; H566-D598 IonicContact ND1-OD1 2.76Å; H566-D598 PolarHBondContact ND1-OD1 3.36Å; H566-L652 WeakPolarHBondContact O-CD1 3.05Å
567	K	93.7	Very high	92.4	Very high	116 Å²	116	58.5 Å²	58.5	50%	0.504	30%	0.3	S	S	.	.			trans	-133.9	155	-179.8	70.8	-169.8	176.2	-170.9	0	107.6	I569 D596 L652	K567-I569 VanDerWaalsContact O-CG1 3.26Å; K567-I569 WeakPolarHBondContact O-CG1 3.35Å; K567-I569 PolarHBondContact O-N 2.78Å; K567-D596 VanDerWaalsContact C-CG 3.49Å; K567-D596 VanDerWaalsContact C-OD2 3.22Å; K567-D596 PolarHBondContact N-OD1 2.75Å; K567-L652 HydrophobicContact CB-CB 3.69Å; K567-L652 HydrophobicContact CB-CD1 4.38Å
568	P	96.5	Very high	92.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.304	C	S	.	.			trans	-58.3	129.2	-175.5	-25.5	32.5	0	0	0	111.1	A594 H595 D596 I605 A644 S654	P568-A594 HydrophobicContact CB-CB 4.08Å; P568-H595 CarbonylContact C-O 3.51Å; P568-D596 VanDerWaalsContact CA-OD2 3.31Å; P568-D596 WeakPolarHBondContact CA-OD2 3.4Å; P568-D596 WeakPolarHBondContact CD-OD2 3.4Å; P568-D596 WeakPolarHBondContact CG-OD2 3.42Å; P568-I605 HydrophobicContact CB-CD1 4.05Å; P568-I605 HydrophobicContact CB-CG1 3.99Å; P568-I605 HydrophobicContact CG-CG1 4.01Å; P568-A644 HydrophobicContact CB-CB 3.61Å; P568-A644 HydrophobicContact CG-CB 4.22Å; P568-S654 WeakPolarHBondContact O-CB 3.23Å; P568-S654 PolarHBondContact O-OG 2.99Å
569	I	94.9	Very high	92.6	Very high	105 Å²	105	59.1 Å²	59.1	54%	0.538	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	115.7	178.3	-50.8	-172.6	0	0	0	109.2	K567 A594 H595	K567-I569 VanDerWaalsContact O-CG1 3.26Å; K567-I569 WeakPolarHBondContact O-CG1 3.35Å; K567-I569 PolarHBondContact O-N 2.78Å; I569-A594 CarbonylContact O-C 3.53Å; I569-A594 WeakPolarHBondContact O-CA 3.35Å; I569-A594 WeakPolarHBondContact O-CB 3.33Å; I569-H595 PolarHBondContact N-O 2.62Å; I569-H595 PolarHBondContact O-N 2.72Å
570	F	95.9	Very high	92.6	Very high	20 Å²	20	63.3 Å²	63.3	9%	0.088	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	141.7	174.7	-74.5	-79.7	0	0	0	112.1	N572 Y575 I592 R593 A594 Y607 A644 S654 V656	F570-N572 WeakPolarHBondContact CB-O 3.5Å; F570-N572 PolarHBondContact O-N 3.36Å; F570-Y575 HydrophobicContact CD1-CE2 4.33Å; F570-I592 HydrophobicContact CE1-CB 4.27Å; F570-I592 HydrophobicContact CE1-CD1 4.07Å; F570-R593 WeakPolarHBondContact CA-O 3.43Å; F570-R593 WeakPolarHBondContact CD1-O 3.07Å; F570-A594 HydrophobicContact CD1-CB 3.93Å; F570-A594 HydrophobicContact CE1-CB 4.15Å; F570-A594 HydrophobicContact CG-CB 4.15Å; F570-Y607 HydrophobicContact CE1-CD1 4.23Å; F570-Y607 HydrophobicContact CE1-CE1 4.04Å; F570-A644 HydrophobicContact CE1-CB 4.13Å; F570-A644 HydrophobicContact CE2-CB 3.74Å; F570-A644 HydrophobicContact CZ-CB 3.43Å; F570-A644 VanDerWaalsContact CZ-CB 3.43Å; F570-S654 WeakPolarHBondContact CD2-OG 3.47Å; F570-S654 WeakPolarHBondContact CE2-OG 3Å; F570-V656 HydrophobicContact CB-CB 4.2Å; F570-V656 HydrophobicContact CB-CG2 4.38Å; F570-V656 HydrophobicContact CD1-CB 4.21Å; F570-V656 HydrophobicContact CD1-CG1 3.64Å; F570-V656 HydrophobicContact CD2-CB 3.62Å; F570-V656 HydrophobicContact CD2-CG1 3.77Å; F570-V656 HydrophobicContact CE1-CG1 3.64Å; F570-V656 HydrophobicContact CE2-CB 3.98Å; F570-V656 HydrophobicContact CE2-CG1 3.76Å; F570-V656 HydrophobicContact CG-CB 3.74Å; F570-V656 HydrophobicContact CG-CG1 3.7Å; F570-V656 HydrophobicContact CG-CG2 4.4Å; F570-V656 HydrophobicContact CZ-CB 4.41Å; F570-V656 HydrophobicContact CZ-CG1 3.68Å
571	E	92.5	Very high	92.8	Very high	91 Å²	91	63.2 Å²	63.2	43%	0.425	32%	0.321	S	S	.	.	S	Bend	trans	-57	-35.8	178.2	-70.1	175.9	169.6	0	0	112.5	R593 H595	E571-R593 VanDerWaalsContact CD-CB 3.41Å; E571-R593 HydrophobicContact CG-CB 3.92Å; E571-R593 PolarHBondContact N-O 3.15Å; E571-R593 WeakPolarHBondContact OE1-CB 3.39Å; E571-R593 WeakPolarHBondContact OE1-CD 3.37Å; E571-R593 IonicContact OE1-NH1 2.85Å; E571-H595 IonicContact OE1-CE1 3.39Å; E571-H595 PolarHBondContact OE1-CE1 2.87Å
572	N	92.1	Very high	92.8	Very high	80 Å²	80	60 Å²	60	43%	0.428	31%	0.313	S	S	.	.	S	Bend	trans	-121.9	145.1	178.3	-61.9	-67.6	0	0	0	110.5	F570 I574 Y575 V656	F570-N572 WeakPolarHBondContact CB-O 3.5Å; F570-N572 PolarHBondContact O-N 3.36Å; N572-I574 VanDerWaalsContact C-N 3.32Å; N572-Y575 HydrophobicContact CB-CD2 4.2Å; N572-Y575 HydrophobicContact CB-CE1 4.42Å; N572-Y575 HydrophobicContact CB-CE2 3.99Å; N572-Y575 WeakPolarHBondContact ND2-CE1 3.24Å; N572-V656 VanDerWaalsContact O-CG2 3.31Å; N572-V656 WeakPolarHBondContact O-CG2 3.24Å
573	S	89.5	Confident	92.7	Very high	116 Å²	116	59.4 Å²	59.4	81%	0.811	31%	0.31	S	S	*	.	S	Bend	trans	-73.8	-23.1	175.3	54.3	0	0	0	0	113.7	V656	S573-V656 WeakPolarHBondContact O-CG2 3.49Å
574	I	92.6	Very high	92.7	Very high	71 Å²	71	60.7 Å²	60.7	36%	0.364	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	136.4	172.9	-58.1	-178.9	0	0	0	106.7	N572 L657 N659	N572-I574 VanDerWaalsContact C-N 3.32Å; I574-L657 WeakPolarHBondContact CA-O 3.41Å; I574-N659 VanDerWaalsContact CG2-ND2 3.27Å; I574-N659 WeakPolarHBondContact CG2-ND2 3.25Å
575	Y	92.8	Very high	92.6	Very high	16 Å²	16	65.3 Å²	65.3	6%	0.063	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	135.8	166.3	-69.2	-105	0	0	0	109.6	F570 N572 V590 I592 R593 V656 L657 L658 N659	F570-Y575 HydrophobicContact CD1-CE2 4.33Å; N572-Y575 HydrophobicContact CB-CD2 4.2Å; N572-Y575 HydrophobicContact CB-CE1 4.42Å; N572-Y575 HydrophobicContact CB-CE2 3.99Å; N572-Y575 WeakPolarHBondContact ND2-CE1 3.24Å; Y575-V590 HydrophobicContact CD1-CG2 4.24Å; Y575-I592 HydrophobicContact CD1-CG2 4.44Å; Y575-I592 HydrophobicContact CD2-CG2 4.11Å; Y575-I592 HydrophobicContact CE1-CG2 4.39Å; Y575-I592 HydrophobicContact CE2-CB 4.45Å; Y575-I592 HydrophobicContact CE2-CG2 4.06Å; Y575-I592 HydrophobicContact CG-CG2 4.3Å; Y575-R593 PolarHBondContact OH-N 3.01Å; Y575-R593 VanDerWaalsContact OH-N 3.16Å; Y575-R593 PolarHBondContact OH-O 3.17Å; Y575-R593 VanDerWaalsContact OH-O 3.14Å; Y575-V656 HydrophobicContact CD2-CG1 4.28Å; Y575-V656 HydrophobicContact CD2-CG2 3.78Å; Y575-V656 HydrophobicContact CE2-CG1 4.28Å; Y575-V656 HydrophobicContact CE2-CG2 4.02Å; Y575-L657 PolarHBondContact N-O 2.76Å; Y575-L658 HydrophobicContact CD2-CD2 3.93Å; Y575-L658 HydrophobicContact CG-CD2 4.1Å; Y575-N659 PolarHBondContact O-N 3.46Å
576	H	92.4	Very high	92.6	Very high	139 Å²	139	64 Å²	64	64%	0.644	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	134.6	170.4	-72.6	-98	0	0	0	108.9	N659	H576-N659 WeakPolarHBondContact CA-O 3.37Å; H576-N659 PolarHBondContact CE1-ND2 3.12Å; H576-N659 VanDerWaalsContact CE1-ND2 3.34Å
577	M	90.9	Very high	92.5	Very high	14 Å²	14	66.2 Å²	66.2	7%	0.069	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	152.6	-175.9	56.8	-176.3	-66.6	0	0	110.7	I579 V589 V590 N659 I660 T661	M577-I579 HydrophobicContact CE-CD1 4.11Å; M577-I579 HydrophobicContact CE-CG1 4.45Å; M577-V589 HydrophobicContact CE-CB 3.66Å; M577-V589 HydrophobicContact CE-CG1 3.43Å; M577-V589 VanDerWaalsContact CE-CG1 3.43Å; M577-V590 HydrophobicContact CB-CB 4.39Å; M577-V590 HydrophobicContact CE-CB 4.08Å; M577-V590 HydrophobicContact CE-CG1 3.68Å; M577-V590 HydrophobicContact SD-CB 4.08Å; M577-V590 HydrophobicContact SD-CG1 3.4Å; M577-V590 WeakPolarHBondContact SD-CG1 3.07Å; M577-N659 PolarHBondContact N-O 2.86Å; M577-I660 HydrophobicContact CE-CD1 4.2Å; M577-I660 HydrophobicContact CE-CG1 4.46Å; M577-I660 HydrophobicContact CE-CG2 4.28Å; M577-I660 HydrophobicContact CG-CB 4.08Å; M577-I660 HydrophobicContact CG-CD1 4.43Å; M577-I660 HydrophobicContact CG-CG1 3.73Å; M577-I660 HydrophobicContact CG-CG2 4.05Å; M577-I660 WeakPolarHBondContact O-CA 3.43Å; M577-I660 HydrophobicContact SD-CB 4.47Å; M577-I660 HydrophobicContact SD-CD1 3.71Å; M577-I660 HydrophobicContact SD-CG1 3.63Å; M577-I660 HydrophobicContact SD-CG2 4.4Å; M577-T661 PolarHBondContact O-N 2.85Å
578	S	92.3	Very high	92.4	Very high	68 Å²	68	66.5 Å²	66.5	48%	0.476	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	142.4	-179.8	-54.3	0	0	0	0	110.7	T661	S578-T661 VanDerWaalsContact CA-O 3.3Å; S578-T661 WeakPolarHBondContact CA-O 3.4Å
579	I	92.9	Very high	92	Very high	8 Å²	8	68.5 Å²	68.5	4%	0.041	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.5	178.5	-63.6	173.3	0	0	0	106.9	M577 N583 V589 F615 F630 I660 T661 V662 L663	M577-I579 HydrophobicContact CE-CD1 4.11Å; M577-I579 HydrophobicContact CE-CG1 4.45Å; I579-N583 HydrophobicContact CG2-CB 3.96Å; I579-V589 HydrophobicContact CD1-CB 4.46Å; I579-V589 HydrophobicContact CD1-CG1 4.15Å; I579-V589 HydrophobicContact CD1-CG2 3.96Å; I579-V589 HydrophobicContact CG1-CB 4.28Å; I579-V589 HydrophobicContact CG1-CG1 3.54Å; I579-V589 HydrophobicContact CG1-CG2 3.91Å; I579-F615 HydrophobicContact CD1-CE1 3.71Å; I579-F630 HydrophobicContact CD1-CD2 4.48Å; I579-F630 HydrophobicContact CD1-CE2 4.06Å; I579-F630 HydrophobicContact CG2-CD2 3.96Å; I579-F630 HydrophobicContact CG2-CE2 4.49Å; I579-I660 HydrophobicContact CD1-CG2 3.74Å; I579-I660 HydrophobicContact CG1-CG2 4.23Å; I579-T661 PolarHBondContact N-O 2.66Å; I579-V662 CarbonylContact O-C 3.52Å; I579-V662 VanDerWaalsContact O-CA 3.26Å; I579-V662 WeakPolarHBondContact O-CA 3.42Å; I579-L663 PolarHBondContact O-N 3.36Å
580	Q	91.9	Very high	91.9	Very high	127 Å²	127	64.7 Å²	64.7	59%	0.593	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	143.8	169.4	-63.1	-174.4	-97.9	0	0	109.7	N583 L663 V665	Q580-N583 WeakPolarHBondContact O-CB 3.18Å; Q580-L663 HydrophobicContact CG-CB 4.37Å; Q580-L663 HydrophobicContact CG-CD1 4.46Å; Q580-V665 HydrophobicContact CB-CG2 4.32Å
581	E	93.9	Very high	91.8	Very high	5 Å²	5	66.2 Å²	66.2	2%	0.023	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	172.7	166.3	71.6	-165.4	126.4	0	0	112.1	N583 R632 V662 L663 D664 V665	E581-N583 PolarHBondContact O-N 3.01Å; E581-R632 HydrophobicContact CB-CB 4.45Å; E581-R632 WeakPolarHBondContact OE2-CB 3.45Å; E581-R632 PolarHBondContact OE2-N 2.98Å; E581-V662 HydrophobicContact CB-CG1 3.71Å; E581-L663 PolarHBondContact N-O 2.85Å; E581-D664 WeakPolarHBondContact OE1-CA 3.28Å; E581-V665 HydrophobicContact CG-CB 3.87Å; E581-V665 HydrophobicContact CG-CG2 3.95Å; E581-V665 PolarHBondContact OE1-N 3.01Å
582	N	92	Very high	91.9	Very high	67 Å²	67	61.9 Å²	61.9	36%	0.358	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	20.4	-171.7	-69	-63.4	0	0	0	113.7	M629 F630 D667	N582-M629 HydrophobicContact CB-CE 3.97Å; N582-M629 WeakPolarHBondContact OD1-CE 3.33Å; N582-F630 PolarHBondContact N-O 3.07Å; N582-D667 PolarHBondContact ND2-OD2 2.86Å
583	N	91.3	Very high	92	Very high	9 Å²	9	63.7 Å²	63.7	5%	0.048	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-60.1	150.9	-173.7	64.7	-82.9	0	0	0	114.6	I579 Q580 E581 P626 V628 F630	I579-N583 HydrophobicContact CG2-CB 3.96Å; Q580-N583 WeakPolarHBondContact O-CB 3.18Å; E581-N583 PolarHBondContact O-N 3.01Å; N583-P626 VanDerWaalsContact ND2-CB 3.33Å; N583-P626 WeakPolarHBondContact ND2-CB 3.02Å; N583-P626 WeakPolarHBondContact ND2-CG 3.42Å; N583-V628 PolarHBondContact ND2-O 3.49Å; N583-F630 VanDerWaalsContact OD1-CD2 3.23Å; N583-F630 WeakPolarHBondContact OD1-CD2 3.19Å; N583-F630 PolarHBondContact OD1-N 2.88Å
584	P	91.9	Very high	92.3	Very high	80 Å²	80	58.6 Å²	58.6	52%	0.519	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-66.4	135.4	165	28.5	-32.9	0	0	0	111.3	E587 P626	P584-E587 HydrophobicContact CG-CB 4.13Å; P584-E587 WeakPolarHBondContact CG-OE2 3.46Å; P584-P626 WeakPolarHBondContact O-CG 3.24Å
585	I	92	Very high	92.4	Very high	109 Å²	109	60.8 Å²	60.8	56%	0.559	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	131.3	176.8	-63.6	176.9	0	0	0	109.8
586	G	89.9	Confident	92.5	Very high	45 Å²	45	61.2 Å²	61.2	46%	0.464	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	3.8	178.7	0	0	0	0	0	116	P626	G586-P626 PolarHBondContact N-O 2.62Å
587	E	91.5	Very high	92.5	Very high	104 Å²	104	57.4 Å²	57.4	49%	0.486	31%	0.306	S	S	.	.			trans	-62.5	148.9	172.4	179.1	162.2	-138.6	0	0	112.9	P584 T625 P626	P584-E587 HydrophobicContact CG-CB 4.13Å; P584-E587 WeakPolarHBondContact CG-OE2 3.46Å; E587-T625 WeakPolarHBondContact O-CA 3.09Å; E587-T625 WeakPolarHBondContact O-CB 3.13Å; E587-T625 VanDerWaalsContact O-CG2 3.23Å; E587-T625 WeakPolarHBondContact O-CG2 3.44Å; E587-P626 WeakPolarHBondContact O-CD 3.5Å
588	K	90.6	Very high	92.6	Very high	123 Å²	123	57.1 Å²	57.1	54%	0.535	31%	0.305	S	S	.	.			trans	-88.6	107.3	179	-78.3	-172	169.4	-156.5	0	110.8	W623 T625	K588-W623 HydrophobicContact CB-CD2 4.24Å; K588-W623 HydrophobicContact CB-CE3 3.62Å; K588-W623 HydrophobicContact CB-CZ3 3.81Å; K588-W623 HydrophobicContact CD-CD2 3.68Å; K588-W623 HydrophobicContact CD-CE3 3.95Å; K588-W623 HydrophobicContact CD-CG 3.93Å; K588-W623 HydrophobicContact CD-CZ3 4.47Å; K588-W623 HydrophobicContact CG-CD2 4.06Å; K588-W623 HydrophobicContact CG-CE3 3.91Å; K588-W623 HydrophobicContact CG-CG 4.34Å; K588-T625 HydrophobicContact CG-CG2 4.35Å
589	V	89	Confident	92.6	Very high	42 Å²	42	59 Å²	59	26%	0.255	31%	0.306	S	S	.	.			trans	-98.5	-51.8	-174.7	-168.2	0	0	0	0	112.3	M577 I579 I624	M577-V589 HydrophobicContact CE-CB 3.66Å; M577-V589 HydrophobicContact CE-CG1 3.43Å; M577-V589 VanDerWaalsContact CE-CG1 3.43Å; I579-V589 HydrophobicContact CD1-CB 4.46Å; I579-V589 HydrophobicContact CD1-CG1 4.15Å; I579-V589 HydrophobicContact CD1-CG2 3.96Å; I579-V589 HydrophobicContact CG1-CB 4.28Å; I579-V589 HydrophobicContact CG1-CG1 3.54Å; I579-V589 HydrophobicContact CG1-CG2 3.91Å; V589-I624 PolarHBondContact N-O 2.76Å; V589-I624 VanDerWaalsContact N-O 3.14Å
590	V	91.7	Very high	92.5	Very high	24 Å²	24	61.4 Å²	61.4	15%	0.145	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	149.7	177.6	76.9	0	0	0	0	110.5	Y575 M577 W623 I624	Y575-V590 HydrophobicContact CD1-CG2 4.24Å; M577-V590 HydrophobicContact CB-CB 4.39Å; M577-V590 HydrophobicContact CE-CB 4.08Å; M577-V590 HydrophobicContact CE-CG1 3.68Å; M577-V590 HydrophobicContact SD-CB 4.08Å; M577-V590 HydrophobicContact SD-CG1 3.4Å; M577-V590 WeakPolarHBondContact SD-CG1 3.07Å; V590-W623 VanDerWaalsContact O-CE3 3.31Å; V590-I624 HydrophobicContact CG1-CB 3.95Å; V590-I624 HydrophobicContact CG1-CD1 4.02Å; V590-I624 HydrophobicContact CG1-CG1 4.28Å; V590-I624 PolarHBondContact O-N 2.73Å
591	Q	93.9	Very high	92.6	Very high	52 Å²	52	59.5 Å²	59.5	24%	0.243	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.5	166.8	-163.7	-175.8	21.2	0	0	108.4	R593 T621 G622 W623	Q591-R593 HydrophobicContact CG-CG 4.39Å; Q591-T621 WeakPolarHBondContact CG-O 3.38Å; Q591-T621 PolarHBondContact NE2-O 3.18Å; Q591-G622 WeakPolarHBondContact CA-O 3.46Å; Q591-W623 HydrophobicContact CB-CD2 3.9Å; Q591-W623 HydrophobicContact CB-CE3 4.02Å; Q591-W623 HydrophobicContact CB-CG 4.5Å; Q591-W623 HydrophobicContact CB-CH2 4.1Å; Q591-W623 HydrophobicContact CB-CZ2 3.97Å; Q591-W623 HydrophobicContact CB-CZ3 4.12Å; Q591-W623 HydrophobicContact CG-CD2 4.11Å; Q591-W623 HydrophobicContact CG-CG 4.24Å; Q591-W623 HydrophobicContact CG-CZ2 4.46Å
592	I	94.5	Very high	92.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.33	C	S	.	.			trans	-81.8	145.7	166	56.1	169.5	0	0	0	109.5	F570 Y575 Y607 V617 G622 I624 A642 L658	F570-I592 HydrophobicContact CE1-CB 4.27Å; F570-I592 HydrophobicContact CE1-CD1 4.07Å; Y575-I592 HydrophobicContact CD1-CG2 4.44Å; Y575-I592 HydrophobicContact CD2-CG2 4.11Å; Y575-I592 HydrophobicContact CE1-CG2 4.39Å; Y575-I592 HydrophobicContact CE2-CB 4.45Å; Y575-I592 HydrophobicContact CE2-CG2 4.06Å; Y575-I592 HydrophobicContact CG-CG2 4.3Å; I592-Y607 HydrophobicContact CD1-CD1 3.75Å; I592-Y607 HydrophobicContact CD1-CE1 4.47Å; I592-Y607 HydrophobicContact CD1-CG 4.35Å; I592-Y607 HydrophobicContact CG1-CD1 4.06Å; I592-Y607 HydrophobicContact CG1-CE1 4.42Å; I592-V617 HydrophobicContact CD1-CG2 4.2Å; I592-V617 HydrophobicContact CG1-CG2 4.42Å; I592-G622 VanDerWaalsContact CG1-O 3.26Å; I592-G622 WeakPolarHBondContact CG1-O 3.3Å; I592-G622 PolarHBondContact N-O 2.95Å; I592-I624 HydrophobicContact CD1-CD1 4.14Å; I592-I624 HydrophobicContact CG1-CD1 4.16Å; I592-I624 HydrophobicContact CG1-CG1 4.38Å; I592-I624 HydrophobicContact CG2-CD1 3.75Å; I592-A642 HydrophobicContact CD1-CB 3.55Å; I592-L658 HydrophobicContact CG2-CD2 3.69Å
593	R	95	Very high	92.6	Very high	118 Å²	118	58.9 Å²	58.9	45%	0.445	32%	0.324	S	S	.	.			trans	-141	135.1	179.1	-68.2	179.1	-179	-168.6	3.5	109.8	F570 E571 Y575 Q591	F570-R593 WeakPolarHBondContact CA-O 3.43Å; F570-R593 WeakPolarHBondContact CD1-O 3.07Å; E571-R593 VanDerWaalsContact CD-CB 3.41Å; E571-R593 HydrophobicContact CG-CB 3.92Å; E571-R593 PolarHBondContact N-O 3.15Å; E571-R593 WeakPolarHBondContact OE1-CB 3.39Å; E571-R593 WeakPolarHBondContact OE1-CD 3.37Å; E571-R593 IonicContact OE1-NH1 2.85Å; Y575-R593 PolarHBondContact OH-N 3.01Å; Y575-R593 VanDerWaalsContact OH-N 3.16Å; Y575-R593 PolarHBondContact OH-O 3.17Å; Y575-R593 VanDerWaalsContact OH-O 3.14Å; Q591-R593 HydrophobicContact CG-CG 4.39Å
594	A	95.1	Very high	92.8	Very high	9 Å²	9	64.7 Å²	64.7	7%	0.074	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	155.4	166.4	0	0	0	0	0	109.4	P568 I569 F570 I605 Y607 A644	P568-A594 HydrophobicContact CB-CB 4.08Å; I569-A594 CarbonylContact O-C 3.53Å; I569-A594 WeakPolarHBondContact O-CA 3.35Å; I569-A594 WeakPolarHBondContact O-CB 3.33Å; F570-A594 HydrophobicContact CD1-CB 3.93Å; F570-A594 HydrophobicContact CE1-CB 4.15Å; F570-A594 HydrophobicContact CG-CB 4.15Å; A594-I605 VanDerWaalsContact C-CD1 3.46Å; A594-I605 HydrophobicContact CB-CD1 3.94Å; A594-I605 WeakPolarHBondContact O-CD1 3.47Å; A594-Y607 HydrophobicContact CB-CE1 4.18Å; A594-Y607 PolarHBondContact N-OH 3.35Å; A594-Y607 PolarHBondContact O-OH 3.46Å; A594-A644 HydrophobicContact CB-CB 3.93Å
595	H	94.1	Very high	92.9	Very high	118 Å²	118	62 Å²	62	55%	0.546	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144	172.8	-63	90.3	0	0	0	108.4	P568 I569 E571	P568-H595 CarbonylContact C-O 3.51Å; I569-H595 PolarHBondContact N-O 2.62Å; I569-H595 PolarHBondContact O-N 2.72Å; E571-H595 IonicContact OE1-CE1 3.39Å; E571-H595 PolarHBondContact OE1-CE1 2.87Å
596	D	95.3	Very high	93.1	Very high	25 Å²	25	58.8 Å²	58.8	13%	0.134	31%	0.312	C	S	.	.			trans	-121	154	166.8	-130.9	-36.9	0	0	0	108.9	H566 K567 P568 A603 I605	H566-D596 WeakPolarHBondContact CB-OD1 3.19Å; K567-D596 VanDerWaalsContact C-CG 3.49Å; K567-D596 VanDerWaalsContact C-OD2 3.22Å; K567-D596 PolarHBondContact N-OD1 2.75Å; P568-D596 VanDerWaalsContact CA-OD2 3.31Å; P568-D596 WeakPolarHBondContact CA-OD2 3.4Å; P568-D596 WeakPolarHBondContact CD-OD2 3.4Å; P568-D596 WeakPolarHBondContact CG-OD2 3.42Å; D596-A603 HydrophobicContact CB-CB 3.85Å; D596-I605 HydrophobicContact CB-CD1 4.21Å; D596-I605 HydrophobicContact CB-CG1 4.4Å
597	S	92.1	Very high	93.4	Very high	58 Å²	58	57.7 Å²	57.7	41%	0.406	29%	0.294	S	S	.	.			trans	-91	-31	-174.4	-53.3	0	0	0	0	113.1	R512 E513	R512-S597 PolarHBondContact NH2-O 2.54Å; E513-S597 VanDerWaalsContact CG-CB 3.45Å
598	D	94	Very high	93.6	Very high	9 Å²	9	53.9 Å²	53.9	5%	0.048	28%	0.279	C	S	.	.	S	Bend	trans	-61.8	-169.2	-174.4	-59.8	-1	0	0	0	113.9	R512 D562 N564 D565 H566 N602 A603	R512-D598 PolarHBondContact NH2-O 2.79Å; D562-D598 WeakPolarHBondContact OD1-CA 3.17Å; N564-D598 VanDerWaalsContact CA-OD2 3.23Å; N564-D598 WeakPolarHBondContact CA-OD2 3.01Å; D565-D598 PolarHBondContact N-OD2 3.35Å; H566-D598 WeakPolarHBondContact CB-OD1 3.47Å; H566-D598 IonicContact CG-OD1 3.53Å; H566-D598 PolarHBondContact N-OD1 2.89Å; H566-D598 PolarHBondContact N-OD2 2.88Å; H566-D598 IonicContact ND1-OD1 2.76Å; H566-D598 PolarHBondContact ND1-OD1 3.36Å; D598-N602 HydrophobicContact CB-CB 3.67Å; D598-A603 HydrophobicContact CB-CB 4.41Å; D598-A603 WeakPolarHBondContact O-CB 3.4Å
599	E	90.9	Very high	93.8	Very high	108 Å²	108	48.2 Å²	48.2	51%	0.505	25%	0.254	S	S	.	.			trans	-116.2	146.5	-174.1	-147.6	175.6	125	0	0	114.9	R512 D562 E601 N602	R512-E599 IonicContact CZ-OE2 3.44Å; R512-E599 IonicContact NH1-OE2 3.75Å; R512-E599 PolarHBondContact NH1-OE2 2.83Å; D562-E599 HydrophobicContact CB-CB 3.79Å; D562-E599 VanDerWaalsContact CG-CB 3.45Å; D562-E599 VanDerWaalsContact CG-N 3.31Å; D562-E599 VanDerWaalsContact OD1-CB 3.32Å; D562-E599 WeakPolarHBondContact OD1-CB 3.19Å; D562-E599 PolarHBondContact OD1-N 3.17Å; D562-E599 PolarHBondContact OD2-N 2.92Å; E599-E601 PolarHBondContact O-N 3.39Å; E599-E601 VanDerWaalsContact O-N 3.16Å; E599-N602 WeakPolarHBondContact O-CB 3.23Å; E599-N602 PolarHBondContact O-N 3.01Å
600	G	92.1	Very high	93.8	Very high	58 Å²	58	51.8 Å²	51.8	60%	0.598	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	-117.1	167.5	0	0	0	0	0	113.5	N602 R604	G600-N602 VanDerWaalsContact C-N 3.35Å; G600-R604 WeakPolarHBondContact O-CB 3.15Å; G600-R604 PolarHBondContact O-N 3.05Å
601	E	93.2	Very high	93.1	Very high	87 Å²	87	52.9 Å²	52.9	41%	0.407	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-23.1	176.4	-69.2	-66.5	130.9	0	0	112.9	E599 R604 N647	E599-E601 PolarHBondContact O-N 3.39Å; E599-E601 VanDerWaalsContact O-N 3.16Å; E601-R604 WeakPolarHBondContact O-CB 3.37Å; E601-R604 PolarHBondContact O-N 3.16Å; E601-R604 VanDerWaalsContact O-N 3.15Å; E601-R604 WeakPolarHBondContact OE1-CD 3.19Å; E601-R604 IonicContact OE1-CZ 3.84Å; E601-R604 IonicContact OE1-NE 3.98Å; E601-R604 IonicContact OE1-NH1 3.16Å; E601-R604 PolarHBondContact OE1-NH1 3.4Å; E601-R604 WeakPolarHBondContact OE2-CD 3.23Å; E601-R604 IonicContact OE2-NH1 2.77Å; E601-N647 HydrophobicContact CB-CB 4.11Å; E601-N647 CarbonylContact O-C 3.49Å; E601-N647 WeakPolarHBondContact O-CA 3.31Å; E601-N647 WeakPolarHBondContact O-CB 3.38Å; E601-N647 PolarHBondContact O-N 2.96Å; E601-N647 WeakPolarHBondContact OE2-CB 3.36Å; E601-N647 PolarHBondContact OE2-ND2 3.47Å
602	N	93.6	Very high	92.4	Very high	30 Å²	30	58.5 Å²	58.5	16%	0.16	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-33	178.3	-67.3	2.8	0	0	0	111.2	D562 N564 D598 E599 G600 D646 G648	D562-N602 WeakPolarHBondContact OD2-CB 3.17Å; D562-N602 VanDerWaalsContact OD2-CG 3.28Å; D562-N602 PolarHBondContact OD2-ND2 2.78Å; N564-N602 WeakPolarHBondContact CA-ND2 3.16Å; N564-N602 HydrophobicContact CB-CB 4.03Å; N564-N602 WeakPolarHBondContact CB-ND2 3.31Å; N564-N602 PolarHBondContact N-ND2 3.39Å; N564-N602 WeakPolarHBondContact OD1-CA 3.26Å; N564-N602 WeakPolarHBondContact OD1-CB 3.48Å; N564-N602 VanDerWaalsContact OD1-CG 3.29Å; N564-N602 PolarHBondContact OD1-O 3.45Å; D598-N602 HydrophobicContact CB-CB 3.67Å; E599-N602 WeakPolarHBondContact O-CB 3.23Å; E599-N602 PolarHBondContact O-N 3.01Å; G600-N602 VanDerWaalsContact C-N 3.35Å; N602-D646 WeakPolarHBondContact O-CB 2.99Å; N602-G648 WeakPolarHBondContact OD1-CA 3.26Å
603	A	93.2	Very high	91.9	Very high	28 Å²	28	61.3 Å²	61.3	23%	0.231	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	7.5	168	0	0	0	0	0	115	D596 D598 I605	D596-A603 HydrophobicContact CB-CB 3.85Å; D598-A603 HydrophobicContact CB-CB 4.41Å; D598-A603 WeakPolarHBondContact O-CB 3.4Å; A603-I605 PolarHBondContact O-N 2.93Å
604	R	94.5	Very high	91.8	Very high	132 Å²	132	57.5 Å²	57.5	50%	0.498	31%	0.307	S	S	.	.			trans	-84.8	83.7	-174.1	-168.8	173.6	176.1	-169.9	-0.3	112.5	G600 E601 D646 N647	G600-R604 WeakPolarHBondContact O-CB 3.15Å; G600-R604 PolarHBondContact O-N 3.05Å; E601-R604 WeakPolarHBondContact O-CB 3.37Å; E601-R604 PolarHBondContact O-N 3.16Å; E601-R604 VanDerWaalsContact O-N 3.15Å; E601-R604 WeakPolarHBondContact OE1-CD 3.19Å; E601-R604 IonicContact OE1-CZ 3.84Å; E601-R604 IonicContact OE1-NE 3.98Å; E601-R604 IonicContact OE1-NH1 3.16Å; E601-R604 PolarHBondContact OE1-NH1 3.4Å; E601-R604 WeakPolarHBondContact OE2-CD 3.23Å; E601-R604 IonicContact OE2-NH1 2.77Å; R604-D646 CarbonylContact O-C 3.51Å; R604-N647 HydrophobicContact CB-CB 4.4Å; R604-N647 PolarHBondContact O-N 3.04Å
605	I	95.3	Very high	91.7	Very high	24 Å²	24	57.1 Å²	57.1	12%	0.123	30%	0.304	C	S	.	.			trans	-63.7	136.9	-178.2	-63.5	164.6	0	0	0	112.7	P568 A594 D596 A603 Y607 A644 L645	P568-I605 HydrophobicContact CB-CD1 4.05Å; P568-I605 HydrophobicContact CB-CG1 3.99Å; P568-I605 HydrophobicContact CG-CG1 4.01Å; A594-I605 VanDerWaalsContact C-CD1 3.46Å; A594-I605 HydrophobicContact CB-CD1 3.94Å; A594-I605 WeakPolarHBondContact O-CD1 3.47Å; D596-I605 HydrophobicContact CB-CD1 4.21Å; D596-I605 HydrophobicContact CB-CG1 4.4Å; A603-I605 PolarHBondContact O-N 2.93Å; I605-Y607 HydrophobicContact CG2-CD1 4.25Å; I605-Y607 HydrophobicContact CG2-CD2 4.33Å; I605-Y607 HydrophobicContact CG2-CE1 3.79Å; I605-Y607 HydrophobicContact CG2-CE2 3.87Å; I605-A644 HydrophobicContact CG2-CB 3.88Å; I605-L645 CarbonylContact C-O 3.57Å; I605-L645 WeakPolarHBondContact CA-O 3.16Å
606	T	96.1	Very high	91.6	Very high	40 Å²	40	56.9 Å²	56.9	25%	0.245	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.5	168.4	57	0	0	0	0	110.1	S619 L645 R651	T606-S619 WeakPolarHBondContact CA-O 3.42Å; T606-L645 PolarHBondContact N-O 2.76Å; T606-L645 PolarHBondContact O-N 2.88Å; T606-L645 PolarHBondContact OG1-O 2.91Å; T606-R651 PolarHBondContact OG1-NH2 3.39Å; T606-R651 VanDerWaalsContact OG1-NH2 3.11Å
607	Y	96.7	Very high	91.6	Very high	23 Å²	23	57.1 Å²	57.1	9%	0.09	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	144.2	-177.7	-60.1	-80.1	0	0	0	112.4	F570 I592 A594 I605 S619 A644	F570-Y607 HydrophobicContact CE1-CD1 4.23Å; F570-Y607 HydrophobicContact CE1-CE1 4.04Å; I592-Y607 HydrophobicContact CD1-CD1 3.75Å; I592-Y607 HydrophobicContact CD1-CE1 4.47Å; I592-Y607 HydrophobicContact CD1-CG 4.35Å; I592-Y607 HydrophobicContact CG1-CD1 4.06Å; I592-Y607 HydrophobicContact CG1-CE1 4.42Å; A594-Y607 HydrophobicContact CB-CE1 4.18Å; A594-Y607 PolarHBondContact N-OH 3.35Å; A594-Y607 PolarHBondContact O-OH 3.46Å; I605-Y607 HydrophobicContact CG2-CD1 4.25Å; I605-Y607 HydrophobicContact CG2-CD2 4.33Å; I605-Y607 HydrophobicContact CG2-CE1 3.79Å; I605-Y607 HydrophobicContact CG2-CE2 3.87Å; Y607-S619 PolarHBondContact N-O 2.74Å; Y607-S619 WeakPolarHBondContact O-CA 3.48Å; Y607-S619 WeakPolarHBondContact O-CB 3.34Å; Y607-A644 HydrophobicContact CD1-CB 4.25Å; Y607-A644 HydrophobicContact CE1-CB 4.24Å
608	S	95.2	Very high	91.7	Very high	23 Å²	23	57.6 Å²	57.6	16%	0.161	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	160.2	171.4	70.5	0	0	0	0	112.5	A642 I643	S608-A642 CarbonylContact O-C 3.54Å; S608-A642 WeakPolarHBondContact O-CA 3.38Å; S608-I643 PolarHBondContact N-O 2.83Å; S608-I643 PolarHBondContact O-N 2.9Å
609	L	94.4	Very high	91.7	Very high	4 Å²	4	60.5 Å²	60.5	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	149.4	171.7	-55.1	179.4	0	0	0	110.5	D611 R612 F615 V617 I624 V640 A642 L658	L609-D611 WeakPolarHBondContact CB-O 3.38Å; L609-R612 HydrophobicContact CB-CG 4.45Å; L609-R612 WeakPolarHBondContact O-CG 3.16Å; L609-R612 PolarHBondContact O-NE 3.25Å; L609-F615 HydrophobicContact CD1-CB 3.66Å; L609-V617 HydrophobicContact CD1-CB 4.17Å; L609-V617 HydrophobicContact CD1-CG1 4.5Å; L609-V617 HydrophobicContact CD2-CB 4.18Å; L609-V617 HydrophobicContact CD2-CG1 4.28Å; L609-V617 HydrophobicContact CG-CB 3.87Å; L609-V617 HydrophobicContact CG-CG1 3.78Å; L609-I624 HydrophobicContact CD2-CD1 4.08Å; L609-V640 HydrophobicContact CB-CG1 4.39Å; L609-V640 HydrophobicContact CD1-CG1 4.3Å; L609-V640 HydrophobicContact CD2-CG1 4.14Å; L609-A642 HydrophobicContact CD2-CB 3.73Å; L609-L658 HydrophobicContact CD2-CD1 4.21Å
610	L	88.5	Confident	91.8	Very high	118 Å²	118	61.5 Å²	61.5	62%	0.618	33%	0.33	S	S	*	.	S	Bend	trans	-78.1	-48.4	169	-82.6	167.3	0	0	0	111.9	T641 I643	L610-T641 HydrophobicContact CD1-CG2 3.9Å; L610-T641 PolarHBondContact N-O 3Å; L610-I643 HydrophobicContact CD1-CD1 3.93Å; L610-I643 HydrophobicContact CD1-CG1 4.4Å; L610-I643 HydrophobicContact CD2-CD1 4.14Å; L610-I643 HydrophobicContact CG-CD1 3.79Å; L610-I643 HydrophobicContact CG-CG1 4.38Å
611	D	76.9	Confident	91.9	Very high	47 Å²	47	61.1 Å²	61.1	25%	0.251	32%	0.317	S	S	.	.			trans	-81.7	119.9	164.3	-178.7	11	0	0	0	109.7	L609 A613 N614 V640	L609-D611 WeakPolarHBondContact CB-O 3.38Å; D611-A613 WeakPolarHBondContact OD1-CB 3.27Å; D611-A613 PolarHBondContact OD1-N 3.32Å; D611-N614 PolarHBondContact OD2-ND2 2.94Å; D611-V640 HydrophobicContact CB-CG1 4.41Å
612	R	79.5	Confident	91.9	Very high	170 Å²	170	57 Å²	57	64%	0.642	30%	0.297	S	S	*	.			trans	-119.4	5.9	177.6	-55.7	-175.4	-174.8	-167.3	1.9	112.8	L609 F615	L609-R612 HydrophobicContact CB-CG 4.45Å; L609-R612 WeakPolarHBondContact O-CG 3.16Å; L609-R612 PolarHBondContact O-NE 3.25Å; R612-F615 WeakPolarHBondContact CA-O 3.15Å
613	A	85.4	Confident	92	Very high	59 Å²	59	58.8 Å²	58.8	49%	0.488	30%	0.302	S	S	.	.	S	Bend	trans	-80.7	-50.7	177.8	0	0	0	0	0	110.3	D611 N627	D611-A613 WeakPolarHBondContact OD1-CB 3.27Å; D611-A613 PolarHBondContact OD1-N 3.32Å; A613-N627 PolarHBondContact O-ND2 2.67Å
614	N	91.2	Very high	92	Very high	37 Å²	37	57.5 Å²	57.5	20%	0.198	29%	0.291	C	S	.	.	S	Bend	trans	-89.5	-28.3	-174.1	-57.3	-63.7	0	0	0	112.9	D611 N627 V628 F630 Y638	D611-N614 PolarHBondContact OD2-ND2 2.94Å; N614-N627 WeakPolarHBondContact O-CB 3.35Å; N614-N627 PolarHBondContact O-N 3.3Å; N614-V628 HydrophobicContact CB-CG2 4.39Å; N614-F630 HydrophobicContact CB-CE1 4.11Å; N614-F630 HydrophobicContact CB-CZ 4.19Å; N614-Y638 HydrophobicContact CB-CD1 4.31Å; N614-Y638 HydrophobicContact CB-CE1 4.06Å
615	F	93.1	Very high	92	Very high	1 Å²	1	52.3 Å²	52.3	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	156.9	-173.3	-59.3	-83.8	0	0	0	112.4	I579 L609 R612 I624 T625 F630 Y638 V640 I660	I579-F615 HydrophobicContact CD1-CE1 3.71Å; L609-F615 HydrophobicContact CD1-CB 3.66Å; R612-F615 WeakPolarHBondContact CA-O 3.15Å; F615-I624 HydrophobicContact CB-CG2 4.43Å; F615-I624 HydrophobicContact CD1-CG2 4.39Å; F615-T625 WeakPolarHBondContact CA-O 3.37Å; F615-F630 HydrophobicContact CD1-CE2 4.49Å; F615-F630 HydrophobicContact CD1-CZ 4.23Å; F615-F630 AromaticContact CE1-CE2 3.62Å; F615-F630 HydrophobicContact CE1-CE2 3.62Å; F615-F630 AromaticContact CE1-CZ 3.45Å; F615-F630 HydrophobicContact CE1-CZ 3.45Å; F615-F630 VanDerWaalsContact CE1-CZ 3.45Å; F615-F630 HydrophobicContact CE2-CE1 4.4Å; F615-F630 AromaticContact CE2-CZ 3.85Å; F615-F630 HydrophobicContact CE2-CZ 3.85Å; F615-F630 AromaticContact CZ-CE1 4Å; F615-F630 HydrophobicContact CZ-CE1 4Å; F615-F630 AromaticContact CZ-CE2 3.78Å; F615-F630 HydrophobicContact CZ-CE2 3.78Å; F615-F630 AromaticContact CZ-CZ 3.22Å; F615-F630 HydrophobicContact CZ-CZ 3.22Å; F615-Y638 AromaticContact CE2-CD1 3.87Å; F615-Y638 HydrophobicContact CE2-CD1 3.87Å; F615-Y638 AromaticContact CE2-CG 3.83Å; F615-Y638 HydrophobicContact CE2-CG 3.83Å; F615-Y638 HydrophobicContact CZ-CD1 4.48Å; F615-Y638 HydrophobicContact CZ-CD2 4.38Å; F615-Y638 HydrophobicContact CZ-CG 4.09Å; F615-V640 HydrophobicContact CD2-CG2 3.52Å; F615-V640 HydrophobicContact CE2-CG2 3.66Å; F615-V640 HydrophobicContact CG-CG2 4.41Å; F615-I660 HydrophobicContact CD1-CD1 4.06Å; F615-I660 HydrophobicContact CD2-CD1 4.25Å; F615-I660 HydrophobicContact CE1-CD1 3.6Å; F615-I660 HydrophobicContact CE1-CG2 4.18Å; F615-I660 HydrophobicContact CE2-CD1 3.83Å; F615-I660 HydrophobicContact CG-CD1 4.37Å; F615-I660 HydrophobicContact CZ-CB 4.44Å; F615-I660 HydrophobicContact CZ-CD1 3.48Å; F615-I660 VanDerWaalsContact CZ-CD1 3.48Å; F615-I660 HydrophobicContact CZ-CG2 4Å
616	K	92.9	Very high	91.9	Very high	113 Å²	113	51.2 Å²	51.2	49%	0.491	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	150.4	170.8	-82.8	163.9	169.3	158.6	0	109.5	I624 T625 N627	K616-I624 CarbonylContact O-C 3.56Å; K616-I624 VanDerWaalsContact O-CA 3.3Å; K616-I624 WeakPolarHBondContact O-CA 3.35Å; K616-T625 PolarHBondContact N-O 3.28Å; K616-T625 PolarHBondContact O-N 2.71Å; K616-N627 HydrophobicContact CD-CB 4.19Å; K616-N627 WeakPolarHBondContact CD-OD1 3Å; K616-N627 WeakPolarHBondContact CE-OD1 3.47Å; K616-N627 HydrophobicContact CG-CB 4.2Å; K616-N627 PolarHBondContact NZ-OD1 3.48Å
617	V	94.9	Very high	91.7	Very high	31 Å²	31	51.5 Å²	51.5	19%	0.188	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	141.1	167.9	70.3	0	0	0	0	109.7	I592 L609 S619 W623 I624	I592-V617 HydrophobicContact CD1-CG2 4.2Å; I592-V617 HydrophobicContact CG1-CG2 4.42Å; L609-V617 HydrophobicContact CD1-CB 4.17Å; L609-V617 HydrophobicContact CD1-CG1 4.5Å; L609-V617 HydrophobicContact CD2-CB 4.18Å; L609-V617 HydrophobicContact CD2-CG1 4.28Å; L609-V617 HydrophobicContact CG-CB 3.87Å; L609-V617 HydrophobicContact CG-CG1 3.78Å; V617-S619 PolarHBondContact O-N 3.21Å; V617-W623 CarbonylContact C-O 3.58Å; V617-W623 WeakPolarHBondContact CA-O 3.4Å; V617-I624 HydrophobicContact CB-CG1 4.12Å; V617-I624 HydrophobicContact CG2-CG1 3.77Å
618	D	94.3	Very high	91.5	Very high	67 Å²	67	52.5 Å²	52.5	36%	0.358	28%	0.277	S	S	.	.			trans	-71.5	116.3	163.2	178.7	-28.5	0	0	0	108.9	L620 T621 G622 W623	D618-L620 PolarHBondContact O-N 2.93Å; D618-L620 PolarHBondContact OD1-N 3.34Å; D618-T621 WeakPolarHBondContact CB-OG1 3.26Å; D618-T621 PolarHBondContact OD1-N 3.45Å; D618-T621 WeakPolarHBondContact OD2-CB 3.49Å; D618-T621 WeakPolarHBondContact OD2-CG2 3.49Å; D618-T621 PolarHBondContact OD2-OG1 3.11Å; D618-G622 WeakPolarHBondContact O-CA 3.33Å; D618-G622 PolarHBondContact O-N 2.94Å; D618-W623 HydrophobicContact CB-CB 4.38Å; D618-W623 PolarHBondContact N-O 3Å
619	S	94.4	Very high	91.4	Very high	71 Å²	71	56.7 Å²	56.7	50%	0.497	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.9	-174.3	55.7	0	0	0	0	114.8	T606 Y607 V617	T606-S619 WeakPolarHBondContact CA-O 3.42Å; Y607-S619 PolarHBondContact N-O 2.74Å; Y607-S619 WeakPolarHBondContact O-CA 3.48Å; Y607-S619 WeakPolarHBondContact O-CB 3.34Å; V617-S619 PolarHBondContact O-N 3.21Å
620	L	93.2	Very high	91.4	Very high	128 Å²	128	56.7 Å²	56.7	67%	0.67	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-45.2	176.8	178.6	64.1	0	0	0	111.5	D618	D618-L620 PolarHBondContact O-N 2.93Å; D618-L620 PolarHBondContact OD1-N 3.34Å
621	T	93.6	Very high	91.7	Very high	50 Å²	50	54.3 Å²	54.3	31%	0.307	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-8.4	-171.5	74	0	0	0	0	114.5	Q591 D618 W623	Q591-T621 WeakPolarHBondContact CG-O 3.38Å; Q591-T621 PolarHBondContact NE2-O 3.18Å; D618-T621 WeakPolarHBondContact CB-OG1 3.26Å; D618-T621 PolarHBondContact OD1-N 3.45Å; D618-T621 WeakPolarHBondContact OD2-CB 3.49Å; D618-T621 WeakPolarHBondContact OD2-CG2 3.49Å; D618-T621 PolarHBondContact OD2-OG1 3.11Å; T621-W623 PolarHBondContact O-N 2.89Å
622	G	94	Very high	92.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.277	C	S	.	.			trans	69.2	7.6	179.9	0	0	0	0	0	114.5	Q591 I592 D618 I624	Q591-G622 WeakPolarHBondContact CA-O 3.46Å; I592-G622 VanDerWaalsContact CG1-O 3.26Å; I592-G622 WeakPolarHBondContact CG1-O 3.3Å; I592-G622 PolarHBondContact N-O 2.95Å; D618-G622 WeakPolarHBondContact O-CA 3.33Å; D618-G622 PolarHBondContact O-N 2.94Å; G622-I624 PolarHBondContact O-N 2.65Å
623	W	95.2	Very high	93.2	Very high	69 Å²	69	47.6 Å²	47.6	26%	0.261	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	123.3	175.1	-85.4	103.5	0	0	0	111.2	K588 V590 Q591 V617 D618 T621	K588-W623 HydrophobicContact CB-CD2 4.24Å; K588-W623 HydrophobicContact CB-CE3 3.62Å; K588-W623 HydrophobicContact CB-CZ3 3.81Å; K588-W623 HydrophobicContact CD-CD2 3.68Å; K588-W623 HydrophobicContact CD-CE3 3.95Å; K588-W623 HydrophobicContact CD-CG 3.93Å; K588-W623 HydrophobicContact CD-CZ3 4.47Å; K588-W623 HydrophobicContact CG-CD2 4.06Å; K588-W623 HydrophobicContact CG-CE3 3.91Å; K588-W623 HydrophobicContact CG-CG 4.34Å; V590-W623 VanDerWaalsContact O-CE3 3.31Å; Q591-W623 HydrophobicContact CB-CD2 3.9Å; Q591-W623 HydrophobicContact CB-CE3 4.02Å; Q591-W623 HydrophobicContact CB-CG 4.5Å; Q591-W623 HydrophobicContact CB-CH2 4.1Å; Q591-W623 HydrophobicContact CB-CZ2 3.97Å; Q591-W623 HydrophobicContact CB-CZ3 4.12Å; Q591-W623 HydrophobicContact CG-CD2 4.11Å; Q591-W623 HydrophobicContact CG-CG 4.24Å; Q591-W623 HydrophobicContact CG-CZ2 4.46Å; V617-W623 CarbonylContact C-O 3.58Å; V617-W623 WeakPolarHBondContact CA-O 3.4Å; D618-W623 HydrophobicContact CB-CB 4.38Å; D618-W623 PolarHBondContact N-O 3Å; T621-W623 PolarHBondContact O-N 2.89Å
624	I	93.5	Very high	93.6	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.1	176.1	-60.3	-178.7	0	0	0	109.7	V589 V590 I592 L609 F615 K616 V617 G622 L658	V589-I624 PolarHBondContact N-O 2.76Å; V589-I624 VanDerWaalsContact N-O 3.14Å; V590-I624 HydrophobicContact CG1-CB 3.95Å; V590-I624 HydrophobicContact CG1-CD1 4.02Å; V590-I624 HydrophobicContact CG1-CG1 4.28Å; V590-I624 PolarHBondContact O-N 2.73Å; I592-I624 HydrophobicContact CD1-CD1 4.14Å; I592-I624 HydrophobicContact CG1-CD1 4.16Å; I592-I624 HydrophobicContact CG1-CG1 4.38Å; I592-I624 HydrophobicContact CG2-CD1 3.75Å; L609-I624 HydrophobicContact CD2-CD1 4.08Å; F615-I624 HydrophobicContact CB-CG2 4.43Å; F615-I624 HydrophobicContact CD1-CG2 4.39Å; K616-I624 CarbonylContact O-C 3.56Å; K616-I624 VanDerWaalsContact O-CA 3.3Å; K616-I624 WeakPolarHBondContact O-CA 3.35Å; V617-I624 HydrophobicContact CB-CG1 4.12Å; V617-I624 HydrophobicContact CG2-CG1 3.77Å; G622-I624 PolarHBondContact O-N 2.65Å; I624-L658 HydrophobicContact CD1-CD1 3.25Å
625	T	93.3	Very high	93.7	Very high	24 Å²	24	53.7 Å²	53.7	15%	0.147	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.6	-176.2	66.2	0	0	0	0	111.1	E587 K588 F615 K616	E587-T625 WeakPolarHBondContact O-CA 3.09Å; E587-T625 WeakPolarHBondContact O-CB 3.13Å; E587-T625 VanDerWaalsContact O-CG2 3.23Å; E587-T625 WeakPolarHBondContact O-CG2 3.44Å; K588-T625 HydrophobicContact CG-CG2 4.35Å; F615-T625 WeakPolarHBondContact CA-O 3.37Å; K616-T625 PolarHBondContact N-O 3.28Å; K616-T625 PolarHBondContact O-N 2.71Å
626	P	93.3	Very high	93.6	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.006	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	132.3	176.6	33.2	-33.5	0	0	0	109.1	N583 P584 G586 E587 F630	N583-P626 VanDerWaalsContact ND2-CB 3.33Å; N583-P626 WeakPolarHBondContact ND2-CB 3.02Å; N583-P626 WeakPolarHBondContact ND2-CG 3.42Å; P584-P626 WeakPolarHBondContact O-CG 3.24Å; G586-P626 PolarHBondContact N-O 2.62Å; E587-P626 WeakPolarHBondContact O-CD 3.5Å; P626-F630 HydrophobicContact CB-CD2 4.49Å; P626-F630 HydrophobicContact CB-CE2 3.79Å
