A0A077Z1A0_TRITR Loading...

Transmembrane cell adhesion receptor mua 3

AlphaFold DB , UniProt , Accession A0A077Z1A0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 2,584 aa.

						>A0A077Z1A0_TRITR|A0A077Z1A0
MGSGRLKDCRFRPPRLGYPLHLDLRTHDRPMVMSLLIRRLSTVFLFAVLLPCITSPVDAQYTAASPACSSSQSTPSTFSEQLVTVCHPVGAWEQGFVSGSYSQTSTSGKNPFLRPEFRVPCNVRDPLACNTSLLEVCTFNSGAYGCTCPPNYSRLPDGRCKVANECFERSMNNCSANAICIDEIESYRCQCKPGFTDISPDRSRLPGRICVVVEAQCGSPSRYGVDCDPNAQCVDTPKGFTCKCNAGFVDTSEYVNMKPGRKCSKEINECADSKLNDCHPNASCVDTKIGYTCRCHVGYIDVSPNVACYPGRDCILPKPSESPDRICSPSTVHPCPSGETCTLVGTVYRCTCPAQAKRLENGRCAVVDNCRSGQTLCDPNASCINLIDGYTCQCNSGYKDISPDPIKKPGRKCTQLINECTVPWMNDCSPFAECVDTTESYMCQCKAGYVDVSSVYAWSTMHQWYQKCFASENLYCFQLSVTDMCADPSLNSCDPEAICIKKPDGYICVCPDGYRDVSSNAKLPPGRVCTIQTLCPMQPTDLVFLIDGSGSIGTEIFYRYVLRFVHEFVTLFEINRQKTRVGIVQYTGHVKSEFFLGQHTDIDKLQNAIRNIRYIGGLTKTGAAIEFMTRKTFTEQMGARSRDPNVYRIGVVITDGRAQDEVTGPADEARRHNISLYAVGVTNHVLKSELIQIAGSRDRVFIVGSFTDLNTRLRAKIQKEMCKDETVDVERPAQKCATSETDIESMCDRSRNEVCVHGTCGCSAGFCKDIKTGECGTPLCNPELPSSCPYPFVCKITIYGDARCACPVDHICHPQERTCISAILLNISVKPSFQYECKQNEEFNYGSGKCEPKGTFCKPVCDPRKKEECRPDPHAPSRLACQCPEKYHRDPDTGICQINECAHQLHDCSPFATCTDTFDGFICTCSPGFIDESPDRVNKPGRKCTKPMNPCESGRHNCSLNAQCYPTATGGFTCQCKEGYLDVSPNVQQAAGLVCKQKINECADKSLNNCSENAVCTDTDTGYLCHCKSGFRDLSPLQLPGRKCVQDICQLPEYNDCWRGRCRTIDAEKGQYACEPCPAGFMDKSPDPNLPGRICVPKKSPCSDTSQNDCSHYASCIEVGEHGYSCQCRDGYEDVSPDPKKKPGRVCEPVVDPCRDQSLNECDINALCEKRRRGYTCTCKTGYKDTSPDKANYPGRQCTRLVNECEHYQMNNCSRYANCIDQEDGYTCKCISGYHDNNPRMPGRECTLIINECQSPNLNDCHPQADCEDLLVGYKCRCRPPYVDHSPNPEKPGRVCKCTDSSAKVIMHSFLLRFHVLDNECLDPALNDCDPNAECQDTDTSYVCFCKEGYQDMDVTKPGRNCMQVTTQTTPVTEQQCDIQCASRLCCSSKGEVCLRGKCSCPPGFGRSTQNDNCVAVDTVVIPVVVNRFGESPLVWSSTFTDSKSPRFMEFADLFSHGINQAIDKTSIEPFYVDTTVTEIKNSKHVNQKLPEGLLVEAKVNILRGSSSQEEICKELEKSIEKAGHKIGTTNLYTPESYSICKPPKQTEEPLCGNKKCDTALGEVCIGKQVCTCPYGQGRHASNDHCQDIIGIHLPLLVRRKNQEILHYNRSYAESSSEPYKTIVKTFHDGIGKAFERTNLWSQYAGNEVRDIRDPGQMNSTWKSGLWFEFTTYFLKGYEPSPAEAWQQLFQSIKQTGYSIGGTDLYIDEQQPPFACYQHQCDKKAILIDRGDGVCACKCPSGYVDKDVLHPGTYCVPMIPTAPPLTTLPPNCGEKHCYSSLSEVCVGGECVCPKGMSRRLLGQPCIQVEKFEVPIIVDRWASMPLQWSTVYDHENDPRFIEMHNVYLSAFGQAVKAIPDLDSSTVSFEVESIKDPSKTYSTVGSGLLFNTTVNTSPGSIDKEQFCKTLFQQIKAASGKLGSSKLHVDTSVDSCAPLPKPTTELPCGTSHCKADLGEVCIGGRICSCPFGFGRKHPGDQCVETLPVSMPLWVIRRNQDPLYYGKNYSDADSPLRKAIVEMFEDGIKKAYGRTSLNGNFVDVAVRDIQNPSRINDTFTKGLWFEFIVHFTPTASFTAANAHKELLQSIRGTGYSIGGTELYINEWQPSLACYKNDCFKGGLCIPLEDGSYTCRCPPKYEDKRPSQPGRMCTMVSNPCSDKSLNTCDPNAECVFISGGEYRCECKPGYVEPFGFAGPRGTKCVYDLCADLPFCKEKNATCVNFGDRADCQCLDGYLDIRKSPVSTRAQLGLDDVFCLKPSDTDRCALGLHNCLPPAVCIGGKGEAPQCRCPDGSLTFEGVLCREKLDTCAECNYHGDCIFKDNKTTCHHCIRNRGLIYREMGASSGSEGLSAGYGRDSDFYTDFSIPRAKLKEPPMKGYTNAAADAGADRRMMQYLEGEGRQGDEQVGSETIAFSDVAQGIPGRADAYRDDMSESSEYSSASYQEEIRRKVTKDTTRTITTKTTNAAGVTTTTTAAFNVYPPEAITEAIAAHLIETYIRLGKECWVTVIRKIICFSPVCSFSLRRKHQLFFLNSFYATVLQDEQDFSSTEYDEAASDTSSQILGVKDVSFLLVQIEQQDKAIINITI
					

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(Predicted Aligned Error values between residue pairs)

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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	20.7	Very low	23.3	Very low	94 Å²	94	134 Å²	134	46%	0.463	69%	0.694	S	S	.	*				0	133.6	0	-118.9	-171.8	-168.9	0	0	106.9	S3 P1763 P1764 L1765	M1-S3 WeakPolarHBondContact O-CB 3.45Å; M1-S3 PolarHBondContact O-N 3.21Å; M1-S3 VanDerWaalsContact O-N 3.08Å; M1-S3 PolarHBondContact O-OG 2.63Å; M1-P1763 PolarHBondContact N-O 3.31Å; M1-P1764 CarbonylContact O-C 2.65Å; M1-P1764 VanDerWaalsContact O-C 3.29Å; M1-L1765 HydrophobicContact CB-CB 3.84Å; M1-L1765 HydrophobicContact CB-CD1 4.32Å; M1-L1765 HydrophobicContact CB-CG 3.63Å; M1-L1765 HydrophobicContact CE-CD1 4.38Å; M1-L1765 HydrophobicContact CG-CB 4.05Å; M1-L1765 HydrophobicContact CG-CD1 3.72Å; M1-L1765 HydrophobicContact CG-CG 3.62Å; M1-L1765 HydrophobicContact SD-CB 3.86Å; M1-L1765 HydrophobicContact SD-CD1 3.82Å; M1-L1765 HydrophobicContact SD-CG 3.97Å
2	G	22.1	Very low	23.5	Very low	31 Å²	31	137.1 Å²	137.1	32%	0.32	69%	0.69	S	S	.	*			trans	-36.8	103.4	-162.1	0	0	0	0	0	117	L1765 T1766	G2-L1765 CarbonylContact O-C 2.9Å; G2-L1765 WeakPolarHBondContact O-CA 3.15Å; G2-T1766 PolarHBondContact O-N 2.77Å
3	S	25.6	Very low	23.6	Very low	89 Å²	89	131.5 Å²	131.5	62%	0.622	67%	0.669	S	S	*	*			cis	57.7	65.1	14.4	-53.4	0	0	0	0	113.1	M1	M1-S3 WeakPolarHBondContact O-CB 3.45Å; M1-S3 PolarHBondContact O-N 3.21Å; M1-S3 VanDerWaalsContact O-N 3.08Å; M1-S3 PolarHBondContact O-OG 2.63Å
4	G	24.5	Very low	23.8	Very low	70 Å²	70	125.1 Å²	125.1	72%	0.722	64%	0.641	S	S	*	*			trans	176.8	-170.2	176.2	0	0	0	0	0	112.9
5	R	22.9	Very low	23.9	Very low	233 Å²	233	124.6 Å²	124.6	88%	0.879	63%	0.628	S	S	*	*			trans	1.2	130.8	154.2	-77.2	-173.8	-176.7	-170.9	2.6	116
6	L	26.2	Very low	23.6	Very low	145 Å²	145	125.4 Å²	125.4	76%	0.759	63%	0.633	S	S	*	*			cis	-136	154.7	19.5	-76.3	102.7	0	0	0	110.7
7	K	21.6	Very low	23.4	Very low	162 Å²	162	121.1 Å²	121.1	70%	0.704	63%	0.627	S	S	*	*				63.8	122.9	54.4	-92.3	-153.3	166.9	-155.7	0	114.9	C9	K7-C9 PolarHBondContact O-N 2.78Å
8	D	22.4	Very low	23.3	Very low	128 Å²	128	125.3 Å²	125.3	68%	0.684	64%	0.635	S	S	*	*				41.8	66.7	124.1	-45.6	-31.1	0	0	0	118.4
9	C	21.6	Very low	23.3	Very low	131 Å²	131	125 Å²	125	89%	0.885	64%	0.643	S	S	*	*			trans	-94.1	94.1	145.8	-78.2	0	0	0	0	109.2	K7	K7-C9 PolarHBondContact O-N 2.78Å
10	R	25.1	Very low	23.3	Very low	200 Å²	200	123.5 Å²	123.5	76%	0.755	64%	0.635	S	S	*	*			trans	-148.5	104.6	167.7	-75.3	-168.9	179.4	-171.7	1.2	110.7
11	F	23.9	Very low	23.4	Very low	191 Å²	191	123.8 Å²	123.8	84%	0.838	63%	0.634	S	S	*	*				-168.4	167	115.7	-118.8	-84.4	0	0	0	113.1
12	R	25.6	Very low	23.8	Very low	171 Å²	171	123 Å²	123	65%	0.645	63%	0.631	S	S	*	*			trans	-36.5	154.9	177.7	-78.1	176.8	162.8	-178.6	-6.3	118
13	P	24.6	Very low	24.3	Very low	65 Å²	65	125.4 Å²	125.4	42%	0.422	64%	0.637	S	S	.	*			trans	-137.7	123.9	140.1	14.8	11.3	0	0	0	116.1	I2418 P2419 G2420	P13-I2418 CarbonylContact C-O 3.19Å; P13-I2418 WeakPolarHBondContact CA-O 3.38Å; P13-I2418 WeakPolarHBondContact CB-O 3.41Å; P13-P2419 VanDerWaalsContact CB-C 3.46Å; P13-P2419 WeakPolarHBondContact CB-O 3.27Å; P13-P2419 WeakPolarHBondContact CG-O 3.49Å; P13-P2419 CarbonylContact O-C 3.52Å; P13-P2419 WeakPolarHBondContact O-CA 3.46Å; P13-G2420 PolarHBondContact O-N 3.07Å; P13-G2420 VanDerWaalsContact O-N 3.13Å
14	P	27	Very low	24.7	Very low	42 Å²	42	126.3 Å²	126.3	27%	0.273	63%	0.634	S	S	.	*			trans	-89.6	-131.8	170.6	8.8	5	0	0	0	122.3	G2417 I2418 P2419	P14-G2417 VanDerWaalsContact C-C 3.44Å; P14-G2417 VanDerWaalsContact CD-O 3.26Å; P14-G2417 WeakPolarHBondContact CD-O 3.04Å; P14-I2418 VanDerWaalsContact C-C 3.44Å; P14-I2418 CarbonylContact C-O 3.48Å; P14-I2418 WeakPolarHBondContact CD-O 3.03Å; P14-I2418 CarbonylContact O-C 3.51Å; P14-I2418 WeakPolarHBondContact O-CA 3.31Å; P14-I2418 PolarHBondContact O-N 3.35Å; P14-P2419 WeakPolarHBondContact O-CA 3.33Å; P14-P2419 VanDerWaalsContact O-CB 3.23Å; P14-P2419 WeakPolarHBondContact O-CB 3.47Å; P14-P2419 VanDerWaalsContact O-N 3.08Å
15	R	24.4	Very low	25.2	Very low	117 Å²	117	132.5 Å²	132.5	44%	0.442	64%	0.635	S	S	.	*			trans	-8.4	146.7	-162.6	-81.1	175.5	175.3	174.9	-1.1	122	G2417 I2418	R15-G2417 VanDerWaalsContact CB-CA 3.45Å; R15-G2417 VanDerWaalsContact N-C 3.33Å; R15-I2418 PolarHBondContact O-N 2.62Å
16	L	19.5	Very low	25.5	Very low	138 Å²	138	126.2 Å²	126.2	72%	0.723	62%	0.623	S	S	*	*			trans	65.6	91.1	161.9	-91.8	79.5	0	0	0	112.5
17	G	20.4	Very low	25.7	Very low	51 Å²	51	127 Å²	127	53%	0.526	62%	0.622	S	S	.	*			cis	72.9	132.4	9.4	0	0	0	0	0	112.8
18	Y	22.1	Very low	26	Very low	198 Å²	198	124.5 Å²	124.5	78%	0.776	62%	0.617	S	S	*	*			trans	51	95.8	-167	-59.2	-75.8	0	0	0	112.4	L20	Y18-L20 HydrophobicContact CD1-CD1 3.74Å; Y18-L20 HydrophobicContact CD1-CG 4.02Å; Y18-L20 HydrophobicContact CE1-CD1 4.49Å
19	P	21.8	Very low	26	Very low	119 Å²	119	128.8 Å²	128.8	77%	0.773	62%	0.624	S	S	*	*				-126.8	146	64.3	43.6	-34.7	0	0	0	111.3
20	L	23.7	Very low	26.3	Very low	95 Å²	95	127.8 Å²	127.8	50%	0.497	62%	0.615	S	S	.	*				54.5	97.8	55.6	-69.4	162.9	0	0	0	112	Y18 A2438	Y18-L20 HydrophobicContact CD1-CD1 3.74Å; Y18-L20 HydrophobicContact CD1-CG 4.02Å; Y18-L20 HydrophobicContact CE1-CD1 4.49Å; L20-A2438 HydrophobicContact CD2-CB 4.17Å
21	H	25	Very low	26.7	Very low	130 Å²	130	126.3 Å²	126.3	60%	0.602	62%	0.619	S	S	*	*				-160.5	175	110.9	-112.2	-87.7	0	0	0	109.4	S2439 Y2440	H21-S2439 CarbonylContact O-C 3.57Å; H21-S2439 VanDerWaalsContact O-CA 3.32Å; H21-S2439 WeakPolarHBondContact O-CA 3.28Å; H21-S2439 WeakPolarHBondContact O-CB 3.48Å; H21-S2439 VanDerWaalsContact O-O 3.11Å; H21-Y2440 WeakPolarHBondContact O-CB 3.11Å; H21-Y2440 PolarHBondContact O-N 3.24Å
22	L	30.5	Very low	27.4	Very low	78 Å²	78	123.1 Å²	123.1	41%	0.408	62%	0.615	S	S	.	*			trans	-2	118.4	177.2	-79.8	66	0	0	0	122.6	S2439 Y2440	L22-S2439 VanDerWaalsContact C-CB 3.45Å; L22-Y2440 HydrophobicContact CB-CD2 3.33Å; L22-Y2440 HydrophobicContact CB-CE2 3.82Å; L22-Y2440 HydrophobicContact CB-CG 4.05Å; L22-Y2440 HydrophobicContact CD2-CD2 4.38Å; L22-Y2440 HydrophobicContact CD2-CE2 3.99Å; L22-Y2440 HydrophobicContact CG-CD2 4.47Å; L22-Y2440 WeakPolarHBondContact O-CA 2.9Å; L22-Y2440 WeakPolarHBondContact O-CB 2.88Å; L22-Y2440 WeakPolarHBondContact O-CD2 3.02Å; L22-Y2440 PolarHBondContact O-N 3.27Å
23	D	31.4	Very low	28	Very low	81 Å²	81	123.2 Å²	123.2	43%	0.433	63%	0.625	S	S	.	*				70.3	165.1	129.6	-54.9	-22.1	0	0	0	120.4	S2439 Y2440	D23-S2439 VanDerWaalsContact N-CB 3.26Å; D23-S2439 PolarHBondContact N-OG 2.78Å; D23-Y2440 PolarHBondContact O-N 2.79Å
24	L	33.6	Very low	29.1	Very low	108 Å²	108	125 Å²	125	57%	0.565	64%	0.638	S	S	*	*			cis	-144.1	120.2	-21.6	-135.2	68.4	0	0	0	106.9
25	R	35.2	Very low	29.8	Very low	199 Å²	199	130.5 Å²	130.5	75%	0.751	67%	0.665	S	S	*	*				79.1	148.8	103.1	-87.7	-167.1	-146.9	164.4	7	119.7
26	T	29.9	Very low	30.3	Very low	101 Å²	101	131.5 Å²	131.5	62%	0.62	68%	0.678	S	S	*	*			trans	62.5	117.3	139.3	57.7	0	0	0	0	120.8
27	H	30.3	Very low	30.8	Very low	162 Å²	162	130.4 Å²	130.4	75%	0.75	67%	0.672	S	S	*	*				73.4	125.9	126	-71.1	-60.8	0	0	0	117.8
28	D	27.2	Very low	31.3	Very low	110 Å²	110	138.1 Å²	138.1	59%	0.588	69%	0.685	S	S	*	*				76.4	135.3	54.1	177.1	38	0	0	0	112.3
29	R	23.7	Very low	31.7	Very low	218 Å²	218	139.4 Å²	139.4	82%	0.823	69%	0.689	S	S	*	*			trans	66.3	166.2	168.1	-86	156	178.1	-171.4	-4	118.3
30	P	28.1	Very low	32.1	Very low	109 Å²	109	140.1 Å²	140.1	71%	0.708	69%	0.685	S	S	*	*			trans	-130.3	-148	-151.8	41.6	-21.7	0	0	0	112.3
31	M	33.7	Very low	32.4	Very low	169 Å²	169	138.8 Å²	138.8	83%	0.833	68%	0.684	S	S	*	*			trans	84.4	113.4	170.1	-59.2	-164.7	172.9	0	0	118
32	V	37.5	Very low	32.6	Very low	125 Å²	125	137.1 Å²	137.1	76%	0.758	68%	0.683	S	S	*	*			trans	69.4	117.4	135.7	-177	0	0	0	0	120.4
33	M	37.5	Very low	32.5	Very low	172 Å²	172	138.4 Å²	138.4	85%	0.847	69%	0.694	S	S	*	*			trans	78.1	111.9	155.4	-74.3	-175.3	179.6	0	0	124
34	S	48.9	Very low	32.3	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	71%	0.712	S	S	*	*				73.7	135.9	125.6	-49.6	0	0	0	0	125.7
35	L	41.5	Very low	32.1	Very low	159 Å²	159	144.7 Å²	144.7	83%	0.832	72%	0.719	S	S	*	*			trans	92.6	163.5	154.8	-44.1	-174.2	0	0	0	122.1
36	L	35.7	Very low	32.2	Very low	137 Å²	137	144 Å²	144	72%	0.717	72%	0.722	S	S	*	*			cis	-170.8	148.1	-38	-93.5	-177.9	0	0	0	116.2
37	I	29.1	Very low	32.3	Very low	115 Å²	115	144.1 Å²	144.1	59%	0.59	73%	0.733	S	S	*	*			trans	67.1	104.1	146.1	-56.9	163	0	0	0	125.9
38	R	30.6	Very low	32.1	Very low	214 Å²	214	143.1 Å²	143.1	81%	0.808	74%	0.738	S	S	*	*			trans	69.7	0	132.8	-55.3	172.9	-165.9	132.6	-0.5	132.2
39	R	31.6	Very low	32.7	Very low	224 Å²	224	145.1 Å²	145.1	85%	0.845	75%	0.748	S	S	*	*				0	128.5	0	-82.5	-179	168.1	-168	-2.4	131.9
40	L	28.5	Very low	33.6	Very low	135 Å²	135	142.1 Å²	142.1	71%	0.707	75%	0.747	S	S	*	*			trans	92.6	137.7	130.1	-68.2	170.8	0	0	0	133
41	S	30.4	Very low	33.8	Very low	66 Å²	66	142.7 Å²	142.7	46%	0.462	75%	0.751	S	S	.	*			trans	74.6	127.4	136.5	-61.6	0	0	0	0	134.2	R2445	S41-R2445 PolarHBondContact O-NE 3.02Å; S41-R2445 PolarHBondContact O-NH2 2.03Å
42	T	30.6	Very low	33.5	Very low	96 Å²	96	139.4 Å²	139.4	59%	0.589	74%	0.744	S	S	*	*			trans	78.8	0	130.3	53.9	0	0	0	0	134	R2445	T42-R2445 PolarHBondContact O-NE 2.93Å; T42-R2445 PolarHBondContact O-NH2 3.31Å
43	V	28	Very low	33.2	Very low	105 Å²	105	139.6 Å²	139.6	64%	0.636	74%	0.739	S	S	*	*				0	162.8	0	157.2	0	0	0	0	129.1	R2446	V43-R2446 PolarHBondContact O-NH2 2.84Å
44	F	27.2	Very low	33.4	Very low	183 Å²	183	137.1 Å²	137.1	80%	0.803	73%	0.733	S	S	*	*			trans	82.6	0	160.1	-82.9	-47	0	0	0	131.9
45	L	30	Very low	32.3	Very low	138 Å²	138	138 Å²	138	72%	0.723	74%	0.74	S	S	*	*				0	170.1	0	-120.9	176.7	0	0	0	123
46	F	36.1	Very low	31.7	Very low	185 Å²	185	135 Å²	135	81%	0.811	73%	0.73	S	S	*	*			trans	107.2	0	153.6	-61	-66.8	0	0	0	127.2
47	A	31.8	Very low	31.1	Very low	103 Å²	103	133.3 Å²	133.3	85%	0.851	73%	0.725	S	S	*	*				0	164.6	0	0	0	0	0	0	120.5
48	V	27.1	Very low	30.7	Very low	141 Å²	141	133 Å²	133	86%	0.855	72%	0.724	S	S	*	*			trans	-163.3	168.1	179.4	-145.8	0	0	0	0	120
49	L	39.6	Very low	30.2	Very low	152 Å²	152	125.5 Å²	125.5	80%	0.796	71%	0.708	S	S	*	*			trans	94.6	0	160.3	-53.2	-177.5	0	0	0	122.2
50	L	41.6	Very low	29.9	Very low	155 Å²	155	119.7 Å²	119.7	81%	0.812	69%	0.691	S	S	*	*				0	0	0	-97.6	171.8	0	0	0	115
51	P	32	Very low	29.6	Very low	121 Å²	121	118.9 Å²	118.9	79%	0.786	68%	0.679	S	S	*	*				0	179.8	0	45.5	-32.2	0	0	0	122.8
52	C	27.2	Very low	29.4	Very low	100 Å²	100	118.2 Å²	118.2	68%	0.676	67%	0.672	S	S	*	*			trans	-163.6	-166.7	176.3	-147.3	0	0	0	0	121.3	F78	C52-F78 HydrophobicContact CB-CD2 3.97Å; C52-F78 HydrophobicContact CB-CE2 3.34Å; C52-F78 HydrophobicContact CB-CZ 4.04Å; C52-F78 WeakPolarHBondContact SG-CE2 3.32Å
53	I	31.6	Very low	29.4	Very low	128 Å²	128	117.9 Å²	117.9	66%	0.656	68%	0.68	S	S	*	*			trans	-151.2	132.2	-151.7	-61.2	148.2	0	0	0	122.7	F78	I53-F78 VanDerWaalsContact C-CZ 3.45Å; I53-F78 WeakPolarHBondContact O-CE1 2.96Å; I53-F78 WeakPolarHBondContact O-CZ 3.44Å
54	T	42.2	Very low	29.3	Very low	120 Å²	120	116.5 Å²	116.5	74%	0.736	68%	0.679	S	S	*	*			trans	91.7	149.5	168.2	59	0	0	0	0	125.7	F78	T54-F78 WeakPolarHBondContact O-CE1 3.04Å
55	S	26.7	Very low	29	Very low	121 Å²	121	112.1 Å²	112.1	85%	0.846	67%	0.671	S	S	*	*			trans	108.6	175.4	157.6	99.6	0	0	0	0	119.7
56	P	27.3	Very low	28.6	Very low	97 Å²	97	109.6 Å²	109.6	63%	0.63	66%	0.663	S	S	*	*			trans	-138.7	-162	-140.1	48.2	-28.9	0	0	0	118.8
57	V	24.2	Very low	28.1	Very low	101 Å²	101	104.1 Å²	104.1	61%	0.612	65%	0.652	S	S	*	*			trans	76.7	138.7	153.8	163.2	0	0	0	0	119.5	Q60	V57-Q60 PolarHBondContact O-NE2 2.73Å
58	D	21.6	Very low	27.5	Very low	107 Å²	107	103.7 Å²	103.7	57%	0.572	64%	0.642	S	S	*	*	S	Bend	trans	30.1	132.1	166.2	-72	-56.3	0	0	0	121.2	Q60 Q839	D58-Q60 WeakPolarHBondContact O-CG 3.34Å; D58-Q60 PolarHBondContact O-NE2 2.99Å; D58-Q839 PolarHBondContact OD1-NE2 3.16Å
59	A	19.9	Very low	27.5	Very low	57 Å²	57	100.1 Å²	100.1	47%	0.471	62%	0.623	S	S	.	*	S	Bend	trans	53.6	-127.5	-153.4	0	0	0	0	0	109.5	Y61 T62 Q839	A59-Y61 PolarHBondContact O-N 2.67Å; A59-Y61 VanDerWaalsContact O-N 3.15Å; A59-T62 HydrophobicContact CB-CG2 4.29Å; A59-Q839 PolarHBondContact O-OE1 3.19Å
60	Q	23.8	Very low	26.8	Very low	103 Å²	103	94.8 Å²	94.8	48%	0.481	60%	0.598	S	S	.	*			trans	52.3	47.1	157.9	-60.9	179.3	100.5	0	0	116.9	V57 D58 T62	V57-Q60 PolarHBondContact O-NE2 2.73Å; D58-Q60 WeakPolarHBondContact O-CG 3.34Å; D58-Q60 PolarHBondContact O-NE2 2.99Å; Q60-T62 WeakPolarHBondContact CA-OG1 3.47Å; Q60-T62 HydrophobicContact CG-CG2 4.38Å
61	Y	23.9	Very low	25.8	Very low	117 Å²	117	90.8 Å²	90.8	46%	0.459	58%	0.584	S	S	.	*				-108.5	87.4	112.7	-84.3	-89.8	0	0	0	108	A59 Q81 K838	A59-Y61 PolarHBondContact O-N 2.67Å; A59-Y61 VanDerWaalsContact O-N 3.15Å; Y61-Q81 WeakPolarHBondContact CD1-O 3.43Å; Y61-K838 HydrophobicContact CD1-CD 3.77Å; Y61-K838 VanDerWaalsContact CD1-CE 3.46Å; Y61-K838 HydrophobicContact CD1-CG 4.4Å; Y61-K838 HydrophobicContact CD2-CB 3.76Å; Y61-K838 HydrophobicContact CD2-CD 3.68Å; Y61-K838 HydrophobicContact CD2-CG 3.5Å; Y61-K838 VanDerWaalsContact CD2-CG 3.5Å; Y61-K838 HydrophobicContact CE1-CD 4.28Å; Y61-K838 HydrophobicContact CE2-CB 4.36Å; Y61-K838 HydrophobicContact CE2-CD 4.18Å; Y61-K838 HydrophobicContact CE2-CG 3.76Å; Y61-K838 HydrophobicContact CG-CB 4.23Å; Y61-K838 HydrophobicContact CG-CD 3.43Å; Y61-K838 VanDerWaalsContact CG-CD 3.43Å; Y61-K838 HydrophobicContact CG-CG 3.84Å
62	T	26.2	Very low	25.5	Very low	52 Å²	52	90.7 Å²	90.7	32%	0.319	57%	0.573	S	S	.	*			trans	-125.5	93.4	-166.1	45.6	0	0	0	0	110.4	A59 Q60 A64	A59-T62 HydrophobicContact CB-CG2 4.29Å; Q60-T62 WeakPolarHBondContact CA-OG1 3.47Å; Q60-T62 HydrophobicContact CG-CG2 4.38Å; T62-A64 PolarHBondContact O-N 2.91Å
63	A	29	Very low	25.2	Very low	90 Å²	90	89.8 Å²	89.8	74%	0.744	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	121.5	173.1	0	0	0	0	0	111	S65	A63-S65 VanDerWaalsContact C-N 3.34Å; A63-S65 PolarHBondContact O-N 3.36Å; A63-S65 VanDerWaalsContact O-N 3.07Å
64	A	26.3	Very low	24.8	Very low	76 Å²	76	89.3 Å²	89.3	63%	0.628	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.1	39.3	157.3	0	0	0	0	0	117.5	T62 A67	T62-A64 PolarHBondContact O-N 2.91Å; A64-A67 HydrophobicContact CB-CB 4.32Å
65	S	21	Very low	23.9	Very low	90 Å²	90	88.8 Å²	88.8	63%	0.629	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	154.6	150.4	-61.4	0	0	0	0	109.5	A63 A67	A63-S65 VanDerWaalsContact C-N 3.34Å; A63-S65 PolarHBondContact O-N 3.36Å; A63-S65 VanDerWaalsContact O-N 3.07Å; S65-A67 VanDerWaalsContact C-N 3.33Å; S65-A67 PolarHBondContact O-N 2.81Å
66	P	21.7	Very low	23.6	Very low	85 Å²	85	87.2 Å²	87.2	55%	0.552	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-29.7	86.6	-133.8	24.9	-37.5	0	0	0	115.9	C68	P66-C68 CarbonylContact C-O 3.59Å; P66-C68 CarbonylContact O-C 3.44Å
67	A	24.9	Very low	23.6	Very low	71 Å²	71	88.1 Å²	88.1	59%	0.587	56%	0.562	S	S	*	*			trans	-144	88	173.8	0	0	0	0	0	108.6	A64 S65	A64-A67 HydrophobicContact CB-CB 4.32Å; S65-A67 VanDerWaalsContact C-N 3.33Å; S65-A67 PolarHBondContact O-N 2.81Å
68	C	20.2	Very low	23.9	Very low	93 Å²	93	88 Å²	88	63%	0.628	55%	0.554	S	S	*	*	S	Bend	cis	-27.8	113.1	13.2	-169.5	0	0	0	0	118.6	P66 S70	P66-C68 CarbonylContact C-O 3.59Å; P66-C68 CarbonylContact O-C 3.44Å; C68-S70 PolarHBondContact O-N 3.2Å
69	S	26.4	Very low	24.1	Very low	66 Å²	66	87.7 Å²	87.7	46%	0.462	56%	0.56	S	S	.	*			trans	-67.9	114.8	161.8	59.1	0	0	0	0	108.8
70	S	26.1	Very low	24.6	Very low	40 Å²	40	89.9 Å²	89.9	28%	0.28	56%	0.56	S	S	.	*				-156.3	100.5	83.7	35.7	0	0	0	0	112.7	C68	C68-S70 PolarHBondContact O-N 3.2Å
71	S	19.9	Very low	25	Very low	72 Å²	72	89.4 Å²	89.4	50%	0.503	56%	0.558	S	S	.	*				-61.7	77.9	84.1	61.6	0	0	0	0	113.7	S73	S71-S73 WeakPolarHBondContact CA-OG 3.04Å; S71-S73 VanDerWaalsContact CB-OG 3.31Å; S71-S73 WeakPolarHBondContact CB-OG 3.41Å; S71-S73 PolarHBondContact O-OG 3.39Å
72	Q	26	Very low	25.5	Very low	118 Å²	118	88.7 Å²	88.7	55%	0.551	56%	0.562	S	S	*	*			trans	-106.1	113.8	143.9	-69.3	-176	12.6	0	0	103.7
73	S	20.9	Very low	25.6	Very low	82 Å²	82	90.9 Å²	90.9	57%	0.573	58%	0.575	S	S	*	*	S	Bend	cis	38.3	57.2	-2.4	66.5	0	0	0	0	114.6	S71	S71-S73 WeakPolarHBondContact CA-OG 3.04Å; S71-S73 VanDerWaalsContact CB-OG 3.31Å; S71-S73 WeakPolarHBondContact CB-OG 3.41Å; S71-S73 PolarHBondContact O-OG 3.39Å
74	T	23.1	Very low	25.3	Very low	117 Å²	117	92.1 Å²	92.1	72%	0.718	57%	0.574	S	S	*	*	S	Bend	trans	-28	134.4	148.2	47.7	0	0	0	0	111.9
75	P	23.6	Very low	25.2	Very low	109 Å²	109	94.2 Å²	94.2	71%	0.708	58%	0.578	S	S	*	*			cis	-127.9	-128	-12.8	38.1	-18.9	0	0	0	110.6
76	S	19.6	Very low	25.4	Very low	88 Å²	88	94.7 Å²	94.7	62%	0.615	58%	0.58	S	S	*	*			trans	58.3	101.7	149	67	0	0	0	0	119.1
77	T	26.6	Very low	25.4	Very low	117 Å²	117	99 Å²	99	72%	0.718	59%	0.592	S	S	*	*				98.5	135	89.2	45.9	0	0	0	0	115.9
78	F	31.2	Very low	25.5	Very low	98 Å²	98	100.5 Å²	100.5	43%	0.43	60%	0.597	S	S	.	*			trans	75.8	164.1	157.5	-73.9	-150.7	0	0	0	120.9	C52 I53 T54	C52-F78 HydrophobicContact CB-CD2 3.97Å; C52-F78 HydrophobicContact CB-CE2 3.34Å; C52-F78 HydrophobicContact CB-CZ 4.04Å; C52-F78 WeakPolarHBondContact SG-CE2 3.32Å; I53-F78 VanDerWaalsContact C-CZ 3.45Å; I53-F78 WeakPolarHBondContact O-CE1 2.96Å; I53-F78 WeakPolarHBondContact O-CZ 3.44Å; T54-F78 WeakPolarHBondContact O-CE1 3.04Å
79	S	26	Very low	25.6	Very low	101 Å²	101	102.6 Å²	102.6	71%	0.706	61%	0.606	S	S	*	*			trans	83.6	159.1	168.2	-58.5	0	0	0	0	119.3
80	E	30.9	Very low	25.5	Very low	102 Å²	102	102.8 Å²	102.8	48%	0.477	62%	0.619	S	S	.	*				167.6	144.8	-53	-91.7	-70	90.7	0	0	109.1
81	Q	31	Very low	26.1	Very low	94 Å²	94	105 Å²	105	44%	0.439	64%	0.639	S	S	.	*			cis	-167.4	164.5	-27.9	-144.6	-160.2	122.5	0	0	109.5	Y61	Y61-Q81 WeakPolarHBondContact CD1-O 3.43Å
82	L	34.7	Very low	26.2	Very low	102 Å²	102	110.6 Å²	110.6	53%	0.534	65%	0.649	S	S	.	*			trans	63	135.7	160.6	-63.3	155.2	0	0	0	117.1	K838	L82-K838 VanDerWaalsContact CB-NZ 3.3Å; L82-K838 PolarHBondContact O-NZ 3.25Å
83	V	28.8	Very low	26	Very low	97 Å²	97	114.2 Å²	114.2	59%	0.588	67%	0.666	S	S	*	*			cis	-149.8	173.9	8.2	-109.4	0	0	0	0	107.3
84	T	23.2	Very low	26.1	Very low	117 Å²	117	118.6 Å²	118.6	72%	0.718	68%	0.678	S	S	*	*			cis	-151.3	148.8	9.2	2.4	0	0	0	0	105.6
85	V	24	Very low	26.2	Very low	120 Å²	120	115.8 Å²	115.8	73%	0.727	67%	0.672	S	S	*	*				58.8	97.3	51.5	-170.6	0	0	0	0	111.7
86	C	24.4	Very low	26.2	Very low	99 Å²	99	115.5 Å²	115.5	67%	0.669	66%	0.66	S	S	*	*			cis	-137.2	130.3	42.3	-78	0	0	0	0	115.4
87	H	22.9	Very low	26.4	Very low	175 Å²	175	113.3 Å²	113.3	81%	0.81	64%	0.643	S	S	*	*			trans	57.1	156	139.7	-63.4	-63.2	0	0	0	122
88	P	25.7	Very low	26.3	Very low	104 Å²	104	111.3 Å²	111.3	68%	0.675	63%	0.634	S	S	*	*			cis	-132.6	159.9	-20.5	39.2	-24	0	0	0	114.6
89	V	22.2	Very low	26	Very low	137 Å²	137	108 Å²	108	83%	0.83	63%	0.627	S	S	*	*			trans	65.5	140.5	172.7	-164.3	0	0	0	0	112.1	A91	V89-A91 HydrophobicContact CG1-CB 4.26Å
90	G	25.4	Very low	26	Very low	70 Å²	70	107.2 Å²	107.2	72%	0.722	62%	0.622	S	S	*	*			cis	101.8	174.4	22.8	0	0	0	0	0	110.4
91	A	37.5	Very low	25.5	Very low	86 Å²	86	105.5 Å²	105.5	71%	0.711	61%	0.611	S	S	*	*			trans	61.2	83.6	170.3	0	0	0	0	0	118	V89	V89-A91 HydrophobicContact CG1-CB 4.26Å
92	W	22.6	Very low	25.3	Very low	189 Å²	189	103.2 Å²	103.2	72%	0.716	61%	0.606	S	S	*	*			trans	72.1	56.9	133.8	-68.7	18.5	0	0	0	118.3	V97	W92-V97 HydrophobicContact CB-CG1 4.01Å; W92-V97 HydrophobicContact CE3-CB 4.39Å; W92-V97 HydrophobicContact CE3-CG1 4.07Å; W92-V97 HydrophobicContact CE3-CG2 3.71Å; W92-V97 HydrophobicContact CZ3-CG2 3.97Å
93	E	21.2	Very low	24.7	Very low	195 Å²	195	103.2 Å²	103.2	91%	0.911	60%	0.603	S	S	*	*				-68.7	110.5	123.3	-65	175.3	118.3	0	0	108.4
94	Q	22.7	Very low	24.4	Very low	173 Å²	173	99.6 Å²	99.6	81%	0.808	58%	0.581	S	S	*	*	S	Bend	trans	-159	34.4	157.1	-133.2	-178.2	22.1	0	0	117.5	F96	Q94-F96 CarbonylContact C-O 2.8Å
95	G	26.3	Very low	24.3	Very low	59 Å²	59	96.9 Å²	96.9	61%	0.608	57%	0.567	S	S	*	*	S	Bend	trans	149.5	-107.1	164.5	0	0	0	0	0	116.9	V97	G95-V97 CarbonylContact C-O 3.39Å; G95-V97 PolarHBondContact N-O 3.31Å
96	F	22.5	Very low	24.2	Very low	103 Å²	103	96 Å²	96	45%	0.452	56%	0.562	S	S	.	*	S	Bend	cis	54.8	89.4	31.1	-141.8	-27.1	0	0	0	109.9	Q94 V2404	Q94-F96 CarbonylContact C-O 2.8Å; F96-V2404 HydrophobicContact CB-CG2 3.78Å; F96-V2404 HydrophobicContact CD1-CG2 3.7Å; F96-V2404 HydrophobicContact CD2-CB 4.47Å; F96-V2404 HydrophobicContact CD2-CG1 4.28Å; F96-V2404 HydrophobicContact CD2-CG2 3.31Å; F96-V2404 HydrophobicContact CE1-CG2 3.99Å; F96-V2404 HydrophobicContact CE2-CG1 4.25Å; F96-V2404 HydrophobicContact CE2-CG2 3.63Å; F96-V2404 HydrophobicContact CG-CG2 3.32Å; F96-V2404 HydrophobicContact CZ-CG2 3.94Å
97	V	24.8	Very low	24	Very low	42 Å²	42	93.8 Å²	93.8	26%	0.255	55%	0.547	S	S	.	.			trans	70.2	120.2	-151.6	-161.2	0	0	0	0	108.5	W92 G95 G99 Q2403	W92-V97 HydrophobicContact CB-CG1 4.01Å; W92-V97 HydrophobicContact CE3-CB 4.39Å; W92-V97 HydrophobicContact CE3-CG1 4.07Å; W92-V97 HydrophobicContact CE3-CG2 3.71Å; W92-V97 HydrophobicContact CZ3-CG2 3.97Å; G95-V97 CarbonylContact C-O 3.39Å; G95-V97 PolarHBondContact N-O 3.31Å; V97-G99 WeakPolarHBondContact CG1-O 3.29Å; V97-Q2403 VanDerWaalsContact N-NE2 3.15Å
98	S	23.9	Very low	24	Very low	74 Å²	74	86.2 Å²	86.2	52%	0.517	52%	0.517	S	S	.	.			cis	-137.9	144.5	38.8	58.2	0	0	0	0	116.8	Q2403	S98-Q2403 PolarHBondContact O-OE1 3.43Å
99	G	26.2	Very low	24	Very low	29 Å²	29	85.4 Å²	85.4	30%	0.299	50%	0.503	S	S	.	.			cis	57.9	83.9	-3.5	0	0	0	0	0	115.4	V97	V97-G99 WeakPolarHBondContact CG1-O 3.29Å
100	S	24.6	Very low	24.1	Very low	84 Å²	84	80.6 Å²	80.6	59%	0.587	47%	0.473	S	S	*	.			cis	-72.9	124.3	46.1	53.7	0	0	0	0	111.4	P1769	S100-P1769 WeakPolarHBondContact O-CB 3.06Å
101	Y	21.9	Very low	24.6	Very low	66 Å²	66	79.2 Å²	79.2	26%	0.259	45%	0.451	S	S	.	.			trans	-57.6	153	169.7	89.5	122.1	0	0	0	107.3	Q103 P1770 D2401	Y101-Q103 VanDerWaalsContact CA-CD 3.48Å; Y101-Q103 VanDerWaalsContact N-NE2 3.19Å; Y101-Q103 PolarHBondContact O-OE1 2.92Å; Y101-P1770 VanDerWaalsContact CB-CD 3.47Å; Y101-P1770 WeakPolarHBondContact CB-O 3.28Å; Y101-P1770 HydrophobicContact CD1-CG 4.06Å; Y101-P1770 WeakPolarHBondContact CD1-O 3.47Å; Y101-P1770 HydrophobicContact CG-CG 4.24Å; Y101-D2401 VanDerWaalsContact CE1-CG 3.48Å; Y101-D2401 WeakPolarHBondContact CE1-OD1 3.44Å; Y101-D2401 WeakPolarHBondContact CE1-OD2 3.46Å; Y101-D2401 VanDerWaalsContact CZ-OD2 3.31Å; Y101-D2401 PolarHBondContact OH-OD2 2.59Å
102	S	26.3	Very low	23.9	Very low	47 Å²	47	80.2 Å²	80.2	33%	0.329	44%	0.439	S	S	.	.			trans	-116.2	66.4	138.6	-145.6	0	0	0	0	102.7	T104 P1769 P1770 N1771 C1772	S102-T104 PolarHBondContact O-N 2.96Å; S102-P1769 WeakPolarHBondContact CA-O 3.31Å; S102-P1769 VanDerWaalsContact CB-C 3.43Å; S102-P1769 WeakPolarHBondContact CB-O 3.33Å; S102-P1769 PolarHBondContact N-O 3.23Å; S102-P1770 CarbonylContact C-O 3.44Å; S102-P1770 VanDerWaalsContact N-N 3.16Å; S102-P1770 PolarHBondContact N-O 2.69Å; S102-P1770 CarbonylContact O-C 3.55Å; S102-N1771 CarbonylContact C-O 3.54Å; S102-N1771 CarbonylContact O-C 3.59Å; S102-N1771 VanDerWaalsContact O-CA 3.27Å; S102-N1771 WeakPolarHBondContact O-CA 3.27Å; S102-N1771 PolarHBondContact O-N 2.95Å; S102-N1771 VanDerWaalsContact O-O 3.12Å; S102-C1772 PolarHBondContact O-N 2.85Å
103	Q	22.2	Very low	24.1	Very low	102 Å²	102	76.1 Å²	76.1	48%	0.477	43%	0.431	S	S	.	.				30.8	81.4	74.1	-71	156.6	20.7	0	0	103.7	Y101 P1770 N1771	Y101-Q103 VanDerWaalsContact CA-CD 3.48Å; Y101-Q103 VanDerWaalsContact N-NE2 3.19Å; Y101-Q103 PolarHBondContact O-OE1 2.92Å; Q103-P1770 PolarHBondContact N-O 3.37Å; Q103-N1771 PolarHBondContact N-O 2.03Å
104	T	22.4	Very low	24.4	Very low	21 Å²	21	76 Å²	76	13%	0.129	42%	0.422	C	S	.	.				-154.6	67.2	94.3	35.9	0	0	0	0	112.3	S102 T106 S107 G108 N1771 C1772 C1777	S102-T104 PolarHBondContact O-N 2.96Å; T104-T106 VanDerWaalsContact CB-O 3.26Å; T104-T106 WeakPolarHBondContact CB-O 3.11Å; T104-T106 WeakPolarHBondContact CG2-O 3.18Å; T104-T106 CarbonylContact O-C 3.6Å; T104-T106 PolarHBondContact O-N 2.75Å; T104-S107 VanDerWaalsContact CG2-C 3.41Å; T104-S107 WeakPolarHBondContact CG2-O 3.27Å; T104-S107 PolarHBondContact O-N 3.17Å; T104-S107 VanDerWaalsContact O-N 3.15Å; T104-G108 WeakPolarHBondContact OG1-CA 3.23Å; T104-G108 PolarHBondContact OG1-N 3.29Å; T104-G108 PolarHBondContact OG1-O 3.15Å; T104-N1771 PolarHBondContact N-O 2.74Å; T104-N1771 VanDerWaalsContact N-O 3.12Å; T104-C1772 VanDerWaalsContact C-CA 3.44Å; T104-C1777 PolarHBondContact O-SG 2.72Å
105	S	19.8	Very low	25	Very low	60 Å²	60	72.7 Å²	72.7	42%	0.42	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	54.4	149.3	-68.2	0	0	0	0	109.2	N1771 G1773	S105-N1771 PolarHBondContact N-O 3.4Å; S105-N1771 PolarHBondContact OG-OD1 2.83Å; S105-G1773 VanDerWaalsContact OG-CA 3.31Å; S105-G1773 WeakPolarHBondContact OG-CA 2.97Å; S105-G1773 PolarHBondContact OG-N 2.61Å
106	T	21.8	Very low	24.9	Very low	102 Å²	102	78 Å²	78	63%	0.626	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	146.9	47.6	-139.5	35.6	0	0	0	0	112.5	T104	T104-T106 VanDerWaalsContact CB-O 3.26Å; T104-T106 WeakPolarHBondContact CB-O 3.11Å; T104-T106 WeakPolarHBondContact CG2-O 3.18Å; T104-T106 CarbonylContact O-C 3.6Å; T104-T106 PolarHBondContact O-N 2.75Å
107	S	20.3	Very low	25.4	Very low	51 Å²	51	82.3 Å²	82.3	36%	0.357	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	70.7	161	73.4	0	0	0	0	123.7	T104 K109 Y1778	T104-S107 VanDerWaalsContact CG2-C 3.41Å; T104-S107 WeakPolarHBondContact CG2-O 3.27Å; T104-S107 PolarHBondContact O-N 3.17Å; T104-S107 VanDerWaalsContact O-N 3.15Å; S107-K109 WeakPolarHBondContact O-CE 3.44Å; S107-K109 WeakPolarHBondContact O-CG 3.19Å; S107-Y1778 CarbonylContact C-O 3.42Å; S107-Y1778 WeakPolarHBondContact CB-O 3.44Å
108	G	23	Very low	26.2	Very low	17 Å²	17	89.7 Å²	89.7	18%	0.175	47%	0.467	C	S	.	.			trans	37	-119.6	154.1	0	0	0	0	0	122.2	T104 C1777	T104-G108 WeakPolarHBondContact OG1-CA 3.23Å; T104-G108 PolarHBondContact OG1-N 3.29Å; T104-G108 PolarHBondContact OG1-O 3.15Å; G108-C1777 WeakPolarHBondContact CA-O 3.31Å; G108-C1777 PolarHBondContact N-SG 3.09Å
109	K	26.6	Very low	27.2	Very low	86 Å²	86	90.6 Å²	90.6	37%	0.374	47%	0.469	S	S	.	.			trans	93.6	151.4	176.1	-30.5	-140.6	167.7	-155.3	0	116	S107 Y1778 S1780 C1785 C1790	S107-K109 WeakPolarHBondContact O-CE 3.44Å; S107-K109 WeakPolarHBondContact O-CG 3.19Å; K109-Y1778 VanDerWaalsContact CE-O 3.29Å; K109-Y1778 WeakPolarHBondContact CE-O 3.33Å; K109-S1780 WeakPolarHBondContact CD-OG 3.31Å; K109-C1785 WeakPolarHBondContact CA-SG 3.5Å; K109-C1785 PolarHBondContact N-SG 2.68Å; K109-C1790 PolarHBondContact O-SG 3.03Å; K109-C1790 VanDerWaalsContact O-SG 3.35Å
110	N	23.5	Very low	28.3	Very low	37 Å²	37	93.9 Å²	93.9	20%	0.198	49%	0.485	C	S	.	.			trans	-106.4	-175.4	-159.6	-145.8	11.7	0	0	0	111.5	E1783 C1790	N110-E1783 WeakPolarHBondContact CB-OE2 3.27Å; N110-E1783 PolarHBondContact ND2-OE1 3.01Å; N110-E1783 PolarHBondContact ND2-OE2 2.55Å; N110-C1790 WeakPolarHBondContact CA-SG 3.33Å; N110-C1790 HydrophobicContact CB-CB 3.84Å; N110-C1790 WeakPolarHBondContact CB-SG 3.3Å; N110-C1790 PolarHBondContact N-SG 3.33Å; N110-C1790 VanDerWaalsContact N-SG 3.38Å; N110-C1790 PolarHBondContact ND2-O 2.92Å; N110-C1790 VanDerWaalsContact ND2-O 3.09Å; N110-C1790 VanDerWaalsContact OD1-CA 3.3Å; N110-C1790 WeakPolarHBondContact OD1-CA 3.26Å; N110-C1790 WeakPolarHBondContact OD1-CB 3.42Å; N110-C1790 PolarHBondContact OD1-N 2.93Å; N110-C1790 VanDerWaalsContact OD1-N 3.09Å; N110-C1790 PolarHBondContact OD1-O 3.01Å; N110-C1790 PolarHBondContact OD1-SG 2.04Å
111	P	35.8	Very low	29.9	Very low	40 Å²	40	90.3 Å²	90.3	26%	0.26	46%	0.46	S	S	.	.			cis	-128.4	-175.1	-27.5	15.2	10	0	0	0	113.9
112	F	24.6	Very low	31.3	Very low	108 Å²	108	91.2 Å²	91.2	47%	0.474	47%	0.469	S	S	.	.				168.7	155.6	124.5	-88.4	-162.2	0	0	0	114.1	L1801	F112-L1801 HydrophobicContact CB-CD2 4.11Å; F112-L1801 HydrophobicContact CB-CG 4.15Å; F112-L1801 HydrophobicContact CD1-CB 3.91Å; F112-L1801 HydrophobicContact CD1-CD2 3.63Å; F112-L1801 HydrophobicContact CD1-CG 3.89Å; F112-L1801 HydrophobicContact CD2-CB 3.79Å; F112-L1801 HydrophobicContact CD2-CD2 4.48Å; F112-L1801 HydrophobicContact CD2-CG 3.86Å; F112-L1801 HydrophobicContact CE1-CB 3.76Å; F112-L1801 HydrophobicContact CE1-CD2 4.19Å; F112-L1801 HydrophobicContact CE1-CG 4.27Å; F112-L1801 HydrophobicContact CE2-CB 3.71Å; F112-L1801 HydrophobicContact CE2-CG 4.31Å; F112-L1801 HydrophobicContact CG-CB 3.94Å; F112-L1801 HydrophobicContact CG-CD2 3.81Å; F112-L1801 HydrophobicContact CG-CG 3.67Å; F112-L1801 HydrophobicContact CZ-CB 3.69Å; F112-L1801 HydrophobicContact CZ-CG 4.49Å