627	N	93	Very high	93.7	Very high	45 Å²	45	55.2 Å²	55.2	24%	0.241	29%	0.294	C	S	.	.	S	Bend	trans	-92.4	-14.5	175.5	-175	55.1	0	0	0	112.3	A613 N614 K616	A613-N627 PolarHBondContact O-ND2 2.67Å; N614-N627 WeakPolarHBondContact O-CB 3.35Å; N614-N627 PolarHBondContact O-N 3.3Å; K616-N627 HydrophobicContact CD-CB 4.19Å; K616-N627 WeakPolarHBondContact CD-OD1 3Å; K616-N627 WeakPolarHBondContact CE-OD1 3.47Å; K616-N627 HydrophobicContact CG-CB 4.2Å; K616-N627 PolarHBondContact NZ-OD1 3.48Å
628	V	92.4	Very high	93.6	Very high	44 Å²	44	54.9 Å²	54.9	27%	0.267	29%	0.289	S	S	.	.	S	Bend	trans	-127.1	168.4	177.9	-60.6	0	0	0	0	110	N583 N614 F630	N583-V628 PolarHBondContact ND2-O 3.49Å; N614-V628 HydrophobicContact CB-CG2 4.39Å; V628-F630 HydrophobicContact CG2-CD1 3.88Å; V628-F630 HydrophobicContact CG2-CE1 3.39Å; V628-F630 HydrophobicContact CG2-CE2 4.37Å; V628-F630 HydrophobicContact CG2-CZ 3.66Å
629	M	93.2	Very high	93.5	Very high	111 Å²	111	58.5 Å²	58.5	55%	0.547	30%	0.304	S	S	.	.			trans	-89.7	125.6	164.9	-178.6	174	164.4	0	0	106.4	N582	N582-M629 HydrophobicContact CB-CE 3.97Å; N582-M629 WeakPolarHBondContact OD1-CE 3.33Å
630	F	93.2	Very high	93.3	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.018	28%	0.281	C	S	.	.			trans	-86.2	158.1	-179.8	-66.2	-65	0	0	0	112	I579 N582 N583 N614 F615 P626 V628 Y638 V662	I579-F630 HydrophobicContact CD1-CD2 4.48Å; I579-F630 HydrophobicContact CD1-CE2 4.06Å; I579-F630 HydrophobicContact CG2-CD2 3.96Å; I579-F630 HydrophobicContact CG2-CE2 4.49Å; N582-F630 PolarHBondContact N-O 3.07Å; N583-F630 VanDerWaalsContact OD1-CD2 3.23Å; N583-F630 WeakPolarHBondContact OD1-CD2 3.19Å; N583-F630 PolarHBondContact OD1-N 2.88Å; N614-F630 HydrophobicContact CB-CE1 4.11Å; N614-F630 HydrophobicContact CB-CZ 4.19Å; F615-F630 HydrophobicContact CD1-CE2 4.49Å; F615-F630 HydrophobicContact CD1-CZ 4.23Å; F615-F630 AromaticContact CE1-CE2 3.62Å; F615-F630 HydrophobicContact CE1-CE2 3.62Å; F615-F630 AromaticContact CE1-CZ 3.45Å; F615-F630 HydrophobicContact CE1-CZ 3.45Å; F615-F630 VanDerWaalsContact CE1-CZ 3.45Å; F615-F630 HydrophobicContact CE2-CE1 4.4Å; F615-F630 AromaticContact CE2-CZ 3.85Å; F615-F630 HydrophobicContact CE2-CZ 3.85Å; F615-F630 AromaticContact CZ-CE1 4Å; F615-F630 HydrophobicContact CZ-CE1 4Å; F615-F630 AromaticContact CZ-CE2 3.78Å; F615-F630 HydrophobicContact CZ-CE2 3.78Å; F615-F630 AromaticContact CZ-CZ 3.22Å; F615-F630 HydrophobicContact CZ-CZ 3.22Å; P626-F630 HydrophobicContact CB-CD2 4.49Å; P626-F630 HydrophobicContact CB-CE2 3.79Å; V628-F630 HydrophobicContact CG2-CD1 3.88Å; V628-F630 HydrophobicContact CG2-CE1 3.39Å; V628-F630 HydrophobicContact CG2-CE2 4.37Å; V628-F630 HydrophobicContact CG2-CZ 3.66Å; F630-Y638 HydrophobicContact CD1-CD2 4.5Å; F630-Y638 AromaticContact CD1-CE2 3.6Å; F630-Y638 HydrophobicContact CD1-CE2 3.6Å; F630-Y638 AromaticContact CD1-CZ 3.66Å; F630-Y638 WeakPolarHBondContact CD1-OH 3.5Å; F630-Y638 HydrophobicContact CE1-CD2 4.26Å; F630-Y638 HydrophobicContact CE1-CE1 4.02Å; F630-Y638 AromaticContact CE1-CE2 3.63Å; F630-Y638 HydrophobicContact CE1-CE2 3.63Å; F630-Y638 AromaticContact CE1-CZ 3.47Å; F630-Y638 VanDerWaalsContact CE1-CZ 3.47Å; F630-V662 HydrophobicContact CB-CG1 4.09Å; F630-V662 HydrophobicContact CB-CG2 4.24Å; F630-V662 HydrophobicContact CG-CG2 4.39Å
631	D	94.4	Very high	93.4	Very high	69 Å²	69	51.3 Å²	51.3	37%	0.369	26%	0.263	S	S	.	.			trans	-145.1	115.4	-175.9	151.2	-5.2	0	0	0	104	E633 T634 R635	D631-E633 PolarHBondContact OD1-N 3.25Å; D631-T634 WeakPolarHBondContact OD1-CB 3.42Å; D631-T634 PolarHBondContact OD1-N 3.23Å; D631-T634 PolarHBondContact OD1-OG1 3.14Å; D631-T634 VanDerWaalsContact OD1-OG1 3.12Å; D631-T634 WeakPolarHBondContact OD2-CB 3.31Å; D631-T634 PolarHBondContact OD2-OG1 2.55Å; D631-R635 PolarHBondContact O-N 2.9Å
632	R	95.4	Very high	93.4	Very high	30 Å²	30	49 Å²	49	11%	0.113	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-33.8	-169.2	-172.4	-146.5	61	109.8	4.7	111	E581 T634 R635 D636 V662 D664 K718 E720	E581-R632 HydrophobicContact CB-CB 4.45Å; E581-R632 WeakPolarHBondContact OE2-CB 3.45Å; E581-R632 PolarHBondContact OE2-N 2.98Å; R632-T634 PolarHBondContact O-N 3.14Å; R632-R635 CarbonylContact O-C 3.59Å; R632-R635 VanDerWaalsContact O-C 3.25Å; R632-R635 PolarHBondContact O-N 3.02Å; R632-D636 PolarHBondContact O-N 2.85Å; R632-V662 HydrophobicContact CB-CB 4.32Å; R632-V662 HydrophobicContact CB-CG1 3.82Å; R632-V662 HydrophobicContact CG-CB 4.23Å; R632-V662 HydrophobicContact CG-CG1 4.22Å; R632-D664 IonicContact CZ-OD1 2.96Å; R632-D664 IonicContact NE-OD1 3.67Å; R632-D664 PolarHBondContact NE-OD1 2.94Å; R632-D664 IonicContact NH1-OD1 3.25Å; R632-D664 IonicContact NH2-OD1 2.65Å; R632-D664 PolarHBondContact NH2-OD1 3.33Å; R632-K718 PolarHBondContact NH2-O 2.98Å; R632-E720 IonicContact CZ-OE2 3.83Å; R632-E720 IonicContact NH1-OE2 2.7Å; R632-E720 PolarHBondContact NH1-OE2 3.35Å
633	E	94	Very high	93.5	Very high	45 Å²	45	50.7 Å²	50.7	21%	0.21	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-29.1	177	-64.4	62.8	-115.3	0	0	111.4	D631 H668 K718	D631-E633 PolarHBondContact OD1-N 3.25Å; E633-H668 IonicContact OE2-CE1 3.59Å; E633-H668 PolarHBondContact OE2-CE1 2.96Å; E633-H668 VanDerWaalsContact OE2-CE1 3.3Å; E633-H668 IonicContact OE2-ND1 2.7Å; E633-K718 HydrophobicContact CB-CB 4.47Å; E633-K718 HydrophobicContact CB-CD 4.03Å; E633-K718 HydrophobicContact CG-CB 3.49Å; E633-K718 VanDerWaalsContact CG-CB 3.49Å; E633-K718 HydrophobicContact CG-CD 3.77Å; E633-K718 HydrophobicContact CG-CG 4.37Å
634	T	93	Very high	93.6	Very high	109 Å²	109	47.4 Å²	47.4	67%	0.669	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-43.9	167.5	-69.9	0	0	0	0	111.2	D631 R632	D631-T634 WeakPolarHBondContact OD1-CB 3.42Å; D631-T634 PolarHBondContact OD1-N 3.23Å; D631-T634 PolarHBondContact OD1-OG1 3.14Å; D631-T634 VanDerWaalsContact OD1-OG1 3.12Å; D631-T634 WeakPolarHBondContact OD2-CB 3.31Å; D631-T634 PolarHBondContact OD2-OG1 2.55Å; R632-T634 PolarHBondContact O-N 3.14Å
635	R	92.5	Very high	93.7	Very high	116 Å²	116	49.4 Å²	49.4	44%	0.438	26%	0.255	S	S	.	.			trans	-159.5	107.6	179.7	-171.8	161.7	175.1	165.3	5.4	115.8	D631 R632 S637 Y638 V662	D631-R635 PolarHBondContact O-N 2.9Å; R632-R635 CarbonylContact O-C 3.59Å; R632-R635 VanDerWaalsContact O-C 3.25Å; R632-R635 PolarHBondContact O-N 3.02Å; R635-S637 VanDerWaalsContact C-N 3.34Å; R635-S637 PolarHBondContact NE-O 2.88Å; R635-S637 PolarHBondContact NH2-O 2.82Å; R635-S637 VanDerWaalsContact NH2-O 3.15Å; R635-S637 PolarHBondContact O-N 2.89Å; R635-Y638 HydrophobicContact CB-CE2 4.18Å; R635-Y638 HydrophobicContact CG-CD2 4.37Å; R635-Y638 HydrophobicContact CG-CE2 3.8Å; R635-V662 WeakPolarHBondContact O-CG2 3.48Å
636	D	92.7	Very high	93.8	Very high	94 Å²	94	48.3 Å²	48.3	50%	0.503	25%	0.248	S	C	.	.	S	Bend	trans	-60.7	-28.2	175.9	67.5	-2.8	0	0	0	116.2	R632 V662	R632-D636 PolarHBondContact O-N 2.85Å; D636-V662 PolarHBondContact O-N 2.94Å
637	S	94.1	Very high	93.8	Very high	52 Å²	52	50.5 Å²	50.5	36%	0.364	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	142.2	-163.3	63.3	0	0	0	0	115.3	R635 I660	R635-S637 VanDerWaalsContact C-N 3.34Å; R635-S637 PolarHBondContact NE-O 2.88Å; R635-S637 PolarHBondContact NH2-O 2.82Å; R635-S637 VanDerWaalsContact NH2-O 3.15Å; R635-S637 PolarHBondContact O-N 2.89Å; S637-I660 CarbonylContact C-O 3.53Å; S637-I660 VanDerWaalsContact CA-O 3.32Å; S637-I660 WeakPolarHBondContact CA-O 3.35Å
638	Y	92.1	Very high	93.6	Very high	24 Å²	24	48.5 Å²	48.5	9%	0.094	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.1	177.1	-65.2	-105.3	0	0	0	110.8	N614 F615 F630 R635 I660 V662	N614-Y638 HydrophobicContact CB-CD1 4.31Å; N614-Y638 HydrophobicContact CB-CE1 4.06Å; F615-Y638 AromaticContact CE2-CD1 3.87Å; F615-Y638 HydrophobicContact CE2-CD1 3.87Å; F615-Y638 AromaticContact CE2-CG 3.83Å; F615-Y638 HydrophobicContact CE2-CG 3.83Å; F615-Y638 HydrophobicContact CZ-CD1 4.48Å; F615-Y638 HydrophobicContact CZ-CD2 4.38Å; F615-Y638 HydrophobicContact CZ-CG 4.09Å; F630-Y638 HydrophobicContact CD1-CD2 4.5Å; F630-Y638 AromaticContact CD1-CE2 3.6Å; F630-Y638 HydrophobicContact CD1-CE2 3.6Å; F630-Y638 AromaticContact CD1-CZ 3.66Å; F630-Y638 WeakPolarHBondContact CD1-OH 3.5Å; F630-Y638 HydrophobicContact CE1-CD2 4.26Å; F630-Y638 HydrophobicContact CE1-CE1 4.02Å; F630-Y638 AromaticContact CE1-CE2 3.63Å; F630-Y638 HydrophobicContact CE1-CE2 3.63Å; F630-Y638 AromaticContact CE1-CZ 3.47Å; F630-Y638 VanDerWaalsContact CE1-CZ 3.47Å; R635-Y638 HydrophobicContact CB-CE2 4.18Å; R635-Y638 HydrophobicContact CG-CD2 4.37Å; R635-Y638 HydrophobicContact CG-CE2 3.8Å; Y638-I660 PolarHBondContact N-O 3.23Å; Y638-I660 PolarHBondContact O-N 3.43Å; Y638-V662 HydrophobicContact CD2-CG2 4.2Å; Y638-V662 HydrophobicContact CE2-CG2 4.02Å
639	Q	92.4	Very high	93.4	Very high	142 Å²	142	55.7 Å²	55.7	66%	0.664	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	112.3	169	-76.9	-171.8	-17.8	0	0	108	L657 L658 N659	Q639-L657 HydrophobicContact CB-CD1 4.11Å; Q639-L657 HydrophobicContact CG-CD1 4.45Å; Q639-L658 WeakPolarHBondContact CA-O 3.28Å; Q639-N659 PolarHBondContact NE2-OD1 2.94Å
640	V	91.3	Very high	93.3	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.1	-176.2	-178	0	0	0	0	108.6	L609 D611 F615 L658 I660	L609-V640 HydrophobicContact CB-CG1 4.39Å; L609-V640 HydrophobicContact CD1-CG1 4.3Å; L609-V640 HydrophobicContact CD2-CG1 4.14Å; D611-V640 HydrophobicContact CB-CG1 4.41Å; F615-V640 HydrophobicContact CD2-CG2 3.52Å; F615-V640 HydrophobicContact CE2-CG2 3.66Å; F615-V640 HydrophobicContact CG-CG2 4.41Å; V640-L658 HydrophobicContact CB-CB 4.28Å; V640-L658 HydrophobicContact CB-CD1 4.22Å; V640-L658 HydrophobicContact CG1-CD1 4.22Å; V640-L658 PolarHBondContact N-O 2.77Å; V640-L658 VanDerWaalsContact O-CB 3.26Å; V640-L658 WeakPolarHBondContact O-CB 3.41Å; V640-L658 VanDerWaalsContact O-CG 3.26Å; V640-L658 WeakPolarHBondContact O-CG 3.35Å; V640-L658 PolarHBondContact O-N 2.83Å; V640-I660 HydrophobicContact CB-CD1 4.28Å; V640-I660 HydrophobicContact CG2-CD1 3.78Å
641	T	94	Very high	93.3	Very high	48 Å²	48	60.4 Å²	60.4	29%	0.294	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	118.5	173.8	-54.8	0	0	0	0	109.5	L610 V656	L610-T641 HydrophobicContact CD1-CG2 3.9Å; L610-T641 PolarHBondContact N-O 3Å; T641-V656 WeakPolarHBondContact CA-O 3.15Å
642	A	94.6	Very high	93.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	152.5	166.9	0	0	0	0	0	110.6	I592 S608 L609 S655 V656 L658	I592-A642 HydrophobicContact CD1-CB 3.55Å; S608-A642 CarbonylContact O-C 3.54Å; S608-A642 WeakPolarHBondContact O-CA 3.38Å; L609-A642 HydrophobicContact CD2-CB 3.73Å; A642-S655 CarbonylContact O-C 3.53Å; A642-S655 WeakPolarHBondContact O-CA 3.44Å; A642-S655 WeakPolarHBondContact O-CB 3.33Å; A642-V656 HydrophobicContact CB-CG1 3.9Å; A642-V656 PolarHBondContact N-O 3.04Å; A642-V656 PolarHBondContact O-N 2.83Å; A642-L658 HydrophobicContact CB-CD1 4.11Å; A642-L658 HydrophobicContact CB-CG 4.39Å
643	I	95.6	Very high	93.3	Very high	37 Å²	37	61.2 Å²	61.2	19%	0.19	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	132.1	177.1	-54.4	179.8	0	0	0	108.5	S608 L610 L645 S654	S608-I643 PolarHBondContact N-O 2.83Å; S608-I643 PolarHBondContact O-N 2.9Å; L610-I643 HydrophobicContact CD1-CD1 3.93Å; L610-I643 HydrophobicContact CD1-CG1 4.4Å; L610-I643 HydrophobicContact CD2-CD1 4.14Å; L610-I643 HydrophobicContact CG-CD1 3.79Å; L610-I643 HydrophobicContact CG-CG1 4.38Å; I643-L645 HydrophobicContact CB-CD1 4.34Å; I643-L645 HydrophobicContact CG2-CD1 3.61Å; I643-L645 HydrophobicContact CG2-CG 3.92Å; I643-S654 VanDerWaalsContact CA-O 3.29Å; I643-S654 WeakPolarHBondContact CA-O 3.29Å; I643-S654 VanDerWaalsContact CG2-O 3.31Å; I643-S654 WeakPolarHBondContact CG2-O 3.29Å
644	A	96.7	Very high	93.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	134.9	166.3	0	0	0	0	0	108.7	P568 F570 A594 I605 Y607 S653 S654	P568-A644 HydrophobicContact CB-CB 3.61Å; P568-A644 HydrophobicContact CG-CB 4.22Å; F570-A644 HydrophobicContact CE1-CB 4.13Å; F570-A644 HydrophobicContact CE2-CB 3.74Å; F570-A644 HydrophobicContact CZ-CB 3.43Å; F570-A644 VanDerWaalsContact CZ-CB 3.43Å; A594-A644 HydrophobicContact CB-CB 3.93Å; I605-A644 HydrophobicContact CG2-CB 3.88Å; Y607-A644 HydrophobicContact CD1-CB 4.25Å; Y607-A644 HydrophobicContact CE1-CB 4.24Å; A644-S653 WeakPolarHBondContact O-CA 3.46Å; A644-S653 VanDerWaalsContact O-CB 3.29Å; A644-S653 WeakPolarHBondContact O-CB 2.95Å; A644-S654 PolarHBondContact N-O 3.01Å; A644-S654 PolarHBondContact O-N 2.99Å
645	L	95.7	Very high	93.5	Very high	42 Å²	42	58.9 Å²	58.9	22%	0.22	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.8	175.2	-51.2	93.2	0	0	0	109.6	I605 T606 I643	I605-L645 CarbonylContact C-O 3.57Å; I605-L645 WeakPolarHBondContact CA-O 3.16Å; T606-L645 PolarHBondContact N-O 2.76Å; T606-L645 PolarHBondContact O-N 2.88Å; T606-L645 PolarHBondContact OG1-O 2.91Å; I643-L645 HydrophobicContact CB-CD1 4.34Å; I643-L645 HydrophobicContact CG2-CD1 3.61Å; I643-L645 HydrophobicContact CG2-CG 3.92Å
646	D	96.3	Very high	93.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.286	C	S	.	.			trans	-62.8	-176.2	165.9	57.1	53.7	0	0	0	112.7	N564 N602 R604 G648 R651 L652	N564-D646 PolarHBondContact ND2-OD2 3.14Å; N602-D646 WeakPolarHBondContact O-CB 2.99Å; R604-D646 CarbonylContact O-C 3.51Å; D646-G648 PolarHBondContact OD1-N 2.99Å; D646-R651 PolarHBondContact O-NE 2.81Å; D646-R651 PolarHBondContact O-NH2 2.86Å; D646-R651 WeakPolarHBondContact OD1-CA 3.21Å; D646-R651 WeakPolarHBondContact OD1-CB 3.49Å; D646-L652 PolarHBondContact OD1-N 2.92Å; D646-L652 VanDerWaalsContact OD2-C 3.27Å; D646-L652 WeakPolarHBondContact OD2-CA 3.41Å; D646-L652 VanDerWaalsContact OD2-CB 3.27Å; D646-L652 WeakPolarHBondContact OD2-CB 3.3Å; D646-L652 PolarHBondContact OD2-N 2.83Å; D646-L652 VanDerWaalsContact OD2-O 3.07Å
647	N	92.8	Very high	93.7	Very high	47 Å²	47	51.6 Å²	51.6	25%	0.251	28%	0.275	S	S	.	.	S	Bend	trans	-108.8	20.6	166.4	-73.3	-16.7	0	0	0	113.2	E601 R604 R651	E601-N647 HydrophobicContact CB-CB 4.11Å; E601-N647 CarbonylContact O-C 3.49Å; E601-N647 WeakPolarHBondContact O-CA 3.31Å; E601-N647 WeakPolarHBondContact O-CB 3.38Å; E601-N647 PolarHBondContact O-N 2.96Å; E601-N647 WeakPolarHBondContact OE2-CB 3.36Å; E601-N647 PolarHBondContact OE2-ND2 3.47Å; R604-N647 HydrophobicContact CB-CB 4.4Å; R604-N647 PolarHBondContact O-N 3.04Å; N647-R651 PolarHBondContact OD1-NH2 2.87Å
648	G	90	Very high	93.7	Very high	3 Å²	3	49.1 Å²	49.1	3%	0.031	26%	0.258	C	S	.	.			trans	-70.2	-177.6	-171.9	0	0	0	0	0	117	N564 N602 D646 P650 R651	N564-G648 WeakPolarHBondContact OD1-CA 3.26Å; N602-G648 WeakPolarHBondContact OD1-CA 3.26Å; D646-G648 PolarHBondContact OD1-N 2.99Å; G648-P650 VanDerWaalsContact C-C 3.5Å; G648-P650 CarbonylContact C-O 3.13Å; G648-P650 VanDerWaalsContact C-O 3.3Å; G648-P650 CarbonylContact O-C 3.57Å; G648-R651 WeakPolarHBondContact O-CG 3.26Å; G648-R651 PolarHBondContact O-N 3.07Å
649	K	88.1	Confident	93.8	Very high	195 Å²	195	49.5 Å²	49.5	85%	0.848	26%	0.261	S	S	*	.	S	Bend	trans	-142.5	96.6	177.9	-67.7	176.8	-172	157.2	0	110.9
650	P	90.9	Very high	93.7	Very high	91 Å²	91	42.9 Å²	42.9	59%	0.591	23%	0.23	S	C	*	.	S	Bend	cis	-66.5	157.4	1.8	31.1	-36.9	0	0	0	112.4	G648	G648-P650 VanDerWaalsContact C-C 3.5Å; G648-P650 CarbonylContact C-O 3.13Å; G648-P650 VanDerWaalsContact C-O 3.3Å; G648-P650 CarbonylContact O-C 3.57Å
651	R	92.6	Very high	93.9	Very high	124 Å²	124	46.1 Å²	46.1	47%	0.468	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-78.5	129.8	168.9	-65.9	-176.4	76.3	-175.1	10.2	110	T606 D646 N647 G648	T606-R651 PolarHBondContact OG1-NH2 3.39Å; T606-R651 VanDerWaalsContact OG1-NH2 3.11Å; D646-R651 PolarHBondContact O-NE 2.81Å; D646-R651 PolarHBondContact O-NH2 2.86Å; D646-R651 WeakPolarHBondContact OD1-CA 3.21Å; D646-R651 WeakPolarHBondContact OD1-CB 3.49Å; N647-R651 PolarHBondContact OD1-NH2 2.87Å; G648-R651 WeakPolarHBondContact O-CG 3.26Å; G648-R651 PolarHBondContact O-N 3.07Å
652	L	95	Very high	93.9	Very high	54 Å²	54	44 Å²	44	28%	0.283	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-102.2	168.3	170.2	-58.4	-179.8	0	0	0	109.9	H566 K567 D646	H566-L652 WeakPolarHBondContact O-CD1 3.05Å; K567-L652 HydrophobicContact CB-CB 3.69Å; K567-L652 HydrophobicContact CB-CD1 4.38Å; D646-L652 PolarHBondContact OD1-N 2.92Å; D646-L652 VanDerWaalsContact OD2-C 3.27Å; D646-L652 WeakPolarHBondContact OD2-CA 3.41Å; D646-L652 VanDerWaalsContact OD2-CB 3.27Å; D646-L652 WeakPolarHBondContact OD2-CB 3.3Å; D646-L652 PolarHBondContact OD2-N 2.83Å; D646-L652 VanDerWaalsContact OD2-O 3.07Å
653	S	95.8	Very high	93.9	Very high	61 Å²	61	47.6 Å²	47.6	43%	0.427	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	159.9	-175.3	56.9	0	0	0	0	112.4	A644	A644-S653 WeakPolarHBondContact O-CA 3.46Å; A644-S653 VanDerWaalsContact O-CB 3.29Å; A644-S653 WeakPolarHBondContact O-CB 2.95Å
654	S	95.5	Very high	93.8	Very high	25 Å²	25	47.4 Å²	47.4	18%	0.175	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	168.3	168.2	72	0	0	0	0	111	P568 F570 I643 A644	P568-S654 WeakPolarHBondContact O-CB 3.23Å; P568-S654 PolarHBondContact O-OG 2.99Å; F570-S654 WeakPolarHBondContact CD2-OG 3.47Å; F570-S654 WeakPolarHBondContact CE2-OG 3Å; I643-S654 VanDerWaalsContact CA-O 3.29Å; I643-S654 WeakPolarHBondContact CA-O 3.29Å; I643-S654 VanDerWaalsContact CG2-O 3.31Å; I643-S654 WeakPolarHBondContact CG2-O 3.29Å; A644-S654 PolarHBondContact N-O 3.01Å; A644-S654 PolarHBondContact O-N 2.99Å
655	S	95.4	Very high	93.5	Very high	81 Å²	81	49.6 Å²	49.6	57%	0.566	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	151.9	176.4	56.4	0	0	0	0	111.7	A642	A642-S655 CarbonylContact O-C 3.53Å; A642-S655 WeakPolarHBondContact O-CA 3.44Å; A642-S655 WeakPolarHBondContact O-CB 3.33Å
656	V	95	Very high	93.4	Very high	6 Å²	6	48.7 Å²	48.7	4%	0.036	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.4	177.9	66.8	0	0	0	0	110	F570 N572 S573 Y575 T641 A642 L658	F570-V656 HydrophobicContact CB-CB 4.2Å; F570-V656 HydrophobicContact CB-CG2 4.38Å; F570-V656 HydrophobicContact CD1-CB 4.21Å; F570-V656 HydrophobicContact CD1-CG1 3.64Å; F570-V656 HydrophobicContact CD2-CB 3.62Å; F570-V656 HydrophobicContact CD2-CG1 3.77Å; F570-V656 HydrophobicContact CE1-CG1 3.64Å; F570-V656 HydrophobicContact CE2-CB 3.98Å; F570-V656 HydrophobicContact CE2-CG1 3.76Å; F570-V656 HydrophobicContact CG-CB 3.74Å; F570-V656 HydrophobicContact CG-CG1 3.7Å; F570-V656 HydrophobicContact CG-CG2 4.4Å; F570-V656 HydrophobicContact CZ-CB 4.41Å; F570-V656 HydrophobicContact CZ-CG1 3.68Å; N572-V656 VanDerWaalsContact O-CG2 3.31Å; N572-V656 WeakPolarHBondContact O-CG2 3.24Å; S573-V656 WeakPolarHBondContact O-CG2 3.49Å; Y575-V656 HydrophobicContact CD2-CG1 4.28Å; Y575-V656 HydrophobicContact CD2-CG2 3.78Å; Y575-V656 HydrophobicContact CE2-CG1 4.28Å; Y575-V656 HydrophobicContact CE2-CG2 4.02Å; T641-V656 WeakPolarHBondContact CA-O 3.15Å; A642-V656 HydrophobicContact CB-CG1 3.9Å; A642-V656 PolarHBondContact N-O 3.04Å; A642-V656 PolarHBondContact O-N 2.83Å; V656-L658 HydrophobicContact CG1-CD2 4.15Å
657	L	94	Very high	93.2	Very high	51 Å²	51	52.1 Å²	52.1	27%	0.267	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	132	175.4	-176	63.5	0	0	0	110.5	I574 Y575 Q639	I574-L657 WeakPolarHBondContact CA-O 3.41Å; Y575-L657 PolarHBondContact N-O 2.76Å; Q639-L657 HydrophobicContact CB-CD1 4.11Å; Q639-L657 HydrophobicContact CG-CD1 4.45Å
658	L	93.6	Very high	93.2	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	116.1	171.5	-43.9	175.6	0	0	0	107.8	Y575 I592 L609 I624 Q639 V640 A642 V656 I660	Y575-L658 HydrophobicContact CD2-CD2 3.93Å; Y575-L658 HydrophobicContact CG-CD2 4.1Å; I592-L658 HydrophobicContact CG2-CD2 3.69Å; L609-L658 HydrophobicContact CD2-CD1 4.21Å; I624-L658 HydrophobicContact CD1-CD1 3.25Å; Q639-L658 WeakPolarHBondContact CA-O 3.28Å; V640-L658 HydrophobicContact CB-CB 4.28Å; V640-L658 HydrophobicContact CB-CD1 4.22Å; V640-L658 HydrophobicContact CG1-CD1 4.22Å; V640-L658 PolarHBondContact N-O 2.77Å; V640-L658 VanDerWaalsContact O-CB 3.26Å; V640-L658 WeakPolarHBondContact O-CB 3.41Å; V640-L658 VanDerWaalsContact O-CG 3.26Å; V640-L658 WeakPolarHBondContact O-CG 3.35Å; V640-L658 PolarHBondContact O-N 2.83Å; A642-L658 HydrophobicContact CB-CD1 4.11Å; A642-L658 HydrophobicContact CB-CG 4.39Å; V656-L658 HydrophobicContact CG1-CD2 4.15Å; L658-I660 HydrophobicContact CB-CD1 4.45Å; L658-I660 HydrophobicContact CB-CG1 4.27Å
659	N	93.6	Very high	93.3	Very high	31 Å²	31	54.3 Å²	54.3	17%	0.166	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	111.2	171.9	-72.1	-42	0	0	0	108.1	I574 Y575 H576 M577 Q639	I574-N659 VanDerWaalsContact CG2-ND2 3.27Å; I574-N659 WeakPolarHBondContact CG2-ND2 3.25Å; Y575-N659 PolarHBondContact O-N 3.46Å; H576-N659 WeakPolarHBondContact CA-O 3.37Å; H576-N659 PolarHBondContact CE1-ND2 3.12Å; H576-N659 VanDerWaalsContact CE1-ND2 3.34Å; M577-N659 PolarHBondContact N-O 2.86Å; Q639-N659 PolarHBondContact NE2-OD1 2.94Å
660	I	92.3	Very high	93.6	Very high	3 Å²	3	45 Å²	45	2%	0.015	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.9	-173.3	-44.2	-171.2	0	0	0	108.1	M577 I579 F615 S637 Y638 V640 L658	M577-I660 HydrophobicContact CE-CD1 4.2Å; M577-I660 HydrophobicContact CE-CG1 4.46Å; M577-I660 HydrophobicContact CE-CG2 4.28Å; M577-I660 HydrophobicContact CG-CB 4.08Å; M577-I660 HydrophobicContact CG-CD1 4.43Å; M577-I660 HydrophobicContact CG-CG1 3.73Å; M577-I660 HydrophobicContact CG-CG2 4.05Å; M577-I660 WeakPolarHBondContact O-CA 3.43Å; M577-I660 HydrophobicContact SD-CB 4.47Å; M577-I660 HydrophobicContact SD-CD1 3.71Å; M577-I660 HydrophobicContact SD-CG1 3.63Å; M577-I660 HydrophobicContact SD-CG2 4.4Å; I579-I660 HydrophobicContact CD1-CG2 3.74Å; I579-I660 HydrophobicContact CG1-CG2 4.23Å; F615-I660 HydrophobicContact CD1-CD1 4.06Å; F615-I660 HydrophobicContact CD2-CD1 4.25Å; F615-I660 HydrophobicContact CE1-CD1 3.6Å; F615-I660 HydrophobicContact CE1-CG2 4.18Å; F615-I660 HydrophobicContact CE2-CD1 3.83Å; F615-I660 HydrophobicContact CG-CD1 4.37Å; F615-I660 HydrophobicContact CZ-CB 4.44Å; F615-I660 HydrophobicContact CZ-CD1 3.48Å; F615-I660 VanDerWaalsContact CZ-CD1 3.48Å; F615-I660 HydrophobicContact CZ-CG2 4Å; S637-I660 CarbonylContact C-O 3.53Å; S637-I660 VanDerWaalsContact CA-O 3.32Å; S637-I660 WeakPolarHBondContact CA-O 3.35Å; Y638-I660 PolarHBondContact N-O 3.23Å; Y638-I660 PolarHBondContact O-N 3.43Å; V640-I660 HydrophobicContact CB-CD1 4.28Å; V640-I660 HydrophobicContact CG2-CD1 3.78Å; L658-I660 HydrophobicContact CB-CD1 4.45Å; L658-I660 HydrophobicContact CB-CG1 4.27Å
661	T	94.2	Very high	93.7	Very high	69 Å²	69	45 Å²	45	42%	0.423	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.6	175.2	-56.8	0	0	0	0	109.6	M577 S578 I579 L663	M577-T661 PolarHBondContact O-N 2.85Å; S578-T661 VanDerWaalsContact CA-O 3.3Å; S578-T661 WeakPolarHBondContact CA-O 3.4Å; I579-T661 PolarHBondContact N-O 2.66Å; T661-L663 HydrophobicContact CG2-CD2 4.35Å
662	V	94.5	Very high	93.6	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.03	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.3	168.3	-171.9	0	0	0	0	108	I579 E581 F630 R632 R635 D636 Y638	I579-V662 CarbonylContact O-C 3.52Å; I579-V662 VanDerWaalsContact O-CA 3.26Å; I579-V662 WeakPolarHBondContact O-CA 3.42Å; E581-V662 HydrophobicContact CB-CG1 3.71Å; F630-V662 HydrophobicContact CB-CG1 4.09Å; F630-V662 HydrophobicContact CB-CG2 4.24Å; F630-V662 HydrophobicContact CG-CG2 4.39Å; R632-V662 HydrophobicContact CB-CB 4.32Å; R632-V662 HydrophobicContact CB-CG1 3.82Å; R632-V662 HydrophobicContact CG-CB 4.23Å; R632-V662 HydrophobicContact CG-CG1 4.22Å; R635-V662 WeakPolarHBondContact O-CG2 3.48Å; D636-V662 PolarHBondContact O-N 2.94Å; Y638-V662 HydrophobicContact CD2-CG2 4.2Å; Y638-V662 HydrophobicContact CE2-CG2 4.02Å
663	L	93.5	Very high	93.2	Very high	74 Å²	74	39.3 Å²	39.3	39%	0.387	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.8	178.9	-56.3	179	0	0	0	110.5	I579 Q580 E581 T661	I579-L663 PolarHBondContact O-N 3.36Å; Q580-L663 HydrophobicContact CG-CB 4.37Å; Q580-L663 HydrophobicContact CG-CD1 4.46Å; E581-L663 PolarHBondContact N-O 2.85Å; T661-L663 HydrophobicContact CG2-CD2 4.35Å
664	D	93.5	Very high	92.6	Very high	34 Å²	34	39.4 Å²	39.4	18%	0.182	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-61.9	138.8	-178.3	-165.9	81.9	0	0	0	113.8	E581 R632 D719 E720 N723	E581-D664 WeakPolarHBondContact OE1-CA 3.28Å; R632-D664 IonicContact CZ-OD1 2.96Å; R632-D664 IonicContact NE-OD1 3.67Å; R632-D664 PolarHBondContact NE-OD1 2.94Å; R632-D664 IonicContact NH1-OD1 3.25Å; R632-D664 IonicContact NH2-OD1 2.65Å; R632-D664 PolarHBondContact NH2-OD1 3.33Å; D664-D719 WeakPolarHBondContact OD1-CA 3.4Å; D664-E720 HydrophobicContact CB-CB 3.82Å; D664-E720 VanDerWaalsContact CG-CB 3.44Å; D664-E720 WeakPolarHBondContact OD1-CB 3.36Å; D664-E720 PolarHBondContact OD1-N 2.65Å; D664-E720 PolarHBondContact OD2-N 2.95Å; D664-N723 WeakPolarHBondContact OD2-CB 3.26Å; D664-N723 PolarHBondContact OD2-ND2 3.15Å
665	V	92.2	Very high	91.7	Very high	45 Å²	45	41.8 Å²	41.8	27%	0.273	24%	0.243	S	C	.	.			trans	-135	131.6	172.8	176.1	0	0	0	0	108.2	Q580 E581 D667	Q580-V665 HydrophobicContact CB-CG2 4.32Å; E581-V665 HydrophobicContact CG-CB 3.87Å; E581-V665 HydrophobicContact CG-CG2 3.95Å; E581-V665 PolarHBondContact OE1-N 3.01Å; V665-D667 PolarHBondContact O-N 2.83Å
666	N	93.3	Very high	90.5	Very high	24 Å²	24	44 Å²	44	13%	0.128	25%	0.245	C	C	.	.	S	Bend	trans	-65	93.6	-175.9	-154.7	59.7	0	0	0	111.2	D719 N723 D772 E777 L779	N666-D719 WeakPolarHBondContact CA-OD2 3.22Å; N666-N723 HydrophobicContact CB-CB 4.18Å; N666-N723 PolarHBondContact N-ND2 3.44Å; N666-N723 WeakPolarHBondContact OD1-CA 3.47Å; N666-N723 WeakPolarHBondContact OD1-CB 3.27Å; N666-N723 VanDerWaalsContact OD1-CG 3.26Å; N666-N723 PolarHBondContact OD1-O 2.86Å; N666-N723 PolarHBondContact OD1-OD1 3.37Å; N666-D772 PolarHBondContact ND2-OD2 2.84Å; N666-D772 PolarHBondContact OD1-OD2 2.85Å; N666-E777 PolarHBondContact ND2-O 2.9Å; N666-L779 WeakPolarHBondContact ND2-CG 3.4Å; N666-L779 PolarHBondContact ND2-N 2.91Å
667	D	92.5	Very high	88.9	Confident	71 Å²	71	46.1 Å²	46.1	38%	0.38	26%	0.263	S	S	.	.			trans	-132	-16.8	-174.2	104.5	-7.4	0	0	0	114.3	N582 V665 D719	N582-D667 PolarHBondContact ND2-OD2 2.86Å; V665-D667 PolarHBondContact O-N 2.83Å; D667-D719 PolarHBondContact N-OD2 2.98Å
668	H	91.1	Very high	87.5	Confident	45 Å²	45	48.3 Å²	48.3	21%	0.208	28%	0.275	C	S	.	.	S	Bend	trans	-91.6	143.9	164.2	-63.1	78.7	0	0	0	111.5	E633 K718 D719 L779	E633-H668 IonicContact OE2-CE1 3.59Å; E633-H668 PolarHBondContact OE2-CE1 2.96Å; E633-H668 VanDerWaalsContact OE2-CE1 3.3Å; E633-H668 IonicContact OE2-ND1 2.7Å; H668-K718 HydrophobicContact CB-CB 4.34Å; H668-K718 PolarHBondContact CD2-NZ 2.76Å; H668-K718 WeakPolarHBondContact NE2-CE 3.39Å; H668-K718 PolarHBondContact NE2-NZ 3.34Å; H668-D719 WeakPolarHBondContact CB-OD1 3.46Å; H668-D719 IonicContact CG-OD1 3.09Å; H668-D719 PolarHBondContact N-OD2 2.75Å; H668-D719 IonicContact ND1-OD1 3.95Å; H668-D719 PolarHBondContact ND1-OD1 3.41Å; H668-L779 WeakPolarHBondContact O-CD1 3.38Å
669	S	92.7	Very high	86.2	Confident	52 Å²	52	55.5 Å²	55.5	36%	0.364	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-100.6	143.6	174.7	-55.6	0	0	0	0	111.1	V671	S669-V671 PolarHBondContact O-N 2.87Å
670	P	94.7	Very high	84.8	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-51.4	125.9	-174.5	-27	26.6	0	0	0	114.7	D717 L726 V770 T781	P670-D717 WeakPolarHBondContact CA-OD2 3.21Å; P670-D717 WeakPolarHBondContact CB-OD2 3.49Å; P670-D717 WeakPolarHBondContact CD-OD2 3.33Å; P670-D717 WeakPolarHBondContact CG-OD2 3.17Å; P670-D717 VanDerWaalsContact N-OD2 3.08Å; P670-L726 HydrophobicContact CB-CD2 3.75Å; P670-L726 HydrophobicContact CG-CD2 3.84Å; P670-V770 HydrophobicContact CB-CB 3.95Å; P670-V770 HydrophobicContact CB-CG1 3.58Å; P670-V770 HydrophobicContact CG-CG1 4.24Å; P670-T781 WeakPolarHBondContact O-CB 3.34Å; P670-T781 WeakPolarHBondContact O-CG2 3.46Å; P670-T781 PolarHBondContact O-OG1 2.91Å
671	V	92	Very high	83.6	Confident	91 Å²	91	57.6 Å²	57.6	55%	0.552	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	111.9	-179.8	-174.8	0	0	0	0	110.8	S669 A715 S716	S669-V671 PolarHBondContact O-N 2.87Å; V671-A715 CarbonylContact O-C 3.58Å; V671-A715 WeakPolarHBondContact O-CA 3.48Å; V671-A715 WeakPolarHBondContact O-CB 3.16Å; V671-S716 PolarHBondContact N-O 3.3Å; V671-S716 PolarHBondContact O-N 2.82Å
672	L	91.4	Very high	82.1	Confident	26 Å²	26	58.3 Å²	58.3	14%	0.136	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130.5	172.5	-173.1	75.9	0	0	0	111	N696 I713 A715 V770 I785	L672-N696 WeakPolarHBondContact CD1-ND2 3.31Å; L672-I713 HydrophobicContact CD1-CG2 3.42Å; L672-I713 VanDerWaalsContact CD1-CG2 3.42Å; L672-A715 HydrophobicContact CD1-CB 4.19Å; L672-V770 HydrophobicContact CD1-CG2 3.92Å; L672-I785 HydrophobicContact CD2-CG2 4.31Å
673	A	87.4	Confident	80.5	Confident	32 Å²	32	66 Å²	66	26%	0.264	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-66.2	149.1	174.8	0	0	0	0	0	112.3	N696 L714	A673-N696 PolarHBondContact N-ND2 2.69Å; A673-N696 PolarHBondContact O-ND2 2.76Å; A673-L714 HydrophobicContact CB-CB 3.8Å; A673-L714 WeakPolarHBondContact CB-O 3.32Å; A673-L714 PolarHBondContact N-O 3.3Å
674	S	81.3	Confident	79.2	Confident	63 Å²	63	65.4 Å²	65.4	44%	0.441	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-67.9	153.9	-172.7	69.9	0	0	0	0	113.8	K695 N696	S674-K695 CarbonylContact O-C 3.47Å; S674-K695 VanDerWaalsContact O-CA 3.31Å; S674-K695 WeakPolarHBondContact O-CA 3.21Å; S674-K695 WeakPolarHBondContact O-CB 3.28Å; S674-N696 PolarHBondContact O-N 3.44Å
675	Y	77	Confident	77.8	Confident	74 Å²	74	67.2 Å²	67.2	29%	0.29	37%	0.368	S	S	.	.			trans	-113.1	28.5	-179.2	83.5	-74.5	0	0	0	113.4	A677 N696 R765 T784	Y675-A677 PolarHBondContact O-N 2.78Å; Y675-N696 WeakPolarHBondContact CB-O 3.25Å; Y675-R765 HydrophobicContact CE2-CG 4.39Å; Y675-T784 WeakPolarHBondContact CB-O 3.46Å; Y675-T784 HydrophobicContact CD1-CG2 4.34Å; Y675-T784 WeakPolarHBondContact CD1-O 3.47Å; Y675-T784 HydrophobicContact CD2-CG2 4.29Å; Y675-T784 HydrophobicContact CE1-CG2 3.86Å; Y675-T784 HydrophobicContact CE2-CG2 3.81Å; Y675-T784 VanDerWaalsContact CG-O 3.29Å
676	E	71.2	Confident	76.8	Confident	127 Å²	127	73.1 Å²	73.1	59%	0.593	40%	0.397	S	S	*	.			trans	-61.4	94.2	179.3	-73	173.7	174.6	0	0	112.7	K695	E676-K695 HydrophobicContact CB-CD 4.05Å; E676-K695 WeakPolarHBondContact O-CD 3.18Å; E676-K695 PolarHBondContact O-NZ 2.89Å; E676-K695 IonicContact OE2-NZ 3.41Å; E676-K695 PolarHBondContact OE2-NZ 3.48Å
677	A	61.4	Low	76.1	Confident	52 Å²	52	73 Å²	73	43%	0.43	40%	0.397	S	S	.	.			trans	-70.3	130.9	161.2	0	0	0	0	0	110	Y675 L697	Y675-A677 PolarHBondContact O-N 2.78Å; A677-L697 HydrophobicContact CB-CD1 4.04Å; A677-L697 HydrophobicContact CB-CD2 3.94Å
678	D	65.1	Low	75.6	Confident	96 Å²	96	74 Å²	74	51%	0.513	41%	0.407	S	S	.	.			trans	-80.5	133.5	161.9	175.6	4.9	0	0	0	107.9	S680 L681	D678-S680 PolarHBondContact O-N 2.75Å; D678-S680 VanDerWaalsContact O-N 3.08Å; D678-S680 PolarHBondContact OD1-N 2.86Å; D678-S680 PolarHBondContact OD1-OG 2.89Å; D678-S680 WeakPolarHBondContact OD2-CB 3.32Å; D678-S680 PolarHBondContact OD2-OG 3.01Å; D678-L681 HydrophobicContact CB-CD1 4.4Å; D678-L681 HydrophobicContact CB-CG 4.31Å; D678-L681 WeakPolarHBondContact O-CB 3.38Å; D678-L681 PolarHBondContact O-N 2.82Å
679	E	64.4	Low	75.5	Confident	151 Å²	151	74 Å²	74	71%	0.706	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-58.7	-19.4	177	-69.4	-174.4	175.1	0	0	112.6	L681 L682	E679-L681 PolarHBondContact O-N 3.4Å; E679-L682 PolarHBondContact O-N 3.02Å
680	S	64.7	Low	75.2	Confident	60 Å²	60	72.2 Å²	72.2	42%	0.42	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-60.8	-30.3	171.8	76.9	0	0	0	0	113.4	D678 K683	D678-S680 PolarHBondContact O-N 2.75Å; D678-S680 VanDerWaalsContact O-N 3.08Å; D678-S680 PolarHBondContact OD1-N 2.86Å; D678-S680 PolarHBondContact OD1-OG 2.89Å; D678-S680 WeakPolarHBondContact OD2-CB 3.32Å; D678-S680 PolarHBondContact OD2-OG 3.01Å; S680-K683 PolarHBondContact O-N 2.8Å
681	L	67.2	Low	74.9	Confident	19 Å²	19	76.2 Å²	76.2	10%	0.099	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-75.2	-22.5	-177.1	-59	175	0	0	0	113.2	D678 E679 K683 T684 L687 F692 L697 I788	D678-L681 HydrophobicContact CB-CD1 4.4Å; D678-L681 HydrophobicContact CB-CG 4.31Å; D678-L681 WeakPolarHBondContact O-CB 3.38Å; D678-L681 PolarHBondContact O-N 2.82Å; E679-L681 PolarHBondContact O-N 3.4Å; L681-K683 PolarHBondContact O-N 3.37Å; L681-T684 PolarHBondContact O-OG1 3.02Å; L681-L687 HydrophobicContact CB-CD1 3.92Å; L681-L687 HydrophobicContact CD2-CD1 3.99Å; L681-L687 HydrophobicContact CD2-CD2 4.24Å; L681-L687 WeakPolarHBondContact O-CD1 3.21Å; L681-F692 HydrophobicContact CD1-CD1 3.96Å; L681-F692 HydrophobicContact CD1-CE1 3.62Å; L681-F692 HydrophobicContact CD1-CZ 4.09Å; L681-F692 HydrophobicContact CD2-CE1 4.04Å; L681-F692 HydrophobicContact CD2-CE2 4.26Å; L681-F692 HydrophobicContact CD2-CZ 3.65Å; L681-L697 HydrophobicContact CD1-CD2 3.77Å; L681-I788 HydrophobicContact CB-CD1 4.24Å
682	L	63	Low	74.6	Confident	83 Å²	83	75.2 Å²	75.2	44%	0.435	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-74.1	-3.4	175.8	-69.2	166.8	0	0	0	112.9	E679 I788	E679-L682 PolarHBondContact O-N 3.02Å; L682-I788 HydrophobicContact CD2-CD1 3.86Å; L682-I788 HydrophobicContact CD2-CG1 3.83Å; L682-I788 HydrophobicContact CD2-CG2 3.97Å; L682-I788 HydrophobicContact CG-CD1 4.31Å
683	K	61.6	Low	74	Confident	168 Å²	168	76.4 Å²	76.4	73%	0.73	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-119.5	13.4	-175	-60	-179.7	-176.8	173.3	0	113.1	S680 L681	S680-K683 PolarHBondContact O-N 2.8Å; L681-K683 PolarHBondContact O-N 3.37Å
684	T	66.5	Low	73.6	Confident	60 Å²	60	81.9 Å²	81.9	37%	0.368	45%	0.446	S	S	.	.			trans	-126.6	96.1	-175.7	40	0	0	0	0	111.1	L681 D686 L687	L681-T684 PolarHBondContact O-OG1 3.02Å; T684-D686 PolarHBondContact O-N 3.43Å; T684-L687 WeakPolarHBondContact O-CG 3.45Å; T684-L687 WeakPolarHBondContact OG1-CD1 3.44Å; T684-L687 WeakPolarHBondContact OG1-CG 3.46Å
685	N	63.9	Low	73.7	Confident	73 Å²	73	82.1 Å²	82.1	39%	0.39	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-22	179.7	-58.9	32.8	0	0	0	112.7	L687 D791	N685-L687 VanDerWaalsContact C-N 3.27Å; N685-L687 PolarHBondContact O-N 2.89Å; N685-D791 WeakPolarHBondContact ND2-CB 3.21Å; N685-D791 PolarHBondContact ND2-O 2.99Å; N685-D791 VanDerWaalsContact ND2-O 3.15Å; N685-D791 PolarHBondContact ND2-OD2 2.86Å
686	D	71.5	Confident	74.4	Confident	168 Å²	168	78.6 Å²	78.6	90%	0.898	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	27.2	179.5	-76.1	-43	0	0	0	114.7	T684	T684-D686 PolarHBondContact O-N 3.43Å
687	L	77.8	Confident	75.4	Confident	23 Å²	23	72.7 Å²	72.7	12%	0.12	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-81.8	145	176.3	-70.6	178.9	0	0	0	113	L681 T684 N685 V689 F692 I699 L790	L681-L687 HydrophobicContact CB-CD1 3.92Å; L681-L687 HydrophobicContact CD2-CD1 3.99Å; L681-L687 HydrophobicContact CD2-CD2 4.24Å; L681-L687 WeakPolarHBondContact O-CD1 3.21Å; T684-L687 WeakPolarHBondContact O-CG 3.45Å; T684-L687 WeakPolarHBondContact OG1-CD1 3.44Å; T684-L687 WeakPolarHBondContact OG1-CG 3.46Å; N685-L687 VanDerWaalsContact C-N 3.27Å; N685-L687 PolarHBondContact O-N 2.89Å; L687-V689 PolarHBondContact O-N 3.44Å; L687-F692 HydrophobicContact CD2-CE2 4.1Å; L687-I699 HydrophobicContact CB-CD1 3.87Å; L687-I699 HydrophobicContact CB-CG2 4.14Å; L687-I699 HydrophobicContact CD1-CD1 3.71Å; L687-I699 HydrophobicContact CG-CD1 4.32Å; L687-L790 HydrophobicContact CB-CD1 4.16Å; L687-L790 HydrophobicContact CB-CD2 4.31Å; L687-L790 WeakPolarHBondContact O-CD1 3.48Å
688	P	82.8	Confident	76.8	Confident	90 Å²	90	70.2 Å²	70.2	58%	0.584	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-71.9	125.8	178.2	29.2	-33.8	0	0	0	111.1	G690	P688-G690 PolarHBondContact O-N 2.95Å
689	V	87.1	Confident	78.1	Confident	46 Å²	46	65.6 Å²	65.6	28%	0.279	35%	0.353	S	S	.	.	S	Bend	trans	-61.5	131.6	172.7	170.2	0	0	0	0	110.4	L687 I699 R701 M704	L687-V689 PolarHBondContact O-N 3.44Å; V689-I699 CarbonylContact C-O 3.53Å; V689-I699 WeakPolarHBondContact CA-O 3.2Å; V689-R701 HydrophobicContact CG2-CB 4.49Å; V689-R701 HydrophobicContact CG2-CG 4.17Å; V689-M704 HydrophobicContact CG1-CE 4.3Å; V689-M704 HydrophobicContact CG1-SD 3.95Å; V689-M704 HydrophobicContact CG2-SD 4.16Å
690	G	87.1	Confident	79.4	Confident	15 Å²	15	58.5 Å²	58.5	16%	0.155	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	133.1	-164.8	-177.1	0	0	0	0	0	112.6	P688 F698 I699 M710	P688-G690 PolarHBondContact O-N 2.95Å; G690-F698 CarbonylContact O-C 3.49Å; G690-F698 WeakPolarHBondContact O-CA 3.25Å; G690-I699 PolarHBondContact N-O 3.39Å; G690-I699 PolarHBondContact O-N 3.48Å; G690-M710 CarbonylContact C-O 3.46Å; G690-M710 VanDerWaalsContact C-O 3.25Å; G690-M710 WeakPolarHBondContact CA-O 3.37Å
691	R	89.2	Confident	80.6	Confident	84 Å²	84	60.8 Å²	60.8	32%	0.317	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	127	172.5	-167	-175.2	67	-135.9	-2.4	111.1	G693 K695 L697 F698 M710 N712	R691-G693 PolarHBondContact NE-O 2.82Å; R691-G693 VanDerWaalsContact NE-O 3.13Å; R691-G693 PolarHBondContact O-N 2.87Å; R691-K695 WeakPolarHBondContact CD-O 3.2Å; R691-K695 VanDerWaalsContact CG-O 3.29Å; R691-K695 WeakPolarHBondContact CG-O 3.22Å; R691-L697 CarbonylContact C-O 3.16Å; R691-L697 WeakPolarHBondContact CA-O 3.18Å; R691-F698 HydrophobicContact CB-CD1 3.74Å; R691-F698 HydrophobicContact CB-CE1 3.64Å; R691-F698 HydrophobicContact CB-CZ 4.47Å; R691-F698 HydrophobicContact CG-CD1 4Å; R691-F698 HydrophobicContact CG-CE1 3.69Å; R691-F698 HydrophobicContact CG-CZ 4.04Å; R691-M710 PolarHBondContact N-O 2.78Å; R691-M710 VanDerWaalsContact N-O 3.07Å; R691-N712 WeakPolarHBondContact CD-O 3.35Å; R691-N712 PolarHBondContact NH1-O 3.05Å
692	F	84.7	Confident	81.7	Confident	70 Å²	70	60 Å²	60	31%	0.307	32%	0.315	S	S	.	.			trans	-79.1	87.2	-179.4	-165.7	-104.1	0	0	0	111.7	L681 L687 L697 I699	L681-F692 HydrophobicContact CD1-CD1 3.96Å; L681-F692 HydrophobicContact CD1-CE1 3.62Å; L681-F692 HydrophobicContact CD1-CZ 4.09Å; L681-F692 HydrophobicContact CD2-CE1 4.04Å; L681-F692 HydrophobicContact CD2-CE2 4.26Å; L681-F692 HydrophobicContact CD2-CZ 3.65Å; L687-F692 HydrophobicContact CD2-CE2 4.1Å; F692-L697 HydrophobicContact CB-CB 4.3Å; F692-L697 HydrophobicContact CB-CD2 4.25Å; F692-L697 HydrophobicContact CB-CG 4.27Å; F692-L697 HydrophobicContact CD1-CD2 4.2Å; F692-L697 HydrophobicContact CG-CD2 4.47Å; F692-L697 PolarHBondContact N-O 2.69Å; F692-I699 HydrophobicContact CB-CD1 3.98Å; F692-I699 HydrophobicContact CB-CG1 4.34Å; F692-I699 HydrophobicContact CD2-CD1 3.57Å; F692-I699 HydrophobicContact CE2-CD1 4.35Å; F692-I699 HydrophobicContact CG-CD1 4Å
693	G	79	Confident	82.9	Confident	50 Å²	50	60 Å²	60	52%	0.515	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	-131	175.2	0	0	0	0	0	113.9	R691	R691-G693 PolarHBondContact NE-O 2.82Å; R691-G693 VanDerWaalsContact NE-O 3.13Å; R691-G693 PolarHBondContact O-N 2.87Å
694	L	79.1	Confident	84.2	Confident	147 Å²	147	54.1 Å²	54.1	77%	0.77	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	8	-179.3	-60.2	179.8	0	0	0	113.5	L714	L694-L714 WeakPolarHBondContact O-CD1 3.39Å
695	K	84.4	Confident	85.5	Confident	68 Å²	68	55 Å²	55	30%	0.296	30%	0.297	S	S	.	.	S	Bend	trans	-94.8	156.1	174	-61.8	-163.8	-174.4	-167.7	0	110.5	S674 E676 R691 L697	S674-K695 CarbonylContact O-C 3.47Å; S674-K695 VanDerWaalsContact O-CA 3.31Å; S674-K695 WeakPolarHBondContact O-CA 3.21Å; S674-K695 WeakPolarHBondContact O-CB 3.28Å; E676-K695 HydrophobicContact CB-CD 4.05Å; E676-K695 WeakPolarHBondContact O-CD 3.18Å; E676-K695 PolarHBondContact O-NZ 2.89Å; E676-K695 IonicContact OE2-NZ 3.41Å; E676-K695 PolarHBondContact OE2-NZ 3.48Å; R691-K695 WeakPolarHBondContact CD-O 3.2Å; R691-K695 VanDerWaalsContact CG-O 3.29Å; R691-K695 WeakPolarHBondContact CG-O 3.22Å; K695-L697 HydrophobicContact CB-CB 4.32Å; K695-L697 PolarHBondContact O-N 3.19Å
696	N	91.7	Very high	86.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.299	C	S	.	.	S	Bend	trans	-80.7	49.9	167.2	-78.5	-44.7	0	0	0	111.8	L672 A673 S674 Y675 L714 I785 G786	L672-N696 WeakPolarHBondContact CD1-ND2 3.31Å; A673-N696 PolarHBondContact N-ND2 2.69Å; A673-N696 PolarHBondContact O-ND2 2.76Å; S674-N696 PolarHBondContact O-N 3.44Å; Y675-N696 WeakPolarHBondContact CB-O 3.25Å; N696-L714 PolarHBondContact ND2-O 3.43Å; N696-L714 PolarHBondContact OD1-N 2.82Å; N696-I785 HydrophobicContact CB-CB 4.04Å; N696-I785 HydrophobicContact CB-CG2 3.66Å; N696-I785 WeakPolarHBondContact O-CA 3.43Å; N696-I785 WeakPolarHBondContact O-CB 3.37Å; N696-G786 PolarHBondContact O-N 3.5Å
697	L	90.6	Very high	87.8	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129	171.6	179.6	63.2	0	0	0	107.7	A677 L681 R691 F692 K695 G786 I788	A677-L697 HydrophobicContact CB-CD1 4.04Å; A677-L697 HydrophobicContact CB-CD2 3.94Å; L681-L697 HydrophobicContact CD1-CD2 3.77Å; R691-L697 CarbonylContact C-O 3.16Å; R691-L697 WeakPolarHBondContact CA-O 3.18Å; F692-L697 HydrophobicContact CB-CB 4.3Å; F692-L697 HydrophobicContact CB-CD2 4.25Å; F692-L697 HydrophobicContact CB-CG 4.27Å; F692-L697 HydrophobicContact CD1-CD2 4.2Å; F692-L697 HydrophobicContact CG-CD2 4.47Å; F692-L697 PolarHBondContact N-O 2.69Å; K695-L697 HydrophobicContact CB-CB 4.32Å; K695-L697 PolarHBondContact O-N 3.19Å; L697-G786 CarbonylContact C-O 3.58Å; L697-G786 WeakPolarHBondContact CA-O 3.34Å; L697-I788 HydrophobicContact CD1-CD1 4.08Å; L697-I788 HydrophobicContact CD1-CG1 4.15Å; L697-I788 HydrophobicContact CD2-CD1 4.37Å
698	F	92.4	Very high	88.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	149.6	178.9	-58.8	-92.5	0	0	0	109.7	G690 R691 M710 I713 L750 I785 G786 I787 I788	G690-F698 CarbonylContact O-C 3.49Å; G690-F698 WeakPolarHBondContact O-CA 3.25Å; R691-F698 HydrophobicContact CB-CD1 3.74Å; R691-F698 HydrophobicContact CB-CE1 3.64Å; R691-F698 HydrophobicContact CB-CZ 4.47Å; R691-F698 HydrophobicContact CG-CD1 4Å; R691-F698 HydrophobicContact CG-CE1 3.69Å; R691-F698 HydrophobicContact CG-CZ 4.04Å; F698-M710 HydrophobicContact CB-CB 4.28Å; F698-M710 HydrophobicContact CB-SD 4.34Å; F698-M710 HydrophobicContact CD1-CB 3.89Å; F698-M710 HydrophobicContact CG-CB 4.37Å; F698-I713 HydrophobicContact CZ-CG1 4.19Å; F698-L750 HydrophobicContact CD1-CD2 4.4Å; F698-L750 HydrophobicContact CD2-CD2 3.95Å; F698-L750 HydrophobicContact CE1-CD2 4.48Å; F698-L750 HydrophobicContact CE2-CD2 4.08Å; F698-L750 HydrophobicContact CG-CD2 4.13Å; F698-L750 HydrophobicContact CZ-CD2 4.34Å; F698-I785 HydrophobicContact CD2-CD1 4.26Å; F698-I785 HydrophobicContact CE2-CB 4.27Å; F698-I785 HydrophobicContact CE2-CD1 3.86Å; F698-G786 PolarHBondContact N-O 2.88Å; F698-I787 HydrophobicContact CB-CG1 4.28Å; F698-I787 HydrophobicContact CB-CG2 4.48Å; F698-I787 CarbonylContact O-C 3.57Å; F698-I787 VanDerWaalsContact O-CA 3.29Å; F698-I787 WeakPolarHBondContact O-CA 3.31Å; F698-I788 PolarHBondContact O-N 2.86Å
699	I	90.6	Very high	89	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.8	-177.4	-56.2	-178.2	0	0	0	107.4	L687 V689 G690 F692 I788 L790	L687-I699 HydrophobicContact CB-CD1 3.87Å; L687-I699 HydrophobicContact CB-CG2 4.14Å; L687-I699 HydrophobicContact CD1-CD1 3.71Å; L687-I699 HydrophobicContact CG-CD1 4.32Å; V689-I699 CarbonylContact C-O 3.53Å; V689-I699 WeakPolarHBondContact CA-O 3.2Å; G690-I699 PolarHBondContact N-O 3.39Å; G690-I699 PolarHBondContact O-N 3.48Å; F692-I699 HydrophobicContact CB-CD1 3.98Å; F692-I699 HydrophobicContact CB-CG1 4.34Å; F692-I699 HydrophobicContact CD2-CD1 3.57Å; F692-I699 HydrophobicContact CE2-CD1 4.35Å; F692-I699 HydrophobicContact CG-CD1 4Å; I699-I788 WeakPolarHBondContact CA-O 3.14Å; I699-L790 HydrophobicContact CG2-CD1 3.49Å; I699-L790 VanDerWaalsContact CG2-CD1 3.49Å; I699-L790 HydrophobicContact CG2-CD2 3.98Å; I699-L790 HydrophobicContact CG2-CG 3.61Å
700	V	92	Very high	89.3	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	149.6	179.9	71.9	0	0	0	0	108.2	M704 T708 M710 T752 L756 I787 I788 V789 L790	V700-M704 HydrophobicContact CG2-CB 4.44Å; V700-M704 HydrophobicContact CG2-SD 3.91Å; V700-T708 HydrophobicContact CG2-CG2 4.31Å; V700-M710 HydrophobicContact CB-SD 4.39Å; V700-T752 HydrophobicContact CG2-CG2 4.26Å; V700-L756 HydrophobicContact CG1-CD1 3.79Å; V700-I787 HydrophobicContact CG1-CG2 4.1Å; V700-I788 PolarHBondContact N-O 2.82Å; V700-V789 HydrophobicContact CG1-CG2 4.07Å; V700-V789 CarbonylContact O-C 3.59Å; V700-V789 WeakPolarHBondContact O-CA 3.46Å; V700-L790 PolarHBondContact O-N 2.95Å
701	R	90.5	Very high	89.5	Confident	109 Å²	109	49.1 Å²	49.1	41%	0.411	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	150.3	165.6	-83	175.8	-73.7	-114.7	0.3	108.7	V689 M704 L790 L792	V689-R701 HydrophobicContact CG2-CB 4.49Å; V689-R701 HydrophobicContact CG2-CG 4.17Å; R701-M704 HydrophobicContact CB-CG 3.92Å; R701-M704 HydrophobicContact CB-SD 4Å; R701-M704 WeakPolarHBondContact O-CB 3.38Å; R701-M704 VanDerWaalsContact O-CG 3.27Å; R701-M704 WeakPolarHBondContact O-CG 3.46Å; R701-L790 HydrophobicContact CG-CB 3.9Å; R701-L790 HydrophobicContact CG-CD1 4.16Å; R701-L792 HydrophobicContact CB-CD1 4.44Å; R701-L792 HydrophobicContact CG-CD2 4.44Å
702	E	90	Very high	89.7	Confident	3 Å²	3	47.9 Å²	47.9	1%	0.014	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	169.8	164.7	67.6	-161.6	125.9	0	0	112.2	M704 L756 R758 V789 L790 D791 L792	E702-M704 PolarHBondContact O-N 2.69Å; E702-L756 CarbonylContact C-O 3.56Å; E702-L756 WeakPolarHBondContact CA-O 3.41Å; E702-L756 WeakPolarHBondContact CB-O 3.16Å; E702-R758 HydrophobicContact CB-CB 4.32Å; E702-R758 VanDerWaalsContact CD-CB 3.47Å; E702-R758 IonicContact OE1-NE 3.57Å; E702-R758 WeakPolarHBondContact OE2-CB 3.16Å; E702-R758 PolarHBondContact OE2-N 2.91Å; E702-V789 HydrophobicContact CB-CG1 3.75Å; E702-L790 PolarHBondContact N-O 2.83Å; E702-D791 VanDerWaalsContact OE1-CA 3.22Å; E702-D791 WeakPolarHBondContact OE1-CA 3.23Å; E702-L792 HydrophobicContact CG-CB 3.97Å; E702-L792 HydrophobicContact CG-CD1 3.86Å; E702-L792 HydrophobicContact CG-CG 3.88Å; E702-L792 WeakPolarHBondContact O-CD1 3.36Å; E702-L792 PolarHBondContact OE1-N 3.37Å
703	N	89.1	Confident	90.1	Very high	83 Å²	83	45 Å²	45	44%	0.444	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	15.1	-175.7	-71.9	-64.6	0	0	0	114.3	L756 D794	N703-L756 PolarHBondContact N-O 3.1Å; N703-D794 PolarHBondContact ND2-OD2 3.45Å
704	M	89.2	Confident	90.8	Very high	44 Å²	44	44.9 Å²	44.9	22%	0.217	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-75.3	137.3	172.5	-77	-162.5	72.3	0	0	110.4	V689 V700 R701 E702 T708	V689-M704 HydrophobicContact CG1-CE 4.3Å; V689-M704 HydrophobicContact CG1-SD 3.95Å; V689-M704 HydrophobicContact CG2-SD 4.16Å; V700-M704 HydrophobicContact CG2-CB 4.44Å; V700-M704 HydrophobicContact CG2-SD 3.91Å; R701-M704 HydrophobicContact CB-CG 3.92Å; R701-M704 HydrophobicContact CB-SD 4Å; R701-M704 WeakPolarHBondContact O-CB 3.38Å; R701-M704 VanDerWaalsContact O-CG 3.27Å; R701-M704 WeakPolarHBondContact O-CG 3.46Å; E702-M704 PolarHBondContact O-N 2.69Å; M704-T708 HydrophobicContact CE-CG2 3.59Å; M704-T708 HydrophobicContact SD-CG2 4.25Å
705	P	92.3	Very high	91.4	Very high	77 Å²	77	39.2 Å²	39.2	50%	0.5	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-56.7	151.5	-173.9	-27.6	34.8	0	0	0	114.6	T708 T752	P705-T708 WeakPolarHBondContact O-CB 3Å; P705-T708 PolarHBondContact O-N 3.01Å; P705-T708 PolarHBondContact O-OG1 3.05Å; P705-T752 PolarHBondContact O-OG1 2.82Å
706	V	91.4	Very high	91.9	Very high	72 Å²	72	39.4 Å²	39.4	44%	0.436	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.3	144.2	170	-59.6	0	0	0	0	111.6	T708 E755	V706-T708 VanDerWaalsContact C-N 3.31Å; V706-E755 HydrophobicContact CG1-CG 3.65Å
707	N	92.5	Very high	92	Very high	78 Å²	78	40.6 Å²	40.6	42%	0.417	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	26	-174	-61.9	-96.1	0	0	0	114.7	Y709 T752	N707-Y709 PolarHBondContact O-N 3.48Å; N707-T752 WeakPolarHBondContact CA-O 3.16Å; N707-T752 PolarHBondContact N-O 2.77Å
708	T	92.9	Very high	92.1	Very high	20 Å²	20	46.4 Å²	46.4	12%	0.123	24%	0.243	C	C	.	.			trans	-64.5	124.8	167.6	-74	0	0	0	0	110	V700 M704 P705 V706 Y751 T752	V700-T708 HydrophobicContact CG2-CG2 4.31Å; M704-T708 HydrophobicContact CE-CG2 3.59Å; M704-T708 HydrophobicContact SD-CG2 4.25Å; P705-T708 WeakPolarHBondContact O-CB 3Å; P705-T708 PolarHBondContact O-N 3.01Å; P705-T708 PolarHBondContact O-OG1 3.05Å; V706-T708 VanDerWaalsContact C-N 3.31Å; T708-Y751 CarbonylContact O-C 3.49Å; T708-Y751 WeakPolarHBondContact O-CA 3.32Å; T708-T752 WeakPolarHBondContact CB-OG1 3.35Å; T708-T752 PolarHBondContact N-OG1 2.93Å; T708-T752 VanDerWaalsContact N-OG1 3.12Å; T708-T752 PolarHBondContact O-N 2.99Å
709	Y	94.1	Very high	92.2	Very high	112 Å²	112	46.8 Å²	46.8	44%	0.439	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	123.8	176	173.4	-117.1	0	0	0	110.8	N707 G711 N712 Y751	N707-Y709 PolarHBondContact O-N 3.48Å; Y709-G711 VanDerWaalsContact CE2-C 3.46Å; Y709-G711 WeakPolarHBondContact CE2-O 3.47Å; Y709-N712 PolarHBondContact OH-N 2.89Å; Y709-N712 PolarHBondContact OH-OD1 2.93Å; Y709-N712 VanDerWaalsContact OH-OD1 3.12Å; Y709-Y751 HydrophobicContact CD2-CD1 4.31Å; Y709-Y751 AromaticContact CD2-CE1 3.83Å; Y709-Y751 HydrophobicContact CD2-CE1 3.83Å; Y709-Y751 HydrophobicContact CD2-CE2 4.19Å; Y709-Y751 AromaticContact CD2-CZ 3.74Å; Y709-Y751 HydrophobicContact CG-CE1 4.14Å
710	M	92.6	Very high	92.3	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.015	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-28.2	178.2	-71.6	179.4	-82.3	0	0	112.9	G690 R691 F698 V700 F742 L750 Y751 T752 I787	G690-M710 CarbonylContact C-O 3.46Å; G690-M710 VanDerWaalsContact C-O 3.25Å; G690-M710 WeakPolarHBondContact CA-O 3.37Å; R691-M710 PolarHBondContact N-O 2.78Å; R691-M710 VanDerWaalsContact N-O 3.07Å; F698-M710 HydrophobicContact CB-CB 4.28Å; F698-M710 HydrophobicContact CB-SD 4.34Å; F698-M710 HydrophobicContact CD1-CB 3.89Å; F698-M710 HydrophobicContact CG-CB 4.37Å; V700-M710 HydrophobicContact CB-SD 4.39Å; M710-F742 HydrophobicContact CE-CD1 3.57Å; M710-F742 HydrophobicContact CE-CE1 3.83Å; M710-F742 HydrophobicContact SD-CE1 4.46Å; M710-L750 HydrophobicContact CB-CD2 4.5Å; M710-L750 HydrophobicContact CE-CD2 3.77Å; M710-L750 HydrophobicContact CE-CG 3.72Å; M710-L750 PolarHBondContact N-O 2.83Å; M710-L750 HydrophobicContact SD-CD2 4.38Å; M710-Y751 VanDerWaalsContact CE-C 3.49Å; M710-T752 HydrophobicContact CE-CG2 3.98Å; M710-T752 HydrophobicContact SD-CG2 4.34Å; M710-I787 HydrophobicContact CE-CD1 4.03Å; M710-I787 HydrophobicContact SD-CD1 4.03Å; M710-I787 HydrophobicContact SD-CG2 3.93Å
711	G	91.2	Very high	92.3	Very high	7 Å²	7	54.8 Å²	54.8	7%	0.072	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.2	180	179.8	0	0	0	0	0	113	Y709 L750	Y709-G711 VanDerWaalsContact CE2-C 3.46Å; Y709-G711 WeakPolarHBondContact CE2-O 3.47Å; G711-L750 PolarHBondContact O-N 3.22Å
712	N	92.8	Very high	92.4	Very high	59 Å²	59	53.1 Å²	53.1	32%	0.316	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	140.6	168.4	-69.3	-10.5	0	0	0	110.5	R691 Y709 G748 S749	R691-N712 WeakPolarHBondContact CD-O 3.35Å; R691-N712 PolarHBondContact NH1-O 3.05Å; Y709-N712 PolarHBondContact OH-N 2.89Å; Y709-N712 PolarHBondContact OH-OD1 2.93Å; Y709-N712 VanDerWaalsContact OH-OD1 3.12Å; N712-G748 CarbonylContact C-O 3.54Å; N712-G748 WeakPolarHBondContact CA-O 3.49Å; N712-S749 VanDerWaalsContact OD1-CA 3.3Å; N712-S749 WeakPolarHBondContact OD1-CA 3.24Å; N712-S749 WeakPolarHBondContact OD1-CB 3.46Å; N712-S749 PolarHBondContact OD1-OG 2.92Å
713	I	93.9	Very high	92.5	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.051	30%	0.303	C	S	.	.			trans	-63.2	140.8	166.8	-61.7	-179.4	0	0	0	109.5	L672 F698 F728 L744 G748 V768 I785	L672-I713 HydrophobicContact CD1-CG2 3.42Å; L672-I713 VanDerWaalsContact CD1-CG2 3.42Å; F698-I713 HydrophobicContact CZ-CG1 4.19Å; I713-F728 HydrophobicContact CB-CD1 4.06Å; I713-F728 HydrophobicContact CB-CE1 3.9Å; I713-F728 HydrophobicContact CD1-CD1 4.32Å; I713-F728 HydrophobicContact CG2-CD1 3.93Å; I713-F728 HydrophobicContact CG2-CE1 3.59Å; I713-L744 HydrophobicContact CD1-CD1 3.58Å; I713-L744 HydrophobicContact CD1-CD2 3.66Å; I713-L744 HydrophobicContact CD1-CG 4.3Å; I713-L744 HydrophobicContact CG1-CD1 4.24Å; I713-G748 PolarHBondContact N-O 2.88Å; I713-V768 HydrophobicContact CD1-CB 4.43Å; I713-V768 HydrophobicContact CD1-CG1 3.87Å; I713-V768 HydrophobicContact CD1-CG2 3.92Å; I713-I785 HydrophobicContact CD1-CD1 3.86Å; I713-I785 HydrophobicContact CD1-CG2 4.47Å; I713-I785 HydrophobicContact CG1-CD1 4.2Å; I713-I785 HydrophobicContact CG2-CG2 4.48Å
714	L	92.7	Very high	92.7	Very high	47 Å²	47	51.5 Å²	51.5	25%	0.246	29%	0.293	C	S	.	.			trans	-96.9	113.9	174.2	-68.1	176.2	0	0	0	110	A673 L694 N696	A673-L714 HydrophobicContact CB-CB 3.8Å; A673-L714 WeakPolarHBondContact CB-O 3.32Å; A673-L714 PolarHBondContact N-O 3.3Å; L694-L714 WeakPolarHBondContact O-CD1 3.39Å; N696-L714 PolarHBondContact ND2-O 3.43Å; N696-L714 PolarHBondContact OD1-N 2.82Å
715	A	93.5	Very high	92.9	Very high	27 Å²	27	54.2 Å²	54.2	22%	0.223	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	161.4	164.6	0	0	0	0	0	108.7	V671 L672 L726 F728 V770	V671-A715 CarbonylContact O-C 3.58Å; V671-A715 WeakPolarHBondContact O-CA 3.48Å; V671-A715 WeakPolarHBondContact O-CB 3.16Å; L672-A715 HydrophobicContact CD1-CB 4.19Å; A715-L726 VanDerWaalsContact C-CD1 3.47Å; A715-L726 HydrophobicContact CB-CD1 3.58Å; A715-F728 HydrophobicContact CB-CE1 3.83Å; A715-F728 HydrophobicContact CB-CZ 3.94Å; A715-V770 HydrophobicContact CB-CG1 4.08Å; A715-V770 HydrophobicContact CB-CG2 4.2Å
716	S	93	Very high	93	Very high	72 Å²	72	52 Å²	52	50%	0.503	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	136.9	178.5	53.5	0	0	0	0	109.7	V671	V671-S716 PolarHBondContact N-O 3.3Å; V671-S716 PolarHBondContact O-N 2.82Å
717	D	94.6	Very high	93.1	Very high	25 Å²	25	54.2 Å²	54.2	13%	0.134	29%	0.289	C	S	.	.			trans	-97.3	174.5	157.7	-120.3	-50.7	0	0	0	111.9	P670 A724 L726	P670-D717 WeakPolarHBondContact CA-OD2 3.21Å; P670-D717 WeakPolarHBondContact CB-OD2 3.49Å; P670-D717 WeakPolarHBondContact CD-OD2 3.33Å; P670-D717 WeakPolarHBondContact CG-OD2 3.17Å; P670-D717 VanDerWaalsContact N-OD2 3.08Å; D717-A724 HydrophobicContact CB-CB 3.72Å; D717-L726 HydrophobicContact CB-CD2 4.12Å
718	K	93.5	Very high	93.3	Very high	125 Å²	125	51.2 Å²	51.2	54%	0.543	27%	0.273	S	S	.	.	S	Bend	trans	-103.2	-31.4	171.4	-61.1	-164.5	-163.1	161.9	0	114.5	R632 E633 H668	R632-K718 PolarHBondContact NH2-O 2.98Å; E633-K718 HydrophobicContact CB-CB 4.47Å; E633-K718 HydrophobicContact CB-CD 4.03Å; E633-K718 HydrophobicContact CG-CB 3.49Å; E633-K718 VanDerWaalsContact CG-CB 3.49Å; E633-K718 HydrophobicContact CG-CD 3.77Å; E633-K718 HydrophobicContact CG-CG 4.37Å; H668-K718 HydrophobicContact CB-CB 4.34Å; H668-K718 PolarHBondContact CD2-NZ 2.76Å; H668-K718 WeakPolarHBondContact NE2-CE 3.39Å; H668-K718 PolarHBondContact NE2-NZ 3.34Å
719	D	94.8	Very high	93.3	Very high	8 Å²	8	54.4 Å²	54.4	4%	0.043	29%	0.287	C	S	.	.	S	Bend	trans	-66.5	-168.9	-170.9	-58.3	9.4	0	0	0	111.4	D664 N666 D667 H668 N723 A724	D664-D719 WeakPolarHBondContact OD1-CA 3.4Å; N666-D719 WeakPolarHBondContact CA-OD2 3.22Å; D667-D719 PolarHBondContact N-OD2 2.98Å; H668-D719 WeakPolarHBondContact CB-OD1 3.46Å; H668-D719 IonicContact CG-OD1 3.09Å; H668-D719 PolarHBondContact N-OD2 2.75Å; H668-D719 IonicContact ND1-OD1 3.95Å; H668-D719 PolarHBondContact ND1-OD1 3.41Å; D719-N723 HydrophobicContact CB-CB 3.67Å; D719-A724 WeakPolarHBondContact O-CB 3.33Å
720	E	91.5	Very high	93.1	Very high	112 Å²	112	50 Å²	50	52%	0.523	27%	0.271	S	S	.	.			trans	-119.5	148.3	-170.5	-149.3	170.6	143.3	0	0	115.1	R632 D664 L722 N723	R632-E720 IonicContact CZ-OE2 3.83Å; R632-E720 IonicContact NH1-OE2 2.7Å; R632-E720 PolarHBondContact NH1-OE2 3.35Å; D664-E720 HydrophobicContact CB-CB 3.82Å; D664-E720 VanDerWaalsContact CG-CB 3.44Å; D664-E720 WeakPolarHBondContact OD1-CB 3.36Å; D664-E720 PolarHBondContact OD1-N 2.65Å; D664-E720 PolarHBondContact OD2-N 2.95Å; E720-L722 PolarHBondContact O-N 3.12Å; E720-N723 WeakPolarHBondContact O-CB 3.35Å; E720-N723 PolarHBondContact O-N 2.75Å
721	G	91.5	Very high	92.8	Very high	58 Å²	58	55 Å²	55	60%	0.598	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	-113.6	172.3	0	0	0	0	0	112.3	Q725	G721-Q725 WeakPolarHBondContact O-CB 3.36Å; G721-Q725 PolarHBondContact O-N 3.31Å
722	L	92.7	Very high	92.3	Very high	74 Å²	74	58.6 Å²	58.6	39%	0.387	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-32.3	179.6	-70.2	-180	0	0	0	113.1	E720 A724 Q725 Q773 S774 L775	E720-L722 PolarHBondContact O-N 3.12Å; L722-A724 PolarHBondContact O-N 3.2Å; L722-Q725 PolarHBondContact O-N 3.07Å; L722-Q725 VanDerWaalsContact O-N 3.08Å; L722-Q773 CarbonylContact O-C 3.53Å; L722-Q773 PolarHBondContact O-N 3.14Å; L722-S774 PolarHBondContact O-N 3.34Å; L722-L775 HydrophobicContact CD1-CD1 4.13Å; L722-L775 HydrophobicContact CD1-CD2 4.32Å; L722-L775 HydrophobicContact CD1-CG 3.94Å
723	N	92.4	Very high	91.4	Very high	23 Å²	23	57.9 Å²	57.9	12%	0.123	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-26.4	179.6	-66.4	-8.6	0	0	0	111.5	D664 N666 D719 E720 D772 S774	D664-N723 WeakPolarHBondContact OD2-CB 3.26Å; D664-N723 PolarHBondContact OD2-ND2 3.15Å; N666-N723 HydrophobicContact CB-CB 4.18Å; N666-N723 PolarHBondContact N-ND2 3.44Å; N666-N723 WeakPolarHBondContact OD1-CA 3.47Å; N666-N723 WeakPolarHBondContact OD1-CB 3.27Å; N666-N723 VanDerWaalsContact OD1-CG 3.26Å; N666-N723 PolarHBondContact OD1-O 2.86Å; N666-N723 PolarHBondContact OD1-OD1 3.37Å; D719-N723 HydrophobicContact CB-CB 3.67Å; E720-N723 WeakPolarHBondContact O-CB 3.35Å; E720-N723 PolarHBondContact O-N 2.75Å; N723-D772 WeakPolarHBondContact O-CB 3.39Å; N723-S774 WeakPolarHBondContact OD1-CB 3.4Å; N723-S774 PolarHBondContact OD1-OG 2.83Å
724	A	93	Very high	90.5	Very high	29 Å²	29	63 Å²	63	24%	0.24	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	3.4	168.4	0	0	0	0	0	115.3	D717 D719 L722 L726	D717-A724 HydrophobicContact CB-CB 3.72Å; D719-A724 WeakPolarHBondContact O-CB 3.33Å; L722-A724 PolarHBondContact O-N 3.2Å; A724-L726 PolarHBondContact O-N 3.17Å
725	Q	93.5	Very high	89.5	Confident	100 Å²	100	65.7 Å²	65.7	47%	0.467	36%	0.363	S	S	.	.			trans	-82.3	87.7	-175.7	-162.7	-173.7	-17.3	0	0	111.6	G721 L722 Q773	G721-Q725 WeakPolarHBondContact O-CB 3.36Å; G721-Q725 PolarHBondContact O-N 3.31Å; L722-Q725 PolarHBondContact O-N 3.07Å; L722-Q725 VanDerWaalsContact O-N 3.08Å; Q725-Q773 HydrophobicContact CB-CB 4.39Å; Q725-Q773 WeakPolarHBondContact O-CG 3.07Å; Q725-Q773 PolarHBondContact O-N 3.47Å; Q725-Q773 PolarHBondContact O-NE2 2.69Å
726	L	94.9	Very high	88.4	Confident	31 Å²	31	70 Å²	70	16%	0.162	37%	0.374	C	S	.	.			trans	-63.5	139.7	-172.2	-54.9	-172.7	0	0	0	115.4	P670 A715 D717 A724 F728 V770 S771	P670-L726 HydrophobicContact CB-CD2 3.75Å; P670-L726 HydrophobicContact CG-CD2 3.84Å; A715-L726 VanDerWaalsContact C-CD1 3.47Å; A715-L726 HydrophobicContact CB-CD1 3.58Å; D717-L726 HydrophobicContact CB-CD2 4.12Å; A724-L726 PolarHBondContact O-N 3.17Å; L726-F728 HydrophobicContact CB-CE2 3.86Å; L726-F728 HydrophobicContact CB-CZ 4.13Å; L726-F728 HydrophobicContact CD1-CZ 4.22Å; L726-V770 HydrophobicContact CB-CG1 4.17Å; L726-V770 HydrophobicContact CD1-CG1 4.09Å; L726-V770 HydrophobicContact CD2-CG1 4.09Å; L726-V770 HydrophobicContact CG-CG1 4.35Å; L726-S771 CarbonylContact C-O 3.59Å; L726-S771 WeakPolarHBondContact CA-O 3.4Å
727	R	94.1	Very high	87.8	Confident	118 Å²	118	73 Å²	73	45%	0.445	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.2	173.5	178.6	176.3	176	169.2	-2.5	110.2	P746 S771 Q773	R727-P746 WeakPolarHBondContact CA-O 2.99Å; R727-P746 HydrophobicContact CG-CB 4.43Å; R727-S771 PolarHBondContact N-O 2.92Å; R727-S771 PolarHBondContact O-N 3.44Å; R727-Q773 HydrophobicContact CB-CG 4.02Å
728	F	95.3	Very high	87.3	Confident	16 Å²	16	72 Å²	72	7%	0.07	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.7	-173.3	-61.6	-97.4	0	0	0	112.1	I713 A715 L726 L744 P746 G748 V768 V770	I713-F728 HydrophobicContact CB-CD1 4.06Å; I713-F728 HydrophobicContact CB-CE1 3.9Å; I713-F728 HydrophobicContact CD1-CD1 4.32Å; I713-F728 HydrophobicContact CG2-CD1 3.93Å; I713-F728 HydrophobicContact CG2-CE1 3.59Å; A715-F728 HydrophobicContact CB-CE1 3.83Å; A715-F728 HydrophobicContact CB-CZ 3.94Å; L726-F728 HydrophobicContact CB-CE2 3.86Å; L726-F728 HydrophobicContact CB-CZ 4.13Å; L726-F728 HydrophobicContact CD1-CZ 4.22Å; F728-L744 HydrophobicContact CB-CD2 4.21Å; F728-L744 HydrophobicContact CB-CG 4.39Å; F728-P746 PolarHBondContact N-O 3.3Å; F728-G748 VanDerWaalsContact CD2-N 3.28Å; F728-V768 HydrophobicContact CD1-CG1 4.33Å; F728-V770 HydrophobicContact CD1-CG1 4.29Å; F728-V770 HydrophobicContact CD1-CG2 3.84Å; F728-V770 HydrophobicContact CE1-CG1 3.98Å; F728-V770 HydrophobicContact CE1-CG2 3.8Å; F728-V770 HydrophobicContact CZ-CG1 4.3Å
729	M	92.8	Very high	86.8	Confident	87 Å²	87	70.6 Å²	70.6	43%	0.429	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	138.1	175.3	-62.6	-174.3	-68.4	0	0	110.9	V768 V769	M729-V768 WeakPolarHBondContact O-CA 3.33Å; M729-V769 HydrophobicContact CB-CB 4.42Å; M729-V769 PolarHBondContact N-O 3.26Å; M729-V769 PolarHBondContact O-N 2.81Å
730	L	91.3	Very high	86.4	Confident	19 Å²	19	75.2 Å²	75.2	10%	0.099	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	125.7	177.2	-177.5	64.2	0	0	0	109.7	I738 H739 L744 L766 V768	L730-I738 HydrophobicContact CD1-CG2 4.16Å; L730-I738 HydrophobicContact CD2-CG2 3.97Å; L730-I738 HydrophobicContact CG-CG2 4.44Å; L730-H739 PolarHBondContact O-CE1 2.79Å; L730-H739 PolarHBondContact O-NE2 2.88Å; L730-L744 HydrophobicContact CB-CB 4.14Å; L730-L744 HydrophobicContact CB-CD2 4.23Å; L730-L766 HydrophobicContact CD1-CB 4.06Å; L730-L766 HydrophobicContact CD1-CD2 3.98Å; L730-L766 HydrophobicContact CD1-CG 4.31Å; L730-V768 HydrophobicContact CD1-CG2 4.34Å
731	F	86.3	Confident	86.3	Confident	109 Å²	109	72.1 Å²	72.1	48%	0.478	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-75.9	136	178.9	-164.7	-88.4	0	0	0	110.3	D733 T767 V769	F731-D733 PolarHBondContact O-N 3.37Å; F731-T767 HydrophobicContact CB-CG2 3.8Å; F731-T767 WeakPolarHBondContact CB-O 3.26Å; F731-T767 HydrophobicContact CG-CG2 4.2Å; F731-T767 PolarHBondContact N-O 3.39Å; F731-V769 HydrophobicContact CB-CG2 4.4Å; F731-V769 HydrophobicContact CD2-CG2 3.93Å
732	P	79.8	Confident	86.4	Confident	82 Å²	82	69.4 Å²	69.4	53%	0.532	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-66.4	116.5	178.3	-19.3	32.1	0	0	0	113	H739	P732-H739 WeakPolarHBondContact CA-NE2 3.34Å
733	D	74.1	Confident	86.4	Confident	44 Å²	44	70.4 Å²	70.4	24%	0.235	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-101	116.6	160.9	170.7	20.2	0	0	0	109.2	F731 V735 Y736 I738	F731-D733 PolarHBondContact O-N 3.37Å; D733-V735 VanDerWaalsContact C-N 3.33Å; D733-V735 WeakPolarHBondContact OD1-CB 3.36Å; D733-V735 PolarHBondContact OD1-N 3.06Å; D733-Y736 WeakPolarHBondContact OD2-CD2 3.05Å; D733-Y736 PolarHBondContact OD2-N 2.78Å; D733-I738 HydrophobicContact CB-CD1 3.59Å; D733-I738 HydrophobicContact CB-CG1 3.87Å; D733-I738 WeakPolarHBondContact OD2-CD1 3.12Å
734	P	74.2	Confident	86.5	Confident	116 Å²	116	70.4 Å²	70.4	75%	0.753	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.9	179.1	32.1	-36	0	0	0	113.8
735	V	72.5	Confident	86.6	Confident	105 Å²	105	71.5 Å²	71.5	64%	0.636	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-50.7	-173.3	-176.8	0	0	0	0	111.2	D733	D733-V735 VanDerWaalsContact C-N 3.33Å; D733-V735 WeakPolarHBondContact OD1-CB 3.36Å; D733-V735 PolarHBondContact OD1-N 3.06Å
736	Y	70.5	Confident	86.5	Confident	116 Å²	116	70.5 Å²	70.5	46%	0.455	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	9.4	-177.1	-61.7	-68.3	0	0	0	114.1	D733 I738 R741 K761	D733-Y736 WeakPolarHBondContact OD2-CD2 3.05Å; D733-Y736 PolarHBondContact OD2-N 2.78Å; Y736-I738 VanDerWaalsContact C-N 3.28Å; Y736-I738 PolarHBondContact O-N 3.38Å; Y736-R741 PolarHBondContact O-NE 3.08Å; Y736-K761 HydrophobicContact CD1-CD 4.2Å; Y736-K761 VanDerWaalsContact CD2-NZ 3.27Å; Y736-K761 HydrophobicContact CE1-CD 4.32Å; Y736-K761 VanDerWaalsContact CG-NZ 3.26Å
737	R	80.6	Confident	86.4	Confident	136 Å²	136	73.4 Å²	73.4	51%	0.513	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.4	49.9	-177.3	-55.7	-166.2	-172.5	176.8	2.5	112.8	H739 E740 R741	R737-H739 PolarHBondContact O-N 3.18Å; R737-E740 HydrophobicContact CB-CB 4.32Å; R737-E740 HydrophobicContact CB-CG 4.33Å; R737-E740 VanDerWaalsContact CD-CD 3.41Å; R737-E740 WeakPolarHBondContact CD-OE1 3.09Å; R737-E740 WeakPolarHBondContact CD-OE2 3.43Å; R737-E740 IonicContact CZ-OE2 3.62Å; R737-E740 IonicContact NE-OE2 3.77Å; R737-E740 IonicContact NH1-OE1 3.07Å; R737-E740 PolarHBondContact NH1-OE1 2.69Å; R737-E740 IonicContact NH1-OE2 3.77Å; R737-E740 PolarHBondContact NH1-OE2 3.31Å; R737-E740 WeakPolarHBondContact O-CB 2.93Å; R737-E740 PolarHBondContact O-N 2.93Å; R737-R741 PolarHBondContact O-N 3.19Å
738	I	84.5	Confident	86.4	Confident	5 Å²	5	67.8 Å²	67.8	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-57	-33.3	-166.3	-60.1	-174.4	0	0	0	112.7	L730 D733 Y736 E740 R741 F742 L766	L730-I738 HydrophobicContact CD1-CG2 4.16Å; L730-I738 HydrophobicContact CD2-CG2 3.97Å; L730-I738 HydrophobicContact CG-CG2 4.44Å; D733-I738 HydrophobicContact CB-CD1 3.59Å; D733-I738 HydrophobicContact CB-CG1 3.87Å; D733-I738 WeakPolarHBondContact OD2-CD1 3.12Å; Y736-I738 VanDerWaalsContact C-N 3.28Å; Y736-I738 PolarHBondContact O-N 3.38Å; I738-E740 VanDerWaalsContact C-N 3.28Å; I738-E740 PolarHBondContact O-N 2.84Å; I738-R741 PolarHBondContact O-N 3.48Å; I738-R741 VanDerWaalsContact O-N 3.14Å; I738-F742 HydrophobicContact CG2-CB 4.42Å; I738-F742 HydrophobicContact CG2-CD2 3.8Å; I738-F742 PolarHBondContact O-N 3.03Å; I738-L766 HydrophobicContact CD1-CG 4.38Å; I738-L766 HydrophobicContact CG2-CD1 4.48Å; I738-L766 HydrophobicContact CG2-CD2 3.84Å; I738-L766 HydrophobicContact CG2-CG 3.62Å
739	H	81.6	Confident	86.3	Confident	94 Å²	94	67.4 Å²	67.4	44%	0.435	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-24.5	175	-72.7	-83.2	0	0	0	114.9	L730 P732 R737	L730-H739 PolarHBondContact O-CE1 2.79Å; L730-H739 PolarHBondContact O-NE2 2.88Å; P732-H739 WeakPolarHBondContact CA-NE2 3.34Å; R737-H739 PolarHBondContact O-N 3.18Å
740	E	86.2	Confident	86.5	Confident	105 Å²	105	63.3 Å²	63.3	49%	0.491	32%	0.317	S	S	.	.	H	α-helix	trans	-79.7	-32.4	173.6	-66.9	175.4	-165.9	0	0	110.8	R737 I738 N753	R737-E740 HydrophobicContact CB-CB 4.32Å; R737-E740 HydrophobicContact CB-CG 4.33Å; R737-E740 VanDerWaalsContact CD-CD 3.41Å; R737-E740 WeakPolarHBondContact CD-OE1 3.09Å; R737-E740 WeakPolarHBondContact CD-OE2 3.43Å; R737-E740 IonicContact CZ-OE2 3.62Å; R737-E740 IonicContact NE-OE2 3.77Å; R737-E740 IonicContact NH1-OE1 3.07Å; R737-E740 PolarHBondContact NH1-OE1 2.69Å; R737-E740 IonicContact NH1-OE2 3.77Å; R737-E740 PolarHBondContact NH1-OE2 3.31Å; R737-E740 WeakPolarHBondContact O-CB 2.93Å; R737-E740 PolarHBondContact O-N 2.93Å; I738-E740 VanDerWaalsContact C-N 3.28Å; I738-E740 PolarHBondContact O-N 2.84Å; E740-N753 WeakPolarHBondContact O-CB 3.11Å; E740-N753 PolarHBondContact O-ND2 2.95Å
741	R	90.4	Very high	86.6	Confident	47 Å²	47	64.8 Å²	64.8	18%	0.177	32%	0.322	C	S	.	.	H	α-helix	trans	-88.6	-31	-176.5	-64.8	-178	177.9	-98.4	-11.1	114.5	Y736 R737 I738 N753 V754 E760 Y764	Y736-R741 PolarHBondContact O-NE 3.08Å; R737-R741 PolarHBondContact O-N 3.19Å; I738-R741 PolarHBondContact O-N 3.48Å; I738-R741 VanDerWaalsContact O-N 3.14Å; R741-N753 PolarHBondContact O-N 2.87Å; R741-V754 HydrophobicContact CB-CG2 4.14Å; R741-V754 HydrophobicContact CG-CG2 4.09Å; R741-E760 IonicContact CZ-OE1 3.75Å; R741-E760 IonicContact CZ-OE2 3.23Å; R741-E760 VanDerWaalsContact CZ-OE2 3.25Å; R741-E760 IonicContact NH1-OE1 2.66Å; R741-E760 IonicContact NH1-OE2 2.73Å; R741-E760 PolarHBondContact NH1-OE2 3.49Å; R741-E760 IonicContact NH2-OE1 3.75Å; R741-E760 PolarHBondContact NH2-OE1 3.01Å; R741-E760 IonicContact NH2-OE2 3.69Å; R741-E760 PolarHBondContact NH2-OE2 2.87Å; R741-Y764 PolarHBondContact NH1-OH 3.24Å
742	F	93.7	Very high	87	Confident	1 Å²	1	59.7 Å²	59.7	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	139.2	-172.9	-60.2	-78.7	0	0	0	112	M710 I738 Y751 L756 Y764 L766 I787	M710-F742 HydrophobicContact CE-CD1 3.57Å; M710-F742 HydrophobicContact CE-CE1 3.83Å; M710-F742 HydrophobicContact SD-CE1 4.46Å; I738-F742 HydrophobicContact CG2-CB 4.42Å; I738-F742 HydrophobicContact CG2-CD2 3.8Å; I738-F742 PolarHBondContact O-N 3.03Å; F742-Y751 WeakPolarHBondContact CA-O 3.05Å; F742-L756 HydrophobicContact CE1-CD1 3.86Å; F742-L756 HydrophobicContact CE1-CD2 4.47Å; F742-L756 HydrophobicContact CZ-CD1 4.01Å; F742-L756 HydrophobicContact CZ-CD2 4.06Å; F742-Y764 AromaticContact CE2-CD1 3.55Å; F742-Y764 HydrophobicContact CE2-CD1 3.55Å; F742-Y764 HydrophobicContact CE2-CD2 4.28Å; F742-Y764 AromaticContact CE2-CE1 3.83Å; F742-Y764 HydrophobicContact CE2-CE1 3.83Å; F742-Y764 AromaticContact CE2-CG 3.78Å; F742-Y764 HydrophobicContact CE2-CG 3.78Å; F742-Y764 HydrophobicContact CZ-CD1 4.01Å; F742-Y764 AromaticContact CZ-CD2 3.88Å; F742-Y764 HydrophobicContact CZ-CD2 3.88Å; F742-Y764 HydrophobicContact CZ-CE1 4.23Å; F742-Y764 HydrophobicContact CZ-CE2 4.15Å; F742-Y764 AromaticContact CZ-CG 3.8Å; F742-Y764 HydrophobicContact CZ-CG 3.8Å; F742-L766 HydrophobicContact CB-CD2 3.98Å; F742-L766 HydrophobicContact CD1-CD2 4.49Å; F742-L766 HydrophobicContact CD2-CD1 4.46Å; F742-L766 HydrophobicContact CD2-CD2 4.01Å; F742-L766 HydrophobicContact CE2-CD1 4.39Å; F742-L766 HydrophobicContact CG-CD2 3.9Å; F742-I787 HydrophobicContact CD1-CD1 3.71Å; F742-I787 HydrophobicContact CE1-CD1 3.34Å; F742-I787 HydrophobicContact CE2-CD1 4.37Å; F742-I787 HydrophobicContact CG-CD1 4.35Å; F742-I787 HydrophobicContact CZ-CD1 3.72Å
743	R	92.7	Very high	87.5	Confident	95 Å²	95	58.8 Å²	58.8	36%	0.358	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	110.3	178.4	-173.9	-175	67.4	145	3.1	110	L745 Y751 N753	R743-L745 HydrophobicContact CG-CD2 4.43Å; R743-Y751 PolarHBondContact N-O 3.43Å; R743-Y751 PolarHBondContact O-N 2.87Å; R743-N753 HydrophobicContact CB-CB 4.38Å
744	L	94.6	Very high	88.3	Confident	24 Å²	24	59 Å²	59	13%	0.126	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.9	170.9	-179.2	54.4	0	0	0	109.5	I713 F728 L730 L750 V768	I713-L744 HydrophobicContact CD1-CD1 3.58Å; I713-L744 HydrophobicContact CD1-CD2 3.66Å; I713-L744 HydrophobicContact CD1-CG 4.3Å; I713-L744 HydrophobicContact CG1-CD1 4.24Å; F728-L744 HydrophobicContact CB-CD2 4.21Å; F728-L744 HydrophobicContact CB-CG 4.39Å; L730-L744 HydrophobicContact CB-CB 4.14Å; L730-L744 HydrophobicContact CB-CD2 4.23Å; L744-L750 HydrophobicContact CB-CD1 4.06Å; L744-L750 HydrophobicContact CD1-CB 4.36Å; L744-L750 HydrophobicContact CD1-CD1 4.16Å; L744-V768 HydrophobicContact CD2-CG1 3.81Å; L744-V768 HydrophobicContact CD2-CG2 4.01Å
745	L	93.9	Very high	89.1	Confident	51 Å²	51	57.8 Å²	57.8	27%	0.267	28%	0.277	S	S	.	.			trans	-84.6	153.9	173.2	-62.6	-173.8	0	0	0	111	R743 N747 G748 S749 Y751	R743-L745 HydrophobicContact CG-CD2 4.43Å; L745-N747 WeakPolarHBondContact CB-OD1 3.06Å; L745-N747 PolarHBondContact O-N 3.22Å; L745-G748 PolarHBondContact O-N 3.11Å; L745-S749 PolarHBondContact N-O 3.34Å; L745-Y751 HydrophobicContact CD1-CD2 4.42Å; L745-Y751 HydrophobicContact CD1-CE2 3.6Å; L745-Y751 HydrophobicContact CG-CD2 4.28Å; L745-Y751 HydrophobicContact CG-CE2 3.9Å
746	P	93	Very high	90	Very high	80 Å²	80	53 Å²	53	52%	0.519	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.7	-176.4	-27.2	36	0	0	0	115.9	R727 F728 G748	R727-P746 WeakPolarHBondContact CA-O 2.99Å; R727-P746 HydrophobicContact CG-CB 4.43Å; F728-P746 PolarHBondContact N-O 3.3Å; P746-G748 VanDerWaalsContact C-N 3.29Å
747	N	92.1	Very high	91	Very high	91 Å²	91	51.1 Å²	51.1	49%	0.487	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	5.8	175.5	73.1	-33.8	0	0	0	113.8	L745 S749	L745-N747 WeakPolarHBondContact CB-OD1 3.06Å; L745-N747 PolarHBondContact O-N 3.22Å; N747-S749 PolarHBondContact ND2-OG 2.77Å; N747-S749 WeakPolarHBondContact OD1-CB 3.46Å; N747-S749 PolarHBondContact OD1-N 2.8Å; N747-S749 PolarHBondContact OD1-OG 3.3Å
748	G	93.3	Very high	91.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	88.3	-0.7	-179.1	0	0	0	0	0	115.3	N712 I713 F728 L745 P746 L750	N712-G748 CarbonylContact C-O 3.54Å; N712-G748 WeakPolarHBondContact CA-O 3.49Å; I713-G748 PolarHBondContact N-O 2.88Å; F728-G748 VanDerWaalsContact CD2-N 3.28Å; L745-G748 PolarHBondContact O-N 3.11Å; P746-G748 VanDerWaalsContact C-N 3.29Å; G748-L750 PolarHBondContact O-N 2.88Å
749	S	95	Very high	91.7	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.063	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.3	178.1	-60.7	0	0	0	0	112	N712 L745 N747	N712-S749 VanDerWaalsContact OD1-CA 3.3Å; N712-S749 WeakPolarHBondContact OD1-CA 3.24Å; N712-S749 WeakPolarHBondContact OD1-CB 3.46Å; N712-S749 PolarHBondContact OD1-OG 2.92Å; L745-S749 PolarHBondContact N-O 3.34Å; N747-S749 PolarHBondContact ND2-OG 2.77Å; N747-S749 WeakPolarHBondContact OD1-CB 3.46Å; N747-S749 PolarHBondContact OD1-N 2.8Å; N747-S749 PolarHBondContact OD1-OG 3.3Å
750	L	95	Very high	92	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.4	-176.6	-171	73.7	0	0	0	111.9	F698 M710 G711 L744 G748 L766 I785 I787	F698-L750 HydrophobicContact CD1-CD2 4.4Å; F698-L750 HydrophobicContact CD2-CD2 3.95Å; F698-L750 HydrophobicContact CE1-CD2 4.48Å; F698-L750 HydrophobicContact CE2-CD2 4.08Å; F698-L750 HydrophobicContact CG-CD2 4.13Å; F698-L750 HydrophobicContact CZ-CD2 4.34Å; M710-L750 HydrophobicContact CB-CD2 4.5Å; M710-L750 HydrophobicContact CE-CD2 3.77Å; M710-L750 HydrophobicContact CE-CG 3.72Å; M710-L750 PolarHBondContact N-O 2.83Å; M710-L750 HydrophobicContact SD-CD2 4.38Å; G711-L750 PolarHBondContact O-N 3.22Å; L744-L750 HydrophobicContact CB-CD1 4.06Å; L744-L750 HydrophobicContact CD1-CB 4.36Å; L744-L750 HydrophobicContact CD1-CD1 4.16Å; G748-L750 PolarHBondContact O-N 2.88Å; L750-L766 HydrophobicContact CD1-CD2 4.31Å; L750-I785 HydrophobicContact CD1-CD1 4.38Å; L750-I785 HydrophobicContact CD2-CD1 3.73Å; L750-I787 HydrophobicContact CD2-CD1 4.12Å
751	Y	94.8	Very high	92.1	Very high	50 Å²	50	46.9 Å²	46.9	20%	0.196	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.5	179.4	-60.3	-100.7	0	0	0	111.8	T708 Y709 M710 F742 R743 L745	T708-Y751 CarbonylContact O-C 3.49Å; T708-Y751 WeakPolarHBondContact O-CA 3.32Å; Y709-Y751 HydrophobicContact CD2-CD1 4.31Å; Y709-Y751 AromaticContact CD2-CE1 3.83Å; Y709-Y751 HydrophobicContact CD2-CE1 3.83Å; Y709-Y751 HydrophobicContact CD2-CE2 4.19Å; Y709-Y751 AromaticContact CD2-CZ 3.74Å; Y709-Y751 HydrophobicContact CG-CE1 4.14Å; M710-Y751 VanDerWaalsContact CE-C 3.49Å; F742-Y751 WeakPolarHBondContact CA-O 3.05Å; R743-Y751 PolarHBondContact N-O 3.43Å; R743-Y751 PolarHBondContact O-N 2.87Å; L745-Y751 HydrophobicContact CD1-CD2 4.42Å; L745-Y751 HydrophobicContact CD1-CE2 3.6Å; L745-Y751 HydrophobicContact CG-CD2 4.28Å; L745-Y751 HydrophobicContact CG-CE2 3.9Å