113	L	26.1	Very low	33	Very low	103 Å²	103	91.9 Å²	91.9	54%	0.539	47%	0.471	S	S	.	.			trans	-94.7	166.4	172.8	-72.4	61.3	0	0	0	110.8	L1801	L113-L1801 HydrophobicContact CB-CD1 4.19Å; L113-L1801 HydrophobicContact CD1-CD1 4.05Å
114	R	26.6	Very low	34.1	Very low	193 Å²	193	93.9 Å²	93.9	73%	0.728	48%	0.475	S	S	*	.				166.8	163.7	109.7	-88.7	-152.3	171	-164.4	-3.2	114.3	L1801	R114-L1801 HydrophobicContact CG-CD2 4.41Å
115	P	35.5	Very low	35.4	Very low	102 Å²	102	96 Å²	96	66%	0.662	49%	0.485	S	S	*	.			trans	-113.9	-161.8	-149.2	45.3	-37.4	0	0	0	115
116	E	25.7	Very low	36.9	Very low	172 Å²	172	99 Å²	99	80%	0.804	50%	0.503	S	S	*	.			trans	30.3	120.9	149.8	-68.8	171.1	154.5	0	0	120.8
117	F	31	Very low	38.5	Very low	193 Å²	193	100.2 Å²	100.2	85%	0.846	51%	0.505	S	S	*	.				-159.9	104.1	105.6	-128.1	-94.2	0	0	0	110.5
118	R	41.7	Very low	40.5	Very low	196 Å²	196	98.8 Å²	98.8	74%	0.74	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-102.3	142.8	148.7	-73.2	-173.8	-178.4	-175.2	1.9	105.6	P120	R118-P120 VanDerWaalsContact O-CD 3.23Å; R118-P120 WeakPolarHBondContact O-CD 3.18Å
119	V	46	Very low	42.6	Very low	94 Å²	94	98.6 Å²	98.6	57%	0.57	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-67.6	119.1	169.6	179.7	0	0	0	0	107.7	C121	V119-C121 PolarHBondContact O-N 3.28Å
120	P	49.1	Very low	44.4	Very low	98 Å²	98	98.1 Å²	98.1	64%	0.636	49%	0.494	S	S	*	.	B	Isolated β-bridge	trans	-71.6	124.1	168.6	30.4	-31.4	0	0	0	107.9	R118 Y144	R118-P120 VanDerWaalsContact O-CD 3.23Å; R118-P120 WeakPolarHBondContact O-CD 3.18Å; P120-Y144 VanDerWaalsContact CA-O 3.27Å; P120-Y144 WeakPolarHBondContact CA-O 3.33Å
121	C	57.3	Low	45.8	Very low	9 Å²	9	100.8 Å²	100.8	6%	0.061	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-91.1	155.9	177	61.9	0	0	0	0	110.4	V119 A128 C137 Y144 G145	V119-C121 PolarHBondContact O-N 3.28Å; C121-A128 HydrophobicContact CB-CB 3.75Å; C121-C137 HydrophobicContact CB-CB 3.74Å; C121-C137 WeakPolarHBondContact CB-SG 3.46Å; C121-C137 WeakPolarHBondContact SG-CA 3.48Å; C121-C137 WeakPolarHBondContact SG-CB 3.1Å; C121-C137 CovalentContact SG-SG 2.03Å; C121-C137 PolarHBondContact SG-SG 2.83Å; C121-Y144 PolarHBondContact N-O 2.1Å; C121-Y144 WeakPolarHBondContact O-CB 3.42Å; C121-Y144 VanDerWaalsContact SG-C 3.56Å; C121-G145 WeakPolarHBondContact SG-CA 3.06Å; C121-G145 PolarHBondContact SG-N 3.23Å
122	N	52.2	Low	46.4	Very low	84 Å²	84	103.3 Å²	103.3	45%	0.449	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-99	125.9	172.7	-178.7	4.2	0	0	0	108.9	R124 D125	N122-R124 PolarHBondContact O-N 2.89Å; N122-R124 VanDerWaalsContact O-N 3.16Å; N122-R124 WeakPolarHBondContact OD1-CB 3.31Å; N122-R124 PolarHBondContact OD1-N 3.35Å; N122-D125 HydrophobicContact CB-CB 4.12Å; N122-D125 PolarHBondContact O-N 3.2Å
123	V	61.8	Low	48	Very low	62 Å²	62	100.1 Å²	100.1	38%	0.376	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.6	174.1	-97.7	0	0	0	0	113.3	Y144	V123-Y144 HydrophobicContact CB-CE1 4.22Å; V123-Y144 HydrophobicContact CG1-CD1 3.61Å; V123-Y144 HydrophobicContact CG1-CE1 3.39Å; V123-Y144 HydrophobicContact CG1-CG 4.46Å; V123-Y144 HydrophobicContact CG2-CD1 4.22Å; V123-Y144 HydrophobicContact CG2-CD2 4.29Å; V123-Y144 HydrophobicContact CG2-CE1 3.75Å; V123-Y144 HydrophobicContact CG2-CE2 3.83Å; V123-Y144 HydrophobicContact CG2-CG 4.47Å
124	R	46.5	Very low	49.5	Very low	144 Å²	144	100.4 Å²	100.4	54%	0.543	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	1	176.3	-59.2	-178.4	176.9	-175.9	-4.3	114.3	N122 D487	N122-R124 PolarHBondContact O-N 2.89Å; N122-R124 VanDerWaalsContact O-N 3.16Å; N122-R124 WeakPolarHBondContact OD1-CB 3.31Å; N122-R124 PolarHBondContact OD1-N 3.35Å; R124-D487 IonicContact CZ-OD2 3.34Å; R124-D487 IonicContact NE-OD2 3.02Å; R124-D487 PolarHBondContact NE-OD2 3.2Å; R124-D487 IonicContact NH2-OD2 2.72Å; R124-D487 PolarHBondContact NH2-OD2 3.41Å
125	D	49	Very low	51.2	Low	65 Å²	65	92.6 Å²	92.6	35%	0.348	49%	0.491	S	S	.	.			trans	-121.8	107.3	179.6	174.6	15.8	0	0	0	111.1	N122 L127 A128	N122-D125 HydrophobicContact CB-CB 4.12Å; N122-D125 PolarHBondContact O-N 3.2Å; D125-L127 PolarHBondContact O-N 3.13Å; D125-L127 VanDerWaalsContact O-N 3.16Å; D125-L127 WeakPolarHBondContact OD1-CA 3.48Å; D125-L127 WeakPolarHBondContact OD1-CB 3.1Å; D125-L127 PolarHBondContact OD1-N 3.29Å; D125-A128 HydrophobicContact CB-CB 3.95Å; D125-A128 WeakPolarHBondContact O-CB 2.93Å; D125-A128 PolarHBondContact O-N 3.42Å; D125-A128 VanDerWaalsContact O-N 3.16Å; D125-A128 PolarHBondContact OD2-N 3.45Å
126	P	52.1	Low	52.7	Low	122 Å²	122	90.7 Å²	90.7	79%	0.792	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-5.8	178.2	30.5	-35.2	0	0	0	113.9
127	L	54.8	Low	54.5	Low	128 Å²	128	84.1 Å²	84.1	67%	0.67	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	0.3	174.4	-60.9	175.3	0	0	0	113.2	D125 C129 T131	D125-L127 PolarHBondContact O-N 3.13Å; D125-L127 VanDerWaalsContact O-N 3.16Å; D125-L127 WeakPolarHBondContact OD1-CA 3.48Å; D125-L127 WeakPolarHBondContact OD1-CB 3.1Å; D125-L127 PolarHBondContact OD1-N 3.29Å; L127-C129 PolarHBondContact O-N 3.01Å; L127-T131 HydrophobicContact CD2-CG2 4.14Å
128	A	60.9	Low	55.9	Low	22 Å²	22	76.7 Å²	76.7	18%	0.182	42%	0.421	C	S	.	.	S	Bend	trans	-64.8	-9.4	-179.1	0	0	0	0	0	114.3	C121 D125 C146	C121-A128 HydrophobicContact CB-CB 3.75Å; D125-A128 HydrophobicContact CB-CB 3.95Å; D125-A128 WeakPolarHBondContact O-CB 2.93Å; D125-A128 PolarHBondContact O-N 3.42Å; D125-A128 VanDerWaalsContact O-N 3.16Å; D125-A128 PolarHBondContact OD2-N 3.45Å; A128-C146 PolarHBondContact O-SG 3.31Å
129	C	67.3	Low	56.9	Low	12 Å²	12	73.4 Å²	73.4	8%	0.081	41%	0.412	C	S	.	.	S	Bend	trans	-128.9	152.5	174	-62.8	0	0	0	0	111.1	L127 T131 E135 C137 C146	L127-C129 PolarHBondContact O-N 3.01Å; C129-T131 PolarHBondContact O-N 2.97Å; C129-E135 HydrophobicContact CB-CB 4.1Å; C129-E135 WeakPolarHBondContact CB-O 3.23Å; C129-C137 PolarHBondContact SG-N 3.29Å; C129-C146 WeakPolarHBondContact CA-SG 3.41Å; C129-C146 HydrophobicContact CB-CB 3.77Å; C129-C146 WeakPolarHBondContact CB-SG 2.94Å; C129-C146 WeakPolarHBondContact SG-CA 2.84Å; C129-C146 WeakPolarHBondContact SG-CB 3.42Å; C129-C146 CovalentContact SG-SG 2.04Å; C129-C146 PolarHBondContact SG-SG 3.17Å
130	N	64.1	Low	56.9	Low	76 Å²	76	71.9 Å²	71.9	41%	0.406	40%	0.401	S	S	.	.			trans	-72.7	105.7	-170.4	-171.8	-8	0	0	0	111.9	S132 L133 E135	N130-S132 PolarHBondContact O-N 3.16Å; N130-S132 VanDerWaalsContact O-N 3.13Å; N130-S132 WeakPolarHBondContact OD1-CB 3.22Å; N130-S132 PolarHBondContact OD1-N 3.5Å; N130-S132 PolarHBondContact OD1-OG 3.23Å; N130-L133 HydrophobicContact CB-CB 4.47Å; N130-L133 HydrophobicContact CB-CD1 4.19Å; N130-L133 HydrophobicContact CB-CG 4.17Å; N130-L133 PolarHBondContact O-N 2.92Å; N130-E135 PolarHBondContact O-N 2.53Å
131	T	54.8	Low	56.4	Low	93 Å²	93	71.8 Å²	71.8	57%	0.571	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-53.6	-30.4	175	54.9	0	0	0	0	113.1	L127 C129 L133 L134	L127-T131 HydrophobicContact CD2-CG2 4.14Å; C129-T131 PolarHBondContact O-N 2.97Å; T131-L133 PolarHBondContact O-N 2.7Å; T131-L134 PolarHBondContact O-N 3.39Å
132	S	48.4	Very low	56.2	Low	93 Å²	93	74.2 Å²	74.2	65%	0.65	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-71.5	-14.6	177.9	-51.4	0	0	0	0	114.1	N130	N130-S132 PolarHBondContact O-N 3.16Å; N130-S132 VanDerWaalsContact O-N 3.13Å; N130-S132 WeakPolarHBondContact OD1-CB 3.22Å; N130-S132 PolarHBondContact OD1-N 3.5Å; N130-S132 PolarHBondContact OD1-OG 3.23Å
133	L	57.4	Low	56	Low	42 Å²	42	72.9 Å²	72.9	22%	0.22	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-102.7	-7.9	176.9	-61.7	-177.9	0	0	0	113	N130 T131 E135 R159 C160	N130-L133 HydrophobicContact CB-CB 4.47Å; N130-L133 HydrophobicContact CB-CD1 4.19Å; N130-L133 HydrophobicContact CB-CG 4.17Å; N130-L133 PolarHBondContact O-N 2.92Å; T131-L133 PolarHBondContact O-N 2.7Å; L133-E135 VanDerWaalsContact C-N 3.3Å; L133-E135 HydrophobicContact CB-CG 3.84Å; L133-R159 HydrophobicContact CD2-CG 3.97Å; L133-C160 WeakPolarHBondContact O-CB 3.34Å; L133-C160 PolarHBondContact O-N 3.35Å; L133-C160 PolarHBondContact O-SG 3.27Å
134	L	57.1	Low	56	Low	108 Å²	108	74.9 Å²	74.9	57%	0.565	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	37	-164.4	-62.6	167.9	0	0	0	112.9	T131 P149 C160	T131-L134 PolarHBondContact O-N 3.39Å; L134-P149 VanDerWaalsContact O-CD 3.23Å; L134-P149 WeakPolarHBondContact O-CD 3.19Å; L134-C160 HydrophobicContact CB-CB 4.14Å
135	E	63.2	Low	57	Low	29 Å²	29	68.4 Å²	68.4	14%	0.136	41%	0.409	C	S	.	.			trans	-86	142	174.6	-71	-174	164.1	0	0	112.4	C129 N130 L133 C146 T147 R154	C129-E135 HydrophobicContact CB-CB 4.1Å; C129-E135 WeakPolarHBondContact CB-O 3.23Å; N130-E135 PolarHBondContact O-N 2.53Å; L133-E135 VanDerWaalsContact C-N 3.3Å; L133-E135 HydrophobicContact CB-CG 3.84Å; E135-C146 HydrophobicContact CB-CB 4.45Å; E135-T147 CarbonylContact C-O 2.75Å; E135-T147 VanDerWaalsContact CA-O 3.29Å; E135-T147 WeakPolarHBondContact CA-O 3.21Å; E135-R154 IonicContact OE1-CZ 2.74Å; E135-R154 IonicContact OE1-NE 2.68Å; E135-R154 PolarHBondContact OE1-NE 3.43Å; E135-R154 IonicContact OE1-NH2 3.85Å; E135-R154 PolarHBondContact OE1-NH2 2.99Å; E135-R154 IonicContact OE2-NH2 2.99Å
136	V	65.8	Low	58	Low	62 Å²	62	66.6 Å²	66.6	38%	0.376	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	150	177.8	-73.7	0	0	0	0	110.7	T138 T147 P149	V136-T138 HydrophobicContact CG2-CG2 3.85Å; V136-T138 PolarHBondContact O-N 2.75Å; V136-T147 PolarHBondContact N-O 3.3Å; V136-T147 PolarHBondContact O-N 2.85Å; V136-P149 HydrophobicContact CG1-CG 4.23Å; V136-P149 HydrophobicContact CG2-CB 4.24Å; V136-P149 HydrophobicContact CG2-CG 3.89Å
137	C	63.6	Low	58.8	Low	34 Å²	34	62.2 Å²	62.2	23%	0.23	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	116.9	173.6	-175.2	0	0	0	0	109.8	C121 C129	C121-C137 HydrophobicContact CB-CB 3.74Å; C121-C137 WeakPolarHBondContact CB-SG 3.46Å; C121-C137 WeakPolarHBondContact SG-CA 3.48Å; C121-C137 WeakPolarHBondContact SG-CB 3.1Å; C121-C137 CovalentContact SG-SG 2.03Å; C121-C137 PolarHBondContact SG-SG 2.83Å; C129-C137 PolarHBondContact SG-N 3.29Å
138	T	60.4	Low	59.2	Low	38 Å²	38	57 Å²	57	23%	0.233	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	142.2	179.2	64.5	0	0	0	0	112.3	V136 N140 G145 T147	V136-T138 HydrophobicContact CG2-CG2 3.85Å; V136-T138 PolarHBondContact O-N 2.75Å; T138-N140 PolarHBondContact O-N 2.91Å; T138-N140 PolarHBondContact O-ND2 3.12Å; T138-N140 PolarHBondContact OG1-ND2 3.02Å; T138-G145 PolarHBondContact N-O 3.44Å; T138-G145 PolarHBondContact O-N 2.84Å; T138-T147 PolarHBondContact OG1-OG1 3.29Å
139	F	62.3	Low	59	Low	126 Å²	126	57.5 Å²	57.5	55%	0.553	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	111.2	173.6	-174	-98.5	0	0	0	110	G142 Y144	F139-G142 VanDerWaalsContact CE2-C 3.47Å; F139-Y144 HydrophobicContact CB-CD1 3.88Å; F139-Y144 HydrophobicContact CB-CE1 3.86Å; F139-Y144 AromaticContact CD2-CD1 4Å; F139-Y144 HydrophobicContact CD2-CD1 4Å; F139-Y144 AromaticContact CD2-CE1 3.88Å; F139-Y144 HydrophobicContact CD2-CE1 3.88Å; F139-Y144 HydrophobicContact CD2-CE2 4.44Å; F139-Y144 HydrophobicContact CD2-CG 4.32Å; F139-Y144 HydrophobicContact CG-CD1 4.46Å; F139-Y144 HydrophobicContact CG-CE1 4.31Å
140	N	46.1	Very low	58	Low	63 Å²	63	61.7 Å²	61.7	34%	0.337	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	115	177.2	-70.5	-84.9	0	0	0	109.6	T138 G142 A143	T138-N140 PolarHBondContact O-N 2.91Å; T138-N140 PolarHBondContact O-ND2 3.12Å; T138-N140 PolarHBondContact OG1-ND2 3.02Å; N140-G142 VanDerWaalsContact C-N 3.32Å; N140-G142 PolarHBondContact O-N 3Å; N140-A143 PolarHBondContact N-O 3.19Å; N140-A143 PolarHBondContact O-N 2.97Å
141	S	39.9	Very low	56.9	Low	95 Å²	95	61.4 Å²	61.4	66%	0.664	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	41.6	165.1	-50.3	0	0	0	0	115.1	I1759	S141-I1759 WeakPolarHBondContact OG-CD1 3.44Å
142	G	52.4	Low	56.9	Low	60 Å²	60	61.9 Å²	61.9	62%	0.619	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	108	-13.5	174.6	0	0	0	0	0	115.6	F139 N140	F139-G142 VanDerWaalsContact CE2-C 3.47Å; N140-G142 VanDerWaalsContact C-N 3.32Å; N140-G142 PolarHBondContact O-N 3Å
143	A	47.5	Very low	57.1	Low	56 Å²	56	60.7 Å²	60.7	46%	0.463	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	155	177.5	0	0	0	0	0	112.8	N140	N140-A143 PolarHBondContact N-O 3.19Å; N140-A143 PolarHBondContact O-N 2.97Å
144	Y	61.9	Low	57.1	Low	105 Å²	105	65.4 Å²	65.4	41%	0.412	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	132.1	168.9	-63	-70.9	0	0	0	110.3	P120 C121 V123 F139	P120-Y144 VanDerWaalsContact CA-O 3.27Å; P120-Y144 WeakPolarHBondContact CA-O 3.33Å; C121-Y144 PolarHBondContact N-O 2.1Å; C121-Y144 WeakPolarHBondContact O-CB 3.42Å; C121-Y144 VanDerWaalsContact SG-C 3.56Å; V123-Y144 HydrophobicContact CB-CE1 4.22Å; V123-Y144 HydrophobicContact CG1-CD1 3.61Å; V123-Y144 HydrophobicContact CG1-CE1 3.39Å; V123-Y144 HydrophobicContact CG1-CG 4.46Å; V123-Y144 HydrophobicContact CG2-CD1 4.22Å; V123-Y144 HydrophobicContact CG2-CD2 4.29Å; V123-Y144 HydrophobicContact CG2-CE1 3.75Å; V123-Y144 HydrophobicContact CG2-CE2 3.83Å; V123-Y144 HydrophobicContact CG2-CG 4.47Å; F139-Y144 HydrophobicContact CB-CD1 3.88Å; F139-Y144 HydrophobicContact CB-CE1 3.86Å; F139-Y144 AromaticContact CD2-CD1 4Å; F139-Y144 HydrophobicContact CD2-CD1 4Å; F139-Y144 AromaticContact CD2-CE1 3.88Å; F139-Y144 HydrophobicContact CD2-CE1 3.88Å; F139-Y144 HydrophobicContact CD2-CE2 4.44Å; F139-Y144 HydrophobicContact CD2-CG 4.32Å; F139-Y144 HydrophobicContact CG-CD1 4.46Å; F139-Y144 HydrophobicContact CG-CE1 4.31Å
145	G	68.1	Low	56.8	Low	7 Å²	7	63.6 Å²	63.6	7%	0.072	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	161.2	174.7	0	0	0	0	0	113.4	C121 T138	C121-G145 WeakPolarHBondContact SG-CA 3.06Å; C121-G145 PolarHBondContact SG-N 3.23Å; T138-G145 PolarHBondContact N-O 3.44Å; T138-G145 PolarHBondContact O-N 2.84Å
146	C	70.7	Confident	55.8	Low	28 Å²	28	69 Å²	69	19%	0.189	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	127.9	-175.6	-59.2	0	0	0	0	113.6	A128 C129 E135 R154	A128-C146 PolarHBondContact O-SG 3.31Å; C129-C146 WeakPolarHBondContact CA-SG 3.41Å; C129-C146 HydrophobicContact CB-CB 3.77Å; C129-C146 WeakPolarHBondContact CB-SG 2.94Å; C129-C146 WeakPolarHBondContact SG-CA 2.84Å; C129-C146 WeakPolarHBondContact SG-CB 3.42Å; C129-C146 CovalentContact SG-SG 2.04Å; C129-C146 PolarHBondContact SG-SG 3.17Å; E135-C146 HydrophobicContact CB-CB 4.45Å; C146-R154 PolarHBondContact O-NH2 3.26Å
147	T	67.7	Low	55	Low	29 Å²	29	68.9 Å²	68.9	18%	0.178	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	164.2	177.8	63.8	0	0	0	0	110.7	E135 V136 T138	E135-T147 CarbonylContact C-O 2.75Å; E135-T147 VanDerWaalsContact CA-O 3.29Å; E135-T147 WeakPolarHBondContact CA-O 3.21Å; V136-T147 PolarHBondContact N-O 3.3Å; V136-T147 PolarHBondContact O-N 2.85Å; T138-T147 PolarHBondContact OG1-OG1 3.29Å
148	C	63	Low	54.5	Low	18 Å²	18	68.2 Å²	68.2	12%	0.122	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-59.4	154.5	158.6	-64.4	0	0	0	0	111	Y152 R154 C160	C148-Y152 VanDerWaalsContact CB-O 3.23Å; C148-Y152 WeakPolarHBondContact CB-O 3.1Å; C148-R154 WeakPolarHBondContact SG-CG 3.21Å; C148-C160 WeakPolarHBondContact CA-SG 3.35Å; C148-C160 HydrophobicContact CB-CB 3.78Å; C148-C160 WeakPolarHBondContact CB-SG 3.19Å; C148-C160 VanDerWaalsContact SG-CA 3.56Å; C148-C160 WeakPolarHBondContact SG-CB 3.27Å; C148-C160 CovalentContact SG-SG 2.03Å; C148-C160 PolarHBondContact SG-SG 2.01Å
149	P	57.3	Low	54.4	Low	33 Å²	33	72.3 Å²	72.3	21%	0.214	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-58.4	159.9	165.2	-21.4	31.2	0	0	0	111.3	L134 V136 N151 Y152	L134-P149 VanDerWaalsContact O-CD 3.23Å; L134-P149 WeakPolarHBondContact O-CD 3.19Å; V136-P149 HydrophobicContact CG1-CG 4.23Å; V136-P149 HydrophobicContact CG2-CB 4.24Å; V136-P149 HydrophobicContact CG2-CG 3.89Å; P149-N151 PolarHBondContact O-N 3.07Å; P149-Y152 HydrophobicContact CB-CD2 4.01Å; P149-Y152 HydrophobicContact CG-CD2 4.32Å; P149-Y152 PolarHBondContact O-N 2.75Å
150	P	46.9	Very low	54.2	Low	100 Å²	100	66.4 Å²	66.4	65%	0.649	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	141.9	163.5	-25.3	35	0	0	0	111.2	Y152	P150-Y152 PolarHBondContact O-N 2.8Å
151	N	41.3	Very low	54.4	Low	70 Å²	70	69.7 Å²	69.7	37%	0.374	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	9.9	179.6	-50.4	-16.2	0	0	0	115.6	P149 E185 S1660	P149-N151 PolarHBondContact O-N 3.07Å; N151-E185 HydrophobicContact CB-CB 3.93Å; N151-E185 HydrophobicContact CB-CG 4.47Å; N151-E185 PolarHBondContact ND2-OE2 3.47Å; N151-S1660 VanDerWaalsContact ND2-CB 3.26Å; N151-S1660 WeakPolarHBondContact ND2-CB 3.5Å
152	Y	53.2	Low	55	Low	104 Å²	104	68.3 Å²	68.3	41%	0.408	38%	0.38	S	S	.	.			trans	-114.2	128.5	167.7	-71.3	-112.9	0	0	0	111.2	C148 P149 P150 C160 V162	C148-Y152 VanDerWaalsContact CB-O 3.23Å; C148-Y152 WeakPolarHBondContact CB-O 3.1Å; P149-Y152 HydrophobicContact CB-CD2 4.01Å; P149-Y152 HydrophobicContact CG-CD2 4.32Å; P149-Y152 PolarHBondContact O-N 2.75Å; P150-Y152 PolarHBondContact O-N 2.8Å; Y152-C160 HydrophobicContact CD1-CB 4.18Å; Y152-C160 HydrophobicContact CG-CB 4.45Å; Y152-V162 HydrophobicContact CE1-CG2 4.38Å
153	S	54.3	Low	54.9	Low	68 Å²	68	67.4 Å²	67.4	48%	0.476	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	143.6	174.8	-65.3	0	0	0	0	111.4	L155 C160 K161	S153-L155 PolarHBondContact O-N 3.48Å; S153-C160 CarbonylContact O-C 3.29Å; S153-C160 WeakPolarHBondContact O-CA 3.21Å; S153-K161 PolarHBondContact N-O 3.09Å; S153-K161 PolarHBondContact O-N 3.01Å
154	R	56.2	Low	55.4	Low	140 Å²	140	67.8 Å²	67.8	53%	0.528	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	122	166.4	-75.4	-165.1	-177.2	117.9	-4.2	109.6	E135 C146 C148 R159	E135-R154 IonicContact OE1-CZ 2.74Å; E135-R154 IonicContact OE1-NE 2.68Å; E135-R154 PolarHBondContact OE1-NE 3.43Å; E135-R154 IonicContact OE1-NH2 3.85Å; E135-R154 PolarHBondContact OE1-NH2 2.99Å; E135-R154 IonicContact OE2-NH2 2.99Å; C146-R154 PolarHBondContact O-NH2 3.26Å; C148-R154 WeakPolarHBondContact SG-CG 3.21Å; R154-R159 WeakPolarHBondContact CA-O 3.27Å
155	L	50.4	Low	55.8	Low	71 Å²	71	64.4 Å²	64.4	37%	0.372	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-66.4	166.4	164.2	-78.9	169.7	0	0	0	111.1	S153 D157 G158 R159 K161	S153-L155 PolarHBondContact O-N 3.48Å; L155-D157 WeakPolarHBondContact CB-OD1 3.48Å; L155-D157 PolarHBondContact O-N 2.74Å; L155-G158 PolarHBondContact O-N 3.26Å; L155-R159 PolarHBondContact N-O 3.38Å; L155-K161 HydrophobicContact CD1-CB 4.23Å; L155-K161 HydrophobicContact CD1-CD 4.1Å; L155-K161 HydrophobicContact CD1-CG 4.44Å
156	P	43.7	Very low	56	Low	142 Å²	142	65.8 Å²	65.8	92%	0.922	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-10.1	175.1	-25.7	35.9	0	0	0	115.6
157	D	47.1	Very low	55.8	Low	59 Å²	59	73.2 Å²	73.2	32%	0.316	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	3.1	173.7	66.1	12	0	0	0	114.1	L155 R159	L155-D157 WeakPolarHBondContact CB-OD1 3.48Å; L155-D157 PolarHBondContact O-N 2.74Å; D157-R159 WeakPolarHBondContact OD1-CB 3.04Å; D157-R159 PolarHBondContact OD1-N 3.24Å; D157-R159 IonicContact OD1-NE 2.89Å; D157-R159 PolarHBondContact OD1-NE 2.79Å; D157-R159 IonicContact OD2-CZ 2.9Å; D157-R159 IonicContact OD2-NE 2.72Å; D157-R159 PolarHBondContact OD2-NE 3.14Å; D157-R159 IonicContact OD2-NH2 3.61Å; D157-R159 PolarHBondContact OD2-NH2 3.35Å
158	G	54.1	Low	55.1	Low	20 Å²	20	77 Å²	77	21%	0.206	40%	0.402	C	S	.	.	S	Bend	trans	91.8	-12.1	178.7	0	0	0	0	0	115.6	L155	L155-G158 PolarHBondContact O-N 3.26Å
159	R	57.8	Low	54.9	Low	124 Å²	124	86.2 Å²	86.2	47%	0.468	43%	0.434	S	S	.	.			trans	-76.7	142.2	-176	-65	-177.4	-68	173.1	-4.5	112.7	L133 R154 L155 D157	L133-R159 HydrophobicContact CD2-CG 3.97Å; R154-R159 WeakPolarHBondContact CA-O 3.27Å; L155-R159 PolarHBondContact N-O 3.38Å; D157-R159 WeakPolarHBondContact OD1-CB 3.04Å; D157-R159 PolarHBondContact OD1-N 3.24Å; D157-R159 IonicContact OD1-NE 2.89Å; D157-R159 PolarHBondContact OD1-NE 2.79Å; D157-R159 IonicContact OD2-CZ 2.9Å; D157-R159 IonicContact OD2-NE 2.72Å; D157-R159 PolarHBondContact OD2-NE 3.14Å; D157-R159 IonicContact OD2-NH2 3.61Å; D157-R159 PolarHBondContact OD2-NH2 3.35Å
160	C	57.7	Low	54.8	Low	3 Å²	3	88.7 Å²	88.7	2%	0.02	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	123.6	175.6	-57.4	0	0	0	0	111.4	L133 L134 C148 Y152 S153	L133-C160 WeakPolarHBondContact O-CB 3.34Å; L133-C160 PolarHBondContact O-N 3.35Å; L133-C160 PolarHBondContact O-SG 3.27Å; L134-C160 HydrophobicContact CB-CB 4.14Å; C148-C160 WeakPolarHBondContact CA-SG 3.35Å; C148-C160 HydrophobicContact CB-CB 3.78Å; C148-C160 WeakPolarHBondContact CB-SG 3.19Å; C148-C160 VanDerWaalsContact SG-CA 3.56Å; C148-C160 WeakPolarHBondContact SG-CB 3.27Å; C148-C160 CovalentContact SG-SG 2.03Å; C148-C160 PolarHBondContact SG-SG 2.01Å; Y152-C160 HydrophobicContact CD1-CB 4.18Å; Y152-C160 HydrophobicContact CG-CB 4.45Å; S153-C160 CarbonylContact O-C 3.29Å; S153-C160 WeakPolarHBondContact O-CA 3.21Å
161	K	50.8	Low	55.1	Low	132 Å²	132	87.6 Å²	87.6	57%	0.574	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.7	156.1	172.1	-101.9	-165.6	177.5	-175.5	0	112.4	S153 L155	S153-K161 PolarHBondContact N-O 3.09Å; S153-K161 PolarHBondContact O-N 3.01Å; L155-K161 HydrophobicContact CD1-CB 4.23Å; L155-K161 HydrophobicContact CD1-CD 4.1Å; L155-K161 HydrophobicContact CD1-CG 4.44Å
162	V	52.9	Low	56.4	Low	65 Å²	65	85.4 Å²	85.4	39%	0.394	43%	0.428	S	S	.	.			trans	-62.8	141.7	168.9	169.3	0	0	0	0	110.6	Y152 I184	Y152-V162 HydrophobicContact CE1-CG2 4.38Å; V162-I184 WeakPolarHBondContact CG1-O 3.03Å
163	A	49.5	Very low	57.4	Low	41 Å²	41	85 Å²	85	34%	0.339	43%	0.432	S	S	.	.			trans	-92.7	-178.5	179.6	0	0	0	0	0	112.9
164	N	59.3	Low	58.7	Low	65 Å²	65	83.3 Å²	83.3	35%	0.348	42%	0.42	S	S	.	.			trans	-140.2	105.7	169.3	174.3	-38	0	0	0	108.8	C166 F167 M171 D182	N164-C166 PolarHBondContact O-N 2.94Å; N164-C166 PolarHBondContact OD1-N 2.77Å; N164-F167 PolarHBondContact OD1-N 3.48Å; N164-F167 VanDerWaalsContact OD1-N 3.12Å; N164-M171 WeakPolarHBondContact O-CE 3.5Å; N164-D182 WeakPolarHBondContact CA-OD1 3.44Å; N164-D182 PolarHBondContact ND2-OD2 2.72Å
165	E	69.8	Low	59.7	Low	34 Å²	34	78 Å²	78	16%	0.159	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-0.2	-171.2	-64.9	89.8	137.9	0	0	113.1	M171 N172 S186 Y187	E165-M171 HydrophobicContact CB-CB 4.01Å; E165-M171 HydrophobicContact CG-CB 4.44Å; E165-M171 WeakPolarHBondContact O-CB 3.29Å; E165-N172 PolarHBondContact O-ND2 2.8Å; E165-S186 VanDerWaalsContact CD-O 3.25Å; E165-S186 PolarHBondContact OE1-N 2.95Å; E165-S186 VanDerWaalsContact OE1-N 3.11Å; E165-Y187 HydrophobicContact CB-CD1 3.79Å; E165-Y187 HydrophobicContact CB-CG 4.08Å; E165-Y187 HydrophobicContact CG-CD1 4.02Å
166	C	73.1	Confident	60.8	Low	36 Å²	36	77.9 Å²	77.9	24%	0.243	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-13.4	-176.2	-61.5	0	0	0	0	113.4	N164 E168 C180 I181 D182	N164-C166 PolarHBondContact O-N 2.94Å; N164-C166 PolarHBondContact OD1-N 2.77Å; C166-E168 PolarHBondContact O-N 3.09Å; C166-C180 PolarHBondContact SG-SG 3.47Å; C166-I181 PolarHBondContact SG-O 3.23Å; C166-D182 HydrophobicContact CB-CB 4.07Å; C166-D182 VanDerWaalsContact SG-CA 3.56Å; C166-D182 PolarHBondContact SG-N 3.14Å
167	F	65.3	Low	62.1	Low	184 Å²	184	74 Å²	74	81%	0.807	39%	0.385	S	S	*	.	S	Bend	trans	-63.4	-28.6	171.4	-169.2	-98.3	0	0	0	112.2	N164	N164-F167 PolarHBondContact OD1-N 3.48Å; N164-F167 VanDerWaalsContact OD1-N 3.12Å
168	E	54	Low	63.6	Low	108 Å²	108	71.8 Å²	71.8	51%	0.505	38%	0.375	S	S	.	.	S	Bend	trans	-134.9	131	-173.7	-148.1	179.2	-110.9	0	0	112.6	C166 S170 M171 N172	C166-E168 PolarHBondContact O-N 3.09Å; E168-S170 WeakPolarHBondContact CB-OG 3.03Å; E168-S170 VanDerWaalsContact CG-OG 3.26Å; E168-S170 WeakPolarHBondContact CG-OG 3.47Å; E168-S170 PolarHBondContact O-N 2.03Å; E168-S170 VanDerWaalsContact O-N 3.12Å; E168-S170 PolarHBondContact OE2-OG 3.06Å; E168-M171 HydrophobicContact CB-CE 3.63Å; E168-M171 PolarHBondContact O-N 2.87Å; E168-N172 PolarHBondContact O-ND2 2.99Å; E168-N172 VanDerWaalsContact O-ND2 3.12Å
169	R	57.7	Low	64.7	Low	212 Å²	212	74 Å²	74	80%	0.8	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-4.6	-173.3	-149.1	-175.5	-166.8	-175.3	5.3	114.5
170	S	54.9	Low	65.6	Low	85 Å²	85	69.9 Å²	69.9	59%	0.594	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-29.7	169.6	46.1	0	0	0	0	112.3	E168	E168-S170 WeakPolarHBondContact CB-OG 3.03Å; E168-S170 VanDerWaalsContact CG-OG 3.26Å; E168-S170 WeakPolarHBondContact CG-OG 3.47Å; E168-S170 PolarHBondContact O-N 2.03Å; E168-S170 VanDerWaalsContact O-N 3.12Å; E168-S170 PolarHBondContact OE2-OG 3.06Å
171	M	53.2	Low	66.2	Low	76 Å²	76	70.2 Å²	70.2	37%	0.374	37%	0.373	S	S	.	.	S	Bend	trans	-95.1	-4	-170.6	-64.1	-167.1	-78.3	0	0	114	N164 E165 E168 Y187	N164-M171 WeakPolarHBondContact O-CE 3.5Å; E165-M171 HydrophobicContact CB-CB 4.01Å; E165-M171 HydrophobicContact CG-CB 4.44Å; E165-M171 WeakPolarHBondContact O-CB 3.29Å; E168-M171 HydrophobicContact CB-CE 3.63Å; E168-M171 PolarHBondContact O-N 2.87Å; M171-Y187 WeakPolarHBondContact O-CE1 3.31Å
172	N	69.8	Low	66.6	Low	25 Å²	25	65.8 Å²	65.8	13%	0.134	36%	0.356	C	S	.	.			trans	-138.6	153.9	179.7	62.9	82.3	0	0	0	113.4	E165 E168 C180 Y187	E165-N172 PolarHBondContact O-ND2 2.8Å; E168-N172 PolarHBondContact O-ND2 2.99Å; E168-N172 VanDerWaalsContact O-ND2 3.12Å; N172-C180 VanDerWaalsContact CB-SG 3.53Å; N172-C180 PolarHBondContact OD1-SG 3.33Å; N172-Y187 HydrophobicContact CB-CD2 3.76Å; N172-Y187 HydrophobicContact CB-CE2 3.59Å; N172-Y187 HydrophobicContact CB-CG 4.42Å
173	N	74.7	Confident	66.7	Low	94 Å²	94	62.7 Å²	62.7	50%	0.503	34%	0.337	S	S	.	.			trans	-121.1	45.4	-175.7	62.5	-3.8	0	0	0	113.3	Y187 R208	N173-Y187 PolarHBondContact OD1-OH 3.15Å; N173-Y187 VanDerWaalsContact OD1-OH 3.08Å; N173-R208 VanDerWaalsContact C-NH1 3.26Å; N173-R208 WeakPolarHBondContact O-CD 3.46Å; N173-R208 PolarHBondContact O-NH1 3.02Å; N173-R208 VanDerWaalsContact OD1-CZ 3.24Å; N173-R208 PolarHBondContact OD1-NH1 3.27Å
174	C	80.9	Confident	66.9	Low	33 Å²	33	63 Å²	63	22%	0.223	33%	0.333	C	S	.	.			trans	-67.8	157.2	175.9	-46	0	0	0	0	112.8	A178 C180 C189	C174-A178 HydrophobicContact CB-CB 4.21Å; C174-C180 WeakPolarHBondContact SG-CB 3.39Å; C174-C180 PolarHBondContact SG-SG 3.28Å; C174-C189 WeakPolarHBondContact CA-SG 3.43Å; C174-C189 HydrophobicContact CB-CB 3.56Å; C174-C189 WeakPolarHBondContact CB-SG 3.06Å; C174-C189 WeakPolarHBondContact SG-CB 3.42Å; C174-C189 CovalentContact SG-SG 2.03Å; C174-C189 PolarHBondContact SG-SG 2.88Å
175	S	77.6	Confident	66.4	Low	28 Å²	28	63.5 Å²	63.5	20%	0.196	33%	0.333	C	S	.	.			trans	-62.7	153.7	163.9	-156.1	0	0	0	0	111.6	N177 A178 G207 R208	S175-N177 PolarHBondContact O-N 3.18Å; S175-A178 WeakPolarHBondContact O-CA 3.19Å; S175-A178 WeakPolarHBondContact O-CB 3.31Å; S175-A178 PolarHBondContact O-N 3.05Å; S175-G207 VanDerWaalsContact CB-O 3.29Å; S175-G207 WeakPolarHBondContact CB-O 3.3Å; S175-G207 PolarHBondContact N-O 3.31Å; S175-R208 WeakPolarHBondContact CB-O 3.31Å; S175-R208 PolarHBondContact OG-O 2.93Å
176	A	72.8	Confident	65.4	Low	69 Å²	69	62 Å²	62	57%	0.57	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.6	169.6	0	0	0	0	0	112.1	A178 K192	A176-A178 PolarHBondContact O-N 3.28Å; A176-K192 PolarHBondContact O-NZ 3.48Å
177	N	71.3	Confident	65.5	Low	60 Å²	60	62.4 Å²	62.4	32%	0.321	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	21.6	169.8	-71	-11.7	0	0	0	112.6	S175 K192 F195 C210	S175-N177 PolarHBondContact O-N 3.18Å; N177-K192 WeakPolarHBondContact O-CB 3.21Å; N177-K192 VanDerWaalsContact O-CG 3.27Å; N177-K192 WeakPolarHBondContact O-CG 3.34Å; N177-K192 PolarHBondContact O-N 3.44Å; N177-F195 WeakPolarHBondContact ND2-CE1 3.24Å; N177-C210 HydrophobicContact CB-CB 4.33Å
178	A	78.3	Confident	65.8	Low	13 Å²	13	53.9 Å²	53.9	11%	0.107	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	160.7	176.3	0	0	0	0	0	114.4	C174 S175 A176 Q190	C174-A178 HydrophobicContact CB-CB 4.21Å; S175-A178 WeakPolarHBondContact O-CA 3.19Å; S175-A178 WeakPolarHBondContact O-CB 3.31Å; S175-A178 PolarHBondContact O-N 3.05Å; A176-A178 PolarHBondContact O-N 3.28Å; A178-Q190 CarbonylContact C-O 3.45Å; A178-Q190 WeakPolarHBondContact CA-O 3.33Å; A178-Q190 WeakPolarHBondContact CB-O 3.46Å
179	I	77.1	Confident	67	Low	67 Å²	67	48.7 Å²	48.7	34%	0.344	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	155.9	170.5	-52.5	165.5	0	0	0	108	I181 C189 Q190 K192	I179-I181 HydrophobicContact CG2-CD1 4.13Å; I179-C189 CarbonylContact O-C 3.39Å; I179-C189 WeakPolarHBondContact O-CA 2.89Å; I179-C189 WeakPolarHBondContact O-CB 3.09Å; I179-Q190 HydrophobicContact CB-CB 3.83Å; I179-Q190 HydrophobicContact CD1-CB 4.48Å; I179-Q190 HydrophobicContact CG1-CB 4.46Å; I179-Q190 PolarHBondContact N-O 2.96Å; I179-Q190 PolarHBondContact O-N 2.75Å; I179-K192 HydrophobicContact CG1-CG 4.34Å
180	C	76.7	Confident	67.6	Low	37 Å²	37	39 Å²	39	25%	0.25	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	147.4	175	-163	0	0	0	0	111.2	C166 N172 C174	C166-C180 PolarHBondContact SG-SG 3.47Å; N172-C180 VanDerWaalsContact CB-SG 3.53Å; N172-C180 PolarHBondContact OD1-SG 3.33Å; C174-C180 WeakPolarHBondContact SG-CB 3.39Å; C174-C180 PolarHBondContact SG-SG 3.28Å
181	I	69.7	Low	68.5	Low	11 Å²	11	34.9 Å²	34.9	6%	0.056	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	134	-174.3	-69.4	105.7	0	0	0	112.8	C166 I179 E183 Y187 R188 Q190 R1599 S1664	C166-I181 PolarHBondContact SG-O 3.23Å; I179-I181 HydrophobicContact CG2-CD1 4.13Å; I181-E183 HydrophobicContact CG2-CG 4.24Å; I181-E183 VanDerWaalsContact CG2-OE1 3.25Å; I181-E183 WeakPolarHBondContact CG2-OE1 3.29Å; I181-E183 WeakPolarHBondContact O-CG 3.21Å; I181-Y187 WeakPolarHBondContact O-CA 2.84Å; I181-Y187 WeakPolarHBondContact O-CB 2.86Å; I181-R188 WeakPolarHBondContact CA-O 3.26Å; I181-R188 HydrophobicContact CB-CG 4.49Å; I181-R188 WeakPolarHBondContact CB-O 3.33Å; I181-R188 PolarHBondContact N-O 3.38Å; I181-R188 PolarHBondContact O-N 3.07Å; I181-R188 VanDerWaalsContact O-O 3.1Å; I181-Q190 HydrophobicContact CD1-CB 4.03Å; I181-Q190 HydrophobicContact CD1-CG 3.7Å; I181-R1599 VanDerWaalsContact CG2-CZ 3.43Å; I181-R1599 VanDerWaalsContact CG2-NH1 3.33Å; I181-S1664 WeakPolarHBondContact CG2-OG 3.33Å
182	D	59.2	Low	69	Low	38 Å²	38	35 Å²	35	20%	0.203	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	138.4	-179	170.2	46	0	0	0	113.2	N164 C166 K1663	N164-D182 WeakPolarHBondContact CA-OD1 3.44Å; N164-D182 PolarHBondContact ND2-OD2 2.72Å; C166-D182 HydrophobicContact CB-CB 4.07Å; C166-D182 VanDerWaalsContact SG-CA 3.56Å; C166-D182 PolarHBondContact SG-N 3.14Å; D182-K1663 IonicContact OD1-NZ 2.69Å; D182-K1663 PolarHBondContact OD1-NZ 3.48Å; D182-K1663 IonicContact OD2-NZ 3.38Å; D182-K1663 PolarHBondContact OD2-NZ 2.95Å
183	E	56	Low	68.6	Low	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	171.2	-161	-60.1	-71.2	87.7	0	0	112.5	I181 E185 S186 Y187 R188 T1661 W1662 K1663 S1664	I181-E183 HydrophobicContact CG2-CG 4.24Å; I181-E183 VanDerWaalsContact CG2-OE1 3.25Å; I181-E183 WeakPolarHBondContact CG2-OE1 3.29Å; I181-E183 WeakPolarHBondContact O-CG 3.21Å; E183-E185 PolarHBondContact O-N 3.07Å; E183-S186 VanDerWaalsContact CB-C 3.47Å; E183-S186 WeakPolarHBondContact CB-O 3.37Å; E183-S186 PolarHBondContact N-O 3.07Å; E183-Y187 VanDerWaalsContact CG-CA 3.47Å; E183-R188 HydrophobicContact CG-CG 4.29Å; E183-R188 IonicContact OE1-NH1 3.77Å; E183-R188 PolarHBondContact OE1-NH1 3.06Å; E183-R188 WeakPolarHBondContact OE2-CD 3.45Å; E183-R188 IonicContact OE2-CZ 2.81Å; E183-R188 IonicContact OE2-NE 2.65Å; E183-R188 IonicContact OE2-NH1 3.06Å; E183-R188 PolarHBondContact OE2-NH1 2.86Å; E183-T1661 WeakPolarHBondContact CB-O 3.44Å; E183-T1661 WeakPolarHBondContact CG-O 3.02Å; E183-W1662 WeakPolarHBondContact OE2-CA 3.32Å; E183-W1662 WeakPolarHBondContact OE2-CB 2.97Å; E183-K1663 VanDerWaalsContact C-CE 3.45Å; E183-K1663 VanDerWaalsContact CA-CB 3.45Å; E183-K1663 VanDerWaalsContact CA-CD 3.47Å; E183-K1663 HydrophobicContact CB-CB 4.27Å; E183-K1663 VanDerWaalsContact CB-N 3.27Å; E183-K1663 WeakPolarHBondContact O-CE 3.45Å; E183-K1663 PolarHBondContact O-NZ 2.93Å; E183-K1663 PolarHBondContact OE1-N 2.86Å; E183-K1663 PolarHBondContact OE2-N 2.81Å; E183-S1664 WeakPolarHBondContact OE1-CA 2.98Å; E183-S1664 WeakPolarHBondContact OE1-CB 3.44Å; E183-S1664 PolarHBondContact OE1-N 2.85Å; E183-S1664 PolarHBondContact OE1-OG 3.36Å; E183-S1664 PolarHBondContact OE2-N 2.66Å
184	I	53.1	Low	67.3	Low	48 Å²	48	36.5 Å²	36.5	25%	0.246	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-44.7	-162.5	-59.1	172.5	0	0	0	112.5	V162 D1654 W1662 K1663	V162-I184 WeakPolarHBondContact CG1-O 3.03Å; I184-D1654 WeakPolarHBondContact CD1-OD1 3.24Å; I184-W1662 PolarHBondContact N-O 3.27Å; I184-K1663 HydrophobicContact CB-CG 4.09Å; I184-K1663 HydrophobicContact CG1-CB 3.86Å; I184-K1663 HydrophobicContact CG1-CG 3.4Å
185	E	49.1	Very low	66.5	Low	76 Å²	76	38.2 Å²	38.2	36%	0.355	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.9	25.7	-168.8	-50.4	-175.3	-167.6	0	0	109.6	N151 E183 S1660	N151-E185 HydrophobicContact CB-CB 3.93Å; N151-E185 HydrophobicContact CB-CG 4.47Å; N151-E185 PolarHBondContact ND2-OE2 3.47Å; E183-E185 PolarHBondContact O-N 3.07Å; E185-S1660 CarbonylContact O-C 3.59Å; E185-S1660 WeakPolarHBondContact O-CB 3.27Å; E185-S1660 VanDerWaalsContact O-O 3.08Å
186	S	49.2	Very low	65.9	Low	2 Å²	2	37.9 Å²	37.9	1%	0.014	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)		-170.5	167.2	-117.4	-70.6	0	0	0	0	119	E165 E183 S1660 T1661 W1662	E165-S186 VanDerWaalsContact CD-O 3.25Å; E165-S186 PolarHBondContact OE1-N 2.95Å; E165-S186 VanDerWaalsContact OE1-N 3.11Å; E183-S186 VanDerWaalsContact CB-C 3.47Å; E183-S186 WeakPolarHBondContact CB-O 3.37Å; E183-S186 PolarHBondContact N-O 3.07Å; S186-S1660 VanDerWaalsContact OG-CA 3.28Å; S186-S1660 WeakPolarHBondContact OG-CA 3.31Å; S186-T1661 VanDerWaalsContact OG-C 3.23Å; S186-T1661 VanDerWaalsContact OG-CA 3.24Å; S186-T1661 WeakPolarHBondContact OG-CA 3.13Å; S186-T1661 PolarHBondContact OG-N 3.45Å; S186-W1662 PolarHBondContact OG-N 3.14Å; S186-W1662 PolarHBondContact OG-O 3.21Å
187	Y	75.4	Confident	65.7	Low	45 Å²	45	34.7 Å²	34.7	18%	0.176	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	158.1	155.9	73.8	-83.5	0	0	0	117.9	E165 M171 N172 N173 I181 E183 T1661	E165-Y187 HydrophobicContact CB-CD1 3.79Å; E165-Y187 HydrophobicContact CB-CG 4.08Å; E165-Y187 HydrophobicContact CG-CD1 4.02Å; M171-Y187 WeakPolarHBondContact O-CE1 3.31Å; N172-Y187 HydrophobicContact CB-CD2 3.76Å; N172-Y187 HydrophobicContact CB-CE2 3.59Å; N172-Y187 HydrophobicContact CB-CG 4.42Å; N173-Y187 PolarHBondContact OD1-OH 3.15Å; N173-Y187 VanDerWaalsContact OD1-OH 3.08Å; I181-Y187 WeakPolarHBondContact O-CA 2.84Å; I181-Y187 WeakPolarHBondContact O-CB 2.86Å; E183-Y187 VanDerWaalsContact CG-CA 3.47Å; Y187-T1661 CarbonylContact C-O 3.6Å; Y187-T1661 WeakPolarHBondContact CA-O 3.33Å; Y187-T1661 HydrophobicContact CD1-CG2 4.33Å; Y187-T1661 PolarHBondContact N-O 2.89Å; Y187-T1661 VanDerWaalsContact O-CB 3.27Å; Y187-T1661 WeakPolarHBondContact O-CB 3.25Å; Y187-T1661 WeakPolarHBondContact O-CG2 3.4Å
188	R	72	Confident	65.4	Low	4 Å²	4	35.3 Å²	35.3	2%	0.015	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	168.2	168.2	76.8	-166.4	-157.7	-83.9	16	113.6	I181 E183 L1597 W1662 S1664 D1708	I181-R188 WeakPolarHBondContact CA-O 3.26Å; I181-R188 HydrophobicContact CB-CG 4.49Å; I181-R188 WeakPolarHBondContact CB-O 3.33Å; I181-R188 PolarHBondContact N-O 3.38Å; I181-R188 PolarHBondContact O-N 3.07Å; I181-R188 VanDerWaalsContact O-O 3.1Å; E183-R188 HydrophobicContact CG-CG 4.29Å; E183-R188 IonicContact OE1-NH1 3.77Å; E183-R188 PolarHBondContact OE1-NH1 3.06Å; E183-R188 WeakPolarHBondContact OE2-CD 3.45Å; E183-R188 IonicContact OE2-CZ 2.81Å; E183-R188 IonicContact OE2-NE 2.65Å; E183-R188 IonicContact OE2-NH1 3.06Å; E183-R188 PolarHBondContact OE2-NH1 2.86Å; R188-L1597 VanDerWaalsContact NE-CD2 3.33Å; R188-W1662 VanDerWaalsContact CD-CD1 3.48Å; R188-S1664 PolarHBondContact NH1-O 2.97Å; R188-S1664 PolarHBondContact NH1-OG 2.85Å; R188-S1664 PolarHBondContact NH2-O 3.05Å; R188-D1708 VanDerWaalsContact CD-OD2 3.28Å; R188-D1708 WeakPolarHBondContact CD-OD2 3.19Å; R188-D1708 WeakPolarHBondContact CG-OD2 3.01Å; R188-D1708 IonicContact CZ-OD1 3.18Å; R188-D1708 IonicContact CZ-OD2 2.64Å; R188-D1708 IonicContact NE-OD1 2.8Å; R188-D1708 IonicContact NE-OD2 3.92Å; R188-D1708 PolarHBondContact NE-OD2 3.09Å; R188-D1708 IonicContact NH2-OD1 3.21Å
189	C	78.3	Confident	65	Low	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	-165.5	-176.1	-56.4	0	0	0	0	112	C174 I179 R208 Q1710	C174-C189 WeakPolarHBondContact CA-SG 3.43Å; C174-C189 HydrophobicContact CB-CB 3.56Å; C174-C189 WeakPolarHBondContact CB-SG 3.06Å; C174-C189 WeakPolarHBondContact SG-CB 3.42Å; C174-C189 CovalentContact SG-SG 2.03Å; C174-C189 PolarHBondContact SG-SG 2.88Å; I179-C189 CarbonylContact O-C 3.39Å; I179-C189 WeakPolarHBondContact O-CA 2.89Å; I179-C189 WeakPolarHBondContact O-CB 3.09Å; C189-R208 PolarHBondContact SG-NH1 2.69Å; C189-R208 VanDerWaalsContact SG-NH1 3.44Å; C189-Q1710 VanDerWaalsContact C-NE2 3.31Å; C189-Q1710 VanDerWaalsContact CA-CD 3.49Å; C189-Q1710 VanDerWaalsContact CB-CD 3.41Å; C189-Q1710 VanDerWaalsContact CB-OE1 3.27Å; C189-Q1710 VanDerWaalsContact N-OE1 3.08Å; C189-Q1710 WeakPolarHBondContact O-CB 3.3Å; C189-Q1710 WeakPolarHBondContact O-CG 3.04Å
190	Q	71	Confident	64	Low	7 Å²	7	37.9 Å²	37.9	3%	0.033	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	114.5	-169.6	-100	-142.8	-86.1	0	0	115.3	A178 I179 I181 K192 R1599 D1708 E1709	A178-Q190 CarbonylContact C-O 3.45Å; A178-Q190 WeakPolarHBondContact CA-O 3.33Å; A178-Q190 WeakPolarHBondContact CB-O 3.46Å; I179-Q190 HydrophobicContact CB-CB 3.83Å; I179-Q190 HydrophobicContact CD1-CB 4.48Å; I179-Q190 HydrophobicContact CG1-CB 4.46Å; I179-Q190 PolarHBondContact N-O 2.96Å; I179-Q190 PolarHBondContact O-N 2.75Å; I181-Q190 HydrophobicContact CD1-CB 4.03Å; I181-Q190 HydrophobicContact CD1-CG 3.7Å; Q190-K192 PolarHBondContact O-N 2.87Å; Q190-R1599 VanDerWaalsContact OE1-CD 3.29Å; Q190-D1708 WeakPolarHBondContact CG-OD1 3.25Å; Q190-E1709 HydrophobicContact CB-CB 3.78Å; Q190-E1709 HydrophobicContact CB-CG 4.42Å; Q190-E1709 WeakPolarHBondContact CB-OE2 3.38Å; Q190-E1709 HydrophobicContact CG-CB 3.65Å; Q190-E1709 HydrophobicContact CG-CG 4.26Å; Q190-E1709 VanDerWaalsContact NE2-N 3.19Å; Q190-E1709 PolarHBondContact NE2-OE1 3.03Å; Q190-E1709 PolarHBondContact NE2-OE2 3.35Å; Q190-E1709 VanDerWaalsContact O-OE2 3.13Å
191	C	73	Confident	62.8	Low	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	110.1	176.5	-90.4	0	0	0	0	115.8	D197 G207 C210 Y1698 E1709	C191-D197 HydrophobicContact CB-CB 4.37Å; C191-G207 WeakPolarHBondContact SG-CA 3.26Å; C191-C210 HydrophobicContact CB-CB 4.01Å; C191-C210 WeakPolarHBondContact CB-SG 3.38Å; C191-C210 WeakPolarHBondContact SG-CB 3.14Å; C191-C210 CovalentContact SG-SG 2.04Å; C191-C210 PolarHBondContact SG-SG 2.73Å; C191-Y1698 PolarHBondContact O-OH 3.45Å; C191-Y1698 VanDerWaalsContact O-OH 3.12Å; C191-E1709 VanDerWaalsContact C-CD 3.48Å; C191-E1709 PolarHBondContact N-OE2 3.41Å; C191-E1709 VanDerWaalsContact N-OE2 3.1Å
192	K	64.3	Low	61.8	Low	79 Å²	79	40.5 Å²	40.5	34%	0.343	22%	0.224	S	C	.	.			trans	-48.6	143.1	-177.4	-68.1	166.9	-173.6	166.5	0	114.2	A176 N177 I179 Q190 F195	A176-K192 PolarHBondContact O-NZ 3.48Å; N177-K192 WeakPolarHBondContact O-CB 3.21Å; N177-K192 VanDerWaalsContact O-CG 3.27Å; N177-K192 WeakPolarHBondContact O-CG 3.34Å; N177-K192 PolarHBondContact O-N 3.44Å; I179-K192 HydrophobicContact CG1-CG 4.34Å; Q190-K192 PolarHBondContact O-N 2.87Å; K192-F195 PolarHBondContact O-N 2.93Å
193	P	61.9	Low	61.2	Low	86 Å²	86	39.1 Å²	39.1	56%	0.558	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.7	146.8	175.6	-30.3	36.1	0	0	0	114.6	F195	P193-F195 VanDerWaalsContact C-N 3.26Å; P193-F195 PolarHBondContact O-N 2.99Å
194	G	47.1	Very low	60.9	Low	63 Å²	63	41.9 Å²	41.9	65%	0.649	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.8	-21.6	-171.2	0	0	0	0	0	114
195	F	64	Low	61.5	Low	69 Å²	69	43.9 Å²	43.9	30%	0.303	24%	0.239	S	C	.	.			trans	-108.7	124.6	176.3	-57.9	-99	0	0	0	111.5	N177 K192 P193 C210 V212 Y1698	N177-F195 WeakPolarHBondContact ND2-CE1 3.24Å; K192-F195 PolarHBondContact O-N 2.93Å; P193-F195 VanDerWaalsContact C-N 3.26Å; P193-F195 PolarHBondContact O-N 2.99Å; F195-C210 HydrophobicContact CB-CB 3.44Å; F195-C210 VanDerWaalsContact CB-CB 3.44Å; F195-C210 HydrophobicContact CD1-CB 4.47Å; F195-C210 HydrophobicContact CG-CB 4.22Å; F195-V212 HydrophobicContact CD1-CG2 4.41Å; F195-Y1698 PolarHBondContact O-OH 3.08Å
196	T	64.4	Low	62.4	Low	22 Å²	22	40.3 Å²	40.3	14%	0.135	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.7	165.5	-92.5	0	0	0	0	111.3	I198 C210 V211 V213 K1694	T196-I198 HydrophobicContact CG2-CG2 4.3Å; T196-I198 PolarHBondContact O-N 2.77Å; T196-C210 CarbonylContact O-C 3.35Å; T196-C210 WeakPolarHBondContact O-CA 3.06Å; T196-V211 CarbonylContact C-O 3.56Å; T196-V211 VanDerWaalsContact CA-O 3.25Å; T196-V211 WeakPolarHBondContact CA-O 3.33Å; T196-V211 VanDerWaalsContact CB-O 3.27Å; T196-V211 WeakPolarHBondContact CB-O 3.41Å; T196-V211 PolarHBondContact N-O 3.41Å; T196-V211 PolarHBondContact O-N 3.49Å; T196-V211 VanDerWaalsContact O-O 3.08Å; T196-V213 HydrophobicContact CG2-CG2 4.21Å; T196-V213 WeakPolarHBondContact OG1-CG2 3.23Å; T196-K1694 WeakPolarHBondContact OG1-CD 3.14Å; T196-K1694 WeakPolarHBondContact OG1-CE 3.42Å; T196-K1694 PolarHBondContact OG1-NZ 3Å
197	D	67.8	Low	63.7	Low	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-47.4	130	165.4	-170	0.8	0	0	0	113.2	C191 S199 R202 P206 G207 I209	C191-D197 HydrophobicContact CB-CB 4.37Å; D197-S199 WeakPolarHBondContact OD1-CB 3Å; D197-S199 PolarHBondContact OD1-N 2.79Å; D197-S199 PolarHBondContact OD1-OG 2.88Å; D197-R202 PolarHBondContact O-NE 2.66Å; D197-R202 PolarHBondContact O-NH2 3.39Å; D197-P206 VanDerWaalsContact OD2-CA 3.25Å; D197-P206 WeakPolarHBondContact OD2-CA 3.42Å; D197-P206 WeakPolarHBondContact OD2-CB 3.11Å; D197-G207 PolarHBondContact OD1-N 2.72Å; D197-G207 PolarHBondContact OD2-N 2.7Å; D197-I209 CarbonylContact C-O 3.51Å; D197-I209 WeakPolarHBondContact CA-O 3.48Å
198	I	65.6	Low	64	Low	74 Å²	74	40.6 Å²	40.6	38%	0.379	22%	0.223	S	C	.	.			trans	-131.7	24.5	171	59.7	157.4	0	0	0	111.8	T196 I209 V211	T196-I198 HydrophobicContact CG2-CG2 4.3Å; T196-I198 PolarHBondContact O-N 2.77Å; I198-I209 HydrophobicContact CD1-CG2 3.87Å; I198-I209 HydrophobicContact CG1-CB 4.01Å; I198-I209 HydrophobicContact CG1-CG2 3.61Å; I198-I209 PolarHBondContact N-O 2.88Å; I198-V211 HydrophobicContact CB-CG2 4.36Å; I198-V211 HydrophobicContact CD1-CB 4.38Å; I198-V211 HydrophobicContact CD1-CG1 3.7Å; I198-V211 HydrophobicContact CD1-CG2 3.71Å; I198-V211 HydrophobicContact CG1-CG1 4.13Å; I198-V211 HydrophobicContact CG1-CG2 3.85Å; I198-V211 HydrophobicContact CG2-CG2 3.62Å
199	S	71	Confident	64	Low	3 Å²	3	44 Å²	44	2%	0.021	24%	0.24	C	C	.	.			trans	-55.1	140	170.6	-49.2	0	0	0	0	109.4	D197 D201 R202 L205 G207 R208 I209	D197-S199 WeakPolarHBondContact OD1-CB 3Å; D197-S199 PolarHBondContact OD1-N 2.79Å; D197-S199 PolarHBondContact OD1-OG 2.88Å; S199-D201 PolarHBondContact O-N 3.29Å; S199-D201 VanDerWaalsContact O-N 3.14Å; S199-R202 PolarHBondContact O-N 2.75Å; S199-L205 WeakPolarHBondContact CB-O 3.44Å; S199-G207 PolarHBondContact OG-N 3.43Å; S199-G207 VanDerWaalsContact OG-N 3.09Å; S199-R208 PolarHBondContact OG-N 3.27Å; S199-I209 PolarHBondContact OG-N 2.89Å
200	P	55.3	Low	63.6	Low	131 Å²	131	44.5 Å²	44.5	85%	0.851	24%	0.244	S	C	*	.	S	Bend	trans	-56	-37.2	-171.5	-27.6	35.6	0	0	0	113.1
201	D	51.9	Low	63.2	Low	26 Å²	26	47.1 Å²	47.1	14%	0.139	26%	0.26	C	S	.	.			trans	-112.1	92.1	167	-174.8	-2.1	0	0	0	109.1	S199 S203 R204 L205 P206	S199-D201 PolarHBondContact O-N 3.29Å; S199-D201 VanDerWaalsContact O-N 3.14Å; D201-S203 PolarHBondContact O-N 3.45Å; D201-S203 WeakPolarHBondContact OD1-CA 3.32Å; D201-S203 VanDerWaalsContact OD1-CB 3.29Å; D201-S203 WeakPolarHBondContact OD1-CB 3.32Å; D201-S203 PolarHBondContact OD1-N 3.25Å; D201-S203 PolarHBondContact OD1-OG 3.31Å; D201-R204 PolarHBondContact OD1-N 2.95Å; D201-R204 WeakPolarHBondContact OD2-CA 3.07Å; D201-R204 WeakPolarHBondContact OD2-CB 3.34Å; D201-R204 PolarHBondContact OD2-N 3.43Å; D201-L205 CarbonylContact O-C 3.43Å; D201-L205 PolarHBondContact O-N 2.72Å; D201-P206 WeakPolarHBondContact O-CD 3.48Å
202	R	48.8	Very low	62.6	Low	76 Å²	76	52.4 Å²	52.4	29%	0.287	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-1.2	168.7	-74	176.6	166.9	167.3	-5.1	113.5	D197 S199 P206	D197-R202 PolarHBondContact O-NE 2.66Å; D197-R202 PolarHBondContact O-NH2 3.39Å; S199-R202 PolarHBondContact O-N 2.75Å; R202-P206 WeakPolarHBondContact O-CB 3.46Å; R202-P206 WeakPolarHBondContact O-CG 3.48Å
203	S	45.5	Very low	61.9	Low	10 Å²	10	52.1 Å²	52.1	7%	0.07	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-65.9	-177.5	76.6	0	0	0	0	112.6	D201 P206 Q1711 P1712 P1713 F1714	D201-S203 PolarHBondContact O-N 3.45Å; D201-S203 WeakPolarHBondContact OD1-CA 3.32Å; D201-S203 VanDerWaalsContact OD1-CB 3.29Å; D201-S203 WeakPolarHBondContact OD1-CB 3.32Å; D201-S203 PolarHBondContact OD1-N 3.25Å; D201-S203 PolarHBondContact OD1-OG 3.31Å; S203-P206 VanDerWaalsContact C-CD 3.5Å; S203-P206 WeakPolarHBondContact O-CD 3.48Å; S203-Q1711 CarbonylContact O-C 3.52Å; S203-P1712 CarbonylContact C-O 3.55Å; S203-P1712 VanDerWaalsContact C-O 3.31Å; S203-P1712 WeakPolarHBondContact CA-O 3.48Å; S203-P1712 WeakPolarHBondContact CB-O 3.48Å; S203-P1712 CarbonylContact O-C 3.57Å; S203-P1712 WeakPolarHBondContact O-CA 3.39Å; S203-P1713 VanDerWaalsContact OG-CA 3.3Å; S203-P1713 WeakPolarHBondContact OG-CA 3.28Å; S203-F1714 VanDerWaalsContact CB-N 3.25Å; S203-F1714 PolarHBondContact OG-N 2.78Å
204	R	51.4	Low	61.1	Low	58 Å²	58	55 Å²	55	22%	0.219	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-36.5	176.6	-157.4	172.4	-151.1	108.7	7.2	114.6	D201 P206 P1713 C1716	D201-R204 PolarHBondContact OD1-N 2.95Å; D201-R204 WeakPolarHBondContact OD2-CA 3.07Å; D201-R204 WeakPolarHBondContact OD2-CB 3.34Å; D201-R204 PolarHBondContact OD2-N 3.43Å; R204-P206 VanDerWaalsContact C-CD 3.41Å; R204-P1713 HydrophobicContact CB-CB 3.88Å; R204-P1713 HydrophobicContact CB-CG 3.85Å; R204-P1713 HydrophobicContact CG-CB 4.41Å; R204-P1713 HydrophobicContact CG-CG 3.82Å; R204-C1716 PolarHBondContact NH1-O 3.38Å
205	L	65.6	Low	61.5	Low	90 Å²	90	55.4 Å²	55.4	47%	0.471	30%	0.301	S	S	.	.	S	Bend	trans	-136.4	57.1	-179.2	-65.8	170.6	0	0	0	113.8	S199 D201 R208	S199-L205 WeakPolarHBondContact CB-O 3.44Å; D201-L205 CarbonylContact O-C 3.43Å; D201-L205 PolarHBondContact O-N 2.72Å; L205-R208 WeakPolarHBondContact O-CG 3.26Å
206	P	66.2	Low	61.6	Low	1 Å²	1	54 Å²	54	1%	0.006	30%	0.295	C	S	.	.			trans	-56.7	176	170.3	12.7	-24.3	0	0	0	113.8	D197 D201 R202 S203 R204 R208 Q1710 Q1711	D197-P206 VanDerWaalsContact OD2-CA 3.25Å; D197-P206 WeakPolarHBondContact OD2-CA 3.42Å; D197-P206 WeakPolarHBondContact OD2-CB 3.11Å; D201-P206 WeakPolarHBondContact O-CD 3.48Å; R202-P206 WeakPolarHBondContact O-CB 3.46Å; R202-P206 WeakPolarHBondContact O-CG 3.48Å; S203-P206 VanDerWaalsContact C-CD 3.5Å; S203-P206 WeakPolarHBondContact O-CD 3.48Å; R204-P206 VanDerWaalsContact C-CD 3.41Å; P206-R208 PolarHBondContact O-N 3.24Å; P206-Q1710 VanDerWaalsContact C-CD 3.49Å; P206-Q1710 VanDerWaalsContact C-CG 3.5Å; P206-Q1710 HydrophobicContact CB-CB 4.18Å; P206-Q1710 HydrophobicContact CB-CG 3.93Å; P206-Q1710 VanDerWaalsContact CG-CA 3.42Å; P206-Q1710 HydrophobicContact CG-CB 3.73Å; P206-Q1710 HydrophobicContact CG-CG 4.03Å; P206-Q1710 WeakPolarHBondContact O-CG 3.32Å; P206-Q1710 PolarHBondContact O-NE2 2.86Å; P206-Q1710 PolarHBondContact O-OE1 3.47Å; P206-Q1711 WeakPolarHBondContact CD-O 3.27Å; P206-Q1711 HydrophobicContact CG-CB 4.42Å; P206-Q1711 VanDerWaalsContact CG-N 3.27Å; P206-Q1711 VanDerWaalsContact CG-O 3.25Å; P206-Q1711 WeakPolarHBondContact CG-O 3.23Å
207	G	76.9	Confident	61.9	Low	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	41.5	31.7	177.2	0	0	0	0	0	119.1	S175 C191 D197 S199 Q1710	S175-G207 VanDerWaalsContact CB-O 3.29Å; S175-G207 WeakPolarHBondContact CB-O 3.3Å; S175-G207 PolarHBondContact N-O 3.31Å; C191-G207 WeakPolarHBondContact SG-CA 3.26Å; D197-G207 PolarHBondContact OD1-N 2.72Å; D197-G207 PolarHBondContact OD2-N 2.7Å; S199-G207 PolarHBondContact OG-N 3.43Å; S199-G207 VanDerWaalsContact OG-N 3.09Å; G207-Q1710 PolarHBondContact O-NE2 3.3Å
208	R	81.5	Confident	61.8	Low	53 Å²	53	58.4 Å²	58.4	20%	0.2	34%	0.339	C	S	.	.	S	Bend	trans	-80.4	-25.5	160	-47.9	-58.3	168.7	-171.8	-1.9	110.3	N173 S175 C189 S199 L205 P206	N173-R208 VanDerWaalsContact C-NH1 3.26Å; N173-R208 WeakPolarHBondContact O-CD 3.46Å; N173-R208 PolarHBondContact O-NH1 3.02Å; N173-R208 VanDerWaalsContact OD1-CZ 3.24Å; N173-R208 PolarHBondContact OD1-NH1 3.27Å; S175-R208 WeakPolarHBondContact CB-O 3.31Å; S175-R208 PolarHBondContact OG-O 2.93Å; C189-R208 PolarHBondContact SG-NH1 2.69Å; C189-R208 VanDerWaalsContact SG-NH1 3.44Å; S199-R208 PolarHBondContact OG-N 3.27Å; L205-R208 WeakPolarHBondContact O-CG 3.26Å; P206-R208 PolarHBondContact O-N 3.24Å
209	I	72.7	Confident	61	Low	74 Å²	74	56.8 Å²	56.8	38%	0.379	33%	0.334	S	S	.	.	S	Bend	trans	-139	130	-178.7	-38.4	178.6	0	0	0	111	D197 I198 S199	D197-I209 CarbonylContact C-O 3.51Å; D197-I209 WeakPolarHBondContact CA-O 3.48Å; I198-I209 HydrophobicContact CD1-CG2 3.87Å; I198-I209 HydrophobicContact CG1-CB 4.01Å; I198-I209 HydrophobicContact CG1-CG2 3.61Å; I198-I209 PolarHBondContact N-O 2.88Å; S199-I209 PolarHBondContact OG-N 2.89Å
210	C	70	Confident	60.3	Low	11 Å²	11	59 Å²	59	7%	0.074	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	131	-176.9	-35.3	0	0	0	0	112.6	N177 C191 F195 T196	N177-C210 HydrophobicContact CB-CB 4.33Å; C191-C210 HydrophobicContact CB-CB 4.01Å; C191-C210 WeakPolarHBondContact CB-SG 3.38Å; C191-C210 WeakPolarHBondContact SG-CB 3.14Å; C191-C210 CovalentContact SG-SG 2.04Å; C191-C210 PolarHBondContact SG-SG 2.73Å; F195-C210 HydrophobicContact CB-CB 3.44Å; F195-C210 VanDerWaalsContact CB-CB 3.44Å; F195-C210 HydrophobicContact CD1-CB 4.47Å; F195-C210 HydrophobicContact CG-CB 4.22Å; T196-C210 CarbonylContact O-C 3.35Å; T196-C210 WeakPolarHBondContact O-CA 3.06Å
211	V	61.7	Low	60	Low	62 Å²	62	58.6 Å²	58.6	38%	0.376	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	160.8	-176.7	-56.1	0	0	0	0	113.9	T196 I198	T196-V211 CarbonylContact C-O 3.56Å; T196-V211 VanDerWaalsContact CA-O 3.25Å; T196-V211 WeakPolarHBondContact CA-O 3.33Å; T196-V211 VanDerWaalsContact CB-O 3.27Å; T196-V211 WeakPolarHBondContact CB-O 3.41Å; T196-V211 PolarHBondContact N-O 3.41Å; T196-V211 PolarHBondContact O-N 3.49Å; T196-V211 VanDerWaalsContact O-O 3.08Å; I198-V211 HydrophobicContact CB-CG2 4.36Å; I198-V211 HydrophobicContact CD1-CB 4.38Å; I198-V211 HydrophobicContact CD1-CG1 3.7Å; I198-V211 HydrophobicContact CD1-CG2 3.71Å; I198-V211 HydrophobicContact CG1-CG1 4.13Å; I198-V211 HydrophobicContact CG1-CG2 3.85Å; I198-V211 HydrophobicContact CG2-CG2 3.62Å
212	V	60.6	Low	60	Low	112 Å²	112	65 Å²	65	68%	0.679	37%	0.371	S	S	*	.			trans	-82.4	174	-168.8	-166.7	0	0	0	0	114.1	F195	F195-V212 HydrophobicContact CD1-CG2 4.41Å
213	V	49.2	Very low	60.8	Low	73 Å²	73	63.6 Å²	63.6	44%	0.442	37%	0.366	S	S	.	.			trans	-135	148	-173	-173.4	0	0	0	0	112.6	T196 P237	T196-V213 HydrophobicContact CG2-CG2 4.21Å; T196-V213 WeakPolarHBondContact OG1-CG2 3.23Å; V213-P237 HydrophobicContact CG1-CB 4.12Å
214	E	46.1	Very low	61.4	Low	146 Å²	146	64.3 Å²	64.3	68%	0.682	38%	0.375	S	S	*	.			trans	-131.6	165	175.3	-61.4	-171.4	166.2	0	0	112.4
215	A	56.1	Low	62.3	Low	72 Å²	72	62.4 Å²	62.4	60%	0.595	37%	0.37	S	S	*	.			trans	-119.3	154.1	-175.8	0	0	0	0	0	113.4	Y223	A215-Y223 PolarHBondContact O-OH 3.47Å
216	Q	65.5	Low	62.3	Low	40 Å²	40	58.3 Å²	58.3	19%	0.187	35%	0.348	C	S	.	.			trans	-127.4	-43	-158.7	-54.7	-162.5	12.3	0	0	116.6	G218 S219 Y223 D235	Q216-G218 PolarHBondContact O-N 3.16Å; Q216-G218 VanDerWaalsContact O-N 3.12Å; Q216-S219 PolarHBondContact O-N 3.15Å; Q216-S219 VanDerWaalsContact O-N 3.11Å; Q216-Y223 HydrophobicContact CB-CD1 3.87Å; Q216-Y223 HydrophobicContact CB-CD2 3.82Å; Q216-Y223 HydrophobicContact CB-CE1 4.29Å; Q216-Y223 HydrophobicContact CB-CE2 4.24Å; Q216-Y223 HydrophobicContact CB-CG 3.61Å; Q216-Y223 VanDerWaalsContact CD-CD1 3.44Å; Q216-Y223 HydrophobicContact CG-CD1 3.56Å; Q216-Y223 HydrophobicContact CG-CD2 4.3Å; Q216-Y223 HydrophobicContact CG-CE1 3.69Å; Q216-Y223 HydrophobicContact CG-CE2 4.41Å; Q216-Y223 HydrophobicContact CG-CG 3.88Å; Q216-Y223 WeakPolarHBondContact O-CD2 3.13Å; Q216-D235 PolarHBondContact N-OD1 2.89Å; Q216-D235 PolarHBondContact N-OD2 2.63Å
217	C	71.7	Confident	62.8	Low	34 Å²	34	58.3 Å²	58.3	23%	0.23	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-18.2	-175	-70.6	0	0	0	0	113.6	S219 P220 D235	C217-S219 PolarHBondContact O-N 3.37Å; C217-S219 VanDerWaalsContact O-N 3.13Å; C217-P220 WeakPolarHBondContact O-CD 3.43Å; C217-D235 HydrophobicContact CB-CB 4.02Å; C217-D235 WeakPolarHBondContact CB-OD2 3.19Å; C217-D235 VanDerWaalsContact N-CG 3.28Å; C217-D235 PolarHBondContact N-OD1 3.04Å; C217-D235 PolarHBondContact N-OD2 2.84Å; C217-D235 PolarHBondContact SG-N 3.3Å
218	G	64.4	Low	62.7	Low	80 Å²	80	58.9 Å²	58.9	83%	0.825	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-9.6	172	0	0	0	0	0	115.2	Q216	Q216-G218 PolarHBondContact O-N 3.16Å; Q216-G218 VanDerWaalsContact O-N 3.12Å
219	S	48.3	Very low	62.2	Low	40 Å²	40	57.3 Å²	57.3	28%	0.28	35%	0.348	S	S	.	.	S	Bend	trans	-148.3	79.6	170.7	51.9	0	0	0	0	111.2	Q216 C217 S221 R222 Y223	Q216-S219 PolarHBondContact O-N 3.15Å; Q216-S219 VanDerWaalsContact O-N 3.11Å; C217-S219 PolarHBondContact O-N 3.37Å; C217-S219 VanDerWaalsContact O-N 3.13Å; S219-S221 VanDerWaalsContact C-N 3.29Å; S219-S221 PolarHBondContact O-N 3.44Å; S219-R222 VanDerWaalsContact O-CB 3.32Å; S219-R222 WeakPolarHBondContact O-CB 3.11Å; S219-R222 PolarHBondContact O-N 3.48Å; S219-R222 WeakPolarHBondContact OG-CB 3.15Å; S219-R222 WeakPolarHBondContact OG-CD 3.48Å; S219-Y223 WeakPolarHBondContact OG-CE2 3.48Å
220	P	56.4	Low	62	Low	50 Å²	50	54 Å²	54	33%	0.325	33%	0.331	S	S	.	.	H	α-helix	trans	-55.2	-40.5	-170.5	-28.1	36.4	0	0	0	113.9	C217 R222 Y223 G224 V225	C217-P220 WeakPolarHBondContact O-CD 3.43Å; P220-R222 PolarHBondContact O-N 2.91Å; P220-Y223 PolarHBondContact O-N 3.27Å; P220-G224 PolarHBondContact O-N 3.08Å; P220-V225 HydrophobicContact CB-CG2 4.26Å
221	S	50.3	Low	62	Low	123 Å²	123	53.5 Å²	53.5	86%	0.86	33%	0.328	S	S	*	.	H	α-helix	trans	-63.5	-18.9	177	-44.1	0	0	0	0	114.6	S219	S219-S221 VanDerWaalsContact C-N 3.29Å; S219-S221 PolarHBondContact O-N 3.44Å
222	R	51.5	Low	62.5	Low	160 Å²	160	51.6 Å²	51.6	60%	0.604	32%	0.315	S	S	*	.	H	α-helix	trans	-90.6	-21.6	-177.3	-169.5	-178	-174.3	-139.3	3.3	113.2	S219 P220	S219-R222 VanDerWaalsContact O-CB 3.32Å; S219-R222 WeakPolarHBondContact O-CB 3.11Å; S219-R222 PolarHBondContact O-N 3.48Å; S219-R222 WeakPolarHBondContact OG-CB 3.15Å; S219-R222 WeakPolarHBondContact OG-CD 3.48Å; P220-R222 PolarHBondContact O-N 2.91Å
223	Y	64.3	Low	63.2	Low	46 Å²	46	46.8 Å²	46.8	18%	0.18	29%	0.286	C	S	.	.	H	α-helix	trans	-122.6	-11.9	-172.2	-66.3	-81.6	0	0	0	114.1	A215 Q216 S219 P220	A215-Y223 PolarHBondContact O-OH 3.47Å; Q216-Y223 HydrophobicContact CB-CD1 3.87Å; Q216-Y223 HydrophobicContact CB-CD2 3.82Å; Q216-Y223 HydrophobicContact CB-CE1 4.29Å; Q216-Y223 HydrophobicContact CB-CE2 4.24Å; Q216-Y223 HydrophobicContact CB-CG 3.61Å; Q216-Y223 VanDerWaalsContact CD-CD1 3.44Å; Q216-Y223 HydrophobicContact CG-CD1 3.56Å; Q216-Y223 HydrophobicContact CG-CD2 4.3Å; Q216-Y223 HydrophobicContact CG-CE1 3.69Å; Q216-Y223 HydrophobicContact CG-CE2 4.41Å; Q216-Y223 HydrophobicContact CG-CG 3.88Å; Q216-Y223 WeakPolarHBondContact O-CD2 3.13Å; S219-Y223 WeakPolarHBondContact OG-CE2 3.48Å; P220-Y223 PolarHBondContact O-N 3.27Å
224	G	58.1	Low	64.2	Low	25 Å²	25	44.7 Å²	44.7	26%	0.258	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	81.6	172.7	0	0	0	0	0	112.1	P220 F240 F2189	P220-G224 PolarHBondContact O-N 3.08Å; G224-F240 WeakPolarHBondContact O-CE1 3.3Å; G224-F240 WeakPolarHBondContact O-CZ 2.91Å; G224-F2189 WeakPolarHBondContact O-CE2 3.25Å; G224-F2189 WeakPolarHBondContact O-CZ 3.1Å
225	V	71.1	Confident	65.1	Low	18 Å²	18	40.6 Å²	40.6	11%	0.109	26%	0.256	C	S	.	.			trans	-81.8	131.1	173.5	163.8	0	0	0	0	110.8	P220 C233 F240 V2218 Q2227	P220-V225 HydrophobicContact CB-CG2 4.26Å; V225-C233 HydrophobicContact CG1-CB 3.69Å; V225-C233 WeakPolarHBondContact CG1-SG 3.43Å; V225-C233 WeakPolarHBondContact CG2-SG 3.42Å; V225-F240 HydrophobicContact CB-CE2 4.49Å; V225-F240 HydrophobicContact CG1-CD2 4.47Å; V225-F240 HydrophobicContact CG1-CE2 4.47Å; V225-F240 HydrophobicContact CG2-CD1 4.2Å; V225-F240 HydrophobicContact CG2-CD2 4.35Å; V225-F240 HydrophobicContact CG2-CG 4.14Å; V225-V2218 WeakPolarHBondContact O-CG1 3.38Å; V225-Q2227 PolarHBondContact O-OE1 2.78Å
226	D	65.4	Low	64.9	Low	4 Å²	4	39.3 Å²	39.3	2%	0.021	24%	0.241	C	C	.	.			trans	-129	66.8	171.2	67.8	-22.1	0	0	0	115.4	F240 R261 F2189 F2220 Q2227	D226-F240 WeakPolarHBondContact OD1-CZ 3.44Å; D226-R261 PolarHBondContact O-NE 3.37Å; D226-R261 IonicContact OD1-CZ 2.85Å; D226-R261 VanDerWaalsContact OD1-CZ 3.25Å; D226-R261 IonicContact OD1-NE 3.81Å; D226-R261 IonicContact OD1-NH2 3.64Å; D226-R261 PolarHBondContact OD1-NH2 3.07Å; D226-R261 IonicContact OD2-CZ 3.57Å; D226-R261 IonicContact OD2-NE 3.46Å; D226-R261 PolarHBondContact OD2-NE 3.33Å; D226-R261 IonicContact OD2-NH1 3.21Å; D226-R261 PolarHBondContact OD2-NH1 2.66Å; D226-R261 IonicContact OD2-NH2 3.54Å; D226-R261 PolarHBondContact OD2-NH2 2.91Å; D226-F2189 HydrophobicContact CB-CD1 4.03Å; D226-F2189 HydrophobicContact CB-CD2 4.29Å; D226-F2189 HydrophobicContact CB-CE1 3.44Å; D226-F2189 VanDerWaalsContact CB-CE1 3.44Å; D226-F2189 HydrophobicContact CB-CE2 3.62Å; D226-F2189 HydrophobicContact CB-CG 4.49Å; D226-F2189 HydrophobicContact CB-CZ 3.2Å; D226-F2189 WeakPolarHBondContact OD1-CE1 3.44Å; D226-F2189 VanDerWaalsContact OD1-CZ 3.31Å; D226-F2189 WeakPolarHBondContact OD1-CZ 3.35Å; D226-F2189 WeakPolarHBondContact OD2-CE1 3.36Å; D226-F2220 HydrophobicContact CB-CE2 4.17Å; D226-F2220 HydrophobicContact CB-CZ 4.18Å; D226-Q2227 VanDerWaalsContact CA-OE1 3.22Å
227	C	77	Confident	64	Low	1 Å²	1	40.6 Å²	40.6	1%	0.007	25%	0.253	C	S	.	.			trans	-89.4	147.3	167.5	-56.5	0	0	0	0	109.2	A231 Q232 C233 C242 Q2227	C227-A231 HydrophobicContact CB-CB 3.79Å; C227-Q232 PolarHBondContact SG-O 3.31Å; C227-C233 HydrophobicContact CB-CB 4.46Å; C227-C233 VanDerWaalsContact SG-CA 3.58Å; C227-C233 WeakPolarHBondContact SG-CB 3.41Å; C227-C242 WeakPolarHBondContact CA-SG 3.35Å; C227-C242 HydrophobicContact CB-CB 3.67Å; C227-C242 WeakPolarHBondContact CB-SG 3.29Å; C227-C242 PolarHBondContact N-SG 3.38Å; C227-C242 VanDerWaalsContact N-SG 3.42Å; C227-C242 WeakPolarHBondContact SG-CA 3.44Å; C227-C242 WeakPolarHBondContact SG-CB 3.27Å; C227-C242 CovalentContact SG-SG 2.04Å; C227-C242 PolarHBondContact SG-SG 3.17Å; C227-Q2227 WeakPolarHBondContact O-CB 3.24Å; C227-Q2227 WeakPolarHBondContact O-CG 3.23Å; C227-Q2227 PolarHBondContact O-NE2 2.93Å; C227-Q2227 VanDerWaalsContact O-NE2 3.14Å; C227-Q2227 PolarHBondContact O-OE1 3.46Å; C227-Q2227 VanDerWaalsContact O-OE1 3.09Å
228	D	73.9	Confident	62.8	Low	12 Å²	12	48.4 Å²	48.4	6%	0.064	28%	0.283	C	S	.	.			trans	-51.9	157.4	177.2	-168.2	-84.4	0	0	0	110.4	N230 A231 G260 K262 K2237	D228-N230 CarbonylContact O-C 3.47Å; D228-N230 PolarHBondContact O-N 3.09Å; D228-N230 WeakPolarHBondContact OD1-CA 3.16Å; D228-N230 WeakPolarHBondContact OD1-CB 3.42Å; D228-N230 PolarHBondContact OD1-N 2.95Å; D228-N230 PolarHBondContact OD1-ND2 2.64Å; D228-A231 HydrophobicContact CB-CB 4.24Å; D228-A231 PolarHBondContact O-N 3.06Å; D228-G260 WeakPolarHBondContact CB-O 3.41Å; D228-G260 PolarHBondContact N-O 3.03Å; D228-K262 WeakPolarHBondContact OD2-CA 2.94Å; D228-K2237 WeakPolarHBondContact OD1-CE 3.09Å; D228-K2237 IonicContact OD1-NZ 3.21Å; D228-K2237 PolarHBondContact OD1-NZ 2.88Å; D228-K2237 IonicContact OD2-NZ 3.61Å; D228-K2237 PolarHBondContact OD2-NZ 3.33Å
229	P	71.4	Confident	62.7	Low	21 Å²	21	45.2 Å²	45.2	14%	0.136	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-32.9	-40.5	154.3	-4.3	-9.2	0	0	0	112.3	C2226 C2228 R2236	P229-C2226 VanDerWaalsContact CA-O 3.23Å; P229-C2226 WeakPolarHBondContact CA-O 3.46Å; P229-C2226 WeakPolarHBondContact CB-O 3.43Å; P229-C2226 WeakPolarHBondContact CD-O 3.49Å; P229-C2226 VanDerWaalsContact CG-O 3.24Å; P229-C2226 WeakPolarHBondContact CG-O 3.32Å; P229-C2228 WeakPolarHBondContact O-CB 3.41Å; P229-C2228 PolarHBondContact O-N 3.3Å; P229-C2228 PolarHBondContact O-SG 2.7Å; P229-R2236 VanDerWaalsContact CB-CZ 3.47Å; P229-R2236 PolarHBondContact O-NH2 2.95Å
230	N	68.8	Low	63.9	Low	4 Å²	4	45.5 Å²	45.5	2%	0.021	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	52	177.8	-43.8	-118.2	0	0	0	114	D228 N245 F248 C263 D2234 R2236 K2237	D228-N230 CarbonylContact O-C 3.47Å; D228-N230 PolarHBondContact O-N 3.09Å; D228-N230 WeakPolarHBondContact OD1-CA 3.16Å; D228-N230 WeakPolarHBondContact OD1-CB 3.42Å; D228-N230 PolarHBondContact OD1-N 2.95Å; D228-N230 PolarHBondContact OD1-ND2 2.64Å; N230-N245 VanDerWaalsContact C-CG 3.45Å; N230-N245 VanDerWaalsContact CA-ND2 3.28Å; N230-N245 WeakPolarHBondContact CA-ND2 3.36Å; N230-N245 HydrophobicContact CB-CB 4.48Å; N230-N245 VanDerWaalsContact O-CG 3.23Å; N230-N245 PolarHBondContact O-ND2 3.15Å; N230-N245 VanDerWaalsContact O-ND2 3.16Å; N230-F248 HydrophobicContact CB-CD1 4.46Å; N230-F248 HydrophobicContact CB-CE1 3.62Å; N230-F248 HydrophobicContact CB-CZ 3.93Å; N230-F248 WeakPolarHBondContact OD1-CE1 3.27Å; N230-F248 WeakPolarHBondContact OD1-CZ 3.29Å; N230-C263 PolarHBondContact O-SG 2.92Å; N230-C263 VanDerWaalsContact O-SG 3.33Å; N230-D2234 WeakPolarHBondContact CA-OD2 2.98Å; N230-D2234 HydrophobicContact CB-CB 3.65Å; N230-D2234 PolarHBondContact N-OD2 3.01Å; N230-D2234 PolarHBondContact ND2-OD2 2.87Å; N230-D2234 PolarHBondContact OD1-OD1 2.99Å; N230-D2234 PolarHBondContact OD1-OD2 3.27Å; N230-R2236 VanDerWaalsContact OD1-CB 3.28Å; N230-R2236 WeakPolarHBondContact OD1-CB 3.25Å; N230-R2236 PolarHBondContact OD1-N 2.92Å; N230-R2236 VanDerWaalsContact OD1-N 3.16Å; N230-K2237 HydrophobicContact CB-CD 3.81Å; N230-K2237 VanDerWaalsContact CG-CD 3.44Å; N230-K2237 WeakPolarHBondContact ND2-CD 3.34Å; N230-K2237 WeakPolarHBondContact ND2-CE 3.09Å; N230-K2237 PolarHBondContact OD1-N 3.16Å