752	T	93.5	Very high	92	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	148.7	158	68.1	0	0	0	0	109.5	V700 P705 N707 T708 M710 V754 L756	V700-T752 HydrophobicContact CG2-CG2 4.26Å; P705-T752 PolarHBondContact O-OG1 2.82Å; N707-T752 WeakPolarHBondContact CA-O 3.16Å; N707-T752 PolarHBondContact N-O 2.77Å; T708-T752 WeakPolarHBondContact CB-OG1 3.35Å; T708-T752 PolarHBondContact N-OG1 2.93Å; T708-T752 VanDerWaalsContact N-OG1 3.12Å; T708-T752 PolarHBondContact O-N 2.99Å; M710-T752 HydrophobicContact CE-CG2 3.98Å; M710-T752 HydrophobicContact SD-CG2 4.34Å; T752-V754 WeakPolarHBondContact CB-O 3.49Å; T752-L756 HydrophobicContact CG2-CD1 3.78Å; T752-L756 HydrophobicContact CG2-CG 4.37Å
753	N	91	Very high	91.7	Very high	63 Å²	63	50.7 Å²	50.7	34%	0.337	25%	0.252	S	S	.	.	S	Bend	trans	-115.8	-25.4	175.1	-169.2	70.7	0	0	0	111.9	E740 R741 R743	E740-N753 WeakPolarHBondContact O-CB 3.11Å; E740-N753 PolarHBondContact O-ND2 2.95Å; R741-N753 PolarHBondContact O-N 2.87Å; R743-N753 HydrophobicContact CB-CB 4.38Å
754	V	91.6	Very high	91.6	Very high	49 Å²	49	46.3 Å²	46.3	30%	0.297	24%	0.235	S	C	.	.	S	Bend	trans	-108	167.6	165.5	-60.4	0	0	0	0	110.7	R741 T752 L756	R741-V754 HydrophobicContact CB-CG2 4.14Å; R741-V754 HydrophobicContact CG-CG2 4.09Å; T752-V754 WeakPolarHBondContact CB-O 3.49Å; V754-L756 HydrophobicContact CG2-CD2 3.86Å
755	E	91.3	Very high	91.4	Very high	91 Å²	91	52.3 Å²	52.3	43%	0.425	26%	0.256	S	S	.	.			trans	-74.5	132.1	159.9	-49.2	-167	150.7	0	0	106	V706	V706-E755 HydrophobicContact CG1-CG 3.65Å
756	L	91.7	Very high	91.2	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	24%	0.243	C	C	.	.			trans	-95.3	140	-175.9	-66.4	170.9	0	0	0	110	V700 E702 N703 F742 T752 V754 Y764 V789	V700-L756 HydrophobicContact CG1-CD1 3.79Å; E702-L756 CarbonylContact C-O 3.56Å; E702-L756 WeakPolarHBondContact CA-O 3.41Å; E702-L756 WeakPolarHBondContact CB-O 3.16Å; N703-L756 PolarHBondContact N-O 3.1Å; F742-L756 HydrophobicContact CE1-CD1 3.86Å; F742-L756 HydrophobicContact CE1-CD2 4.47Å; F742-L756 HydrophobicContact CZ-CD1 4.01Å; F742-L756 HydrophobicContact CZ-CD2 4.06Å; T752-L756 HydrophobicContact CG2-CD1 3.78Å; T752-L756 HydrophobicContact CG2-CG 4.37Å; V754-L756 HydrophobicContact CG2-CD2 3.86Å; L756-Y764 HydrophobicContact CD2-CE2 4.28Å; L756-V789 HydrophobicContact CD1-CG2 4.36Å
757	D	90.7	Very high	91.2	Very high	75 Å²	75	48.8 Å²	48.8	40%	0.401	24%	0.235	S	C	.	.			trans	-114.5	131.1	176.7	168.3	-26.1	0	0	0	106.6	E759 E760 K761	D757-E759 PolarHBondContact OD1-N 3.04Å; D757-E760 HydrophobicContact CB-CB 4.17Å; D757-E760 PolarHBondContact OD1-N 2.9Å; D757-K761 PolarHBondContact O-N 3.48Å
758	R	90.4	Very high	91.2	Very high	41 Å²	41	44.4 Å²	44.4	16%	0.155	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-32.1	-175.1	-168.2	-160.2	74.5	101.2	3.2	112.5	E702 E760 K761 D762 V789 D791 A893	E702-R758 HydrophobicContact CB-CB 4.32Å; E702-R758 VanDerWaalsContact CD-CB 3.47Å; E702-R758 IonicContact OE1-NE 3.57Å; E702-R758 WeakPolarHBondContact OE2-CB 3.16Å; E702-R758 PolarHBondContact OE2-N 2.91Å; R758-E760 PolarHBondContact O-N 3.32Å; R758-K761 CarbonylContact O-C 3.41Å; R758-K761 WeakPolarHBondContact O-CA 3.43Å; R758-K761 PolarHBondContact O-N 3.23Å; R758-D762 HydrophobicContact CG-CB 4.22Å; R758-D762 PolarHBondContact O-N 3.19Å; R758-D762 VanDerWaalsContact O-N 3.09Å; R758-V789 HydrophobicContact CB-CB 4.34Å; R758-V789 HydrophobicContact CB-CG1 3.78Å; R758-V789 HydrophobicContact CG-CB 4.08Å; R758-V789 HydrophobicContact CG-CG1 4.02Å; R758-D791 VanDerWaalsContact CD-CA 3.44Å; R758-D791 IonicContact CZ-OD1 3.81Å; R758-D791 IonicContact NE-OD1 2.7Å; R758-D791 PolarHBondContact NE-OD1 2.87Å; R758-D791 IonicContact NH1-OD1 3.56Å; R758-D791 IonicContact NH2-OD1 2.75Å; R758-D791 PolarHBondContact NH2-OD1 2.84Å; R758-D791 VanDerWaalsContact NH2-OD1 3.07Å; R758-A893 VanDerWaalsContact NH1-CB 3.33Å; R758-A893 VanDerWaalsContact NH2-CB 3.26Å
759	E	89.4	Confident	91.1	Very high	61 Å²	61	45.5 Å²	45.5	29%	0.285	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-30.5	174	-76	51.9	-113	0	0	110.7	D757 P891	D757-E759 PolarHBondContact OD1-N 3.04Å; E759-P891 HydrophobicContact CG-CB 3.62Å
760	E	88.5	Confident	91.1	Very high	113 Å²	113	45 Å²	45	53%	0.528	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-49.1	163.5	-166	-168	-164.8	0	0	111.4	R741 D757 R758	R741-E760 IonicContact CZ-OE1 3.75Å; R741-E760 IonicContact CZ-OE2 3.23Å; R741-E760 VanDerWaalsContact CZ-OE2 3.25Å; R741-E760 IonicContact NH1-OE1 2.66Å; R741-E760 IonicContact NH1-OE2 2.73Å; R741-E760 PolarHBondContact NH1-OE2 3.49Å; R741-E760 IonicContact NH2-OE1 3.75Å; R741-E760 PolarHBondContact NH2-OE1 3.01Å; R741-E760 IonicContact NH2-OE2 3.69Å; R741-E760 PolarHBondContact NH2-OE2 2.87Å; D757-E760 HydrophobicContact CB-CB 4.17Å; D757-E760 PolarHBondContact OD1-N 2.9Å; R758-E760 PolarHBondContact O-N 3.32Å
761	K	87.6	Confident	91.1	Very high	36 Å²	36	45.9 Å²	45.9	16%	0.157	22%	0.221	C	C	.	.			trans	-161.1	111.3	179.1	-171.4	151.8	176.9	165.9	0	116.3	Y736 D757 R758 H763 Y764	Y736-K761 HydrophobicContact CD1-CD 4.2Å; Y736-K761 VanDerWaalsContact CD2-NZ 3.27Å; Y736-K761 HydrophobicContact CE1-CD 4.32Å; Y736-K761 VanDerWaalsContact CG-NZ 3.26Å; D757-K761 PolarHBondContact O-N 3.48Å; R758-K761 CarbonylContact O-C 3.41Å; R758-K761 WeakPolarHBondContact O-CA 3.43Å; R758-K761 PolarHBondContact O-N 3.23Å; K761-H763 WeakPolarHBondContact CE-O 3.43Å; K761-H763 WeakPolarHBondContact CG-O 3.45Å; K761-H763 PolarHBondContact O-N 2.87Å; K761-Y764 HydrophobicContact CB-CE1 4.37Å; K761-Y764 HydrophobicContact CB-CE2 4.01Å; K761-Y764 HydrophobicContact CD-CD1 3.99Å; K761-Y764 HydrophobicContact CD-CE1 3.71Å; K761-Y764 HydrophobicContact CD-CE2 4.4Å; K761-Y764 HydrophobicContact CD-CG 4.48Å; K761-Y764 HydrophobicContact CG-CD1 4.43Å; K761-Y764 HydrophobicContact CG-CD2 4.27Å; K761-Y764 HydrophobicContact CG-CE1 4.09Å; K761-Y764 HydrophobicContact CG-CE2 3.88Å; K761-Y764 WeakPolarHBondContact O-CE2 3.41Å
762	D	87.4	Confident	91.1	Very high	67 Å²	67	43.6 Å²	43.6	36%	0.358	21%	0.212	S	C	.	.	S	Bend	trans	-63.1	-36.3	178.2	74.5	-37.6	0	0	0	115.6	R758 V789	R758-D762 HydrophobicContact CG-CB 4.22Å; R758-D762 PolarHBondContact O-N 3.19Å; R758-D762 VanDerWaalsContact O-N 3.09Å; D762-V789 WeakPolarHBondContact O-CB 3.21Å; D762-V789 PolarHBondContact O-N 3.13Å
763	H	89.3	Confident	91	Very high	62 Å²	62	46.7 Å²	46.7	29%	0.287	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	145.8	-175.7	79.1	-76.2	0	0	0	113.6	K761 I787	K761-H763 WeakPolarHBondContact CE-O 3.43Å; K761-H763 WeakPolarHBondContact CG-O 3.45Å; K761-H763 PolarHBondContact O-N 2.87Å; H763-I787 CarbonylContact C-O 3.49Å; H763-I787 VanDerWaalsContact CA-O 3.31Å; H763-I787 WeakPolarHBondContact CA-O 3.16Å
764	Y	90.2	Very high	91	Very high	3 Å²	3	44.7 Å²	44.7	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.8	177.8	-60.8	-103.8	0	0	0	110.9	R741 F742 L756 K761 I787 V789	R741-Y764 PolarHBondContact NH1-OH 3.24Å; F742-Y764 AromaticContact CE2-CD1 3.55Å; F742-Y764 HydrophobicContact CE2-CD1 3.55Å; F742-Y764 HydrophobicContact CE2-CD2 4.28Å; F742-Y764 AromaticContact CE2-CE1 3.83Å; F742-Y764 HydrophobicContact CE2-CE1 3.83Å; F742-Y764 AromaticContact CE2-CG 3.78Å; F742-Y764 HydrophobicContact CE2-CG 3.78Å; F742-Y764 HydrophobicContact CZ-CD1 4.01Å; F742-Y764 AromaticContact CZ-CD2 3.88Å; F742-Y764 HydrophobicContact CZ-CD2 3.88Å; F742-Y764 HydrophobicContact CZ-CE1 4.23Å; F742-Y764 HydrophobicContact CZ-CE2 4.15Å; F742-Y764 AromaticContact CZ-CG 3.8Å; F742-Y764 HydrophobicContact CZ-CG 3.8Å; L756-Y764 HydrophobicContact CD2-CE2 4.28Å; K761-Y764 HydrophobicContact CB-CE1 4.37Å; K761-Y764 HydrophobicContact CB-CE2 4.01Å; K761-Y764 HydrophobicContact CD-CD1 3.99Å; K761-Y764 HydrophobicContact CD-CE1 3.71Å; K761-Y764 HydrophobicContact CD-CE2 4.4Å; K761-Y764 HydrophobicContact CD-CG 4.48Å; K761-Y764 HydrophobicContact CG-CD1 4.43Å; K761-Y764 HydrophobicContact CG-CD2 4.27Å; K761-Y764 HydrophobicContact CG-CE1 4.09Å; K761-Y764 HydrophobicContact CG-CE2 3.88Å; K761-Y764 WeakPolarHBondContact O-CE2 3.41Å; Y764-I787 PolarHBondContact N-O 2.79Å; Y764-I787 PolarHBondContact O-N 2.89Å; Y764-V789 HydrophobicContact CD2-CG2 4.18Å; Y764-V789 HydrophobicContact CE2-CG2 3.89Å
765	R	89.7	Confident	90.7	Very high	149 Å²	149	49.1 Å²	49.1	56%	0.562	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.3	117.3	171.1	-59.2	-175.6	-166.5	-162.1	2.5	107.6	Y675 T784 I785	Y675-R765 HydrophobicContact CE2-CG 4.39Å; R765-T784 HydrophobicContact CB-CG2 3.98Å; R765-I785 WeakPolarHBondContact CA-O 3.34Å
766	L	90.6	Very high	90	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.3	-173.3	-74.1	67.8	0	0	0	108.5	L730 I738 F742 L750 T784 I785 I787	L730-L766 HydrophobicContact CD1-CB 4.06Å; L730-L766 HydrophobicContact CD1-CD2 3.98Å; L730-L766 HydrophobicContact CD1-CG 4.31Å; I738-L766 HydrophobicContact CD1-CG 4.38Å; I738-L766 HydrophobicContact CG2-CD1 4.48Å; I738-L766 HydrophobicContact CG2-CD2 3.84Å; I738-L766 HydrophobicContact CG2-CG 3.62Å; F742-L766 HydrophobicContact CB-CD2 3.98Å; F742-L766 HydrophobicContact CD1-CD2 4.49Å; F742-L766 HydrophobicContact CD2-CD1 4.46Å; F742-L766 HydrophobicContact CD2-CD2 4.01Å; F742-L766 HydrophobicContact CE2-CD1 4.39Å; F742-L766 HydrophobicContact CG-CD2 3.9Å; L750-L766 HydrophobicContact CD1-CD2 4.31Å; L766-T784 CarbonylContact O-C 3.58Å; L766-T784 WeakPolarHBondContact O-CA 3.36Å; L766-I785 HydrophobicContact CB-CD1 4.23Å; L766-I785 HydrophobicContact CB-CG1 3.68Å; L766-I785 HydrophobicContact CD2-CD1 4.42Å; L766-I785 PolarHBondContact N-O 2.81Å; L766-I785 PolarHBondContact O-N 3.46Å; L766-I787 HydrophobicContact CD1-CD1 3.54Å; L766-I787 HydrophobicContact CD1-CG1 3.91Å; L766-I787 HydrophobicContact CD2-CD1 3.84Å; L766-I787 HydrophobicContact CG-CD1 4.36Å
767	T	91.1	Very high	89.7	Confident	57 Å²	57	59.4 Å²	59.4	35%	0.35	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	129.5	172	-59.7	0	0	0	0	109.5	F731 G783	F731-T767 HydrophobicContact CB-CG2 3.8Å; F731-T767 WeakPolarHBondContact CB-O 3.26Å; F731-T767 HydrophobicContact CG-CG2 4.2Å; F731-T767 PolarHBondContact N-O 3.39Å; T767-G783 CarbonylContact C-O 3.53Å; T767-G783 WeakPolarHBondContact CA-O 3.45Å
768	V	92.4	Very high	89.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	134.1	-176	176	0	0	0	0	108.8	I713 F728 M729 L730 L744 V770 G783 I785	I713-V768 HydrophobicContact CD1-CB 4.43Å; I713-V768 HydrophobicContact CD1-CG1 3.87Å; I713-V768 HydrophobicContact CD1-CG2 3.92Å; F728-V768 HydrophobicContact CD1-CG1 4.33Å; M729-V768 WeakPolarHBondContact O-CA 3.33Å; L730-V768 HydrophobicContact CD1-CG2 4.34Å; L744-V768 HydrophobicContact CD2-CG1 3.81Å; L744-V768 HydrophobicContact CD2-CG2 4.01Å; V768-V770 HydrophobicContact CG1-CG2 4.45Å; V768-G783 PolarHBondContact N-O 3.12Å; V768-G783 PolarHBondContact O-N 2.64Å; V768-I785 HydrophobicContact CG2-CD1 4.04Å; V768-I785 HydrophobicContact CG2-CG1 4.17Å; V768-I785 HydrophobicContact CG2-CG2 4.24Å
769	V	93	Very high	89.9	Confident	22 Å²	22	59.5 Å²	59.5	13%	0.133	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	128.6	168.7	-166.2	0	0	0	0	107.8	M729 F731 T782	M729-V769 HydrophobicContact CB-CB 4.42Å; M729-V769 PolarHBondContact N-O 3.26Å; M729-V769 PolarHBondContact O-N 2.81Å; F731-V769 HydrophobicContact CB-CG2 4.4Å; F731-V769 HydrophobicContact CD2-CG2 3.93Å; V769-T782 HydrophobicContact CG1-CG2 4.49Å; V769-T782 HydrophobicContact CG2-CG2 4.3Å
770	V	94.3	Very high	90.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.8	167	-167.4	0	0	0	0	107.2	P670 L672 A715 L726 F728 V768 T780 T781	P670-V770 HydrophobicContact CB-CB 3.95Å; P670-V770 HydrophobicContact CB-CG1 3.58Å; P670-V770 HydrophobicContact CG-CG1 4.24Å; L672-V770 HydrophobicContact CD1-CG2 3.92Å; A715-V770 HydrophobicContact CB-CG1 4.08Å; A715-V770 HydrophobicContact CB-CG2 4.2Å; L726-V770 HydrophobicContact CB-CG1 4.17Å; L726-V770 HydrophobicContact CD1-CG1 4.09Å; L726-V770 HydrophobicContact CD2-CG1 4.09Å; L726-V770 HydrophobicContact CG-CG1 4.35Å; F728-V770 HydrophobicContact CD1-CG1 4.29Å; F728-V770 HydrophobicContact CD1-CG2 3.84Å; F728-V770 HydrophobicContact CE1-CG1 3.98Å; F728-V770 HydrophobicContact CE1-CG2 3.8Å; F728-V770 HydrophobicContact CZ-CG1 4.3Å; V768-V770 HydrophobicContact CG1-CG2 4.45Å; V770-T780 CarbonylContact O-C 3.57Å; V770-T780 VanDerWaalsContact O-CA 3.26Å; V770-T780 WeakPolarHBondContact O-CA 3.3Å; V770-T781 PolarHBondContact N-O 2.96Å; V770-T781 PolarHBondContact O-N 2.81Å
771	S	94.6	Very high	90.3	Very high	17 Å²	17	57.1 Å²	57.1	12%	0.119	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.6	175	-178.7	0	0	0	0	107.6	L726 R727 L779	L726-S771 CarbonylContact C-O 3.59Å; L726-S771 WeakPolarHBondContact CA-O 3.4Å; R727-S771 PolarHBondContact N-O 2.92Å; R727-S771 PolarHBondContact O-N 3.44Å; S771-L779 WeakPolarHBondContact CA-O 3.44Å
772	D	94.4	Very high	90.5	Very high	2 Å²	2	60 Å²	60	1%	0.011	32%	0.317	C	S	.	.			trans	-71.1	-169.9	156.2	64.6	56.7	0	0	0	110.9	N666 N723 S774 P778 L779	N666-D772 PolarHBondContact ND2-OD2 2.84Å; N666-D772 PolarHBondContact OD1-OD2 2.85Å; N723-D772 WeakPolarHBondContact O-CB 3.39Å; D772-S774 VanDerWaalsContact OD1-CB 3.25Å; D772-S774 WeakPolarHBondContact OD1-CB 3.43Å; D772-S774 PolarHBondContact OD1-N 2.85Å; D772-P778 VanDerWaalsContact OD1-CA 3.23Å; D772-P778 WeakPolarHBondContact OD1-CA 2.98Å; D772-P778 WeakPolarHBondContact OD1-CB 3.43Å; D772-L779 PolarHBondContact N-O 2.85Å; D772-L779 WeakPolarHBondContact OD2-CA 3.44Å; D772-L779 WeakPolarHBondContact OD2-CB 3.42Å; D772-L779 PolarHBondContact OD2-N 3.41Å
773	Q	92.6	Very high	90.6	Very high	68 Å²	68	57.7 Å²	57.7	32%	0.318	31%	0.309	S	S	.	.			trans	-126.9	33	171.3	-74.4	173.1	96.2	0	0	112.4	L722 Q725 R727	L722-Q773 CarbonylContact O-C 3.53Å; L722-Q773 PolarHBondContact O-N 3.14Å; Q725-Q773 HydrophobicContact CB-CB 4.39Å; Q725-Q773 WeakPolarHBondContact O-CG 3.07Å; Q725-Q773 PolarHBondContact O-N 3.47Å; Q725-Q773 PolarHBondContact O-NE2 2.69Å; R727-Q773 HydrophobicContact CB-CG 4.02Å
774	S	89.4	Confident	90.7	Very high	21 Å²	21	56.4 Å²	56.4	15%	0.147	31%	0.306	C	S	.	.			trans	-57.1	148.7	171.3	-161.4	0	0	0	0	111.5	L722 N723 D772	L722-S774 PolarHBondContact O-N 3.34Å; N723-S774 WeakPolarHBondContact OD1-CB 3.4Å; N723-S774 PolarHBondContact OD1-OG 2.83Å; D772-S774 VanDerWaalsContact OD1-CB 3.25Å; D772-S774 WeakPolarHBondContact OD1-CB 3.43Å; D772-S774 PolarHBondContact OD1-N 2.85Å
775	L	85.7	Confident	90.8	Very high	141 Å²	141	56.3 Å²	56.3	74%	0.738	31%	0.305	S	S	*	.	S	Bend	trans	-84.6	-36.5	-173	-67.8	176.3	0	0	0	113.2	L722	L722-L775 HydrophobicContact CD1-CD1 4.13Å; L722-L775 HydrophobicContact CD1-CD2 4.32Å; L722-L775 HydrophobicContact CD1-CG 3.94Å
776	D	76.5	Confident	90.8	Very high	153 Å²	153	49.4 Å²	49.4	82%	0.818	28%	0.28	S	S	*	.	S	Bend	trans	-105.6	-44.2	-168.1	-66.6	-54.8	0	0	0	112.9
777	E	85.5	Confident	90.8	Very high	159 Å²	159	49.4 Å²	49.4	74%	0.743	28%	0.28	S	S	*	.	S	Bend	trans	-139.4	81.4	174.7	-66.4	-163	173.3	0	0	112.3	N666	N666-E777 PolarHBondContact ND2-O 2.9Å
778	P	91.8	Very high	90.7	Very high	69 Å²	69	47.1 Å²	47.1	45%	0.448	27%	0.266	S	S	.	.			trans	-72.7	128.1	179.5	28.6	-34.7	0	0	0	112.9	D772	D772-P778 VanDerWaalsContact OD1-CA 3.23Å; D772-P778 WeakPolarHBondContact OD1-CA 2.98Å; D772-P778 WeakPolarHBondContact OD1-CB 3.43Å
779	L	93.6	Very high	90.6	Very high	50 Å²	50	47.4 Å²	47.4	26%	0.262	27%	0.268	S	S	.	.			trans	-91.4	148.5	179.5	-63.7	171.7	0	0	0	110.9	N666 H668 S771 D772	N666-L779 WeakPolarHBondContact ND2-CG 3.4Å; N666-L779 PolarHBondContact ND2-N 2.91Å; H668-L779 WeakPolarHBondContact O-CD1 3.38Å; S771-L779 WeakPolarHBondContact CA-O 3.44Å; D772-L779 PolarHBondContact N-O 2.85Å; D772-L779 WeakPolarHBondContact OD2-CA 3.44Å; D772-L779 WeakPolarHBondContact OD2-CB 3.42Å; D772-L779 PolarHBondContact OD2-N 3.41Å
780	T	93.7	Very high	90.4	Very high	82 Å²	82	46.7 Å²	46.7	50%	0.503	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	141.6	-172.5	74.4	0	0	0	0	112.7	V770	V770-T780 CarbonylContact O-C 3.57Å; V770-T780 VanDerWaalsContact O-CA 3.26Å; V770-T780 WeakPolarHBondContact O-CA 3.3Å
781	T	93	Very high	90.1	Very high	41 Å²	41	47.2 Å²	47.2	25%	0.252	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.1	175.9	-65.2	0	0	0	0	110.5	P670 V770	P670-T781 WeakPolarHBondContact O-CB 3.34Å; P670-T781 WeakPolarHBondContact O-CG2 3.46Å; P670-T781 PolarHBondContact O-OG1 2.91Å; V770-T781 PolarHBondContact N-O 2.96Å; V770-T781 PolarHBondContact O-N 2.81Å
782	T	92.2	Very high	89.7	Confident	97 Å²	97	49.4 Å²	49.4	60%	0.595	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	129.8	170	60.4	0	0	0	0	110.4	V769	V769-T782 HydrophobicContact CG1-CG2 4.49Å; V769-T782 HydrophobicContact CG2-CG2 4.3Å
783	G	89.2	Confident	89.4	Confident	18 Å²	18	49.7 Å²	49.7	19%	0.186	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	-173.1	171.3	0	0	0	0	0	112.2	T767 V768	T767-G783 CarbonylContact C-O 3.53Å; T767-G783 WeakPolarHBondContact CA-O 3.45Å; V768-G783 PolarHBondContact N-O 3.12Å; V768-G783 PolarHBondContact O-N 2.64Å
784	T	90.7	Very high	89.2	Confident	36 Å²	36	49.9 Å²	49.9	22%	0.221	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.1	-177	-55.6	0	0	0	0	110.1	Y675 R765 L766	Y675-T784 WeakPolarHBondContact CB-O 3.46Å; Y675-T784 HydrophobicContact CD1-CG2 4.34Å; Y675-T784 WeakPolarHBondContact CD1-O 3.47Å; Y675-T784 HydrophobicContact CD2-CG2 4.29Å; Y675-T784 HydrophobicContact CE1-CG2 3.86Å; Y675-T784 HydrophobicContact CE2-CG2 3.81Å; Y675-T784 VanDerWaalsContact CG-O 3.29Å; R765-T784 HydrophobicContact CB-CG2 3.98Å; L766-T784 CarbonylContact O-C 3.58Å; L766-T784 WeakPolarHBondContact O-CA 3.36Å
785	I	91.9	Very high	89.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	149	172.6	72.7	173.2	0	0	0	109.3	L672 N696 F698 I713 L750 R765 L766 V768	L672-I785 HydrophobicContact CD2-CG2 4.31Å; N696-I785 HydrophobicContact CB-CB 4.04Å; N696-I785 HydrophobicContact CB-CG2 3.66Å; N696-I785 WeakPolarHBondContact O-CA 3.43Å; N696-I785 WeakPolarHBondContact O-CB 3.37Å; F698-I785 HydrophobicContact CD2-CD1 4.26Å; F698-I785 HydrophobicContact CE2-CB 4.27Å; F698-I785 HydrophobicContact CE2-CD1 3.86Å; I713-I785 HydrophobicContact CD1-CD1 3.86Å; I713-I785 HydrophobicContact CD1-CG2 4.47Å; I713-I785 HydrophobicContact CG1-CD1 4.2Å; I713-I785 HydrophobicContact CG2-CG2 4.48Å; L750-I785 HydrophobicContact CD1-CD1 4.38Å; L750-I785 HydrophobicContact CD2-CD1 3.73Å; R765-I785 WeakPolarHBondContact CA-O 3.34Å; L766-I785 HydrophobicContact CB-CD1 4.23Å; L766-I785 HydrophobicContact CB-CG1 3.68Å; L766-I785 HydrophobicContact CD2-CD1 4.42Å; L766-I785 PolarHBondContact N-O 2.81Å; L766-I785 PolarHBondContact O-N 3.46Å; V768-I785 HydrophobicContact CG2-CD1 4.04Å; V768-I785 HydrophobicContact CG2-CG1 4.17Å; V768-I785 HydrophobicContact CG2-CG2 4.24Å
786	G	89.9	Confident	89.1	Confident	4 Å²	4	50 Å²	50	4%	0.041	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146	179.3	0	0	0	0	0	112.1	N696 L697 F698	N696-G786 PolarHBondContact O-N 3.5Å; L697-G786 CarbonylContact C-O 3.58Å; L697-G786 WeakPolarHBondContact CA-O 3.34Å; F698-G786 PolarHBondContact N-O 2.88Å
787	I	91.5	Very high	89.7	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130.6	168.7	-48.4	178.3	0	0	0	108.3	F698 V700 M710 F742 L750 H763 Y764 L766	F698-I787 HydrophobicContact CB-CG1 4.28Å; F698-I787 HydrophobicContact CB-CG2 4.48Å; F698-I787 CarbonylContact O-C 3.57Å; F698-I787 VanDerWaalsContact O-CA 3.29Å; F698-I787 WeakPolarHBondContact O-CA 3.31Å; V700-I787 HydrophobicContact CG1-CG2 4.1Å; M710-I787 HydrophobicContact CE-CD1 4.03Å; M710-I787 HydrophobicContact SD-CD1 4.03Å; M710-I787 HydrophobicContact SD-CG2 3.93Å; F742-I787 HydrophobicContact CD1-CD1 3.71Å; F742-I787 HydrophobicContact CE1-CD1 3.34Å; F742-I787 HydrophobicContact CE2-CD1 4.37Å; F742-I787 HydrophobicContact CG-CD1 4.35Å; F742-I787 HydrophobicContact CZ-CD1 3.72Å; L750-I787 HydrophobicContact CD2-CD1 4.12Å; H763-I787 CarbonylContact C-O 3.49Å; H763-I787 VanDerWaalsContact CA-O 3.31Å; H763-I787 WeakPolarHBondContact CA-O 3.16Å; Y764-I787 PolarHBondContact N-O 2.79Å; Y764-I787 PolarHBondContact O-N 2.89Å; L766-I787 HydrophobicContact CD1-CD1 3.54Å; L766-I787 HydrophobicContact CD1-CG1 3.91Å; L766-I787 HydrophobicContact CD2-CD1 3.84Å; L766-I787 HydrophobicContact CG-CD1 4.36Å
788	I	89.2	Confident	89.7	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.041	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.2	171.9	-63.4	172.7	0	0	0	108.3	L681 L682 L697 F698 I699 V700 L790	L681-I788 HydrophobicContact CB-CD1 4.24Å; L682-I788 HydrophobicContact CD2-CD1 3.86Å; L682-I788 HydrophobicContact CD2-CG1 3.83Å; L682-I788 HydrophobicContact CD2-CG2 3.97Å; L682-I788 HydrophobicContact CG-CD1 4.31Å; L697-I788 HydrophobicContact CD1-CD1 4.08Å; L697-I788 HydrophobicContact CD1-CG1 4.15Å; L697-I788 HydrophobicContact CD2-CD1 4.37Å; F698-I788 PolarHBondContact O-N 2.86Å; I699-I788 WeakPolarHBondContact CA-O 3.14Å; V700-I788 PolarHBondContact N-O 2.82Å; I788-L790 HydrophobicContact CG2-CD2 4.27Å
789	V	90.8	Very high	89.4	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.042	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.3	170.8	-171.9	0	0	0	0	108.5	V700 E702 L756 R758 D762 Y764	V700-V789 HydrophobicContact CG1-CG2 4.07Å; V700-V789 CarbonylContact O-C 3.59Å; V700-V789 WeakPolarHBondContact O-CA 3.46Å; E702-V789 HydrophobicContact CB-CG1 3.75Å; L756-V789 HydrophobicContact CD1-CG2 4.36Å; R758-V789 HydrophobicContact CB-CB 4.34Å; R758-V789 HydrophobicContact CB-CG1 3.78Å; R758-V789 HydrophobicContact CG-CB 4.08Å; R758-V789 HydrophobicContact CG-CG1 4.02Å; D762-V789 WeakPolarHBondContact O-CB 3.21Å; D762-V789 PolarHBondContact O-N 3.13Å; Y764-V789 HydrophobicContact CD2-CG2 4.18Å; Y764-V789 HydrophobicContact CE2-CG2 3.89Å
790	L	88.3	Confident	88.9	Confident	7 Å²	7	39.6 Å²	39.6	4%	0.037	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	132.3	-179.1	-62.5	176.8	0	0	0	111.5	L687 I699 V700 R701 E702 I788	L687-L790 HydrophobicContact CB-CD1 4.16Å; L687-L790 HydrophobicContact CB-CD2 4.31Å; L687-L790 WeakPolarHBondContact O-CD1 3.48Å; I699-L790 HydrophobicContact CG2-CD1 3.49Å; I699-L790 VanDerWaalsContact CG2-CD1 3.49Å; I699-L790 HydrophobicContact CG2-CD2 3.98Å; I699-L790 HydrophobicContact CG2-CG 3.61Å; V700-L790 PolarHBondContact O-N 2.95Å; R701-L790 HydrophobicContact CG-CB 3.9Å; R701-L790 HydrophobicContact CG-CD1 4.16Å; E702-L790 PolarHBondContact N-O 2.83Å; I788-L790 HydrophobicContact CG2-CD2 4.27Å
791	D	86.9	Confident	87.8	Confident	11 Å²	11	37.8 Å²	37.8	6%	0.059	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-63.4	123.8	-179.6	175.2	83.1	0	0	0	113.8	N685 E702 R758 A893 N896	N685-D791 WeakPolarHBondContact ND2-CB 3.21Å; N685-D791 PolarHBondContact ND2-O 2.99Å; N685-D791 VanDerWaalsContact ND2-O 3.15Å; N685-D791 PolarHBondContact ND2-OD2 2.86Å; E702-D791 VanDerWaalsContact OE1-CA 3.22Å; E702-D791 WeakPolarHBondContact OE1-CA 3.23Å; R758-D791 VanDerWaalsContact CD-CA 3.44Å; R758-D791 IonicContact CZ-OD1 3.81Å; R758-D791 IonicContact NE-OD1 2.7Å; R758-D791 PolarHBondContact NE-OD1 2.87Å; R758-D791 IonicContact NH1-OD1 3.56Å; R758-D791 IonicContact NH2-OD1 2.75Å; R758-D791 PolarHBondContact NH2-OD1 2.84Å; R758-D791 VanDerWaalsContact NH2-OD1 3.07Å; D791-A893 WeakPolarHBondContact OD1-CB 3.27Å; D791-A893 PolarHBondContact OD1-N 2.9Å; D791-N896 PolarHBondContact OD2-ND2 3.35Å
792	L	87.5	Confident	86.8	Confident	63 Å²	63	36.7 Å²	36.7	33%	0.33	20%	0.201	S	C	.	.			trans	-116.2	149.3	171.6	-64.8	-178.8	0	0	0	110	R701 E702 D794	R701-L792 HydrophobicContact CB-CD1 4.44Å; R701-L792 HydrophobicContact CG-CD2 4.44Å; E702-L792 HydrophobicContact CG-CB 3.97Å; E702-L792 HydrophobicContact CG-CD1 3.86Å; E702-L792 HydrophobicContact CG-CG 3.88Å; E702-L792 WeakPolarHBondContact O-CD1 3.36Å; E702-L792 PolarHBondContact OE1-N 3.37Å; L792-D794 PolarHBondContact O-N 2.8Å; L792-D794 VanDerWaalsContact O-N 3.13Å
793	N	88.1	Confident	85.6	Confident	8 Å²	8	40.1 Å²	40.1	4%	0.043	21%	0.21	C	C	.	.			trans	-85.2	83.1	179.4	-160.9	123.7	0	0	0	110.2	D892 N896 D951 G953 H954 P955 M957	N793-D892 WeakPolarHBondContact CA-OD2 3.31Å; N793-N896 HydrophobicContact CB-CB 4.03Å; N793-N896 VanDerWaalsContact OD1-CA 3.27Å; N793-N896 WeakPolarHBondContact OD1-CA 2.98Å; N793-N896 VanDerWaalsContact OD1-CB 3.27Å; N793-N896 WeakPolarHBondContact OD1-CB 3.22Å; N793-N896 PolarHBondContact OD1-OD1 2.72Å; N793-D951 PolarHBondContact ND2-OD2 3.3Å; N793-D951 PolarHBondContact OD1-OD2 3.4Å; N793-G953 VanDerWaalsContact OD1-C 3.22Å; N793-G953 WeakPolarHBondContact OD1-CA 3.48Å; N793-H954 PolarHBondContact OD1-N 3.04Å; N793-P955 PolarHBondContact ND2-O 2.97Å; N793-M957 VanDerWaalsContact ND2-CG 3.27Å; N793-M957 WeakPolarHBondContact ND2-CG 3.32Å; N793-M957 WeakPolarHBondContact O-CE 3.31Å
794	D	88	Confident	84.3	Confident	71 Å²	71	39.7 Å²	39.7	38%	0.38	21%	0.206	S	C	.	.			trans	-121.3	-16.5	-174.9	99	-27	0	0	0	115.8	N703 L792 D892	N703-D794 PolarHBondContact ND2-OD2 3.45Å; L792-D794 PolarHBondContact O-N 2.8Å; L792-D794 VanDerWaalsContact O-N 3.13Å; D794-D892 PolarHBondContact N-OD2 3.37Å; D794-D892 VanDerWaalsContact N-OD2 3.13Å
795	N	87.5	Confident	83.5	Confident	55 Å²	55	39.1 Å²	39.1	29%	0.294	20%	0.201	S	C	.	.	S	Bend	trans	-83.8	-172.4	168.4	-64.3	-82.2	0	0	0	111.6	P891 D892 M957	N795-P891 HydrophobicContact CB-CB 4.18Å; N795-P891 HydrophobicContact CB-CG 3.93Å; N795-D892 VanDerWaalsContact CB-OD1 3.23Å; N795-D892 WeakPolarHBondContact CB-OD1 3.09Å; N795-D892 PolarHBondContact N-OD1 3.13Å; N795-D892 PolarHBondContact N-OD2 3.13Å; N795-D892 PolarHBondContact ND2-OD1 2.76Å; N795-M957 WeakPolarHBondContact O-CB 3.29Å; N795-M957 WeakPolarHBondContact O-CG 3.42Å
796	Q	86.1	Confident	82.5	Confident	109 Å²	109	40.6 Å²	40.6	51%	0.509	21%	0.209	S	C	.	.			trans	-147.8	153.8	178.3	63.2	171.9	-9.3	0	0	111.4	Q798 M957	Q796-Q798 PolarHBondContact O-N 2.9Å; Q796-M957 HydrophobicContact CB-CB 3.93Å
797	P	89.3	Confident	81.5	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-67.4	123.7	-174.4	-19.2	29.3	0	0	0	111.7	E889 D890 V899 A949 I959	P797-E889 CarbonylContact C-O 3.51Å; P797-E889 WeakPolarHBondContact CA-O 3.23Å; P797-D890 HydrophobicContact CB-CB 4.36Å; P797-D890 WeakPolarHBondContact CD-OD2 3.31Å; P797-D890 HydrophobicContact CG-CB 4.38Å; P797-D890 WeakPolarHBondContact CG-OD2 3.4Å; P797-V899 HydrophobicContact CB-CG1 4.2Å; P797-V899 HydrophobicContact CB-CG2 4.08Å; P797-A949 HydrophobicContact CB-CB 3.78Å; P797-I959 WeakPolarHBondContact O-CB 3.39Å; P797-I959 VanDerWaalsContact O-CD1 3.28Å; P797-I959 WeakPolarHBondContact O-CD1 2.85Å; P797-I959 VanDerWaalsContact O-CG1 3.27Å; P797-I959 WeakPolarHBondContact O-CG1 3.47Å
798	Q	85.7	Confident	80.2	Confident	130 Å²	130	46.5 Å²	46.5	61%	0.607	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.3	178.4	-179.3	171	-20	0	0	111.5	Q796 L800 A888 E889	Q796-Q798 PolarHBondContact O-N 2.9Å; Q798-L800 HydrophobicContact CG-CD2 4.49Å; Q798-L800 PolarHBondContact O-N 3.37Å; Q798-L800 VanDerWaalsContact O-N 3.16Å; Q798-A888 WeakPolarHBondContact O-CA 3.46Å; Q798-A888 VanDerWaalsContact O-CB 3.27Å; Q798-A888 WeakPolarHBondContact O-CB 3.22Å; Q798-E889 PolarHBondContact N-O 2.94Å; Q798-E889 PolarHBondContact O-N 3.23Å; Q798-E889 VanDerWaalsContact O-N 3.16Å
799	F	84.1	Confident	78.9	Confident	26 Å²	26	50.8 Å²	50.8	11%	0.114	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	116.3	170.7	-83.2	-60.1	0	0	0	111.6	L805 L886 A888 Y901 V947 A949 I959 K962	F799-L805 HydrophobicContact CB-CD1 3.98Å; F799-L805 HydrophobicContact CD1-CD1 3.78Å; F799-L805 HydrophobicContact CD2-CD1 3.99Å; F799-L805 HydrophobicContact CE1-CD1 4.23Å; F799-L805 HydrophobicContact CE2-CD1 4.41Å; F799-L805 HydrophobicContact CG-CD1 3.67Å; F799-L886 HydrophobicContact CE1-CB 4.13Å; F799-L886 HydrophobicContact CE1-CD1 4.23Å; F799-L886 HydrophobicContact CZ-CD1 4.47Å; F799-A888 HydrophobicContact CD1-CB 3.87Å; F799-A888 HydrophobicContact CE1-CB 4.38Å; F799-A888 HydrophobicContact CG-CB 4.34Å; F799-Y901 AromaticContact CE1-CD1 3.88Å; F799-Y901 HydrophobicContact CE1-CD1 3.88Å; F799-Y901 AromaticContact CE1-CE1 3.93Å; F799-Y901 HydrophobicContact CE1-CE1 3.93Å; F799-Y901 HydrophobicContact CZ-CD1 4.46Å; F799-V947 HydrophobicContact CE2-CB 4.45Å; F799-V947 HydrophobicContact CE2-CG2 3.88Å; F799-V947 HydrophobicContact CZ-CB 4.03Å; F799-V947 HydrophobicContact CZ-CG2 3.81Å; F799-A949 HydrophobicContact CE1-CB 4.09Å; F799-A949 HydrophobicContact CE2-CB 4.1Å; F799-A949 HydrophobicContact CZ-CB 3.83Å; F799-I959 HydrophobicContact CB-CD1 4.28Å; F799-I959 HydrophobicContact CD2-CD1 3.85Å; F799-I959 HydrophobicContact CD2-CG2 3.7Å; F799-I959 HydrophobicContact CE2-CG2 3.56Å; F799-I959 HydrophobicContact CG-CD1 4.41Å; F799-K962 HydrophobicContact CD2-CG 3.65Å; F799-K962 HydrophobicContact CE2-CG 4.02Å
800	L	82.7	Confident	76.9	Confident	57 Å²	57	57 Å²	57	30%	0.298	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-33.7	175.4	-65.1	178.5	0	0	0	112.3	Q798 H803 Y887 E889	Q798-L800 HydrophobicContact CG-CD2 4.49Å; Q798-L800 PolarHBondContact O-N 3.37Å; Q798-L800 VanDerWaalsContact O-N 3.16Å; L800-H803 PolarHBondContact O-CE1 3Å; L800-H803 PolarHBondContact O-ND1 2.7Å; L800-Y887 HydrophobicContact CB-CD1 3.98Å; L800-Y887 HydrophobicContact CD1-CD1 4.16Å; L800-Y887 HydrophobicContact CD1-CE1 3.87Å; L800-Y887 PolarHBondContact N-O 2.96Å; L800-E889 HydrophobicContact CD1-CB 3.99Å; L800-E889 HydrophobicContact CD1-CG 3.68Å; L800-E889 VanDerWaalsContact CD1-OE2 3.31Å; L800-E889 WeakPolarHBondContact CD1-OE2 3.43Å
801	S	71.4	Confident	75.2	Confident	44 Å²	44	61.3 Å²	61.3	31%	0.308	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	144.9	-179.1	-162.6	0	0	0	0	112.8	L886 Y887	S801-L886 CarbonylContact O-C 3.56Å; S801-L886 WeakPolarHBondContact O-CA 3.29Å; S801-Y887 PolarHBondContact N-O 2.65Å; S801-Y887 PolarHBondContact O-N 2.8Å
802	P	71.2	Confident	73.4	Confident	18 Å²	18	64.8 Å²	64.8	12%	0.117	34%	0.34	C	S	.	.	S	Bend	cis	-72	143.9	-8.4	29.8	-33.7	0	0	0	111.9	G804 L805 L964	P802-G804 PolarHBondContact O-N 3.07Å; P802-L805 HydrophobicContact CG-CD2 4.39Å; P802-L805 HydrophobicContact CG-CG 4.2Å; P802-L805 WeakPolarHBondContact O-CG 3.42Å; P802-L805 PolarHBondContact O-N 2.86Å; P802-L964 HydrophobicContact CG-CD1 4.06Å
803	H	67.3	Low	71.6	Confident	169 Å²	169	62.6 Å²	62.6	78%	0.782	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	0.1	179.5	-53.4	-63	0	0	0	115.2	L800	L800-H803 PolarHBondContact O-CE1 3Å; L800-H803 PolarHBondContact O-ND1 2.7Å
804	G	62.4	Low	69.6	Low	9 Å²	9	64.5 Å²	64.5	9%	0.093	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	2.6	-179.1	0	0	0	0	0	116.3	P802 L806	P802-G804 PolarHBondContact O-N 3.07Å; G804-L806 PolarHBondContact O-N 2.89Å
805	L	74.7	Confident	67.7	Low	24 Å²	24	62.7 Å²	62.7	13%	0.126	34%	0.341	C	S	.	.			trans	-65.5	103.8	-175.7	-74.6	179.7	0	0	0	111.9	F799 P802 L886 V947 K962 I963 L964	F799-L805 HydrophobicContact CB-CD1 3.98Å; F799-L805 HydrophobicContact CD1-CD1 3.78Å; F799-L805 HydrophobicContact CD2-CD1 3.99Å; F799-L805 HydrophobicContact CE1-CD1 4.23Å; F799-L805 HydrophobicContact CE2-CD1 4.41Å; F799-L805 HydrophobicContact CG-CD1 3.67Å; P802-L805 HydrophobicContact CG-CD2 4.39Å; P802-L805 HydrophobicContact CG-CG 4.2Å; P802-L805 WeakPolarHBondContact O-CG 3.42Å; P802-L805 PolarHBondContact O-N 2.86Å; L805-L886 HydrophobicContact CD1-CD2 4.35Å; L805-L886 HydrophobicContact CD2-CD2 4.45Å; L805-V947 HydrophobicContact CD1-CG2 3.98Å; L805-V947 HydrophobicContact CD2-CG2 3.64Å; L805-V947 HydrophobicContact CG-CG2 4.41Å; L805-K962 HydrophobicContact CB-CB 3.77Å; L805-K962 HydrophobicContact CB-CG 4.09Å; L805-K962 HydrophobicContact CD1-CB 4.42Å; L805-K962 HydrophobicContact CD2-CB 4.44Å; L805-K962 HydrophobicContact CG-CB 4.43Å; L805-I963 CarbonylContact C-O 3.4Å; L805-L964 HydrophobicContact CD2-CB 3.89Å; L805-L964 HydrophobicContact CD2-CD1 3.81Å
806	L	71.1	Confident	65.9	Low	31 Å²	31	61.6 Å²	61.6	16%	0.162	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-64.4	154.5	-178.2	-60.4	172.3	0	0	0	111.5	G804 Y816 K962 I963 P965	G804-L806 PolarHBondContact O-N 2.89Å; L806-Y816 HydrophobicContact CD1-CD2 4.3Å; L806-Y816 HydrophobicContact CD1-CE2 3.68Å; L806-Y816 HydrophobicContact CD2-CE2 4.14Å; L806-K962 CarbonylContact O-C 3.55Å; L806-K962 VanDerWaalsContact O-CA 3.29Å; L806-K962 WeakPolarHBondContact O-CA 3.18Å; L806-K962 WeakPolarHBondContact O-CB 3.17Å; L806-I963 HydrophobicContact CB-CB 4.15Å; L806-I963 WeakPolarHBondContact CB-O 3.36Å; L806-I963 PolarHBondContact N-O 2.75Å; L806-I963 PolarHBondContact O-N 2.66Å; L806-P965 HydrophobicContact CD1-CB 4Å; L806-P965 HydrophobicContact CD1-CG 3.85Å; L806-P965 HydrophobicContact CG-CG 4.12Å
807	I	69.1	Low	63.9	Low	76 Å²	76	61.2 Å²	61.2	39%	0.39	33%	0.329	S	S	.	.			trans	-91.4	135.5	174.6	-59.6	175.4	0	0	0	108	N809 Q812	I807-N809 HydrophobicContact CG2-CB 4.31Å; I807-N809 PolarHBondContact O-N 2.83Å; I807-Q812 PolarHBondContact O-OE1 3.03Å
808	P	63.5	Low	61.7	Low	54 Å²	54	69.3 Å²	69.3	35%	0.351	36%	0.36	S	S	.	.			trans	-74.7	44.3	-179.4	34.7	-40.7	0	0	0	112.4	Q961 I963	P808-Q961 WeakPolarHBondContact CD-O 3.29Å; P808-Q961 WeakPolarHBondContact CG-O 3.45Å; P808-I963 HydrophobicContact CB-CD1 3.87Å; P808-I963 HydrophobicContact CB-CG1 4.18Å
809	N	61	Low	59.8	Low	98 Å²	98	70.3 Å²	70.3	52%	0.524	36%	0.364	S	S	.	.			trans	-88	129.4	170.3	-114.9	-44.8	0	0	0	108.6	I807 T811 Q812	I807-N809 HydrophobicContact CG2-CB 4.31Å; I807-N809 PolarHBondContact O-N 2.83Å; N809-T811 PolarHBondContact O-N 3.03Å; N809-Q812 PolarHBondContact O-N 3.08Å
810	N	50.1	Low	57.7	Low	138 Å²	138	74.3 Å²	74.3	74%	0.738	39%	0.385	S	S	*	.	H	α-helix	trans	-52.2	-27.5	-178	-75.3	-28.3	0	0	0	113.2	S814	N810-S814 WeakPolarHBondContact O-CB 3.37Å; N810-S814 PolarHBondContact O-N 2.78Å
811	T	51.3	Low	55.3	Low	96 Å²	96	77.7 Å²	77.7	59%	0.589	40%	0.403	S	S	*	.	H	α-helix	trans	-65.1	-43.6	175.9	48.9	0	0	0	0	113.5	N809 S814 G815	N809-T811 PolarHBondContact O-N 3.03Å; T811-S814 WeakPolarHBondContact O-CB 3.47Å; T811-S814 PolarHBondContact O-N 2.97Å; T811-S814 PolarHBondContact O-OG 3.46Å; T811-G815 PolarHBondContact O-N 3.12Å; T811-G815 VanDerWaalsContact O-N 3.14Å
812	Q	48.6	Very low	53.3	Low	84 Å²	84	87.4 Å²	87.4	39%	0.393	43%	0.433	S	S	.	.	H	α-helix	trans	-70	-41.4	179.6	-72.4	-167.5	-11.2	0	0	111.7	I807 N809 S814 G815 Y816	I807-Q812 PolarHBondContact O-OE1 3.03Å; N809-Q812 PolarHBondContact O-N 3.08Å; Q812-S814 VanDerWaalsContact C-N 3.27Å; Q812-S814 PolarHBondContact O-N 3.45Å; Q812-G815 WeakPolarHBondContact O-CA 3.39Å; Q812-G815 PolarHBondContact O-N 2.69Å; Q812-Y816 PolarHBondContact O-N 3.03Å
813	L	50.6	Low	51.3	Low	17 Å²	17	88.7 Å²	88.7	9%	0.089	45%	0.449	C	S	.	.	H	α-helix	trans	-60.7	-35.9	170.5	-86	153.9	0	0	0	112.1	G815 Y816 K817 F906 I963	L813-G815 VanDerWaalsContact C-N 3.26Å; L813-G815 PolarHBondContact O-N 3.19Å; L813-Y816 PolarHBondContact O-N 3.31Å; L813-K817 PolarHBondContact O-N 3Å; L813-K817 VanDerWaalsContact O-N 3.11Å; L813-F906 HydrophobicContact CD1-CE1 3.74Å; L813-F906 HydrophobicContact CD1-CZ 3.82Å; L813-F906 HydrophobicContact CD2-CE1 4.02Å; L813-I963 HydrophobicContact CD1-CD1 3.89Å
814	S	46.2	Very low	49.4	Very low	49 Å²	49	86.9 Å²	86.9	34%	0.343	44%	0.444	S	S	.	.	H	α-helix	trans	-65.4	-26.7	172.5	88.5	0	0	0	0	113.6	N810 T811 Q812 K817 R818	N810-S814 WeakPolarHBondContact O-CB 3.37Å; N810-S814 PolarHBondContact O-N 2.78Å; T811-S814 WeakPolarHBondContact O-CB 3.47Å; T811-S814 PolarHBondContact O-N 2.97Å; T811-S814 PolarHBondContact O-OG 3.46Å; Q812-S814 VanDerWaalsContact C-N 3.27Å; Q812-S814 PolarHBondContact O-N 3.45Å; S814-K817 PolarHBondContact O-N 3.02Å; S814-R818 PolarHBondContact O-N 3.36Å; S814-R818 VanDerWaalsContact O-N 3.17Å
815	G	47.4	Very low	47.8	Very low	32 Å²	32	94.5 Å²	94.5	33%	0.33	48%	0.478	S	S	.	.	H	α-helix	trans	-66.9	-48.7	174.6	0	0	0	0	0	112.1	T811 Q812 L813 K817 R818 H819	T811-G815 PolarHBondContact O-N 3.12Å; T811-G815 VanDerWaalsContact O-N 3.14Å; Q812-G815 WeakPolarHBondContact O-CA 3.39Å; Q812-G815 PolarHBondContact O-N 2.69Å; L813-G815 VanDerWaalsContact C-N 3.26Å; L813-G815 PolarHBondContact O-N 3.19Å; G815-K817 VanDerWaalsContact C-N 3.3Å; G815-K817 PolarHBondContact O-N 2.77Å; G815-R818 WeakPolarHBondContact O-CB 3.2Å; G815-R818 PolarHBondContact O-N 3.44Å; G815-H819 PolarHBondContact O-N 2.79Å
816	Y	49.9	Very low	45.5	Very low	32 Å²	32	100.4 Å²	100.4	13%	0.125	51%	0.508	C	S	.	.	H	α-helix	trans	-60.1	-38.4	172.5	-86.2	-86.5	0	0	0	112.1	L806 Q812 L813 R818 H819 M820 Y942	L806-Y816 HydrophobicContact CD1-CD2 4.3Å; L806-Y816 HydrophobicContact CD1-CE2 3.68Å; L806-Y816 HydrophobicContact CD2-CE2 4.14Å; Q812-Y816 PolarHBondContact O-N 3.03Å; L813-Y816 PolarHBondContact O-N 3.31Å; Y816-R818 PolarHBondContact O-N 3.09Å; Y816-H819 PolarHBondContact O-N 2.85Å; Y816-M820 PolarHBondContact O-N 2.86Å; Y816-M820 VanDerWaalsContact O-N 3.16Å; Y816-Y942 HydrophobicContact CD1-CE1 4.36Å; Y816-Y942 AromaticContact CE1-CE1 3.86Å; Y816-Y942 HydrophobicContact CE1-CE1 3.86Å
817	K	44.7	Very low	43.4	Very low	101 Å²	101	108 Å²	108	44%	0.439	54%	0.536	S	S	.	.	H	α-helix	trans	-59.8	-29.3	172.2	-77.8	172.3	165.1	164.9	0	113.6	L813 S814 G815 D908	L813-K817 PolarHBondContact O-N 3Å; L813-K817 VanDerWaalsContact O-N 3.11Å; S814-K817 PolarHBondContact O-N 3.02Å; G815-K817 VanDerWaalsContact C-N 3.3Å; G815-K817 PolarHBondContact O-N 2.77Å; K817-D908 VanDerWaalsContact CE-OD2 3.27Å; K817-D908 WeakPolarHBondContact CE-OD2 3.21Å; K817-D908 IonicContact NZ-OD1 2.73Å; K817-D908 PolarHBondContact NZ-OD1 3.18Å; K817-D908 IonicContact NZ-OD2 2.65Å; K817-D908 PolarHBondContact NZ-OD2 2.82Å
818	R	43.7	Very low	41.6	Very low	171 Å²	171	112.5 Å²	112.5	65%	0.645	56%	0.561	S	S	*	*	H	α-helix	trans	-81.4	-38.4	174.3	-70.1	-179.3	-174.4	-174.2	2.9	113	S814 G815 Y816 M820 N821	S814-R818 PolarHBondContact O-N 3.36Å; S814-R818 VanDerWaalsContact O-N 3.17Å; G815-R818 WeakPolarHBondContact O-CB 3.2Å; G815-R818 PolarHBondContact O-N 3.44Å; Y816-R818 PolarHBondContact O-N 3.09Å; R818-M820 PolarHBondContact O-N 3.46Å; R818-N821 CarbonylContact O-C 3.49Å; R818-N821 PolarHBondContact O-N 2.91Å; R818-N821 VanDerWaalsContact O-O 3.07Å