231	A	70.6	Confident	64.2	Low	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	160.7	160.5	0	0	0	0	0	114.5	C227 D228 C242 K243 N245 G260	C227-A231 HydrophobicContact CB-CB 3.79Å; D228-A231 HydrophobicContact CB-CB 4.24Å; D228-A231 PolarHBondContact O-N 3.06Å; A231-C242 HydrophobicContact CB-CB 4.4Å; A231-K243 CarbonylContact C-O 3.59Å; A231-K243 WeakPolarHBondContact CA-O 3.4Å; A231-K243 WeakPolarHBondContact CB-O 3.46Å; A231-N245 WeakPolarHBondContact CA-ND2 3.25Å; A231-N245 WeakPolarHBondContact CA-OD1 3.44Å; A231-N245 PolarHBondContact N-ND2 3.38Å; A231-N245 VanDerWaalsContact N-ND2 3.11Å; A231-G260 WeakPolarHBondContact CB-O 3.25Å
232	Q	71.7	Confident	65.5	Low	22 Å²	22	41.2 Å²	41.2	10%	0.103	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	144.4	173	-102.4	-159.1	-113.7	0	0	111.4	C227 C242 K243 D2230 L2233	C227-Q232 PolarHBondContact SG-O 3.31Å; Q232-C242 VanDerWaalsContact O-CA 3.23Å; Q232-C242 WeakPolarHBondContact O-CA 3.43Å; Q232-K243 HydrophobicContact CB-CB 4.16Å; Q232-K243 PolarHBondContact N-O 2.81Å; Q232-K243 PolarHBondContact O-N 2.78Å; Q232-K243 VanDerWaalsContact O-N 3.09Å; Q232-D2230 WeakPolarHBondContact CB-OD1 3.19Å; Q232-D2230 WeakPolarHBondContact CG-OD1 3.48Å; Q232-D2230 PolarHBondContact NE2-OD1 3.33Å; Q232-L2233 HydrophobicContact CG-CD1 4.32Å
233	C	74.3	Confident	66.4	Low	11 Å²	11	38 Å²	38	7%	0.074	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	105.8	-179.7	-175.7	0	0	0	0	116.5	V225 C227 F240 T241 D2230	V225-C233 HydrophobicContact CG1-CB 3.69Å; V225-C233 WeakPolarHBondContact CG1-SG 3.43Å; V225-C233 WeakPolarHBondContact CG2-SG 3.42Å; C227-C233 HydrophobicContact CB-CB 4.46Å; C227-C233 VanDerWaalsContact SG-CA 3.58Å; C227-C233 WeakPolarHBondContact SG-CB 3.41Å; C233-F240 VanDerWaalsContact SG-CD2 3.55Å; C233-T241 CarbonylContact C-O 3.6Å; C233-T241 WeakPolarHBondContact CA-O 3.49Å; C233-D2230 HydrophobicContact CB-CB 4.4Å; C233-D2230 PolarHBondContact N-OD1 3.03Å; C233-D2230 WeakPolarHBondContact O-CB 3.4Å
234	V	72	Confident	66.7	Low	30 Å²	30	36.8 Å²	36.8	18%	0.182	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.9	-172.3	-148.3	0	0	0	0	113.3	F240 T241 N1639	V234-F240 CarbonylContact O-C 3.58Å; V234-F240 WeakPolarHBondContact O-CA 3.46Å; V234-F240 WeakPolarHBondContact O-CB 3.3Å; V234-T241 HydrophobicContact CB-CG2 3.91Å; V234-T241 HydrophobicContact CG2-CG2 4.16Å; V234-T241 PolarHBondContact N-O 3.02Å; V234-T241 PolarHBondContact O-N 3.07Å; V234-N1639 WeakPolarHBondContact CG1-ND2 3.39Å
235	D	63.3	Low	66.8	Low	59 Å²	59	36 Å²	36	32%	0.316	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	144.8	-177.9	-133.9	-29.4	0	0	0	112.6	Q216 C217	Q216-D235 PolarHBondContact N-OD1 2.89Å; Q216-D235 PolarHBondContact N-OD2 2.63Å; C217-D235 HydrophobicContact CB-CB 4.02Å; C217-D235 WeakPolarHBondContact CB-OD2 3.19Å; C217-D235 VanDerWaalsContact N-CG 3.28Å; C217-D235 PolarHBondContact N-OD1 3.04Å; C217-D235 PolarHBondContact N-OD2 2.84Å; C217-D235 PolarHBondContact SG-N 3.3Å
236	T	51.8	Low	66.2	Low	46 Å²	46	36.2 Å²	36.2	28%	0.282	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	154	178.8	73.8	0	0	0	0	111.8	K238 G239 T241	T236-K238 PolarHBondContact O-N 3.26Å; T236-G239 CarbonylContact C-O 3.59Å; T236-G239 WeakPolarHBondContact CA-O 3.47Å; T236-G239 PolarHBondContact N-O 3.47Å; T236-G239 PolarHBondContact O-N 2.6Å; T236-G239 PolarHBondContact OG1-N 3.26Å; T236-G239 PolarHBondContact OG1-O 3.22Å; T236-T241 HydrophobicContact CG2-CG2 4.17Å
237	P	46.4	Very low	65.4	Low	66 Å²	66	37.6 Å²	37.6	43%	0.429	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	23.3	-175.8	28.4	-33.4	0	0	0	116	V213 Q1691	V213-P237 HydrophobicContact CG1-CB 4.12Å; P237-Q1691 HydrophobicContact CG-CG 4.06Å
238	K	47.9	Very low	64.9	Low	198 Å²	198	38.6 Å²	38.6	86%	0.861	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-141.3	1.4	162.7	-87.5	-165.8	175.5	-176.5	0	113.9	T236	T236-K238 PolarHBondContact O-N 3.26Å
239	G	61.4	Low	64.6	Low	13 Å²	13	39.5 Å²	39.5	13%	0.134	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.1	-145.1	-170.4	0	0	0	0	0	112	T236	T236-G239 CarbonylContact C-O 3.59Å; T236-G239 WeakPolarHBondContact CA-O 3.47Å; T236-G239 PolarHBondContact N-O 3.47Å; T236-G239 PolarHBondContact O-N 2.6Å; T236-G239 PolarHBondContact OG1-N 3.26Å; T236-G239 PolarHBondContact OG1-O 3.22Å
240	F	73.6	Confident	64.6	Low	47 Å²	47	41.1 Å²	41.1	21%	0.206	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	170.9	175.8	62.8	-85.2	0	0	0	110.8	G224 V225 D226 C233 V234 F2189	G224-F240 WeakPolarHBondContact O-CE1 3.3Å; G224-F240 WeakPolarHBondContact O-CZ 2.91Å; V225-F240 HydrophobicContact CB-CE2 4.49Å; V225-F240 HydrophobicContact CG1-CD2 4.47Å; V225-F240 HydrophobicContact CG1-CE2 4.47Å; V225-F240 HydrophobicContact CG2-CD1 4.2Å; V225-F240 HydrophobicContact CG2-CD2 4.35Å; V225-F240 HydrophobicContact CG2-CG 4.14Å; D226-F240 WeakPolarHBondContact OD1-CZ 3.44Å; C233-F240 VanDerWaalsContact SG-CD2 3.55Å; V234-F240 CarbonylContact O-C 3.58Å; V234-F240 WeakPolarHBondContact O-CA 3.46Å; V234-F240 WeakPolarHBondContact O-CB 3.3Å; F240-F2189 HydrophobicContact CZ-CZ 4.22Å
241	T	62.9	Low	64.4	Low	68 Å²	68	41.6 Å²	41.6	42%	0.417	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	161	179	-171.7	0	0	0	0	112.8	C233 V234 T236	C233-T241 CarbonylContact C-O 3.6Å; C233-T241 WeakPolarHBondContact CA-O 3.49Å; V234-T241 HydrophobicContact CB-CG2 3.91Å; V234-T241 HydrophobicContact CG2-CG2 4.16Å; V234-T241 PolarHBondContact N-O 3.02Å; V234-T241 PolarHBondContact O-N 3.07Å; T236-T241 HydrophobicContact CG2-CG2 4.17Å
242	C	78	Confident	64.3	Low	15 Å²	15	41.6 Å²	41.6	10%	0.101	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	136.3	-169.7	-59.8	0	0	0	0	113.2	C227 A231 Q232	C227-C242 WeakPolarHBondContact CA-SG 3.35Å; C227-C242 HydrophobicContact CB-CB 3.67Å; C227-C242 WeakPolarHBondContact CB-SG 3.29Å; C227-C242 PolarHBondContact N-SG 3.38Å; C227-C242 VanDerWaalsContact N-SG 3.42Å; C227-C242 WeakPolarHBondContact SG-CA 3.44Å; C227-C242 WeakPolarHBondContact SG-CB 3.27Å; C227-C242 CovalentContact SG-SG 2.04Å; C227-C242 PolarHBondContact SG-SG 3.17Å; A231-C242 HydrophobicContact CB-CB 4.4Å; Q232-C242 VanDerWaalsContact O-CA 3.23Å; Q232-C242 WeakPolarHBondContact O-CA 3.43Å
243	K	71	Confident	63.5	Low	93 Å²	93	48.4 Å²	48.4	40%	0.404	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122	-177	170.3	-172.9	173.4	-170.8	0	111.6	A231 Q232 N245	A231-K243 CarbonylContact C-O 3.59Å; A231-K243 WeakPolarHBondContact CA-O 3.4Å; A231-K243 WeakPolarHBondContact CB-O 3.46Å; Q232-K243 HydrophobicContact CB-CB 4.16Å; Q232-K243 PolarHBondContact N-O 2.81Å; Q232-K243 PolarHBondContact O-N 2.78Å; Q232-K243 VanDerWaalsContact O-N 3.09Å; K243-N245 PolarHBondContact O-OD1 3.02Å
244	C	69	Low	62.7	Low	20 Å²	20	55.7 Å²	55.7	14%	0.135	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	163.2	174.2	-94	0	0	0	0	113.4	D250 K262 C263	C244-D250 HydrophobicContact CB-CB 3.97Å; C244-D250 PolarHBondContact SG-OD2 2.69Å; C244-K262 PolarHBondContact SG-O 2.88Å; C244-C263 HydrophobicContact CB-CB 4.07Å; C244-C263 WeakPolarHBondContact CB-SG 3.13Å; C244-C263 WeakPolarHBondContact SG-CB 3.41Å; C244-C263 CovalentContact SG-SG 2.05Å; C244-C263 PolarHBondContact SG-SG 2.14Å
245	N	61.1	Low	61.7	Low	8 Å²	8	57.7 Å²	57.7	4%	0.043	30%	0.304	C	S	.	.			trans	-110.7	-179.9	-155.9	-66.1	-13.2	0	0	0	114.5	N230 A231 K243 F248 L2233 D2234	N230-N245 VanDerWaalsContact C-CG 3.45Å; N230-N245 VanDerWaalsContact CA-ND2 3.28Å; N230-N245 WeakPolarHBondContact CA-ND2 3.36Å; N230-N245 HydrophobicContact CB-CB 4.48Å; N230-N245 VanDerWaalsContact O-CG 3.23Å; N230-N245 PolarHBondContact O-ND2 3.15Å; N230-N245 VanDerWaalsContact O-ND2 3.16Å; A231-N245 WeakPolarHBondContact CA-ND2 3.25Å; A231-N245 WeakPolarHBondContact CA-OD1 3.44Å; A231-N245 PolarHBondContact N-ND2 3.38Å; A231-N245 VanDerWaalsContact N-ND2 3.11Å; K243-N245 PolarHBondContact O-OD1 3.02Å; N245-F248 HydrophobicContact CB-CD2 4.1Å; N245-F248 HydrophobicContact CB-CE2 3.71Å; N245-F248 HydrophobicContact CB-CZ 4Å; N245-F248 WeakPolarHBondContact O-CB 3.46Å; N245-F248 WeakPolarHBondContact O-CD2 3.21Å; N245-L2233 HydrophobicContact CB-CB 3.62Å; N245-L2233 HydrophobicContact CB-CD2 4.47Å; N245-L2233 HydrophobicContact CB-CG 4.01Å; N245-L2233 WeakPolarHBondContact ND2-CA 3.36Å; N245-L2233 WeakPolarHBondContact OD1-CA 3.38Å; N245-L2233 WeakPolarHBondContact OD1-CG 3.48Å; N245-D2234 HydrophobicContact CB-CB 4.36Å; N245-D2234 WeakPolarHBondContact CB-O 3.48Å; N245-D2234 WeakPolarHBondContact ND2-CA 3.27Å; N245-D2234 WeakPolarHBondContact ND2-CB 3.48Å; N245-D2234 PolarHBondContact ND2-N 3.34Å
246	A	57.6	Low	60.8	Low	23 Å²	23	62.5 Å²	62.5	19%	0.19	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	131.2	-158.7	0	0	0	0	0	115.3	F248 L2233 S2238	A246-F248 VanDerWaalsContact C-CD2 3.46Å; A246-F248 WeakPolarHBondContact O-CD2 3.17Å; A246-F248 VanDerWaalsContact O-CE2 3.29Å; A246-F248 WeakPolarHBondContact O-CE2 3.03Å; A246-L2233 HydrophobicContact CB-CB 4.34Å; A246-L2233 HydrophobicContact CB-CD2 3.75Å; A246-S2238 VanDerWaalsContact O-CB 3.3Å; A246-S2238 WeakPolarHBondContact O-CB 3.5Å; A246-S2238 PolarHBondContact O-OG 3.43Å
247	G	49.6	Very low	61.2	Low	33 Å²	33	64.3 Å²	64.3	34%	0.34	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	23.6	-167.2	0	0	0	0	0	113.3	S2238 P2239	G247-S2238 WeakPolarHBondContact CA-OG 3.18Å; G247-S2238 WeakPolarHBondContact O-CA 3.31Å; G247-P2239 WeakPolarHBondContact O-CD 3.08Å
248	F	66	Low	62.1	Low	21 Å²	21	67.4 Å²	67.4	9%	0.092	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.5	178.1	-57.2	-125.4	0	0	0	109.7	N230 N245 A246 C263 S264 D2234 I2235 K2237	N230-F248 HydrophobicContact CB-CD1 4.46Å; N230-F248 HydrophobicContact CB-CE1 3.62Å; N230-F248 HydrophobicContact CB-CZ 3.93Å; N230-F248 WeakPolarHBondContact OD1-CE1 3.27Å; N230-F248 WeakPolarHBondContact OD1-CZ 3.29Å; N245-F248 HydrophobicContact CB-CD2 4.1Å; N245-F248 HydrophobicContact CB-CE2 3.71Å; N245-F248 HydrophobicContact CB-CZ 4Å; N245-F248 WeakPolarHBondContact O-CB 3.46Å; N245-F248 WeakPolarHBondContact O-CD2 3.21Å; A246-F248 VanDerWaalsContact C-CD2 3.46Å; A246-F248 WeakPolarHBondContact O-CD2 3.17Å; A246-F248 VanDerWaalsContact O-CE2 3.29Å; A246-F248 WeakPolarHBondContact O-CE2 3.03Å; F248-C263 HydrophobicContact CB-CB 3.83Å; F248-C263 HydrophobicContact CD1-CB 3.72Å; F248-C263 HydrophobicContact CG-CB 4.2Å; F248-S264 WeakPolarHBondContact CA-O 3.41Å; F248-D2234 WeakPolarHBondContact CE2-O 3.38Å; F248-D2234 WeakPolarHBondContact CZ-O 3.25Å; F248-I2235 HydrophobicContact CE2-CB 4.47Å; F248-I2235 HydrophobicContact CE2-CG2 4.2Å; F248-K2237 HydrophobicContact CD1-CB 3.48Å; F248-K2237 VanDerWaalsContact CD1-CB 3.48Å; F248-K2237 HydrophobicContact CD1-CD 3.56Å; F248-K2237 HydrophobicContact CD1-CG 4.06Å; F248-K2237 WeakPolarHBondContact CD1-O 3.08Å; F248-K2237 HydrophobicContact CE1-CB 3.41Å; F248-K2237 VanDerWaalsContact CE1-CB 3.41Å; F248-K2237 HydrophobicContact CE1-CD 3.4Å; F248-K2237 HydrophobicContact CE1-CG 3.76Å; F248-K2237 WeakPolarHBondContact CE1-O 3.41Å; F248-K2237 WeakPolarHBondContact CG-O 3.12Å
249	V	68.7	Low	63.1	Low	31 Å²	31	62.4 Å²	62.4	19%	0.188	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.9	159	-167.9	0	0	0	0	107.8	T251 C263 S264 E266 K288 I289	V249-T251 HydrophobicContact CG1-CG2 4.48Å; V249-T251 PolarHBondContact O-N 2.89Å; V249-C263 CarbonylContact O-C 3.57Å; V249-C263 WeakPolarHBondContact O-CA 3.29Å; V249-C263 WeakPolarHBondContact O-CB 3.26Å; V249-S264 PolarHBondContact N-O 3.07Å; V249-S264 VanDerWaalsContact N-O 3.08Å; V249-S264 PolarHBondContact O-N 2.69Å; V249-E266 HydrophobicContact CG2-CB 4.39Å; V249-K288 VanDerWaalsContact CG2-O 3.23Å; V249-K288 WeakPolarHBondContact CG2-O 3.19Å; V249-I289 HydrophobicContact CG1-CG1 4.44Å
250	D	70.4	Confident	63.7	Low	56 Å²	56	61.8 Å²	61.8	30%	0.299	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	121.6	166.1	-167.3	-40.8	0	0	0	108.3	C244 S252 G260	C244-D250 HydrophobicContact CB-CB 3.97Å; C244-D250 PolarHBondContact SG-OD2 2.69Å; D250-S252 WeakPolarHBondContact OD1-CB 3.5Å; D250-S252 PolarHBondContact OD1-N 3.5Å; D250-S252 PolarHBondContact OD1-OG 2.99Å; D250-G260 PolarHBondContact OD2-N 2.6Å
251	T	64.6	Low	64.1	Low	13 Å²	13	61.9 Å²	61.9	8%	0.08	32%	0.323	C	S	.	.			trans	-119.5	18.5	179.1	40.9	0	0	0	0	111.4	V249 E253 Y254 V255 K262 C263 S264	V249-T251 HydrophobicContact CG1-CG2 4.48Å; V249-T251 PolarHBondContact O-N 2.89Å; T251-E253 PolarHBondContact O-N 3.45Å; T251-Y254 HydrophobicContact CG2-CD2 4.05Å; T251-Y254 PolarHBondContact O-N 3.24Å; T251-V255 PolarHBondContact O-N 2.97Å; T251-K262 CarbonylContact C-O 3.59Å; T251-K262 PolarHBondContact N-O 3.08Å; T251-C263 WeakPolarHBondContact OG1-CA 3.23Å; T251-C263 PolarHBondContact OG1-N 3.1Å; T251-C263 PolarHBondContact OG1-O 3.25Å; T251-S264 WeakPolarHBondContact CG2-OG 3.32Å; T251-S264 PolarHBondContact OG1-OG 3.06Å
252	S	68	Low	64.4	Low	1 Å²	1	62.9 Å²	62.9	1%	0.007	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-41.5	171.5	-47	0	0	0	0	110	D250 V255 N256 M257 K258 G260 R261 K262	D250-S252 WeakPolarHBondContact OD1-CB 3.5Å; D250-S252 PolarHBondContact OD1-N 3.5Å; D250-S252 PolarHBondContact OD1-OG 2.99Å; S252-V255 CarbonylContact O-C 3.56Å; S252-V255 PolarHBondContact O-N 2.88Å; S252-N256 PolarHBondContact O-N 2.96Å; S252-M257 CarbonylContact C-O 3.53Å; S252-M257 VanDerWaalsContact CB-O 3.28Å; S252-M257 WeakPolarHBondContact CB-O 3.01Å; S252-M257 PolarHBondContact O-N 3.08Å; S252-K258 WeakPolarHBondContact CB-O 3.19Å; S252-K258 PolarHBondContact OG-O 2.8Å; S252-K258 VanDerWaalsContact OG-O 3.09Å; S252-G260 PolarHBondContact OG-N 2.93Å; S252-R261 PolarHBondContact OG-N 3.09Å; S252-R261 VanDerWaalsContact OG-N 3.12Å; S252-K262 PolarHBondContact N-O 3.47Å; S252-K262 PolarHBondContact OG-N 2.86Å; S252-K262 PolarHBondContact OG-O 2.94Å
253	E	56.5	Low	64	Low	165 Å²	165	62.3 Å²	62.3	77%	0.771	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-57.6	-49.7	175.1	-172.1	171.7	-165.3	0	0	112.2	T251 V255 N256	T251-E253 PolarHBondContact O-N 3.45Å; E253-V255 PolarHBondContact O-N 2.59Å; E253-V255 VanDerWaalsContact O-N 3.11Å; E253-N256 PolarHBondContact O-N 2.65Å
254	Y	57.1	Low	63.5	Low	163 Å²	163	59.6 Å²	59.6	64%	0.639	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-62.9	-17.6	178.5	-79.6	-89.7	0	0	0	114.4	T251 I289	T251-Y254 HydrophobicContact CG2-CD2 4.05Å; T251-Y254 PolarHBondContact O-N 3.24Å; Y254-I289 HydrophobicContact CD2-CD1 4.49Å; Y254-I289 HydrophobicContact CE2-CD1 3.51Å; Y254-I289 VanDerWaalsContact OH-CD1 3.3Å; Y254-I289 WeakPolarHBondContact OH-CD1 3.44Å
255	V	50.3	Low	62.9	Low	73 Å²	73	61.9 Å²	61.9	44%	0.442	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-119.5	15.1	-179.7	-159.2	0	0	0	0	112.1	T251 S252 E253 M257 K262	T251-V255 PolarHBondContact O-N 2.97Å; S252-V255 CarbonylContact O-C 3.56Å; S252-V255 PolarHBondContact O-N 2.88Å; E253-V255 PolarHBondContact O-N 2.59Å; E253-V255 VanDerWaalsContact O-N 3.11Å; V255-M257 HydrophobicContact CG1-CE 4.26Å; V255-M257 PolarHBondContact O-N 2.74Å; V255-K262 HydrophobicContact CG2-CG 4.17Å
256	N	45.7	Very low	62.8	Low	160 Å²	160	66.2 Å²	66.2	86%	0.856	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	43.6	-179.2	-61.9	-80.2	0	0	0	114.5	S252 E253	S252-N256 PolarHBondContact O-N 2.96Å; E253-N256 PolarHBondContact O-N 2.65Å
257	M	60.3	Low	62.6	Low	83 Å²	83	67.1 Å²	67.1	41%	0.409	34%	0.339	S	S	.	.			trans	-113.7	160	173.4	-55.1	-173.3	171.4	0	0	110.7	S252 V255 R261 K262	S252-M257 CarbonylContact C-O 3.53Å; S252-M257 VanDerWaalsContact CB-O 3.28Å; S252-M257 WeakPolarHBondContact CB-O 3.01Å; S252-M257 PolarHBondContact O-N 3.08Å; V255-M257 HydrophobicContact CG1-CE 4.26Å; V255-M257 PolarHBondContact O-N 2.74Å; M257-R261 HydrophobicContact CB-CB 3.78Å; M257-R261 HydrophobicContact SD-CB 4.3Å; M257-K262 HydrophobicContact SD-CB 4.32Å
258	K	65.1	Low	63.2	Low	132 Å²	132	68.9 Å²	68.9	57%	0.574	34%	0.34	S	S	*	.			trans	-64.3	153.3	172.4	-58.4	-169.8	-165.1	162.2	0	110.8	S252 R261	S252-K258 WeakPolarHBondContact CB-O 3.19Å; S252-K258 PolarHBondContact OG-O 2.8Å; S252-K258 VanDerWaalsContact OG-O 3.09Å; K258-R261 HydrophobicContact CB-CG 4.38Å; K258-R261 WeakPolarHBondContact O-CB 3.36Å; K258-R261 WeakPolarHBondContact O-CG 3.19Å; K258-R261 PolarHBondContact O-N 3.4Å; K258-R261 VanDerWaalsContact O-N 3.11Å
259	P	68.3	Low	63.6	Low	93 Å²	93	69.3 Å²	69.3	60%	0.604	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	145	174.5	-28.1	35.6	0	0	0	112.8	R261	P259-R261 VanDerWaalsContact C-N 3.28Å; P259-R261 PolarHBondContact O-N 2.91Å
260	G	74.3	Confident	63.9	Low	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	18.3	-173.7	0	0	0	0	0	114.8	D228 A231 D250 S252	D228-G260 WeakPolarHBondContact CB-O 3.41Å; D228-G260 PolarHBondContact N-O 3.03Å; A231-G260 WeakPolarHBondContact CB-O 3.25Å; D250-G260 PolarHBondContact OD2-N 2.6Å; S252-G260 PolarHBondContact OG-N 2.93Å
261	R	81.1	Confident	63.9	Low	49 Å²	49	71.2 Å²	71.2	19%	0.185	37%	0.366	C	S	.	.	S	Bend	trans	-117.2	-8.2	175.2	-61.4	-171.8	-176.9	175.4	-0.1	114.7	D226 S252 M257 K258 P259	D226-R261 PolarHBondContact O-NE 3.37Å; D226-R261 IonicContact OD1-CZ 2.85Å; D226-R261 VanDerWaalsContact OD1-CZ 3.25Å; D226-R261 IonicContact OD1-NE 3.81Å; D226-R261 IonicContact OD1-NH2 3.64Å; D226-R261 PolarHBondContact OD1-NH2 3.07Å; D226-R261 IonicContact OD2-CZ 3.57Å; D226-R261 IonicContact OD2-NE 3.46Å; D226-R261 PolarHBondContact OD2-NE 3.33Å; D226-R261 IonicContact OD2-NH1 3.21Å; D226-R261 PolarHBondContact OD2-NH1 2.66Å; D226-R261 IonicContact OD2-NH2 3.54Å; D226-R261 PolarHBondContact OD2-NH2 2.91Å; S252-R261 PolarHBondContact OG-N 3.09Å; S252-R261 VanDerWaalsContact OG-N 3.12Å; M257-R261 HydrophobicContact CB-CB 3.78Å; M257-R261 HydrophobicContact SD-CB 4.3Å; K258-R261 HydrophobicContact CB-CG 4.38Å; K258-R261 WeakPolarHBondContact O-CB 3.36Å; K258-R261 WeakPolarHBondContact O-CG 3.19Å; K258-R261 PolarHBondContact O-N 3.4Å; K258-R261 VanDerWaalsContact O-N 3.11Å; P259-R261 VanDerWaalsContact C-N 3.28Å; P259-R261 PolarHBondContact O-N 2.91Å
262	K	69.5	Low	63.7	Low	89 Å²	89	73.5 Å²	73.5	39%	0.387	38%	0.378	S	S	.	.			trans	-152.2	145.4	162.3	-158.6	71.2	177.5	-178.5	0	110.1	D228 C244 T251 S252 V255 M257	D228-K262 WeakPolarHBondContact OD2-CA 2.94Å; C244-K262 PolarHBondContact SG-O 2.88Å; T251-K262 CarbonylContact C-O 3.59Å; T251-K262 PolarHBondContact N-O 3.08Å; S252-K262 PolarHBondContact N-O 3.47Å; S252-K262 PolarHBondContact OG-N 2.86Å; S252-K262 PolarHBondContact OG-O 2.94Å; V255-K262 HydrophobicContact CG2-CG 4.17Å; M257-K262 HydrophobicContact SD-CB 4.32Å
263	C	69.6	Low	63.4	Low	3 Å²	3	78.4 Å²	78.4	2%	0.02	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	173.1	174	-2.9	0	0	0	0	108.1	N230 C244 F248 V249 T251 K2237	N230-C263 PolarHBondContact O-SG 2.92Å; N230-C263 VanDerWaalsContact O-SG 3.33Å; C244-C263 HydrophobicContact CB-CB 4.07Å; C244-C263 WeakPolarHBondContact CB-SG 3.13Å; C244-C263 WeakPolarHBondContact SG-CB 3.41Å; C244-C263 CovalentContact SG-SG 2.05Å; C244-C263 PolarHBondContact SG-SG 2.14Å; F248-C263 HydrophobicContact CB-CB 3.83Å; F248-C263 HydrophobicContact CD1-CB 3.72Å; F248-C263 HydrophobicContact CG-CB 4.2Å; V249-C263 CarbonylContact O-C 3.57Å; V249-C263 WeakPolarHBondContact O-CA 3.29Å; V249-C263 WeakPolarHBondContact O-CB 3.26Å; T251-C263 WeakPolarHBondContact OG1-CA 3.23Å; T251-C263 PolarHBondContact OG1-N 3.1Å; T251-C263 PolarHBondContact OG1-O 3.25Å; C263-K2237 VanDerWaalsContact C-CD 3.47Å; C263-K2237 HydrophobicContact CB-CD 3.97Å; C263-K2237 WeakPolarHBondContact O-CD 3.05Å; C263-K2237 WeakPolarHBondContact O-CE 3.4Å; C263-K2237 PolarHBondContact SG-NZ 3.5Å
264	S	60.9	Low	63.7	Low	35 Å²	35	79.1 Å²	79.1	25%	0.245	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	163.8	-177.5	45.3	0	0	0	0	113.8	F248 V249 T251 K2237	F248-S264 WeakPolarHBondContact CA-O 3.41Å; V249-S264 PolarHBondContact N-O 3.07Å; V249-S264 VanDerWaalsContact N-O 3.08Å; V249-S264 PolarHBondContact O-N 2.69Å; T251-S264 WeakPolarHBondContact CG2-OG 3.32Å; T251-S264 PolarHBondContact OG1-OG 3.06Å; S264-K2237 CarbonylContact C-O 3.19Å
265	K	57.1	Low	64.1	Low	69 Å²	69	75.1 Å²	75.1	30%	0.3	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	125.5	-174.7	-75.7	-176.5	140.8	144.3	0	112.7	I267 R2236 K2237 S2238 P2239 V2240	K265-I267 HydrophobicContact CB-CD1 4.47Å; K265-I267 HydrophobicContact CB-CG1 4.17Å; K265-I267 PolarHBondContact O-N 3.07Å; K265-R2236 VanDerWaalsContact CE-O 3.26Å; K265-R2236 WeakPolarHBondContact CE-O 3.42Å; K265-R2236 PolarHBondContact NZ-O 3.12Å; K265-K2237 WeakPolarHBondContact CA-O 3.19Å; K265-K2237 HydrophobicContact CG-CB 4.09Å; K265-K2237 WeakPolarHBondContact CG-O 3.44Å; K265-K2237 PolarHBondContact N-O 3.37Å; K265-K2237 VanDerWaalsContact N-O 3.12Å; K265-S2238 WeakPolarHBondContact CE-O 3.25Å; K265-P2239 HydrophobicContact CB-CB 4.41Å; K265-V2240 HydrophobicContact CD-CG2 3.86Å; K265-V2240 VanDerWaalsContact NZ-CG2 3.33Å
266	E	57.7	Low	65	Low	99 Å²	99	72.4 Å²	72.4	46%	0.463	39%	0.386	S	S	.	.			trans	-85.1	73.7	174.5	-170.8	170.2	-140	0	0	110.7	V249 P2239	V249-E266 HydrophobicContact CG2-CB 4.39Å; E266-P2239 HydrophobicContact CB-CG 4.39Å; E266-P2239 WeakPolarHBondContact O-CB 3.48Å; E266-P2239 VanDerWaalsContact O-CG 3.22Å; E266-P2239 WeakPolarHBondContact O-CG 3.39Å
267	I	53.1	Low	66.2	Low	42 Å²	42	68.6 Å²	68.6	22%	0.215	37%	0.365	C	S	.	.			trans	-85.9	129.1	176.3	-57.5	177.4	0	0	0	107.9	K265 E269 L275 P2239	K265-I267 HydrophobicContact CB-CD1 4.47Å; K265-I267 HydrophobicContact CB-CG1 4.17Å; K265-I267 PolarHBondContact O-N 3.07Å; I267-E269 HydrophobicContact CB-CG 4.42Å; I267-E269 HydrophobicContact CG2-CG 3.92Å; I267-E269 VanDerWaalsContact O-CD 3.28Å; I267-E269 PolarHBondContact O-N 2.99Å; I267-E269 VanDerWaalsContact O-OE2 3.04Å; I267-L275 HydrophobicContact CG2-CD1 3.98Å; I267-P2239 HydrophobicContact CG1-CB 3.91Å
268	N	62.7	Low	67.2	Low	69 Å²	69	65.4 Å²	65.4	37%	0.369	35%	0.351	S	S	.	.			trans	-81.4	99.7	160.3	175.4	-51.7	0	0	0	107.3	C270 A271 D286	N268-C270 VanDerWaalsContact C-N 3.29Å; N268-C270 PolarHBondContact OD1-N 3.31Å; N268-C270 VanDerWaalsContact OD1-N 3.13Å; N268-A271 WeakPolarHBondContact OD1-CB 3.4Å; N268-A271 PolarHBondContact OD1-N 3.08Å; N268-D286 PolarHBondContact ND2-OD2 2.85Å
269	E	74.2	Confident	67.9	Low	31 Å²	31	61.4 Å²	61.4	15%	0.145	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-75.4	-20.3	-180	-62.6	90.2	173.7	0	0	112.8	I267 A271 D272 L275 N276 G290 Y291	I267-E269 HydrophobicContact CB-CG 4.42Å; I267-E269 HydrophobicContact CG2-CG 3.92Å; I267-E269 VanDerWaalsContact O-CD 3.28Å; I267-E269 PolarHBondContact O-N 2.99Å; I267-E269 VanDerWaalsContact O-OE2 3.04Å; E269-A271 PolarHBondContact O-N 3.1Å; E269-D272 PolarHBondContact O-N 2.99Å; E269-L275 HydrophobicContact CB-CB 3.79Å; E269-L275 HydrophobicContact CG-CB 3.97Å; E269-N276 HydrophobicContact CB-CB 4.12Å; E269-N276 WeakPolarHBondContact O-CB 3.2Å; E269-N276 PolarHBondContact O-N 2.05Å; E269-N276 PolarHBondContact O-ND2 3.27Å; E269-G290 WeakPolarHBondContact OE2-CA 2.96Å; E269-Y291 HydrophobicContact CB-CD1 3.37Å; E269-Y291 HydrophobicContact CB-CE1 3.76Å; E269-Y291 HydrophobicContact CB-CG 3.92Å; E269-Y291 VanDerWaalsContact CD-CD1 3.49Å; E269-Y291 HydrophobicContact CG-CD1 3.55Å; E269-Y291 HydrophobicContact CG-CE1 3.73Å; E269-Y291 VanDerWaalsContact OE2-CD1 3.28Å; E269-Y291 WeakPolarHBondContact OE2-CD1 3.5Å; E269-Y291 PolarHBondContact OE2-N 3.11Å
270	C	74.6	Confident	68.2	Low	37 Å²	37	62.5 Å²	62.5	25%	0.25	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-65.7	-19.7	178.9	-63.6	0	0	0	0	114.2	N268 C284 V285	N268-C270 VanDerWaalsContact C-N 3.29Å; N268-C270 PolarHBondContact OD1-N 3.31Å; N268-C270 VanDerWaalsContact OD1-N 3.13Å; C270-C284 WeakPolarHBondContact CA-SG 3.33Å; C270-C284 HydrophobicContact CB-CB 3.65Å; C270-C284 WeakPolarHBondContact CB-SG 3.32Å; C270-C284 WeakPolarHBondContact SG-CB 3.45Å; C270-C284 CovalentContact SG-SG 2.04Å; C270-C284 PolarHBondContact SG-SG 2.83Å; C270-V285 PolarHBondContact SG-N 3.26Å; C270-V285 VanDerWaalsContact SG-N 3.39Å
271	A	71.4	Confident	68.2	Low	89 Å²	89	64.5 Å²	64.5	74%	0.736	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-74.1	-20.1	178.6	0	0	0	0	0	114.7	N268 E269	N268-A271 WeakPolarHBondContact OD1-CB 3.4Å; N268-A271 PolarHBondContact OD1-N 3.08Å; E269-A271 PolarHBondContact O-N 3.1Å
272	D	59.8	Low	68	Low	62 Å²	62	62.8 Å²	62.8	33%	0.332	35%	0.348	S	S	.	.	S	Bend	trans	-135.2	122.4	175	-175.9	-9.8	0	0	0	110	E269 K274 L275 N276	E269-D272 PolarHBondContact O-N 2.99Å; D272-K274 PolarHBondContact O-N 2.95Å; D272-K274 WeakPolarHBondContact OD1-CB 3.47Å; D272-K274 WeakPolarHBondContact OD1-CG 3.45Å; D272-K274 PolarHBondContact OD1-N 3.27Å; D272-L275 HydrophobicContact CB-CB 4.44Å; D272-L275 HydrophobicContact CB-CD1 4.03Å; D272-L275 HydrophobicContact CB-CG 4.06Å; D272-L275 PolarHBondContact O-N 2.81Å; D272-N276 PolarHBondContact O-N 3.08Å; D272-N276 PolarHBondContact O-ND2 3.27Å
273	S	62.3	Low	68.5	Low	104 Å²	104	61.1 Å²	61.1	73%	0.727	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	10.8	176.9	54.6	0	0	0	0	114.9	N276	S273-N276 CarbonylContact C-O 3.58Å
274	K	62.3	Low	68.9	Low	180 Å²	180	62.5 Å²	62.5	78%	0.783	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-19.1	163.6	-60.5	169	-172.6	162.3	0	113.6	D272	D272-K274 PolarHBondContact O-N 2.95Å; D272-K274 WeakPolarHBondContact OD1-CB 3.47Å; D272-K274 WeakPolarHBondContact OD1-CG 3.45Å; D272-K274 PolarHBondContact OD1-N 3.27Å
275	L	66.1	Low	69.4	Low	79 Å²	79	64 Å²	64	41%	0.414	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-38.7	177.9	-64.2	177.5	0	0	0	110.5	I267 E269 D272 Y291	I267-L275 HydrophobicContact CG2-CD1 3.98Å; E269-L275 HydrophobicContact CB-CB 3.79Å; E269-L275 HydrophobicContact CG-CB 3.97Å; D272-L275 HydrophobicContact CB-CB 4.44Å; D272-L275 HydrophobicContact CB-CD1 4.03Å; D272-L275 HydrophobicContact CB-CG 4.06Å; D272-L275 PolarHBondContact O-N 2.81Å; L275-Y291 PolarHBondContact O-OH 3.4Å
276	N	68	Low	69.6	Low	16 Å²	16	64.3 Å²	64.3	9%	0.086	37%	0.369	C	S	.	.			trans	-90.7	135.7	165.6	73.1	93	0	0	0	111.1	E269 D272 S273 C278 Y291	E269-N276 HydrophobicContact CB-CB 4.12Å; E269-N276 WeakPolarHBondContact O-CB 3.2Å; E269-N276 PolarHBondContact O-N 2.05Å; E269-N276 PolarHBondContact O-ND2 3.27Å; D272-N276 PolarHBondContact O-N 3.08Å; D272-N276 PolarHBondContact O-ND2 3.27Å; S273-N276 CarbonylContact C-O 3.58Å; N276-C278 VanDerWaalsContact C-N 3.3Å; N276-C278 VanDerWaalsContact OD1-CB 3.25Å; N276-C278 WeakPolarHBondContact OD1-CB 3.48Å; N276-C278 PolarHBondContact OD1-N 2.76Å; N276-C278 PolarHBondContact OD1-SG 2.79Å; N276-Y291 HydrophobicContact CB-CD2 3.64Å; N276-Y291 HydrophobicContact CB-CE2 3.63Å; N276-Y291 HydrophobicContact CB-CG 4.09Å
277	D	72.1	Confident	69.6	Low	79 Å²	79	62.8 Å²	62.8	42%	0.422	37%	0.367	S	S	.	.			trans	-97.9	30.4	167.9	66.6	-5	0	0	0	111.6	Y291 R312	D277-Y291 PolarHBondContact N-OH 3.16Å; D277-Y291 VanDerWaalsContact N-OH 3.16Å; D277-Y291 VanDerWaalsContact OD1-CE2 3.32Å; D277-Y291 WeakPolarHBondContact OD1-CE2 3.24Å; D277-Y291 PolarHBondContact OD1-OH 2.98Å; D277-R312 WeakPolarHBondContact O-CA 3.49Å; D277-R312 WeakPolarHBondContact O-CB 3.41Å; D277-R312 WeakPolarHBondContact OD1-CD 3.01Å; D277-R312 WeakPolarHBondContact OD1-CG 3.04Å; D277-R312 IonicContact OD1-CZ 2.83Å; D277-R312 IonicContact OD1-NE 2.89Å; D277-R312 PolarHBondContact OD1-NE 2.04Å; D277-R312 IonicContact OD1-NH1 2.67Å; D277-R312 PolarHBondContact OD1-NH1 3.48Å; D277-R312 IonicContact OD1-NH2 3.84Å; D277-R312 WeakPolarHBondContact OD2-CD 3.44Å; D277-R312 IonicContact OD2-CZ 2.75Å; D277-R312 IonicContact OD2-NE 2.63Å; D277-R312 IonicContact OD2-NH1 3.18Å; D277-R312 PolarHBondContact OD2-NH1 2.76Å
278	C	80.8	Confident	69.5	Low	17 Å²	17	68.4 Å²	68.4	12%	0.115	39%	0.39	C	S	.	.			trans	-61.8	138.6	170.4	-58.7	0	0	0	0	109.8	N276 A282 C284 C293	N276-C278 VanDerWaalsContact C-N 3.3Å; N276-C278 VanDerWaalsContact OD1-CB 3.25Å; N276-C278 WeakPolarHBondContact OD1-CB 3.48Å; N276-C278 PolarHBondContact OD1-N 2.76Å; N276-C278 PolarHBondContact OD1-SG 2.79Å; C278-A282 HydrophobicContact CB-CB 4.24Å; C278-C284 HydrophobicContact CB-CB 4.35Å; C278-C284 WeakPolarHBondContact SG-CB 3.43Å; C278-C284 PolarHBondContact SG-SG 2.72Å; C278-C293 WeakPolarHBondContact CA-SG 3.15Å; C278-C293 HydrophobicContact CB-CB 3.59Å; C278-C293 WeakPolarHBondContact CB-SG 3.31Å; C278-C293 WeakPolarHBondContact SG-CB 3.43Å; C278-C293 CovalentContact SG-SG 2.02Å; C278-C293 PolarHBondContact SG-SG 2.99Å
279	H	79.7	Confident	69.5	Low	48 Å²	48	69.2 Å²	69.2	22%	0.222	39%	0.394	C	S	.	.			trans	-59.6	148.8	177.5	-160.2	-113.1	0	0	0	110.1	N281 A282 G311 R312 D313 C314	H279-N281 PolarHBondContact CE1-ND2 3.02Å; H279-N281 PolarHBondContact ND1-N 3.39Å; H279-N281 PolarHBondContact ND1-ND2 2.03Å; H279-N281 PolarHBondContact O-N 2.91Å; H279-A282 HydrophobicContact CB-CB 4.24Å; H279-A282 WeakPolarHBondContact O-CB 3.25Å; H279-A282 PolarHBondContact O-N 3.46Å; H279-G311 PolarHBondContact N-O 3.12Å; H279-R312 WeakPolarHBondContact CB-O 3.48Å; H279-R312 PolarHBondContact N-O 2.92Å; H279-D313 IonicContact CD2-OD1 2.67Å; H279-D313 IonicContact NE2-OD1 3.18Å; H279-C314 HydrophobicContact CB-CB 3.71Å; H279-C314 PolarHBondContact CE1-O 3.03Å; H279-C314 PolarHBondContact ND1-N 2.88Å; H279-C314 PolarHBondContact ND1-O 3.34Å
280	P	74.3	Confident	69.1	Low	116 Å²	116	68.2 Å²	68.2	75%	0.753	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-19	173.2	-28.7	36.8	0	0	0	114.3
281	N	74.7	Confident	69.1	Low	42 Å²	42	68.7 Å²	68.7	23%	0.225	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	24.5	173.5	-44.6	-46.9	0	0	0	113.3	H279 H296 Y299 C314	H279-N281 PolarHBondContact CE1-ND2 3.02Å; H279-N281 PolarHBondContact ND1-N 3.39Å; H279-N281 PolarHBondContact ND1-ND2 2.03Å; H279-N281 PolarHBondContact O-N 2.91Å; N281-H296 PolarHBondContact O-N 2.99Å; N281-H296 PolarHBondContact O-ND1 2.84Å; N281-Y299 HydrophobicContact CB-CD1 3.23Å; N281-Y299 HydrophobicContact CB-CD2 4.11Å; N281-Y299 HydrophobicContact CB-CE1 3.4Å; N281-Y299 HydrophobicContact CB-CE2 4.24Å; N281-Y299 HydrophobicContact CB-CG 3.62Å; N281-Y299 WeakPolarHBondContact ND2-CD1 3.38Å; N281-Y299 WeakPolarHBondContact ND2-CE1 3.06Å; N281-Y299 WeakPolarHBondContact OD1-CE1 2.99Å; N281-C314 HydrophobicContact CB-CB 4.02Å; N281-C314 PolarHBondContact ND2-O 2.98Å
282	A	77.7	Confident	69.3	Low	13 Å²	13	67 Å²	67	11%	0.107	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	147.9	172.3	0	0	0	0	0	111.9	C278 H279 C293 R294 H296 G311	C278-A282 HydrophobicContact CB-CB 4.24Å; H279-A282 HydrophobicContact CB-CB 4.24Å; H279-A282 WeakPolarHBondContact O-CB 3.25Å; H279-A282 PolarHBondContact O-N 3.46Å; A282-C293 HydrophobicContact CB-CB 4.2Å; A282-R294 CarbonylContact C-O 3.58Å; A282-R294 VanDerWaalsContact CA-O 3.24Å; A282-R294 WeakPolarHBondContact CA-O 3.45Å; A282-H296 WeakPolarHBondContact CA-ND1 3.11Å; A282-H296 PolarHBondContact N-ND1 2.95Å; A282-H296 PolarHBondContact O-CE1 3.15Å; A282-G311 WeakPolarHBondContact CB-O 3.33Å
283	S	78.5	Confident	70.2	Confident	54 Å²	54	64.2 Å²	64.2	38%	0.378	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	125.8	159.4	161.8	0	0	0	0	107.8	C293 R294	S283-C293 CarbonylContact O-C 3.4Å; S283-C293 WeakPolarHBondContact O-CA 3.46Å; S283-R294 PolarHBondContact N-O 3.49Å; S283-R294 PolarHBondContact O-N 3.44Å
284	C	78.6	Confident	70.7	Confident	31 Å²	31	68.2 Å²	68.2	21%	0.209	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	139	161.1	-167.2	0	0	0	0	108.8	C270 C278	C270-C284 WeakPolarHBondContact CA-SG 3.33Å; C270-C284 HydrophobicContact CB-CB 3.65Å; C270-C284 WeakPolarHBondContact CB-SG 3.32Å; C270-C284 WeakPolarHBondContact SG-CB 3.45Å; C270-C284 CovalentContact SG-SG 2.04Å; C270-C284 PolarHBondContact SG-SG 2.83Å; C278-C284 HydrophobicContact CB-CB 4.35Å; C278-C284 WeakPolarHBondContact SG-CB 3.43Å; C278-C284 PolarHBondContact SG-SG 2.72Å
285	V	71.9	Confident	71.4	Confident	68 Å²	68	60.6 Å²	60.6	41%	0.412	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.3	175.2	-177.1	0	0	0	0	108.1	C270 T292	C270-V285 PolarHBondContact SG-N 3.26Å; C270-V285 VanDerWaalsContact SG-N 3.39Å; V285-T292 HydrophobicContact CB-CG2 3.99Å; V285-T292 HydrophobicContact CG1-CG2 4.48Å; V285-T292 PolarHBondContact N-O 3.3Å; V285-T292 PolarHBondContact O-N 3.09Å; V285-T292 VanDerWaalsContact O-O 3.11Å
286	D	61.3	Low	71.6	Confident	74 Å²	74	61.3 Å²	61.3	40%	0.396	32%	0.324	S	S	.	.			trans	-76.9	144.8	-175.6	-165.6	32.9	0	0	0	111.7	N268	N268-D286 PolarHBondContact ND2-OD2 2.85Å
287	T	58.5	Low	71.5	Confident	68 Å²	68	68 Å²	68	42%	0.417	37%	0.365	S	S	.	.			trans	-143	162.1	177.5	97.1	0	0	0	0	111.3	I289 G290 T292	T287-I289 PolarHBondContact O-N 3.48Å; T287-G290 CarbonylContact C-O 3.48Å; T287-G290 WeakPolarHBondContact CA-O 3.49Å; T287-G290 WeakPolarHBondContact CB-O 3.4Å; T287-G290 WeakPolarHBondContact CG2-O 3.11Å; T287-G290 PolarHBondContact N-O 3.46Å; T287-G290 VanDerWaalsContact N-O 3.17Å; T287-G290 PolarHBondContact O-N 3.33Å; T287-G290 PolarHBondContact OG1-O 3.07Å; T287-T292 HydrophobicContact CG2-CG2 3.89Å
288	K	50.5	Low	70.3	Confident	159 Å²	159	66.7 Å²	66.7	69%	0.691	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-13.3	-172.9	-70.5	-170	173.6	-172.2	0	116.4	V249	V249-K288 VanDerWaalsContact CG2-O 3.23Å; V249-K288 WeakPolarHBondContact CG2-O 3.19Å
289	I	61.6	Low	69.7	Low	87 Å²	87	69.4 Å²	69.4	45%	0.446	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.2	20.7	-178	-43	-177.1	0	0	0	110.2	V249 Y254 T287	V249-I289 HydrophobicContact CG1-CG1 4.44Å; Y254-I289 HydrophobicContact CD2-CD1 4.49Å; Y254-I289 HydrophobicContact CE2-CD1 3.51Å; Y254-I289 VanDerWaalsContact OH-CD1 3.3Å; Y254-I289 WeakPolarHBondContact OH-CD1 3.44Å; T287-I289 PolarHBondContact O-N 3.48Å
290	G	66.7	Low	68.8	Low	10 Å²	10	68.9 Å²	68.9	10%	0.103	38%	0.377	C	S	.	.	S	Bend	trans	118.9	-179.2	-178.5	0	0	0	0	0	113.2	E269 T287	E269-G290 WeakPolarHBondContact OE2-CA 2.96Å; T287-G290 CarbonylContact C-O 3.48Å; T287-G290 WeakPolarHBondContact CA-O 3.49Å; T287-G290 WeakPolarHBondContact CB-O 3.4Å; T287-G290 WeakPolarHBondContact CG2-O 3.11Å; T287-G290 PolarHBondContact N-O 3.46Å; T287-G290 VanDerWaalsContact N-O 3.17Å; T287-G290 PolarHBondContact O-N 3.33Å; T287-G290 PolarHBondContact OG1-O 3.07Å
291	Y	73.9	Confident	68.3	Low	46 Å²	46	64.6 Å²	64.6	18%	0.18	35%	0.348	C	S	.	.			trans	-77	154.6	-174.8	67	-69.5	0	0	0	117.8	E269 L275 N276 D277	E269-Y291 HydrophobicContact CB-CD1 3.37Å; E269-Y291 HydrophobicContact CB-CE1 3.76Å; E269-Y291 HydrophobicContact CB-CG 3.92Å; E269-Y291 VanDerWaalsContact CD-CD1 3.49Å; E269-Y291 HydrophobicContact CG-CD1 3.55Å; E269-Y291 HydrophobicContact CG-CE1 3.73Å; E269-Y291 VanDerWaalsContact OE2-CD1 3.28Å; E269-Y291 WeakPolarHBondContact OE2-CD1 3.5Å; E269-Y291 PolarHBondContact OE2-N 3.11Å; L275-Y291 PolarHBondContact O-OH 3.4Å; N276-Y291 HydrophobicContact CB-CD2 3.64Å; N276-Y291 HydrophobicContact CB-CE2 3.63Å; N276-Y291 HydrophobicContact CB-CG 4.09Å; D277-Y291 PolarHBondContact N-OH 3.16Å; D277-Y291 VanDerWaalsContact N-OH 3.16Å; D277-Y291 VanDerWaalsContact OD1-CE2 3.32Å; D277-Y291 WeakPolarHBondContact OD1-CE2 3.24Å; D277-Y291 PolarHBondContact OD1-OH 2.98Å
292	T	75.1	Confident	67.8	Low	54 Å²	54	64.3 Å²	64.3	33%	0.331	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	140.7	161.4	-170.2	0	0	0	0	109.9	V285 T287 P310	V285-T292 HydrophobicContact CB-CG2 3.99Å; V285-T292 HydrophobicContact CG1-CG2 4.48Å; V285-T292 PolarHBondContact N-O 3.3Å; V285-T292 PolarHBondContact O-N 3.09Å; V285-T292 VanDerWaalsContact O-O 3.11Å; T287-T292 HydrophobicContact CG2-CG2 3.89Å; T292-P310 VanDerWaalsContact OG1-CG 3.31Å; T292-P310 WeakPolarHBondContact OG1-CG 3.44Å
293	C	80.5	Confident	67.6	Low	3 Å²	3	64 Å²	64	2%	0.02	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	155.5	-179.9	-38.9	0	0	0	0	110.9	C278 A282 S283 P310 G311	C278-C293 WeakPolarHBondContact CA-SG 3.15Å; C278-C293 HydrophobicContact CB-CB 3.59Å; C278-C293 WeakPolarHBondContact CB-SG 3.31Å; C278-C293 WeakPolarHBondContact SG-CB 3.43Å; C278-C293 CovalentContact SG-SG 2.02Å; C278-C293 PolarHBondContact SG-SG 2.99Å; A282-C293 HydrophobicContact CB-CB 4.2Å; S283-C293 CarbonylContact O-C 3.4Å; S283-C293 WeakPolarHBondContact O-CA 3.46Å; C293-P310 WeakPolarHBondContact CB-O 3.44Å; C293-P310 CarbonylContact O-C 3.52Å; C293-P310 VanDerWaalsContact O-C 3.27Å; C293-P310 VanDerWaalsContact O-CB 3.31Å; C293-P310 WeakPolarHBondContact O-CB 3.46Å; C293-P310 WeakPolarHBondContact O-CG 3.33Å; C293-G311 VanDerWaalsContact CB-C 3.46Å; C293-G311 WeakPolarHBondContact CB-O 3.5Å
294	R	73.1	Confident	66.3	Low	188 Å²	188	67.4 Å²	67.4	71%	0.709	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.3	121.5	179.7	-177.8	177.4	-176.9	144	4.1	110.7	A282 S283 H296	A282-R294 CarbonylContact C-O 3.58Å; A282-R294 VanDerWaalsContact CA-O 3.24Å; A282-R294 WeakPolarHBondContact CA-O 3.45Å; S283-R294 PolarHBondContact N-O 3.49Å; S283-R294 PolarHBondContact O-N 3.44Å; R294-H296 PolarHBondContact O-N 3.39Å
295	C	76	Confident	64.7	Low	21 Å²	21	69.3 Å²	69.3	14%	0.142	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	139.5	178.6	-57.6	0	0	0	0	112.6	D301 C314	C295-D301 WeakPolarHBondContact SG-CA 3.26Å; C295-D301 WeakPolarHBondContact SG-CB 3.31Å; C295-C314 WeakPolarHBondContact CA-SG 3.43Å; C295-C314 HydrophobicContact CB-CB 3.78Å; C295-C314 WeakPolarHBondContact CB-SG 3.46Å; C295-C314 WeakPolarHBondContact SG-CB 3.44Å; C295-C314 CovalentContact SG-SG 2.03Å; C295-C314 PolarHBondContact SG-SG 2.94Å
296	H	71	Confident	64	Low	94 Å²	94	68.2 Å²	68.2	44%	0.435	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-63.2	152.9	172	-73.1	88.1	0	0	0	110.5	N281 A282 R294 G298 Y299	N281-H296 PolarHBondContact O-N 2.99Å; N281-H296 PolarHBondContact O-ND1 2.84Å; A282-H296 WeakPolarHBondContact CA-ND1 3.11Å; A282-H296 PolarHBondContact N-ND1 2.95Å; A282-H296 PolarHBondContact O-CE1 3.15Å; R294-H296 PolarHBondContact O-N 3.39Å; H296-G298 PolarHBondContact O-N 2.96Å; H296-G298 VanDerWaalsContact O-N 3.16Å; H296-Y299 HydrophobicContact CB-CD2 3.85Å; H296-Y299 HydrophobicContact CB-CE2 4.21Å; H296-Y299 PolarHBondContact O-N 2.9Å
297	V	66	Low	63.5	Low	155 Å²	155	69 Å²	69	94%	0.939	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	120.9	-179.7	-176.4	0	0	0	0	110.3
298	G	46.9	Very low	63.3	Low	53 Å²	53	69.8 Å²	69.8	55%	0.546	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.9	-5.8	-176.1	0	0	0	0	0	115.4	H296 P317	H296-G298 PolarHBondContact O-N 2.96Å; H296-G298 VanDerWaalsContact O-N 3.16Å; G298-P317 WeakPolarHBondContact O-CD 3.44Å
299	Y	67.5	Low	64.2	Low	73 Å²	73	68.1 Å²	68.1	29%	0.286	38%	0.381	S	S	.	.			trans	-110	144.1	174	-60.5	-101.7	0	0	0	110.2	N281 H296 I315 L316	N281-Y299 HydrophobicContact CB-CD1 3.23Å; N281-Y299 HydrophobicContact CB-CD2 4.11Å; N281-Y299 HydrophobicContact CB-CE1 3.4Å; N281-Y299 HydrophobicContact CB-CE2 4.24Å; N281-Y299 HydrophobicContact CB-CG 3.62Å; N281-Y299 WeakPolarHBondContact ND2-CD1 3.38Å; N281-Y299 WeakPolarHBondContact ND2-CE1 3.06Å; N281-Y299 WeakPolarHBondContact OD1-CE1 2.99Å; H296-Y299 HydrophobicContact CB-CD2 3.85Å; H296-Y299 HydrophobicContact CB-CE2 4.21Å; H296-Y299 PolarHBondContact O-N 2.9Å; Y299-I315 CarbonylContact C-O 3.58Å; Y299-I315 WeakPolarHBondContact CA-O 3.32Å; Y299-L316 HydrophobicContact CD1-CB 3.55Å; Y299-L316 HydrophobicContact CD1-CD1 4.41Å; Y299-L316 HydrophobicContact CD1-CG 3.73Å; Y299-L316 VanDerWaalsContact CD1-N 3.33Å; Y299-L316 HydrophobicContact CE1-CB 3.4Å; Y299-L316 VanDerWaalsContact CE1-CB 3.4Å; Y299-L316 HydrophobicContact CE1-CD1 3.54Å; Y299-L316 HydrophobicContact CE1-CG 3.34Å; Y299-L316 HydrophobicContact CE2-CG 4.38Å; Y299-L316 HydrophobicContact CG-CG 4.4Å; Y299-L316 WeakPolarHBondContact OH-CD1 3.3Å
300	I	61.2	Low	64.7	Low	37 Å²	37	65.3 Å²	65.3	19%	0.19	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.6	-174.3	-27.6	-179.5	0	0	0	110.5	V302 C314 I315 P317 V367 I387	I300-V302 PolarHBondContact O-N 2.05Å; I300-C314 WeakPolarHBondContact O-CA 3.34Å; I300-I315 HydrophobicContact CB-CG1 4.47Å; I300-I315 PolarHBondContact N-O 2.84Å; I300-I315 PolarHBondContact O-N 3.35Å; I300-I315 VanDerWaalsContact O-N 3.11Å; I300-P317 HydrophobicContact CD1-CB 4.24Å; I300-P317 HydrophobicContact CD1-CG 4.23Å; I300-P317 HydrophobicContact CG1-CG 4.46Å; I300-V367 HydrophobicContact CD1-CG1 3.52Å; I300-I387 HydrophobicContact CB-CD1 4.09Å; I300-I387 HydrophobicContact CG2-CD1 3.42Å; I300-I387 VanDerWaalsContact CG2-CD1 3.42Å; I300-I387 HydrophobicContact CG2-CG1 4.32Å
301	D	63.6	Low	65.2	Low	27 Å²	27	64.8 Å²	64.8	14%	0.144	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	95.9	-175.5	-159.6	-23.8	0	0	0	111.7	C295 S303 V306 G311 I387	C295-D301 WeakPolarHBondContact SG-CA 3.26Å; C295-D301 WeakPolarHBondContact SG-CB 3.31Å; D301-S303 VanDerWaalsContact C-N 3.34Å; D301-S303 WeakPolarHBondContact OD1-CB 3.09Å; D301-S303 PolarHBondContact OD1-N 3.1Å; D301-S303 PolarHBondContact OD1-OG 3.05Å; D301-V306 HydrophobicContact CB-CG1 4.36Å; D301-V306 HydrophobicContact CB-CG2 4.44Å; D301-G311 VanDerWaalsContact CG-N 3.3Å; D301-G311 PolarHBondContact OD1-N 3.28Å; D301-G311 VanDerWaalsContact OD1-N 3.14Å; D301-G311 PolarHBondContact OD2-N 2.75Å; D301-I387 WeakPolarHBondContact O-CD1 3.13Å
302	V	64.5	Low	65.6	Low	36 Å²	36	65.6 Å²	65.6	22%	0.218	37%	0.366	C	S	.	.			trans	-93.5	9.1	177.3	-82.4	0	0	0	0	112.5	I300 D313 I315 I387	I300-V302 PolarHBondContact O-N 2.05Å; V302-D313 HydrophobicContact CG2-CB 3.81Å; V302-D313 WeakPolarHBondContact CG2-O 3.47Å; V302-D313 WeakPolarHBondContact CG2-OD1 3.28Å; V302-D313 PolarHBondContact N-O 2.95Å; V302-I315 HydrophobicContact CG1-CD1 3.77Å; V302-I315 HydrophobicContact CG1-CG1 4.14Å; V302-I315 HydrophobicContact CG2-CB 4.45Å; V302-I315 HydrophobicContact CG2-CD1 4.23Å; V302-I315 HydrophobicContact CG2-CG1 3.97Å; V302-I315 HydrophobicContact CG2-CG2 3.91Å; V302-I387 HydrophobicContact CB-CD1 4.32Å; V302-I387 HydrophobicContact CG1-CB 4.47Å; V302-I387 HydrophobicContact CG1-CD1 3.41Å; V302-I387 VanDerWaalsContact CG1-CD1 3.41Å; V302-I387 HydrophobicContact CG1-CG1 3.67Å
303	S	72.2	Confident	65.4	Low	5 Å²	5	66 Å²	66	4%	0.035	37%	0.367	C	S	.	.			trans	-55.3	139.8	-175	-50.5	0	0	0	0	112.4	D301 N305 V306 Y309 G311 R312 D313	D301-S303 VanDerWaalsContact C-N 3.34Å; D301-S303 WeakPolarHBondContact OD1-CB 3.09Å; D301-S303 PolarHBondContact OD1-N 3.1Å; D301-S303 PolarHBondContact OD1-OG 3.05Å; S303-N305 PolarHBondContact O-N 3.49Å; S303-V306 PolarHBondContact O-N 3.05Å; S303-Y309 WeakPolarHBondContact CB-O 3.35Å; S303-Y309 PolarHBondContact OG-O 3.1Å; S303-G311 PolarHBondContact OG-N 3.28Å; S303-R312 PolarHBondContact OG-N 3.38Å; S303-D313 PolarHBondContact OG-N 2.85Å
304	P	52.6	Low	65.1	Low	127 Å²	127	65.9 Å²	65.9	83%	0.825	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-18.2	-168.6	-30.4	35.9	0	0	0	117.1
305	N	44.4	Very low	64.4	Low	70 Å²	70	59.9 Å²	59.9	37%	0.374	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.7	88.5	165.8	179	1.7	0	0	0	109.5	S303 A307 C308 Y309	S303-N305 PolarHBondContact O-N 3.49Å; N305-A307 PolarHBondContact O-N 3.06Å; N305-A307 PolarHBondContact OD1-N 3.35Å; N305-C308 PolarHBondContact ND2-SG 2.95Å; N305-C308 PolarHBondContact O-N 3.42Å; N305-Y309 HydrophobicContact CB-CD2 4.17Å; N305-Y309 CarbonylContact O-C 3.58Å; N305-Y309 WeakPolarHBondContact O-CA 3.16Å; N305-Y309 PolarHBondContact O-N 3.17Å
306	V	57.8	Low	63.4	Low	46 Å²	46	62.7 Å²	62.7	28%	0.279	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-23.9	-178	-174.7	0	0	0	0	113.6	D301 S303 P310 L386	D301-V306 HydrophobicContact CB-CG1 4.36Å; D301-V306 HydrophobicContact CB-CG2 4.44Å; S303-V306 PolarHBondContact O-N 3.05Å; V306-P310 HydrophobicContact CG1-CB 4.41Å; V306-P310 WeakPolarHBondContact O-CB 3.42Å; V306-P310 WeakPolarHBondContact O-CD 3.08Å; V306-L386 HydrophobicContact CG1-CD2 4.15Å
307	A	50.1	Low	62.1	Low	91 Å²	91	61.4 Å²	61.4	75%	0.752	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-14.3	177.9	0	0	0	0	0	114.9	N305	N305-A307 PolarHBondContact O-N 3.06Å; N305-A307 PolarHBondContact OD1-N 3.35Å
308	C	54	Low	60.4	Low	84 Å²	84	62.1 Å²	62.1	57%	0.568	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	-21.9	179.8	-58.4	0	0	0	0	113.4	N305	N305-C308 PolarHBondContact ND2-SG 2.95Å; N305-C308 PolarHBondContact O-N 3.42Å
309	Y	69.8	Low	59.7	Low	123 Å²	123	65.6 Å²	65.6	48%	0.482	36%	0.364	S	S	.	.	S	Bend	trans	-139.9	52.2	-175.7	-59.1	-50.3	0	0	0	110.5	S303 N305	S303-Y309 WeakPolarHBondContact CB-O 3.35Å; S303-Y309 PolarHBondContact OG-O 3.1Å; N305-Y309 HydrophobicContact CB-CD2 4.17Å; N305-Y309 CarbonylContact O-C 3.58Å; N305-Y309 WeakPolarHBondContact O-CA 3.16Å; N305-Y309 PolarHBondContact O-N 3.17Å
310	P	71.4	Confident	57.8	Low	28 Å²	28	66.8 Å²	66.8	18%	0.182	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	155.1	177.2	29.7	-36.3	0	0	0	111	T292 C293 V306 R312	T292-P310 VanDerWaalsContact OG1-CG 3.31Å; T292-P310 WeakPolarHBondContact OG1-CG 3.44Å; C293-P310 WeakPolarHBondContact CB-O 3.44Å; C293-P310 CarbonylContact O-C 3.52Å; C293-P310 VanDerWaalsContact O-C 3.27Å; C293-P310 VanDerWaalsContact O-CB 3.31Å; C293-P310 WeakPolarHBondContact O-CB 3.46Å; C293-P310 WeakPolarHBondContact O-CG 3.33Å; V306-P310 HydrophobicContact CG1-CB 4.41Å; V306-P310 WeakPolarHBondContact O-CB 3.42Å; V306-P310 WeakPolarHBondContact O-CD 3.08Å; P310-R312 VanDerWaalsContact C-N 3.3Å; P310-R312 PolarHBondContact O-N 2.69Å
311	G	78.9	Confident	56.1	Low	0 Å²	0	74.5 Å²	74.5	0%	0	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	15	169.1	0	0	0	0	0	117.9	H279 A282 C293 D301 S303 C314	H279-G311 PolarHBondContact N-O 3.12Å; A282-G311 WeakPolarHBondContact CB-O 3.33Å; C293-G311 VanDerWaalsContact CB-C 3.46Å; C293-G311 WeakPolarHBondContact CB-O 3.5Å; D301-G311 VanDerWaalsContact CG-N 3.3Å; D301-G311 PolarHBondContact OD1-N 3.28Å; D301-G311 VanDerWaalsContact OD1-N 3.14Å; D301-G311 PolarHBondContact OD2-N 2.75Å; S303-G311 PolarHBondContact OG-N 3.28Å; G311-C314 VanDerWaalsContact CA-SG 3.58Å
312	R	81.1	Confident	54.8	Low	62 Å²	62	77.4 Å²	77.4	23%	0.234	44%	0.44	C	S	.	.	S	Bend	trans	-81.4	-25.2	175.4	-61	-173	-178	-140.4	-11.3	112.8	D277 H279 S303 P310	D277-R312 WeakPolarHBondContact O-CA 3.49Å; D277-R312 WeakPolarHBondContact O-CB 3.41Å; D277-R312 WeakPolarHBondContact OD1-CD 3.01Å; D277-R312 WeakPolarHBondContact OD1-CG 3.04Å; D277-R312 IonicContact OD1-CZ 2.83Å; D277-R312 IonicContact OD1-NE 2.89Å; D277-R312 PolarHBondContact OD1-NE 2.04Å; D277-R312 IonicContact OD1-NH1 2.67Å; D277-R312 PolarHBondContact OD1-NH1 3.48Å; D277-R312 IonicContact OD1-NH2 3.84Å; D277-R312 WeakPolarHBondContact OD2-CD 3.44Å; D277-R312 IonicContact OD2-CZ 2.75Å; D277-R312 IonicContact OD2-NE 2.63Å; D277-R312 IonicContact OD2-NH1 3.18Å; D277-R312 PolarHBondContact OD2-NH1 2.76Å; H279-R312 WeakPolarHBondContact CB-O 3.48Å; H279-R312 PolarHBondContact N-O 2.92Å; S303-R312 PolarHBondContact OG-N 3.38Å; P310-R312 VanDerWaalsContact C-N 3.3Å; P310-R312 PolarHBondContact O-N 2.69Å
313	D	71.2	Confident	53.8	Low	64 Å²	64	81.7 Å²	81.7	34%	0.342	47%	0.469	S	S	.	.	S	Bend	trans	-133.5	117.2	170.2	-168.3	-4.4	0	0	0	110	H279 V302 S303	H279-D313 IonicContact CD2-OD1 2.67Å; H279-D313 IonicContact NE2-OD1 3.18Å; V302-D313 HydrophobicContact CG2-CB 3.81Å; V302-D313 WeakPolarHBondContact CG2-O 3.47Å; V302-D313 WeakPolarHBondContact CG2-OD1 3.28Å; V302-D313 PolarHBondContact N-O 2.95Å; S303-D313 PolarHBondContact OG-N 2.85Å
314	C	73.7	Confident	52.5	Low	0 Å²	0	84.5 Å²	84.5	0%	0	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	86.5	-170.2	-66.8	0	0	0	0	110.9	H279 N281 C295 I300 G311	H279-C314 HydrophobicContact CB-CB 3.71Å; H279-C314 PolarHBondContact CE1-O 3.03Å; H279-C314 PolarHBondContact ND1-N 2.88Å; H279-C314 PolarHBondContact ND1-O 3.34Å; N281-C314 HydrophobicContact CB-CB 4.02Å; N281-C314 PolarHBondContact ND2-O 2.98Å; C295-C314 WeakPolarHBondContact CA-SG 3.43Å; C295-C314 HydrophobicContact CB-CB 3.78Å; C295-C314 WeakPolarHBondContact CB-SG 3.46Å; C295-C314 WeakPolarHBondContact SG-CB 3.44Å; C295-C314 CovalentContact SG-SG 2.03Å; C295-C314 PolarHBondContact SG-SG 2.94Å; I300-C314 WeakPolarHBondContact O-CA 3.34Å; G311-C314 VanDerWaalsContact CA-SG 3.58Å
315	I	59.1	Low	53	Low	62 Å²	62	85.1 Å²	85.1	32%	0.318	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	131.2	-178.3	59.5	177	0	0	0	111.5	Y299 I300 V302	Y299-I315 CarbonylContact C-O 3.58Å; Y299-I315 WeakPolarHBondContact CA-O 3.32Å; I300-I315 HydrophobicContact CB-CG1 4.47Å; I300-I315 PolarHBondContact N-O 2.84Å; I300-I315 PolarHBondContact O-N 3.35Å; I300-I315 VanDerWaalsContact O-N 3.11Å; V302-I315 HydrophobicContact CG1-CD1 3.77Å; V302-I315 HydrophobicContact CG1-CG1 4.14Å; V302-I315 HydrophobicContact CG2-CB 4.45Å; V302-I315 HydrophobicContact CG2-CD1 4.23Å; V302-I315 HydrophobicContact CG2-CG1 3.97Å; V302-I315 HydrophobicContact CG2-CG2 3.91Å
316	L	55	Low	54	Low	80 Å²	80	87.5 Å²	87.5	42%	0.419	48%	0.481	S	S	.	.			trans	-72.8	128.1	160	-138.5	175.3	0	0	0	104.9	Y299 K318	Y299-L316 HydrophobicContact CD1-CB 3.55Å; Y299-L316 HydrophobicContact CD1-CD1 4.41Å; Y299-L316 HydrophobicContact CD1-CG 3.73Å; Y299-L316 VanDerWaalsContact CD1-N 3.33Å; Y299-L316 HydrophobicContact CE1-CB 3.4Å; Y299-L316 VanDerWaalsContact CE1-CB 3.4Å; Y299-L316 HydrophobicContact CE1-CD1 3.54Å; Y299-L316 HydrophobicContact CE1-CG 3.34Å; Y299-L316 HydrophobicContact CE2-CG 4.38Å; Y299-L316 HydrophobicContact CG-CG 4.4Å; Y299-L316 WeakPolarHBondContact OH-CD1 3.3Å; L316-K318 PolarHBondContact O-N 2.93Å
317	P	43.4	Very low	54.2	Low	67 Å²	67	85.8 Å²	85.8	44%	0.435	47%	0.471	S	S	.	.			trans	-68.5	70.8	176.2	26.1	-36.1	0	0	0	112.4	G298 I300	G298-P317 WeakPolarHBondContact O-CD 3.44Å; I300-P317 HydrophobicContact CD1-CB 4.24Å; I300-P317 HydrophobicContact CD1-CG 4.23Å; I300-P317 HydrophobicContact CG1-CG 4.46Å
318	K	30.6	Very low	54.9	Low	170 Å²	170	83.4 Å²	83.4	74%	0.739	45%	0.449	S	S	*	.			trans	-65	130.2	165.9	-67.7	179.4	179.9	175.1	0	108.3	L316 S320	L316-K318 PolarHBondContact O-N 2.93Å; K318-S320 PolarHBondContact O-N 2.84Å; K318-S320 VanDerWaalsContact O-N 3.1Å
319	P	30.9	Very low	55.4	Low	125 Å²	125	83.6 Å²	83.6	81%	0.812	45%	0.449	S	S	*	.			trans	-69.7	106.9	171.6	28.1	-32.2	0	0	0	109.5	E321	P319-E321 PolarHBondContact O-N 3.08Å
320	S	28.2	Very low	54.5	Low	98 Å²	98	80.9 Å²	80.9	69%	0.685	45%	0.448	S	S	*	.			trans	-81.5	100.7	173	57.7	0	0	0	0	110.3	K318 S322	K318-S320 PolarHBondContact O-N 2.84Å; K318-S320 VanDerWaalsContact O-N 3.1Å; S320-S322 PolarHBondContact O-N 3.39Å
321	E	25.6	Very low	53.5	Low	200 Å²	200	85.9 Å²	85.9	94%	0.935	48%	0.478	S	S	*	.			trans	-67.7	95.6	171.5	-65.3	-174.2	153.1	0	0	110.1	P319	P319-E321 PolarHBondContact O-N 3.08Å
322	S	37.4	Very low	52.2	Low	88 Å²	88	91.3 Å²	91.3	62%	0.615	51%	0.511	S	S	*	.			trans	-135.2	129.7	172.6	60.3	0	0	0	0	109.5	S320	S320-S322 PolarHBondContact O-N 3.39Å
323	P	42	Very low	51.1	Low	126 Å²	126	94.5 Å²	94.5	82%	0.818	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-75.2	153	-164.5	27.9	-35.2	0	0	0	114.3
324	D	45.5	Very low	50.5	Low	64 Å²	64	96 Å²	96	34%	0.342	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-59.2	138.4	-176.4	-63.4	-53.4	0	0	0	114.5	R349	D324-R349 HydrophobicContact CB-CB 3.96Å; D324-R349 VanDerWaalsContact CB-CD 3.45Å; D324-R349 HydrophobicContact CB-CG 3.64Å; D324-R349 WeakPolarHBondContact OD2-CD 3.43Å; D324-R349 IonicContact OD2-CZ 2.61Å; D324-R349 IonicContact OD2-NE 2.77Å; D324-R349 IonicContact OD2-NH1 2.88Å; D324-R349 PolarHBondContact OD2-NH1 3.35Å
325	R	62.4	Low	49.9	Very low	140 Å²	140	97.3 Å²	97.3	53%	0.528	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.3	135	169.9	-60.9	-177.4	-179.6	-169.9	0.9	110.7	R349 C350	R325-R349 CarbonylContact O-C 3.52Å; R325-R349 WeakPolarHBondContact O-CA 3.38Å; R325-C350 HydrophobicContact CB-CB 4.41Å; R325-C350 PolarHBondContact O-N 2.81Å
326	I	65.1	Low	50	Low	119 Å²	119	97.3 Å²	97.3	61%	0.61	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.7	144	178.4	-58.6	178.8	0	0	0	110.3	V347 Y348	I326-V347 HydrophobicContact CB-CG1 4.39Å; I326-V347 HydrophobicContact CD1-CG1 3.91Å; I326-V347 HydrophobicContact CG1-CG1 3.79Å; I326-V347 HydrophobicContact CG2-CG1 3.88Å; I326-Y348 WeakPolarHBondContact CA-O 3.32Å; I326-Y348 WeakPolarHBondContact CG2-O 3.1Å
327	C	62.3	Low	49.9	Very low	11 Å²	11	99.4 Å²	99.4	7%	0.074	58%	0.576	C	S	.	*			trans	-134.9	-177.4	177.6	60.6	0	0	0	0	112	C341 Y348 R349 C350	C327-C341 HydrophobicContact CB-CB 3.99Å; C327-C341 WeakPolarHBondContact CB-SG 3.36Å; C327-C341 WeakPolarHBondContact SG-CA 3.44Å; C327-C341 WeakPolarHBondContact SG-CB 3.28Å; C327-C341 CovalentContact SG-SG 2.04Å; C327-C341 PolarHBondContact SG-SG 3.45Å; C327-Y348 PolarHBondContact N-O 2.92Å; C327-Y348 VanDerWaalsContact O-CB 3.32Å; C327-Y348 WeakPolarHBondContact O-CB 3.43Å; C327-R349 PolarHBondContact SG-N 3Å; C327-R349 VanDerWaalsContact SG-N 3.37Å; C327-C350 VanDerWaalsContact CB-SG 3.5Å
328	S	66	Low	50.6	Low	40 Å²	40	98.5 Å²	98.5	28%	0.28	58%	0.579	S	S	.	*			trans	-136.1	144.8	169.2	-177.2	0	0	0	0	110.2	S330	S328-S330 PolarHBondContact O-N 3.45Å; S328-S330 PolarHBondContact OG-N 2.84Å; S328-S330 VanDerWaalsContact OG-N 3.17Å; S328-S330 PolarHBondContact OG-OG 3.5Å
329	P	64.1	Low	52.4	Low	88 Å²	88	91.3 Å²	91.3	57%	0.571	55%	0.548	S	S	*	.	S	Bend	trans	-68.4	-16.2	168.4	30.1	-36.3	0	0	0	112.5	Y348	P329-Y348 HydrophobicContact CB-CE1 4.41Å; P329-Y348 HydrophobicContact CG-CD1 4.4Å; P329-Y348 HydrophobicContact CG-CD2 4.47Å; P329-Y348 HydrophobicContact CG-CE1 3.96Å; P329-Y348 HydrophobicContact CG-CE2 4.05Å
330	S	51.4	Low	54.2	Low	66 Å²	66	88.6 Å²	88.6	46%	0.462	53%	0.529	S	S	.	.	S	Bend	trans	-78.8	135.9	164.6	61.1	0	0	0	0	110.3	S328 V332	S328-S330 PolarHBondContact O-N 3.45Å; S328-S330 PolarHBondContact OG-N 2.84Å; S328-S330 VanDerWaalsContact OG-N 3.17Å; S328-S330 PolarHBondContact OG-OG 3.5Å; S330-V332 PolarHBondContact O-N 3.43Å
331	T	49.6	Very low	56.3	Low	134 Å²	134	86 Å²	86	82%	0.822	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	10.9	-168.8	48.7	0	0	0	0	116.5
332	V	52.5	Low	58.4	Low	113 Å²	113	78.8 Å²	78.8	69%	0.685	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-31.2	-179.3	-174.2	0	0	0	0	112	S330	S330-V332 PolarHBondContact O-N 3.43Å
333	H	57.8	Low	60	Low	129 Å²	129	79.2 Å²	79.2	60%	0.597	48%	0.475	S	S	*	.	S	Bend	trans	-129.4	73.7	173.4	-79.9	16.4	0	0	0	109.7
334	P	58.4	Low	60.6	Low	97 Å²	97	76.1 Å²	76.1	63%	0.63	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-69	145.2	176.4	30.9	-34.4	0	0	0	110.6
335	C	61.7	Low	61.5	Low	27 Å²	27	76.2 Å²	76.2	18%	0.182	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-69.6	143.9	170.6	-65.9	0	0	0	0	110.9	E339 C350	C335-E339 HydrophobicContact CB-CB 3.69Å; C335-E339 VanDerWaalsContact CB-O 3.24Å; C335-E339 WeakPolarHBondContact CB-O 3.38Å; C335-C350 WeakPolarHBondContact CA-SG 3.24Å; C335-C350 HydrophobicContact CB-CB 3.93Å; C335-C350 WeakPolarHBondContact CB-SG 3.5Å; C335-C350 WeakPolarHBondContact SG-CA 3.1Å; C335-C350 WeakPolarHBondContact SG-CB 3.13Å; C335-C350 CovalentContact SG-SG 2.04Å; C335-C350 PolarHBondContact SG-SG 3.07Å
336	P	60.8	Low	61.6	Low	62 Å²	62	76.3 Å²	76.3	40%	0.403	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-55.4	156.4	172.9	-26.3	35.2	0	0	0	113.3	G338 E339	P336-G338 PolarHBondContact O-N 3Å; P336-E339 PolarHBondContact O-N 2.73Å
337	S	51.5	Low	61.4	Low	123 Å²	123	72.8 Å²	72.8	86%	0.86	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	105.1	-173.8	-52.9	0	0	0	0	113.7
338	G	59.5	Low	62	Low	49 Å²	49	76.7 Å²	76.7	51%	0.505	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	111.8	-5.5	178.9	0	0	0	0	0	115.4	P336 P353	P336-G338 PolarHBondContact O-N 3Å; G338-P353 WeakPolarHBondContact O-CD 2.94Å
339	E	67.4	Low	62	Low	18 Å²	18	78.5 Å²	78.5	8%	0.084	48%	0.484	C	S	.	.			trans	-96.5	133.9	174.9	-78.2	179.2	177.5	0	0	112	C335 P336 C350 R358 C364	C335-E339 HydrophobicContact CB-CB 3.69Å; C335-E339 VanDerWaalsContact CB-O 3.24Å; C335-E339 WeakPolarHBondContact CB-O 3.38Å; P336-E339 PolarHBondContact O-N 2.73Å; E339-C350 HydrophobicContact CB-CB 4.11Å; E339-C350 WeakPolarHBondContact OE2-CB 3.46Å; E339-R358 IonicContact OE1-CZ 3.77Å; E339-R358 IonicContact OE1-NE 2.65Å; E339-R358 PolarHBondContact OE1-NE 2.79Å; E339-R358 IonicContact OE1-NH2 3.9Å; E339-R358 PolarHBondContact OE1-NH2 3.41Å; E339-R358 IonicContact OE2-CZ 3.57Å; E339-R358 IonicContact OE2-NH2 2.69Å; E339-R358 PolarHBondContact OE2-NH2 3.45Å; E339-C364 WeakPolarHBondContact CG-SG 3.25Å
340	T	68.6	Low	62.5	Low	69 Å²	69	74.6 Å²	74.6	42%	0.423	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.4	176.6	-54.7	0	0	0	0	110.1	T342 T351	T340-T342 HydrophobicContact CG2-CG2 3.74Å; T340-T342 PolarHBondContact O-N 2.98Å; T340-T342 VanDerWaalsContact O-N 3.13Å; T340-T351 PolarHBondContact N-O 2.62Å; T340-T351 PolarHBondContact O-N 2.74Å; T340-T351 PolarHBondContact O-OG1 2.77Å; T340-T351 VanDerWaalsContact O-OG1 3.07Å
341	C	73.2	Confident	63.2	Low	42 Å²	42	72.8 Å²	72.8	28%	0.284	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	94.3	172.5	-172.3	0	0	0	0	110.2	C327	C327-C341 HydrophobicContact CB-CB 3.99Å; C327-C341 WeakPolarHBondContact CB-SG 3.36Å; C327-C341 WeakPolarHBondContact SG-CA 3.44Å; C327-C341 WeakPolarHBondContact SG-CB 3.28Å; C327-C341 CovalentContact SG-SG 2.04Å; C327-C341 PolarHBondContact SG-SG 3.45Å
342	T	70.2	Confident	64	Low	49 Å²	49	67.6 Å²	67.6	30%	0.301	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	150.8	179.7	64.4	0	0	0	0	111.4	T340 V344 Y348 R349 T351	T340-T342 HydrophobicContact CG2-CG2 3.74Å; T340-T342 PolarHBondContact O-N 2.98Å; T340-T342 VanDerWaalsContact O-N 3.13Å; T342-V344 PolarHBondContact O-N 2.8Å; T342-Y348 CarbonylContact O-C 3.53Å; T342-Y348 WeakPolarHBondContact O-CA 3.36Å; T342-R349 PolarHBondContact N-O 2.78Å; T342-R349 PolarHBondContact O-N 2.05Å; T342-T351 VanDerWaalsContact CG2-OG1 3.26Å; T342-T351 WeakPolarHBondContact CG2-OG1 3.42Å; T342-T351 VanDerWaalsContact OG1-CG2 3.28Å; T342-T351 WeakPolarHBondContact OG1-CG2 3.33Å; T342-T351 PolarHBondContact OG1-OG1 2.89Å
343	L	69.9	Low	64.5	Low	97 Å²	97	64.9 Å²	64.9	51%	0.508	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	108.6	175	-178.2	68	0	0	0	109.2	G345 Y348	L343-G345 WeakPolarHBondContact CG-O 3.34Å; L343-Y348 HydrophobicContact CB-CD1 4.13Å; L343-Y348 HydrophobicContact CB-CE1 4Å; L343-Y348 HydrophobicContact CD1-CD1 4.26Å; L343-Y348 HydrophobicContact CD1-CD2 4.01Å; L343-Y348 HydrophobicContact CD1-CE1 4.27Å; L343-Y348 HydrophobicContact CD1-CE2 4.01Å; L343-Y348 HydrophobicContact CD1-CG 4.13Å
344	V	55.4	Low	64.5	Low	62 Å²	62	63.3 Å²	63.3	38%	0.376	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	99	178.3	-176.7	0	0	0	0	108.4	T342 V347 T351	T342-V344 PolarHBondContact O-N 2.8Å; V344-V347 PolarHBondContact N-O 3.27Å; V344-T351 HydrophobicContact CG2-CG2 4.12Å
345	G	62.8	Low	64.1	Low	65 Å²	65	64.1 Å²	64.1	67%	0.67	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	-129.3	-167.6	0	0	0	0	0	111.1	L343	L343-G345 WeakPolarHBondContact CG-O 3.34Å
346	T	64.9	Low	64	Low	142 Å²	142	63.7 Å²	63.7	87%	0.871	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	1.6	177.8	48	0	0	0	0	113.7
347	V	61.3	Low	63.8	Low	45 Å²	45	66.9 Å²	66.9	27%	0.273	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.9	-171	-175	0	0	0	0	110	I326 V344 R349	I326-V347 HydrophobicContact CB-CG1 4.39Å; I326-V347 HydrophobicContact CD1-CG1 3.91Å; I326-V347 HydrophobicContact CG1-CG1 3.79Å; I326-V347 HydrophobicContact CG2-CG1 3.88Å; V344-V347 PolarHBondContact N-O 3.27Å; V347-R349 HydrophobicContact CG1-CG 4.26Å; V347-R349 PolarHBondContact O-N 2.71Å
348	Y	73.9	Confident	64.1	Low	94 Å²	94	64.4 Å²	64.4	37%	0.369	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	126	168.9	-75.1	-82.4	0	0	0	109.7	I326 C327 P329 T342 L343	I326-Y348 WeakPolarHBondContact CA-O 3.32Å; I326-Y348 WeakPolarHBondContact CG2-O 3.1Å; C327-Y348 PolarHBondContact N-O 2.92Å; C327-Y348 VanDerWaalsContact O-CB 3.32Å; C327-Y348 WeakPolarHBondContact O-CB 3.43Å; P329-Y348 HydrophobicContact CB-CE1 4.41Å; P329-Y348 HydrophobicContact CG-CD1 4.4Å; P329-Y348 HydrophobicContact CG-CD2 4.47Å; P329-Y348 HydrophobicContact CG-CE1 3.96Å; P329-Y348 HydrophobicContact CG-CE2 4.05Å; T342-Y348 CarbonylContact O-C 3.53Å; T342-Y348 WeakPolarHBondContact O-CA 3.36Å; L343-Y348 HydrophobicContact CB-CD1 4.13Å; L343-Y348 HydrophobicContact CB-CE1 4Å; L343-Y348 HydrophobicContact CD1-CD1 4.26Å; L343-Y348 HydrophobicContact CD1-CD2 4.01Å; L343-Y348 HydrophobicContact CD1-CE1 4.27Å; L343-Y348 HydrophobicContact CD1-CE2 4.01Å; L343-Y348 HydrophobicContact CD1-CG 4.13Å
349	R	66.6	Low	63.7	Low	78 Å²	78	63.7 Å²	63.7	29%	0.294	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.7	-177.1	-78.2	160.6	175.3	-167.9	17.6	111.3	D324 R325 C327 T342 V347 T351	D324-R349 HydrophobicContact CB-CB 3.96Å; D324-R349 VanDerWaalsContact CB-CD 3.45Å; D324-R349 HydrophobicContact CB-CG 3.64Å; D324-R349 WeakPolarHBondContact OD2-CD 3.43Å; D324-R349 IonicContact OD2-CZ 2.61Å; D324-R349 IonicContact OD2-NE 2.77Å; D324-R349 IonicContact OD2-NH1 2.88Å; D324-R349 PolarHBondContact OD2-NH1 3.35Å; R325-R349 CarbonylContact O-C 3.52Å; R325-R349 WeakPolarHBondContact O-CA 3.38Å; C327-R349 PolarHBondContact SG-N 3Å; C327-R349 VanDerWaalsContact SG-N 3.37Å; T342-R349 PolarHBondContact N-O 2.78Å; T342-R349 PolarHBondContact O-N 2.05Å; V347-R349 HydrophobicContact CG1-CG 4.26Å; V347-R349 PolarHBondContact O-N 2.71Å; R349-T351 HydrophobicContact CB-CG2 4.44Å; R349-T351 PolarHBondContact O-N 3.14Å; R349-T351 VanDerWaalsContact O-N 3.15Å
350	C	75.5	Confident	62.7	Low	6 Å²	6	72.4 Å²	72.4	4%	0.041	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	106.3	167.4	-63.7	0	0	0	0	108.6	R325 C327 C335 E339 R358	R325-C350 HydrophobicContact CB-CB 4.41Å; R325-C350 PolarHBondContact O-N 2.81Å; C327-C350 VanDerWaalsContact CB-SG 3.5Å; C335-C350 WeakPolarHBondContact CA-SG 3.24Å; C335-C350 HydrophobicContact CB-CB 3.93Å; C335-C350 WeakPolarHBondContact CB-SG 3.5Å; C335-C350 WeakPolarHBondContact SG-CA 3.1Å; C335-C350 WeakPolarHBondContact SG-CB 3.13Å; C335-C350 CovalentContact SG-SG 2.04Å; C335-C350 PolarHBondContact SG-SG 3.07Å; E339-C350 HydrophobicContact CB-CB 4.11Å; E339-C350 WeakPolarHBondContact OE2-CB 3.46Å; C350-R358 VanDerWaalsContact O-CZ 3.29Å; C350-R358 PolarHBondContact O-NH1 3.01Å; C350-R358 PolarHBondContact O-NH2 2.88Å
351	T	64.6	Low	61.7	Low	28 Å²	28	74.7 Å²	74.7	17%	0.172	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	147.7	175.6	51.6	0	0	0	0	109.4	T340 T342 V344 R349	T340-T351 PolarHBondContact N-O 2.62Å; T340-T351 PolarHBondContact O-N 2.74Å; T340-T351 PolarHBondContact O-OG1 2.77Å; T340-T351 VanDerWaalsContact O-OG1 3.07Å; T342-T351 VanDerWaalsContact CG2-OG1 3.26Å; T342-T351 WeakPolarHBondContact CG2-OG1 3.42Å; T342-T351 VanDerWaalsContact OG1-CG2 3.28Å; T342-T351 WeakPolarHBondContact OG1-CG2 3.33Å; T342-T351 PolarHBondContact OG1-OG1 2.89Å; V344-T351 HydrophobicContact CG2-CG2 4.12Å; R349-T351 HydrophobicContact CB-CG2 4.44Å; R349-T351 PolarHBondContact O-N 3.14Å; R349-T351 VanDerWaalsContact O-N 3.15Å