819	H	44.4	Very low	39.9	Very low	150 Å²	150	118 Å²	118	69%	0.694	58%	0.582	S	S	*	*	H	α-helix	trans	-65.6	-26.1	176.3	-89.6	-116.5	0	0	0	113.2	G815 Y816 N821 E868	G815-H819 PolarHBondContact O-N 2.79Å; Y816-H819 PolarHBondContact O-N 2.85Å; H819-N821 VanDerWaalsContact C-N 3.34Å; H819-E868 IonicContact ND1-OE1 2.68Å
820	M	39.8	Very low	38.6	Very low	111 Å²	111	118.1 Å²	118.1	55%	0.547	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	-14	169.6	-67.4	-169	177.8	0	0	114.6	Y816 R818 Y942	Y816-M820 PolarHBondContact O-N 2.86Å; Y816-M820 VanDerWaalsContact O-N 3.16Å; R818-M820 PolarHBondContact O-N 3.46Å; M820-Y942 HydrophobicContact CE-CD2 3.43Å; M820-Y942 VanDerWaalsContact CE-CD2 3.43Å; M820-Y942 HydrophobicContact CE-CE2 4.1Å; M820-Y942 HydrophobicContact CE-CG 3.92Å
821	N	33	Very low	37.7	Very low	127 Å²	127	116.4 Å²	116.4	68%	0.679	59%	0.587	S	S	*	*	S	Bend	trans	-147.3	93.5	-176.5	-84	-59.9	0	0	0	112.8	R818 H819	R818-N821 CarbonylContact O-C 3.49Å; R818-N821 PolarHBondContact O-N 2.91Å; R818-N821 VanDerWaalsContact O-O 3.07Å; H819-N821 VanDerWaalsContact C-N 3.34Å
822	R	29.5	Very low	36.6	Very low	248 Å²	248	120.3 Å²	120.3	94%	0.936	60%	0.599	S	S	*	*			trans	24	101.9	160.6	-76.7	-177.7	166.1	-176.5	-4.3	117.4
823	G	29.3	Very low	35.8	Very low	45 Å²	45	122.6 Å²	122.6	46%	0.464	61%	0.613	S	S	.	*			trans	157.1	75.8	170.2	0	0	0	0	0	110.6
824	I	27.2	Very low	35.1	Very low	131 Å²	131	130.8 Å²	130.8	67%	0.672	65%	0.651	S	S	*	*				62.4	114.6	60.9	-59.6	178.8	0	0	0	111.7
825	E	28	Very low	34.4	Very low	170 Å²	170	134.9 Å²	134.9	79%	0.794	67%	0.669	S	S	*	*			trans	67.5	146.6	162	-67	159.2	-158.4	0	0	117.3
826	L	27.5	Very low	33.5	Very low	147 Å²	147	142.2 Å²	142.2	77%	0.77	69%	0.688	S	S	*	*			cis	-156.8	-176.6	-12.5	-122	167.1	0	0	0	110.8
827	Y	26.2	Very low	32.7	Very low	192 Å²	192	146.9 Å²	146.9	75%	0.753	72%	0.715	S	S	*	*			trans	-62.1	157.8	165.7	-90.1	-126	0	0	0	112.1
828	D	31.5	Very low	32	Very low	169 Å²	169	148.6 Å²	148.6	90%	0.904	73%	0.734	S	S	*	*				-164.1	167	123.9	-106.4	-27.3	0	0	0	114.1
829	Q	28.3	Very low	31.6	Very low	170 Å²	170	145.3 Å²	145.3	79%	0.794	74%	0.743	S	S	*	*			trans	-131.8	-171.3	-171.2	-110.3	-170.4	-6.8	0	0	109.3
830	P	34.3	Very low	31	Very low	101 Å²	101	148.3 Å²	148.3	66%	0.656	75%	0.754	S	S	*	*			cis	-128.8	-128.1	-39.4	37.9	-18.5	0	0	0	109.1
831	S	30	Very low	30.6	Very low	102 Å²	102	146.5 Å²	146.5	71%	0.713	76%	0.764	S	S	*	*			trans	71.8	152	168.9	76.6	0	0	0	0	116.7
832	E	29.5	Very low	30.5	Very low	178 Å²	178	147.9 Å²	147.9	83%	0.832	77%	0.772	S	S	*	*			cis	-167.2	167	-38.2	-118.2	166.4	-173.7	0	0	106.1
833	D	30.8	Very low	30.5	Very low	131 Å²	131	144.5 Å²	144.5	70%	0.701	77%	0.766	S	S	*	*			trans	27.9	119.8	157.9	-75.1	10.7	0	0	0	121.2
834	H	36.1	Very low	30.5	Very low	190 Å²	190	151.3 Å²	151.3	88%	0.88	78%	0.783	S	S	*	*				-167.4	162.3	92.2	-93.6	-40.5	0	0	0	113.8
835	N	30.7	Very low	30.6	Very low	135 Å²	135	155.6 Å²	155.6	72%	0.722	79%	0.791	S	S	*	*			trans	-115.7	176.1	-169	-165.8	-3.4	0	0	0	111.1
836	Y	28.7	Very low	30.6	Very low	186 Å²	186	151 Å²	151	73%	0.729	78%	0.778	S	S	*	*			trans	99.2	132.3	156.3	-80.2	-64.8	0	0	0	123
837	N	34.4	Very low	30.9	Very low	130 Å²	130	150.6 Å²	150.6	70%	0.695	78%	0.776	S	S	*	*			trans	65.7	106.6	147.7	-61	-34.3	0	0	0	118.4
838	V	29.7	Very low	31	Very low	137 Å²	137	149.8 Å²	149.8	83%	0.83	78%	0.779	S	S	*	*				70.4	96.6	55.6	-174.5	0	0	0	0	114
839	A	35.2	Very low	30.9	Very low	102 Å²	102	148 Å²	148	84%	0.843	77%	0.766	S	S	*	*			trans	-148.2	135.3	155.2	0	0	0	0	0	109.8
840	K	31.9	Very low	30.8	Very low	212 Å²	212	150.2 Å²	150.2	92%	0.922	77%	0.768	S	S	*	*			trans	-73.5	145.3	-166.2	-64	171.4	175.8	177	0	113.8
841	G	31.2	Very low	30.5	Very low	74 Å²	74	153 Å²	153	76%	0.763	77%	0.773	S	S	*	*			trans	-170.2	48.1	178.6	0	0	0	0	0	118.6
842	N	30.9	Very low	30.3	Very low	156 Å²	156	153.2 Å²	153.2	83%	0.834	77%	0.774	S	S	*	*			trans	39.1	104	160.7	-61.3	-9.5	0	0	0	120.4
843	Q	29.9	Very low	30.3	Very low	176 Å²	176	153 Å²	153	82%	0.822	77%	0.773	S	S	*	*				167.6	135.1	116	-92.1	-179.8	19	0	0	114.6
844	K	28.5	Very low	30.3	Very low	189 Å²	189	151.7 Å²	151.7	82%	0.822	77%	0.774	S	S	*	*			trans	58.2	136.2	153.3	-67.1	-176.5	173.5	-175.8	0	122.1
845	R	29.7	Very low	29.8	Very low	220 Å²	220	147 Å²	147	83%	0.83	76%	0.763	S	S	*	*			trans	59.6	153.1	164.6	-86.5	-168.4	161.7	172.7	-9	116.9
846	S	28.8	Very low	30.1	Very low	74 Å²	74	145.6 Å²	145.6	52%	0.517	76%	0.761	S	S	.	*			cis	-164	171.9	-36.8	42.8	0	0	0	0	109.7
847	D	31.9	Very low	30.1	Very low	138 Å²	138	143.9 Å²	143.9	74%	0.738	76%	0.764	S	S	*	*			trans	81.8	135.4	154.2	-44.5	-45.6	0	0	0	122.1
848	Q	29.2	Very low	29.9	Very low	175 Å²	175	143.7 Å²	143.7	82%	0.818	77%	0.767	S	S	*	*			trans	61.4	161.3	154.9	-69.4	177.3	-32.6	0	0	121.3
849	E	28.9	Very low	29.8	Very low	132 Å²	132	143.4 Å²	143.4	62%	0.617	76%	0.761	S	S	*	*			cis	-173.6	149.8	-33	178.2	170	177.4	0	0	108.9
850	Y	27.3	Very low	29.6	Very low	216 Å²	216	145.5 Å²	145.5	85%	0.847	76%	0.764	S	S	*	*			trans	-171	154.7	161.4	-95	-60.4	0	0	0	108.4
851	Q	26.6	Very low	29.3	Very low	161 Å²	161	143 Å²	143	75%	0.752	76%	0.76	S	S	*	*			cis	-161.4	154.8	26.5	-148.8	167.5	25.2	0	0	114.5
852	S	27.2	Very low	29.3	Very low	106 Å²	106	146.3 Å²	146.3	74%	0.741	77%	0.766	S	S	*	*			trans	62.3	137.3	153.8	51.3	0	0	0	0	120.5
853	E	27.9	Very low	29	Very low	173 Å²	173	147.9 Å²	147.9	81%	0.808	77%	0.768	S	S	*	*			cis	-134.3	-170.7	-7.7	-77.9	-143.4	64.9	0	0	108.3
854	S	31	Very low	28.9	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	76%	0.763	S	S	*	*			cis	-148.4	157.4	10	44	0	0	0	0	108.6
855	S	27.4	Very low	29	Very low	91 Å²	91	141.3 Å²	141.3	64%	0.636	76%	0.761	S	S	*	*			cis	75.7	127.3	46.2	-65.7	0	0	0	0	115.6
856	P	36	Very low	28.9	Very low	105 Å²	105	135.7 Å²	135.7	68%	0.682	76%	0.761	S	S	*	*			cis	-148.8	166.1	-16.6	42.7	-24.2	0	0	0	118.5
857	L	28.7	Very low	29.5	Very low	151 Å²	151	137 Å²	137	79%	0.791	77%	0.768	S	S	*	*			trans	68.1	156.5	153.3	-66.2	156.9	0	0	0	118.9
858	T	29.6	Very low	30.3	Very low	125 Å²	125	134.9 Å²	134.9	77%	0.767	75%	0.754	S	S	*	*			cis	-145.4	164.7	12.6	-12.4	0	0	0	0	112.5
859	D	28.2	Very low	31.5	Very low	131 Å²	131	128.6 Å²	128.6	70%	0.701	73%	0.728	S	S	*	*			trans	-70.6	159.8	-175.2	-42.2	-97.6	0	0	0	117.2
860	T	30.8	Very low	33.2	Very low	147 Å²	147	122.6 Å²	122.6	90%	0.902	70%	0.7	S	S	*	*				-179.2	148.8	102.5	27	0	0	0	0	114.2
861	N	25.7	Very low	35.3	Very low	159 Å²	159	113.1 Å²	113.1	85%	0.85	67%	0.665	S	S	*	*			trans	-97	141.7	176	-86.1	-59.6	0	0	0	112.6
862	T	30.5	Very low	37.4	Very low	144 Å²	144	109.3 Å²	109.3	88%	0.883	64%	0.643	S	S	*	*			trans	-144.2	121.6	152.6	42	0	0	0	0	111.3
863	Q	26	Very low	39.7	Very low	188 Å²	188	104.2 Å²	104.2	88%	0.879	61%	0.608	S	S	*	*			trans	-83.6	142.7	172	-64.7	172.4	-21.3	0	0	110.9
864	S	27	Very low	41.7	Very low	102 Å²	102	96.1 Å²	96.1	71%	0.713	57%	0.57	S	S	*	*			trans	-154.9	120.6	153.9	-164.4	0	0	0	0	112.5
865	T	31.3	Very low	43.9	Very low	126 Å²	126	92.1 Å²	92.1	77%	0.773	54%	0.541	S	S	*	.			trans	41.8	95.9	146.8	57.5	0	0	0	0	118.3
866	A	27.8	Very low	46.2	Very low	102 Å²	102	94.3 Å²	94.3	84%	0.843	54%	0.537	S	S	*	.			trans	-69.7	136.6	168.5	0	0	0	0	0	112.4
867	P	40.9	Very low	47.9	Very low	101 Å²	101	89.3 Å²	89.3	66%	0.656	50%	0.504	S	S	*	.			trans	-80.8	142.8	164.6	32.9	-32.1	0	0	0	110.8	P869	P867-P869 VanDerWaalsContact O-CD 3.3Å; P867-P869 WeakPolarHBondContact O-CD 3.48Å
868	E	48.9	Very low	50.2	Low	94 Å²	94	88.6 Å²	88.6	44%	0.439	50%	0.495	S	S	.	.			trans	-61.6	115.9	174.9	-68.5	179.3	144.6	0	0	110.4	H819 V870	H819-E868 IonicContact ND1-OE1 2.68Å; E868-V870 HydrophobicContact CB-CG2 4.34Å; E868-V870 PolarHBondContact O-N 2.98Å
869	P	54.1	Low	52.6	Low	42 Å²	42	84.8 Å²	84.8	27%	0.273	47%	0.472	S	S	.	.			trans	-89.6	81.8	-167	36.9	-36.2	0	0	0	110.7	P867 P965 Y986	P867-P869 VanDerWaalsContact O-CD 3.3Å; P867-P869 WeakPolarHBondContact O-CD 3.48Å; P869-P965 WeakPolarHBondContact O-CG 3.36Å; P869-Y986 WeakPolarHBondContact CB-OH 3.35Å
870	V	63.9	Low	55.2	Low	7 Å²	7	83.4 Å²	83.4	4%	0.042	47%	0.465	C	S	.	.			trans	-118.8	132.5	-174.2	-175.4	0	0	0	0	109.9	E868 R872 Y942 P965 L967	E868-V870 HydrophobicContact CB-CG2 4.34Å; E868-V870 PolarHBondContact O-N 2.98Å; V870-R872 PolarHBondContact O-N 3.47Å; V870-Y942 HydrophobicContact CG1-CD1 4.28Å; V870-Y942 HydrophobicContact CG1-CE1 3.76Å; V870-Y942 HydrophobicContact CG2-CE1 3.96Å; V870-P965 HydrophobicContact CG1-CB 4.28Å; V870-P965 HydrophobicContact CG2-CB 4.37Å; V870-P965 HydrophobicContact CG2-CG 4.37Å; V870-L967 HydrophobicContact CG1-CB 3.52Å
871	V	71	Confident	57.3	Low	17 Å²	17	78.5 Å²	78.5	10%	0.103	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	111.7	174.9	175.8	0	0	0	0	109	L873 I883 L964 P965 L966 L967	V871-L873 HydrophobicContact CG1-CD2 4.34Å; V871-I883 HydrophobicContact CG1-CG2 3.45Å; V871-I883 VanDerWaalsContact CG1-CG2 3.45Å; V871-L964 HydrophobicContact CG2-CD1 3.84Å; V871-P965 PolarHBondContact N-O 3.43Å; V871-L966 HydrophobicContact CB-CB 4.41Å; V871-L966 HydrophobicContact CB-CG 4.37Å; V871-L966 HydrophobicContact CG1-CD1 4.19Å; V871-L966 HydrophobicContact CG1-CG 4.35Å; V871-L966 CarbonylContact O-C 3.33Å; V871-L966 VanDerWaalsContact O-CA 3.31Å; V871-L966 WeakPolarHBondContact O-CA 3.48Å; V871-L967 PolarHBondContact O-N 2.85Å
872	R	71	Confident	60	Low	80 Å²	80	74.1 Å²	74.1	30%	0.302	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	110.6	-176.8	-68.6	179.4	-177.3	-96	-6.5	111.4	V870 L967 E969 L982 S983	V870-R872 PolarHBondContact O-N 3.47Å; R872-L967 CarbonylContact C-O 3.6Å; R872-L967 WeakPolarHBondContact CA-O 3.34Å; R872-E969 IonicContact CZ-OE2 2.73Å; R872-E969 IonicContact NH1-OE1 3.44Å; R872-E969 IonicContact NH1-OE2 2.94Å; R872-E969 PolarHBondContact NH1-OE2 2.68Å; R872-L982 HydrophobicContact CB-CB 3.83Å; R872-L982 CarbonylContact O-C 3.58Å; R872-L982 WeakPolarHBondContact O-CB 3.35Å; R872-L982 PolarHBondContact O-N 2.68Å; R872-S983 PolarHBondContact O-N 3.44Å
873	L	76.4	Confident	62.2	Low	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	149.5	168.7	-62.7	-161	0	0	0	111.8	V871 E877 I883 L919 L931 M935 L966 L967 V968 E969	V871-L873 HydrophobicContact CG1-CD2 4.34Å; L873-E877 WeakPolarHBondContact CA-OE1 3.46Å; L873-I883 HydrophobicContact CD1-CD1 4.06Å; L873-I883 HydrophobicContact CD2-CB 4.25Å; L873-I883 HydrophobicContact CD2-CD1 4.08Å; L873-I883 HydrophobicContact CD2-CG1 3.84Å; L873-I883 HydrophobicContact CD2-CG2 3.52Å; L873-L919 HydrophobicContact CD1-CD2 4.02Å; L873-L931 HydrophobicContact CD1-CD1 3.83Å; L873-M935 HydrophobicContact CB-CE 4.07Å; L873-M935 HydrophobicContact CB-SD 4.12Å; L873-M935 HydrophobicContact CD1-CE 3.73Å; L873-M935 HydrophobicContact CD1-SD 3.72Å; L873-L966 HydrophobicContact CD1-CD1 4Å; L873-L966 HydrophobicContact CD1-CD2 3.77Å; L873-L966 HydrophobicContact CD1-CG 4.25Å; L873-L966 HydrophobicContact CD2-CD1 4.45Å; L873-L966 HydrophobicContact CG-CD1 4.02Å; L873-L966 HydrophobicContact CG-CD2 3.82Å; L873-L966 HydrophobicContact CG-CG 3.97Å; L873-L967 PolarHBondContact N-O 2.78Å; L873-V968 HydrophobicContact CB-CG2 4.18Å; L873-V968 HydrophobicContact CD1-CG2 4.39Å; L873-E969 PolarHBondContact O-N 3.15Å
874	S	69.7	Low	64.8	Low	2 Å²	2	60.2 Å²	60.2	1%	0.014	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	136.7	165	-179.6	0	0	0	0	109.6	Y876 E877 M935 K971	S874-Y876 PolarHBondContact O-N 3.26Å; S874-Y876 WeakPolarHBondContact OG-CD2 3.36Å; S874-Y876 PolarHBondContact OG-N 3.37Å; S874-E877 PolarHBondContact N-OE1 2.62Å; S874-E877 WeakPolarHBondContact O-CB 3.35Å; S874-E877 WeakPolarHBondContact O-CG 3.43Å; S874-E877 PolarHBondContact O-N 3.42Å; S874-M935 WeakPolarHBondContact O-CE 3.48Å; S874-K971 PolarHBondContact OG-O 3.41Å
875	V	78	Confident	67.5	Low	20 Å²	20	60 Å²	60	12%	0.121	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.5	172.9	-65.3	0	0	0	0	113.8	E877 M935 L940 V968 E969 D970	V875-E877 VanDerWaalsContact C-N 3.3Å; V875-E877 PolarHBondContact O-N 3.24Å; V875-M935 HydrophobicContact CB-CB 4.23Å; V875-M935 HydrophobicContact CG1-CB 4.28Å; V875-L940 HydrophobicContact CG1-CD2 3.46Å; V875-L940 VanDerWaalsContact CG1-CD2 3.46Å; V875-L940 HydrophobicContact CG1-CG 4.05Å; V875-V968 HydrophobicContact CG1-CG1 3.5Å; V875-V968 VanDerWaalsContact CG1-CG1 3.5Å; V875-E969 PolarHBondContact N-O 2.95Å; V875-D970 WeakPolarHBondContact CG2-OD1 3.45Å
876	Y	74.1	Confident	70.1	Confident	138 Å²	138	54 Å²	54	54%	0.541	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	5.4	179	-61.3	-86.5	0	0	0	114.3	S874 P972	S874-Y876 PolarHBondContact O-N 3.26Å; S874-Y876 WeakPolarHBondContact OG-CD2 3.36Å; S874-Y876 PolarHBondContact OG-N 3.37Å; Y876-P972 HydrophobicContact CD2-CB 3.96Å; Y876-P972 HydrophobicContact CE2-CB 3.71Å; Y876-P972 HydrophobicContact CE2-CG 4.18Å; Y876-P972 HydrophobicContact CG-CB 4.48Å
877	E	73	Confident	73	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.267	C	S	.	.			trans	-72.2	164.8	175.2	-76.7	174.7	-120.7	0	0	114.3	L873 S874 V875 L931 H934 M935 S981	L873-E877 WeakPolarHBondContact CA-OE1 3.46Å; S874-E877 PolarHBondContact N-OE1 2.62Å; S874-E877 WeakPolarHBondContact O-CB 3.35Å; S874-E877 WeakPolarHBondContact O-CG 3.43Å; S874-E877 PolarHBondContact O-N 3.42Å; V875-E877 VanDerWaalsContact C-N 3.3Å; V875-E877 PolarHBondContact O-N 3.24Å; E877-L931 HydrophobicContact CB-CD2 4.05Å; E877-H934 PolarHBondContact O-ND1 3.37Å; E877-H934 VanDerWaalsContact O-ND1 3.13Å; E877-M935 HydrophobicContact CB-CE 3.76Å; E877-S981 VanDerWaalsContact CD-CA 3.44Å; E877-S981 WeakPolarHBondContact OE1-CA 3.42Å; E877-S981 WeakPolarHBondContact OE1-CB 3.27Å; E877-S981 WeakPolarHBondContact OE2-CB 3.48Å
878	K	75.8	Confident	75.2	Confident	135 Å²	135	49.3 Å²	49.3	59%	0.587	24%	0.237	S	C	*	.			trans	-107.8	143.7	-174.5	-65.3	179.5	-178	174	0	111.6	Q881 L931	K878-Q881 VanDerWaalsContact O-CB 3.28Å; K878-Q881 WeakPolarHBondContact O-CB 3Å; K878-Q881 PolarHBondContact O-N 2.89Å; K878-L931 WeakPolarHBondContact O-CD2 3.49Å
879	P	80.9	Confident	77.1	Confident	45 Å²	45	49.5 Å²	49.5	29%	0.292	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	152.9	166.9	-19.5	26.8	0	0	0	112.2	Q881 H934	P879-Q881 PolarHBondContact O-N 2.75Å; P879-Q881 VanDerWaalsContact O-N 3.09Å; P879-H934 VanDerWaalsContact CD-CE1 3.44Å; P879-H934 WeakPolarHBondContact CD-CE1 3.19Å; P879-H934 WeakPolarHBondContact CD-NE2 3.49Å
880	D	81.6	Confident	78.7	Confident	102 Å²	102	48.4 Å²	48.4	55%	0.545	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	12.1	-178.7	-62.4	-68.1	0	0	0	115.2	R921 L931	D880-R921 IonicContact OD1-CZ 2.74Å; D880-R921 VanDerWaalsContact OD1-CZ 3.3Å; D880-R921 IonicContact OD1-NH1 2.83Å; D880-R921 PolarHBondContact OD1-NH1 2.86Å; D880-R921 IonicContact OD1-NH2 3.21Å; D880-R921 PolarHBondContact OD1-NH2 3.01Å; D880-L931 WeakPolarHBondContact CA-O 2.79Å; D880-L931 PolarHBondContact N-O 2.88Å
881	Q	77	Confident	79.9	Confident	45 Å²	45	51.6 Å²	51.6	21%	0.21	25%	0.251	C	S	.	.			trans	-76.5	136.3	167.7	-178.1	172.2	-18.3	0	0	110.9	K878 P879 I930 L931 S980	K878-Q881 VanDerWaalsContact O-CB 3.28Å; K878-Q881 WeakPolarHBondContact O-CB 3Å; K878-Q881 PolarHBondContact O-N 2.89Å; P879-Q881 PolarHBondContact O-N 2.75Å; P879-Q881 VanDerWaalsContact O-N 3.09Å; Q881-I930 WeakPolarHBondContact O-CA 3.22Å; Q881-L931 PolarHBondContact O-N 3.35Å; Q881-S980 PolarHBondContact NE2-O 3.14Å; Q881-S980 PolarHBondContact OE1-OG 2.8Å
882	V	81	Confident	80.8	Confident	67 Å²	67	51.1 Å²	51.1	41%	0.406	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	125.1	167.6	-178.2	0	0	0	0	109.3	S884 E928 L929 I930	V882-S884 WeakPolarHBondContact CG1-O 3.44Å; V882-E928 HydrophobicContact CG1-CB 4.3Å; V882-L929 CarbonylContact C-O 3.59Å; V882-L929 WeakPolarHBondContact CA-O 3.47Å; V882-I930 HydrophobicContact CG2-CG1 4.21Å
883	I	77.7	Confident	81.5	Confident	9 Å²	9	48.9 Å²	48.9	5%	0.046	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-45	-177.6	-70.2	165	0	0	0	111.1	V871 L873 I920 L929 L931 S983	V871-I883 HydrophobicContact CG1-CG2 3.45Å; V871-I883 VanDerWaalsContact CG1-CG2 3.45Å; L873-I883 HydrophobicContact CD1-CD1 4.06Å; L873-I883 HydrophobicContact CD2-CB 4.25Å; L873-I883 HydrophobicContact CD2-CD1 4.08Å; L873-I883 HydrophobicContact CD2-CG1 3.84Å; L873-I883 HydrophobicContact CD2-CG2 3.52Å; I883-I920 HydrophobicContact CD1-CB 4.09Å; I883-I920 HydrophobicContact CD1-CG2 3.37Å; I883-L929 PolarHBondContact N-O 3.41Å; I883-L931 HydrophobicContact CD1-CB 3.91Å; I883-L931 HydrophobicContact CD1-CD1 3.96Å; I883-L931 HydrophobicContact CG1-CB 4.3Å; I883-S983 PolarHBondContact O-OG 3.17Å
884	S	79.5	Confident	81.8	Confident	31 Å²	31	52.1 Å²	52.1	22%	0.217	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.4	177.6	-173.1	-173.1	0	0	0	0	108.5	V882 L929	V882-S884 WeakPolarHBondContact CG1-O 3.44Å; S884-L929 WeakPolarHBondContact O-CB 3.42Å; S884-L929 PolarHBondContact O-N 3.07Å
885	K	84.1	Confident	82.4	Confident	97 Å²	97	57 Å²	57	42%	0.422	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	128.3	-179.4	-170.9	-177	-179	-170	0	109.6	T926 E928	K885-T926 WeakPolarHBondContact CE-O 3.35Å; K885-T926 WeakPolarHBondContact CG-O 3.46Å; K885-E928 HydrophobicContact CD-CG 4.28Å; K885-E928 HydrophobicContact CG-CG 4.03Å
886	L	86.5	Confident	82.7	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.305	C	S	.	.			trans	-74.6	140.5	166.7	-57.1	-178.2	0	0	0	109.6	F799 S801 L805 Y901 V922 G927 L929 V947	F799-L886 HydrophobicContact CE1-CB 4.13Å; F799-L886 HydrophobicContact CE1-CD1 4.23Å; F799-L886 HydrophobicContact CZ-CD1 4.47Å; S801-L886 CarbonylContact O-C 3.56Å; S801-L886 WeakPolarHBondContact O-CA 3.29Å; L805-L886 HydrophobicContact CD1-CD2 4.35Å; L805-L886 HydrophobicContact CD2-CD2 4.45Å; L886-Y901 HydrophobicContact CB-CD1 3.85Å; L886-Y901 HydrophobicContact CB-CE1 4.01Å; L886-Y901 HydrophobicContact CD1-CD1 4.24Å; L886-V922 HydrophobicContact CD1-CG2 3.99Å; L886-G927 PolarHBondContact N-O 3.23Å; L886-L929 HydrophobicContact CD1-CD2 4.46Å; L886-L929 HydrophobicContact CD2-CD1 3.92Å; L886-L929 HydrophobicContact CG-CD1 4.12Å; L886-L929 HydrophobicContact CG-CD2 4.33Å; L886-L929 HydrophobicContact CG-CG 4.24Å; L886-V947 HydrophobicContact CD1-CB 3.84Å; L886-V947 HydrophobicContact CD1-CG1 3.63Å; L886-V947 HydrophobicContact CD2-CG1 4.14Å
887	Y	87.9	Confident	83.2	Confident	100 Å²	100	51.3 Å²	51.3	39%	0.392	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	129.9	173.9	-172.2	-116.8	0	0	0	110	L800 S801 E889	L800-Y887 HydrophobicContact CB-CD1 3.98Å; L800-Y887 HydrophobicContact CD1-CD1 4.16Å; L800-Y887 HydrophobicContact CD1-CE1 3.87Å; L800-Y887 PolarHBondContact N-O 2.96Å; S801-Y887 PolarHBondContact N-O 2.65Å; S801-Y887 PolarHBondContact O-N 2.8Å; Y887-E889 HydrophobicContact CE1-CG 3.84Å; Y887-E889 WeakPolarHBondContact CE1-OE1 3.44Å; Y887-E889 WeakPolarHBondContact OH-CG 3.31Å; Y887-E889 PolarHBondContact OH-OE1 3.23Å
888	A	87.6	Confident	83.9	Confident	4 Å²	4	52.4 Å²	52.4	3%	0.033	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	146.8	173.2	0	0	0	0	0	109.1	Q798 F799 V899 Y901 A949	Q798-A888 WeakPolarHBondContact O-CA 3.46Å; Q798-A888 VanDerWaalsContact O-CB 3.27Å; Q798-A888 WeakPolarHBondContact O-CB 3.22Å; F799-A888 HydrophobicContact CD1-CB 3.87Å; F799-A888 HydrophobicContact CE1-CB 4.38Å; F799-A888 HydrophobicContact CG-CB 4.34Å; A888-V899 HydrophobicContact CB-CG1 3.95Å; A888-Y901 HydrophobicContact CB-CE1 3.98Å; A888-Y901 PolarHBondContact N-OH 3.02Å; A888-Y901 PolarHBondContact O-OH 3.23Å; A888-A949 HydrophobicContact CB-CB 3.92Å
889	E	87.7	Confident	84.4	Confident	99 Å²	99	47.1 Å²	47.1	46%	0.463	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	153.6	174.9	-73.4	171.9	-173.6	0	0	108.8	P797 Q798 L800 Y887	P797-E889 CarbonylContact C-O 3.51Å; P797-E889 WeakPolarHBondContact CA-O 3.23Å; Q798-E889 PolarHBondContact N-O 2.94Å; Q798-E889 PolarHBondContact O-N 3.23Å; Q798-E889 VanDerWaalsContact O-N 3.16Å; L800-E889 HydrophobicContact CD1-CB 3.99Å; L800-E889 HydrophobicContact CD1-CG 3.68Å; L800-E889 VanDerWaalsContact CD1-OE2 3.31Å; L800-E889 WeakPolarHBondContact CD1-OE2 3.43Å; Y887-E889 HydrophobicContact CE1-CG 3.84Å; Y887-E889 WeakPolarHBondContact CE1-OE1 3.44Å; Y887-E889 WeakPolarHBondContact OH-CG 3.31Å; Y887-E889 PolarHBondContact OH-OE1 3.23Å
890	D	88.9	Confident	84.8	Confident	18 Å²	18	48 Å²	48	10%	0.096	28%	0.276	C	S	.	.			trans	-133.9	128.5	174.8	-161.8	-32.4	0	0	0	107.5	P797 D892 V899	P797-D890 HydrophobicContact CB-CB 4.36Å; P797-D890 WeakPolarHBondContact CD-OD2 3.31Å; P797-D890 HydrophobicContact CG-CB 4.38Å; P797-D890 WeakPolarHBondContact CG-OD2 3.4Å; D890-D892 VanDerWaalsContact C-N 3.34Å; D890-D892 PolarHBondContact O-N 3.38Å; D890-V899 HydrophobicContact CB-CG2 3.78Å
891	P	89.2	Confident	85.1	Confident	74 Å²	74	43.7 Å²	43.7	48%	0.481	25%	0.252	S	S	.	.	S	Bend	trans	-61.5	-30.7	-176.4	-27.5	35.8	0	0	0	116.4	E759 N795	E759-P891 HydrophobicContact CG-CB 3.62Å; N795-P891 HydrophobicContact CB-CB 4.18Å; N795-P891 HydrophobicContact CB-CG 3.93Å
892	D	89.8	Confident	85.6	Confident	8 Å²	8	45 Å²	45	4%	0.043	26%	0.26	C	S	.	.	S	Bend	trans	-64.2	165.6	-172.8	-57	-9.7	0	0	0	112.2	N793 D794 N795 D890 N896 G897	N793-D892 WeakPolarHBondContact CA-OD2 3.31Å; D794-D892 PolarHBondContact N-OD2 3.37Å; D794-D892 VanDerWaalsContact N-OD2 3.13Å; N795-D892 VanDerWaalsContact CB-OD1 3.23Å; N795-D892 WeakPolarHBondContact CB-OD1 3.09Å; N795-D892 PolarHBondContact N-OD1 3.13Å; N795-D892 PolarHBondContact N-OD2 3.13Å; N795-D892 PolarHBondContact ND2-OD1 2.76Å; D890-D892 VanDerWaalsContact C-N 3.34Å; D890-D892 PolarHBondContact O-N 3.38Å; D892-N896 HydrophobicContact CB-CB 3.47Å; D892-N896 VanDerWaalsContact CB-CB 3.47Å; D892-G897 WeakPolarHBondContact O-CA 3.27Å; D892-G897 PolarHBondContact O-N 2.93Å
893	A	84.6	Confident	85.6	Confident	32 Å²	32	43.7 Å²	43.7	26%	0.264	25%	0.251	S	S	.	.			trans	-97.8	162.5	-178	0	0	0	0	0	115.5	R758 D791 D895 N896 G897	R758-A893 VanDerWaalsContact NH1-CB 3.33Å; R758-A893 VanDerWaalsContact NH2-CB 3.26Å; D791-A893 WeakPolarHBondContact OD1-CB 3.27Å; D791-A893 PolarHBondContact OD1-N 2.9Å; A893-D895 PolarHBondContact O-N 3.15Å; A893-N896 WeakPolarHBondContact O-CA 3.49Å; A893-N896 VanDerWaalsContact O-CB 3.31Å; A893-N896 WeakPolarHBondContact O-CB 3.28Å; A893-N896 PolarHBondContact O-N 3.03Å; A893-G897 PolarHBondContact O-N 3.27Å
894	G	82.4	Confident	85.5	Confident	68 Å²	68	47.8 Å²	47.8	70%	0.701	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	-123	169.8	0	0	0	0	0	112.8	A898	G894-A898 WeakPolarHBondContact O-CB 3.14Å
895	D	82.6	Confident	84.9	Confident	105 Å²	105	49.4 Å²	49.4	56%	0.561	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-18.6	174	-85.5	-54.3	0	0	0	113	A893 A898 R952 G953	A893-D895 PolarHBondContact O-N 3.15Å; D895-A898 WeakPolarHBondContact O-CB 3.5Å; D895-A898 PolarHBondContact O-N 3.43Å; D895-R952 HydrophobicContact CB-CB 4.25Å; D895-R952 CarbonylContact O-C 3.52Å; D895-R952 WeakPolarHBondContact O-CB 3.48Å; D895-R952 PolarHBondContact O-N 2.61Å; D895-G953 PolarHBondContact O-N 2.73Å
896	N	85.2	Confident	83.8	Confident	19 Å²	19	47.5 Å²	47.5	10%	0.102	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-51.6	176	-61.3	-16	0	0	0	109.1	D791 N793 D892 A893 A898 D951 G953	D791-N896 PolarHBondContact OD2-ND2 3.35Å; N793-N896 HydrophobicContact CB-CB 4.03Å; N793-N896 VanDerWaalsContact OD1-CA 3.27Å; N793-N896 WeakPolarHBondContact OD1-CA 2.98Å; N793-N896 VanDerWaalsContact OD1-CB 3.27Å; N793-N896 WeakPolarHBondContact OD1-CB 3.22Å; N793-N896 PolarHBondContact OD1-OD1 2.72Å; D892-N896 HydrophobicContact CB-CB 3.47Å; D892-N896 VanDerWaalsContact CB-CB 3.47Å; A893-N896 WeakPolarHBondContact O-CA 3.49Å; A893-N896 VanDerWaalsContact O-CB 3.31Å; A893-N896 WeakPolarHBondContact O-CB 3.28Å; A893-N896 PolarHBondContact O-N 3.03Å; N896-A898 PolarHBondContact O-N 3.3Å; N896-D951 WeakPolarHBondContact O-CB 3.14Å; N896-G953 WeakPolarHBondContact OD1-CA 3.22Å
897	G	84.7	Confident	82.3	Confident	19 Å²	19	53.6 Å²	53.6	20%	0.196	29%	0.29	C	S	.	.	S	Bend	trans	-68.5	1.3	172.7	0	0	0	0	0	116.9	D892 A893 V899	D892-G897 WeakPolarHBondContact O-CA 3.27Å; D892-G897 PolarHBondContact O-N 2.93Å; A893-G897 PolarHBondContact O-N 3.27Å; G897-V899 PolarHBondContact O-N 2.79Å
898	A	86.8	Confident	80.6	Confident	23 Å²	23	52.7 Å²	52.7	19%	0.19	29%	0.291	C	S	.	.			trans	-85	78.5	-166	0	0	0	0	0	114.2	G894 D895 N896 R952	G894-A898 WeakPolarHBondContact O-CB 3.14Å; D895-A898 WeakPolarHBondContact O-CB 3.5Å; D895-A898 PolarHBondContact O-N 3.43Å; N896-A898 PolarHBondContact O-N 3.3Å; A898-R952 HydrophobicContact CB-CB 4.22Å; A898-R952 HydrophobicContact CB-CG 3.99Å; A898-R952 WeakPolarHBondContact O-CG 3.13Å
899	V	86.9	Confident	78.7	Confident	24 Å²	24	60 Å²	60	15%	0.145	33%	0.329	C	S	.	.			trans	-57.7	139.4	-176.2	-173.8	0	0	0	0	115	P797 A888 D890 G897 Y901 A949 S950	P797-V899 HydrophobicContact CB-CG1 4.2Å; P797-V899 HydrophobicContact CB-CG2 4.08Å; A888-V899 HydrophobicContact CB-CG1 3.95Å; D890-V899 HydrophobicContact CB-CG2 3.78Å; G897-V899 PolarHBondContact O-N 2.79Å; V899-Y901 HydrophobicContact CG1-CE1 4.06Å; V899-Y901 HydrophobicContact CG1-CE2 4.18Å; V899-A949 HydrophobicContact CG1-CB 4.18Å; V899-S950 CarbonylContact C-O 3.48Å; V899-S950 WeakPolarHBondContact CA-O 3.29Å
900	F	88.5	Confident	76.7	Confident	64 Å²	64	60.4 Å²	60.4	28%	0.281	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	138.6	-178.8	-176.3	-88.8	0	0	0	111.3	L902 P924 E925 A949 S950	F900-L902 HydrophobicContact CD1-CG 4.47Å; F900-L902 HydrophobicContact CE1-CD2 3.97Å; F900-L902 HydrophobicContact CE1-CG 4.27Å; F900-P924 HydrophobicContact CD1-CB 4.44Å; F900-P924 HydrophobicContact CD2-CB 4.09Å; F900-P924 HydrophobicContact CE1-CB 3.86Å; F900-P924 HydrophobicContact CE2-CB 3.47Å; F900-P924 VanDerWaalsContact CE2-CB 3.47Å; F900-P924 HydrophobicContact CZ-CB 3.34Å; F900-P924 HydrophobicContact CZ-CG 4.24Å; F900-E925 HydrophobicContact CD2-CG 4.29Å; F900-E925 HydrophobicContact CE2-CG 4.36Å; F900-A949 CarbonylContact O-C 3.58Å; F900-A949 WeakPolarHBondContact O-CA 3.46Å; F900-S950 PolarHBondContact N-O 3.46Å; F900-S950 PolarHBondContact O-N 2.86Å
901	Y	89.3	Confident	74.4	Confident	11 Å²	11	66.4 Å²	66.4	4%	0.043	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	143	-168.7	-55.6	-85.2	0	0	0	113.8	F799 L886 A888 V899 P924 T948	F799-Y901 AromaticContact CE1-CD1 3.88Å; F799-Y901 HydrophobicContact CE1-CD1 3.88Å; F799-Y901 AromaticContact CE1-CE1 3.93Å; F799-Y901 HydrophobicContact CE1-CE1 3.93Å; F799-Y901 HydrophobicContact CZ-CD1 4.46Å; L886-Y901 HydrophobicContact CB-CD1 3.85Å; L886-Y901 HydrophobicContact CB-CE1 4.01Å; L886-Y901 HydrophobicContact CD1-CD1 4.24Å; A888-Y901 HydrophobicContact CB-CE1 3.98Å; A888-Y901 PolarHBondContact N-OH 3.02Å; A888-Y901 PolarHBondContact O-OH 3.23Å; V899-Y901 HydrophobicContact CG1-CE1 4.06Å; V899-Y901 HydrophobicContact CG1-CE2 4.18Å; Y901-P924 WeakPolarHBondContact CD2-O 3.36Å; Y901-P924 PolarHBondContact N-O 2.58Å; Y901-P924 WeakPolarHBondContact O-CA 3.45Å; Y901-P924 WeakPolarHBondContact O-CB 3.27Å; Y901-T948 WeakPolarHBondContact CA-O 3.49Å
902	L	85.7	Confident	72.1	Confident	73 Å²	73	69 Å²	69	38%	0.382	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148.9	176	-67.9	168.5	0	0	0	111.3	F900 V947 T948	F900-L902 HydrophobicContact CD1-CG 4.47Å; F900-L902 HydrophobicContact CE1-CD2 3.97Å; F900-L902 HydrophobicContact CE1-CG 4.27Å; L902-V947 CarbonylContact O-C 3.56Å; L902-V947 WeakPolarHBondContact O-CA 3.46Å; L902-T948 PolarHBondContact N-O 3.33Å; L902-T948 PolarHBondContact O-N 3.47Å
903	L	83	Confident	69.6	Low	39 Å²	39	77.3 Å²	77.3	20%	0.204	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	127.7	-179.9	-174.8	84.7	0	0	0	110.6	I920 V922 L929 F945 K946 V947	L903-I920 HydrophobicContact CD2-CD1 4.37Å; L903-I920 HydrophobicContact CD2-CG1 3.74Å; L903-V922 HydrophobicContact CB-CB 3.77Å; L903-V922 HydrophobicContact CB-CG1 3.45Å; L903-V922 VanDerWaalsContact CB-CG1 3.45Å; L903-V922 HydrophobicContact CD2-CB 4.28Å; L903-L929 HydrophobicContact CD1-CD2 4.03Å; L903-L929 HydrophobicContact CD2-CD2 4.48Å; L903-F945 HydrophobicContact CD1-CB 3.57Å; L903-F945 HydrophobicContact CD1-CD1 4.48Å; L903-F945 HydrophobicContact CD1-CG 4.32Å; L903-F945 HydrophobicContact CD2-CD1 4.33Å; L903-F945 HydrophobicContact CG-CB 4.33Å; L903-K946 CarbonylContact C-O 3.55Å; L903-K946 WeakPolarHBondContact CA-O 3.4Å; L903-V947 HydrophobicContact CD1-CG1 3.52Å
904	E	75.1	Confident	67.4	Low	96 Å²	96	81.8 Å²	81.8	45%	0.449	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141	173.2	-50.4	-179.4	136	0	0	109.3	K946	E904-K946 HydrophobicContact CB-CB 4.27Å; E904-K946 HydrophobicContact CB-CD 4.4Å; E904-K946 PolarHBondContact N-O 2.8Å; E904-K946 WeakPolarHBondContact O-CB 2.93Å; E904-K946 PolarHBondContact O-N 2.81Å; E904-K946 WeakPolarHBondContact OE2-CD 3.47Å; E904-K946 IonicContact OE2-NZ 2.79Å; E904-K946 PolarHBondContact OE2-NZ 3Å
905	E	66.4	Low	65.5	Low	64 Å²	64	88.5 Å²	88.5	30%	0.299	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	140.7	174	-89.3	-174.5	170	0	0	111.8	Y907 P918 L919 F945	E905-Y907 HydrophobicContact CB-CE2 3.95Å; E905-Y907 PolarHBondContact OE2-OH 2.7Å; E905-P918 WeakPolarHBondContact OE1-CA 3.36Å; E905-P918 VanDerWaalsContact OE1-CB 3.25Å; E905-P918 WeakPolarHBondContact OE1-CB 3.47Å; E905-L919 PolarHBondContact OE1-N 2.76Å; E905-F945 HydrophobicContact CG-CD1 3.63Å; E905-F945 HydrophobicContact CG-CE1 3.48Å; E905-F945 VanDerWaalsContact CG-CE1 3.48Å; E905-F945 WeakPolarHBondContact OE1-CE1 3.41Å
906	F	60.3	Low	64.1	Low	58 Å²	58	88.9 Å²	88.9	25%	0.254	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	120.4	-172.9	-176.9	-91.3	0	0	0	112.1	L813 F944 K946 I963	L813-F906 HydrophobicContact CD1-CE1 3.74Å; L813-F906 HydrophobicContact CD1-CZ 3.82Å; L813-F906 HydrophobicContact CD2-CE1 4.02Å; F906-F944 WeakPolarHBondContact CB-O 3.48Å; F906-F944 HydrophobicContact CD1-CB 4.11Å; F906-F944 PolarHBondContact N-O 3.12Å; F906-F944 VanDerWaalsContact O-O 3.04Å; F906-K946 HydrophobicContact CB-CB 4.3Å; F906-I963 HydrophobicContact CD1-CD1 4.21Å; F906-I963 HydrophobicContact CE1-CD1 4.03Å; F906-I963 HydrophobicContact CZ-CD1 4.3Å
907	Y	56.2	Low	62.7	Low	128 Å²	128	92 Å²	92	50%	0.502	47%	0.473	S	S	.	.			trans	-128.5	127.5	-179.2	-59.7	-83	0	0	0	110.8	E905	E905-Y907 HydrophobicContact CB-CE2 3.95Å; E905-Y907 PolarHBondContact OE2-OH 2.7Å
908	D	51.5	Low	61.9	Low	80 Å²	80	93.9 Å²	93.9	43%	0.428	48%	0.482	S	S	.	.			trans	-98.3	144.4	176.8	-168.5	-23.8	0	0	0	110.2	K817	K817-D908 VanDerWaalsContact CE-OD2 3.27Å; K817-D908 WeakPolarHBondContact CE-OD2 3.21Å; K817-D908 IonicContact NZ-OD1 2.73Å; K817-D908 PolarHBondContact NZ-OD1 3.18Å; K817-D908 IonicContact NZ-OD2 2.65Å; K817-D908 PolarHBondContact NZ-OD2 2.82Å
909	L	47	Very low	61.5	Low	159 Å²	159	92.9 Å²	92.9	83%	0.832	47%	0.473	S	S	*	.			trans	-112.1	111.2	-150.6	-68	148.5	0	0	0	112.8
910	S	46.7	Very low	61.2	Low	107 Å²	107	92 Å²	92	75%	0.748	47%	0.467	S	S	*	.	S	Bend	trans	-150.6	-16.9	171.3	58.8	0	0	0	0	119.2
911	V	40	Very low	61.1	Low	143 Å²	143	93.9 Å²	93.9	87%	0.867	47%	0.472	S	S	*	.	S	Bend	trans	-141.8	153.3	173.7	-172.3	0	0	0	0	110.6
912	D	40.9	Very low	61.1	Low	130 Å²	130	94.3 Å²	94.3	70%	0.695	48%	0.476	S	S	*	.			trans	-63.3	130.2	-164.3	-87.5	-79.1	0	0	0	117.9
913	K	37	Very low	61.2	Low	181 Å²	181	94.7 Å²	94.7	79%	0.787	48%	0.476	S	S	*	.			trans	36.2	111.7	138.5	-61	170.9	-173.6	157.7	0	119.2
914	I	39.8	Very low	61.4	Low	126 Å²	126	94.8 Å²	94.8	65%	0.646	48%	0.479	S	S	*	.				-152.2	131.5	128	-98	139.5	0	0	0	109.9	I938	I914-I938 HydrophobicContact CG2-CD1 4.04Å
915	R	42.5	Very low	61.9	Low	210 Å²	210	96 Å²	96	79%	0.792	49%	0.485	S	S	*	.			trans	17.7	127	167.1	-72	176.1	-79.5	-128.6	-3.5	120.6
916	P	52.7	Low	62.8	Low	113 Å²	113	95.3 Å²	95.3	73%	0.734	49%	0.485	S	S	*	.			trans	-67.5	139	160.1	32.5	-33.9	0	0	0	109.8
917	N	55.8	Low	64	Low	84 Å²	84	92.5 Å²	92.5	45%	0.449	47%	0.473	S	S	.	.			trans	-158.1	83.6	-177.9	-171.8	21.3	0	0	0	108.2	R933	N917-R933 VanDerWaalsContact CG-NE 3.3Å; N917-R933 PolarHBondContact ND2-NE 3.43Å; N917-R933 PolarHBondContact ND2-NH2 3.17Å; N917-R933 VanDerWaalsContact O-CZ 3.3Å; N917-R933 PolarHBondContact O-NE 3.03Å; N917-R933 PolarHBondContact O-NH2 3.05Å; N917-R933 WeakPolarHBondContact OD1-CD 3.27Å; N917-R933 PolarHBondContact OD1-NE 3.14Å
918	P	68.3	Low	65.5	Low	59 Å²	59	89.6 Å²	89.6	38%	0.383	46%	0.463	S	S	.	.			trans	-64.3	143.7	-153.6	23.4	-34.8	0	0	0	113	E905 I932 R933	E905-P918 WeakPolarHBondContact OE1-CA 3.36Å; E905-P918 VanDerWaalsContact OE1-CB 3.25Å; E905-P918 WeakPolarHBondContact OE1-CB 3.47Å; P918-I932 HydrophobicContact CB-CD1 3.95Å; P918-I932 HydrophobicContact CG-CD1 4.24Å; P918-R933 PolarHBondContact O-NE 3.28Å
919	L	77.3	Confident	67.1	Low	1 Å²	1	85.8 Å²	85.8	1%	0.005	44%	0.443	C	S	.	.			trans	-93.3	-45.7	-171.2	-145.8	82.1	0	0	0	112.5	L873 E905 L931 I932 M935 D939 F945 L966 V968	L873-L919 HydrophobicContact CD1-CD2 4.02Å; E905-L919 PolarHBondContact OE1-N 2.76Å; L919-L931 HydrophobicContact CG-CD1 4.22Å; L919-L931 WeakPolarHBondContact O-CD1 3.42Å; L919-I932 PolarHBondContact O-N 3.11Å; L919-M935 HydrophobicContact CD1-CG 4.04Å; L919-M935 HydrophobicContact CD2-SD 4.27Å; L919-D939 HydrophobicContact CD1-CB 4.19Å; L919-F945 HydrophobicContact CB-CE1 4.47Å; L919-F945 HydrophobicContact CB-CZ 3.83Å; L919-L966 HydrophobicContact CD2-CD2 3.75Å; L919-V968 HydrophobicContact CD2-CG2 3.87Å
920	I	81.7	Confident	68.9	Low	6 Å²	6	79 Å²	79	3%	0.031	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.3	-174	86.8	-171.9	0	0	0	111.7	I883 L903 L929 I930 L931 I932 F945 L964 L966	I883-I920 HydrophobicContact CD1-CB 4.09Å; I883-I920 HydrophobicContact CD1-CG2 3.37Å; L903-I920 HydrophobicContact CD2-CD1 4.37Å; L903-I920 HydrophobicContact CD2-CG1 3.74Å; I920-L929 HydrophobicContact CD1-CD2 3.99Å; I920-I930 CarbonylContact C-O 3.53Å; I920-I930 VanDerWaalsContact CA-O 3.23Å; I920-I930 WeakPolarHBondContact CA-O 3.46Å; I920-L931 HydrophobicContact CG2-CD1 4.41Å; I920-I932 VanDerWaalsContact C-CD1 3.41Å; I920-I932 WeakPolarHBondContact O-CD1 3.09Å; I920-F945 HydrophobicContact CD1-CB 4.49Å; I920-F945 HydrophobicContact CD1-CD1 3.98Å; I920-F945 HydrophobicContact CD1-CD2 3.67Å; I920-F945 HydrophobicContact CD1-CE1 4.12Å; I920-F945 HydrophobicContact CD1-CE2 3.84Å; I920-F945 HydrophobicContact CD1-CG 3.77Å; I920-F945 HydrophobicContact CD1-CZ 4.09Å; I920-F945 HydrophobicContact CG1-CD1 3.8Å; I920-F945 HydrophobicContact CG1-CD2 4.32Å; I920-F945 HydrophobicContact CG1-CE1 3.69Å; I920-F945 HydrophobicContact CG1-CE2 4.24Å; I920-F945 HydrophobicContact CG1-CG 4.14Å; I920-F945 HydrophobicContact CG1-CZ 3.96Å; I920-F945 HydrophobicContact CG2-CZ 4.22Å; I920-L964 HydrophobicContact CD1-CD2 3.84Å; I920-L966 HydrophobicContact CD1-CD1 4.12Å; I920-L966 HydrophobicContact CG2-CD1 4Å
921	R	86.6	Confident	70.7	Confident	103 Å²	103	73.9 Å²	73.9	39%	0.389	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	160	167.6	64.8	179.3	-174.3	-113.1	-4.9	110.4	D880 L929 I930 I932	D880-R921 IonicContact OD1-CZ 2.74Å; D880-R921 VanDerWaalsContact OD1-CZ 3.3Å; D880-R921 IonicContact OD1-NH1 2.83Å; D880-R921 PolarHBondContact OD1-NH1 2.86Å; D880-R921 IonicContact OD1-NH2 3.21Å; D880-R921 PolarHBondContact OD1-NH2 3.01Å; R921-L929 CarbonylContact O-C 3.52Å; R921-L929 WeakPolarHBondContact O-CA 3.47Å; R921-I930 HydrophobicContact CG-CB 3.92Å; R921-I930 PolarHBondContact N-O 2.84Å; R921-I930 PolarHBondContact O-N 3.44Å; R921-I932 HydrophobicContact CB-CD1 4.16Å; R921-I932 HydrophobicContact CB-CG1 4.21Å; R921-I932 HydrophobicContact CG-CG1 4.32Å
922	V	88.3	Confident	72.7	Confident	20 Å²	20	70 Å²	70	12%	0.121	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	144.4	166.2	79.2	0	0	0	0	110.7	L886 L903 E928 L929	L886-V922 HydrophobicContact CD1-CG2 3.99Å; L903-V922 HydrophobicContact CB-CB 3.77Å; L903-V922 HydrophobicContact CB-CG1 3.45Å; L903-V922 VanDerWaalsContact CB-CG1 3.45Å; L903-V922 HydrophobicContact CD2-CB 4.28Å; V922-E928 CarbonylContact C-O 3.31Å; V922-E928 VanDerWaalsContact CA-O 3.32Å; V922-E928 WeakPolarHBondContact CA-O 3.35Å; V922-L929 HydrophobicContact CB-CD2 4.1Å; V922-L929 HydrophobicContact CG2-CD2 3.99Å
923	Q	88.4	Confident	74.6	Confident	82 Å²	82	65.6 Å²	65.6	38%	0.383	32%	0.319	S	S	.	.			trans	-86.5	116.7	167.9	-178.3	60.6	23.2	0	0	109.7	E925 T926 G927 E928	Q923-E925 PolarHBondContact O-N 2.83Å; Q923-T926 VanDerWaalsContact CB-OG1 3.29Å; Q923-T926 WeakPolarHBondContact CB-OG1 3.21Å; Q923-T926 HydrophobicContact CG-CG2 4.32Å; Q923-T926 WeakPolarHBondContact CG-OG1 3.22Å; Q923-T926 PolarHBondContact O-N 3.16Å; Q923-G927 WeakPolarHBondContact O-CA 3.27Å; Q923-G927 PolarHBondContact O-N 3.26Å; Q923-E928 HydrophobicContact CB-CB 4.23Å; Q923-E928 PolarHBondContact N-O 3.15Å
924	P	87	Confident	76.7	Confident	40 Å²	40	62.6 Å²	62.6	26%	0.26	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.8	-163.7	-26.7	36.4	0	0	0	117.3	F900 Y901	F900-P924 HydrophobicContact CD1-CB 4.44Å; F900-P924 HydrophobicContact CD2-CB 4.09Å; F900-P924 HydrophobicContact CE1-CB 3.86Å; F900-P924 HydrophobicContact CE2-CB 3.47Å; F900-P924 VanDerWaalsContact CE2-CB 3.47Å; F900-P924 HydrophobicContact CZ-CB 3.34Å; F900-P924 HydrophobicContact CZ-CG 4.24Å; Y901-P924 WeakPolarHBondContact CD2-O 3.36Å; Y901-P924 PolarHBondContact N-O 2.58Å; Y901-P924 WeakPolarHBondContact O-CA 3.45Å; Y901-P924 WeakPolarHBondContact O-CB 3.27Å
925	E	85.5	Confident	78.5	Confident	122 Å²	122	57.4 Å²	57.4	57%	0.57	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-20.4	179.1	-61.7	-170.8	130.2	0	0	113.2	F900 Q923 R952	F900-E925 HydrophobicContact CD2-CG 4.29Å; F900-E925 HydrophobicContact CE2-CG 4.36Å; Q923-E925 PolarHBondContact O-N 2.83Å; E925-R952 IonicContact OE1-CZ 2.87Å; E925-R952 IonicContact OE1-NH1 3.3Å; E925-R952 IonicContact OE1-NH2 3.18Å; E925-R952 PolarHBondContact OE1-NH2 3.22Å