352	C	68.3	Low	60.7	Low	24 Å²	24	73.6 Å²	73.6	16%	0.162	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-65.2	149.4	165.1	-64.6	0	0	0	0	110.6	A356 R358 C364	C352-A356 HydrophobicContact CB-CB 3.96Å; C352-A356 WeakPolarHBondContact CB-O 3.29Å; C352-R358 PolarHBondContact SG-N 3.46Å; C352-C364 WeakPolarHBondContact CA-SG 3.5Å; C352-C364 HydrophobicContact CB-CB 3.76Å; C352-C364 WeakPolarHBondContact CB-SG 3.26Å; C352-C364 VanDerWaalsContact SG-CA 3.56Å; C352-C364 WeakPolarHBondContact SG-CB 3.28Å; C352-C364 CovalentContact SG-SG 2.03Å; C352-C364 PolarHBondContact SG-SG 3.23Å
353	P	61.7	Low	60.1	Low	57 Å²	57	78.3 Å²	78.3	37%	0.37	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-50.4	147.4	166.2	-25.9	34.4	0	0	0	111	G338 Q355 A356	G338-P353 WeakPolarHBondContact O-CD 2.94Å; P353-Q355 PolarHBondContact O-N 2.86Å; P353-A356 WeakPolarHBondContact O-CB 3.09Å; P353-A356 PolarHBondContact O-N 3.12Å
354	A	57.7	Low	59.6	Low	95 Å²	95	74.4 Å²	74.4	79%	0.785	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	140	171.4	0	0	0	0	0	109.7	A356	A354-A356 VanDerWaalsContact C-N 3.32Å
355	Q	50.4	Low	59.8	Low	114 Å²	114	71.5 Å²	71.5	53%	0.533	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	-18.4	-167.7	-49.2	161.7	-13.5	0	0	116	P353 S372	P353-Q355 PolarHBondContact O-N 2.86Å; Q355-S372 PolarHBondContact NE2-O 3.44Å
356	A	60.6	Low	59.7	Low	18 Å²	18	70.1 Å²	70.1	15%	0.149	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	150.8	172.8	0	0	0	0	0	112.8	C352 P353 A354 C364 A365 V366	C352-A356 HydrophobicContact CB-CB 3.96Å; C352-A356 WeakPolarHBondContact CB-O 3.29Å; P353-A356 WeakPolarHBondContact O-CB 3.09Å; P353-A356 PolarHBondContact O-N 3.12Å; A354-A356 VanDerWaalsContact C-N 3.32Å; A356-C364 HydrophobicContact CB-CB 4.35Å; A356-A365 CarbonylContact C-O 3.56Å; A356-A365 VanDerWaalsContact CA-O 3.25Å; A356-A365 WeakPolarHBondContact CA-O 3.47Å; A356-A365 WeakPolarHBondContact CB-O 3.46Å; A356-V366 HydrophobicContact CB-CG2 4.19Å
357	K	55.2	Low	59.2	Low	130 Å²	130	64.7 Å²	64.7	57%	0.565	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	153.1	172.2	-63.6	-175.1	178.7	179.3	0	110.1	L359 C364 A365 V367	K357-L359 PolarHBondContact O-N 2.88Å; K357-C364 WeakPolarHBondContact O-CA 3.28Å; K357-A365 PolarHBondContact N-O 3.49Å; K357-A365 PolarHBondContact O-N 3.29Å; K357-V367 HydrophobicContact CB-CG2 3.97Å; K357-V367 HydrophobicContact CD-CG2 4.26Å; K357-V367 HydrophobicContact CG-CG2 4.2Å
358	R	57.2	Low	59	Low	71 Å²	71	65.3 Å²	65.3	27%	0.268	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	127.9	167.6	-86	-173.8	173.1	111.7	2.8	109.1	E339 C350 C352	E339-R358 IonicContact OE1-CZ 3.77Å; E339-R358 IonicContact OE1-NE 2.65Å; E339-R358 PolarHBondContact OE1-NE 2.79Å; E339-R358 IonicContact OE1-NH2 3.9Å; E339-R358 PolarHBondContact OE1-NH2 3.41Å; E339-R358 IonicContact OE2-CZ 3.57Å; E339-R358 IonicContact OE2-NH2 2.69Å; E339-R358 PolarHBondContact OE2-NH2 3.45Å; C350-R358 VanDerWaalsContact O-CZ 3.29Å; C350-R358 PolarHBondContact O-NH1 3.01Å; C350-R358 PolarHBondContact O-NH2 2.88Å; C352-R358 PolarHBondContact SG-N 3.46Å
359	L	52.1	Low	58.4	Low	33 Å²	33	61.8 Å²	61.8	17%	0.173	32%	0.321	C	S	.	.			trans	-82.3	165.5	161.6	-60.6	176.6	0	0	0	109.9	K357 N361 G362 R363 A365 I387	K357-L359 PolarHBondContact O-N 2.88Å; L359-N361 WeakPolarHBondContact CB-OD1 3.33Å; L359-N361 PolarHBondContact O-N 3.5Å; L359-G362 PolarHBondContact O-N 2.84Å; L359-R363 PolarHBondContact N-O 2.97Å; L359-A365 HydrophobicContact CD1-CB 3.56Å; L359-A365 HydrophobicContact CD2-CB 4.32Å; L359-A365 HydrophobicContact CG-CB 3.8Å; L359-I387 HydrophobicContact CD1-CG2 3.82Å; L359-I387 HydrophobicContact CD2-CG2 4.3Å
360	E	46.2	Very low	58.4	Low	202 Å²	202	60 Å²	60	94%	0.944	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.4	178.8	-66.3	-170.7	129.4	0	0	113.5	G362	E360-G362 PolarHBondContact O-N 2.75Å; E360-G362 VanDerWaalsContact O-N 3.09Å
361	N	47.8	Very low	57.6	Low	117 Å²	117	69.3 Å²	69.3	63%	0.626	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	3.7	175.5	63.4	24.2	0	0	0	114.2	L359 R363	L359-N361 WeakPolarHBondContact CB-OD1 3.33Å; L359-N361 PolarHBondContact O-N 3.5Å; N361-R363 VanDerWaalsContact C-N 3.26Å; N361-R363 PolarHBondContact O-N 2.82Å; N361-R363 WeakPolarHBondContact OD1-CB 2.88Å; N361-R363 PolarHBondContact OD1-N 3.07Å
362	G	51.7	Low	57.1	Low	18 Å²	18	68.9 Å²	68.9	19%	0.186	35%	0.352	C	S	.	.	S	Bend	trans	75.2	10.9	178.9	0	0	0	0	0	114.6	L359 E360	L359-G362 PolarHBondContact O-N 2.84Å; E360-G362 PolarHBondContact O-N 2.75Å; E360-G362 VanDerWaalsContact O-N 3.09Å
363	R	59	Low	56.3	Low	149 Å²	149	71.2 Å²	71.2	56%	0.562	38%	0.38	S	S	*	.			trans	-93.4	139.8	174.8	-160.1	180	-172.9	-173.3	-1.4	109.8	L359 N361	L359-R363 PolarHBondContact N-O 2.97Å; N361-R363 VanDerWaalsContact C-N 3.26Å; N361-R363 PolarHBondContact O-N 2.82Å; N361-R363 WeakPolarHBondContact OD1-CB 2.88Å; N361-R363 PolarHBondContact OD1-N 3.07Å
364	C	59.5	Low	55.7	Low	15 Å²	15	76.1 Å²	76.1	10%	0.101	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.8	166	-68.4	0	0	0	0	109.6	E339 C352 A356 K357	E339-C364 WeakPolarHBondContact CG-SG 3.25Å; C352-C364 WeakPolarHBondContact CA-SG 3.5Å; C352-C364 HydrophobicContact CB-CB 3.76Å; C352-C364 WeakPolarHBondContact CB-SG 3.26Å; C352-C364 VanDerWaalsContact SG-CA 3.56Å; C352-C364 WeakPolarHBondContact SG-CB 3.28Å; C352-C364 CovalentContact SG-SG 2.03Å; C352-C364 PolarHBondContact SG-SG 3.23Å; A356-C364 HydrophobicContact CB-CB 4.35Å; K357-C364 WeakPolarHBondContact O-CA 3.28Å
365	A	58.9	Low	55.9	Low	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	146.6	172.7	0	0	0	0	0	111.1	A356 K357 L359 I387 D388	A356-A365 CarbonylContact C-O 3.56Å; A356-A365 VanDerWaalsContact CA-O 3.25Å; A356-A365 WeakPolarHBondContact CA-O 3.47Å; A356-A365 WeakPolarHBondContact CB-O 3.46Å; K357-A365 PolarHBondContact N-O 3.49Å; K357-A365 PolarHBondContact O-N 3.29Å; L359-A365 HydrophobicContact CD1-CB 3.56Å; L359-A365 HydrophobicContact CD2-CB 4.32Å; L359-A365 HydrophobicContact CG-CB 3.8Å; A365-I387 HydrophobicContact CB-CG2 3.75Å; A365-D388 WeakPolarHBondContact CA-OD1 3.28Å; A365-D388 VanDerWaalsContact CB-OD1 3.27Å; A365-D388 WeakPolarHBondContact CB-OD1 3.48Å
366	V	60.7	Low	56.6	Low	37 Å²	37	74 Å²	74	22%	0.224	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	130.9	169.7	-172.1	0	0	0	0	108.1	A356 N369 D388	A356-V366 HydrophobicContact CB-CG2 4.19Å; V366-N369 VanDerWaalsContact CB-OD1 3.25Å; V366-N369 WeakPolarHBondContact CB-OD1 3.24Å; V366-N369 HydrophobicContact CG1-CB 4.43Å; V366-N369 WeakPolarHBondContact CG1-OD1 3.22Å; V366-N369 PolarHBondContact O-OD1 3.15Å; V366-D388 PolarHBondContact N-OD1 2.86Å; V366-D388 PolarHBondContact O-N 3.45Å; V366-D388 VanDerWaalsContact O-N 3.14Å
367	V	54	Low	57.2	Low	28 Å²	28	74.2 Å²	74.2	17%	0.17	38%	0.378	C	S	.	.	S	Bend	trans	-109.8	-15.4	-172.8	-173.8	0	0	0	0	112	I300 K357	I300-V367 HydrophobicContact CD1-CG1 3.52Å; K357-V367 HydrophobicContact CB-CG2 3.97Å; K357-V367 HydrophobicContact CD-CG2 4.26Å; K357-V367 HydrophobicContact CG-CG2 4.2Å
368	D	56.4	Low	58.1	Low	58 Å²	58	69.2 Å²	69.2	31%	0.31	36%	0.357	S	S	.	.			trans	-140	59	-178.7	-165.6	4.1	0	0	0	110	C370 R371 S372 N385	D368-C370 VanDerWaalsContact C-N 3.3Å; D368-C370 PolarHBondContact O-N 3.01Å; D368-R371 HydrophobicContact CB-CB 4.37Å; D368-R371 VanDerWaalsContact CG-CB 3.46Å; D368-R371 PolarHBondContact O-N 3.31Å; D368-R371 WeakPolarHBondContact OD1-CB 3.36Å; D368-R371 WeakPolarHBondContact OD2-CB 3.26Å; D368-R371 WeakPolarHBondContact OD2-CD 3.47Å; D368-R371 IonicContact OD2-NH1 2.68Å; D368-S372 PolarHBondContact O-N 2.73Å; D368-N385 PolarHBondContact OD1-ND2 3.2Å
369	N	62.1	Low	58.8	Low	20 Å²	20	71.7 Å²	71.7	11%	0.107	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-53.7	-43.6	-179.9	-74	59.1	0	0	0	112.2	V366 R371 S372 T375 N385 G389 Y390	V366-N369 VanDerWaalsContact CB-OD1 3.25Å; V366-N369 WeakPolarHBondContact CB-OD1 3.24Å; V366-N369 HydrophobicContact CG1-CB 4.43Å; V366-N369 WeakPolarHBondContact CG1-OD1 3.22Å; V366-N369 PolarHBondContact O-OD1 3.15Å; N369-R371 PolarHBondContact O-N 3.39Å; N369-S372 WeakPolarHBondContact O-CB 3.48Å; N369-S372 PolarHBondContact O-N 2.69Å; N369-S372 PolarHBondContact O-OG 2.86Å; N369-T375 VanDerWaalsContact C-CG2 3.44Å; N369-T375 HydrophobicContact CB-CG2 3.99Å; N369-T375 WeakPolarHBondContact O-CG2 3.32Å; N369-N385 PolarHBondContact N-OD1 3.49Å; N369-G389 VanDerWaalsContact CB-O 3.31Å; N369-G389 WeakPolarHBondContact CB-O 3.33Å; N369-G389 PolarHBondContact OD1-O 3.22Å; N369-Y390 HydrophobicContact CB-CD1 4.09Å; N369-Y390 HydrophobicContact CB-CG 4.5Å
370	C	67.8	Low	59.6	Low	40 Å²	40	72.5 Å²	72.5	27%	0.27	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-60.1	-15	179.2	-61	0	0	0	0	113.6	D368 C383 I384 N385	D368-C370 VanDerWaalsContact C-N 3.3Å; D368-C370 PolarHBondContact O-N 3.01Å; C370-C383 WeakPolarHBondContact CA-SG 3.09Å; C370-C383 HydrophobicContact CB-CB 3.79Å; C370-C383 WeakPolarHBondContact CB-SG 3.46Å; C370-C383 WeakPolarHBondContact SG-CB 3.41Å; C370-C383 CovalentContact SG-SG 2.04Å; C370-C383 PolarHBondContact SG-SG 2.94Å; C370-I384 VanDerWaalsContact SG-C 3.58Å; C370-I384 PolarHBondContact SG-N 2.82Å; C370-I384 VanDerWaalsContact SG-N 3.41Å; C370-N385 WeakPolarHBondContact CB-OD1 3.41Å; C370-N385 PolarHBondContact N-OD1 3.46Å; C370-N385 PolarHBondContact SG-OD1 3.09Å; C370-N385 VanDerWaalsContact SG-OD1 3.32Å
371	R	56.7	Low	60.9	Low	202 Å²	202	63.4 Å²	63.4	76%	0.762	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-105	-2.2	174.8	-148.6	172.2	-170.3	176.7	4.5	113.6	D368 N369 G373	D368-R371 HydrophobicContact CB-CB 4.37Å; D368-R371 VanDerWaalsContact CG-CB 3.46Å; D368-R371 PolarHBondContact O-N 3.31Å; D368-R371 WeakPolarHBondContact OD1-CB 3.36Å; D368-R371 WeakPolarHBondContact OD2-CB 3.26Å; D368-R371 WeakPolarHBondContact OD2-CD 3.47Å; D368-R371 IonicContact OD2-NH1 2.68Å; N369-R371 PolarHBondContact O-N 3.39Å; R371-G373 VanDerWaalsContact C-N 3.33Å
372	S	54.6	Low	62.2	Low	19 Å²	19	60.8 Å²	60.8	13%	0.133	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-20.3	176.8	78.7	0	0	0	0	113.7	Q355 D368 N369 Q374	Q355-S372 PolarHBondContact NE2-O 3.44Å; D368-S372 PolarHBondContact O-N 2.73Å; N369-S372 WeakPolarHBondContact O-CB 3.48Å; N369-S372 PolarHBondContact O-N 2.69Å; N369-S372 PolarHBondContact O-OG 2.86Å; S372-Q374 PolarHBondContact O-N 2.83Å; S372-Q374 PolarHBondContact OG-N 2.8Å; S372-Q374 VanDerWaalsContact OG-N 3.13Å
373	G	51.4	Low	63.3	Low	72 Å²	72	62 Å²	62	74%	0.742	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	2.8	-172.4	0	0	0	0	0	114.4	R371	R371-G373 VanDerWaalsContact C-N 3.33Å
374	Q	50.4	Low	63.7	Low	161 Å²	161	58.5 Å²	58.5	75%	0.752	33%	0.334	S	S	*	.			trans	-108.7	21.4	-179.1	-62.3	-170.3	-14.1	0	0	113.5	S372	S372-Q374 PolarHBondContact O-N 2.83Å; S372-Q374 PolarHBondContact OG-N 2.8Å; S372-Q374 VanDerWaalsContact OG-N 3.13Å
375	T	60.6	Low	63.8	Low	33 Å²	33	60.3 Å²	60.3	20%	0.202	34%	0.343	C	S	.	.			trans	-89.4	110.3	177	51.4	0	0	0	0	111.4	N369 C377 Y390	N369-T375 VanDerWaalsContact C-CG2 3.44Å; N369-T375 HydrophobicContact CB-CG2 3.99Å; N369-T375 WeakPolarHBondContact O-CG2 3.32Å; T375-C377 PolarHBondContact O-N 2.99Å; T375-Y390 HydrophobicContact CG2-CD1 3.63Å; T375-Y390 HydrophobicContact CG2-CD2 3.84Å; T375-Y390 HydrophobicContact CG2-CE1 3.98Å; T375-Y390 HydrophobicContact CG2-CE2 4.18Å; T375-Y390 HydrophobicContact CG2-CG 3.56Å
376	L	64.7	Low	63.6	Low	131 Å²	131	62.9 Å²	62.9	69%	0.686	36%	0.356	S	S	*	.			trans	-74	59.3	169.1	-61	164.4	0	0	0	110.2	Y390 R411	L376-Y390 WeakPolarHBondContact CB-OH 3.35Å; L376-Y390 PolarHBondContact N-OH 3.03Å; L376-R411 WeakPolarHBondContact O-CD 3.5Å; L376-R411 PolarHBondContact O-NH1 2.88Å
377	C	73.6	Confident	63.1	Low	23 Å²	23	63 Å²	63	16%	0.155	36%	0.355	C	S	.	.			trans	-89.7	151	158	-63.3	0	0	0	0	108.2	T375 A381 C383 C392	T375-C377 PolarHBondContact O-N 2.99Å; C377-A381 HydrophobicContact CB-CB 4.33Å; C377-C383 HydrophobicContact CB-CB 4.49Å; C377-C392 WeakPolarHBondContact CA-SG 3.47Å; C377-C392 HydrophobicContact CB-CB 3.66Å; C377-C392 WeakPolarHBondContact CB-SG 3Å; C377-C392 WeakPolarHBondContact SG-CB 3.38Å; C377-C392 CovalentContact SG-SG 2.03Å; C377-C392 PolarHBondContact SG-SG 3.36Å
378	D	74.2	Confident	63.1	Low	24 Å²	24	65.3 Å²	65.3	13%	0.128	37%	0.367	C	S	.	.			trans	-59.7	143.3	165.4	-164.7	-75.7	0	0	0	109.2	N380 A381 G410 K412 C413	D378-N380 PolarHBondContact O-N 3.45Å; D378-N380 VanDerWaalsContact O-N 3.08Å; D378-N380 VanDerWaalsContact OD1-CB 3.31Å; D378-N380 WeakPolarHBondContact OD1-CB 3.29Å; D378-N380 PolarHBondContact OD1-N 2.99Å; D378-N380 PolarHBondContact OD1-ND2 2.93Å; D378-A381 HydrophobicContact CB-CB 4.06Å; D378-A381 WeakPolarHBondContact O-CB 3.01Å; D378-A381 PolarHBondContact O-N 3.22Å; D378-G410 PolarHBondContact N-O 3.27Å; D378-K412 WeakPolarHBondContact OD2-CA 3.45Å; D378-C413 HydrophobicContact CB-CB 3.91Å; D378-C413 VanDerWaalsContact CG-N 3.32Å; D378-C413 PolarHBondContact OD2-N 3.03Å
379	P	72.3	Confident	63.3	Low	123 Å²	123	63.3 Å²	63.3	80%	0.799	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.7	172.8	-27.1	36	0	0	0	113.4	A381	P379-A381 VanDerWaalsContact C-N 3.32Å
380	N	69.1	Low	63.9	Low	51 Å²	51	64.2 Å²	64.2	27%	0.273	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	17.4	176.5	-46	-75.4	0	0	0	112.8	D378 N395 Y398 C413	D378-N380 PolarHBondContact O-N 3.45Å; D378-N380 VanDerWaalsContact O-N 3.08Å; D378-N380 VanDerWaalsContact OD1-CB 3.31Å; D378-N380 WeakPolarHBondContact OD1-CB 3.29Å; D378-N380 PolarHBondContact OD1-N 2.99Å; D378-N380 PolarHBondContact OD1-ND2 2.93Å; N380-N395 VanDerWaalsContact C-ND2 3.32Å; N380-N395 WeakPolarHBondContact O-CB 3.44Å; N380-N395 VanDerWaalsContact O-CG 3.22Å; N380-N395 PolarHBondContact O-N 3.46Å; N380-N395 PolarHBondContact O-ND2 3.07Å; N380-Y398 HydrophobicContact CB-CD1 3.35Å; N380-Y398 HydrophobicContact CB-CD2 4.09Å; N380-Y398 HydrophobicContact CB-CE1 3.4Å; N380-Y398 HydrophobicContact CB-CE2 4.13Å; N380-Y398 HydrophobicContact CB-CG 3.75Å; N380-Y398 VanDerWaalsContact OD1-CE1 3.29Å; N380-Y398 WeakPolarHBondContact OD1-CE1 3.38Å; N380-Y398 VanDerWaalsContact OD1-CZ 3.31Å; N380-Y398 PolarHBondContact OD1-OH 2.78Å; N380-C413 HydrophobicContact CB-CB 4.11Å
381	A	73.6	Confident	63.9	Low	11 Å²	11	64.4 Å²	64.4	9%	0.091	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.2	169.9	0	0	0	0	0	111.7	C377 D378 P379 C383 C392 Q393 G410	C377-A381 HydrophobicContact CB-CB 4.33Å; D378-A381 HydrophobicContact CB-CB 4.06Å; D378-A381 WeakPolarHBondContact O-CB 3.01Å; D378-A381 PolarHBondContact O-N 3.22Å; P379-A381 VanDerWaalsContact C-N 3.32Å; A381-C383 PolarHBondContact O-N 3.19Å; A381-C392 HydrophobicContact CB-CB 4.05Å; A381-Q393 CarbonylContact C-O 3.53Å; A381-Q393 WeakPolarHBondContact CA-O 3.2Å; A381-Q393 WeakPolarHBondContact CB-O 3.26Å; A381-G410 VanDerWaalsContact CB-O 3.26Å; A381-G410 WeakPolarHBondContact CB-O 2.96Å
382	S	73.9	Confident	65	Low	62 Å²	62	54.9 Å²	54.9	43%	0.434	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	121.3	166.5	-71.2	0	0	0	0	109.7	C392 Q393 N395	S382-C392 WeakPolarHBondContact O-CA 3.49Å; S382-Q393 PolarHBondContact N-O 2.94Å; S382-Q393 PolarHBondContact O-N 2.94Å; S382-N395 PolarHBondContact N-OD1 3.44Å; S382-N395 PolarHBondContact OG-OD1 3.4Å
383	C	75.4	Confident	65.8	Low	42 Å²	42	59.9 Å²	59.9	28%	0.284	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	134.4	173.4	-175.7	0	0	0	0	110.7	C370 C377 A381	C370-C383 WeakPolarHBondContact CA-SG 3.09Å; C370-C383 HydrophobicContact CB-CB 3.79Å; C370-C383 WeakPolarHBondContact CB-SG 3.46Å; C370-C383 WeakPolarHBondContact SG-CB 3.41Å; C370-C383 CovalentContact SG-SG 2.04Å; C370-C383 PolarHBondContact SG-SG 2.94Å; C377-C383 HydrophobicContact CB-CB 4.49Å; A381-C383 PolarHBondContact O-N 3.19Å
384	I	68.3	Low	66.9	Low	76 Å²	76	57.4 Å²	57.4	39%	0.39	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	123.4	178.3	-54	175.7	0	0	0	108.7	C370 Y390 T391	C370-I384 VanDerWaalsContact SG-C 3.58Å; C370-I384 PolarHBondContact SG-N 2.82Å; C370-I384 VanDerWaalsContact SG-N 3.41Å; I384-Y390 CarbonylContact O-C 3.53Å; I384-Y390 VanDerWaalsContact O-CA 3.23Å; I384-Y390 WeakPolarHBondContact O-CA 3.26Å; I384-T391 HydrophobicContact CB-CG2 3.86Å; I384-T391 HydrophobicContact CD1-CG2 4.34Å; I384-T391 HydrophobicContact CG2-CG2 4.34Å; I384-T391 PolarHBondContact N-O 3.43Å; I384-T391 PolarHBondContact O-N 2.02Å
385	N	60.2	Low	67.4	Low	54 Å²	54	52.5 Å²	52.5	29%	0.289	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	141.1	179.6	-76.7	-38.7	0	0	0	112.4	D368 N369 C370	D368-N385 PolarHBondContact OD1-ND2 3.2Å; N369-N385 PolarHBondContact N-OD1 3.49Å; C370-N385 WeakPolarHBondContact CB-OD1 3.41Å; C370-N385 PolarHBondContact N-OD1 3.46Å; C370-N385 PolarHBondContact SG-OD1 3.09Å; C370-N385 VanDerWaalsContact SG-OD1 3.32Å
386	L	55.1	Low	67.1	Low	53 Å²	53	57 Å²	57	28%	0.277	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	159.1	164.7	-57.5	170.6	0	0	0	107.7	V306 D388 G389	V306-L386 HydrophobicContact CG1-CD2 4.15Å; L386-D388 PolarHBondContact O-N 2.88Å; L386-G389 CarbonylContact C-O 3.15Å; L386-G389 PolarHBondContact N-O 2.86Å; L386-G389 CarbonylContact O-C 3.3Å; L386-G389 PolarHBondContact O-N 3.4Å
387	I	50.9	Low	66.2	Low	39 Å²	39	52.9 Å²	52.9	20%	0.2	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	128.7	170.6	-67.9	89.2	0	0	0	108.5	I300 D301 V302 L359 A365 G389	I300-I387 HydrophobicContact CB-CD1 4.09Å; I300-I387 HydrophobicContact CG2-CD1 3.42Å; I300-I387 VanDerWaalsContact CG2-CD1 3.42Å; I300-I387 HydrophobicContact CG2-CG1 4.32Å; D301-I387 WeakPolarHBondContact O-CD1 3.13Å; V302-I387 HydrophobicContact CB-CD1 4.32Å; V302-I387 HydrophobicContact CG1-CB 4.47Å; V302-I387 HydrophobicContact CG1-CD1 3.41Å; V302-I387 VanDerWaalsContact CG1-CD1 3.41Å; V302-I387 HydrophobicContact CG1-CG1 3.67Å; L359-I387 HydrophobicContact CD1-CG2 3.82Å; L359-I387 HydrophobicContact CD2-CG2 4.3Å; A365-I387 HydrophobicContact CB-CG2 3.75Å; I387-G389 PolarHBondContact O-N 3.09Å
388	D	54.4	Low	65.9	Low	78 Å²	78	54.8 Å²	54.8	42%	0.417	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	26.2	-171.2	-82.7	-24.2	0	0	0	114.3	A365 V366 L386	A365-D388 WeakPolarHBondContact CA-OD1 3.28Å; A365-D388 VanDerWaalsContact CB-OD1 3.27Å; A365-D388 WeakPolarHBondContact CB-OD1 3.48Å; V366-D388 PolarHBondContact N-OD1 2.86Å; V366-D388 PolarHBondContact O-N 3.45Å; V366-D388 VanDerWaalsContact O-N 3.14Å; L386-D388 PolarHBondContact O-N 2.88Å
389	G	59.8	Low	65.5	Low	15 Å²	15	60 Å²	60	16%	0.155	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	-170.3	-178.1	0	0	0	0	0	116.5	N369 L386 I387	N369-G389 VanDerWaalsContact CB-O 3.31Å; N369-G389 WeakPolarHBondContact CB-O 3.33Å; N369-G389 PolarHBondContact OD1-O 3.22Å; L386-G389 CarbonylContact C-O 3.15Å; L386-G389 PolarHBondContact N-O 2.86Å; L386-G389 CarbonylContact O-C 3.3Å; L386-G389 PolarHBondContact O-N 3.4Å; I387-G389 PolarHBondContact O-N 3.09Å
390	Y	74.3	Confident	65	Low	39 Å²	39	56.4 Å²	56.4	15%	0.153	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	148.1	175	56.7	-79.5	0	0	0	108.7	N369 T375 L376 I384 R411	N369-Y390 HydrophobicContact CB-CD1 4.09Å; N369-Y390 HydrophobicContact CB-CG 4.5Å; T375-Y390 HydrophobicContact CG2-CD1 3.63Å; T375-Y390 HydrophobicContact CG2-CD2 3.84Å; T375-Y390 HydrophobicContact CG2-CE1 3.98Å; T375-Y390 HydrophobicContact CG2-CE2 4.18Å; T375-Y390 HydrophobicContact CG2-CG 3.56Å; L376-Y390 WeakPolarHBondContact CB-OH 3.35Å; L376-Y390 PolarHBondContact N-OH 3.03Å; I384-Y390 CarbonylContact O-C 3.53Å; I384-Y390 VanDerWaalsContact O-CA 3.23Å; I384-Y390 WeakPolarHBondContact O-CA 3.26Å; Y390-R411 VanDerWaalsContact CE2-NH1 3.28Å; Y390-R411 PolarHBondContact OH-NH1 3.44Å
391	T	68.8	Low	65	Low	44 Å²	44	57 Å²	57	27%	0.27	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	161	164.7	-168.1	0	0	0	0	109.4	I384	I384-T391 HydrophobicContact CB-CG2 3.86Å; I384-T391 HydrophobicContact CD1-CG2 4.34Å; I384-T391 HydrophobicContact CG2-CG2 4.34Å; I384-T391 PolarHBondContact N-O 3.43Å; I384-T391 PolarHBondContact O-N 2.02Å
392	C	79.2	Confident	64.7	Low	2 Å²	2	56.8 Å²	56.8	1%	0.014	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.4	-175	-44.2	0	0	0	0	108.4	C377 A381 S382 P409 G410	C377-C392 WeakPolarHBondContact CA-SG 3.47Å; C377-C392 HydrophobicContact CB-CB 3.66Å; C377-C392 WeakPolarHBondContact CB-SG 3Å; C377-C392 WeakPolarHBondContact SG-CB 3.38Å; C377-C392 CovalentContact SG-SG 2.03Å; C377-C392 PolarHBondContact SG-SG 3.36Å; A381-C392 HydrophobicContact CB-CB 4.05Å; S382-C392 WeakPolarHBondContact O-CA 3.49Å; C392-P409 WeakPolarHBondContact CB-O 3.34Å; C392-P409 CarbonylContact O-C 3.56Å; C392-P409 WeakPolarHBondContact O-CB 3.43Å; C392-P409 WeakPolarHBondContact O-CG 3.35Å; C392-P409 VanDerWaalsContact O-O 3.07Å; C392-G410 VanDerWaalsContact CB-O 3.22Å; C392-G410 WeakPolarHBondContact CB-O 3.44Å; C392-G410 PolarHBondContact O-N 2.94Å
393	Q	70.9	Confident	63.8	Low	125 Å²	125	60 Å²	60	58%	0.584	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.9	125	176.3	179.9	179.5	-4.7	0	0	109.3	A381 S382 N395	A381-Q393 CarbonylContact C-O 3.53Å; A381-Q393 WeakPolarHBondContact CA-O 3.2Å; A381-Q393 WeakPolarHBondContact CB-O 3.26Å; S382-Q393 PolarHBondContact N-O 2.94Å; S382-Q393 PolarHBondContact O-N 2.94Å; Q393-N395 PolarHBondContact O-N 2.85Å
394	C	75.5	Confident	62.7	Low	20 Å²	20	60.5 Å²	60.5	14%	0.135	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	135.8	177.6	-61	0	0	0	0	111.5	D400 C413	C394-D400 WeakPolarHBondContact SG-CA 3.26Å; C394-C413 WeakPolarHBondContact CA-SG 3.37Å; C394-C413 HydrophobicContact CB-CB 3.85Å; C394-C413 WeakPolarHBondContact CB-SG 3.37Å; C394-C413 VanDerWaalsContact SG-CA 3.6Å; C394-C413 WeakPolarHBondContact SG-CB 3.26Å; C394-C413 CovalentContact SG-SG 2.03Å; C394-C413 PolarHBondContact SG-SG 3.02Å
395	N	61.2	Low	62.3	Low	58 Å²	58	60.3 Å²	60.3	31%	0.31	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-70.7	155.6	178.7	-62.8	-28.4	0	0	0	110.3	N380 S382 Q393 G397 Y398	N380-N395 VanDerWaalsContact C-ND2 3.32Å; N380-N395 WeakPolarHBondContact O-CB 3.44Å; N380-N395 VanDerWaalsContact O-CG 3.22Å; N380-N395 PolarHBondContact O-N 3.46Å; N380-N395 PolarHBondContact O-ND2 3.07Å; S382-N395 PolarHBondContact N-OD1 3.44Å; S382-N395 PolarHBondContact OG-OD1 3.4Å; Q393-N395 PolarHBondContact O-N 2.85Å; N395-G397 PolarHBondContact O-N 3.03Å; N395-Y398 HydrophobicContact CB-CD2 4.4Å; N395-Y398 WeakPolarHBondContact O-CB 3.11Å; N395-Y398 PolarHBondContact O-N 2.67Å
396	S	54.6	Low	61.8	Low	127 Å²	127	65.1 Å²	65.1	89%	0.888	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	131.6	176.5	-54.9	0	0	0	0	111.5
397	G	45.1	Very low	61.6	Low	44 Å²	44	70.5 Å²	70.5	45%	0.454	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	1.5	-171.2	0	0	0	0	0	114.8	N395 L416	N395-G397 PolarHBondContact O-N 3.03Å; G397-L416 WeakPolarHBondContact O-CD1 3.3Å; G397-L416 PolarHBondContact O-N 3.08Å
398	Y	68.1	Low	62.5	Low	64 Å²	64	74.2 Å²	74.2	25%	0.251	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.8	176.5	-62.7	-104.3	0	0	0	111.5	N380 N395 C413 T414 Q415	N380-Y398 HydrophobicContact CB-CD1 3.35Å; N380-Y398 HydrophobicContact CB-CD2 4.09Å; N380-Y398 HydrophobicContact CB-CE1 3.4Å; N380-Y398 HydrophobicContact CB-CE2 4.13Å; N380-Y398 HydrophobicContact CB-CG 3.75Å; N380-Y398 VanDerWaalsContact OD1-CE1 3.29Å; N380-Y398 WeakPolarHBondContact OD1-CE1 3.38Å; N380-Y398 VanDerWaalsContact OD1-CZ 3.31Å; N380-Y398 PolarHBondContact OD1-OH 2.78Å; N395-Y398 HydrophobicContact CB-CD2 4.4Å; N395-Y398 WeakPolarHBondContact O-CB 3.11Å; N395-Y398 PolarHBondContact O-N 2.67Å; Y398-C413 HydrophobicContact CD1-CB 4.37Å; Y398-T414 CarbonylContact C-O 3.17Å; Y398-T414 VanDerWaalsContact CA-O 3.28Å; Y398-T414 WeakPolarHBondContact CA-O 3.44Å; Y398-Q415 HydrophobicContact CD1-CB 3.75Å; Y398-Q415 HydrophobicContact CD1-CG 4.27Å; Y398-Q415 VanDerWaalsContact CD1-N 3.3Å; Y398-Q415 HydrophobicContact CE1-CB 3.44Å; Y398-Q415 VanDerWaalsContact CE1-CB 3.44Å; Y398-Q415 HydrophobicContact CE1-CG 3.75Å; Y398-Q415 HydrophobicContact CE2-CG 4.49Å
399	K	64.9	Low	63.1	Low	134 Å²	134	72 Å²	72	58%	0.583	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	130.7	174.5	-176.6	175.7	-177.3	173.9	0	109.7	I401 T414 L416	K399-I401 HydrophobicContact CG-CG2 4.33Å; K399-I401 PolarHBondContact O-N 2.97Å; K399-T414 PolarHBondContact N-O 2.92Å; K399-T414 PolarHBondContact O-N 3.36Å; K399-T414 PolarHBondContact O-OG1 2.91Å; K399-L416 HydrophobicContact CB-CD1 4.29Å
400	D	62.4	Low	64	Low	46 Å²	46	71.3 Å²	71.3	25%	0.246	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	114.7	174.4	-160.1	-28.7	0	0	0	110.3	C394 S402 P409 G410	C394-D400 WeakPolarHBondContact SG-CA 3.26Å; D400-S402 WeakPolarHBondContact OD1-CB 3.17Å; D400-S402 PolarHBondContact OD1-N 2.8Å; D400-S402 PolarHBondContact OD1-OG 2.79Å; D400-P409 VanDerWaalsContact OD2-CA 3.23Å; D400-P409 WeakPolarHBondContact OD2-CA 3.46Å; D400-P409 VanDerWaalsContact OD2-CB 3.32Å; D400-P409 WeakPolarHBondContact OD2-CB 3.44Å; D400-G410 PolarHBondContact OD2-N 3.06Å
401	I	69	Low	64.2	Low	65 Å²	65	72.6 Å²	72.6	33%	0.333	39%	0.389	S	S	.	.			trans	-121.3	28.7	172.8	66.3	149.2	0	0	0	110.9	K399 K412 T414	K399-I401 HydrophobicContact CG-CG2 4.33Å; K399-I401 PolarHBondContact O-N 2.97Å; I401-K412 CarbonylContact C-O 3.58Å; I401-K412 HydrophobicContact CD1-CD 3.67Å; I401-K412 HydrophobicContact CD1-CG 4.05Å; I401-K412 HydrophobicContact CG1-CB 4.22Å; I401-K412 HydrophobicContact CG1-CD 4Å; I401-K412 HydrophobicContact CG1-CG 3.91Å; I401-K412 PolarHBondContact N-O 2.95Å; I401-T414 HydrophobicContact CD1-CG2 3.45Å; I401-T414 VanDerWaalsContact CD1-CG2 3.45Å; I401-T414 HydrophobicContact CG1-CG2 3.89Å; I401-T414 WeakPolarHBondContact CG2-OG1 3.38Å
402	S	66.5	Low	64.3	Low	5 Å²	5	75.9 Å²	75.9	4%	0.035	40%	0.4	C	S	.	.			trans	-57.2	142.9	172.7	-57.3	0	0	0	0	110.2	D400 D404 P405 K408 G410 R411 K412	D400-S402 WeakPolarHBondContact OD1-CB 3.17Å; D400-S402 PolarHBondContact OD1-N 2.8Å; D400-S402 PolarHBondContact OD1-OG 2.79Å; S402-D404 PolarHBondContact O-N 2.73Å; S402-P405 WeakPolarHBondContact O-CD 3.41Å; S402-P405 WeakPolarHBondContact O-CG 3.37Å; S402-K408 WeakPolarHBondContact CB-O 3.47Å; S402-K408 PolarHBondContact OG-O 3.15Å; S402-G410 PolarHBondContact OG-N 2.65Å; S402-R411 PolarHBondContact OG-N 3.06Å; S402-K412 PolarHBondContact N-O 2.57Å; S402-K412 PolarHBondContact OG-N 3.46Å; S402-K412 VanDerWaalsContact OG-N 3.09Å
403	P	54.8	Low	63.8	Low	129 Å²	129	76.1 Å²	76.1	84%	0.838	40%	0.402	S	S	*	.	S	Bend	trans	-60.4	-13	179.3	-27.2	35.8	0	0	0	115.6
404	D	53.5	Low	63.5	Low	53 Å²	53	72.9 Å²	72.9	28%	0.283	39%	0.39	S	S	.	.			trans	-144.5	84.4	170.6	-174.2	-20.5	0	0	0	109	S402 I406 K407 K408	S402-D404 PolarHBondContact O-N 2.73Å; D404-I406 PolarHBondContact O-N 2.87Å; D404-I406 PolarHBondContact OD1-N 2.77Å; D404-K407 PolarHBondContact O-N 2.79Å; D404-K407 PolarHBondContact OD1-N 2.77Å; D404-K407 WeakPolarHBondContact OD2-CB 3.24Å; D404-K407 WeakPolarHBondContact OD2-CD 3.27Å; D404-K408 HydrophobicContact CB-CB 4.45Å; D404-K408 CarbonylContact O-C 3.39Å; D404-K408 VanDerWaalsContact O-CA 3.27Å; D404-K408 WeakPolarHBondContact O-CA 3.25Å; D404-K408 PolarHBondContact O-N 2.8Å; D404-K408 VanDerWaalsContact O-O 3.07Å
405	P	59.6	Low	62.3	Low	72 Å²	72	77 Å²	77	47%	0.468	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-10.2	-178.6	-19.8	33.2	0	0	0	113.6	S402	S402-P405 WeakPolarHBondContact O-CD 3.41Å; S402-P405 WeakPolarHBondContact O-CG 3.37Å
406	I	49.4	Very low	62	Low	155 Å²	155	79.8 Å²	79.8	80%	0.795	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-40.7	-174.6	-58.2	175	0	0	0	110.4	D404	D404-I406 PolarHBondContact O-N 2.87Å; D404-I406 PolarHBondContact OD1-N 2.77Å
407	K	51.3	Low	62	Low	166 Å²	166	77.3 Å²	77.3	72%	0.722	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-17.6	-178.1	-51.2	-178.7	-174.9	176.9	0	114.1	D404	D404-K407 PolarHBondContact O-N 2.79Å; D404-K407 PolarHBondContact OD1-N 2.77Å; D404-K407 WeakPolarHBondContact OD2-CB 3.24Å; D404-K407 WeakPolarHBondContact OD2-CD 3.27Å
408	K	68.2	Low	62.7	Low	117 Å²	117	77.5 Å²	77.5	51%	0.509	39%	0.389	S	S	.	.	S	Bend	trans	-141.7	61.9	178	-60.5	-176.2	-178.8	177.2	0	110.2	S402 D404 R411	S402-K408 WeakPolarHBondContact CB-O 3.47Å; S402-K408 PolarHBondContact OG-O 3.15Å; D404-K408 HydrophobicContact CB-CB 4.45Å; D404-K408 CarbonylContact O-C 3.39Å; D404-K408 VanDerWaalsContact O-CA 3.27Å; D404-K408 WeakPolarHBondContact O-CA 3.25Å; D404-K408 PolarHBondContact O-N 2.8Å; D404-K408 VanDerWaalsContact O-O 3.07Å; K408-R411 HydrophobicContact CB-CG 3.73Å; K408-R411 WeakPolarHBondContact O-CG 3.43Å
409	P	68.6	Low	62.7	Low	32 Å²	32	76 Å²	76	21%	0.208	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	163.2	167.8	27	-34.3	0	0	0	111.5	C392 D400 R411	C392-P409 WeakPolarHBondContact CB-O 3.34Å; C392-P409 CarbonylContact O-C 3.56Å; C392-P409 WeakPolarHBondContact O-CB 3.43Å; C392-P409 WeakPolarHBondContact O-CG 3.35Å; C392-P409 VanDerWaalsContact O-O 3.07Å; D400-P409 VanDerWaalsContact OD2-CA 3.23Å; D400-P409 WeakPolarHBondContact OD2-CA 3.46Å; D400-P409 VanDerWaalsContact OD2-CB 3.32Å; D400-P409 WeakPolarHBondContact OD2-CB 3.44Å; P409-R411 PolarHBondContact O-N 2.86Å; P409-R411 VanDerWaalsContact O-N 3.1Å
410	G	78.1	Confident	62.8	Low	0 Å²	0	71.3 Å²	71.3	0%	0	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	19.3	173.8	0	0	0	0	0	116.5	D378 A381 C392 D400 S402	D378-G410 PolarHBondContact N-O 3.27Å; A381-G410 VanDerWaalsContact CB-O 3.26Å; A381-G410 WeakPolarHBondContact CB-O 2.96Å; C392-G410 VanDerWaalsContact CB-O 3.22Å; C392-G410 WeakPolarHBondContact CB-O 3.44Å; C392-G410 PolarHBondContact O-N 2.94Å; D400-G410 PolarHBondContact OD2-N 3.06Å; S402-G410 PolarHBondContact OG-N 2.65Å
411	R	78.6	Confident	62.6	Low	67 Å²	67	73 Å²	73	25%	0.253	38%	0.379	S	S	.	.	S	Bend	trans	-80.6	-26.8	172	-59.7	-63.1	178.4	157.5	-10	112.7	L376 Y390 S402 K408 P409	L376-R411 WeakPolarHBondContact O-CD 3.5Å; L376-R411 PolarHBondContact O-NH1 2.88Å; Y390-R411 VanDerWaalsContact CE2-NH1 3.28Å; Y390-R411 PolarHBondContact OH-NH1 3.44Å; S402-R411 PolarHBondContact OG-N 3.06Å; K408-R411 HydrophobicContact CB-CG 3.73Å; K408-R411 WeakPolarHBondContact O-CG 3.43Å; P409-R411 PolarHBondContact O-N 2.86Å; P409-R411 VanDerWaalsContact O-N 3.1Å
412	K	70.8	Confident	61.9	Low	113 Å²	113	71.5 Å²	71.5	49%	0.491	37%	0.373	S	S	.	.	S	Bend	trans	-148.2	118.3	174	-165.3	-179.3	-178.4	-169.3	0	109.6	D378 I401 S402	D378-K412 WeakPolarHBondContact OD2-CA 3.45Å; I401-K412 CarbonylContact C-O 3.58Å; I401-K412 HydrophobicContact CD1-CD 3.67Å; I401-K412 HydrophobicContact CD1-CG 4.05Å; I401-K412 HydrophobicContact CG1-CB 4.22Å; I401-K412 HydrophobicContact CG1-CD 4Å; I401-K412 HydrophobicContact CG1-CG 3.91Å; I401-K412 PolarHBondContact N-O 2.95Å; S402-K412 PolarHBondContact N-O 2.57Å; S402-K412 PolarHBondContact OG-N 3.46Å; S402-K412 VanDerWaalsContact OG-N 3.09Å
413	C	67.6	Low	61.2	Low	7 Å²	7	76.2 Å²	76.2	5%	0.047	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	99.6	-174.4	-62.7	0	0	0	0	109.1	D378 N380 C394 Y398	D378-C413 HydrophobicContact CB-CB 3.91Å; D378-C413 VanDerWaalsContact CG-N 3.32Å; D378-C413 PolarHBondContact OD2-N 3.03Å; N380-C413 HydrophobicContact CB-CB 4.11Å; C394-C413 WeakPolarHBondContact CA-SG 3.37Å; C394-C413 HydrophobicContact CB-CB 3.85Å; C394-C413 WeakPolarHBondContact CB-SG 3.37Å; C394-C413 VanDerWaalsContact SG-CA 3.6Å; C394-C413 WeakPolarHBondContact SG-CB 3.26Å; C394-C413 CovalentContact SG-SG 2.03Å; C394-C413 PolarHBondContact SG-SG 3.02Å; Y398-C413 HydrophobicContact CD1-CB 4.37Å