926	T	86.2	Confident	79.8	Confident	49 Å²	49	49.3 Å²	49.3	30%	0.301	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-15.4	-178.5	64.5	0	0	0	0	113.3	K885 Q923 E928	K885-T926 WeakPolarHBondContact CE-O 3.35Å; K885-T926 WeakPolarHBondContact CG-O 3.46Å; Q923-T926 VanDerWaalsContact CB-OG1 3.29Å; Q923-T926 WeakPolarHBondContact CB-OG1 3.21Å; Q923-T926 HydrophobicContact CG-CG2 4.32Å; Q923-T926 WeakPolarHBondContact CG-OG1 3.22Å; Q923-T926 PolarHBondContact O-N 3.16Å; T926-E928 VanDerWaalsContact CB-OE2 3.26Å; T926-E928 WeakPolarHBondContact CB-OE2 3.15Å; T926-E928 PolarHBondContact O-N 3.35Å; T926-E928 WeakPolarHBondContact OG1-CG 3.09Å; T926-E928 PolarHBondContact OG1-N 2.93Å; T926-E928 PolarHBondContact OG1-OE2 3.16Å
927	G	84.9	Confident	80.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.			trans	72.6	4.5	-175.2	0	0	0	0	0	114.4	L886 Q923 L929	L886-G927 PolarHBondContact N-O 3.23Å; Q923-G927 WeakPolarHBondContact O-CA 3.27Å; Q923-G927 PolarHBondContact O-N 3.26Å; G927-L929 PolarHBondContact O-N 3.01Å
928	E	87.6	Confident	81.5	Confident	66 Å²	66	51 Å²	51	31%	0.308	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	125.9	-174.8	-68.6	165.5	131.6	0	0	111.8	V882 K885 V922 Q923 T926	V882-E928 HydrophobicContact CG1-CB 4.3Å; K885-E928 HydrophobicContact CD-CG 4.28Å; K885-E928 HydrophobicContact CG-CG 4.03Å; V922-E928 CarbonylContact C-O 3.31Å; V922-E928 VanDerWaalsContact CA-O 3.32Å; V922-E928 WeakPolarHBondContact CA-O 3.35Å; Q923-E928 HydrophobicContact CB-CB 4.23Å; Q923-E928 PolarHBondContact N-O 3.15Å; T926-E928 VanDerWaalsContact CB-OE2 3.26Å; T926-E928 WeakPolarHBondContact CB-OE2 3.15Å; T926-E928 PolarHBondContact O-N 3.35Å; T926-E928 WeakPolarHBondContact OG1-CG 3.09Å; T926-E928 PolarHBondContact OG1-N 2.93Å; T926-E928 PolarHBondContact OG1-OE2 3.16Å
929	L	85.1	Confident	81.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	119.4	179.4	-64	160.6	0	0	0	108.8	V882 I883 S884 L886 L903 I920 R921 V922 G927 L964	V882-L929 CarbonylContact C-O 3.59Å; V882-L929 WeakPolarHBondContact CA-O 3.47Å; I883-L929 PolarHBondContact N-O 3.41Å; S884-L929 WeakPolarHBondContact O-CB 3.42Å; S884-L929 PolarHBondContact O-N 3.07Å; L886-L929 HydrophobicContact CD1-CD2 4.46Å; L886-L929 HydrophobicContact CD2-CD1 3.92Å; L886-L929 HydrophobicContact CG-CD1 4.12Å; L886-L929 HydrophobicContact CG-CD2 4.33Å; L886-L929 HydrophobicContact CG-CG 4.24Å; L903-L929 HydrophobicContact CD1-CD2 4.03Å; L903-L929 HydrophobicContact CD2-CD2 4.48Å; I920-L929 HydrophobicContact CD1-CD2 3.99Å; R921-L929 CarbonylContact O-C 3.52Å; R921-L929 WeakPolarHBondContact O-CA 3.47Å; V922-L929 HydrophobicContact CB-CD2 4.1Å; V922-L929 HydrophobicContact CG2-CD2 3.99Å; G927-L929 PolarHBondContact O-N 3.01Å; L929-L964 HydrophobicContact CD1-CD1 4.37Å; L929-L964 HydrophobicContact CD1-CD2 3.62Å; L929-L964 HydrophobicContact CD2-CD2 4.11Å; L929-L964 HydrophobicContact CG-CD2 4.49Å
930	I	85.2	Confident	81.8	Confident	17 Å²	17	52 Å²	52	9%	0.087	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.7	-168	-55.5	166.6	0	0	0	110.5	Q881 V882 I920 R921 I932	Q881-I930 WeakPolarHBondContact O-CA 3.22Å; V882-I930 HydrophobicContact CG2-CG1 4.21Å; I920-I930 CarbonylContact C-O 3.53Å; I920-I930 VanDerWaalsContact CA-O 3.23Å; I920-I930 WeakPolarHBondContact CA-O 3.46Å; R921-I930 HydrophobicContact CG-CB 3.92Å; R921-I930 PolarHBondContact N-O 2.84Å; R921-I930 PolarHBondContact O-N 3.44Å; I930-I932 PolarHBondContact O-N 3.23Å
931	L	83.6	Confident	81.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	127.9	176.8	-165.6	74.4	0	0	0	111.2	L873 E877 K878 D880 Q881 I883 L919 I920 R933 M935	L873-L931 HydrophobicContact CD1-CD1 3.83Å; E877-L931 HydrophobicContact CB-CD2 4.05Å; K878-L931 WeakPolarHBondContact O-CD2 3.49Å; D880-L931 WeakPolarHBondContact CA-O 2.79Å; D880-L931 PolarHBondContact N-O 2.88Å; Q881-L931 PolarHBondContact O-N 3.35Å; I883-L931 HydrophobicContact CD1-CB 3.91Å; I883-L931 HydrophobicContact CD1-CD1 3.96Å; I883-L931 HydrophobicContact CG1-CB 4.3Å; L919-L931 HydrophobicContact CG-CD1 4.22Å; L919-L931 WeakPolarHBondContact O-CD1 3.42Å; I920-L931 HydrophobicContact CG2-CD1 4.41Å; L931-R933 VanDerWaalsContact CD2-O 3.23Å; L931-R933 WeakPolarHBondContact CD2-O 3.25Å; L931-R933 WeakPolarHBondContact CG-O 3.3Å; L931-M935 HydrophobicContact CD1-CE 3.9Å; L931-M935 HydrophobicContact CD1-SD 4.41Å; L931-M935 HydrophobicContact CD2-CE 3.8Å
932	I	82.9	Confident	80.6	Confident	61 Å²	61	51.1 Å²	51.1	31%	0.313	27%	0.273	S	S	.	.			trans	-81.8	-30.9	-176.2	-66.1	171	0	0	0	112.3	P918 L919 I920 R921 I930	P918-I932 HydrophobicContact CB-CD1 3.95Å; P918-I932 HydrophobicContact CG-CD1 4.24Å; L919-I932 PolarHBondContact O-N 3.11Å; I920-I932 VanDerWaalsContact C-CD1 3.41Å; I920-I932 WeakPolarHBondContact O-CD1 3.09Å; R921-I932 HydrophobicContact CB-CD1 4.16Å; R921-I932 HydrophobicContact CB-CG1 4.21Å; R921-I932 HydrophobicContact CG-CG1 4.32Å; I930-I932 PolarHBondContact O-N 3.23Å
933	R	81.1	Confident	80	Confident	38 Å²	38	51.4 Å²	51.4	14%	0.143	27%	0.273	C	S	.	.	S	Bend	trans	-156.8	164.5	-168.1	59.7	176.8	-175.7	85.9	-7.8	112.2	N917 P918 L931 D939	N917-R933 VanDerWaalsContact CG-NE 3.3Å; N917-R933 PolarHBondContact ND2-NE 3.43Å; N917-R933 PolarHBondContact ND2-NH2 3.17Å; N917-R933 VanDerWaalsContact O-CZ 3.3Å; N917-R933 PolarHBondContact O-NE 3.03Å; N917-R933 PolarHBondContact O-NH2 3.05Å; N917-R933 WeakPolarHBondContact OD1-CD 3.27Å; N917-R933 PolarHBondContact OD1-NE 3.14Å; P918-R933 PolarHBondContact O-NE 3.28Å; L931-R933 VanDerWaalsContact CD2-O 3.23Å; L931-R933 WeakPolarHBondContact CD2-O 3.25Å; L931-R933 WeakPolarHBondContact CG-O 3.3Å; R933-D939 IonicContact CZ-OD1 3.51Å; R933-D939 IonicContact CZ-OD2 3.57Å; R933-D939 IonicContact NH1-OD1 3.42Å; R933-D939 PolarHBondContact NH1-OD1 3.03Å; R933-D939 IonicContact NH1-OD2 2.73Å; R933-D939 PolarHBondContact NH1-OD2 2.85Å; R933-D939 IonicContact NH2-OD1 2.7Å; R933-D939 PolarHBondContact NH2-OD1 3.39Å; R933-D939 IonicContact NH2-OD2 3.54Å
934	H	80.4	Confident	79.4	Confident	118 Å²	118	49.1 Å²	49.1	55%	0.546	26%	0.262	S	S	.	.			trans	-62	142.7	167.8	-80	-66.4	0	0	0	110.5	E877 P879	E877-H934 PolarHBondContact O-ND1 3.37Å; E877-H934 VanDerWaalsContact O-ND1 3.13Å; P879-H934 VanDerWaalsContact CD-CE1 3.44Å; P879-H934 WeakPolarHBondContact CD-CE1 3.19Å; P879-H934 WeakPolarHBondContact CD-NE2 3.49Å
935	M	78.4	Confident	79	Confident	16 Å²	16	47.3 Å²	47.3	8%	0.079	25%	0.25	C	C	.	.			trans	-84.9	135.7	172.7	-74.9	172.1	-82.5	0	0	110	L873 S874 V875 E877 L919 L931 D939 V968	L873-M935 HydrophobicContact CB-CE 4.07Å; L873-M935 HydrophobicContact CB-SD 4.12Å; L873-M935 HydrophobicContact CD1-CE 3.73Å; L873-M935 HydrophobicContact CD1-SD 3.72Å; S874-M935 WeakPolarHBondContact O-CE 3.48Å; V875-M935 HydrophobicContact CB-CB 4.23Å; V875-M935 HydrophobicContact CG1-CB 4.28Å; E877-M935 HydrophobicContact CB-CE 3.76Å; L919-M935 HydrophobicContact CD1-CG 4.04Å; L919-M935 HydrophobicContact CD2-SD 4.27Å; L931-M935 HydrophobicContact CD1-CE 3.9Å; L931-M935 HydrophobicContact CD1-SD 4.41Å; L931-M935 HydrophobicContact CD2-CE 3.8Å; M935-D939 WeakPolarHBondContact CA-OD2 3.42Å; M935-D939 HydrophobicContact CB-CB 4.28Å; M935-D939 HydrophobicContact CG-CB 4.25Å; M935-V968 HydrophobicContact CG-CG1 4.41Å; M935-V968 HydrophobicContact SD-CB 4.24Å; M935-V968 HydrophobicContact SD-CG1 3.46Å; M935-V968 WeakPolarHBondContact SD-CG1 3.28Å; M935-V968 HydrophobicContact SD-CG2 3.7Å
936	A	68.8	Low	78.9	Confident	41 Å²	41	43.5 Å²	43.5	34%	0.339	23%	0.232	S	C	.	.			trans	-105.7	167.3	171.4	0	0	0	0	0	109.5	I938 D939	A936-I938 HydrophobicContact CB-CG2 4.19Å; A936-I938 PolarHBondContact O-N 3.23Å; A936-D939 PolarHBondContact N-OD2 2.88Å; A936-D939 WeakPolarHBondContact O-CB 3.43Å; A936-D939 PolarHBondContact O-N 3.44Å
937	P	71.5	Confident	78.8	Confident	108 Å²	108	41.2 Å²	41.2	70%	0.701	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-59.5	-12.6	178.5	-27	36.4	0	0	0	115.5	D939 L940	P937-D939 VanDerWaalsContact C-N 3.33Å; P937-L940 HydrophobicContact CB-CD1 4.34Å; P937-L940 WeakPolarHBondContact O-CD1 3.25Å
938	I	72.9	Confident	78.9	Confident	123 Å²	123	41.6 Å²	41.6	63%	0.631	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-78.5	-16.8	172.5	-163.4	165.5	0	0	0	113.2	I914 A936 L940	I914-I938 HydrophobicContact CG2-CD1 4.04Å; A936-I938 HydrophobicContact CB-CG2 4.19Å; A936-I938 PolarHBondContact O-N 3.23Å; I938-L940 VanDerWaalsContact C-N 3.32Å
939	D	75.6	Confident	79	Confident	11 Å²	11	38.4 Å²	38.4	6%	0.059	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-88.6	-0.1	179.5	-55.8	-52.3	0	0	0	112.5	L919 R933 M935 A936 P937 H943 V968	L919-D939 HydrophobicContact CD1-CB 4.19Å; R933-D939 IonicContact CZ-OD1 3.51Å; R933-D939 IonicContact CZ-OD2 3.57Å; R933-D939 IonicContact NH1-OD1 3.42Å; R933-D939 PolarHBondContact NH1-OD1 3.03Å; R933-D939 IonicContact NH1-OD2 2.73Å; R933-D939 PolarHBondContact NH1-OD2 2.85Å; R933-D939 IonicContact NH2-OD1 2.7Å; R933-D939 PolarHBondContact NH2-OD1 3.39Å; R933-D939 IonicContact NH2-OD2 3.54Å; M935-D939 WeakPolarHBondContact CA-OD2 3.42Å; M935-D939 HydrophobicContact CB-CB 4.28Å; M935-D939 HydrophobicContact CG-CB 4.25Å; A936-D939 PolarHBondContact N-OD2 2.88Å; A936-D939 WeakPolarHBondContact O-CB 3.43Å; A936-D939 PolarHBondContact O-N 3.44Å; P937-D939 VanDerWaalsContact C-N 3.33Å; D939-H943 PolarHBondContact O-NE2 2.91Å; D939-V968 VanDerWaalsContact O-CB 3.23Å; D939-V968 WeakPolarHBondContact O-CB 3.43Å; D939-V968 WeakPolarHBondContact O-CG2 3.5Å
940	L	77.3	Confident	79.2	Confident	70 Å²	70	38.8 Å²	38.8	37%	0.366	21%	0.207	S	C	.	.			trans	-66.2	137.8	179.3	-74.5	169.8	0	0	0	112.3	V875 P937 I938 V968 D970	V875-L940 HydrophobicContact CG1-CD2 3.46Å; V875-L940 VanDerWaalsContact CG1-CD2 3.46Å; V875-L940 HydrophobicContact CG1-CG 4.05Å; P937-L940 HydrophobicContact CB-CD1 4.34Å; P937-L940 WeakPolarHBondContact O-CD1 3.25Å; I938-L940 VanDerWaalsContact C-N 3.32Å; L940-V968 HydrophobicContact CD2-CG1 4.26Å; L940-D970 HydrophobicContact CD1-CB 4.01Å; L940-D970 HydrophobicContact CD2-CB 3.7Å
941	G	71.8	Confident	79.3	Confident	26 Å²	26	38 Å²	38	27%	0.268	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	110.8	-159.1	-179.2	0	0	0	0	0	113.4	L967 V968	G941-L967 WeakPolarHBondContact O-CA 3.44Å; G941-V968 PolarHBondContact N-O 2.88Å; G941-V968 PolarHBondContact O-N 2.84Å
942	Y	71.4	Confident	79.4	Confident	65 Å²	65	42.1 Å²	42.1	26%	0.255	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.6	-174.6	-77.6	-98.1	0	0	0	112.4	Y816 M820 V870 F944 L966 L967	Y816-Y942 HydrophobicContact CD1-CE1 4.36Å; Y816-Y942 AromaticContact CE1-CE1 3.86Å; Y816-Y942 HydrophobicContact CE1-CE1 3.86Å; M820-Y942 HydrophobicContact CE-CD2 3.43Å; M820-Y942 VanDerWaalsContact CE-CD2 3.43Å; M820-Y942 HydrophobicContact CE-CE2 4.1Å; M820-Y942 HydrophobicContact CE-CG 3.92Å; V870-Y942 HydrophobicContact CG1-CD1 4.28Å; V870-Y942 HydrophobicContact CG1-CE1 3.76Å; V870-Y942 HydrophobicContact CG2-CE1 3.96Å; Y942-F944 HydrophobicContact CD1-CE1 4.5Å; Y942-F944 HydrophobicContact CD1-CZ 4.05Å; Y942-F944 HydrophobicContact CG-CZ 4.31Å; Y942-L966 CarbonylContact C-O 3.56Å; Y942-L966 WeakPolarHBondContact CA-O 3.21Å; Y942-L967 HydrophobicContact CD1-CB 4.37Å; Y942-L967 HydrophobicContact CD2-CD1 3.91Å; Y942-L967 HydrophobicContact CE1-CB 4.23Å; Y942-L967 HydrophobicContact CE2-CD1 3.87Å; Y942-L967 HydrophobicContact CE2-CD2 4.38Å; Y942-L967 HydrophobicContact CG-CD1 4.42Å
943	H	74	Confident	79.2	Confident	26 Å²	26	39.5 Å²	39.5	12%	0.12	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	150.5	165.7	-58.9	-105.4	0	0	0	108.5	D939 F945 L966	D939-H943 PolarHBondContact O-NE2 2.91Å; H943-F945 HydrophobicContact CB-CE2 3.62Å; H943-F945 HydrophobicContact CB-CZ 4.02Å; H943-L966 HydrophobicContact CB-CD2 4.2Å; H943-L966 PolarHBondContact N-O 2.73Å; H943-L966 PolarHBondContact O-N 2.77Å
944	F	76.4	Confident	79	Confident	35 Å²	35	44.9 Å²	44.9	15%	0.154	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.7	179.9	-62.5	-85.2	0	0	0	109.2	F906 Y942 I963 P965	F906-F944 WeakPolarHBondContact CB-O 3.48Å; F906-F944 HydrophobicContact CD1-CB 4.11Å; F906-F944 PolarHBondContact N-O 3.12Å; F906-F944 VanDerWaalsContact O-O 3.04Å; Y942-F944 HydrophobicContact CD1-CE1 4.5Å; Y942-F944 HydrophobicContact CD1-CZ 4.05Å; Y942-F944 HydrophobicContact CG-CZ 4.31Å; F944-I963 HydrophobicContact CB-CG2 3.88Å; F944-I963 HydrophobicContact CD1-CG2 3.82Å; F944-I963 HydrophobicContact CG-CG2 4.31Å; F944-P965 HydrophobicContact CD1-CB 4.05Å; F944-P965 HydrophobicContact CE1-CB 3.88Å
945	F	79.3	Confident	79.2	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.009	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141	178.4	-55.9	-96.4	0	0	0	109.6	L903 E905 L919 I920 H943 I963 L964 L966	L903-F945 HydrophobicContact CD1-CB 3.57Å; L903-F945 HydrophobicContact CD1-CD1 4.48Å; L903-F945 HydrophobicContact CD1-CG 4.32Å; L903-F945 HydrophobicContact CD2-CD1 4.33Å; L903-F945 HydrophobicContact CG-CB 4.33Å; E905-F945 HydrophobicContact CG-CD1 3.63Å; E905-F945 HydrophobicContact CG-CE1 3.48Å; E905-F945 VanDerWaalsContact CG-CE1 3.48Å; E905-F945 WeakPolarHBondContact OE1-CE1 3.41Å; L919-F945 HydrophobicContact CB-CE1 4.47Å; L919-F945 HydrophobicContact CB-CZ 3.83Å; I920-F945 HydrophobicContact CD1-CB 4.49Å; I920-F945 HydrophobicContact CD1-CD1 3.98Å; I920-F945 HydrophobicContact CD1-CD2 3.67Å; I920-F945 HydrophobicContact CD1-CE1 4.12Å; I920-F945 HydrophobicContact CD1-CE2 3.84Å; I920-F945 HydrophobicContact CD1-CG 3.77Å; I920-F945 HydrophobicContact CD1-CZ 4.09Å; I920-F945 HydrophobicContact CG1-CD1 3.8Å; I920-F945 HydrophobicContact CG1-CD2 4.32Å; I920-F945 HydrophobicContact CG1-CE1 3.69Å; I920-F945 HydrophobicContact CG1-CE2 4.24Å; I920-F945 HydrophobicContact CG1-CG 4.14Å; I920-F945 HydrophobicContact CG1-CZ 3.96Å; I920-F945 HydrophobicContact CG2-CZ 4.22Å; H943-F945 HydrophobicContact CB-CE2 3.62Å; H943-F945 HydrophobicContact CB-CZ 4.02Å; F945-I963 CarbonylContact O-C 3.17Å; F945-I963 VanDerWaalsContact O-CA 3.31Å; F945-I963 WeakPolarHBondContact O-CA 3.43Å; F945-L964 HydrophobicContact CB-CB 4.34Å; F945-L964 HydrophobicContact CB-CD2 4.46Å; F945-L964 PolarHBondContact N-O 2.82Å; F945-L964 PolarHBondContact O-N 3.19Å; F945-L966 HydrophobicContact CD2-CB 4.37Å; F945-L966 HydrophobicContact CE2-CB 4.12Å; F945-L966 HydrophobicContact CE2-CD1 4.09Å; F945-L966 HydrophobicContact CE2-CD2 4.47Å; F945-L966 HydrophobicContact CE2-CG 4.47Å
946	K	82.1	Confident	79.3	Confident	42 Å²	42	50 Å²	50	18%	0.183	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	117.9	-175.4	-171.9	-171.3	177.3	-141.6	0	108.4	L903 E904 F906 Q961 K962	L903-K946 CarbonylContact C-O 3.55Å; L903-K946 WeakPolarHBondContact CA-O 3.4Å; E904-K946 HydrophobicContact CB-CB 4.27Å; E904-K946 HydrophobicContact CB-CD 4.4Å; E904-K946 PolarHBondContact N-O 2.8Å; E904-K946 WeakPolarHBondContact O-CB 2.93Å; E904-K946 PolarHBondContact O-N 2.81Å; E904-K946 WeakPolarHBondContact OE2-CD 3.47Å; E904-K946 IonicContact OE2-NZ 2.79Å; E904-K946 PolarHBondContact OE2-NZ 3Å; F906-K946 HydrophobicContact CB-CB 4.3Å; K946-Q961 HydrophobicContact CG-CB 4.2Å; K946-Q961 VanDerWaalsContact NZ-CD 3.28Å; K946-K962 CarbonylContact C-O 3.41Å; K946-K962 VanDerWaalsContact CA-O 3.3Å; K946-K962 WeakPolarHBondContact CA-O 3.15Å
947	V	85.5	Confident	80	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.1	-175.2	-61.9	0	0	0	0	111.3	F799 L805 L886 L902 L903 Q961 K962 L964	F799-V947 HydrophobicContact CE2-CB 4.45Å; F799-V947 HydrophobicContact CE2-CG2 3.88Å; F799-V947 HydrophobicContact CZ-CB 4.03Å; F799-V947 HydrophobicContact CZ-CG2 3.81Å; L805-V947 HydrophobicContact CD1-CG2 3.98Å; L805-V947 HydrophobicContact CD2-CG2 3.64Å; L805-V947 HydrophobicContact CG-CG2 4.41Å; L886-V947 HydrophobicContact CD1-CB 3.84Å; L886-V947 HydrophobicContact CD1-CG1 3.63Å; L886-V947 HydrophobicContact CD2-CG1 4.14Å; L902-V947 CarbonylContact O-C 3.56Å; L902-V947 WeakPolarHBondContact O-CA 3.46Å; L903-V947 HydrophobicContact CD1-CG1 3.52Å; V947-Q961 CarbonylContact O-C 3.52Å; V947-Q961 WeakPolarHBondContact O-CA 3.41Å; V947-K962 HydrophobicContact CG2-CB 3.78Å; V947-K962 PolarHBondContact N-O 2.9Å; V947-K962 PolarHBondContact O-N 2.94Å; V947-L964 HydrophobicContact CG1-CB 4.27Å
948	T	87.1	Confident	80.2	Confident	8 Å²	8	51 Å²	51	5%	0.049	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.4	175.7	-31.5	0	0	0	0	109.4	Y901 L902 Q961	Y901-T948 WeakPolarHBondContact CA-O 3.49Å; L902-T948 PolarHBondContact N-O 3.33Å; L902-T948 PolarHBondContact O-N 3.47Å; T948-Q961 HydrophobicContact CG2-CG 3.94Å; T948-Q961 WeakPolarHBondContact OG1-CG 3.5Å
949	A	88.1	Confident	80.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.2	163.5	0	0	0	0	0	108.9	P797 F799 A888 V899 F900 K958 I959	P797-A949 HydrophobicContact CB-CB 3.78Å; F799-A949 HydrophobicContact CE1-CB 4.09Å; F799-A949 HydrophobicContact CE2-CB 4.1Å; F799-A949 HydrophobicContact CZ-CB 3.83Å; A888-A949 HydrophobicContact CB-CB 3.92Å; V899-A949 HydrophobicContact CG1-CB 4.18Å; F900-A949 CarbonylContact O-C 3.58Å; F900-A949 WeakPolarHBondContact O-CA 3.46Å; A949-K958 WeakPolarHBondContact O-CA 3.43Å; A949-I959 HydrophobicContact CB-CG2 3.97Å; A949-I959 PolarHBondContact O-N 2.86Å
950	S	89.4	Confident	79.4	Confident	7 Å²	7	51.8 Å²	51.8	5%	0.049	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	146.6	-177.8	-177	0	0	0	0	108.7	V899 F900 M957 K958	V899-S950 CarbonylContact C-O 3.48Å; V899-S950 WeakPolarHBondContact CA-O 3.29Å; F900-S950 PolarHBondContact N-O 3.46Å; F900-S950 PolarHBondContact O-N 2.86Å; S950-M957 WeakPolarHBondContact CA-O 3.4Å; S950-K958 WeakPolarHBondContact OG-CE 3.37Å
951	D	88.6	Confident	79.2	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.011	25%	0.249	C	C	.	.			trans	-74.1	-171.7	165.5	61.4	13.5	0	0	0	112.7	N793 N896 R956 M957	N793-D951 PolarHBondContact ND2-OD2 3.3Å; N793-D951 PolarHBondContact OD1-OD2 3.4Å; N896-D951 WeakPolarHBondContact O-CB 3.14Å; D951-R956 WeakPolarHBondContact OD1-CA 3.31Å; D951-R956 VanDerWaalsContact OD1-CB 3.25Å; D951-R956 WeakPolarHBondContact OD1-CB 3.3Å; D951-R956 VanDerWaalsContact OD1-CG 3.25Å; D951-R956 WeakPolarHBondContact OD1-CG 3.26Å; D951-R956 WeakPolarHBondContact OD2-CA 2.84Å; D951-M957 VanDerWaalsContact CG-N 3.26Å; D951-M957 PolarHBondContact N-O 2.8Å; D951-M957 VanDerWaalsContact N-O 3.17Å; D951-M957 PolarHBondContact OD1-N 2.79Å; D951-M957 WeakPolarHBondContact OD2-CA 3.07Å; D951-M957 WeakPolarHBondContact OD2-CB 3.5Å; D951-M957 PolarHBondContact OD2-N 2.85Å
952	R	84.6	Confident	79.5	Confident	85 Å²	85	52.5 Å²	52.5	32%	0.321	25%	0.245	S	C	.	.	S	Bend	trans	-109	-25.8	162.4	-64.2	173	-169.2	-143.5	-8.3	113.6	D895 A898 E925 R956	D895-R952 HydrophobicContact CB-CB 4.25Å; D895-R952 CarbonylContact O-C 3.52Å; D895-R952 WeakPolarHBondContact O-CB 3.48Å; D895-R952 PolarHBondContact O-N 2.61Å; A898-R952 HydrophobicContact CB-CB 4.22Å; A898-R952 HydrophobicContact CB-CG 3.99Å; A898-R952 WeakPolarHBondContact O-CG 3.13Å; E925-R952 IonicContact OE1-CZ 2.87Å; E925-R952 IonicContact OE1-NH1 3.3Å; E925-R952 IonicContact OE1-NH2 3.18Å; E925-R952 PolarHBondContact OE1-NH2 3.22Å; R952-R956 PolarHBondContact O-NE 2.82Å; R952-R956 PolarHBondContact O-NH2 3.34Å; R952-R956 VanDerWaalsContact O-NH2 3.12Å
953	G	79.1	Confident	79.8	Confident	6 Å²	6	49.5 Å²	49.5	6%	0.062	23%	0.233	C	C	.	.	S	Bend	trans	-69.8	-169	-170.5	0	0	0	0	0	116	N793 D895 N896 R956	N793-G953 VanDerWaalsContact OD1-C 3.22Å; N793-G953 WeakPolarHBondContact OD1-CA 3.48Å; D895-G953 PolarHBondContact O-N 2.73Å; N896-G953 WeakPolarHBondContact OD1-CA 3.22Å; G953-R956 WeakPolarHBondContact O-CG 3.41Å; G953-R956 PolarHBondContact O-N 2.77Å
954	H	77.3	Confident	80.1	Confident	151 Å²	151	48.4 Å²	48.4	70%	0.699	23%	0.228	S	C	*	.	S	Bend	trans	-138	120.7	-166.6	-78.8	7.3	0	0	0	112.1	N793	N793-H954 PolarHBondContact OD1-N 3.04Å
955	P	83.2	Confident	80	Confident	91 Å²	91	46.8 Å²	46.8	59%	0.591	22%	0.222	S	C	*	.	S	Bend	cis	-77.1	134.8	4.6	32.1	-35	0	0	0	113	N793 M957	N793-P955 PolarHBondContact ND2-O 2.97Å; P955-M957 WeakPolarHBondContact O-CG 3.42Å; P955-M957 PolarHBondContact O-N 3.39Å; P955-M957 VanDerWaalsContact O-N 3.11Å
956	R	81.8	Confident	79.9	Confident	150 Å²	150	46.7 Å²	46.7	57%	0.566	22%	0.221	S	C	*	.			trans	-60.2	114.2	-176.4	-76.2	-166	177.7	168.7	-0.3	114.2	D951 R952 G953	D951-R956 WeakPolarHBondContact OD1-CA 3.31Å; D951-R956 VanDerWaalsContact OD1-CB 3.25Å; D951-R956 WeakPolarHBondContact OD1-CB 3.3Å; D951-R956 VanDerWaalsContact OD1-CG 3.25Å; D951-R956 WeakPolarHBondContact OD1-CG 3.26Å; D951-R956 WeakPolarHBondContact OD2-CA 2.84Å; R952-R956 PolarHBondContact O-NE 2.82Å; R952-R956 PolarHBondContact O-NH2 3.34Å; R952-R956 VanDerWaalsContact O-NH2 3.12Å; G953-R956 WeakPolarHBondContact O-CG 3.41Å; G953-R956 PolarHBondContact O-N 2.77Å
957	M	83	Confident	79.6	Confident	56 Å²	56	45.6 Å²	45.6	28%	0.276	22%	0.217	S	C	.	.			trans	-88.2	143.1	174.7	-58.9	-70	-154.8	0	0	110.7	N793 N795 Q796 S950 D951 P955	N793-M957 VanDerWaalsContact ND2-CG 3.27Å; N793-M957 WeakPolarHBondContact ND2-CG 3.32Å; N793-M957 WeakPolarHBondContact O-CE 3.31Å; N795-M957 WeakPolarHBondContact O-CB 3.29Å; N795-M957 WeakPolarHBondContact O-CG 3.42Å; Q796-M957 HydrophobicContact CB-CB 3.93Å; S950-M957 WeakPolarHBondContact CA-O 3.4Å; D951-M957 VanDerWaalsContact CG-N 3.26Å; D951-M957 PolarHBondContact N-O 2.8Å; D951-M957 VanDerWaalsContact N-O 3.17Å; D951-M957 PolarHBondContact OD1-N 2.79Å; D951-M957 WeakPolarHBondContact OD2-CA 3.07Å; D951-M957 WeakPolarHBondContact OD2-CB 3.5Å; D951-M957 PolarHBondContact OD2-N 2.85Å; P955-M957 WeakPolarHBondContact O-CG 3.42Å; P955-M957 PolarHBondContact O-N 3.39Å; P955-M957 VanDerWaalsContact O-N 3.11Å
958	K	76.9	Confident	79.1	Confident	114 Å²	114	45.7 Å²	45.7	50%	0.496	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-146.1	128.6	-174.3	-67.9	-173.2	177.4	179.6	0	109.3	A949 S950	A949-K958 WeakPolarHBondContact O-CA 3.43Å; S950-K958 WeakPolarHBondContact OG-CE 3.37Å
959	I	71.3	Confident	78.4	Confident	17 Å²	17	46.8 Å²	46.8	9%	0.087	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-64.7	143.3	175.2	-148.9	-173.9	0	0	0	110.1	P797 F799 A949 Q961	P797-I959 WeakPolarHBondContact O-CB 3.39Å; P797-I959 VanDerWaalsContact O-CD1 3.28Å; P797-I959 WeakPolarHBondContact O-CD1 2.85Å; P797-I959 VanDerWaalsContact O-CG1 3.27Å; P797-I959 WeakPolarHBondContact O-CG1 3.47Å; F799-I959 HydrophobicContact CB-CD1 4.28Å; F799-I959 HydrophobicContact CD2-CD1 3.85Å; F799-I959 HydrophobicContact CD2-CG2 3.7Å; F799-I959 HydrophobicContact CE2-CG2 3.56Å; F799-I959 HydrophobicContact CG-CD1 4.41Å; A949-I959 HydrophobicContact CB-CG2 3.97Å; A949-I959 PolarHBondContact O-N 2.86Å; I959-Q961 PolarHBondContact O-N 2.98Å; I959-Q961 VanDerWaalsContact O-N 3.14Å
960	D	60.6	Low	77.9	Confident	134 Å²	134	51.4 Å²	51.4	72%	0.717	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-53.5	122.7	166.8	-111.6	-24.3	0	0	0	109.6	K962	D960-K962 PolarHBondContact O-N 2.74Å
961	Q	71.4	Confident	76.7	Confident	68 Å²	68	55.8 Å²	55.8	32%	0.318	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-47.1	134.7	-173.7	-73.2	164	-23.8	0	0	110.3	P808 K946 V947 T948 I959	P808-Q961 WeakPolarHBondContact CD-O 3.29Å; P808-Q961 WeakPolarHBondContact CG-O 3.45Å; K946-Q961 HydrophobicContact CG-CB 4.2Å; K946-Q961 VanDerWaalsContact NZ-CD 3.28Å; V947-Q961 CarbonylContact O-C 3.52Å; V947-Q961 WeakPolarHBondContact O-CA 3.41Å; T948-Q961 HydrophobicContact CG2-CG 3.94Å; T948-Q961 WeakPolarHBondContact OG1-CG 3.5Å; I959-Q961 PolarHBondContact O-N 2.98Å; I959-Q961 VanDerWaalsContact O-N 3.14Å
962	K	79.4	Confident	75.1	Confident	44 Å²	44	59.5 Å²	59.5	19%	0.191	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	167.1	173.9	-50	-66.7	-179.1	178.5	0	110.5	F799 L805 L806 K946 V947 D960	F799-K962 HydrophobicContact CD2-CG 3.65Å; F799-K962 HydrophobicContact CE2-CG 4.02Å; L805-K962 HydrophobicContact CB-CB 3.77Å; L805-K962 HydrophobicContact CB-CG 4.09Å; L805-K962 HydrophobicContact CD1-CB 4.42Å; L805-K962 HydrophobicContact CD2-CB 4.44Å; L805-K962 HydrophobicContact CG-CB 4.43Å; L806-K962 CarbonylContact O-C 3.55Å; L806-K962 VanDerWaalsContact O-CA 3.29Å; L806-K962 WeakPolarHBondContact O-CA 3.18Å; L806-K962 WeakPolarHBondContact O-CB 3.17Å; K946-K962 CarbonylContact C-O 3.41Å; K946-K962 VanDerWaalsContact CA-O 3.3Å; K946-K962 WeakPolarHBondContact CA-O 3.15Å; V947-K962 HydrophobicContact CG2-CB 3.78Å; V947-K962 PolarHBondContact N-O 2.9Å; V947-K962 PolarHBondContact O-N 2.94Å; D960-K962 PolarHBondContact O-N 2.74Å
963	I	77.9	Confident	73.5	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.1	172.5	-63	174	0	0	0	109.3	L805 L806 P808 L813 F906 F944 F945 P965	L805-I963 CarbonylContact C-O 3.4Å; L806-I963 HydrophobicContact CB-CB 4.15Å; L806-I963 WeakPolarHBondContact CB-O 3.36Å; L806-I963 PolarHBondContact N-O 2.75Å; L806-I963 PolarHBondContact O-N 2.66Å; P808-I963 HydrophobicContact CB-CD1 3.87Å; P808-I963 HydrophobicContact CB-CG1 4.18Å; L813-I963 HydrophobicContact CD1-CD1 3.89Å; F906-I963 HydrophobicContact CD1-CD1 4.21Å; F906-I963 HydrophobicContact CE1-CD1 4.03Å; F906-I963 HydrophobicContact CZ-CD1 4.3Å; F944-I963 HydrophobicContact CB-CG2 3.88Å; F944-I963 HydrophobicContact CD1-CG2 3.82Å; F944-I963 HydrophobicContact CG-CG2 4.31Å; F945-I963 CarbonylContact O-C 3.17Å; F945-I963 VanDerWaalsContact O-CA 3.31Å; F945-I963 WeakPolarHBondContact O-CA 3.43Å; I963-P965 WeakPolarHBondContact O-CD 3.32Å
964	L	79.5	Confident	71.9	Confident	3 Å²	3	64 Å²	64	2%	0.016	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	105.6	169.6	-179.6	76.5	0	0	0	108.9	P802 L805 V871 I920 L929 F945 V947	P802-L964 HydrophobicContact CG-CD1 4.06Å; L805-L964 HydrophobicContact CD2-CB 3.89Å; L805-L964 HydrophobicContact CD2-CD1 3.81Å; V871-L964 HydrophobicContact CG2-CD1 3.84Å; I920-L964 HydrophobicContact CD1-CD2 3.84Å; L929-L964 HydrophobicContact CD1-CD1 4.37Å; L929-L964 HydrophobicContact CD1-CD2 3.62Å; L929-L964 HydrophobicContact CD2-CD2 4.11Å; L929-L964 HydrophobicContact CG-CD2 4.49Å; F945-L964 HydrophobicContact CB-CB 4.34Å; F945-L964 HydrophobicContact CB-CD2 4.46Å; F945-L964 PolarHBondContact N-O 2.82Å; F945-L964 PolarHBondContact O-N 3.19Å; V947-L964 HydrophobicContact CG1-CB 4.27Å
965	P	74.3	Confident	70.1	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.013	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131.1	171	32.7	-34.5	0	0	0	110.3	L806 P869 V870 V871 F944 I963	L806-P965 HydrophobicContact CD1-CB 4Å; L806-P965 HydrophobicContact CD1-CG 3.85Å; L806-P965 HydrophobicContact CG-CG 4.12Å; P869-P965 WeakPolarHBondContact O-CG 3.36Å; V870-P965 HydrophobicContact CG1-CB 4.28Å; V870-P965 HydrophobicContact CG2-CB 4.37Å; V870-P965 HydrophobicContact CG2-CG 4.37Å; V871-P965 PolarHBondContact N-O 3.43Å; F944-P965 HydrophobicContact CD1-CB 4.05Å; F944-P965 HydrophobicContact CE1-CB 3.88Å; I963-P965 WeakPolarHBondContact O-CD 3.32Å
966	L	76.3	Confident	67.6	Low	0 Å²	0	58.6 Å²	58.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.1	-178	-178.8	151.3	0	0	0	109.5	V871 L873 L919 I920 Y942 H943 F945 V968	V871-L966 HydrophobicContact CB-CB 4.41Å; V871-L966 HydrophobicContact CB-CG 4.37Å; V871-L966 HydrophobicContact CG1-CD1 4.19Å; V871-L966 HydrophobicContact CG1-CG 4.35Å; V871-L966 CarbonylContact O-C 3.33Å; V871-L966 VanDerWaalsContact O-CA 3.31Å; V871-L966 WeakPolarHBondContact O-CA 3.48Å; L873-L966 HydrophobicContact CD1-CD1 4Å; L873-L966 HydrophobicContact CD1-CD2 3.77Å; L873-L966 HydrophobicContact CD1-CG 4.25Å; L873-L966 HydrophobicContact CD2-CD1 4.45Å; L873-L966 HydrophobicContact CG-CD1 4.02Å; L873-L966 HydrophobicContact CG-CD2 3.82Å; L873-L966 HydrophobicContact CG-CG 3.97Å; L919-L966 HydrophobicContact CD2-CD2 3.75Å; I920-L966 HydrophobicContact CD1-CD1 4.12Å; I920-L966 HydrophobicContact CG2-CD1 4Å; Y942-L966 CarbonylContact C-O 3.56Å; Y942-L966 WeakPolarHBondContact CA-O 3.21Å; H943-L966 HydrophobicContact CB-CD2 4.2Å; H943-L966 PolarHBondContact N-O 2.73Å; H943-L966 PolarHBondContact O-N 2.77Å; F945-L966 HydrophobicContact CD2-CB 4.37Å; F945-L966 HydrophobicContact CE2-CB 4.12Å; F945-L966 HydrophobicContact CE2-CD1 4.09Å; F945-L966 HydrophobicContact CE2-CD2 4.47Å; F945-L966 HydrophobicContact CE2-CG 4.47Å; L966-V968 HydrophobicContact CD2-CG2 3.76Å
967	L	75.9	Confident	65	Low	19 Å²	19	60.2 Å²	60.2	10%	0.099	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118.3	-177.9	168.6	61.8	0	0	0	109.9	V870 V871 R872 L873 G941 Y942 E969	V870-L967 HydrophobicContact CG1-CB 3.52Å; V871-L967 PolarHBondContact O-N 2.85Å; R872-L967 CarbonylContact C-O 3.6Å; R872-L967 WeakPolarHBondContact CA-O 3.34Å; L873-L967 PolarHBondContact N-O 2.78Å; G941-L967 WeakPolarHBondContact O-CA 3.44Å; Y942-L967 HydrophobicContact CD1-CB 4.37Å; Y942-L967 HydrophobicContact CD2-CD1 3.91Å; Y942-L967 HydrophobicContact CE1-CB 4.23Å; Y942-L967 HydrophobicContact CE2-CD1 3.87Å; Y942-L967 HydrophobicContact CE2-CD2 4.38Å; Y942-L967 HydrophobicContact CG-CD1 4.42Å; L967-E969 HydrophobicContact CD1-CG 4.29Å; L967-E969 HydrophobicContact CD2-CG 3.97Å; L967-E969 HydrophobicContact CG-CG 3.73Å
968	V	76.6	Confident	62.7	Low	2 Å²	2	61.5 Å²	61.5	1%	0.012	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	118.7	173.8	-177.5	0	0	0	0	109.4	L873 V875 L919 M935 D939 L940 G941 L966	L873-V968 HydrophobicContact CB-CG2 4.18Å; L873-V968 HydrophobicContact CD1-CG2 4.39Å; V875-V968 HydrophobicContact CG1-CG1 3.5Å; V875-V968 VanDerWaalsContact CG1-CG1 3.5Å; L919-V968 HydrophobicContact CD2-CG2 3.87Å; M935-V968 HydrophobicContact CG-CG1 4.41Å; M935-V968 HydrophobicContact SD-CB 4.24Å; M935-V968 HydrophobicContact SD-CG1 3.46Å; M935-V968 WeakPolarHBondContact SD-CG1 3.28Å; M935-V968 HydrophobicContact SD-CG2 3.7Å; D939-V968 VanDerWaalsContact O-CB 3.23Å; D939-V968 WeakPolarHBondContact O-CB 3.43Å; D939-V968 WeakPolarHBondContact O-CG2 3.5Å; L940-V968 HydrophobicContact CD2-CG1 4.26Å; G941-V968 PolarHBondContact N-O 2.88Å; G941-V968 PolarHBondContact O-N 2.84Å; L966-V968 HydrophobicContact CD2-CG2 3.76Å
969	E	71.7	Confident	60.7	Low	31 Å²	31	63.5 Å²	63.5	15%	0.145	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141	-178.5	-53.3	-162.6	77.9	0	0	112.7	R872 L873 V875 L967 K971 L982	R872-E969 IonicContact CZ-OE2 2.73Å; R872-E969 IonicContact NH1-OE1 3.44Å; R872-E969 IonicContact NH1-OE2 2.94Å; R872-E969 PolarHBondContact NH1-OE2 2.68Å; L873-E969 PolarHBondContact O-N 3.15Å; V875-E969 PolarHBondContact N-O 2.95Å; L967-E969 HydrophobicContact CD1-CG 4.29Å; L967-E969 HydrophobicContact CD2-CG 3.97Å; L967-E969 HydrophobicContact CG-CG 3.73Å; E969-K971 HydrophobicContact CB-CB 4.35Å; E969-K971 HydrophobicContact CB-CD 4.05Å; E969-K971 HydrophobicContact CB-CG 4.23Å; E969-K971 PolarHBondContact O-N 2.94Å; E969-K971 WeakPolarHBondContact OE1-CE 3.36Å; E969-K971 IonicContact OE1-NZ 2.86Å; E969-K971 PolarHBondContact OE1-NZ 3.09Å; E969-K971 IonicContact OE2-NZ 3.49Å; E969-L982 HydrophobicContact CB-CD1 3.97Å
970	D	77	Confident	59	Low	97 Å²	97	64.4 Å²	64.4	52%	0.519	40%	0.403	S	S	.	.			trans	-81	64.6	172	-162	3.9	0	0	0	110.4	V875 L940	V875-D970 WeakPolarHBondContact CG2-OD1 3.45Å; L940-D970 HydrophobicContact CD1-CB 4.01Å; L940-D970 HydrophobicContact CD2-CB 3.7Å
971	K	63.8	Low	58.2	Low	98 Å²	98	59.3 Å²	59.3	43%	0.426	38%	0.378	S	S	.	.			trans	-129.7	107.4	-177.3	-75.6	173.8	-179.4	167.5	0	109	S874 E969 L982	S874-K971 PolarHBondContact OG-O 3.41Å; E969-K971 HydrophobicContact CB-CB 4.35Å; E969-K971 HydrophobicContact CB-CD 4.05Å; E969-K971 HydrophobicContact CB-CG 4.23Å; E969-K971 PolarHBondContact O-N 2.94Å; E969-K971 WeakPolarHBondContact OE1-CE 3.36Å; E969-K971 IonicContact OE1-NZ 2.86Å; E969-K971 PolarHBondContact OE1-NZ 3.09Å; E969-K971 IonicContact OE2-NZ 3.49Å; K971-L982 HydrophobicContact CB-CD1 3.88Å; K971-L982 HydrophobicContact CB-CD2 4.45Å; K971-L982 HydrophobicContact CD-CD1 4.47Å
972	P	56.5	Low	56.9	Low	81 Å²	81	58 Å²	58	53%	0.526	37%	0.373	S	S	.	.			trans	-66	141.1	170.5	27.3	-32.5	0	0	0	109.8	Y876 S974	Y876-P972 HydrophobicContact CD2-CB 3.96Å; Y876-P972 HydrophobicContact CE2-CB 3.71Å; Y876-P972 HydrophobicContact CE2-CG 4.18Å; Y876-P972 HydrophobicContact CG-CB 4.48Å; P972-S974 PolarHBondContact O-N 3.38Å; P972-S974 VanDerWaalsContact O-N 3.15Å
973	A	51.2	Low	55.3	Low	55 Å²	55	57.9 Å²	57.9	46%	0.455	38%	0.377	S	S	.	.			trans	-61.7	116.4	-176.6	0	0	0	0	0	111.5	G975	A973-G975 PolarHBondContact O-N 3.01Å
974	S	45.1	Very low	53.1	Low	131 Å²	131	62.9 Å²	62.9	92%	0.916	41%	0.412	S	S	*	.			trans	-85.2	71	-173	55.8	0	0	0	0	112.7	P972	P972-S974 PolarHBondContact O-N 3.38Å; P972-S974 VanDerWaalsContact O-N 3.15Å
975	G	39.4	Very low	50.9	Low	61 Å²	61	66.7 Å²	66.7	63%	0.629	44%	0.44	S	S	*	.	S	Bend	trans	141.5	127.5	163.1	0	0	0	0	0	116.1	A973	A973-G975 PolarHBondContact O-N 3.01Å
976	G	29.8	Very low	48.9	Very low	66 Å²	66	72 Å²	72	68%	0.68	46%	0.46	S	S	*	.	S	Bend	trans	65.2	98.1	149.1	0	0	0	0	0	119.2
977	L	27.5	Very low	46.6	Very low	185 Å²	185	82.5 Å²	82.5	97%	0.969	50%	0.501	S	S	*	.	S	Bend	trans	41.8	90.8	149.4	-80.9	160.3	0	0	0	117.7
978	G	34.6	Very low	44.2	Very low	82 Å²	82	87.9 Å²	87.9	85%	0.845	54%	0.535	S	S	*	.	S	Bend	trans	100.3	-5.6	152.6	0	0	0	0	0	117.1
979	Q	35.6	Very low	41.8	Very low	157 Å²	157	92.3 Å²	92.3	73%	0.734	57%	0.566	S	S	*	*			trans	-93	113.9	176.6	-64.3	-174.5	-8.1	0	0	111.5
980	S	34.5	Very low	39.8	Very low	35 Å²	35	97.2 Å²	97.2	25%	0.245	59%	0.593	C	S	.	*			trans	-108.4	146.6	165.4	40.7	0	0	0	0	110.2	Q881	Q881-S980 PolarHBondContact NE2-O 3.14Å; Q881-S980 PolarHBondContact OE1-OG 2.8Å
981	S	43.6	Very low	37.4	Very low	28 Å²	28	101.2 Å²	101.2	20%	0.196	61%	0.613	C	S	.	*	S	Bend	trans	93.3	147.6	-167.6	84.3	0	0	0	0	116.3	E877	E877-S981 VanDerWaalsContact CD-CA 3.44Å; E877-S981 WeakPolarHBondContact OE1-CA 3.42Å; E877-S981 WeakPolarHBondContact OE1-CB 3.27Å; E877-S981 WeakPolarHBondContact OE2-CB 3.48Å
982	L	44.8	Very low	35.8	Very low	40 Å²	40	102 Å²	102	21%	0.209	63%	0.626	C	S	.	*	S	Bend	trans	-91	10.3	171.8	-71	154.7	0	0	0	111.4	R872 E969 K971 S984	R872-L982 HydrophobicContact CB-CB 3.83Å; R872-L982 CarbonylContact O-C 3.58Å; R872-L982 WeakPolarHBondContact O-CB 3.35Å; R872-L982 PolarHBondContact O-N 2.68Å; E969-L982 HydrophobicContact CB-CD1 3.97Å; K971-L982 HydrophobicContact CB-CD1 3.88Å; K971-L982 HydrophobicContact CB-CD2 4.45Å; K971-L982 HydrophobicContact CD-CD1 4.47Å; L982-S984 PolarHBondContact O-N 3.25Å
983	S	45.8	Very low	34.5	Very low	41 Å²	41	101.5 Å²	101.5	29%	0.287	64%	0.635	S	S	.	*			trans	-80.9	50.8	-179.6	-159.9	0	0	0	0	111.6	R872 I883	R872-S983 PolarHBondContact O-N 3.44Å; I883-S983 PolarHBondContact O-OG 3.17Å
984	S	32.3	Very low	33.3	Very low	106 Å²	106	106.2 Å²	106.2	74%	0.741	65%	0.652	S	S	*	*			trans	-105	10.1	-177.1	59.7	0	0	0	0	114.4	L982	L982-S984 PolarHBondContact O-N 3.25Å
985	S	32.1	Very low	32.4	Very low	84 Å²	84	103.2 Å²	103.2	59%	0.587	64%	0.642	S	S	*	*	S	Bend	trans	-108.9	22.1	-172.3	60.6	0	0	0	0	115.5
986	Y	32.4	Very low	31.8	Very low	112 Å²	112	107.2 Å²	107.2	44%	0.439	65%	0.648	S	S	.	*	S	Bend	trans	-138.7	24.1	-175.6	-79.6	-72.9	0	0	0	116.2	P869	P869-Y986 WeakPolarHBondContact CB-OH 3.35Å
987	Y	28.7	Very low	31.7	Very low	221 Å²	221	112 Å²	112	87%	0.867	66%	0.658	S	S	*	*			trans	-144.6	69.1	175.2	-84.1	-70.1	0	0	0	114.5
988	V	25.7	Very low	31.7	Very low	133 Å²	133	112 Å²	112	81%	0.806	65%	0.652	S	S	*	*			trans	-147.6	144.3	164.6	-172.4	0	0	0	0	109.7
989	S	26.1	Very low	31.5	Very low	95 Å²	95	120 Å²	120	66%	0.664	66%	0.658	S	S	*	*			trans	61.3	128.7	164.9	47.4	0	0	0	0	118.1
990	N	29.1	Very low	31.2	Very low	134 Å²	134	116 Å²	116	72%	0.717	66%	0.658	S	S	*	*			cis	-143.5	120.2	-0.2	-81.8	-34.6	0	0	0	111.1
991	I	27.3	Very low	31	Very low	181 Å²	181	120.2 Å²	120.2	93%	0.928	68%	0.684	S	S	*	*			trans	-102.7	87.4	159.2	-60.6	176.3	0	0	0	106.7
992	T	29	Very low	30.4	Very low	115 Å²	115	124.6 Å²	124.6	71%	0.706	72%	0.715	S	S	*	*			trans	-148.9	114.5	179	50.3	0	0	0	0	109.8
993	G	29.4	Very low	29.7	Very low	69 Å²	69	126.6 Å²	126.6	71%	0.711	75%	0.745	S	S	*	*			trans	114.6	60.5	-166.1	0	0	0	0	0	110.3
994	L	26.7	Very low	29	Very low	155 Å²	155	128.1 Å²	128.1	81%	0.812	77%	0.767	S	S	*	*				56.9	41	62.7	-78.4	170	0	0	0	114	L996	L994-L996 HydrophobicContact CD2-CD1 4.38Å
995	G	26	Very low	29	Very low	68 Å²	68	134 Å²	134	70%	0.701	77%	0.773	S	S	*	*			trans	-83	129.3	143.6	0	0	0	0	0	109.2
996	L	27.8	Very low	29	Very low	145 Å²	145	136.5 Å²	136.5	76%	0.759	78%	0.78	S	S	*	*			trans	-114.3	68.2	-174.7	-95.5	167.7	0	0	0	110.6	L994	L994-L996 HydrophobicContact CD2-CD1 4.38Å
997	D	27.7	Very low	29.2	Very low	167 Å²	167	137.2 Å²	137.2	89%	0.893	79%	0.79	S	S	*	*			trans	-127.5	37.8	-178.1	-77	-59.6	0	0	0	112.8
998	E	27.5	Very low	29.6	Very low	183 Å²	183	133.4 Å²	133.4	86%	0.855	78%	0.784	S	S	*	*			trans	-143.5	80.4	179.9	-162.4	173.9	-131.3	0	0	113.9
999	W	29.4	Very low	30.4	Very low	252 Å²	252	133.2 Å²	133.2	96%	0.955	78%	0.777	S	S	*	*			trans	-135.8	52.4	166.7	-102.4	77.2	0	0	0	113.4
1000	G	28.7	Very low	31.2	Very low	72 Å²	72	134.6 Å²	134.6	74%	0.742	78%	0.776	S	S	*	*			trans	55.6	-156.1	146.9	0	0	0	0	0	119.4
1001	P	30.9	Very low	31.7	Very low	123 Å²	123	131.3 Å²	131.3	80%	0.799	76%	0.761	S	S	*	*				-125.9	167.3	-55.5	38.1	-32.8	0	0	0	113
1002	S	30.2	Very low	32.5	Very low	121 Å²	121	125.7 Å²	125.7	85%	0.846	74%	0.742	S	S	*	*			trans	-56.7	140.6	157.1	45.2	0	0	0	0	110.3
1003	G	31	Very low	33.2	Very low	81 Å²	81	126.2 Å²	126.2	84%	0.835	74%	0.739	S	S	*	*	S	Bend	trans	126.5	40.2	173.1	0	0	0	0	0	119
1004	G	30.4	Very low	34	Very low	73 Å²	73	125.8 Å²	125.8	75%	0.753	73%	0.725	S	S	*	*			trans	88.6	166.7	148.1	0	0	0	0	0	119.5