414	T	64.5	Low	61.1	Low	57 Å²	57	80.1 Å²	80.1	35%	0.35	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	129.1	169.5	35.2	0	0	0	0	109.4	Y398 K399 I401	Y398-T414 CarbonylContact C-O 3.17Å; Y398-T414 VanDerWaalsContact CA-O 3.28Å; Y398-T414 WeakPolarHBondContact CA-O 3.44Å; K399-T414 PolarHBondContact N-O 2.92Å; K399-T414 PolarHBondContact O-N 3.36Å; K399-T414 PolarHBondContact O-OG1 2.91Å; I401-T414 HydrophobicContact CD1-CG2 3.45Å; I401-T414 VanDerWaalsContact CD1-CG2 3.45Å; I401-T414 HydrophobicContact CG1-CG2 3.89Å; I401-T414 WeakPolarHBondContact CG2-OG1 3.38Å
415	Q	50.3	Low	61	Low	107 Å²	107	81.7 Å²	81.7	50%	0.5	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	144.6	166.4	-165.3	177	-9.7	0	0	109.3	Y398 I417	Y398-Q415 HydrophobicContact CD1-CB 3.75Å; Y398-Q415 HydrophobicContact CD1-CG 4.27Å; Y398-Q415 VanDerWaalsContact CD1-N 3.3Å; Y398-Q415 HydrophobicContact CE1-CB 3.44Å; Y398-Q415 VanDerWaalsContact CE1-CB 3.44Å; Y398-Q415 HydrophobicContact CE1-CG 3.75Å; Y398-Q415 HydrophobicContact CE2-CG 4.49Å; Q415-I417 HydrophobicContact CB-CG1 3.93Å; Q415-I417 HydrophobicContact CG-CG1 4.39Å; Q415-I417 PolarHBondContact O-N 3.23Å
416	L	56.7	Low	60.6	Low	116 Å²	116	79.6 Å²	79.6	61%	0.607	39%	0.393	S	S	*	.			trans	-71.2	91.7	155.8	-74.4	95.9	0	0	0	106.6	G397 K399	G397-L416 WeakPolarHBondContact O-CD1 3.3Å; G397-L416 PolarHBondContact O-N 3.08Å; K399-L416 HydrophobicContact CB-CD1 4.29Å
417	I	53.1	Low	60.7	Low	74 Å²	74	78 Å²	78	38%	0.379	39%	0.386	S	S	.	.			trans	-78.7	118.5	175	-57.3	177.5	0	0	0	106.7	Q415 E419 M425	Q415-I417 HydrophobicContact CB-CG1 3.93Å; Q415-I417 HydrophobicContact CG-CG1 4.39Å; Q415-I417 PolarHBondContact O-N 3.23Å; I417-E419 HydrophobicContact CG2-CG 4.49Å; I417-E419 PolarHBondContact O-N 3.22Å; I417-M425 HydrophobicContact CD1-CE 4.4Å; I417-M425 HydrophobicContact CD1-SD 4.46Å; I417-M425 HydrophobicContact CG2-SD 3.82Å
418	N	59.8	Low	61.1	Low	49 Å²	49	71.1 Å²	71.1	26%	0.262	36%	0.359	S	S	.	.			trans	-75.5	103.6	160.6	169.9	-54.6	0	0	0	106.7	C420 T421 D436	N418-C420 PolarHBondContact O-N 3.2Å; N418-C420 WeakPolarHBondContact OD1-CA 3.39Å; N418-C420 VanDerWaalsContact OD1-CB 3.23Å; N418-C420 WeakPolarHBondContact OD1-CB 3.43Å; N418-C420 PolarHBondContact OD1-N 3.14Å; N418-C420 VanDerWaalsContact OD1-N 3.12Å; N418-T421 HydrophobicContact CB-CG2 4.23Å; N418-T421 PolarHBondContact O-N 3.27Å; N418-T421 PolarHBondContact O-OG1 3.21Å; N418-T421 WeakPolarHBondContact OD1-CG2 3.3Å; N418-T421 PolarHBondContact OD1-N 3.01Å; N418-D436 WeakPolarHBondContact ND2-CB 3.49Å; N418-D436 PolarHBondContact ND2-OD2 3.45Å
419	E	69.4	Low	60.8	Low	33 Å²	33	66.6 Å²	66.6	15%	0.154	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-64.5	-23	-174.6	-57.6	96.3	141.9	0	0	112.1	I417 T421 V422 M425 N426 S440 Y441	I417-E419 HydrophobicContact CG2-CG 4.49Å; I417-E419 PolarHBondContact O-N 3.22Å; E419-T421 PolarHBondContact O-N 3.31Å; E419-V422 PolarHBondContact O-N 3.3Å; E419-V422 VanDerWaalsContact O-N 3.15Å; E419-M425 HydrophobicContact CB-CB 3.97Å; E419-M425 HydrophobicContact CG-CB 4.26Å; E419-N426 HydrophobicContact CB-CB 4.5Å; E419-N426 PolarHBondContact O-ND2 3.35Å; E419-S440 WeakPolarHBondContact OE1-CB 3.27Å; E419-S440 PolarHBondContact OE1-OG 2.82Å; E419-Y441 HydrophobicContact CB-CD1 3.5Å; E419-Y441 HydrophobicContact CB-CE1 4.07Å; E419-Y441 HydrophobicContact CB-CG 4.03Å; E419-Y441 HydrophobicContact CG-CD1 3.72Å; E419-Y441 HydrophobicContact CG-CE1 4.23Å
420	C	66.2	Low	60.4	Low	35 Å²	35	70.1 Å²	70.1	24%	0.236	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-66.9	-18.2	174.2	-50.2	0	0	0	0	114	N418 V422 C434 V435	N418-C420 PolarHBondContact O-N 3.2Å; N418-C420 WeakPolarHBondContact OD1-CA 3.39Å; N418-C420 VanDerWaalsContact OD1-CB 3.23Å; N418-C420 WeakPolarHBondContact OD1-CB 3.43Å; N418-C420 PolarHBondContact OD1-N 3.14Å; N418-C420 VanDerWaalsContact OD1-N 3.12Å; C420-V422 VanDerWaalsContact C-N 3.32Å; C420-C434 WeakPolarHBondContact CA-SG 3.27Å; C420-C434 HydrophobicContact CB-CB 3.53Å; C420-C434 WeakPolarHBondContact CB-SG 3.44Å; C420-C434 WeakPolarHBondContact SG-CB 3.27Å; C420-C434 PolarHBondContact SG-O 2.9Å; C420-C434 CovalentContact SG-SG 2.04Å; C420-C434 PolarHBondContact SG-SG 3.34Å; C420-V435 PolarHBondContact SG-N 2.71Å; C420-V435 VanDerWaalsContact SG-N 3.43Å
421	T	59.2	Low	59.6	Low	80 Å²	80	74 Å²	74	49%	0.491	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-77.4	-14.2	172.2	58.9	0	0	0	0	113.9	N418 E419	N418-T421 HydrophobicContact CB-CG2 4.23Å; N418-T421 PolarHBondContact O-N 3.27Å; N418-T421 PolarHBondContact O-OG1 3.21Å; N418-T421 WeakPolarHBondContact OD1-CG2 3.3Å; N418-T421 PolarHBondContact OD1-N 3.01Å; E419-T421 PolarHBondContact O-N 3.31Å
422	V	53.6	Low	58.8	Low	35 Å²	35	71.1 Å²	71.1	21%	0.212	37%	0.372	C	S	.	.	S	Bend	trans	-126.6	105.6	-174	-174.6	0	0	0	0	110.3	E419 C420 W424 M425 N426	E419-V422 PolarHBondContact O-N 3.3Å; E419-V422 VanDerWaalsContact O-N 3.15Å; C420-V422 VanDerWaalsContact C-N 3.32Å; V422-W424 HydrophobicContact CG1-CD2 3.83Å; V422-W424 HydrophobicContact CG1-CE3 4.45Å; V422-W424 HydrophobicContact CG1-CG 4.19Å; V422-W424 HydrophobicContact CG1-CH2 4.35Å; V422-W424 HydrophobicContact CG1-CZ2 3.69Å; V422-W424 PolarHBondContact O-N 2.86Å; V422-M425 HydrophobicContact CB-CB 4.12Å; V422-M425 HydrophobicContact CB-CG 4.03Å; V422-M425 HydrophobicContact CB-SD 3.85Å; V422-M425 HydrophobicContact CG1-CB 4.38Å; V422-M425 HydrophobicContact CG1-CG 3.87Å; V422-M425 HydrophobicContact CG1-SD 3.89Å; V422-M425 HydrophobicContact CG2-SD 4.02Å; V422-M425 PolarHBondContact O-N 3.36Å; V422-N426 PolarHBondContact O-ND2 2.91Å; V422-N426 VanDerWaalsContact O-ND2 3.1Å
423	P	52	Low	58.6	Low	103 Å²	103	71 Å²	71	67%	0.669	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	10	-171	-25.8	35.8	0	0	0	118.6
424	W	51.9	Low	58.8	Low	212 Å²	212	72 Å²	72	80%	0.803	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	7.8	173.1	59.7	76.7	0	0	0	112.6	V422	V422-W424 HydrophobicContact CG1-CD2 3.83Å; V422-W424 HydrophobicContact CG1-CE3 4.45Å; V422-W424 HydrophobicContact CG1-CG 4.19Å; V422-W424 HydrophobicContact CG1-CH2 4.35Å; V422-W424 HydrophobicContact CG1-CZ2 3.69Å; V422-W424 PolarHBondContact O-N 2.86Å
425	M	51.1	Low	59	Low	86 Å²	86	71.7 Å²	71.7	42%	0.424	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-22.9	167.5	-68.7	178.5	159.8	0	0	111.5	I417 E419 V422 Y441	I417-M425 HydrophobicContact CD1-CE 4.4Å; I417-M425 HydrophobicContact CD1-SD 4.46Å; I417-M425 HydrophobicContact CG2-SD 3.82Å; E419-M425 HydrophobicContact CB-CB 3.97Å; E419-M425 HydrophobicContact CG-CB 4.26Å; V422-M425 HydrophobicContact CB-CB 4.12Å; V422-M425 HydrophobicContact CB-CG 4.03Å; V422-M425 HydrophobicContact CB-SD 3.85Å; V422-M425 HydrophobicContact CG1-CB 4.38Å; V422-M425 HydrophobicContact CG1-CG 3.87Å; V422-M425 HydrophobicContact CG1-SD 3.89Å; V422-M425 HydrophobicContact CG2-SD 4.02Å; V422-M425 PolarHBondContact O-N 3.36Å; M425-Y441 WeakPolarHBondContact O-CE1 3.32Å
426	N	51.3	Low	59.3	Low	27 Å²	27	70.5 Å²	70.5	14%	0.144	38%	0.375	C	S	.	.			trans	-99.9	133.6	161.1	68.4	99.9	0	0	0	110.6	E419 V422 C434 Y441	E419-N426 HydrophobicContact CB-CB 4.5Å; E419-N426 PolarHBondContact O-ND2 3.35Å; V422-N426 PolarHBondContact O-ND2 2.91Å; V422-N426 VanDerWaalsContact O-ND2 3.1Å; N426-C434 HydrophobicContact CB-CB 4.38Å; N426-C434 VanDerWaalsContact CB-SG 3.51Å; N426-Y441 VanDerWaalsContact CA-CZ 3.5Å; N426-Y441 HydrophobicContact CB-CD2 3.73Å; N426-Y441 HydrophobicContact CB-CE1 4.4Å; N426-Y441 HydrophobicContact CB-CE2 3.56Å; N426-Y441 HydrophobicContact CB-CG 4.24Å
427	D	52.2	Low	59.3	Low	122 Å²	122	67.7 Å²	67.7	65%	0.652	36%	0.363	S	S	*	.			trans	-105.4	41.2	177.1	-155.5	10.9	0	0	0	110.9	Y441	D427-Y441 PolarHBondContact N-OH 2.75Å
428	C	60.7	Low	59.1	Low	22 Å²	22	71 Å²	71	15%	0.149	39%	0.387	C	S	.	.			trans	-76	141.5	180	-66.6	0	0	0	0	111.2	A432 C443	C428-A432 HydrophobicContact CB-CB 4.07Å; C428-C443 WeakPolarHBondContact CA-SG 3.49Å; C428-C443 HydrophobicContact CB-CB 3.83Å; C428-C443 WeakPolarHBondContact CB-SG 3.3Å; C428-C443 VanDerWaalsContact SG-CA 3.58Å; C428-C443 WeakPolarHBondContact SG-CB 3.48Å; C428-C443 CovalentContact SG-SG 2.04Å; C428-C443 PolarHBondContact SG-SG 2.98Å
429	S	62	Low	58.7	Low	21 Å²	21	77.4 Å²	77.4	15%	0.147	42%	0.415	C	S	.	.			trans	-49.2	145.5	170.9	168.2	0	0	0	0	111.3	F431 A432 Q466	S429-F431 PolarHBondContact O-N 3.11Å; S429-F431 PolarHBondContact OG-N 3.33Å; S429-F431 VanDerWaalsContact OG-N 3.14Å; S429-A432 WeakPolarHBondContact O-CB 3.48Å; S429-A432 PolarHBondContact O-N 3.43Å; S429-Q466 VanDerWaalsContact CB-O 3.26Å; S429-Q466 WeakPolarHBondContact CB-O 3.08Å
430	P	59	Low	57.9	Low	106 Å²	106	77.4 Å²	77.4	69%	0.688	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-20.6	170.3	-26.5	35.2	0	0	0	113.7	K446	P430-K446 PolarHBondContact O-NZ 2.88Å
431	F	61.6	Low	57.9	Low	83 Å²	83	77.6 Å²	77.6	36%	0.364	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-0.8	-179.7	-54.8	-50	0	0	0	114.3	S429 K446 Y449 C468	S429-F431 PolarHBondContact O-N 3.11Å; S429-F431 PolarHBondContact OG-N 3.33Å; S429-F431 VanDerWaalsContact OG-N 3.14Å; F431-K446 WeakPolarHBondContact O-CB 3.41Å; F431-K446 WeakPolarHBondContact O-CG 3.38Å; F431-K446 PolarHBondContact O-N 2.97Å; F431-Y449 HydrophobicContact CB-CD1 3.34Å; F431-Y449 HydrophobicContact CB-CE1 3.59Å; F431-Y449 HydrophobicContact CB-CG 3.92Å; F431-Y449 AromaticContact CD1-CD1 3.84Å; F431-Y449 HydrophobicContact CD1-CD1 3.84Å; F431-Y449 AromaticContact CD1-CE1 3.07Å; F431-Y449 HydrophobicContact CD1-CE1 3.07Å; F431-Y449 HydrophobicContact CD1-CE2 4.47Å; F431-Y449 AromaticContact CD1-CZ 3.49Å; F431-Y449 VanDerWaalsContact CD1-CZ 3.49Å; F431-Y449 HydrophobicContact CD2-CD1 4.23Å; F431-Y449 HydrophobicContact CD2-CE1 4Å; F431-Y449 AromaticContact CE1-CE1 3.66Å; F431-Y449 HydrophobicContact CE1-CE1 3.66Å; F431-Y449 HydrophobicContact CE2-CE1 4.47Å; F431-Y449 AromaticContact CG-CD1 3.54Å; F431-Y449 HydrophobicContact CG-CD1 3.54Å; F431-Y449 AromaticContact CG-CE1 3.26Å; F431-Y449 HydrophobicContact CG-CE1 3.26Å; F431-Y449 HydrophobicContact CZ-CE1 4.32Å; F431-C468 HydrophobicContact CB-CB 3.85Å; F431-C468 WeakPolarHBondContact CB-O 3.35Å; F431-C468 WeakPolarHBondContact CD2-O 3.43Å
432	A	62.2	Low	57.9	Low	5 Å²	5	78.6 Å²	78.6	4%	0.041	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	167.6	167.2	0	0	0	0	0	111.5	C428 S429 C443 Q444 K446	C428-A432 HydrophobicContact CB-CB 4.07Å; S429-A432 WeakPolarHBondContact O-CB 3.48Å; S429-A432 PolarHBondContact O-N 3.43Å; A432-C443 HydrophobicContact CB-CB 4.06Å; A432-Q444 CarbonylContact C-O 3.56Å; A432-Q444 VanDerWaalsContact CA-O 3.26Å; A432-Q444 WeakPolarHBondContact CA-O 3.02Å; A432-K446 WeakPolarHBondContact O-CE 3.33Å; A432-K446 PolarHBondContact O-NZ 3.27Å
433	E	66	Low	58.6	Low	111 Å²	111	77.2 Å²	77.2	52%	0.519	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129	172	-179.5	156.2	-158.7	0	0	107.4	Q444 K446	E433-Q444 PolarHBondContact N-O 2.9Å; E433-Q444 PolarHBondContact O-N 2.88Å; E433-K446 HydrophobicContact CB-CG 4.25Å
434	C	72.7	Confident	59	Low	28 Å²	28	78.1 Å²	78.1	19%	0.189	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129	-177.5	-176.4	0	0	0	0	109.6	C420 N426 M442	C420-C434 WeakPolarHBondContact CA-SG 3.27Å; C420-C434 HydrophobicContact CB-CB 3.53Å; C420-C434 WeakPolarHBondContact CB-SG 3.44Å; C420-C434 WeakPolarHBondContact SG-CB 3.27Å; C420-C434 PolarHBondContact SG-O 2.9Å; C420-C434 CovalentContact SG-SG 2.04Å; C420-C434 PolarHBondContact SG-SG 3.34Å; N426-C434 HydrophobicContact CB-CB 4.38Å; N426-C434 VanDerWaalsContact CB-SG 3.51Å; C434-M442 WeakPolarHBondContact CA-O 3.23Å
435	V	67.2	Low	59.6	Low	50 Å²	50	69.3 Å²	69.3	30%	0.303	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.5	178.8	-174.6	0	0	0	0	109.7	C420 Y441 M442 Q444	C420-V435 PolarHBondContact SG-N 2.71Å; C420-V435 VanDerWaalsContact SG-N 3.43Å; V435-Y441 CarbonylContact O-C 3.46Å; V435-Y441 WeakPolarHBondContact O-CA 3.31Å; V435-M442 HydrophobicContact CB-CG 3.77Å; V435-M442 HydrophobicContact CB-SD 4.41Å; V435-M442 PolarHBondContact N-O 3.33Å; V435-M442 PolarHBondContact O-N 2.88Å; V435-Q444 HydrophobicContact CG2-CB 4.3Å
436	D	58.1	Low	60	Low	82 Å²	82	68.5 Å²	68.5	44%	0.439	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	145	-174.8	-167	20.4	0	0	0	112.1	N418	N418-D436 WeakPolarHBondContact ND2-CB 3.49Å; N418-D436 PolarHBondContact ND2-OD2 3.45Å
437	T	55.8	Low	60.1	Low	58 Å²	58	70.6 Å²	70.6	36%	0.356	39%	0.388	S	S	.	.			trans	-140.3	174.2	-180	89.6	0	0	0	0	112.2	E439 S440 M442	T437-E439 PolarHBondContact O-N 3.19Å; T437-E439 PolarHBondContact OG1-N 3.12Å; T437-S440 WeakPolarHBondContact CA-O 3.43Å; T437-S440 WeakPolarHBondContact CB-O 3.03Å; T437-S440 WeakPolarHBondContact CG2-O 3.47Å; T437-S440 PolarHBondContact N-O 2.92Å; T437-S440 PolarHBondContact OG1-N 2.98Å; T437-S440 PolarHBondContact OG1-O 3.25Å; T437-M442 HydrophobicContact CG2-CE 3.56Å; T437-M442 HydrophobicContact CG2-CG 4.45Å
438	T	49.2	Very low	59.6	Low	143 Å²	143	66.8 Å²	66.8	88%	0.877	38%	0.378	S	S	*	.	S	Bend	trans	-72.3	-10.3	-176.2	46.1	0	0	0	0	115
439	E	51.2	Low	59.1	Low	183 Å²	183	69.1 Å²	69.1	86%	0.855	38%	0.384	S	S	*	.	S	Bend	trans	-127.3	-23.1	178.5	-60	-161.6	147.3	0	0	115.3	T437	T437-E439 PolarHBondContact O-N 3.19Å; T437-E439 PolarHBondContact OG1-N 3.12Å
440	S	52.8	Low	58.7	Low	34 Å²	34	72.2 Å²	72.2	24%	0.238	40%	0.401	C	S	.	.	S	Bend	trans	-174.2	-155.5	167.9	-170.6	0	0	0	0	109.5	E419 T437	E419-S440 WeakPolarHBondContact OE1-CB 3.27Å; E419-S440 PolarHBondContact OE1-OG 2.82Å; T437-S440 WeakPolarHBondContact CA-O 3.43Å; T437-S440 WeakPolarHBondContact CB-O 3.03Å; T437-S440 WeakPolarHBondContact CG2-O 3.47Å; T437-S440 PolarHBondContact N-O 2.92Å; T437-S440 PolarHBondContact OG1-N 2.98Å; T437-S440 PolarHBondContact OG1-O 3.25Å
441	Y	66.3	Low	58.7	Low	38 Å²	38	70.1 Å²	70.1	15%	0.149	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	168.6	177.9	71.6	-79.4	0	0	0	114.2	E419 M425 N426 D427 V435	E419-Y441 HydrophobicContact CB-CD1 3.5Å; E419-Y441 HydrophobicContact CB-CE1 4.07Å; E419-Y441 HydrophobicContact CB-CG 4.03Å; E419-Y441 HydrophobicContact CG-CD1 3.72Å; E419-Y441 HydrophobicContact CG-CE1 4.23Å; M425-Y441 WeakPolarHBondContact O-CE1 3.32Å; N426-Y441 VanDerWaalsContact CA-CZ 3.5Å; N426-Y441 HydrophobicContact CB-CD2 3.73Å; N426-Y441 HydrophobicContact CB-CE1 4.4Å; N426-Y441 HydrophobicContact CB-CE2 3.56Å; N426-Y441 HydrophobicContact CB-CG 4.24Å; D427-Y441 PolarHBondContact N-OH 2.75Å; V435-Y441 CarbonylContact O-C 3.46Å; V435-Y441 WeakPolarHBondContact O-CA 3.31Å
442	M	59.5	Low	58.2	Low	101 Å²	101	68.2 Å²	68.2	50%	0.498	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	158.6	169.1	69.6	170	80	0	0	112.1	C434 V435 T437	C434-M442 WeakPolarHBondContact CA-O 3.23Å; V435-M442 HydrophobicContact CB-CG 3.77Å; V435-M442 HydrophobicContact CB-SD 4.41Å; V435-M442 PolarHBondContact N-O 3.33Å; V435-M442 PolarHBondContact O-N 2.88Å; T437-M442 HydrophobicContact CG2-CE 3.56Å; T437-M442 HydrophobicContact CG2-CG 4.45Å
443	C	68.4	Low	57.6	Low	7 Å²	7	69.8 Å²	69.8	5%	0.047	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	98.7	-179.5	-57.7	0	0	0	0	111.9	C428 A432 Q466	C428-C443 WeakPolarHBondContact CA-SG 3.49Å; C428-C443 HydrophobicContact CB-CB 3.83Å; C428-C443 WeakPolarHBondContact CB-SG 3.3Å; C428-C443 VanDerWaalsContact SG-CA 3.58Å; C428-C443 WeakPolarHBondContact SG-CB 3.48Å; C428-C443 CovalentContact SG-SG 2.04Å; C428-C443 PolarHBondContact SG-SG 2.98Å; A432-C443 HydrophobicContact CB-CB 4.06Å; C443-Q466 HydrophobicContact CB-CB 4.19Å; C443-Q466 PolarHBondContact O-OE1 2.82Å
444	Q	59.1	Low	56.4	Low	121 Å²	121	69.9 Å²	69.9	57%	0.565	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	131.1	177.9	-176.2	176	8.1	0	0	110.9	A432 E433 V435 K446	A432-Q444 CarbonylContact C-O 3.56Å; A432-Q444 VanDerWaalsContact CA-O 3.26Å; A432-Q444 WeakPolarHBondContact CA-O 3.02Å; E433-Q444 PolarHBondContact N-O 2.9Å; E433-Q444 PolarHBondContact O-N 2.88Å; V435-Q444 HydrophobicContact CG2-CB 4.3Å; Q444-K446 PolarHBondContact O-N 2.93Å
445	C	64.5	Low	54.8	Low	27 Å²	27	73.5 Å²	73.5	18%	0.182	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	134.3	175.3	-61.7	0	0	0	0	112.4	Y449 D451 C468	C445-Y449 WeakPolarHBondContact CB-O 2.98Å; C445-D451 VanDerWaalsContact SG-CA 3.55Å; C445-D451 VanDerWaalsContact SG-CB 3.6Å; C445-D451 PolarHBondContact SG-N 3.21Å; C445-D451 VanDerWaalsContact SG-N 3.45Å; C445-C468 WeakPolarHBondContact CA-SG 3.32Å; C445-C468 HydrophobicContact CB-CB 3.68Å; C445-C468 WeakPolarHBondContact CB-SG 3.2Å; C445-C468 VanDerWaalsContact SG-CA 3.56Å; C445-C468 WeakPolarHBondContact SG-CB 3.32Å; C445-C468 CovalentContact SG-SG 2.03Å; C445-C468 PolarHBondContact SG-SG 3.09Å
446	K	59.9	Low	53.4	Low	70 Å²	70	78.6 Å²	78.6	30%	0.304	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-62.4	141.6	175.2	-71	166.6	173.3	132.4	0	109.4	P430 F431 A432 E433 Q444 G448 Y449	P430-K446 PolarHBondContact O-NZ 2.88Å; F431-K446 WeakPolarHBondContact O-CB 3.41Å; F431-K446 WeakPolarHBondContact O-CG 3.38Å; F431-K446 PolarHBondContact O-N 2.97Å; A432-K446 WeakPolarHBondContact O-CE 3.33Å; A432-K446 PolarHBondContact O-NZ 3.27Å; E433-K446 HydrophobicContact CB-CG 4.25Å; Q444-K446 PolarHBondContact O-N 2.93Å; K446-G448 PolarHBondContact O-N 3.33Å; K446-Y449 HydrophobicContact CB-CD2 4.02Å; K446-Y449 WeakPolarHBondContact O-CA 3.48Å; K446-Y449 VanDerWaalsContact O-CB 3.28Å; K446-Y449 WeakPolarHBondContact O-CB 3.08Å; K446-Y449 PolarHBondContact O-N 2.8Å
447	A	52.9	Low	52	Low	71 Å²	71	79.6 Å²	79.6	59%	0.587	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	135.8	170.7	0	0	0	0	0	111.1
448	G	43.4	Very low	50.7	Low	42 Å²	42	86.4 Å²	86.4	43%	0.433	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-4.1	-165	0	0	0	0	0	114.3	K446 S471	K446-G448 PolarHBondContact O-N 3.33Å; G448-S471 PolarHBondContact O-N 2.99Å; G448-S471 PolarHBondContact O-OG 2.63Å
449	Y	48.9	Very low	49.6	Very low	71 Å²	71	83.7 Å²	83.7	28%	0.278	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.3	176	-60	-105.1	0	0	0	110.9	F431 C445 K446 F469 A470	F431-Y449 HydrophobicContact CB-CD1 3.34Å; F431-Y449 HydrophobicContact CB-CE1 3.59Å; F431-Y449 HydrophobicContact CB-CG 3.92Å; F431-Y449 AromaticContact CD1-CD1 3.84Å; F431-Y449 HydrophobicContact CD1-CD1 3.84Å; F431-Y449 AromaticContact CD1-CE1 3.07Å; F431-Y449 HydrophobicContact CD1-CE1 3.07Å; F431-Y449 HydrophobicContact CD1-CE2 4.47Å; F431-Y449 AromaticContact CD1-CZ 3.49Å; F431-Y449 VanDerWaalsContact CD1-CZ 3.49Å; F431-Y449 HydrophobicContact CD2-CD1 4.23Å; F431-Y449 HydrophobicContact CD2-CE1 4Å; F431-Y449 AromaticContact CE1-CE1 3.66Å; F431-Y449 HydrophobicContact CE1-CE1 3.66Å; F431-Y449 HydrophobicContact CE2-CE1 4.47Å; F431-Y449 AromaticContact CG-CD1 3.54Å; F431-Y449 HydrophobicContact CG-CD1 3.54Å; F431-Y449 AromaticContact CG-CE1 3.26Å; F431-Y449 HydrophobicContact CG-CE1 3.26Å; F431-Y449 HydrophobicContact CZ-CE1 4.32Å; C445-Y449 WeakPolarHBondContact CB-O 2.98Å; K446-Y449 HydrophobicContact CB-CD2 4.02Å; K446-Y449 WeakPolarHBondContact O-CA 3.48Å; K446-Y449 VanDerWaalsContact O-CB 3.28Å; K446-Y449 WeakPolarHBondContact O-CB 3.08Å; K446-Y449 PolarHBondContact O-N 2.8Å; Y449-F469 CarbonylContact C-O 3.56Å; Y449-F469 WeakPolarHBondContact CA-O 3Å; Y449-A470 HydrophobicContact CD1-CB 3.8Å; Y449-A470 HydrophobicContact CE1-CB 3.35Å
450	V	53.5	Low	48.3	Very low	85 Å²	85	77.1 Å²	77.1	52%	0.515	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	146.1	179.6	-69.3	0	0	0	0	111.5	V452 C468 F469	V450-V452 HydrophobicContact CG2-CG1 4.08Å; V450-V452 PolarHBondContact O-N 2.9Å; V450-C468 VanDerWaalsContact O-CA 3.31Å; V450-C468 WeakPolarHBondContact O-CA 3.09Å; V450-F469 PolarHBondContact N-O 3.3Å; V450-F469 PolarHBondContact O-N 2.84Å
451	D	58.8	Low	46.9	Very low	63 Å²	63	82 Å²	82	34%	0.337	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	110.8	172.6	-171.2	-5.1	0	0	0	109.4	C445 S453 Q466	C445-D451 VanDerWaalsContact SG-CA 3.55Å; C445-D451 VanDerWaalsContact SG-CB 3.6Å; C445-D451 PolarHBondContact SG-N 3.21Å; C445-D451 VanDerWaalsContact SG-N 3.45Å; D451-S453 WeakPolarHBondContact OD1-CB 3.08Å; D451-S453 PolarHBondContact OD1-N 3.41Å; D451-S453 PolarHBondContact OD1-OG 2.04Å; D451-Q466 PolarHBondContact OD2-NE2 3.02Å
452	V	51.4	Low	45.2	Very low	42 Å²	42	87.5 Å²	87.5	26%	0.255	49%	0.485	S	S	.	.			trans	-97.2	10.1	178.2	-61.1	0	0	0	0	112.9	V450 S454 V455 K467	V450-V452 HydrophobicContact CG2-CG1 4.08Å; V450-V452 PolarHBondContact O-N 2.9Å; V452-S454 PolarHBondContact O-N 2.73Å; V452-V455 WeakPolarHBondContact O-CB 3.32Å; V452-V455 PolarHBondContact O-N 3.2Å; V452-V455 VanDerWaalsContact O-N 3.1Å; V452-K467 HydrophobicContact CG2-CB 4.16Å; V452-K467 WeakPolarHBondContact CG2-O 3.12Å; V452-K467 PolarHBondContact N-O 2.85Å; V452-K467 VanDerWaalsContact N-O 3.15Å
453	S	50.3	Low	43.7	Very low	38 Å²	38	89.2 Å²	89.2	27%	0.266	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-63.8	-25	-177.8	-48.7	0	0	0	0	112.6	D451 V455 Y456 K467	D451-S453 WeakPolarHBondContact OD1-CB 3.08Å; D451-S453 PolarHBondContact OD1-N 3.41Å; D451-S453 PolarHBondContact OD1-OG 2.04Å; S453-V455 PolarHBondContact O-N 2.8Å; S453-Y456 CarbonylContact O-C 3.39Å; S453-Y456 PolarHBondContact O-N 2.9Å; S453-K467 PolarHBondContact OG-N 2.77Å
454	S	40.9	Very low	41.7	Very low	114 Å²	114	96 Å²	96	80%	0.797	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-66.1	-12.6	174.6	55.1	0	0	0	0	114.9	V452 Y456	V452-S454 PolarHBondContact O-N 2.73Å; S454-Y456 VanDerWaalsContact C-N 3.35Å
455	V	37.8	Very low	40.6	Very low	104 Å²	104	95 Å²	95	63%	0.63	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-78.8	-20.6	171.6	-178.8	0	0	0	0	111.6	V452 S453	V452-V455 WeakPolarHBondContact O-CB 3.32Å; V452-V455 PolarHBondContact O-N 3.2Å; V452-V455 VanDerWaalsContact O-N 3.1Å; S453-V455 PolarHBondContact O-N 2.8Å
456	Y	39	Very low	39.7	Very low	157 Å²	157	96.8 Å²	96.8	62%	0.616	51%	0.514	S	S	*	.	S	Bend	trans	-123.6	87.5	-171.8	-62.9	-84.2	0	0	0	111.1	S453 S454 W458	S453-Y456 CarbonylContact O-C 3.39Å; S453-Y456 PolarHBondContact O-N 2.9Å; S454-Y456 VanDerWaalsContact C-N 3.35Å; Y456-W458 PolarHBondContact O-N 2.98Å
457	A	29.1	Very low	39	Very low	103 Å²	103	99.6 Å²	99.6	85%	0.851	53%	0.526	S	S	*	.			trans	-66.5	94.6	-178	0	0	0	0	0	112.8
458	W	27.1	Very low	38.8	Very low	200 Å²	200	96.5 Å²	96.5	76%	0.758	50%	0.5	S	S	*	.			trans	-114.2	148.3	161.6	-79.5	35.9	0	0	0	108.9	Y456 Y465	Y456-W458 PolarHBondContact O-N 2.98Å; W458-Y465 HydrophobicContact CE3-CE1 4.02Å; W458-Y465 AromaticContact CE3-CZ 3.99Å; W458-Y465 AromaticContact CZ3-CE1 3.98Å; W458-Y465 HydrophobicContact CZ3-CE1 3.98Å; W458-Y465 WeakPolarHBondContact CZ3-OH 3.31Å
459	S	27.2	Very low	39.3	Very low	86 Å²	86	99.4 Å²	99.4	60%	0.601	50%	0.501	S	S	*	.			trans	-132.9	148.2	-173.8	57	0	0	0	0	113.3
460	T	23.2	Very low	39.1	Very low	46 Å²	46	97.2 Å²	97.2	28%	0.282	50%	0.498	S	S	.	.	S	Bend	trans	87.2	178.9	166.4	79.1	0	0	0	0	116.5	D2360 F2361	T460-D2360 PolarHBondContact OG1-N 2.85Å; T460-D2360 VanDerWaalsContact OG1-N 3.1Å; T460-F2361 HydrophobicContact CG2-CD2 4.26Å; T460-F2361 HydrophobicContact CG2-CE2 4.26Å
461	M	24.3	Very low	38.6	Very low	137 Å²	137	96.9 Å²	96.9	68%	0.675	50%	0.499	S	S	*	.	S	Bend	trans	-84.7	145.4	-145.9	-153.9	162.7	62.7	0	0	113.3
462	H	29.2	Very low	37.2	Very low	153 Å²	153	101.2 Å²	101.2	71%	0.708	52%	0.517	S	S	*	.	S	Bend	trans	68.2	56.6	176.6	-63	-76.2	0	0	0	118.5
463	Q	28.7	Very low	36.1	Very low	137 Å²	137	104.7 Å²	104.7	64%	0.64	53%	0.534	S	S	*	.			trans	-169.5	88.9	139.7	-108.9	169.5	23.5	0	0	110.6	Y465	Q463-Y465 PolarHBondContact O-N 2.83Å
464	W	27.4	Very low	35	Very low	150 Å²	150	108.2 Å²	108.2	57%	0.568	55%	0.55	S	S	*	.			trans	-94.4	94.3	-177	-59.6	-44.4	0	0	0	112.2
465	Y	34.2	Very low	34.3	Very low	99 Å²	99	107.4 Å²	107.4	39%	0.388	53%	0.53	S	S	.	.			trans	-97	117.4	162.3	56.5	-89.8	0	0	0	108.8	W458 Q463	W458-Y465 HydrophobicContact CE3-CE1 4.02Å; W458-Y465 AromaticContact CE3-CZ 3.99Å; W458-Y465 AromaticContact CZ3-CE1 3.98Å; W458-Y465 HydrophobicContact CZ3-CE1 3.98Å; W458-Y465 WeakPolarHBondContact CZ3-OH 3.31Å; Q463-Y465 PolarHBondContact O-N 2.83Å
466	Q	46.6	Very low	33.8	Very low	65 Å²	65	106.2 Å²	106.2	30%	0.304	53%	0.525	S	S	.	.			trans	-114.4	110.1	-175.5	-152.4	165.1	-5	0	0	110.2	S429 C443 D451 C468	S429-Q466 VanDerWaalsContact CB-O 3.26Å; S429-Q466 WeakPolarHBondContact CB-O 3.08Å; C443-Q466 HydrophobicContact CB-CB 4.19Å; C443-Q466 PolarHBondContact O-OE1 2.82Å; D451-Q466 PolarHBondContact OD2-NE2 3.02Å; Q466-C468 PolarHBondContact O-N 2.99Å
467	K	46.1	Very low	33.1	Very low	129 Å²	129	106.8 Å²	106.8	56%	0.561	53%	0.531	S	S	*	.			trans	-90.5	99	-170.3	-74.9	-175.2	-179.8	176.7	0	111.6	V452 S453	V452-K467 HydrophobicContact CG2-CB 4.16Å; V452-K467 WeakPolarHBondContact CG2-O 3.12Å; V452-K467 PolarHBondContact N-O 2.85Å; V452-K467 VanDerWaalsContact N-O 3.15Å; S453-K467 PolarHBondContact OG-N 2.77Å
468	C	47.4	Very low	32.8	Very low	5 Å²	5	109.7 Å²	109.7	3%	0.034	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	131.7	167.7	-55.3	0	0	0	0	111.1	F431 C445 V450 Q466	F431-C468 HydrophobicContact CB-CB 3.85Å; F431-C468 WeakPolarHBondContact CB-O 3.35Å; F431-C468 WeakPolarHBondContact CD2-O 3.43Å; C445-C468 WeakPolarHBondContact CA-SG 3.32Å; C445-C468 HydrophobicContact CB-CB 3.68Å; C445-C468 WeakPolarHBondContact CB-SG 3.2Å; C445-C468 VanDerWaalsContact SG-CA 3.56Å; C445-C468 WeakPolarHBondContact SG-CB 3.32Å; C445-C468 CovalentContact SG-SG 2.03Å; C445-C468 PolarHBondContact SG-SG 3.09Å; V450-C468 VanDerWaalsContact O-CA 3.31Å; V450-C468 WeakPolarHBondContact O-CA 3.09Å; Q466-C468 PolarHBondContact O-N 2.99Å
469	F	53.8	Low	32.8	Very low	104 Å²	104	107.7 Å²	107.7	46%	0.456	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.4	-177.5	-170.2	-89.5	0	0	0	113.7	Y449 V450	Y449-F469 CarbonylContact C-O 3.56Å; Y449-F469 WeakPolarHBondContact CA-O 3Å; V450-F469 PolarHBondContact N-O 3.3Å; V450-F469 PolarHBondContact O-N 2.84Å
470	A	45.9	Very low	32.8	Very low	25 Å²	25	109 Å²	109	21%	0.207	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	135.7	-168.3	0	0	0	0	0	113.8	Y449 E472	Y449-A470 HydrophobicContact CD1-CB 3.8Å; Y449-A470 HydrophobicContact CE1-CB 3.35Å; A470-E472 VanDerWaalsContact C-N 3.32Å; A470-E472 PolarHBondContact O-N 2.74Å
471	S	42.8	Very low	33.2	Very low	77 Å²	77	111.1 Å²	111.1	54%	0.538	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	0.7	-177.9	63.9	0	0	0	0	116.1	G448	G448-S471 PolarHBondContact O-N 2.99Å; G448-S471 PolarHBondContact O-OG 2.63Å
472	E	29.5	Very low	33.9	Very low	155 Å²	155	108.9 Å²	108.9	72%	0.724	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	8.1	-171.1	-65.7	-170.8	159	0	0	115.1	A470	A470-E472 VanDerWaalsContact C-N 3.32Å; A470-E472 PolarHBondContact O-N 2.74Å
473	N	26.8	Very low	34.9	Very low	115 Å²	115	104.1 Å²	104.1	62%	0.615	53%	0.526	S	S	*	.			trans	-130.6	94.2	176.6	-145.7	-19.6	0	0	0	112.2	Y475	N473-Y475 PolarHBondContact O-N 3.13Å
474	L	27.3	Very low	36.2	Very low	112 Å²	112	100.4 Å²	100.4	59%	0.586	51%	0.509	S	S	*	.			trans	-98.2	65.9	-164.3	-171.7	61.3	0	0	0	113.6	P503 R1215	L474-P503 HydrophobicContact CD1-CB 4Å; L474-P503 HydrophobicContact CD1-CG 3.71Å; L474-P503 HydrophobicContact CD2-CG 3.66Å; L474-P503 HydrophobicContact CG-CG 4.35Å; L474-R1215 PolarHBondContact O-NH2 3.01Å
475	Y	27.3	Very low	38	Very low	97 Å²	97	94.8 Å²	94.8	38%	0.38	49%	0.493	S	S	.	.			trans	-138.9	129.8	169.9	-80.3	-95.6	0	0	0	107.3	N473 R1215 Y1216	N473-Y475 PolarHBondContact O-N 3.13Å; Y475-R1215 VanDerWaalsContact CD1-NH2 3.28Å; Y475-R1215 HydrophobicContact CE1-CG 4.26Å; Y475-R1215 WeakPolarHBondContact OH-CB 3.47Å; Y475-R1215 WeakPolarHBondContact OH-CG 3.23Å; Y475-R1215 PolarHBondContact OH-NE 2.98Å; Y475-R1215 PolarHBondContact OH-O 3.44Å; Y475-Y1216 HydrophobicContact CD1-CE1 4.06Å; Y475-Y1216 AromaticContact CE1-CD1 3.91Å; Y475-Y1216 HydrophobicContact CE1-CD1 3.91Å; Y475-Y1216 AromaticContact CE1-CE1 3.23Å; Y475-Y1216 HydrophobicContact CE1-CE1 3.23Å; Y475-Y1216 AromaticContact CE1-CZ 3.68Å; Y475-Y1216 AromaticContact CZ-CE1 3.88Å
476	C	27.4	Very low	39.1	Very low	78 Å²	78	92.9 Å²	92.9	53%	0.527	50%	0.497	S	S	.	.			cis	-156.9	166.7	17.9	-132.9	0	0	0	0	113.1
477	F	23.3	Very low	39.3	Very low	170 Å²	170	90.3 Å²	90.3	75%	0.746	49%	0.485	S	S	*	.			trans	60.9	76.8	161.5	-82	-84.6	0	0	0	122.5
478	Q	23.7	Very low	39.5	Very low	164 Å²	164	89.2 Å²	89.2	77%	0.766	49%	0.491	S	S	*	.				50.3	93.2	104.6	-167.9	171.6	-24.6	0	0	120.2
479	L	26.7	Very low	39.3	Very low	158 Å²	158	92.6 Å²	92.6	83%	0.827	52%	0.515	S	S	*	.			trans	-130	160	135.3	-109.8	168.4	0	0	0	108.5	V481	L479-V481 PolarHBondContact O-N 3.11Å
480	S	27.1	Very low	39.3	Very low	112 Å²	112	91 Å²	91	78%	0.783	51%	0.511	S	S	*	.			trans	-76.1	92.1	-162.3	178.9	0	0	0	0	114.6
481	V	31.1	Very low	40.2	Very low	92 Å²	92	91.1 Å²	91.1	56%	0.558	51%	0.508	S	S	*	.			trans	-77.7	120.3	164.9	-176.5	0	0	0	0	109.8	L479	L479-V481 PolarHBondContact O-N 3.11Å
482	T	40.2	Very low	41.5	Very low	90 Å²	90	90.1 Å²	90.1	55%	0.552	50%	0.502	S	S	*	.			trans	-69.4	150.9	174	46.1	0	0	0	0	112.1	M484	T482-M484 PolarHBondContact O-N 2.89Å; T482-M484 VanDerWaalsContact O-N 3.12Å
483	D	49.9	Very low	43.5	Very low	52 Å²	52	83.8 Å²	83.8	28%	0.278	47%	0.474	S	S	.	.			trans	-67.5	108.9	-179.8	-166.6	-25.8	0	0	0	112.6	C485 A486 K501	D483-C485 PolarHBondContact OD1-N 2.98Å; D483-A486 HydrophobicContact CB-CB 3.75Å; D483-A486 VanDerWaalsContact CG-CB 3.5Å; D483-A486 PolarHBondContact OD1-N 3.03Å; D483-K501 VanDerWaalsContact CG-CE 3.43Å; D483-K501 VanDerWaalsContact CG-NZ 3.3Å; D483-K501 VanDerWaalsContact OD2-CD 3.31Å; D483-K501 WeakPolarHBondContact OD2-CD 3.27Å; D483-K501 WeakPolarHBondContact OD2-CE 3.28Å; D483-K501 IonicContact OD2-NZ 2.7Å; D483-K501 PolarHBondContact OD2-NZ 3.11Å
484	M	55.7	Low	45.6	Very low	60 Å²	60	79.8 Å²	79.8	30%	0.296	45%	0.452	S	S	.	.	S	Bend	trans	-79.4	-21.5	178.9	-65.5	-175.7	164.8	0	0	113.9	T482 L490 N491 Y506	T482-M484 PolarHBondContact O-N 2.89Å; T482-M484 VanDerWaalsContact O-N 3.12Å; M484-L490 HydrophobicContact CB-CB 4.19Å; M484-L490 HydrophobicContact CG-CB 4.1Å; M484-N491 WeakPolarHBondContact O-CB 3.47Å; M484-N491 PolarHBondContact O-ND2 2.85Å; M484-Y506 HydrophobicContact CB-CD1 3.75Å; M484-Y506 HydrophobicContact CB-CE1 4.46Å; M484-Y506 HydrophobicContact CG-CD1 4.42Å; M484-Y506 HydrophobicContact SD-CD1 3.8Å; M484-Y506 HydrophobicContact SD-CE1 4.01Å
485	C	65.3	Low	47.5	Very low	32 Å²	32	80.5 Å²	80.5	22%	0.216	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-22.5	173.1	-74.8	0	0	0	0	112	D483 D487 C499 I500 K501	D483-C485 PolarHBondContact OD1-N 2.98Å; C485-D487 PolarHBondContact O-N 2.85Å; C485-C499 WeakPolarHBondContact CA-SG 3.39Å; C485-C499 HydrophobicContact CB-CB 3.9Å; C485-C499 WeakPolarHBondContact CB-SG 3.05Å; C485-C499 WeakPolarHBondContact SG-CB 3.34Å; C485-C499 PolarHBondContact SG-O 2.83Å; C485-C499 CovalentContact SG-SG 2.06Å; C485-C499 PolarHBondContact SG-SG 3.04Å; C485-I500 VanDerWaalsContact SG-C 3.55Å; C485-K501 HydrophobicContact CB-CB 4.35Å; C485-K501 PolarHBondContact SG-N 2.76Å