1005	R	32	Very low	34.9	Very low	230 Å²	230	123.3 Å²	123.3	87%	0.868	71%	0.712	S	S	*	*			trans	65.3	63	176.5	-61.4	-178	172	175.4	-1.8	117.7	I1007	R1005-I1007 PolarHBondContact O-N 2.99Å
1006	N	32.2	Very low	36	Very low	136 Å²	136	124 Å²	124	73%	0.727	70%	0.702	S	S	*	*			trans	-91.5	40.6	147	-99.3	-40.2	0	0	0	112.5	L1008	N1006-L1008 VanDerWaalsContact C-N 3.33Å; N1006-L1008 PolarHBondContact O-N 2.94Å; N1006-L1008 VanDerWaalsContact O-N 3.1Å
1007	I	36.9	Very low	37.1	Very low	128 Å²	128	121 Å²	121	66%	0.656	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	81.1	170.1	-55	172.6	0	0	0	108	R1005	R1005-I1007 PolarHBondContact O-N 2.99Å
1008	L	37.2	Very low	38.3	Very low	140 Å²	140	114.8 Å²	114.8	73%	0.733	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-168.2	-32	149.6	-133.2	82.3	0	0	0	113.4	N1006 T1011	N1006-L1008 VanDerWaalsContact C-N 3.33Å; N1006-L1008 PolarHBondContact O-N 2.94Å; N1006-L1008 VanDerWaalsContact O-N 3.1Å; L1008-T1011 VanDerWaalsContact CA-OG1 3.24Å; L1008-T1011 WeakPolarHBondContact CA-OG1 3.45Å; L1008-T1011 PolarHBondContact O-OG1 2.97Å
1009	I	42.4	Very low	39.5	Very low	130 Å²	130	110.8 Å²	110.8	67%	0.667	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-40.5	-170.3	-63.8	177.3	0	0	0	112	T1011 A1012	I1009-T1011 VanDerWaalsContact C-N 3.27Å; I1009-T1011 PolarHBondContact O-N 3.31Å; I1009-A1012 PolarHBondContact O-N 3.28Å
1010	I	42.4	Very low	40.6	Very low	123 Å²	123	103.6 Å²	103.6	63%	0.631	63%	0.632	S	S	*	*	H	α-helix	trans	-69.4	-28.6	174.7	-65.1	175.6	0	0	0	111.2	A1012 L1013 S1014	I1010-A1012 PolarHBondContact O-N 3.04Å; I1010-L1013 PolarHBondContact O-N 3.28Å; I1010-L1013 VanDerWaalsContact O-N 3.17Å; I1010-S1014 WeakPolarHBondContact O-CB 3.33Å; I1010-S1014 PolarHBondContact O-N 3.16Å; I1010-S1014 PolarHBondContact O-OG 3.11Å
1011	T	41.4	Very low	41.7	Very low	65 Å²	65	102.1 Å²	102.1	40%	0.399	61%	0.613	S	S	.	*	H	α-helix	trans	-68.4	-10.6	176.2	39.1	0	0	0	0	115	L1008 I1009 I1015	L1008-T1011 VanDerWaalsContact CA-OG1 3.24Å; L1008-T1011 WeakPolarHBondContact CA-OG1 3.45Å; L1008-T1011 PolarHBondContact O-OG1 2.97Å; I1009-T1011 VanDerWaalsContact C-N 3.27Å; I1009-T1011 PolarHBondContact O-N 3.31Å; T1011-I1015 VanDerWaalsContact O-CD1 3.26Å; T1011-I1015 WeakPolarHBondContact O-CD1 3.38Å; T1011-I1015 WeakPolarHBondContact O-CG1 3.48Å
1012	A	43.3	Very low	42.9	Very low	64 Å²	64	99 Å²	99	53%	0.529	60%	0.597	S	S	.	*	H	α-helix	trans	-86.6	-29.2	171.1	0	0	0	0	0	112.6	I1009 I1010	I1009-A1012 PolarHBondContact O-N 3.28Å; I1010-A1012 PolarHBondContact O-N 3.04Å
1013	L	43.3	Very low	44	Very low	125 Å²	125	98 Å²	98	65%	0.654	58%	0.582	S	S	*	*	H	α-helix	trans	-97.8	-27.2	-178.5	-69.8	170	0	0	0	112.8	I1010 I1015 V1016 S1017	I1010-L1013 PolarHBondContact O-N 3.28Å; I1010-L1013 VanDerWaalsContact O-N 3.17Å; L1013-I1015 PolarHBondContact O-N 3.01Å; L1013-V1016 PolarHBondContact O-N 3.43Å; L1013-S1017 WeakPolarHBondContact O-CB 3.48Å; L1013-S1017 PolarHBondContact O-N 3.39Å
1014	S	46.5	Very low	45	Very low	60 Å²	60	99.5 Å²	99.5	42%	0.42	57%	0.57	S	S	.	*	H	α-helix	trans	-68	-23	171.2	69.1	0	0	0	0	113.1	I1010 G1018	I1010-S1014 WeakPolarHBondContact O-CB 3.33Å; I1010-S1014 PolarHBondContact O-N 3.16Å; I1010-S1014 PolarHBondContact O-OG 3.11Å; S1014-G1018 WeakPolarHBondContact O-CA 3.43Å; S1014-G1018 PolarHBondContact O-N 3.39Å
1015	I	46.1	Very low	46.1	Very low	103 Å²	103	101.2 Å²	101.2	53%	0.528	56%	0.561	S	S	.	*	H	α-helix	trans	-73.6	-38.4	172.3	-67.2	175.6	0	0	0	110.9	T1011 L1013 I1019	T1011-I1015 VanDerWaalsContact O-CD1 3.26Å; T1011-I1015 WeakPolarHBondContact O-CD1 3.38Å; T1011-I1015 WeakPolarHBondContact O-CG1 3.48Å; L1013-I1015 PolarHBondContact O-N 3.01Å; I1015-I1019 HydrophobicContact CG2-CD1 3.75Å; I1015-I1019 HydrophobicContact CG2-CG1 4.5Å; I1015-I1019 VanDerWaalsContact O-CB 3.31Å; I1015-I1019 WeakPolarHBondContact O-CB 3.45Å; I1015-I1019 VanDerWaalsContact O-CG1 3.25Å; I1015-I1019 WeakPolarHBondContact O-CG1 3.46Å; I1015-I1019 PolarHBondContact O-N 2.9Å
1016	V	47.9	Very low	47.1	Very low	83 Å²	83	93.8 Å²	93.8	50%	0.503	54%	0.544	S	S	.	.	H	α-helix	trans	-71.4	-44.3	175.9	-179.4	0	0	0	0	110.9	L1013 L1020	L1013-V1016 PolarHBondContact O-N 3.43Å; V1016-L1020 HydrophobicContact CG1-CD1 4.19Å; V1016-L1020 WeakPolarHBondContact O-CB 3.09Å; V1016-L1020 PolarHBondContact O-N 3.35Å
1017	S	52.6	Low	47.6	Very low	82 Å²	82	90.2 Å²	90.2	57%	0.573	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-44.7	173.7	-175.1	0	0	0	0	111.8	L1013 L1020 A1021	L1013-S1017 WeakPolarHBondContact O-CB 3.48Å; L1013-S1017 PolarHBondContact O-N 3.39Å; S1017-L1020 PolarHBondContact O-N 3.06Å; S1017-A1021 WeakPolarHBondContact O-CB 3.23Å; S1017-A1021 PolarHBondContact O-N 2.88Å
1018	G	52.1	Low	48.2	Very low	37 Å²	37	89.2 Å²	89.2	38%	0.381	53%	0.533	S	S	.	.	H	α-helix	trans	-66.7	-36.9	179.3	0	0	0	0	0	114	S1014 A1022	S1014-G1018 WeakPolarHBondContact O-CA 3.43Å; S1014-G1018 PolarHBondContact O-N 3.39Å; G1018-A1022 WeakPolarHBondContact O-CB 3.42Å; G1018-A1022 PolarHBondContact O-N 2.7Å
1019	I	52.4	Low	48.6	Very low	98 Å²	98	90.4 Å²	90.4	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-75.1	-37.7	176.1	-69.5	171.5	0	0	0	111.1	I1015 A1022 I1023	I1015-I1019 HydrophobicContact CG2-CD1 3.75Å; I1015-I1019 HydrophobicContact CG2-CG1 4.5Å; I1015-I1019 VanDerWaalsContact O-CB 3.31Å; I1015-I1019 WeakPolarHBondContact O-CB 3.45Å; I1015-I1019 VanDerWaalsContact O-CG1 3.25Å; I1015-I1019 WeakPolarHBondContact O-CG1 3.46Å; I1015-I1019 PolarHBondContact O-N 2.9Å; I1019-A1022 PolarHBondContact O-N 3.06Å; I1019-I1023 HydrophobicContact CG2-CD1 3.73Å; I1019-I1023 HydrophobicContact CG2-CG1 4.42Å; I1019-I1023 WeakPolarHBondContact O-CB 3.36Å; I1019-I1023 VanDerWaalsContact O-CG1 3.22Å; I1019-I1023 WeakPolarHBondContact O-CG1 3.5Å; I1019-I1023 PolarHBondContact O-N 2.78Å
1020	L	51.7	Low	48.5	Very low	101 Å²	101	89.4 Å²	89.4	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-68	-39.7	172.4	-86	160.8	0	0	0	112.3	V1016 S1017 I1023 L1024	V1016-L1020 HydrophobicContact CG1-CD1 4.19Å; V1016-L1020 WeakPolarHBondContact O-CB 3.09Å; V1016-L1020 PolarHBondContact O-N 3.35Å; S1017-L1020 PolarHBondContact O-N 3.06Å; L1020-I1023 PolarHBondContact O-N 2.86Å; L1020-L1024 WeakPolarHBondContact O-CB 3.27Å; L1020-L1024 VanDerWaalsContact O-CG 3.28Å; L1020-L1024 WeakPolarHBondContact O-CG 3.5Å; L1020-L1024 PolarHBondContact O-N 3.22Å
1021	A	53.5	Low	48.3	Very low	41 Å²	41	88.5 Å²	88.5	34%	0.339	54%	0.536	S	S	.	.	H	α-helix	trans	-63	-43.5	172.1	0	0	0	0	0	111.5	S1017 I1023 L1024 I1025	S1017-A1021 WeakPolarHBondContact O-CB 3.23Å; S1017-A1021 PolarHBondContact O-N 2.88Å; A1021-I1023 PolarHBondContact O-N 2.86Å; A1021-L1024 PolarHBondContact O-N 2.89Å; A1021-I1025 VanDerWaalsContact O-CB 3.28Å; A1021-I1025 WeakPolarHBondContact O-CB 3.36Å; A1021-I1025 WeakPolarHBondContact O-CG1 3.38Å; A1021-I1025 PolarHBondContact O-N 2.71Å
1022	A	54.4	Low	48.6	Very low	57 Å²	57	91.4 Å²	91.4	47%	0.471	55%	0.554	S	S	.	*	H	α-helix	trans	-65	-36.9	176	0	0	0	0	0	112.7	G1018 I1019 S1026	G1018-A1022 WeakPolarHBondContact O-CB 3.42Å; G1018-A1022 PolarHBondContact O-N 2.7Å; I1019-A1022 PolarHBondContact O-N 3.06Å; A1022-S1026 VanDerWaalsContact O-CB 3.28Å; A1022-S1026 WeakPolarHBondContact O-CB 3.23Å; A1022-S1026 PolarHBondContact O-N 3.4Å; A1022-S1026 PolarHBondContact O-OG 2.94Å
1023	I	53.5	Low	48.2	Very low	101 Å²	101	97.6 Å²	97.6	52%	0.518	57%	0.569	S	S	.	*	H	α-helix	trans	-71.6	-38	175.6	-71.4	169.4	0	0	0	111.3	I1019 L1020 A1021 S1026 A1027	I1019-I1023 HydrophobicContact CG2-CD1 3.73Å; I1019-I1023 HydrophobicContact CG2-CG1 4.42Å; I1019-I1023 WeakPolarHBondContact O-CB 3.36Å; I1019-I1023 VanDerWaalsContact O-CG1 3.22Å; I1019-I1023 WeakPolarHBondContact O-CG1 3.5Å; I1019-I1023 PolarHBondContact O-N 2.78Å; L1020-I1023 PolarHBondContact O-N 2.86Å; A1021-I1023 PolarHBondContact O-N 2.86Å; I1023-S1026 WeakPolarHBondContact CA-OG 3.23Å; I1023-S1026 PolarHBondContact O-OG 2.81Å; I1023-A1027 VanDerWaalsContact O-CB 3.25Å; I1023-A1027 WeakPolarHBondContact O-CB 3.48Å; I1023-A1027 PolarHBondContact O-N 2.93Å
1024	L	53.4	Low	47.8	Very low	113 Å²	113	97.1 Å²	97.1	59%	0.592	57%	0.573	S	S	*	*	H	α-helix	trans	-71	-42	175.6	-73.1	166.4	0	0	0	112	L1020 A1021 A1027 V1028	L1020-L1024 WeakPolarHBondContact O-CB 3.27Å; L1020-L1024 VanDerWaalsContact O-CG 3.28Å; L1020-L1024 WeakPolarHBondContact O-CG 3.5Å; L1020-L1024 PolarHBondContact O-N 3.22Å; A1021-L1024 PolarHBondContact O-N 2.89Å; L1024-A1027 PolarHBondContact O-N 3.49Å; L1024-V1028 WeakPolarHBondContact O-CG2 3.25Å; L1024-V1028 PolarHBondContact O-N 3.13Å
1025	I	53.9	Low	47.2	Very low	109 Å²	109	99.9 Å²	99.9	56%	0.559	59%	0.591	S	S	*	*	H	α-helix	trans	-68.2	-37.3	177.4	-67.9	166.7	0	0	0	110.9	A1021 V1028 F1029	A1021-I1025 VanDerWaalsContact O-CB 3.28Å; A1021-I1025 WeakPolarHBondContact O-CB 3.36Å; A1021-I1025 WeakPolarHBondContact O-CG1 3.38Å; A1021-I1025 PolarHBondContact O-N 2.71Å; I1025-V1028 PolarHBondContact O-N 3.04Å; I1025-F1029 PolarHBondContact O-N 2.79Å
1026	S	51.4	Low	46.6	Very low	74 Å²	74	99.9 Å²	99.9	52%	0.517	60%	0.6	S	S	.	*	H	α-helix	trans	-75.5	-19.4	172.8	58	0	0	0	0	114.3	A1022 I1023	A1022-S1026 VanDerWaalsContact O-CB 3.28Å; A1022-S1026 WeakPolarHBondContact O-CB 3.23Å; A1022-S1026 PolarHBondContact O-N 3.4Å; A1022-S1026 PolarHBondContact O-OG 2.94Å; I1023-S1026 WeakPolarHBondContact CA-OG 3.23Å; I1023-S1026 PolarHBondContact O-OG 2.81Å
1027	A	43.9	Very low	46	Very low	60 Å²	60	106 Å²	106	50%	0.496	61%	0.614	S	S	.	*	H	α-helix	trans	-77.6	-35.4	168.3	0	0	0	0	0	112.6	I1023 L1024	I1023-A1027 VanDerWaalsContact O-CB 3.25Å; I1023-A1027 WeakPolarHBondContact O-CB 3.48Å; I1023-A1027 PolarHBondContact O-N 2.93Å; L1024-A1027 PolarHBondContact O-N 3.49Å
1028	V	48.4	Very low	45.1	Very low	107 Å²	107	108.8 Å²	108.8	65%	0.648	62%	0.622	S	S	*	*	H	α-helix	trans	-73.8	-39.1	177	171.6	0	0	0	0	111.6	L1024 I1025 C1030	L1024-V1028 WeakPolarHBondContact O-CG2 3.25Å; L1024-V1028 PolarHBondContact O-N 3.13Å; I1025-V1028 PolarHBondContact O-N 3.04Å; V1028-C1030 PolarHBondContact O-N 3.47Å
1029	F	46.8	Very low	44.2	Very low	166 Å²	166	117.8 Å²	117.8	73%	0.728	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	33	177.3	-95.6	-88.7	0	0	0	115.3	I1025	I1025-F1029 PolarHBondContact O-N 2.79Å
1030	C	38.9	Very low	43.3	Very low	109 Å²	109	121.7 Å²	121.7	74%	0.736	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.9	19.3	171.4	-89.7	0	0	0	0	114.1	V1028	V1028-C1030 PolarHBondContact O-N 3.47Å
1031	V	39.6	Very low	42.4	Very low	103 Å²	103	119.9 Å²	119.9	62%	0.624	67%	0.666	S	S	*	*			trans	-111.2	43.4	173	-163.3	0	0	0	0	112.3
1032	T	47.3	Very low	41.5	Very low	127 Å²	127	125.2 Å²	125.2	78%	0.779	69%	0.69	S	S	*	*	S	Bend	trans	-138.6	96.4	165.2	46.3	0	0	0	0	107.8
1033	K	34.2	Very low	40.1	Very low	194 Å²	194	133.4 Å²	133.4	84%	0.843	71%	0.708	S	S	*	*	S	Bend	cis	-126.8	134.4	30.6	-58.5	154.6	-175	172.8	0	109.9	C1035	K1033-C1035 PolarHBondContact O-N 2.73Å
1034	P	35.7	Very low	38.9	Very low	115 Å²	115	134.2 Å²	134.2	75%	0.747	72%	0.722	S	S	*	*			trans	-80.1	74.6	-166.5	32.6	-37.4	0	0	0	113.7
1035	C	33.6	Very low	38	Very low	117 Å²	117	135.4 Å²	135.4	79%	0.791	73%	0.733	S	S	*	*			trans	-124.1	103.1	-176.5	-101.4	0	0	0	0	115.1	K1033	K1033-C1035 PolarHBondContact O-N 2.73Å
1036	S	32.7	Very low	36.8	Very low	104 Å²	104	138 Å²	138	73%	0.727	75%	0.748	S	S	*	*				81.7	127.1	129.9	-146.1	0	0	0	0	121.2
1037	R	35	Very low	36	Very low	212 Å²	212	137.8 Å²	137.8	80%	0.8	76%	0.758	S	S	*	*			trans	91.3	106.2	148.5	-76.8	173.4	169.4	-174.7	-3.1	122.3
1038	N	35.6	Very low	35.2	Very low	139 Å²	139	145.4 Å²	145.4	74%	0.743	77%	0.774	S	S	*	*				69.5	123.1	119.3	-59.8	0.8	0	0	0	120.2
1039	R	32.9	Very low	34.5	Very low	226 Å²	226	146.9 Å²	146.9	85%	0.853	77%	0.774	S	S	*	*				-162.7	142.8	113.5	-112.8	167.1	-168.4	-160.2	2.1	114.7
1040	H	33.5	Very low	33.9	Very low	180 Å²	180	145.3 Å²	145.3	83%	0.833	77%	0.772	S	S	*	*			trans	72	127.8	170.1	-57.1	98	0	0	0	120.2
1041	G	31.6	Very low	33.5	Very low	63 Å²	63	150.6 Å²	150.6	65%	0.649	78%	0.777	S	S	*	*			trans	106.3	98.2	130.1	0	0	0	0	0	118.6
1042	N	35.4	Very low	33.3	Very low	154 Å²	154	153.5 Å²	153.5	82%	0.824	79%	0.788	S	S	*	*			trans	54.6	122.5	146.9	-53.7	-19.4	0	0	0	118.7
1043	R	26	Very low	32.5	Very low	229 Å²	229	158 Å²	158	86%	0.864	79%	0.791	S	S	*	*			cis	69.6	114	38.6	-152.5	-168.6	-152	-169.6	8.3	113.1
1044	C	27.5	Very low	32.7	Very low	118 Å²	118	156.1 Å²	156.1	80%	0.797	79%	0.79	S	S	*	*			trans	70.6	159.1	-179.8	-53.2	0	0	0	0	113.4
1045	V	35.3	Very low	32.6	Very low	138 Å²	138	162.3 Å²	162.3	84%	0.836	80%	0.798	S	S	*	*			cis	-140	155	29.8	172.4	0	0	0	0	113
1046	N	28.3	Very low	32.8	Very low	162 Å²	162	161.3 Å²	161.3	87%	0.866	79%	0.791	S	S	*	*			trans	-76.6	149.6	176.1	-66.5	-64	0	0	0	114.4
1047	G	33.3	Very low	33.2	Very low	71 Å²	71	161.9 Å²	161.9	73%	0.732	79%	0.792	S	S	*	*			trans	166.5	101.3	164.8	0	0	0	0	0	110.4
1048	R	28	Very low	33.3	Very low	219 Å²	219	156.8 Å²	156.8	83%	0.826	79%	0.785	S	S	*	*			cis	72.7	131.2	33.5	-147.6	-171.2	-152.5	-166	9.2	112.6
1049	H	32.7	Very low	33.5	Very low	139 Å²	139	160.9 Å²	160.9	64%	0.644	79%	0.791	S	S	*	*			trans	80.7	133.7	-175.4	-62.8	-86.9	0	0	0	114.9
1050	N	36	Very low	33.9	Very low	132 Å²	132	155.9 Å²	155.9	71%	0.706	79%	0.788	S	S	*	*			cis	-131.1	143.6	-3.1	-77.8	-51.3	0	0	0	109.3
1051	R	29.4	Very low	34	Very low	220 Å²	220	149.9 Å²	149.9	83%	0.83	78%	0.775	S	S	*	*				61.8	101.5	58.5	-86.7	-168.3	172.4	-173.1	-0.1	115.2
1052	L	35.1	Very low	34.4	Very low	165 Å²	165	149 Å²	149	86%	0.864	77%	0.765	S	S	*	*			trans	-177.1	94.4	141.3	-96.8	163.5	0	0	0	107
1053	R	31.8	Very low	34.9	Very low	222 Å²	222	143.9 Å²	143.9	84%	0.838	74%	0.741	S	S	*	*				64.9	107	87.5	-83.7	-169.4	167.3	-172.6	-2.9	115.9
1054	N	37.2	Very low	35.5	Very low	154 Å²	154	139 Å²	139	82%	0.824	73%	0.732	S	S	*	*				168.1	102.2	122.9	-81.1	-15.2	0	0	0	107.6
1055	R	33.6	Very low	36	Very low	244 Å²	244	137.2 Å²	137.2	92%	0.921	72%	0.721	S	S	*	*				92.6	144.7	63.6	-92.9	-151.7	162.2	-167.9	-5.6	114.1
1056	P	38.5	Very low	36	Very low	97 Å²	97	137.7 Å²	137.7	63%	0.63	72%	0.718	S	S	*	*			trans	-133.9	-171.1	-150.5	44.2	-26.1	0	0	0	115.2	T1058	P1056-T1058 HydrophobicContact CG-CG2 4.42Å
1057	P	40.4	Very low	36.4	Very low	116 Å²	116	137 Å²	137	75%	0.753	72%	0.715	S	S	*	*			trans	-125	142.7	135.5	36.1	-25.7	0	0	0	111.1
1058	T	37.1	Very low	36.4	Very low	105 Å²	105	137.4 Å²	137.4	64%	0.644	72%	0.719	S	S	*	*			cis	71.3	105.7	25.1	71.7	0	0	0	0	117.4	P1056	P1056-T1058 HydrophobicContact CG-CG2 4.42Å
1059	Y	39.4	Very low	36.6	Very low	225 Å²	225	133.9 Å²	133.9	88%	0.882	72%	0.715	S	S	*	*				-172	165.9	128.4	-98.1	-55.9	0	0	0	109.6
1060	P	41.2	Very low	36.7	Very low	120 Å²	120	135.8 Å²	135.8	78%	0.779	73%	0.729	S	S	*	*				-133.8	172.3	-119.6	44.5	-29	0	0	0	117.8
1061	G	36.2	Very low	36.6	Very low	55 Å²	55	135.4 Å²	135.4	57%	0.567	73%	0.731	S	S	*	*			trans	169.2	133.2	148.8	0	0	0	0	0	115.7	M1291	G1061-M1291 WeakPolarHBondContact CA-SD 3.06Å
1062	G	39.5	Very low	36.9	Very low	43 Å²	43	131.7 Å²	131.7	44%	0.443	73%	0.728	S	S	.	*			trans	149.9	113.7	161.9	0	0	0	0	0	117.5	Q1290 M1291	G1062-Q1290 WeakPolarHBondContact CA-O 3.4Å; G1062-M1291 PolarHBondContact N-SD 3.32Å
1063	P	46.4	Very low	36.8	Very low	47 Å²	47	131.9 Å²	131.9	31%	0.305	72%	0.724	S	S	.	*			trans	-133.8	158.6	167.4	40.8	-27.7	0	0	0	116.5	Q1290 M1291	P1063-Q1290 VanDerWaalsContact O-CG 3.26Å; P1063-Q1290 WeakPolarHBondContact O-CG 3.48Å; P1063-Q1290 PolarHBondContact O-NE2 2.94Å; P1063-Q1290 PolarHBondContact O-OE1 2.76Å; P1063-M1291 HydrophobicContact CG-CE 4.31Å; P1063-M1291 HydrophobicContact CG-CG 4.49Å
1064	D	39	Very low	37	Very low	128 Å²	128	128.8 Å²	128.8	68%	0.684	73%	0.725	S	S	*	*			trans	73	101.9	159.9	-53.1	-29.7	0	0	0	119	Q1290	D1064-Q1290 VanDerWaalsContact C-NE2 3.3Å; D1064-Q1290 PolarHBondContact O-NE2 3.39Å
1065	S	37.4	Very low	36.7	Very low	80 Å²	80	125.7 Å²	125.7	56%	0.559	73%	0.729	S	S	*	*			cis	84.8	123.1	6.5	115.6	0	0	0	0	118.9
1066	N	36.6	Very low	36.8	Very low	147 Å²	147	119.1 Å²	119.1	79%	0.786	72%	0.72	S	S	*	*			trans	175.3	124.8	144.1	-89.7	-44	0	0	0	108.1
1067	N	36.3	Very low	36.4	Very low	148 Å²	148	124.5 Å²	124.5	79%	0.791	73%	0.734	S	S	*	*			cis	87.1	122.8	42.5	-73.4	-38.1	0	0	0	115.1
1068	G	33.6	Very low	36.1	Very low	80 Å²	80	126.4 Å²	126.4	83%	0.825	74%	0.736	S	S	*	*			trans	-178.9	89.8	175.2	0	0	0	0	0	112.7
1069	I	31.5	Very low	35.8	Very low	145 Å²	145	129.1 Å²	129.1	74%	0.744	75%	0.747	S	S	*	*			trans	-117.7	138.4	175.1	-67.8	172.6	0	0	0	108.9	V1071	I1069-V1071 HydrophobicContact CG2-CG2 3.94Å
1070	L	35.6	Very low	35.3	Very low	178 Å²	178	121.3 Å²	121.3	93%	0.932	74%	0.735	S	S	*	*			trans	-132.6	156.2	159.2	-77.7	178.7	0	0	0	111
1071	V	33.6	Very low	34.7	Very low	124 Å²	124	122 Å²	122	75%	0.752	74%	0.738	S	S	*	*			trans	-150.4	130.6	-168.7	174.4	0	0	0	0	109.6	I1069	I1069-V1071 HydrophobicContact CG2-CG2 3.94Å
1072	D	36	Very low	34.3	Very low	143 Å²	143	127.1 Å²	127.1	77%	0.765	75%	0.748	S	S	*	*			trans	-150	134	141.2	63.2	20.1	0	0	0	110.1
1073	E	32	Very low	33.7	Very low	169 Å²	169	131.3 Å²	131.3	79%	0.79	76%	0.757	S	S	*	*				62.2	78.4	102.2	-55	-165.4	-177.4	0	0	117.2
1074	N	35.2	Very low	32.9	Very low	157 Å²	157	136 Å²	136	84%	0.84	77%	0.774	S	S	*	*				169.1	86.7	119.4	-89.7	-63.1	0	0	0	111.7	S1076	N1074-S1076 PolarHBondContact O-N 2.65Å
1075	G	32.1	Very low	32.5	Very low	89 Å²	89	138.2 Å²	138.2	92%	0.918	78%	0.781	S	S	*	*			trans	-72.4	118.7	-176.9	0	0	0	0	0	114.3
1076	S	35.3	Very low	32.3	Very low	105 Å²	105	137.5 Å²	137.5	73%	0.734	79%	0.785	S	S	*	*			trans	-151	148.6	162.8	69	0	0	0	0	112.5	N1074	N1074-S1076 PolarHBondContact O-N 2.65Å
1077	F	31	Very low	32.3	Very low	210 Å²	210	140.9 Å²	140.9	92%	0.921	79%	0.789	S	S	*	*			trans	-93	136.3	171.7	-83	-107.8	0	0	0	110
1078	I	33.2	Very low	32.6	Very low	156 Å²	156	138.8 Å²	138.8	80%	0.8	78%	0.783	S	S	*	*			trans	-139.4	137.3	162.6	-59.2	-176.6	0	0	0	110
1079	N	29.7	Very low	32.7	Very low	162 Å²	162	140.8 Å²	140.8	87%	0.866	78%	0.779	S	S	*	*			trans	-94.2	137.7	169.7	-76.6	-27.5	0	0	0	110.9
1080	G	30.7	Very low	33	Very low	62 Å²	62	138.8 Å²	138.8	64%	0.639	78%	0.778	S	S	*	*			trans	174.2	138.6	163.1	0	0	0	0	0	109.3
1081	T	28.2	Very low	33.1	Very low	135 Å²	135	137 Å²	137	83%	0.828	77%	0.769	S	S	*	*			cis	67.2	131.5	34.1	76.5	0	0	0	0	115
1082	M	27.5	Very low	33.2	Very low	161 Å²	161	134.6 Å²	134.6	79%	0.793	77%	0.77	S	S	*	*			trans	69.3	156.8	173.7	-70	176.7	74.1	0	0	116.4
1083	E	27.5	Very low	33.2	Very low	132 Å²	132	132.5 Å²	132.5	62%	0.617	77%	0.767	S	S	*	*			cis	-170.1	144.3	-38.6	-121.1	-166.9	125.7	0	0	109.9
1084	Q	29.4	Very low	33.4	Very low	144 Å²	144	133 Å²	133	67%	0.673	77%	0.768	S	S	*	*			trans	59.7	168.3	151.8	-58.8	-173.2	25.9	0	0	122
1085	Q	30.3	Very low	33.5	Very low	176 Å²	176	133 Å²	133	82%	0.822	76%	0.763	S	S	*	*			trans	79.2	116.7	161	-48.1	-170.1	8.6	0	0	118.1
1086	G	32.5	Very low	33.7	Very low	64 Å²	64	135.4 Å²	135.4	66%	0.66	76%	0.76	S	S	*	*			cis	163.5	168.9	-14.2	0	0	0	0	0	116.2
1087	Y	38	Very low	33.6	Very low	219 Å²	219	135.2 Å²	135.2	86%	0.859	76%	0.755	S	S	*	*			trans	73.6	155.9	160.6	-63.6	-73	0	0	0	119.5
1088	P	41.1	Very low	33.7	Very low	103 Å²	103	135.6 Å²	135.6	67%	0.669	76%	0.757	S	S	*	*			cis	-137.5	140.5	-16.1	28.1	-6.6	0	0	0	117.3
1089	V	37.3	Very low	33.8	Very low	123 Å²	123	135.6 Å²	135.6	75%	0.745	75%	0.753	S	S	*	*			trans	66.1	136	133.5	179.3	0	0	0	0	117.4
1090	S	37.8	Very low	33.9	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	75%	0.753	S	S	*	*			cis	-158.6	172.3	30.4	109.4	0	0	0	0	110.4
1091	N	36.6	Very low	34.3	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	76%	0.758	S	S	*	*			cis	-176.9	154.9	-23.8	-98.1	-6.8	0	0	0	108.8
1092	G	35.8	Very low	34.8	Very low	75 Å²	75	141.3 Å²	141.3	77%	0.773	76%	0.76	S	S	*	*			trans	94.6	143.4	152	0	0	0	0	0	119
1093	S	35.6	Very low	35.2	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	76%	0.758	S	S	*	*				177.2	136.7	-64.6	53.5	0	0	0	0	111.7
1094	H	37.4	Very low	35.7	Very low	178 Å²	178	136.7 Å²	136.7	82%	0.824	77%	0.767	S	S	*	*			trans	173.4	107.8	145.9	-92	-64.7	0	0	0	107.3
1095	H	36.3	Very low	36.2	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.727	78%	0.777	S	S	*	*				54.1	132.3	83.9	-72.9	-70.3	0	0	0	114.2
1096	T	36.5	Very low	36.2	Very low	140 Å²	140	137.1 Å²	137.1	86%	0.859	78%	0.779	S	S	*	*			cis	-135.8	176.4	39.5	49.8	0	0	0	0	115.9
1097	T	33.1	Very low	36.3	Very low	101 Å²	101	138 Å²	138	62%	0.62	79%	0.787	S	S	*	*			trans	-130.5	158.1	-171.2	47.2	0	0	0	0	112.9
1098	F	33.4	Very low	36	Very low	219 Å²	219	135.1 Å²	135.1	96%	0.961	79%	0.786	S	S	*	*			trans	-138.8	155.7	155.6	-105	-83.4	0	0	0	112
1099	H	35.3	Very low	35.5	Very low	155 Å²	155	135.8 Å²	135.8	72%	0.718	79%	0.788	S	S	*	*			trans	-117.6	144.4	-164.7	-77.4	-83.8	0	0	0	114.2
1100	R	32.8	Very low	35.1	Very low	231 Å²	231	135.2 Å²	135.2	87%	0.872	79%	0.789	S	S	*	*				31.1	156.7	109.6	-108.6	-170.7	-168.2	-169.6	6	118.9
1101	P	38.2	Very low	34.9	Very low	115 Å²	115	139.4 Å²	139.4	75%	0.747	80%	0.799	S	S	*	*			cis	-143	-133.3	17.8	48.1	-24.8	0	0	0	114.2
1102	P	38.5	Very low	34.5	Very low	134 Å²	134	139.3 Å²	139.3	87%	0.87	80%	0.799	S	S	*	*			trans	-129.3	-171.7	-144.6	35.2	-8.3	0	0	0	116.9
1103	G	35.4	Very low	34.2	Very low	73 Å²	73	142.2 Å²	142.2	75%	0.753	80%	0.797	S	S	*	*			trans	-172.3	129.1	168.1	0	0	0	0	0	114.8
1104	P	39.3	Very low	33.9	Very low	122 Å²	122	147.6 Å²	147.6	79%	0.792	80%	0.802	S	S	*	*			trans	-114.2	169.4	178.4	40.9	-33.2	0	0	0	114
1105	L	38.2	Very low	33.5	Very low	169 Å²	169	144.7 Å²	144.7	89%	0.885	79%	0.792	S	S	*	*			trans	-173.2	165.2	142.7	-106.4	165.8	0	0	0	113.2
1106	N	31.9	Very low	33.2	Very low	161 Å²	161	144.2 Å²	144.2	86%	0.861	79%	0.79	S	S	*	*			trans	-94.5	161.7	-172.7	-58.9	-16.5	0	0	0	113.6
1107	G	33.2	Very low	32.9	Very low	81 Å²	81	145.6 Å²	145.6	84%	0.835	79%	0.786	S	S	*	*			trans	-163.1	138.7	164.4	0	0	0	0	0	110.1
1108	D	31.7	Very low	32.7	Very low	159 Å²	159	146.1 Å²	146.1	85%	0.85	79%	0.789	S	S	*	*			trans	-139.8	161.7	-157.3	-147.3	-16.8	0	0	0	113.5
1109	V	30.3	Very low	32.5	Very low	117 Å²	117	146.3 Å²	146.3	71%	0.709	78%	0.783	S	S	*	*			trans	71.1	118.5	162.6	-179.9	0	0	0	0	121.4
1110	C	29.3	Very low	32.1	Very low	111 Å²	111	146.2 Å²	146.2	75%	0.75	79%	0.788	S	S	*	*			trans	13	144.8	143.7	-45.4	0	0	0	0	123.9
1111	M	33.4	Very low	32.1	Very low	192 Å²	192	141 Å²	141	95%	0.946	79%	0.787	S	S	*	*				-160	159.8	118.4	-113.3	178.3	-178.8	0	0	113.2
1112	D	28.5	Very low	31.7	Very low	137 Å²	137	145 Å²	145	73%	0.733	80%	0.796	S	S	*	*			trans	-106	172.5	-167.3	-51.6	-82.3	0	0	0	115.5
1113	N	31	Very low	31.5	Very low	136 Å²	136	143.5 Å²	143.5	73%	0.727	79%	0.794	S	S	*	*			trans	86.9	130.9	137.4	-77.8	-30.3	0	0	0	123.9
1114	W	29	Very low	31.4	Very low	211 Å²	211	146.7 Å²	146.7	80%	0.799	79%	0.794	S	S	*	*			trans	88.9	101	131.3	-80.1	41.2	0	0	0	123.2
1115	L	29	Very low	30.9	Very low	117 Å²	117	151.7 Å²	151.7	61%	0.613	80%	0.799	S	S	*	*				68.1	141.2	117.3	-76.4	169.8	0	0	0	124
1116	H	29	Very low	30.6	Very low	148 Å²	148	146.7 Å²	146.7	69%	0.685	79%	0.788	S	S	*	*			trans	52.9	108.4	155.6	-67.2	-54.8	0	0	0	121.5
1117	H	31.1	Very low	30.7	Very low	169 Å²	169	145 Å²	145	78%	0.782	78%	0.779	S	S	*	*				173.7	118.8	104.1	-92.4	-61.9	0	0	0	110.8
1118	V	28.7	Very low	30.4	Very low	111 Å²	111	146.4 Å²	146.4	67%	0.673	77%	0.765	S	S	*	*				81.9	113.2	89.6	168.2	0	0	0	0	116.1
1119	R	27.9	Very low	30.3	Very low	223 Å²	223	142 Å²	142	84%	0.842	75%	0.747	S	S	*	*			trans	74.3	116.9	154.3	-75.9	173.8	-176.8	-172	1.6	122.8
1120	N	28.8	Very low	30.3	Very low	153 Å²	153	142.9 Å²	142.9	82%	0.818	74%	0.741	S	S	*	*				59.1	107.2	125.8	-57.1	26.2	0	0	0	121.7
1121	S	31.3	Very low	30.5	Very low	122 Å²	122	141.5 Å²	141.5	85%	0.853	73%	0.731	S	S	*	*				-163.9	138.6	125.9	57	0	0	0	0	111.3
1122	E	29.8	Very low	30.2	Very low	200 Å²	200	142.3 Å²	142.3	94%	0.935	73%	0.73	S	S	*	*			trans	-88	139.4	-176.1	-56.9	159.7	123.5	0	0	112.7
1123	A	35	Very low	30.5	Very low	101 Å²	101	144.6 Å²	144.6	84%	0.835	74%	0.735	S	S	*	*			trans	-163.9	62.6	167.8	0	0	0	0	0	115.8
1124	N	32.2	Very low	30.4	Very low	141 Å²	141	143.2 Å²	143.2	75%	0.754	74%	0.737	S	S	*	*			trans	29.1	134.2	144.9	-95.5	-11.2	0	0	0	124.7
1125	Y	30.4	Very low	30.8	Very low	226 Å²	226	139.4 Å²	139.4	89%	0.886	74%	0.739	S	S	*	*			trans	74.7	119.1	147.9	-71.9	-64.1	0	0	0	123.1
1126	G	31.6	Very low	31.1	Very low	64 Å²	64	138.6 Å²	138.6	66%	0.66	74%	0.743	S	S	*	*			trans	173.9	132.4	158.8	0	0	0	0	0	110.4
1127	N	33.7	Very low	31.4	Very low	125 Å²	125	138.9 Å²	138.9	67%	0.668	75%	0.75	S	S	*	*			trans	-150.9	127.9	-166.6	-166	23.6	0	0	0	114.5
1128	M	26.8	Very low	31.6	Very low	111 Å²	111	137.3 Å²	137.3	55%	0.547	75%	0.747	S	S	.	*			trans	45.4	123.1	162.2	-68.5	-178	-172.2	0	0	118.5	Q1172	M1128-Q1172 CarbonylContact C-O 3.59Å; M1128-Q1172 WeakPolarHBondContact CA-O 3.46Å; M1128-Q1172 PolarHBondContact N-O 2.78Å
1129	S	30	Very low	31.9	Very low	67 Å²	67	136 Å²	136	47%	0.469	74%	0.743	S	S	.	*				176.3	160.4	63.8	43.8	0	0	0	0	112.3	A1170 A1171 Q1172	S1129-A1170 CarbonylContact O-C 3.54Å; S1129-A1170 WeakPolarHBondContact O-CA 3.49Å; S1129-A1171 CarbonylContact O-C 3.55Å; S1129-A1171 VanDerWaalsContact O-C 3.3Å; S1129-A1171 WeakPolarHBondContact O-CA 3.46Å; S1129-A1171 PolarHBondContact O-N 2.73Å; S1129-Q1172 PolarHBondContact N-O 3Å
1130	F	29.4	Very low	32.3	Very low	135 Å²	135	133.9 Å²	133.9	59%	0.592	74%	0.74	S	S	*	*			trans	-111.9	156.9	172.1	-90.6	-65.2	0	0	0	112.1	A1171 Q1172	F1130-A1171 HydrophobicContact CD1-CB 4.1Å; F1130-A1171 HydrophobicContact CE1-CB 3.59Å; F1130-A1171 HydrophobicContact CE2-CB 4.15Å; F1130-A1171 HydrophobicContact CZ-CB 3.63Å; F1130-Q1172 HydrophobicContact CD2-CB 4.21Å; F1130-Q1172 VanDerWaalsContact CD2-N 3.29Å; F1130-Q1172 HydrophobicContact CE2-CB 3.66Å; F1130-Q1172 HydrophobicContact CE2-CG 3.8Å; F1130-Q1172 HydrophobicContact CZ-CB 4.36Å
1131	P	33.4	Very low	32.6	Very low	82 Å²	82	132.9 Å²	132.9	53%	0.532	74%	0.735	S	S	.	*			trans	-101.2	164	-156.5	39.5	-38.9	0	0	0	117
1132	F	27.6	Very low	32.7	Very low	210 Å²	210	132.7 Å²	132.7	92%	0.921	72%	0.724	S	S	*	*			trans	-77.3	151.5	155.2	-89	-103.4	0	0	0	111
1133	H	34	Very low	33	Very low	184 Å²	184	129.6 Å²	129.6	85%	0.852	71%	0.712	S	S	*	*			trans	-134.8	136	161	-101.5	-54.1	0	0	0	110.7
1134	S	29.7	Very low	32.9	Very low	108 Å²	108	129.8 Å²	129.8	76%	0.755	71%	0.707	S	S	*	*			trans	-112.5	152.9	168.5	50.7	0	0	0	0	110.7
1135	P	37.2	Very low	32.9	Very low	131 Å²	131	129.1 Å²	129.1	85%	0.851	70%	0.704	S	S	*	*			trans	-89.6	161.3	164.5	34.4	-30.1	0	0	0	112
1136	S	35.3	Very low	33	Very low	99 Å²	99	124 Å²	124	69%	0.692	69%	0.692	S	S	*	*			trans	-104.7	168	-168	55.1	0	0	0	0	114.6
1137	N	35.5	Very low	33.1	Very low	154 Å²	154	127.8 Å²	127.8	82%	0.824	69%	0.692	S	S	*	*				-178.7	151.6	129.4	-89.3	-10	0	0	0	111.4
1138	D	35.8	Very low	33	Very low	137 Å²	137	129.3 Å²	129.3	73%	0.733	70%	0.695	S	S	*	*			cis	-162	159.2	-34.7	-165	17.7	0	0	0	111.6
1139	S	34.4	Very low	33.1	Very low	84 Å²	84	129.5 Å²	129.5	59%	0.587	70%	0.702	S	S	*	*			trans	91.4	135	146.5	87.5	0	0	0	0	122.5
1140	K	35.6	Very low	33	Very low	177 Å²	177	133.6 Å²	133.6	77%	0.77	72%	0.718	S	S	*	*			trans	98.6	100.2	147.6	-69.2	171.1	-175.2	172	0	122.4
1141	N	36	Very low	33.2	Very low	133 Å²	133	135.3 Å²	135.3	71%	0.711	73%	0.732	S	S	*	*				72.5	144.5	125.4	-69.1	46.7	0	0	0	119.4
1142	D	34	Very low	33	Very low	118 Å²	118	138.4 Å²	138.4	63%	0.631	74%	0.744	S	S	*	*			cis	-155.6	155.4	5.6	-115.4	-28.7	0	0	0	114
1143	I	35.2	Very low	33.4	Very low	135 Å²	135	132.9 Å²	132.9	69%	0.692	73%	0.729	S	S	*	*			trans	54.4	101.4	144.4	-62.3	164.1	0	0	0	118.5
1144	S	34.1	Very low	33.3	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	73%	0.727	S	S	*	*				78.6	153.6	90	109.6	0	0	0	0	116.1
1145	N	31.4	Very low	33.6	Very low	127 Å²	127	135.9 Å²	135.9	68%	0.679	72%	0.722	S	S	*	*			cis	-162.5	169.5	-15.2	-142.7	37.4	0	0	0	109.9
1146	D	33	Very low	33.4	Very low	118 Å²	118	135.1 Å²	135.1	63%	0.631	71%	0.711	S	S	*	*			trans	62.5	156.1	153.8	-62.7	-38.3	0	0	0	121.3
1147	Q	32.7	Very low	33.2	Very low	145 Å²	145	136.2 Å²	136.2	68%	0.678	71%	0.709	S	S	*	*			cis	-170.9	174.6	-43.6	-118.6	-175.1	36.9	0	0	109.4
1148	H	31.2	Very low	33	Very low	157 Å²	157	135.7 Å²	135.7	73%	0.727	70%	0.702	S	S	*	*			trans	80.9	117.4	151.6	-74.3	-40	0	0	0	124.3
1149	V	30.5	Very low	32.7	Very low	115 Å²	115	136 Å²	136	70%	0.697	70%	0.7	S	S	*	*				104	96.3	120.6	170.1	0	0	0	0	121.4
1150	L	27.3	Very low	32.4	Very low	152 Å²	152	139.4 Å²	139.4	80%	0.796	71%	0.707	S	S	*	*				41.3	130.3	127.2	-49.3	166.9	0	0	0	121.6
1151	I	33.1	Very low	32.1	Very low	171 Å²	171	137.4 Å²	137.4	88%	0.877	71%	0.705	S	S	*	*				173.7	147.9	106.8	-88.4	170.5	0	0	0	111.5
1152	N	30.3	Very low	31.9	Very low	147 Å²	147	138.2 Å²	138.2	79%	0.786	71%	0.709	S	S	*	*			trans	-90.1	-176.2	-177.2	-134	-7.3	0	0	0	110.9
1153	P	35.4	Very low	31.8	Very low	94 Å²	94	138.7 Å²	138.7	61%	0.61	71%	0.711	S	S	*	*			cis	-146.2	-176.1	3.1	46.2	-26.8	0	0	0	118.8
1154	R	32.4	Very low	31.6	Very low	215 Å²	215	138.5 Å²	138.5	81%	0.811	71%	0.711	S	S	*	*			trans	72	151.5	155.3	-74.4	170	169.2	175.1	-0.8	118
1155	H	34.6	Very low	31.4	Very low	140 Å²	140	142.3 Å²	142.3	65%	0.648	72%	0.715	S	S	*	*			cis	-154.9	146.2	-0.2	-124	-52.7	0	0	0	112.5
1156	N	33	Very low	31.3	Very low	115 Å²	115	141.6 Å²	141.6	62%	0.615	72%	0.715	S	S	*	*			trans	63.9	118.1	149.4	-74	15.4	0	0	0	124.1
1157	N	32.1	Very low	31.1	Very low	122 Å²	122	144 Å²	144	65%	0.652	72%	0.722	S	S	*	*				70.2	145	126.9	-58.4	22.3	0	0	0	119.8
1158	Q	29.9	Very low	30.9	Very low	144 Å²	144	142.8 Å²	142.8	67%	0.673	72%	0.72	S	S	*	*			cis	-175.4	152.6	-13.4	-111.8	168.7	-38.1	0	0	105.8
1159	M	30.7	Very low	30.8	Very low	144 Å²	144	142.8 Å²	142.8	71%	0.709	72%	0.721	S	S	*	*			cis	-125.7	144.3	-7	-85.6	172.3	177	0	0	107
1160	E	28.3	Very low	30.8	Very low	155 Å²	155	140.7 Å²	140.7	72%	0.724	72%	0.715	S	S	*	*				57.9	118.9	77.4	-55.8	-159.9	116.6	0	0	116.4
1161	N	28.7	Very low	30.8	Very low	135 Å²	135	135.9 Å²	135.9	72%	0.722	70%	0.698	S	S	*	*			cis	-150.7	147.1	-15.7	-101.6	-34	0	0	0	110.1
1162	N	32.1	Very low	30.7	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	69%	0.686	S	S	*	*			trans	-132.3	141.3	-172.5	-105.6	-13.9	0	0	0	112.5
1163	L	30.8	Very low	30.6	Very low	129 Å²	129	131.2 Å²	131.2	68%	0.675	67%	0.673	S	S	*	*			trans	36.9	120.9	149.1	-74.5	89.5	0	0	0	121.6
1164	N	31.3	Very low	30.4	Very low	130 Å²	130	131.7 Å²	131.7	70%	0.695	68%	0.675	S	S	*	*				93.4	150.9	127.7	-65.7	1.8	0	0	0	122.7
1165	F	29.9	Very low	30.3	Very low	184 Å²	184	130.6 Å²	130.6	81%	0.807	67%	0.672	S	S	*	*			trans	79.1	97.8	166	-82.1	-81.6	0	0	0	120.3
1166	V	30.1	Very low	30.1	Very low	112 Å²	112	131.3 Å²	131.3	68%	0.679	68%	0.676	S	S	*	*				54.2	120	121.8	176.7	0	0	0	0	116.5
1167	Q	28.8	Very low	29.9	Very low	168 Å²	168	131.2 Å²	131.2	79%	0.785	68%	0.675	S	S	*	*				-169.1	155.2	55	-151.9	150.8	9.7	0	0	114.1
1168	N	29	Very low	29.8	Very low	120 Å²	120	132.2 Å²	132.2	64%	0.642	68%	0.68	S	S	*	*			trans	64.9	134.1	157.6	-78.2	26.9	0	0	0	125.4
1169	E	29.4	Very low	29.6	Very low	158 Å²	158	134.2 Å²	134.2	74%	0.738	69%	0.686	S	S	*	*			trans	75.7	107.9	140.7	-72.6	166.6	-134	0	0	124.1
1170	A	28.8	Very low	29.7	Very low	70 Å²	70	134 Å²	134	58%	0.579	69%	0.688	S	S	*	*			trans	64.1	154.2	149.3	0	0	0	0	0	118.7	S1129	S1129-A1170 CarbonylContact O-C 3.54Å; S1129-A1170 WeakPolarHBondContact O-CA 3.49Å
1171	A	29	Very low	29.8	Very low	52 Å²	52	133.2 Å²	133.2	43%	0.43	69%	0.688	S	S	.	*			cis	-150.5	158.7	5	0	0	0	0	0	112	S1129 F1130	S1129-A1171 CarbonylContact O-C 3.55Å; S1129-A1171 VanDerWaalsContact O-C 3.3Å; S1129-A1171 WeakPolarHBondContact O-CA 3.46Å; S1129-A1171 PolarHBondContact O-N 2.73Å; F1130-A1171 HydrophobicContact CD1-CB 4.1Å; F1130-A1171 HydrophobicContact CE1-CB 3.59Å; F1130-A1171 HydrophobicContact CE2-CB 4.15Å; F1130-A1171 HydrophobicContact CZ-CB 3.63Å
1172	Q	29.5	Very low	30	Very low	133 Å²	133	135.5 Å²	135.5	62%	0.621	70%	0.695	S	S	*	*			trans	70	169	150.7	-140.6	147.1	25.5	0	0	120.8	M1128 S1129 F1130	M1128-Q1172 CarbonylContact C-O 3.59Å; M1128-Q1172 WeakPolarHBondContact CA-O 3.46Å; M1128-Q1172 PolarHBondContact N-O 2.78Å; S1129-Q1172 PolarHBondContact N-O 3Å; F1130-Q1172 HydrophobicContact CD2-CB 4.21Å; F1130-Q1172 VanDerWaalsContact CD2-N 3.29Å; F1130-Q1172 HydrophobicContact CE2-CB 3.66Å; F1130-Q1172 HydrophobicContact CE2-CG 3.8Å; F1130-Q1172 HydrophobicContact CZ-CB 4.36Å
1173	V	28.6	Very low	29.7	Very low	87 Å²	87	135.9 Å²	135.9	53%	0.527	70%	0.696	S	S	.	*			trans	-141.3	139.2	-151	172.8	0	0	0	0	114.1
1174	T	31.7	Very low	29.7	Very low	104 Å²	104	138.3 Å²	138.3	64%	0.638	70%	0.704	S	S	*	*			trans	175.5	130.2	140.9	33.7	0	0	0	0	108.9
1175	Y	29.3	Very low	29.5	Very low	191 Å²	191	138.4 Å²	138.4	75%	0.749	70%	0.704	S	S	*	*				93.7	139.7	57.6	-120.5	-103.2	0	0	0	114.6
1176	E	30.8	Very low	29.6	Very low	156 Å²	156	137.6 Å²	137.6	73%	0.729	71%	0.706	S	S	*	*			trans	71.6	148.6	168	-63.2	-117.1	153.6	0	0	119.3
1177	N	29.9	Very low	29.4	Very low	113 Å²	113	140.8 Å²	140.8	60%	0.604	71%	0.714	S	S	*	*			cis	-156.3	166.6	-23	-133.7	-23.9	0	0	0	115.3
1178	L	28.6	Very low	29.4	Very low	143 Å²	143	140.5 Å²	140.5	75%	0.749	72%	0.717	S	S	*	*			trans	-30.7	132.6	169.2	-65.9	155.1	0	0	0	120.1
1179	K	27.3	Very low	29.4	Very low	185 Å²	185	139.7 Å²	139.7	80%	0.804	72%	0.72	S	S	*	*				161.7	132.9	110.9	-95.7	169.2	-179.8	169	0	114.6
1180	N	32.1	Very low	29.2	Very low	139 Å²	139	138.2 Å²	138.2	74%	0.743	73%	0.727	S	S	*	*				179.6	119.7	126.8	-94.8	-35.2	0	0	0	112.3
1181	N	29.6	Very low	29.3	Very low	139 Å²	139	138.2 Å²	138.2	74%	0.743	74%	0.735	S	S	*	*				51.9	137.7	124.7	-54.1	-14.6	0	0	0	120.1
1182	Q	32.7	Very low	29.3	Very low	183 Å²	183	144.2 Å²	144.2	86%	0.855	76%	0.758	S	S	*	*			cis	-141.7	168	19.6	-70	-176.7	-48.7	0	0	113.3
1183	L	26.4	Very low	29.4	Very low	158 Å²	158	141.7 Å²	141.7	83%	0.827	76%	0.761	S	S	*	*			trans	-79.7	153.8	165.7	-60.7	75.7	0	0	0	110.9
1184	H	31.5	Very low	29.4	Very low	180 Å²	180	143.3 Å²	143.3	83%	0.833	78%	0.775	S	S	*	*				-166.4	167.2	121.2	-109	-65.2	0	0	0	112.6
1185	D	27.4	Very low	29.3	Very low	131 Å²	131	143.5 Å²	143.5	70%	0.701	79%	0.787	S	S	*	*			trans	-64.7	156.5	-170.6	-44.2	-100.4	0	0	0	115
1186	I	30.5	Very low	29.4	Very low	167 Å²	167	141.3 Å²	141.3	86%	0.856	79%	0.789	S	S	*	*				-166.3	120.9	127.4	-99.4	151.4	0	0	0	110.2
1187	H	25.8	Very low	29.2	Very low	180 Å²	180	141.6 Å²	141.6	83%	0.833	79%	0.794	S	S	*	*			trans	-92.9	174	160.9	-121	-101.2	0	0	0	108.8
1188	L	28.9	Very low	29.2	Very low	162 Å²	162	141.7 Å²	141.7	85%	0.848	80%	0.804	S	S	*	*			trans	91.5	149.6	179.4	-53.7	159.5	0	0	0	114.6
1189	S	29.2	Very low	29.1	Very low	103 Å²	103	143.2 Å²	143.2	72%	0.72	81%	0.812	S	S	*	*			cis	-168.9	155	-23.9	52.5	0	0	0	0	109.9
1190	S	26.7	Very low	29.3	Very low	126 Å²	126	140.2 Å²	140.2	88%	0.881	81%	0.814	S	S	*	*			trans	-66.8	138.8	178	54.5	0	0	0	0	114.6
1191	G	30.6	Very low	29.2	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	81%	0.812	S	S	*	*			trans	-172	74.2	178.2	0	0	0	0	0	119.7
1192	L	28.3	Very low	29.3	Very low	177 Å²	177	142.5 Å²	142.5	93%	0.927	82%	0.817	S	S	*	*			trans	49.8	131.8	138.8	-73.7	159.4	0	0	0	124.5
1193	A	30.8	Very low	29.3	Very low	81 Å²	81	139.9 Å²	139.9	67%	0.669	81%	0.809	S	S	*	*			trans	82.7	89.7	131	0	0	0	0	0	123.5
1194	S	28.3	Very low	29.7	Very low	120 Å²	120	139.5 Å²	139.5	84%	0.839	81%	0.808	S	S	*	*				41.2	125.9	121.2	63.3	0	0	0	0	123.2
1195	A	31.3	Very low	29.6	Very low	108 Å²	108	134.5 Å²	134.5	89%	0.893	81%	0.805	S	S	*	*			trans	-146.9	145.8	153.9	0	0	0	0	0	112.8
1196	N	31.2	Very low	29.9	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	82%	0.816	S	S	*	*			trans	-92	156.3	-161.4	-70.8	-42.4	0	0	0	117.2
1197	L	26	Very low	29.6	Very low	161 Å²	161	134.7 Å²	134.7	84%	0.843	82%	0.815	S	S	*	*			trans	53.2	142.4	138.4	-65.6	164.2	0	0	0	119.4
1198	S	31.1	Very low	29.8	Very low	115 Å²	115	132.2 Å²	132.2	80%	0.804	81%	0.813	S	S	*	*				-170.9	171.2	60.8	53.9	0	0	0	0	113.7
1199	L	25.7	Very low	29.8	Very low	176 Å²	176	129.7 Å²	129.7	92%	0.921	82%	0.815	S	S	*	*			trans	-123.7	149.9	-177.9	-145.9	100.7	0	0	0	111.9
1200	S	32	Very low	29.7	Very low	122 Å²	122	130.2 Å²	130.2	85%	0.853	81%	0.813	S	S	*	*			trans	-148.9	152.5	167.4	69.6	0	0	0	0	112.5
1201	S	28.4	Very low	29.6	Very low	99 Å²	99	136 Å²	136	69%	0.692	82%	0.816	S	S	*	*			trans	-111.4	157.2	-160.7	59.9	0	0	0	0	115.1
1202	R	32.1	Very low	29.4	Very low	226 Å²	226	138.8 Å²	138.8	85%	0.853	82%	0.819	S	S	*	*				-177.3	131.4	117.2	-101.1	168.9	178.5	-172.7	-1	114.6
1203	N	32.8	Very low	29.3	Very low	129 Å²	129	138.8 Å²	138.8	69%	0.69	82%	0.819	S	S	*	*				32.5	130.7	123.5	-62.4	47	0	0	0	118.2
1204	N	35.4	Very low	29.2	Very low	150 Å²	150	140.5 Å²	140.5	80%	0.802	83%	0.825	S	S	*	*			cis	-163.3	145.4	22.6	-100	-10.7	0	0	0	112.6
1205	G	30.3	Very low	29.3	Very low	74 Å²	74	143.9 Å²	143.9	76%	0.763	83%	0.828	S	S	*	*				70	83.1	128.6	0	0	0	0	0	121.5
1206	Q	32	Very low	29.1	Very low	202 Å²	202	147.6 Å²	147.6	94%	0.944	83%	0.827	S	S	*	*				-161.8	150.3	126.1	-110.6	172.7	3.2	0	0	109.8
1207	A	25.4	Very low	28.9	Very low	101 Å²	101	149 Å²	149	84%	0.835	83%	0.831	S	S	*	*			trans	-114.9	119.2	-174.5	0	0	0	0	0	111.4
1208	V	29.8	Very low	29.1	Very low	128 Å²	128	147.9 Å²	147.9	78%	0.776	83%	0.826	S	S	*	*			trans	-134.6	119.4	166.9	-178.5	0	0	0	0	107.1	V1210	V1208-V1210 HydrophobicContact CG1-CG2 4.19Å
1209	A	27.6	Very low	28.9	Very low	108 Å²	108	149.4 Å²	149.4	89%	0.893	82%	0.823	S	S	*	*			trans	-87.8	109.7	179.9	0	0	0	0	0	110.1
1210	V	27	Very low	29	Very low	114 Å²	114	147.6 Å²	147.6	69%	0.691	81%	0.814	S	S	*	*			trans	-111.3	122.5	172.4	-178.8	0	0	0	0	108.5	V1208 V1212	V1208-V1210 HydrophobicContact CG1-CG2 4.19Å; V1210-V1212 HydrophobicContact CG1-CG2 4.44Å; V1210-V1212 PolarHBondContact O-N 2.79Å
1211	R	24.9	Very low	29	Very low	249 Å²	249	153 Å²	153	94%	0.94	82%	0.816	S	S	*	*			trans	-67.1	126	169.4	-88	-179.3	166.2	-179.1	-5.3	109.1
1212	V	27.7	Very low	29	Very low	129 Å²	129	158.6 Å²	158.6	78%	0.782	83%	0.828	S	S	*	*			trans	-124.5	132.3	163.4	-179.6	0	0	0	0	107.4	V1210	V1210-V1212 HydrophobicContact CG1-CG2 4.44Å; V1210-V1212 PolarHBondContact O-N 2.79Å
1213	L	26.3	Very low	28.8	Very low	177 Å²	177	151.4 Å²	151.4	93%	0.927	83%	0.825	S	S	*	*			trans	-76.5	134.5	-178.5	-68.8	153.6	0	0	0	110.3
1214	S	29	Very low	28.8	Very low	116 Å²	116	154 Å²	154	81%	0.811	83%	0.833	S	S	*	*			trans	-142.9	148.5	159.7	62.4	0	0	0	0	109.5
1215	Q	28.6	Very low	28.6	Very low	191 Å²	191	154.8 Å²	154.8	89%	0.893	84%	0.836	S	S	*	*			trans	-85.8	129.7	-166.1	-65.8	155.5	-43.1	0	0	111.2
1216	Q	28.7	Very low	28.4	Very low	187 Å²	187	159.9 Å²	159.9	87%	0.874	84%	0.839	S	S	*	*			trans	-93.4	109.6	160.5	-75.8	-178.2	-93.4	0	0	109.1	N1218	Q1216-N1218 PolarHBondContact O-N 3.2Å
1217	M	25.4	Very low	28.3	Very low	176 Å²	176	156.1 Å²	156.1	87%	0.867	83%	0.826	S	S	*	*			trans	-65.6	123	153	-71.2	175.8	-103.1	0	0	107.4
1218	N	30.4	Very low	28.5	Very low	136 Å²	136	159.6 Å²	159.6	73%	0.727	83%	0.825	S	S	*	*			trans	-122.5	125.6	163.7	-160.1	56.4	0	0	0	108.3	Q1216 D1220	Q1216-N1218 PolarHBondContact O-N 3.2Å; N1218-D1220 PolarHBondContact ND2-OD2 3.06Å; N1218-D1220 VanDerWaalsContact ND2-OD2 3.14Å
1219	I	28.1	Very low	28.5	Very low	147 Å²	147	161.1 Å²	161.1	75%	0.754	83%	0.827	S	S	*	*			trans	-109.1	99.3	-169.2	-60.2	171.1	0	0	0	108.1
1220	D	28.2	Very low	28.5	Very low	138 Å²	138	164.6 Å²	164.6	74%	0.738	82%	0.822	S	S	*	*			trans	-144	57.1	177.6	-82.4	-55	0	0	0	111.6	N1218	N1218-D1220 PolarHBondContact ND2-OD2 3.06Å; N1218-D1220 VanDerWaalsContact ND2-OD2 3.14Å
1221	R	31.8	Very low	28.5	Very low	235 Å²	235	165.8 Å²	165.8	89%	0.887	82%	0.824	S	S	*	*			trans	-149.4	89.2	162	-80.8	-159.5	-178.2	-165.4	2.8	111.4
1222	F	28.4	Very low	28.7	Very low	217 Å²	217	159 Å²	159	95%	0.952	81%	0.812	S	S	*	*			trans	-157.1	123	152.6	-102.9	-71.5	0	0	0	108.2
1223	G	28.1	Very low	28.7	Very low	76 Å²	76	163.7 Å²	163.7	78%	0.784	82%	0.816	S	S	*	*			trans	-169.2	27	-166.5	0	0	0	0	0	115.5
1224	E	31.2	Very low	28.8	Very low	184 Å²	184	160.2 Å²	160.2	86%	0.86	81%	0.806	S	S	*	*			trans	-155.2	174.7	170.4	-120.8	161.2	-145.7	0	0	110.2
1225	I	31.9	Very low	28.9	Very low	166 Å²	166	162.1 Å²	162.1	85%	0.851	81%	0.807	S	S	*	*			trans	70.6	85.3	-165.3	-49.2	171.9	0	0	0	113
1226	Q	26.1	Very low	28.9	Very low	181 Å²	181	164.4 Å²	164.4	85%	0.846	81%	0.808	S	S	*	*			trans	-79.5	129.8	140.3	-66.9	176.9	-119.1	0	0	107.6
1227	D	30.3	Very low	28.9	Very low	123 Å²	123	164 Å²	164	66%	0.658	81%	0.81	S	S	*	*				-177.1	147.3	98.4	-123.4	-3.9	0	0	0	112.8
1228	Q	28.7	Very low	28.9	Very low	173 Å²	173	161.1 Å²	161.1	81%	0.808	81%	0.808	S	S	*	*			trans	63.1	133	170.1	-52.6	169.9	50	0	0	114.2
1229	I	29.4	Very low	28.8	Very low	160 Å²	160	157.9 Å²	157.9	82%	0.821	81%	0.807	S	S	*	*			cis	-140.8	162.6	36	-70.9	170.5	0	0	0	111.6
1230	F	28.9	Very low	28.8	Very low	182 Å²	182	159 Å²	159	80%	0.798	81%	0.813	S	S	*	*			trans	-49.1	131.7	-175.9	-77.5	-118.6	0	0	0	118.9
1231	L	26.9	Very low	28.7	Very low	138 Å²	138	158.3 Å²	158.3	72%	0.723	81%	0.814	S	S	*	*				45.9	160.2	122.8	-69.1	175.4	0	0	0	122.5
1232	P	29	Very low	28.5	Very low	108 Å²	108	155.4 Å²	155.4	70%	0.701	81%	0.814	S	S	*	*			cis	-137.6	143.2	-5.2	32.9	-11.3	0	0	0	118.5
1233	R	26.8	Very low	28.5	Very low	227 Å²	227	148.1 Å²	148.1	86%	0.857	80%	0.8	S	S	*	*			trans	44.8	138.5	135.7	-64.6	-176.3	172.5	178.1	-1.7	124.6
1234	S	29.2	Very low	28.4	Very low	104 Å²	104	155.9 Å²	155.9	73%	0.727	81%	0.807	S	S	*	*			trans	82.7	146.2	151.4	82.1	0	0	0	0	117.2
1235	N	31.3	Very low	28.2	Very low	155 Å²	155	152.3 Å²	152.3	83%	0.829	80%	0.802	S	S	*	*			cis	-126.6	160.3	15	-84.4	-66.4	0	0	0	114.7
1236	R	27.4	Very low	28	Very low	240 Å²	240	150.6 Å²	150.6	91%	0.906	80%	0.8	S	S	*	*			trans	-86.4	148.7	161.9	-71.5	178.8	172.7	176.4	-3	110.3
1237	L	29.6	Very low	28.3	Very low	177 Å²	177	149 Å²	149	93%	0.927	80%	0.797	S	S	*	*			trans	-154.2	146.5	144.3	-112.6	169.9	0	0	0	109.7
1238	S	26.1	Very low	28.5	Very low	116 Å²	116	147.9 Å²	147.9	81%	0.811	80%	0.799	S	S	*	*			trans	-142.4	139.7	-167.1	56.5	0	0	0	0	112
1239	G	27.7	Very low	28.6	Very low	69 Å²	69	147.2 Å²	147.2	71%	0.711	80%	0.798	S	S	*	*			trans	141.2	123.1	158.6	0	0	0	0	0	115.6
1240	I	28	Very low	28.7	Very low	171 Å²	171	145.9 Å²	145.9	88%	0.877	80%	0.797	S	S	*	*			trans	-170.5	156.9	138.6	-96.4	154.1	0	0	0	106.5
1241	T	25.9	Very low	28.6	Very low	123 Å²	123	142 Å²	142	76%	0.755	79%	0.793	S	S	*	*			trans	-154.2	176	-164.3	-49.7	0	0	0	0	110.3
1242	I	26.9	Very low	28.9	Very low	173 Å²	173	142 Å²	142	89%	0.887	80%	0.799	S	S	*	*			trans	87.8	132.8	172.3	-49.9	159.3	0	0	0	112.9
1243	G	29.5	Very low	29.1	Very low	64 Å²	64	142.6 Å²	142.6	66%	0.66	81%	0.806	S	S	*	*			cis	-175.7	-176.5	-1.5	0	0	0	0	0	113.8
1244	Y	25.5	Very low	29.2	Very low	239 Å²	239	139.3 Å²	139.3	94%	0.937	81%	0.805	S	S	*	*			trans	-109.2	166.7	-177.8	-67.7	-88.3	0	0	0	112.5
1245	S	27.7	Very low	29.3	Very low	109 Å²	109	140.1 Å²	140.1	76%	0.762	81%	0.811	S	S	*	*			trans	-133.8	145.7	167.5	-171.1	0	0	0	0	111
1246	T	27.7	Very low	29.4	Very low	130 Å²	130	136.7 Å²	136.7	80%	0.798	80%	0.804	S	S	*	*			trans	-152.9	128.3	177.7	53.7	0	0	0	0	110.9
1247	D	31.6	Very low	29.5	Very low	147 Å²	147	133.2 Å²	133.2	79%	0.786	80%	0.803	S	S	*	*			trans	-106.8	118.6	166.2	-69.2	-54.7	0	0	0	108
1248	S	34.3	Very low	29.7	Very low	100 Å²	100	130.7 Å²	130.7	70%	0.699	80%	0.797	S	S	*	*				83.6	144.5	89	95.8	0	0	0	0	113.4
1249	M	30.3	Very low	29.7	Very low	159 Å²	159	129 Å²	129	78%	0.783	79%	0.79	S	S	*	*			cis	-158.4	126.3	3.8	-140.7	170.3	179.9	0	0	114.2
1250	T	33.4	Very low	29.7	Very low	132 Å²	132	135.9 Å²	135.9	81%	0.81	80%	0.801	S	S	*	*			trans	63.3	156.1	139.9	52.8	0	0	0	0	124.6
1251	S	26.8	Very low	29.6	Very low	102 Å²	102	135 Å²	135	71%	0.713	80%	0.798	S	S	*	*			trans	-132.1	162.2	177.9	60	0	0	0	0	111.9
1252	T	31.6	Very low	29.7	Very low	136 Å²	136	136.7 Å²	136.7	83%	0.834	80%	0.801	S	S	*	*			trans	163	138.3	135	34.1	0	0	0	0	114.1
1253	S	33.7	Very low	29.6	Very low	122 Å²	122	137.3 Å²	137.3	85%	0.853	80%	0.797	S	S	*	*			trans	170.8	171	132.1	44.9	0	0	0	0	110.8
1254	N	28.1	Very low	29.4	Very low	158 Å²	158	141 Å²	141	85%	0.845	80%	0.801	S	S	*	*			trans	-129.2	171.6	-163.2	-81.5	-42.1	0	0	0	113.6
1255	S	32.3	Very low	29.5	Very low	120 Å²	120	136.2 Å²	136.2	84%	0.839	79%	0.791	S	S	*	*			trans	87.7	148.1	161	78.8	0	0	0	0	118.7
1256	A	33.4	Very low	29.5	Very low	84 Å²	84	136.6 Å²	136.6	69%	0.694	79%	0.791	S	S	*	*			cis	-170.8	132.5	-26.3	0	0	0	0	0	112.6
1257	L	29.1	Very low	29.6	Very low	167 Å²	167	136.4 Å²	136.4	87%	0.874	79%	0.79	S	S	*	*			trans	58.1	168.7	150.8	-69.5	172	0	0	0	119.3
1258	P	34	Very low	29.4	Very low	123 Å²	123	134.9 Å²	134.9	80%	0.799	78%	0.782	S	S	*	*			cis	-115.2	-173.5	-7.5	36.5	-20	0	0	0	113.7
1259	A	25.8	Very low	29	Very low	82 Å²	82	134.7 Å²	134.7	68%	0.678	79%	0.786	S	S	*	*			trans	-112.1	165.6	-174.9	0	0	0	0	0	113.9
1260	F	28.5	Very low	29	Very low	213 Å²	213	137 Å²	137	93%	0.934	79%	0.787	S	S	*	*			trans	-133.5	145.3	160.9	-103.1	-91.8	0	0	0	109.9
1261	N	24.8	Very low	28.6	Very low	151 Å²	151	136.1 Å²	136.1	81%	0.807	79%	0.785	S	S	*	*			trans	-125.4	137	-178.7	-81.6	-30.8	0	0	0	110.7
1262	I	28.7	Very low	28.7	Very low	160 Å²	160	138.1 Å²	138.1	82%	0.821	79%	0.793	S	S	*	*			trans	-179.9	120.4	156.1	-88.1	139.3	0	0	0	103
1263	K	23.8	Very low	28.6	Very low	186 Å²	186	137.8 Å²	137.8	81%	0.809	79%	0.791	S	S	*	*			cis	92.3	138.3	40.1	-163.4	-174.7	-178.3	-164.6	0	112.1
1264	L	25.6	Very low	28.2	Very low	141 Å²	141	141 Å²	141	74%	0.738	79%	0.79	S	S	*	*			trans	82.8	143.6	-168.5	-49.7	156.3	0	0	0	112.1
1265	D	27.6	Very low	28.3	Very low	138 Å²	138	138.5 Å²	138.5	74%	0.738	78%	0.782	S	S	*	*			cis	-154.7	169.9	-19.7	-109.2	-9.1	0	0	0	110.2
1266	P	29	Very low	28.1	Very low	117 Å²	117	140.1 Å²	140.1	76%	0.76	78%	0.78	S	S	*	*			trans	-103	115.7	-163.4	35.9	-30.9	0	0	0	115.7
1267	V	28.3	Very low	27.9	Very low	127 Å²	127	141 Å²	141	77%	0.77	78%	0.779	S	S	*	*			trans	-141.7	141.3	172.8	-180	0	0	0	0	111.8
1268	N	28.6	Very low	27.9	Very low	115 Å²	115	137.6 Å²	137.6	62%	0.615	76%	0.764	S	S	*	*			trans	43.7	94.4	164.4	-62.6	-3.8	0	0	0	119.7	Y1270	N1268-Y1270 HydrophobicContact CB-CD2 4.35Å; N1268-Y1270 HydrophobicContact CB-CE2 4.38Å
1269	A	26.2	Very low	27.6	Very low	96 Å²	96	137.2 Å²	137.2	79%	0.793	76%	0.759	S	S	*	*			trans	-123.3	89.9	152	0	0	0	0	0	108.8	C1271	A1269-C1271 PolarHBondContact O-N 2.84Å
1270	Y	28.9	Very low	27.6	Very low	207 Å²	207	137.8 Å²	137.8	81%	0.812	76%	0.759	S	S	*	*			trans	-73.2	121.7	-179.5	-87	-86.6	0	0	0	111.2	N1268	N1268-Y1270 HydrophobicContact CB-CD2 4.35Å; N1268-Y1270 HydrophobicContact CB-CE2 4.38Å
1271	C	26.6	Very low	27.6	Very low	113 Å²	113	136 Å²	136	76%	0.764	75%	0.75	S	S	*	*			trans	-84.2	114.7	178	-66.5	0	0	0	0	110.3	A1269 T1273	A1269-C1271 PolarHBondContact O-N 2.84Å; C1271-T1273 PolarHBondContact O-N 3.25Å
1272	V	28.4	Very low	27.8	Very low	145 Å²	145	136.2 Å²	136.2	88%	0.879	75%	0.75	S	S	*	*			trans	-60.2	112.2	165	-179.8	0	0	0	0	108.2
1273	T	28.3	Very low	27.8	Very low	129 Å²	129	134.7 Å²	134.7	79%	0.791	74%	0.742	S	S	*	*			trans	-73.7	132.6	-173.7	44.1	0	0	0	0	111.7	C1271	C1271-T1273 PolarHBondContact O-N 3.25Å
1274	K	26.1	Very low	27.9	Very low	189 Å²	189	131.4 Å²	131.4	82%	0.822	74%	0.741	S	S	*	*			trans	-31.1	141.6	-179.2	-57.4	168.5	-177.1	172.8	0	115.2
1275	P	30.2	Very low	28	Very low	106 Å²	106	130.5 Å²	130.5	69%	0.688	74%	0.737	S	S	*	*			trans	-59.9	143.5	165.2	28.8	-34.8	0	0	0	110.5
1276	I	28.2	Very low	28.1	Very low	154 Å²	154	134.1 Å²	134.1	79%	0.79	75%	0.746	S	S	*	*			trans	-68.2	127.4	-179.8	-61	170.8	0	0	0	108.9	V1278	I1276-V1278 PolarHBondContact O-N 2.94Å
1277	P	29.5	Very low	28.2	Very low	103 Å²	103	134.8 Å²	134.8	67%	0.669	74%	0.744	S	S	*	*			trans	-73.4	114.7	172.9	29.6	-31.9	0	0	0	109.5	V1279	P1277-V1279 PolarHBondContact O-N 2.73Å; P1277-V1279 VanDerWaalsContact O-N 3.12Å
1278	V	28.5	Very low	28.3	Very low	95 Å²	95	138 Å²	138	58%	0.576	75%	0.75	S	S	*	*			trans	-69.5	107.6	168.4	-174.6	0	0	0	0	108.1	I519 I1276 S1280	I519-V1278 HydrophobicContact CD1-CB 4.08Å; I519-V1278 HydrophobicContact CD1-CG1 3.8Å; I519-V1278 HydrophobicContact CD1-CG2 4.15Å; I1276-V1278 PolarHBondContact O-N 2.94Å; V1278-S1280 PolarHBondContact O-N 2.78Å
1279	V	28.1	Very low	28.6	Very low	115 Å²	115	138.4 Å²	138.4	70%	0.697	75%	0.752	S	S	*	*			trans	-90.1	96.9	177.7	179.9	0	0	0	0	108.8	P1277 K1281	P1277-V1279 PolarHBondContact O-N 2.73Å; P1277-V1279 VanDerWaalsContact O-N 3.12Å; V1279-K1281 PolarHBondContact O-N 2.7Å
1280	S	26.4	Very low	29	Very low	94 Å²	94	137.8 Å²	137.8	66%	0.657	73%	0.733	S	S	*	*			trans	-64.7	100.2	169.3	38.6	0	0	0	0	110.1	V1278 I1282	V1278-S1280 PolarHBondContact O-N 2.78Å; S1280-I1282 PolarHBondContact O-N 3.42Å
1281	K	28	Very low	29.1	Very low	176 Å²	176	133.8 Å²	133.8	77%	0.765	72%	0.723	S	S	*	*			trans	-86.1	88.1	-176.3	-137	-175.6	-173.1	-173	0	110.3	V1279 I1283	V1279-K1281 PolarHBondContact O-N 2.7Å; K1281-I1283 PolarHBondContact O-N 2.86Å; K1281-I1283 VanDerWaalsContact O-N 3.17Å
1282	I	28.8	Very low	29.5	Very low	154 Å²	154	134.5 Å²	134.5	79%	0.79	72%	0.72	S	S	*	*			trans	-64.1	113.6	165.4	-63.2	174.5	0	0	0	107.6	S1280	S1280-I1282 PolarHBondContact O-N 3.42Å
1283	I	27.8	Very low	29.7	Very low	129 Å²	129	131.3 Å²	131.3	66%	0.662	70%	0.703	S	S	*	*			trans	-99.3	103.8	175.1	-61.1	175.6	0	0	0	108.2	K1281	K1281-I1283 PolarHBondContact O-N 2.86Å; K1281-I1283 VanDerWaalsContact O-N 3.17Å
1284	C	27.1	Very low	29.8	Very low	116 Å²	116	133.1 Å²	133.1	78%	0.784	70%	0.703	S	S	*	*			trans	-96	124.4	155.2	-68.6	0	0	0	0	108
1285	N	27.5	Very low	30.1	Very low	122 Å²	122	131.2 Å²	131.2	65%	0.652	70%	0.7	S	S	*	*			trans	-61.5	146.4	175.7	-62.2	-22.7	0	0	0	111
1286	F	28.9	Very low	30	Very low	214 Å²	214	131.5 Å²	131.5	94%	0.939	70%	0.7	S	S	*	*				-156.4	146.3	114.5	-100.3	-69.2	0	0	0	109.2
1287	N	32.7	Very low	30.2	Very low	131 Å²	131	132.1 Å²	132.1	70%	0.701	70%	0.7	S	S	*	*			trans	-85.1	144.8	-168.6	-59.8	3.7	0	0	0	112.1
1288	E	30.3	Very low	30.4	Very low	196 Å²	196	134.3 Å²	134.3	92%	0.916	71%	0.706	S	S	*	*			trans	-98.6	119.2	154.9	-70.5	-172.1	131.8	0	0	108.8
1289	D	34.2	Very low	30.7	Very low	122 Å²	122	134 Å²	134	65%	0.652	71%	0.708	S	S	*	*			trans	-105.1	115.3	166	-80.2	-51.7	0	0	0	109.6
1290	Q	33.8	Very low	30.9	Very low	83 Å²	83	137.8 Å²	137.8	39%	0.388	72%	0.718	S	S	.	*			trans	52.4	114.7	133.3	-56	171.3	-6.4	0	0	120.1	G1062 P1063 D1064	G1062-Q1290 WeakPolarHBondContact CA-O 3.4Å; P1063-Q1290 VanDerWaalsContact O-CG 3.26Å; P1063-Q1290 WeakPolarHBondContact O-CG 3.48Å; P1063-Q1290 PolarHBondContact O-NE2 2.94Å; P1063-Q1290 PolarHBondContact O-OE1 2.76Å; D1064-Q1290 VanDerWaalsContact C-NE2 3.3Å; D1064-Q1290 PolarHBondContact O-NE2 3.39Å
1291	M	32.4	Very low	31.2	Very low	123 Å²	123	137.2 Å²	137.2	61%	0.606	72%	0.719	S	S	*	*				-164.3	143	101.4	-174.4	150.5	-167.5	0	0	112.6	G1061 G1062 P1063	G1061-M1291 WeakPolarHBondContact CA-SD 3.06Å; G1062-M1291 PolarHBondContact N-SD 3.32Å; P1063-M1291 HydrophobicContact CG-CE 4.31Å; P1063-M1291 HydrophobicContact CG-CG 4.49Å
1292	D	33.8	Very low	31.4	Very low	129 Å²	129	136.4 Å²	136.4	69%	0.69	72%	0.722	S	S	*	*			trans	-88.5	159.8	177.2	-165.1	10	0	0	0	114.3
1293	S	32.1	Very low	31.7	Very low	77 Å²	77	136.5 Å²	136.5	54%	0.538	72%	0.719	S	S	.	*			trans	91.3	131.2	143.3	82.9	0	0	0	0	122.2
1294	Q	32	Very low	31.8	Very low	168 Å²	168	138.5 Å²	138.5	79%	0.785	73%	0.725	S	S	*	*			trans	96.9	124.3	131	-89.6	-178.7	51.5	0	0	123.5
1295	I	31.2	Very low	32.2	Very low	148 Å²	148	137.3 Å²	137.3	76%	0.759	72%	0.724	S	S	*	*			trans	92.7	140.3	148.3	-63.9	161.3	0	0	0	117.5
1296	T	28.8	Very low	32.6	Very low	112 Å²	112	138.9 Å²	138.9	69%	0.687	73%	0.733	S	S	*	*			trans	-117.2	171.7	-160.4	45.1	0	0	0	0	112.9
1297	E	31.5	Very low	33.2	Very low	167 Å²	167	133.9 Å²	133.9	78%	0.78	72%	0.722	S	S	*	*			trans	76.4	147.9	153.3	-78.1	168.6	-176.7	0	0	120.7
1298	N	34.1	Very low	33.3	Very low	150 Å²	150	132.5 Å²	132.5	80%	0.802	73%	0.728	S	S	*	*			trans	93.7	123.3	174	-52.5	-64.7	0	0	0	115.7
1299	S	35.1	Very low	33.4	Very low	88 Å²	88	130.7 Å²	130.7	62%	0.615	73%	0.725	S	S	*	*			cis	158.3	135	-12.1	42.4	0	0	0	0	105.3
1300	E	32.8	Very low	33.4	Very low	195 Å²	195	129.6 Å²	129.6	91%	0.911	73%	0.727	S	S	*	*			trans	55.9	145.3	148.3	-62.8	-178	178.3	0	0	120.3
1301	A	33.4	Very low	33.5	Very low	82 Å²	82	131.8 Å²	131.8	68%	0.678	75%	0.746	S	S	*	*			cis	-168.9	-169	-13	0	0	0	0	0	109.3
1302	L	31.2	Very low	33.6	Very low	159 Å²	159	132.2 Å²	132.2	83%	0.832	75%	0.746	S	S	*	*			trans	77.7	94.6	155.2	-68.2	156.4	0	0	0	121
1303	H	34.9	Very low	33.5	Very low	155 Å²	155	136.4 Å²	136.4	72%	0.718	76%	0.759	S	S	*	*				33.6	126.8	122.8	-82.1	-103.3	0	0	0	123.3
1304	E	29.9	Very low	33.4	Very low	171 Å²	171	139 Å²	139	80%	0.799	76%	0.76	S	S	*	*			trans	85.9	158.6	130.3	-78.8	175.4	-142.4	0	0	124
1305	A	35.5	Very low	33.4	Very low	91 Å²	91	137.6 Å²	137.6	75%	0.752	76%	0.764	S	S	*	*			trans	77.6	71.5	163.3	0	0	0	0	0	120.9
1306	N	36	Very low	33.3	Very low	156 Å²	156	136.3 Å²	136.3	83%	0.834	76%	0.758	S	S	*	*				47.3	168.1	105.1	-127.5	8.7	0	0	0	120.9
1307	P	40.6	Very low	33.6	Very low	109 Å²	109	138.4 Å²	138.4	71%	0.708	76%	0.764	S	S	*	*				-127.2	167.3	-102.1	41.7	-26.1	0	0	0	116
1308	A	36.3	Very low	33.6	Very low	102 Å²	102	137.9 Å²	137.9	84%	0.843	76%	0.762	S	S	*	*			trans	-154.9	148.3	164.5	0	0	0	0	0	115.8
1309	N	32.5	Very low	33.4	Very low	157 Å²	157	137.3 Å²	137.3	84%	0.84	76%	0.759	S	S	*	*			trans	-52.2	156.4	176.2	-57.4	-48.6	0	0	0	114.8
1310	S	33.9	Very low	33.3	Very low	99 Å²	99	140.8 Å²	140.8	69%	0.692	77%	0.77	S	S	*	*				179.2	140.7	77.9	49.8	0	0	0	0	116.2
1311	T	34.5	Very low	33.5	Very low	129 Å²	129	136.7 Å²	136.7	79%	0.791	76%	0.761	S	S	*	*			trans	55	159.1	141	56.5	0	0	0	0	123.5
1312	H	34.5	Very low	33.6	Very low	132 Å²	132	140 Å²	140	61%	0.611	77%	0.766	S	S	*	*			cis	-177.2	112.8	-39.9	-146.9	-24.9	0	0	0	109.4
1313	F	32.4	Very low	33.6	Very low	218 Å²	218	139 Å²	139	96%	0.956	76%	0.762	S	S	*	*			trans	-170.1	111.6	162.9	-93.8	-71.6	0	0	0	107.1
1314	K	30.6	Very low	33.6	Very low	130 Å²	130	136.3 Å²	136.3	57%	0.565	75%	0.753	S	S	*	*			cis	98.1	73.2	5.9	-147.4	-174.1	-167.6	173.9	0	118.3	N1316	K1314-N1316 VanDerWaalsContact CE-OD1 3.3Å; K1314-N1316 WeakPolarHBondContact CE-OD1 3.44Å; K1314-N1316 WeakPolarHBondContact CG-OD1 3.39Å
1315	T	32.6	Very low	33.8	Very low	140 Å²	140	138.1 Å²	138.1	86%	0.859	75%	0.752	S	S	*	*			trans	-135.9	86	142.3	45.9	0	0	0	0	107.5
1316	N	29	Very low	33.5	Very low	121 Å²	121	140 Å²	140	65%	0.647	75%	0.749	S	S	*	*				51.7	101.4	82.8	-86.4	30.5	0	0	0	114.7	K1314	K1314-N1316 VanDerWaalsContact CE-OD1 3.3Å; K1314-N1316 WeakPolarHBondContact CE-OD1 3.44Å; K1314-N1316 WeakPolarHBondContact CG-OD1 3.39Å
1317	L	33.3	Very low	33.3	Very low	155 Å²	155	137.9 Å²	137.9	81%	0.812	74%	0.737	S	S	*	*				-170.4	93.6	129.4	-102.7	158	0	0	0	110.6
1318	Q	32	Very low	32.8	Very low	156 Å²	156	142 Å²	142	73%	0.729	74%	0.738	S	S	*	*			trans	44.3	116.4	131.9	-61.1	-177.6	-90.4	0	0	118.9
1319	D	31.1	Very low	32.5	Very low	138 Å²	138	144.6 Å²	144.6	74%	0.738	73%	0.732	S	S	*	*				68.8	94	67.3	-63	-45.1	0	0	0	114.1
1320	N	32.7	Very low	32.5	Very low	161 Å²	161	146.8 Å²	146.8	86%	0.861	74%	0.738	S	S	*	*				-169.1	130.7	112.5	-112.5	-23.1	0	0	0	113.2
1321	P	37.4	Very low	32.3	Very low	109 Å²	109	145.1 Å²	145.1	71%	0.708	74%	0.736	S	S	*	*			trans	-100.5	161.3	167	38.5	-32.5	0	0	0	112.8
1322	L	35	Very low	32.3	Very low	152 Å²	152	148.9 Å²	148.9	80%	0.796	74%	0.741	S	S	*	*			trans	-154.6	128.1	151.3	-87.4	124.9	0	0	0	105.2
1323	D	31.9	Very low	32.1	Very low	138 Å²	138	153.6 Å²	153.6	74%	0.738	75%	0.754	S	S	*	*				61	139.6	82.3	-79	-30	0	0	0	113.6
1324	D	34.5	Very low	31.9	Very low	99 Å²	99	150 Å²	150	53%	0.529	74%	0.744	S	S	.	*			cis	-143	171.5	21.3	178.9	22.3	0	0	0	111.1
1325	R	33.6	Very low	32	Very low	209 Å²	209	149.7 Å²	149.7	79%	0.789	75%	0.752	S	S	*	*			trans	82	97.2	165.3	-47.2	-157.3	177.9	-153.2	-13.2	115.2
1326	L	30	Very low	31.9	Very low	130 Å²	130	148.7 Å²	148.7	68%	0.681	75%	0.746	S	S	*	*			cis	58.8	134.3	32.2	-77.2	84.2	0	0	0	114
1327	I	31.2	Very low	32	Very low	112 Å²	112	148.5 Å²	148.5	57%	0.574	75%	0.749	S	S	*	*			cis	-164.5	144.8	-15.6	-128.2	179.2	0	0	0	111
1328	R	29.7	Very low	32.2	Very low	195 Å²	195	145.6 Å²	145.6	74%	0.736	74%	0.738	S	S	*	*			trans	53.3	153.7	152.1	-58.6	172.2	-152.2	-165.7	6	124.5
1329	H	30.7	Very low	32.3	Very low	157 Å²	157	144.1 Å²	144.1	73%	0.727	74%	0.742	S	S	*	*			trans	68.4	85.2	145.8	-64.7	-45.3	0	0	0	121.3
1330	Q	32.2	Very low	32.3	Very low	203 Å²	203	146.1 Å²	146.1	95%	0.949	74%	0.744	S	S	*	*			trans	-168.5	160.4	130.7	-102.6	148	90.1	0	0	109.3
1331	G	30.1	Very low	32.1	Very low	64 Å²	64	145.7 Å²	145.7	66%	0.66	74%	0.741	S	S	*	*			cis	141.9	72.2	-5.9	0	0	0	0	0	114.9
1332	K	33.1	Very low	31.8	Very low	208 Å²	208	143.6 Å²	143.6	90%	0.904	74%	0.739	S	S	*	*			trans	85.8	105	172.5	-54.2	172.1	178.4	174.6	0	118.9
1333	R	30.8	Very low	31.6	Very low	230 Å²	230	142.1 Å²	142.1	87%	0.868	74%	0.737	S	S	*	*				51.7	103.4	113.8	-163.8	-165.7	-168.9	175.3	4.6	119.9
1334	L	29.6	Very low	31.4	Very low	144 Å²	144	142.4 Å²	142.4	75%	0.754	74%	0.738	S	S	*	*				177.4	129	120.1	-106.7	101	0	0	0	107.4
1335	V	30.7	Very low	31.1	Very low	122 Å²	122	147.1 Å²	147.1	74%	0.739	75%	0.749	S	S	*	*				60.4	121.3	88.3	175.6	0	0	0	0	111.5
1336	T	31.7	Very low	30.9	Very low	119 Å²	119	143.7 Å²	143.7	73%	0.73	75%	0.747	S	S	*	*			cis	-150.1	175.4	13.5	35.1	0	0	0	0	109.9
1337	T	31.9	Very low	30.8	Very low	117 Å²	117	141.9 Å²	141.9	72%	0.718	74%	0.744	S	S	*	*			cis	-162.7	141.9	-20.9	29.7	0	0	0	0	112.1
1338	V	36	Very low	30.7	Very low	94 Å²	94	143.9 Å²	143.9	57%	0.57	75%	0.753	S	S	*	*			trans	-5.6	159.5	137.4	-119	0	0	0	0	120.9	K1340 L1341	V1338-K1340 HydrophobicContact CG1-CG 4.25Å; V1338-L1341 HydrophobicContact CG1-CD1 3.52Å
1339	P	34	Very low	30.7	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	76%	0.755	S	S	*	*				-131.1	162.3	65.8	40.5	-29.8	0	0	0	115.9
1340	K	31.3	Very low	30.7	Very low	179 Å²	179	140 Å²	140	78%	0.778	76%	0.761	S	S	*	*			cis	-165.8	113.8	-27.3	-105.9	-175.8	179.3	-178.4	0	104.3	V1338	V1338-K1340 HydrophobicContact CG1-CG 4.25Å
1341	L	29.4	Very low	30.6	Very low	152 Å²	152	133.2 Å²	133.2	80%	0.796	75%	0.746	S	S	*	*				44.9	137.9	86.9	-78.6	91.4	0	0	0	116.4	V1338	V1338-L1341 HydrophobicContact CG1-CD1 3.52Å
1342	G	30.4	Very low	30.7	Very low	65 Å²	65	138.4 Å²	138.4	67%	0.67	75%	0.753	S	S	*	*			cis	149.3	143.6	-10	0	0	0	0	0	116.9
1343	T	31	Very low	30.6	Very low	121 Å²	121	139.3 Å²	139.3	74%	0.742	75%	0.751	S	S	*	*			trans	52.6	115.8	136.1	58	0	0	0	0	124.2
1344	L	28.6	Very low	30.7	Very low	145 Å²	145	132.7 Å²	132.7	76%	0.759	74%	0.74	S	S	*	*				57.8	125.3	115.2	-58	165.9	0	0	0	124.1
1345	Y	28	Very low	30.7	Very low	198 Å²	198	132.6 Å²	132.6	78%	0.776	74%	0.74	S	S	*	*			trans	76.5	136	131.3	-87	-118.4	0	0	0	125.2
1346	N	29.3	Very low	30.6	Very low	137 Å²	137	135.3 Å²	135.3	73%	0.733	75%	0.749	S	S	*	*			trans	68.2	151.9	148.1	-73	1.2	0	0	0	120.3
1347	C	27.1	Very low	30.5	Very low	92 Å²	92	132.7 Å²	132.7	62%	0.622	75%	0.745	S	S	*	*			cis	-164.2	170.5	19.1	-139.9	0	0	0	0	114.6
1348	M	30.3	Very low	30.4	Very low	154 Å²	154	133.7 Å²	133.7	76%	0.759	75%	0.751	S	S	*	*			trans	66.7	108.6	154.5	-71.2	177	-70.8	0	0	120
1349	T	28.8	Very low	30.1	Very low	127 Å²	127	137 Å²	137	78%	0.779	76%	0.761	S	S	*	*				63	133.1	84.4	64.2	0	0	0	0	114.8
1350	V	31.3	Very low	29.8	Very low	143 Å²	143	138.5 Å²	138.5	87%	0.867	76%	0.757	S	S	*	*			cis	-148.9	160.9	25.6	176.4	0	0	0	0	107.7
1351	G	29.8	Very low	29.8	Very low	61 Å²	61	138 Å²	138	63%	0.629	76%	0.761	S	S	*	*			cis	159.6	-158.5	1.2	0	0	0	0	0	111.1
1352	H	32.9	Very low	29.8	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.796	75%	0.751	S	S	*	*			trans	67.1	116.5	-168.9	-76.4	-106.2	0	0	0	114.2
1353	R	30	Very low	29.8	Very low	228 Å²	228	138.9 Å²	138.9	86%	0.86	76%	0.759	S	S	*	*				66	128.3	83.4	-77.3	-167.8	178.4	-169.9	0.1	113.4
1354	S	32.2	Very low	29.6	Very low	91 Å²	91	140.9 Å²	140.9	64%	0.636	76%	0.758	S	S	*	*			cis	-173.8	156	4.4	42.8	0	0	0	0	114.7
1355	N	29.6	Very low	29.6	Very low	142 Å²	142	142 Å²	142	76%	0.759	76%	0.759	S	S	*	*			trans	79.7	143.5	153.8	-63.4	-0.8	0	0	0	120.7
1356	L	30	Very low	29.5	Very low	179 Å²	179	140.2 Å²	140.2	94%	0.937	76%	0.758	S	S	*	*			trans	66.2	129.9	164.1	-58.6	141.4	0	0	0	115.8
1357	G	29.2	Very low	29.5	Very low	63 Å²	63	141.6 Å²	141.6	65%	0.649	76%	0.76	S	S	*	*			cis	147.1	156.2	-4.6	0	0	0	0	0	110.8
1358	V	29.8	Very low	29.8	Very low	139 Å²	139	142 Å²	142	84%	0.842	77%	0.769	S	S	*	*			trans	67	139.5	172	-178.6	0	0	0	0	114
1359	E	30.5	Very low	29.8	Very low	164 Å²	164	140.3 Å²	140.3	77%	0.766	77%	0.772	S	S	*	*			cis	-162.7	-162	-30.5	-136.1	170.9	166.1	0	0	108.5
1360	Q	27	Very low	29.9	Very low	157 Å²	157	141.5 Å²	141.5	73%	0.734	77%	0.774	S	S	*	*			trans	-61	146.9	179.2	-56	163.5	5	0	0	113.7
1361	I	30.4	Very low	30.1	Very low	168 Å²	168	140.2 Å²	140.2	86%	0.862	77%	0.771	S	S	*	*			trans	-130.2	117	143	-62.7	-176.8	0	0	0	108.1
1362	I	30.1	Very low	30.2	Very low	117 Å²	117	140.6 Å²	140.6	60%	0.6	78%	0.776	S	S	*	*			trans	-98	125.8	162.1	-61	172.3	0	0	0	105.9	F1364	I1362-F1364 HydrophobicContact CB-CD2 4.34Å; I1362-F1364 HydrophobicContact CG2-CD2 3.74Å; I1362-F1364 HydrophobicContact CG2-CE2 3.94Å; I1362-F1364 PolarHBondContact O-N 2.98Å
1363	S	29.7	Very low	30.1	Very low	119 Å²	119	144.7 Å²	144.7	83%	0.832	78%	0.784	S	S	*	*			trans	-77.2	101.7	172.1	53.5	0	0	0	0	109.5
1364	F	27.7	Very low	30.2	Very low	163 Å²	163	137.8 Å²	137.8	72%	0.715	78%	0.784	S	S	*	*			trans	-88.8	177.6	177.7	-111.1	-81.3	0	0	0	113	I1362	I1362-F1364 HydrophobicContact CB-CD2 4.34Å; I1362-F1364 HydrophobicContact CG2-CD2 3.74Å; I1362-F1364 HydrophobicContact CG2-CE2 3.94Å; I1362-F1364 PolarHBondContact O-N 2.98Å
1365	E	28.2	Very low	30.1	Very low	169 Å²	169	136.6 Å²	136.6	79%	0.79	79%	0.786	S	S	*	*			trans	-74	-175.5	-170.6	-63.7	156.1	109.1	0	0	114.7
1366	E	25.6	Very low	30.3	Very low	160 Å²	160	135.2 Å²	135.2	75%	0.748	79%	0.788	S	S	*	*			trans	-72.5	175	178.5	-53.8	179	68.9	0	0	114.8
1367	H	30.5	Very low	30.3	Very low	166 Å²	166	135.2 Å²	135.2	77%	0.769	78%	0.783	S	S	*	*			trans	86.1	168.9	154.5	-56.1	-18.8	0	0	0	119.5
1368	A	32.7	Very low	30.4	Very low	99 Å²	99	141 Å²	141	82%	0.818	79%	0.793	S	S	*	*			trans	74.9	85.8	167.5	0	0	0	0	0	118.3
1369	S	31.1	Very low	30.5	Very low	119 Å²	119	140.8 Å²	140.8	83%	0.832	78%	0.783	S	S	*	*			trans	-51.4	150.4	156.8	-39.9	0	0	0	0	114.8
1370	D	30.6	Very low	30.5	Very low	153 Å²	153	141.7 Å²	141.7	82%	0.818	79%	0.792	S	S	*	*			trans	59.5	102.8	139	-165.5	16.8	0	0	0	120
1371	S	34.7	Very low	30.5	Very low	115 Å²	115	138.6 Å²	138.6	80%	0.804	78%	0.784	S	S	*	*				175.2	162.2	116.2	47	0	0	0	0	113.5
1372	G	31.9	Very low	30.7	Very low	70 Å²	70	137.7 Å²	137.7	72%	0.722	79%	0.786	S	S	*	*				120.9	8.4	126.8	0	0	0	0	0	123.6
1373	R	31.1	Very low	30.8	Very low	257 Å²	257	140.4 Å²	140.4	97%	0.97	80%	0.796	S	S	*	*			trans	43.6	110.2	143.4	-170.8	-169.6	-162.6	175.3	6.8	120.6
1374	G	31.4	Very low	30.9	Very low	83 Å²	83	141.9 Å²	141.9	86%	0.856	80%	0.795	S	S	*	*			trans	135.1	148.8	159.1	0	0	0	0	0	113.1
1375	G	31.2	Very low	31.1	Very low	67 Å²	67	144.8 Å²	144.8	69%	0.691	80%	0.802	S	S	*	*			cis	144.7	127.8	-7.5	0	0	0	0	0	112.5
1376	S	31.9	Very low	31.6	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	80%	0.799	S	S	*	*			trans	50	142.6	157.7	48.1	0	0	0	0	119.8
1377	E	30.1	Very low	32.3	Very low	179 Å²	179	139.4 Å²	139.4	84%	0.836	79%	0.789	S	S	*	*			cis	-151.6	167	2.3	-103.4	149.9	178.9	0	0	106.9
1378	E	31.9	Very low	32.7	Very low	185 Å²	185	138.2 Å²	138.2	86%	0.864	78%	0.783	S	S	*	*				167.3	163.9	93.2	-85.6	-175.3	172.8	0	0	107
1379	E	31.7	Very low	32.9	Very low	134 Å²	134	141.3 Å²	141.3	63%	0.626	78%	0.778	S	S	*	*			cis	-161.1	140.7	-36.8	-167.3	-163.1	172.5	0	0	106.9	T1381	E1379-T1381 HydrophobicContact CG-CG2 3.77Å; E1379-T1381 VanDerWaalsContact OE1-CG2 3.24Å; E1379-T1381 WeakPolarHBondContact OE1-CG2 3.47Å; E1379-T1381 PolarHBondContact OE1-OG1 3.36Å
1380	L	31.2	Very low	33.1	Very low	183 Å²	183	139.6 Å²	139.6	96%	0.958	77%	0.771	S	S	*	*			trans	-161.8	111.6	142.8	-112.2	169.3	0	0	0	109.8
1381	T	27.3	Very low	33.3	Very low	92 Å²	92	140.5 Å²	140.5	56%	0.564	77%	0.77	S	S	*	*			trans	-113.8	133.6	-157.8	42.4	0	0	0	0	114.1	E1379	E1379-T1381 HydrophobicContact CG-CG2 3.77Å; E1379-T1381 VanDerWaalsContact OE1-CG2 3.24Å; E1379-T1381 WeakPolarHBondContact OE1-CG2 3.47Å; E1379-T1381 PolarHBondContact OE1-OG1 3.36Å
1382	V	33.4	Very low	33.2	Very low	148 Å²	148	140.9 Å²	140.9	90%	0.897	77%	0.768	S	S	*	*			trans	-143.9	83.5	154.8	-169.3	0	0	0	0	112
1383	Q	32.5	Very low	33.3	Very low	174 Å²	174	143.9 Å²	143.9	81%	0.813	77%	0.766	S	S	*	*			trans	17.4	115.3	145.7	-60.6	175.9	-7.1	0	0	121.6
1384	N	31.3	Very low	33.4	Very low	151 Å²	151	137.7 Å²	137.7	81%	0.807	75%	0.751	S	S	*	*				30.3	129.7	127.2	-57.3	-6.6	0	0	0	121.9
1385	Y	33.3	Very low	33.2	Very low	223 Å²	223	138.2 Å²	138.2	88%	0.875	74%	0.742	S	S	*	*				-167.1	114.3	112.9	-122.7	-86.4	0	0	0	114
1386	D	39.2	Very low	33.2	Very low	134 Å²	134	141.6 Å²	141.6	72%	0.717	74%	0.744	S	S	*	*				20.4	161.7	129.2	-126.1	38.9	0	0	0	122.2
1387	P	39.7	Very low	33.2	Very low	83 Å²	83	144.2 Å²	144.2	54%	0.539	75%	0.746	S	S	.	*			cis	-137.9	173.3	-42	35.3	-19.2	0	0	0	114.5
1388	H	38.9	Very low	33.3	Very low	141 Å²	141	142.4 Å²	142.4	65%	0.653	74%	0.742	S	S	*	*				168.7	130.6	117.2	-96.6	-20	0	0	0	117.5
1389	K	35.8	Very low	33.5	Very low	164 Å²	164	139 Å²	139	71%	0.713	74%	0.736	S	S	*	*			trans	60.7	135.3	137.8	-65.8	161	179.8	153.1	0	119.2
1390	A	36.5	Very low	33.4	Very low	83 Å²	83	140.2 Å²	140.2	69%	0.686	74%	0.741	S	S	*	*			cis	-141.2	142.7	4	0	0	0	0	0	108.8
1391	E	35	Very low	33.5	Very low	171 Å²	171	140.3 Å²	140.3	80%	0.799	73%	0.734	S	S	*	*				57	121.3	65.7	-80.7	178.7	-178.6	0	0	112.7
1392	T	32	Very low	33.9	Very low	123 Å²	123	142.3 Å²	142.3	76%	0.755	74%	0.742	S	S	*	*			cis	-145.8	-140	-10.8	-21.9	0	0	0	0	108.7
1393	I	34.1	Very low	33.9	Very low	133 Å²	133	142.5 Å²	142.5	68%	0.682	74%	0.736	S	S	*	*			cis	-158.8	152.4	9.7	-150.7	156.2	0	0	0	111.7
1394	I	32.7	Very low	33.7	Very low	128 Å²	128	138.8 Å²	138.8	66%	0.656	73%	0.729	S	S	*	*			trans	23	103.1	148.5	-62.4	171.3	0	0	0	116.6
1395	S	28.1	Very low	33.7	Very low	94 Å²	94	137.6 Å²	137.6	66%	0.657	72%	0.721	S	S	*	*				54.3	109.2	68.5	81.5	0	0	0	0	116.3
1396	N	30.4	Very low	33.6	Very low	138 Å²	138	137.6 Å²	137.6	74%	0.738	72%	0.72	S	S	*	*			trans	173.7	156.1	140.8	-95.9	-32.2	0	0	0	115.5
1397	M	32.5	Very low	33.3	Very low	167 Å²	167	138 Å²	138	82%	0.823	72%	0.723	S	S	*	*			trans	68.6	100	149.2	-70.9	161.5	-172.6	0	0	120.7
1398	N	32.7	Very low	32.8	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	74%	0.737	S	S	*	*			trans	-47.7	153.8	141.1	-153.4	17.8	0	0	0	111.1
1399	P	34.5	Very low	32.6	Very low	115 Å²	115	141.2 Å²	141.2	75%	0.747	74%	0.743	S	S	*	*				-147	173.1	93.1	41.1	-26.2	0	0	0	116.4
1400	E	30.8	Very low	32.3	Very low	158 Å²	158	139.6 Å²	139.6	74%	0.738	75%	0.747	S	S	*	*			trans	-69.2	175.1	176.8	-48	155.3	121.5	0	0	114.3
1401	K	32.5	Very low	32.1	Very low	185 Å²	185	143.5 Å²	143.5	80%	0.804	76%	0.755	S	S	*	*			trans	102.5	139.7	168.6	-62.6	169.3	-175.7	174	0	114.5
1402	D	35.5	Very low	31.9	Very low	135 Å²	135	143.1 Å²	143.1	72%	0.722	75%	0.753	S	S	*	*	S	Bend	cis	-121.9	145.7	22.1	-98.8	-42.6	0	0	0	117.6
1403	I	34.4	Very low	32	Very low	152 Å²	152	143.5 Å²	143.5	78%	0.779	75%	0.75	S	S	*	*			trans	61.6	105.7	143.6	-59.4	163.4	0	0	0	119.5
1404	S	28.9	Very low	32	Very low	96 Å²	96	144 Å²	144	67%	0.671	75%	0.754	S	S	*	*			trans	-92.3	-173.7	161.1	53.6	0	0	0	0	112.3
1405	I	30.3	Very low	32.2	Very low	125 Å²	125	142.2 Å²	142.2	64%	0.641	76%	0.759	S	S	*	*			trans	68.4	137.5	172.7	-17	179	0	0	0	112.3
1406	W	32.2	Very low	32.5	Very low	223 Å²	223	143 Å²	143	85%	0.845	76%	0.764	S	S	*	*			cis	-134.9	143.6	21.3	-66.5	63.4	0	0	0	110.6
1407	N	32.6	Very low	32.7	Very low	144 Å²	144	144.8 Å²	144.8	77%	0.77	77%	0.773	S	S	*	*				76.9	145.8	63.6	-121	35	0	0	0	114.7
1408	E	29	Very low	32.8	Very low	179 Å²	179	143.8 Å²	143.8	84%	0.836	77%	0.771	S	S	*	*			trans	-78.4	-178.8	-163.4	-54.9	177.1	109	0	0	115.9
1409	S	34.3	Very low	32.9	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	77%	0.766	S	S	*	*			trans	92	107.5	157.7	74	0	0	0	0	119.2
1410	T	29.1	Very low	33	Very low	130 Å²	130	142.8 Å²	142.8	80%	0.798	77%	0.767	S	S	*	*			trans	-25.4	144.5	147.8	49.4	0	0	0	0	117.3
1411	I	33.2	Very low	33.3	Very low	165 Å²	165	142.5 Å²	142.5	85%	0.846	77%	0.769	S	S	*	*				-159.7	154.6	123.2	-103.6	154.6	0	0	0	110.1
1412	Q	30.4	Very low	33.4	Very low	162 Å²	162	138.8 Å²	138.8	76%	0.757	76%	0.764	S	S	*	*			trans	-84.3	159.3	-174.2	-59.4	149.6	-87.8	0	0	112.6
1413	N	33.7	Very low	33.2	Very low	131 Å²	131	138 Å²	138	70%	0.701	76%	0.76	S	S	*	*				178.8	138.7	109.9	-90.8	-0.2	0	0	0	116.1
1414	D	34.1	Very low	33	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	76%	0.76	S	S	*	*			trans	70.4	153.1	141.7	-59.7	-31	0	0	0	124.9
1415	A	36.3	Very low	33.1	Very low	91 Å²	91	139.8 Å²	139.8	75%	0.752	76%	0.763	S	S	*	*			trans	71.3	66.1	169.4	0	0	0	0	0	117.7
1416	S	34.4	Very low	33	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	77%	0.77	S	S	*	*				73.3	109.1	61.4	89.8	0	0	0	0	116.7
1417	L	36.1	Very low	32.9	Very low	175 Å²	175	136 Å²	136	92%	0.916	77%	0.765	S	S	*	*			trans	-155.3	113.8	141.6	-122.9	161.9	0	0	0	110.5
1418	N	33.5	Very low	32.7	Very low	146 Å²	146	134.8 Å²	134.8	78%	0.781	77%	0.768	S	S	*	*			trans	-70.7	161.4	-178.5	-73.9	-30	0	0	0	111
1419	S	35.8	Very low	32.8	Very low	94 Å²	94	133.3 Å²	133.3	66%	0.657	77%	0.765	S	S	*	*				177	149.6	64.7	43.7	0	0	0	0	115.5
1420	N	36.7	Very low	32.7	Very low	141 Å²	141	132.4 Å²	132.4	75%	0.754	76%	0.758	S	S	*	*			trans	64.9	153.5	145.1	-59.3	-8.1	0	0	0	120.5
1421	L	35.9	Very low	33.2	Very low	151 Å²	151	133.5 Å²	133.5	79%	0.791	76%	0.759	S	S	*	*			cis	-165.6	175.8	-24.5	-101.9	169.8	0	0	0	105.2
1422	P	35.4	Very low	33.7	Very low	108 Å²	108	130.2 Å²	130.2	70%	0.701	75%	0.749	S	S	*	*			trans	-123.6	-177.3	-145.4	46.3	-38.3	0	0	0	117.3
1423	D	30.6	Very low	34	Very low	118 Å²	118	131.1 Å²	131.1	63%	0.631	75%	0.745	S	S	*	*			trans	73.5	131.2	145.7	-162.6	34.5	0	0	0	119.8
1424	K	31	Very low	34	Very low	180 Å²	180	135.1 Å²	135.1	78%	0.783	76%	0.757	S	S	*	*			trans	61.7	146.6	177.4	-64.4	148.7	-169.2	145	0	115.2
1425	S	29.9	Very low	34.1	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	74%	0.743	S	S	*	*			cis	-150.7	-165.5	28.5	58.6	0	0	0	0	112.8
1426	D	28.4	Very low	34.1	Very low	146 Å²	146	135.8 Å²	135.8	78%	0.781	75%	0.75	S	S	*	*			trans	-54.6	151.1	173.5	-42.2	-99.3	0	0	0	114.3
1427	V	31.1	Very low	34.1	Very low	124 Å²	124	135.8 Å²	135.8	75%	0.752	75%	0.745	S	S	*	*				-177.9	124.6	119.4	147.1	0	0	0	0	110.3	L1429	V1427-L1429 HydrophobicContact CG1-CB 4.01Å
1428	S	28.3	Very low	34.1	Very low	118 Å²	118	131.7 Å²	131.7	83%	0.825	74%	0.737	S	S	*	*			trans	-86.8	105.5	161	55.5	0	0	0	0	109.5
1429	L	31.6	Very low	34.2	Very low	148 Å²	148	130.1 Å²	130.1	78%	0.775	74%	0.738	S	S	*	*			trans	-163.1	108.9	163.7	-105.1	162.1	0	0	0	111.4	V1427	V1427-L1429 HydrophobicContact CG1-CB 4.01Å
1430	S	31.3	Very low	34.3	Very low	92 Å²	92	131 Å²	131	64%	0.643	74%	0.741	S	S	*	*			trans	-0.1	136.3	149.1	57.6	0	0	0	0	120.4
1431	N	40	Very low	34.2	Very low	154 Å²	154	133.5 Å²	133.5	82%	0.824	75%	0.751	S	S	*	*				37.4	147.2	120.6	-84.6	13.9	0	0	0	119.6
1432	P	43	Very low	34	Very low	95 Å²	95	129.8 Å²	129.8	62%	0.617	75%	0.749	S	S	*	*				-166.1	-174.9	62.9	48.3	-27.2	0	0	0	121
1433	W	37.6	Very low	33.7	Very low	181 Å²	181	129.6 Å²	129.6	69%	0.686	75%	0.75	S	S	*	*			trans	61.7	117.9	147.1	-60.2	133.7	0	0	0	121.4	E1435	W1433-E1435 HydrophobicContact CB-CB 4.12Å; W1433-E1435 HydrophobicContact CD2-CB 3.93Å; W1433-E1435 HydrophobicContact CD2-CG 4.07Å; W1433-E1435 HydrophobicContact CE3-CB 3.78Å; W1433-E1435 HydrophobicContact CE3-CG 3.97Å; W1433-E1435 HydrophobicContact CG-CB 4.06Å; W1433-E1435 HydrophobicContact CZ3-CG 4.31Å
1434	F	34.1	Very low	33.7	Very low	216 Å²	216	130.9 Å²	130.9	95%	0.947	76%	0.757	S	S	*	*				-104.5	146.8	106.8	-120.1	-93.2	0	0	0	108.5
1435	E	35.9	Very low	33.7	Very low	102 Å²	102	133.6 Å²	133.6	48%	0.477	76%	0.764	S	S	.	*			trans	-141.1	148.3	-156.6	-177.8	-173.9	-119.8	0	0	111.8	W1433 T1437	W1433-E1435 HydrophobicContact CB-CB 4.12Å; W1433-E1435 HydrophobicContact CD2-CB 3.93Å; W1433-E1435 HydrophobicContact CD2-CG 4.07Å; W1433-E1435 HydrophobicContact CE3-CB 3.78Å; W1433-E1435 HydrophobicContact CE3-CG 3.97Å; W1433-E1435 HydrophobicContact CG-CB 4.06Å; W1433-E1435 HydrophobicContact CZ3-CG 4.31Å; E1435-T1437 HydrophobicContact CG-CG2 4.19Å
1436	T	35.6	Very low	33.6	Very low	146 Å²	146	137.8 Å²	137.8	90%	0.896	77%	0.772	S	S	*	*			trans	-145.9	126.4	152.5	-16.9	0	0	0	0	111.2
1437	T	35.3	Very low	33.7	Very low	111 Å²	111	140.9 Å²	140.9	68%	0.681	77%	0.772	S	S	*	*			trans	-88.1	174.3	-178.2	56	0	0	0	0	111.2	E1435	E1435-T1437 HydrophobicContact CG-CG2 4.19Å
1438	A	36.1	Very low	33.8	Very low	90 Å²	90	142.3 Å²	142.3	74%	0.744	77%	0.771	S	S	*	*			cis	-145.4	-165.2	7.7	0	0	0	0	0	108.7
1439	S	35.6	Very low	33.9	Very low	113 Å²	113	140.4 Å²	140.4	79%	0.79	76%	0.758	S	S	*	*			cis	-160.8	166.1	9.2	-139.5	0	0	0	0	110.3
1440	P	36.9	Very low	34	Very low	113 Å²	113	143.3 Å²	143.3	73%	0.734	76%	0.758	S	S	*	*			trans	-102.9	-174.2	-171.5	40.1	-35.5	0	0	0	115.8
1441	M	35.1	Very low	34.1	Very low	193 Å²	193	149.3 Å²	149.3	95%	0.951	77%	0.773	S	S	*	*			trans	91.1	137.9	173.1	-52.6	-177.5	74.3	0	0	117.1
1442	G	31.6	Very low	34	Very low	73 Å²	73	147.6 Å²	147.6	75%	0.753	77%	0.772	S	S	*	*			trans	134.1	94.8	157.7	0	0	0	0	0	117.4
1443	S	29.6	Very low	33.6	Very low	103 Å²	103	151.8 Å²	151.8	72%	0.72	79%	0.785	S	S	*	*			trans	-15	145.3	154.1	54.3	0	0	0	0	120.7
1444	D	28.9	Very low	33.5	Very low	146 Å²	146	147.5 Å²	147.5	78%	0.781	78%	0.783	S	S	*	*			trans	35.5	110	136.7	-54.8	-47.1	0	0	0	119.9
1445	Y	32.5	Very low	33.5	Very low	237 Å²	237	143.3 Å²	143.3	93%	0.929	78%	0.775	S	S	*	*				-162.4	117.4	128.6	-118.1	-76.2	0	0	0	111.4
1446	Q	27.8	Very low	33.9	Very low	193 Å²	193	147 Å²	147	90%	0.902	81%	0.808	S	S	*	*			trans	-86.4	137.2	175	-73.1	-173.8	-28.6	0	0	112
1447	R	30.4	Very low	33.9	Very low	211 Å²	211	147.1 Å²	147.1	80%	0.796	80%	0.804	S	S	*	*			trans	-150.6	127.4	158.2	-96.9	-161.4	147	139.6	3.2	109.2
1448	E	31.6	Very low	33.8	Very low	154 Å²	154	148.9 Å²	148.9	72%	0.72	81%	0.81	S	S	*	*				64.2	123.5	85.6	-67	-168.2	119.7	0	0	113.3
1449	S	32.4	Very low	33.7	Very low	78 Å²	78	152.2 Å²	152.2	55%	0.545	81%	0.814	S	S	.	*			cis	-164.6	163.2	3.5	65.6	0	0	0	0	114.4
1450	R	32.9	Very low	33.5	Very low	208 Å²	208	154.5 Å²	154.5	79%	0.785	82%	0.815	S	S	*	*			trans	67.3	107.7	154	-75.1	173.2	-83.1	-164.3	-8.7	119.6
1451	F	32.6	Very low	33.3	Very low	219 Å²	219	157.1 Å²	157.1	96%	0.961	82%	0.82	S	S	*	*				-129.6	172.7	86.2	-100.6	-89.3	0	0	0	109.2
1452	C	37.8	Very low	33.2	Very low	118 Å²	118	154.7 Å²	154.7	80%	0.797	81%	0.812	S	S	*	*			trans	-93.2	149.2	-162.4	-71.8	0	0	0	0	116.2
1453	M	34.2	Very low	33.3	Very low	182 Å²	182	160.6 Å²	160.6	90%	0.897	82%	0.816	S	S	*	*			trans	-44	163.9	156.6	-70	167.4	165.4	0	0	113.5
1454	S	36.6	Very low	33.6	Very low	91 Å²	91	165 Å²	165	64%	0.636	82%	0.823	S	S	*	*			cis	-166.2	135.6	8.2	25.6	0	0	0	0	107.2
1455	T	34.3	Very low	34	Very low	128 Å²	128	166.6 Å²	166.6	79%	0.785	83%	0.827	S	S	*	*				50.3	143.6	80.9	70.5	0	0	0	0	115.7
1456	P	44.8	Very low	34.1	Very low	180 Å²	180	160.2 Å²	160.2	100%	1.169	82%	0.818	S	S	*	*			cis	-88.7	0	2.5	35.4	-32.3	0	0	0	113.7

Retrieved 1,456 of 1,456 residues in 1356.8 ms (Link to these results)

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