486	A	58.3	Low	49.2	Very low	59 Å²	59	80.2 Å²	80.2	49%	0.488	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-0.7	169.1	0	0	0	0	0	114.2	D483	D483-A486 HydrophobicContact CB-CB 3.75Å; D483-A486 VanDerWaalsContact CG-CB 3.5Å; D483-A486 PolarHBondContact OD1-N 3.03Å
487	D	49.3	Very low	51.2	Low	10 Å²	10	77.2 Å²	77.2	5%	0.053	45%	0.447	C	S	.	.			trans	-142.6	105.5	179.6	-165.8	-26.7	0	0	0	112.1	R124 C485 S489 L490 N491	R124-D487 IonicContact CZ-OD2 3.34Å; R124-D487 IonicContact NE-OD2 3.02Å; R124-D487 PolarHBondContact NE-OD2 3.2Å; R124-D487 IonicContact NH2-OD2 2.72Å; R124-D487 PolarHBondContact NH2-OD2 3.41Å; C485-D487 PolarHBondContact O-N 2.85Å; D487-S489 VanDerWaalsContact CG-OG 3.29Å; D487-S489 PolarHBondContact O-N 2.68Å; D487-S489 WeakPolarHBondContact OD1-CB 3.47Å; D487-S489 PolarHBondContact OD1-N 3.4Å; D487-S489 PolarHBondContact OD1-OG 3.31Å; D487-S489 PolarHBondContact OD2-OG 2.79Å; D487-L490 HydrophobicContact CB-CB 4.14Å; D487-L490 HydrophobicContact CB-CD1 3.93Å; D487-L490 HydrophobicContact CB-CG 3.93Å; D487-L490 PolarHBondContact O-N 2.68Å; D487-N491 PolarHBondContact O-N 2.87Å; D487-N491 PolarHBondContact O-ND2 2.82Å
488	P	50.7	Low	53.6	Low	106 Å²	106	73.5 Å²	73.5	69%	0.688	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-13.6	175	-26.8	36.4	0	0	0	115.5
489	S	42.8	Very low	55.7	Low	77 Å²	77	67.4 Å²	67.4	54%	0.538	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-14	173.8	73.3	0	0	0	0	113.9	D487	D487-S489 VanDerWaalsContact CG-OG 3.29Å; D487-S489 PolarHBondContact O-N 2.68Å; D487-S489 WeakPolarHBondContact OD1-CB 3.47Å; D487-S489 PolarHBondContact OD1-N 3.4Å; D487-S489 PolarHBondContact OD1-OG 3.31Å; D487-S489 PolarHBondContact OD2-OG 2.79Å
490	L	55.3	Low	57.6	Low	70 Å²	70	63.6 Å²	63.6	37%	0.366	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-18.1	174.5	-61.2	-179.9	0	0	0	112.8	M484 D487 Y506	M484-L490 HydrophobicContact CB-CB 4.19Å; M484-L490 HydrophobicContact CG-CB 4.1Å; D487-L490 HydrophobicContact CB-CB 4.14Å; D487-L490 HydrophobicContact CB-CD1 3.93Å; D487-L490 HydrophobicContact CB-CG 3.93Å; D487-L490 PolarHBondContact O-N 2.68Å; L490-Y506 WeakPolarHBondContact O-CE1 3.28Å
491	N	63.2	Low	59	Low	27 Å²	27	64 Å²	64	14%	0.144	38%	0.376	C	S	.	.			trans	-104.7	179.5	168.5	76.5	79.7	0	0	0	112.8	M484 D487 C493 Y506	M484-N491 WeakPolarHBondContact O-CB 3.47Å; M484-N491 PolarHBondContact O-ND2 2.85Å; D487-N491 PolarHBondContact O-N 2.87Å; D487-N491 PolarHBondContact O-ND2 2.82Å; N491-C493 PolarHBondContact OD1-N 2.93Å; N491-Y506 VanDerWaalsContact CA-CZ 3.45Å; N491-Y506 HydrophobicContact CB-CD1 3.79Å; N491-Y506 HydrophobicContact CB-CD2 3.65Å; N491-Y506 HydrophobicContact CB-CE1 3.81Å; N491-Y506 HydrophobicContact CB-CE2 3.66Å; N491-Y506 HydrophobicContact CB-CG 3.73Å
492	S	70.7	Confident	59.8	Low	57 Å²	57	64.7 Å²	64.7	40%	0.399	37%	0.372	S	S	.	.			trans	-150.7	36.1	-177.5	54	0	0	0	0	112.6	Y506 R527	S492-Y506 PolarHBondContact N-OH 3.27Å; S492-Y506 PolarHBondContact OG-OH 2.88Å; S492-R527 WeakPolarHBondContact O-CD 3.38Å; S492-R527 VanDerWaalsContact O-CZ 3.26Å; S492-R527 PolarHBondContact O-NE 2.91Å; S492-R527 PolarHBondContact O-NH1 3.13Å; S492-R527 VanDerWaalsContact OG-CZ 3.3Å; S492-R527 PolarHBondContact OG-NH1 3.07Å; S492-R527 PolarHBondContact OG-NH2 3.4Å
493	C	71.2	Confident	59.8	Low	22 Å²	22	63.7 Å²	63.7	15%	0.149	37%	0.367	C	S	.	.			trans	-72.2	162.3	174.4	-59.7	0	0	0	0	112.1	N491 A497 C508	N491-C493 PolarHBondContact OD1-N 2.93Å; C493-A497 HydrophobicContact CB-CB 4.33Å; C493-C508 WeakPolarHBondContact CA-SG 3.38Å; C493-C508 HydrophobicContact CB-CB 3.63Å; C493-C508 WeakPolarHBondContact CB-SG 3.24Å; C493-C508 VanDerWaalsContact SG-CA 3.57Å; C493-C508 WeakPolarHBondContact SG-CB 3.36Å; C493-C508 CovalentContact SG-SG 2.04Å; C493-C508 PolarHBondContact SG-SG 3.11Å
494	D	71	Confident	59.6	Low	30 Å²	30	67.9 Å²	67.9	16%	0.16	39%	0.389	C	S	.	.			trans	-61.1	138.7	161.6	-167.8	-53.6	0	0	0	109	E496 A497 G526 V528 C529	D494-E496 PolarHBondContact O-N 2.89Å; D494-E496 VanDerWaalsContact O-N 3.16Å; D494-E496 WeakPolarHBondContact OD1-CB 3.39Å; D494-E496 PolarHBondContact OD1-N 2.77Å; D494-A497 HydrophobicContact CB-CB 3.96Å; D494-A497 WeakPolarHBondContact O-CB 3.45Å; D494-A497 PolarHBondContact O-N 2.83Å; D494-G526 PolarHBondContact N-O 2.04Å; D494-V528 VanDerWaalsContact OD2-CA 3.25Å; D494-V528 WeakPolarHBondContact OD2-CA 3.49Å; D494-C529 HydrophobicContact CB-CB 4.43Å; D494-C529 PolarHBondContact OD2-N 2.94Å
495	P	67.3	Low	59.8	Low	127 Å²	127	65.6 Å²	65.6	83%	0.825	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.1	173.2	-27.8	36.3	0	0	0	114.6	A497	P495-A497 VanDerWaalsContact C-N 3.33Å
496	E	62.2	Low	60.2	Low	91 Å²	91	67 Å²	67	43%	0.425	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	2	175.4	-51.3	-74.4	130.8	0	0	112.6	D494 P511 Y514 C529	D494-E496 PolarHBondContact O-N 2.89Å; D494-E496 VanDerWaalsContact O-N 3.16Å; D494-E496 WeakPolarHBondContact OD1-CB 3.39Å; D494-E496 PolarHBondContact OD1-N 2.77Å; E496-P511 WeakPolarHBondContact O-CD 3.45Å; E496-P511 WeakPolarHBondContact O-CG 3.47Å; E496-Y514 HydrophobicContact CB-CD1 4.1Å; E496-Y514 HydrophobicContact CB-CE1 3.67Å; E496-Y514 HydrophobicContact CG-CE1 3.9Å; E496-Y514 WeakPolarHBondContact OE2-CE1 3.38Å; E496-Y514 PolarHBondContact OE2-OH 2.96Å; E496-C529 HydrophobicContact CB-CB 4.19Å
497	A	70.6	Confident	60.6	Low	15 Å²	15	67.3 Å²	67.3	12%	0.124	38%	0.375	C	S	.	.	S	Bend	trans	-100.8	144.7	178	0	0	0	0	0	112.9	C493 D494 P495 C499 C508 V509	C493-A497 HydrophobicContact CB-CB 4.33Å; D494-A497 HydrophobicContact CB-CB 3.96Å; D494-A497 WeakPolarHBondContact O-CB 3.45Å; D494-A497 PolarHBondContact O-N 2.83Å; P495-A497 VanDerWaalsContact C-N 3.33Å; A497-C499 PolarHBondContact O-N 3.41Å; A497-C508 HydrophobicContact CB-CB 4.39Å; A497-V509 CarbonylContact C-O 3.49Å; A497-V509 WeakPolarHBondContact CA-O 3.48Å
498	I	73.7	Confident	61.7	Low	92 Å²	92	67 Å²	67	47%	0.472	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	116.5	170.6	-52.7	178.6	0	0	0	108.8	I500 C508 V509 P511	I498-I500 HydrophobicContact CG2-CG1 3.9Å; I498-I500 PolarHBondContact O-N 2.84Å; I498-C508 WeakPolarHBondContact O-CA 3.49Å; I498-V509 PolarHBondContact N-O 2.77Å; I498-V509 PolarHBondContact O-N 3.47Å; I498-P511 HydrophobicContact CD1-CB 4.25Å; I498-P511 HydrophobicContact CG1-CB 4.41Å
499	C	67.9	Low	62.5	Low	36 Å²	36	65 Å²	65	24%	0.243	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	111.9	166	-167.9	0	0	0	0	109.1	C485 A497	C485-C499 WeakPolarHBondContact CA-SG 3.39Å; C485-C499 HydrophobicContact CB-CB 3.9Å; C485-C499 WeakPolarHBondContact CB-SG 3.05Å; C485-C499 WeakPolarHBondContact SG-CB 3.34Å; C485-C499 PolarHBondContact SG-O 2.83Å; C485-C499 CovalentContact SG-SG 2.06Å; C485-C499 PolarHBondContact SG-SG 3.04Å; A497-C499 PolarHBondContact O-N 3.41Å
500	I	65.8	Low	63.6	Low	78 Å²	78	62.3 Å²	62.3	40%	0.4	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.5	174.3	-53.9	176.3	0	0	0	108.5	C485 I498 Y506 I507 V509	C485-I500 VanDerWaalsContact SG-C 3.55Å; I498-I500 HydrophobicContact CG2-CG1 3.9Å; I498-I500 PolarHBondContact O-N 2.84Å; I500-Y506 WeakPolarHBondContact O-CA 3.16Å; I500-I507 HydrophobicContact CB-CG2 3.8Å; I500-I507 HydrophobicContact CG2-CG2 4.49Å; I500-I507 PolarHBondContact N-O 3.3Å; I500-I507 PolarHBondContact O-N 2.7Å; I500-V509 HydrophobicContact CD1-CG2 3.9Å
501	K	56.8	Low	64	Low	122 Å²	122	60.7 Å²	60.7	53%	0.53	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	136.3	175.3	-176.3	-176.3	-174.2	172.3	0	110.7	D483 C485	D483-K501 VanDerWaalsContact CG-CE 3.43Å; D483-K501 VanDerWaalsContact CG-NZ 3.3Å; D483-K501 VanDerWaalsContact OD2-CD 3.31Å; D483-K501 WeakPolarHBondContact OD2-CD 3.27Å; D483-K501 WeakPolarHBondContact OD2-CE 3.28Å; D483-K501 IonicContact OD2-NZ 2.7Å; D483-K501 PolarHBondContact OD2-NZ 3.11Å; C485-K501 HydrophobicContact CB-CB 4.35Å; C485-K501 PolarHBondContact SG-N 2.76Å
502	K	47.1	Very low	63.6	Low	105 Å²	105	67.7 Å²	67.7	46%	0.457	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	161.7	169.8	-69.6	-164.2	174.1	-167	0	110.2	D504 G505	K502-D504 PolarHBondContact O-N 2.93Å; K502-G505 PolarHBondContact N-O 3.49Å; K502-G505 PolarHBondContact O-N 2.77Å
503	P	41.3	Very low	62.3	Low	69 Å²	69	66.9 Å²	66.9	45%	0.448	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-38.1	175.9	-26.6	36.2	0	0	0	113	L474	L474-P503 HydrophobicContact CD1-CB 4Å; L474-P503 HydrophobicContact CD1-CG 3.71Å; L474-P503 HydrophobicContact CD2-CG 3.66Å; L474-P503 HydrophobicContact CG-CG 4.35Å
504	D	45.9	Very low	61.8	Low	141 Å²	141	68.9 Å²	68.9	75%	0.754	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	15.3	-176	-41.3	-70.9	0	0	0	113.6	K502	K502-D504 PolarHBondContact O-N 2.93Å
505	G	59.2	Low	61.2	Low	11 Å²	11	75.8 Å²	75.8	11%	0.113	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	143.7	-131	178.1	0	0	0	0	0	114.8	K502	K502-G505 PolarHBondContact N-O 3.49Å; K502-G505 PolarHBondContact O-N 2.77Å
506	Y	72.9	Confident	61.1	Low	61 Å²	61	72.7 Å²	72.7	24%	0.239	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	159.2	-177.6	62.2	-84.6	0	0	0	112.1	M484 L490 N491 S492 I500	M484-Y506 HydrophobicContact CB-CD1 3.75Å; M484-Y506 HydrophobicContact CB-CE1 4.46Å; M484-Y506 HydrophobicContact CG-CD1 4.42Å; M484-Y506 HydrophobicContact SD-CD1 3.8Å; M484-Y506 HydrophobicContact SD-CE1 4.01Å; L490-Y506 WeakPolarHBondContact O-CE1 3.28Å; N491-Y506 VanDerWaalsContact CA-CZ 3.45Å; N491-Y506 HydrophobicContact CB-CD1 3.79Å; N491-Y506 HydrophobicContact CB-CD2 3.65Å; N491-Y506 HydrophobicContact CB-CE1 3.81Å; N491-Y506 HydrophobicContact CB-CE2 3.66Å; N491-Y506 HydrophobicContact CB-CG 3.73Å; S492-Y506 PolarHBondContact N-OH 3.27Å; S492-Y506 PolarHBondContact OG-OH 2.88Å; I500-Y506 WeakPolarHBondContact O-CA 3.16Å
507	I	66.7	Low	61	Low	67 Å²	67	70.3 Å²	70.3	34%	0.344	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	152.6	167.5	-170	166.9	0	0	0	110.1	I500	I500-I507 HydrophobicContact CB-CG2 3.8Å; I500-I507 HydrophobicContact CG2-CG2 4.49Å; I500-I507 PolarHBondContact N-O 3.3Å; I500-I507 PolarHBondContact O-N 2.7Å
508	C	73.7	Confident	60.7	Low	4 Å²	4	69.6 Å²	69.6	3%	0.027	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.6	-177.5	-46.6	0	0	0	0	109.8	C493 A497 I498 G526	C493-C508 WeakPolarHBondContact CA-SG 3.38Å; C493-C508 HydrophobicContact CB-CB 3.63Å; C493-C508 WeakPolarHBondContact CB-SG 3.24Å; C493-C508 VanDerWaalsContact SG-CA 3.57Å; C493-C508 WeakPolarHBondContact SG-CB 3.36Å; C493-C508 CovalentContact SG-SG 2.04Å; C493-C508 PolarHBondContact SG-SG 3.11Å; A497-C508 HydrophobicContact CB-CB 4.39Å; I498-C508 WeakPolarHBondContact O-CA 3.49Å; C508-G526 VanDerWaalsContact CB-O 3.23Å; C508-G526 WeakPolarHBondContact CB-O 3.45Å
509	V	66.9	Low	59.4	Low	62 Å²	62	69.5 Å²	69.5	38%	0.376	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	126.9	-179.1	-175.2	0	0	0	0	109.7	A497 I498 I500	A497-V509 CarbonylContact C-O 3.49Å; A497-V509 WeakPolarHBondContact CA-O 3.48Å; I498-V509 PolarHBondContact N-O 2.77Å; I498-V509 PolarHBondContact O-N 3.47Å; I500-V509 HydrophobicContact CD1-CG2 3.9Å
510	C	66.2	Low	58.2	Low	21 Å²	21	74.6 Å²	74.6	14%	0.142	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-68.7	135.8	173.6	-55.8	0	0	0	0	110.4	D516 C529	C510-D516 VanDerWaalsContact SG-CA 3.54Å; C510-C529 WeakPolarHBondContact CA-SG 3.29Å; C510-C529 HydrophobicContact CB-CB 3.88Å; C510-C529 WeakPolarHBondContact CB-SG 3.25Å; C510-C529 VanDerWaalsContact SG-CA 3.54Å; C510-C529 WeakPolarHBondContact SG-CB 3.5Å; C510-C529 CovalentContact SG-SG 2.04Å; C510-C529 PolarHBondContact SG-SG 3.01Å
511	P	63.9	Low	57.1	Low	37 Å²	37	73.8 Å²	73.8	24%	0.24	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-71.2	163.8	178	30.6	-36.1	0	0	0	112.2	E496 I498 G513 Y514	E496-P511 WeakPolarHBondContact O-CD 3.45Å; E496-P511 WeakPolarHBondContact O-CG 3.47Å; I498-P511 HydrophobicContact CD1-CB 4.25Å; I498-P511 HydrophobicContact CG1-CB 4.41Å; P511-G513 PolarHBondContact O-N 3.3Å; P511-Y514 HydrophobicContact CG-CD2 3.88Å; P511-Y514 HydrophobicContact CG-CE2 4.36Å; P511-Y514 HydrophobicContact CG-CG 4.24Å; P511-Y514 PolarHBondContact O-N 3.14Å
512	D	55.3	Low	56.1	Low	173 Å²	173	77.7 Å²	77.7	93%	0.925	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	135.4	172.9	-80.9	-45.8	0	0	0	111.4
513	G	43	Very low	56.3	Low	41 Å²	41	76.8 Å²	76.8	42%	0.423	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	2.4	-171.1	0	0	0	0	0	114.6	P511 Q532	P511-G513 PolarHBondContact O-N 3.3Å; G513-Q532 WeakPolarHBondContact O-CA 3.09Å; G513-Q532 WeakPolarHBondContact O-CB 3.22Å; G513-Q532 PolarHBondContact O-N 3.5Å
514	Y	60.4	Low	56.8	Low	64 Å²	64	76.8 Å²	76.8	25%	0.251	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	147.7	169.2	-71.2	-120.6	0	0	0	110.1	E496 P511 C529 T530 I531	E496-Y514 HydrophobicContact CB-CD1 4.1Å; E496-Y514 HydrophobicContact CB-CE1 3.67Å; E496-Y514 HydrophobicContact CG-CE1 3.9Å; E496-Y514 WeakPolarHBondContact OE2-CE1 3.38Å; E496-Y514 PolarHBondContact OE2-OH 2.96Å; P511-Y514 HydrophobicContact CG-CD2 3.88Å; P511-Y514 HydrophobicContact CG-CE2 4.36Å; P511-Y514 HydrophobicContact CG-CG 4.24Å; P511-Y514 PolarHBondContact O-N 3.14Å; Y514-C529 HydrophobicContact CD1-CB 4.09Å; Y514-T530 CarbonylContact C-O 3.54Å; Y514-T530 WeakPolarHBondContact CA-O 3.49Å; Y514-I531 HydrophobicContact CD1-CG1 4.11Å; Y514-I531 HydrophobicContact CE1-CB 4.38Å; Y514-I531 HydrophobicContact CE1-CG1 3.52Å; Y514-I531 HydrophobicContact CE2-CG1 4.4Å
515	R	57.6	Low	57.3	Low	174 Å²	174	74.2 Å²	74.2	66%	0.657	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	135.1	168.5	-84.5	-168.3	172.3	-134.7	-0.7	111.3	T530	R515-T530 PolarHBondContact N-O 2.84Å; R515-T530 PolarHBondContact O-N 2.89Å; R515-T530 PolarHBondContact O-OG1 3.33Å
516	D	65.3	Low	57.8	Low	63 Å²	63	73.7 Å²	73.7	34%	0.337	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126	162.3	-169.1	-12.4	0	0	0	109.8	C510 S518 P525 G526	C510-D516 VanDerWaalsContact SG-CA 3.54Å; D516-S518 WeakPolarHBondContact OD1-CB 3.33Å; D516-S518 PolarHBondContact OD1-N 3.19Å; D516-S518 PolarHBondContact OD1-OG 3.37Å; D516-P525 VanDerWaalsContact OD2-CA 3.24Å; D516-P525 WeakPolarHBondContact OD2-CA 3.3Å; D516-G526 PolarHBondContact OD2-N 3.09Å
517	V	61.1	Low	58	Low	41 Å²	41	74 Å²	74	25%	0.248	40%	0.403	C	S	.	.			trans	-122.1	11.3	173.1	-59.3	0	0	0	0	112.6	S519 N520 V528 T530	V517-S519 PolarHBondContact O-N 3.22Å; V517-N520 WeakPolarHBondContact O-CB 3.21Å; V517-N520 PolarHBondContact O-N 2.87Å; V517-N520 VanDerWaalsContact O-N 3.08Å; V517-V528 HydrophobicContact CG2-CB 3.8Å; V517-V528 HydrophobicContact CG2-CG1 3.47Å; V517-V528 VanDerWaalsContact CG2-CG1 3.47Å; V517-V528 PolarHBondContact N-O 3.26Å; V517-T530 HydrophobicContact CG2-CG2 3.89Å
518	S	63.6	Low	58.2	Low	0 Å²	0	73.1 Å²	73.1	0%	0	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-58.7	-34.5	-176.9	-44.9	0	0	0	0	112.6	D516 N520 A521 K522 L523 P524 R527 V528	D516-S518 WeakPolarHBondContact OD1-CB 3.33Å; D516-S518 PolarHBondContact OD1-N 3.19Å; D516-S518 PolarHBondContact OD1-OG 3.37Å; S518-N520 VanDerWaalsContact C-N 3.31Å; S518-N520 PolarHBondContact O-N 2.98Å; S518-A521 CarbonylContact O-C 3.55Å; S518-A521 WeakPolarHBondContact O-CA 3.25Å; S518-A521 PolarHBondContact O-N 3.49Å; S518-K522 PolarHBondContact O-N 3.1Å; S518-L523 PolarHBondContact O-N 3.12Å; S518-P524 WeakPolarHBondContact CB-O 3.27Å; S518-P524 PolarHBondContact OG-O 3.03Å; S518-R527 PolarHBondContact OG-N 3.47Å; S518-V528 PolarHBondContact OG-N 2.84Å
519	S	47.7	Very low	57.6	Low	89 Å²	89	73.4 Å²	73.4	62%	0.622	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-59.8	-35.9	176.1	52.6	0	0	0	0	113.3	V517 A521 K522	V517-S519 PolarHBondContact O-N 3.22Å; S519-A521 PolarHBondContact O-N 2.84Å; S519-K522 PolarHBondContact O-N 3.31Å; S519-K522 VanDerWaalsContact O-N 3.15Å
520	N	42.4	Very low	57.2	Low	143 Å²	143	73.5 Å²	73.5	77%	0.765	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-66.2	-20.8	175	-67.6	-20.5	0	0	0	112.7	V517 S518	V517-N520 WeakPolarHBondContact O-CB 3.21Å; V517-N520 PolarHBondContact O-N 2.87Å; V517-N520 VanDerWaalsContact O-N 3.08Å; S518-N520 VanDerWaalsContact C-N 3.31Å; S518-N520 PolarHBondContact O-N 2.98Å
521	A	42.6	Very low	56.5	Low	61 Å²	61	77.3 Å²	77.3	50%	0.504	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-100.5	4.2	177.1	0	0	0	0	0	113.6	S518 S519 L523	S518-A521 CarbonylContact O-C 3.55Å; S518-A521 WeakPolarHBondContact O-CA 3.25Å; S518-A521 PolarHBondContact O-N 3.49Å; S519-A521 PolarHBondContact O-N 2.84Å; A521-L523 HydrophobicContact CB-CD1 4.01Å; A521-L523 HydrophobicContact CB-CG 4.06Å; A521-L523 PolarHBondContact O-N 3.29Å
522	K	34.9	Very low	55.2	Low	205 Å²	205	80.8 Å²	80.8	89%	0.891	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	33.7	-168.9	-59.1	-173.9	176.6	-175.5	0	113.9	S518 S519	S518-K522 PolarHBondContact O-N 3.1Å; S519-K522 PolarHBondContact O-N 3.31Å; S519-K522 VanDerWaalsContact O-N 3.15Å
523	L	51.3	Low	54.3	Low	85 Å²	85	76.6 Å²	76.6	45%	0.445	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-97.8	159.1	173.6	-66.7	173.7	0	0	0	111.2	S518 A521 R527 V528	S518-L523 PolarHBondContact O-N 3.12Å; A521-L523 HydrophobicContact CB-CD1 4.01Å; A521-L523 HydrophobicContact CB-CG 4.06Å; A521-L523 PolarHBondContact O-N 3.29Å; L523-R527 HydrophobicContact CB-CB 4.17Å; L523-R527 HydrophobicContact CD1-CB 4.26Å; L523-V528 HydrophobicContact CD1-CG2 4.03Å
524	P	52.7	Low	53.7	Low	70 Å²	70	82 Å²	82	46%	0.455	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-57.2	165.7	167.8	-23	33.8	0	0	0	112.7	S518 R527	S518-P524 WeakPolarHBondContact CB-O 3.27Å; S518-P524 PolarHBondContact OG-O 3.03Å; P524-R527 HydrophobicContact CB-CG 4.19Å; P524-R527 WeakPolarHBondContact O-CG 3.32Å
525	P	56.5	Low	52.6	Low	86 Å²	86	80.8 Å²	80.8	56%	0.558	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	151.6	175.4	-24.3	35.1	0	0	0	114.2	D516 R527	D516-P525 VanDerWaalsContact OD2-CA 3.24Å; D516-P525 WeakPolarHBondContact OD2-CA 3.3Å; P525-R527 VanDerWaalsContact C-N 3.32Å; P525-R527 PolarHBondContact O-N 2.95Å
526	G	70.1	Confident	51.7	Low	0 Å²	0	76.3 Å²	76.3	0%	0	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	26	174.9	0	0	0	0	0	115.2	D494 C508 D516	D494-G526 PolarHBondContact N-O 2.04Å; C508-G526 VanDerWaalsContact CB-O 3.23Å; C508-G526 WeakPolarHBondContact CB-O 3.45Å; D516-G526 PolarHBondContact OD2-N 3.09Å
527	R	76.8	Confident	50.9	Low	68 Å²	68	78.1 Å²	78.1	26%	0.257	44%	0.435	S	S	.	.	S	Bend	trans	-104.4	-14.8	179.7	-55.6	-48.6	-169.5	96.5	-3.5	114.1	S492 S518 L523 P524 P525	S492-R527 WeakPolarHBondContact O-CD 3.38Å; S492-R527 VanDerWaalsContact O-CZ 3.26Å; S492-R527 PolarHBondContact O-NE 2.91Å; S492-R527 PolarHBondContact O-NH1 3.13Å; S492-R527 VanDerWaalsContact OG-CZ 3.3Å; S492-R527 PolarHBondContact OG-NH1 3.07Å; S492-R527 PolarHBondContact OG-NH2 3.4Å; S518-R527 PolarHBondContact OG-N 3.47Å; L523-R527 HydrophobicContact CB-CB 4.17Å; L523-R527 HydrophobicContact CD1-CB 4.26Å; P524-R527 HydrophobicContact CB-CG 4.19Å; P524-R527 WeakPolarHBondContact O-CG 3.32Å; P525-R527 VanDerWaalsContact C-N 3.32Å; P525-R527 PolarHBondContact O-N 2.95Å
528	V	70	Confident	51	Low	48 Å²	48	80 Å²	80	29%	0.291	44%	0.441	S	S	.	.	S	Bend	trans	-141.9	105.9	167.6	-169.6	0	0	0	0	108.3	D494 V517 S518 L523 T530	D494-V528 VanDerWaalsContact OD2-CA 3.25Å; D494-V528 WeakPolarHBondContact OD2-CA 3.49Å; V517-V528 HydrophobicContact CG2-CB 3.8Å; V517-V528 HydrophobicContact CG2-CG1 3.47Å; V517-V528 VanDerWaalsContact CG2-CG1 3.47Å; V517-V528 PolarHBondContact N-O 3.26Å; S518-V528 PolarHBondContact OG-N 2.84Å; L523-V528 HydrophobicContact CD1-CG2 4.03Å; V528-T530 HydrophobicContact CG1-CG2 4.47Å
529	C	61.2	Low	51.4	Low	11 Å²	11	81.8 Å²	81.8	7%	0.074	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.1	177.2	-63.4	0	0	0	0	110	D494 E496 C510 Y514	D494-C529 HydrophobicContact CB-CB 4.43Å; D494-C529 PolarHBondContact OD2-N 2.94Å; E496-C529 HydrophobicContact CB-CB 4.19Å; C510-C529 WeakPolarHBondContact CA-SG 3.29Å; C510-C529 HydrophobicContact CB-CB 3.88Å; C510-C529 WeakPolarHBondContact CB-SG 3.25Å; C510-C529 VanDerWaalsContact SG-CA 3.54Å; C510-C529 WeakPolarHBondContact SG-CB 3.5Å; C510-C529 CovalentContact SG-SG 2.04Å; C510-C529 PolarHBondContact SG-SG 3.01Å; Y514-C529 HydrophobicContact CD1-CB 4.09Å
530	T	58.2	Low	53.1	Low	64 Å²	64	78 Å²	78	39%	0.393	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.7	179.4	57.6	0	0	0	0	111.2	Y514 R515 V517 V528 Q532	Y514-T530 CarbonylContact C-O 3.54Å; Y514-T530 WeakPolarHBondContact CA-O 3.49Å; R515-T530 PolarHBondContact N-O 2.84Å; R515-T530 PolarHBondContact O-N 2.89Å; R515-T530 PolarHBondContact O-OG1 3.33Å; V517-T530 HydrophobicContact CG2-CG2 3.89Å; V528-T530 HydrophobicContact CG1-CG2 4.47Å; T530-Q532 PolarHBondContact O-N 2.62Å
531	I	51.3	Low	55.3	Low	101 Å²	101	71.2 Å²	71.2	52%	0.518	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.3	129.2	177.9	-48.1	168.2	0	0	0	110.1	Y514 T533	Y514-I531 HydrophobicContact CD1-CG1 4.11Å; Y514-I531 HydrophobicContact CE1-CB 4.38Å; Y514-I531 HydrophobicContact CE1-CG1 3.52Å; Y514-I531 HydrophobicContact CE2-CG1 4.4Å; I531-T533 HydrophobicContact CB-CG2 4.06Å; I531-T533 HydrophobicContact CG2-CG2 3.65Å; I531-T533 PolarHBondContact O-N 2.79Å
532	Q	38.4	Very low	57.6	Low	109 Å²	109	68.4 Å²	68.4	51%	0.509	37%	0.366	S	S	.	.			trans	-75.8	60.5	169.1	-168.9	179	-50	0	0	109.7	G513 T530 L534	G513-Q532 WeakPolarHBondContact O-CA 3.09Å; G513-Q532 WeakPolarHBondContact O-CB 3.22Å; G513-Q532 PolarHBondContact O-N 3.5Å; T530-Q532 PolarHBondContact O-N 2.62Å; Q532-L534 PolarHBondContact O-N 2.94Å
533	T	36.2	Very low	60.3	Low	85 Å²	85	58.7 Å²	58.7	52%	0.521	32%	0.324	S	S	.	.			trans	-63.7	102.9	172.9	51.4	0	0	0	0	108.8	I531 C535	I531-T533 HydrophobicContact CB-CG2 4.06Å; I531-T533 HydrophobicContact CG2-CG2 3.65Å; I531-T533 PolarHBondContact O-N 2.79Å; T533-C535 PolarHBondContact O-N 3.03Å
534	L	30.3	Very low	62.3	Low	155 Å²	155	54.6 Å²	54.6	81%	0.812	30%	0.303	S	S	*	.			trans	-65.1	70.1	158.7	-78.2	164.3	0	0	0	108.4	Q532 P536	Q532-L534 PolarHBondContact O-N 2.94Å; L534-P536 WeakPolarHBondContact O-CD 3.41Å; L534-P536 VanDerWaalsContact O-N 3.1Å
535	C	37.5	Very low	64.2	Low	38 Å²	38	51.3 Å²	51.3	26%	0.257	28%	0.281	S	S	.	.			trans	-57	115.6	171.8	179.9	0	0	0	0	107	T533 M537 C722	T533-C535 PolarHBondContact O-N 3.03Å; C535-M537 PolarHBondContact O-N 3.4Å; C535-M537 VanDerWaalsContact O-N 3.12Å; C535-C722 HydrophobicContact CB-CB 3.87Å; C535-C722 WeakPolarHBondContact CB-SG 3.43Å; C535-C722 WeakPolarHBondContact SG-CB 3.32Å; C535-C722 CovalentContact SG-SG 2.03Å; C535-C722 PolarHBondContact SG-SG 2.61Å
536	P	38.4	Very low	66	Low	80 Å²	80	47.2 Å²	47.2	52%	0.519	26%	0.255	S	S	.	.			trans	-60.1	122.6	-170.9	22.8	-32.6	0	0	0	108.3	L534 Q538	L534-P536 WeakPolarHBondContact O-CD 3.41Å; L534-P536 VanDerWaalsContact O-N 3.1Å; P536-Q538 PolarHBondContact O-N 2.97Å
537	M	48.3	Very low	66.8	Low	102 Å²	102	47.2 Å²	47.2	50%	0.502	26%	0.255	S	S	.	.			trans	-72.9	76.9	-168	-68.3	-172.4	72	0	0	111.8	C535 E573	C535-M537 PolarHBondContact O-N 3.4Å; C535-M537 VanDerWaalsContact O-N 3.12Å; M537-E573 HydrophobicContact CE-CB 3.61Å
538	Q	62.6	Low	67.2	Low	80 Å²	80	44 Å²	44	37%	0.374	24%	0.243	S	C	.	.			trans	-63.7	141	-178.1	-61.8	-58.3	-9.3	0	0	110.9	P536 T540 Y647	P536-Q538 PolarHBondContact O-N 2.97Å; Q538-T540 PolarHBondContact O-N 2.92Å; Q538-T540 PolarHBondContact O-OG1 3.01Å; Q538-Y647 HydrophobicContact CB-CD2 3.9Å; Q538-Y647 HydrophobicContact CB-CE2 4.36Å; Q538-Y647 HydrophobicContact CG-CD2 4.27Å; Q538-Y647 HydrophobicContact CG-CE2 4.22Å
539	P	71.2	Confident	67.8	Low	37 Å²	37	41.7 Å²	41.7	24%	0.24	23%	0.229	C	C	.	.			trans	-43.2	109.1	168.3	-33.8	39.7	0	0	0	112.3	K578 V646 Y647	P539-K578 CarbonylContact C-O 3.56Å; P539-K578 WeakPolarHBondContact CA-O 3.49Å; P539-V646 HydrophobicContact CB-CB 4.47Å; P539-V646 HydrophobicContact CB-CG2 3.91Å; P539-V646 CarbonylContact O-C 3.58Å; P539-V646 VanDerWaalsContact O-CA 3.23Å; P539-V646 WeakPolarHBondContact O-CA 3.43Å; P539-Y647 PolarHBondContact O-N 2.8Å
540	T	83.5	Confident	68.4	Low	11 Å²	11	43.2 Å²	43.2	7%	0.067	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	118.7	-171.8	-62.7	0	0	0	0	112	Q538 L542 K578 T579 R580 R640 Y647 I649	Q538-T540 PolarHBondContact O-N 2.92Å; Q538-T540 PolarHBondContact O-OG1 3.01Å; T540-L542 HydrophobicContact CG2-CB 4.44Å; T540-K578 PolarHBondContact N-O 3.43Å; T540-T579 HydrophobicContact CG2-CG2 4.46Å; T540-T579 VanDerWaalsContact O-CA 3.31Å; T540-T579 WeakPolarHBondContact O-CA 3.31Å; T540-R580 PolarHBondContact O-N 3.46Å; T540-R640 PolarHBondContact O-NH2 3.46Å; T540-Y647 CarbonylContact C-O 3.47Å; T540-Y647 VanDerWaalsContact CA-O 3.32Å; T540-Y647 WeakPolarHBondContact CA-O 3.41Å; T540-I649 HydrophobicContact CG2-CD1 3.75Å; T540-I649 HydrophobicContact CG2-CG1 4.2Å
541	D	88.6	Confident	69	Low	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	103.2	169.6	-76	-12.5	0	0	0	108.8	R580 L596 F633 A639 R640 Y647 R648 I649	D541-R580 WeakPolarHBondContact OD1-CD 3.43Å; D541-L596 HydrophobicContact CB-CD1 4.18Å; D541-L596 HydrophobicContact CB-CD2 4.24Å; D541-F633 HydrophobicContact CB-CE1 3.96Å; D541-F633 WeakPolarHBondContact O-CE1 3.18Å; D541-A639 WeakPolarHBondContact OD2-CA 3.36Å; D541-R640 IonicContact OD1-CZ 3.67Å; D541-R640 IonicContact OD1-NE 2.76Å; D541-R640 PolarHBondContact OD1-NE 3.28Å; D541-R640 IonicContact OD1-NH2 2.88Å; D541-R640 PolarHBondContact OD1-NH2 2.9Å; D541-R640 PolarHBondContact OD2-N 3.41Å; D541-R640 IonicContact OD2-NE 2.89Å; D541-Y647 PolarHBondContact N-O 2.91Å; D541-R648 HydrophobicContact CB-CG 4.43Å; D541-I649 PolarHBondContact O-N 2.98Å
542	L	90.6	Very high	70.4	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.6	-175.8	176.6	61.8	0	0	0	110.7	T540 F544 F568 T579 R580 V581 G582 I649 V651	T540-L542 HydrophobicContact CG2-CB 4.44Å; L542-F544 HydrophobicContact CD2-CE2 3.78Å; L542-F544 HydrophobicContact CD2-CZ 4.05Å; L542-F544 HydrophobicContact CG-CD2 4.5Å; L542-F544 HydrophobicContact CG-CE2 3.97Å; L542-F544 HydrophobicContact CG-CZ 4.43Å; L542-F568 HydrophobicContact CD2-CD1 4.44Å; L542-F568 HydrophobicContact CD2-CE1 4.07Å; L542-T579 HydrophobicContact CB-CG2 4.47Å; L542-R580 PolarHBondContact N-O 3.43Å; L542-V581 HydrophobicContact CB-CG2 4.36Å; L542-V581 HydrophobicContact CD2-CG2 4.28Å; L542-V581 CarbonylContact O-C 3.22Å; L542-V581 VanDerWaalsContact O-CA 3.26Å; L542-V581 WeakPolarHBondContact O-CA 3.35Å; L542-G582 PolarHBondContact O-N 2.64Å; L542-I649 CarbonylContact C-O 2.92Å; L542-I649 WeakPolarHBondContact CA-O 3.27Å; L542-I649 HydrophobicContact CD1-CB 4.05Å; L542-I649 HydrophobicContact CD1-CG2 3.65Å; L542-V651 HydrophobicContact CD1-CG2 3.74Å
543	V	92.1	Very high	72.2	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.4	174.6	178.2	0	0	0	0	109.8	G582 V584 L596 M628 T632 F633 I649 G650 V651	V543-G582 WeakPolarHBondContact CA-O 3.23Å; V543-V584 HydrophobicContact CG1-CG2 4.45Å; V543-L596 HydrophobicContact CG2-CD1 3.84Å; V543-L596 HydrophobicContact CG2-CD2 4.01Å; V543-L596 HydrophobicContact CG2-CG 3.97Å; V543-M628 HydrophobicContact CB-CG 4.49Å; V543-M628 HydrophobicContact CB-SD 4.09Å; V543-M628 HydrophobicContact CG1-CG 4.01Å; V543-M628 HydrophobicContact CG1-SD 3.81Å; V543-T632 HydrophobicContact CG1-CG2 3.93Å; V543-T632 HydrophobicContact CG2-CG2 3.74Å; V543-F633 HydrophobicContact CB-CE2 3.87Å; V543-F633 HydrophobicContact CB-CZ 3.79Å; V543-F633 HydrophobicContact CG2-CD1 4.42Å; V543-F633 HydrophobicContact CG2-CD2 4.32Å; V543-F633 HydrophobicContact CG2-CE1 3.83Å; V543-F633 HydrophobicContact CG2-CE2 3.73Å; V543-F633 HydrophobicContact CG2-CZ 3.45Å; V543-F633 VanDerWaalsContact CG2-CZ 3.45Å; V543-I649 PolarHBondContact N-O 3.04Å; V543-G650 CarbonylContact O-C 3.5Å; V543-G650 WeakPolarHBondContact O-CA 3.38Å; V543-V651 PolarHBondContact O-N 2.74Å
544	F	94.4	Very high	74.1	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.6	165.6	-64.6	-91.6	0	0	0	109.6	L542 I546 F564 V565 F568 V569 V581 G582 I583 V584 V651 I653	L542-F544 HydrophobicContact CD2-CE2 3.78Å; L542-F544 HydrophobicContact CD2-CZ 4.05Å; L542-F544 HydrophobicContact CG-CD2 4.5Å; L542-F544 HydrophobicContact CG-CE2 3.97Å; L542-F544 HydrophobicContact CG-CZ 4.43Å; F544-I546 HydrophobicContact CB-CD1 4.26Å; F544-I546 HydrophobicContact CB-CG1 3.74Å; F544-F564 HydrophobicContact CE1-CE1 4.39Å; F544-V565 HydrophobicContact CD1-CG1 4.42Å; F544-V565 HydrophobicContact CD1-CG2 3.84Å; F544-V565 HydrophobicContact CD2-CG1 3.86Å; F544-V565 HydrophobicContact CE1-CG1 4.36Å; F544-V565 HydrophobicContact CE1-CG2 3.94Å; F544-V565 HydrophobicContact CE2-CG1 3.8Å; F544-V565 HydrophobicContact CG-CG1 4.17Å; F544-V565 HydrophobicContact CG-CG2 4.23Å; F544-V565 HydrophobicContact CZ-CG1 4.06Å; F544-V565 HydrophobicContact CZ-CG2 4.41Å; F544-F568 HydrophobicContact CE1-CD1 4.41Å; F544-F568 AromaticContact CZ-CD1 3.69Å; F544-F568 HydrophobicContact CZ-CD1 3.69Å; F544-F568 HydrophobicContact CZ-CE1 4.17Å; F544-F568 HydrophobicContact CZ-CG 4.45Å; F544-V569 HydrophobicContact CE2-CG1 4.09Å; F544-V581 HydrophobicContact CD2-CG1 4.24Å; F544-V581 HydrophobicContact CE2-CG1 4.22Å; F544-G582 PolarHBondContact N-O 3.43Å; F544-I583 HydrophobicContact CB-CG1 4.25Å; F544-I583 HydrophobicContact CD2-CD1 4.49Å; F544-I583 HydrophobicContact CD2-CG1 4.19Å; F544-V584 PolarHBondContact O-N 3.3Å; F544-V651 WeakPolarHBondContact CA-O 3.19Å; F544-V651 HydrophobicContact CD1-CB 3.75Å; F544-V651 HydrophobicContact CD1-CG1 3.76Å; F544-V651 HydrophobicContact CD1-CG2 4.48Å; F544-V651 HydrophobicContact CE1-CB 3.97Å; F544-V651 HydrophobicContact CE1-CG1 3.85Å; F544-V651 HydrophobicContact CE1-CG2 4.25Å; F544-V651 HydrophobicContact CG-CB 4.49Å; F544-I653 HydrophobicContact CD1-CD1 4.13Å
545	L	92.6	Very high	76	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	105.3	154.1	-74.1	-175.7	0	0	0	106.5	V584 Y586 A624 I625 M628 V651 V652 I653	L545-V584 HydrophobicContact CD2-CB 3.76Å; L545-V584 HydrophobicContact CD2-CG1 3.89Å; L545-V584 HydrophobicContact CD2-CG2 4.4Å; L545-Y586 HydrophobicContact CB-CD1 4.14Å; L545-Y586 HydrophobicContact CB-CE1 3.85Å; L545-A624 HydrophobicContact CD1-CB 4Å; L545-A624 HydrophobicContact CD2-CB 4.18Å; L545-I625 HydrophobicContact CD1-CB 4.35Å; L545-I625 HydrophobicContact CD1-CG1 3.66Å; L545-M628 HydrophobicContact CD1-CB 4.15Å; L545-M628 HydrophobicContact CD1-CE 3.73Å; L545-M628 HydrophobicContact CD1-SD 3.94Å; L545-M628 HydrophobicContact CD2-CB 3.86Å; L545-M628 HydrophobicContact CD2-SD 4.3Å; L545-M628 HydrophobicContact CG-CB 4.17Å; L545-M628 HydrophobicContact CG-CE 4.17Å; L545-M628 HydrophobicContact CG-SD 3.69Å; L545-V651 PolarHBondContact N-O 3.3Å; L545-V652 HydrophobicContact CB-CG1 4.37Å; L545-V652 HydrophobicContact CD1-CG1 4.46Å; L545-V652 HydrophobicContact CD1-CG2 4.2Å; L545-I653 WeakPolarHBondContact O-CA 3.33Å; L545-I653 WeakPolarHBondContact O-CB 3.37Å; L545-I653 PolarHBondContact O-N 2.82Å; L545-I653 VanDerWaalsContact O-O 3.14Å
546	I	93	Very high	77.8	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	118.7	175.7	-43.2	-178.4	0	0	0	108.1	F544 G548 F557 V561 L562 V565 I583 V584 Q585 Y586 I653	F544-I546 HydrophobicContact CB-CD1 4.26Å; F544-I546 HydrophobicContact CB-CG1 3.74Å; I546-G548 PolarHBondContact O-N 2.94Å; I546-F557 HydrophobicContact CB-CE2 4.39Å; I546-F557 HydrophobicContact CG2-CD2 4.37Å; I546-F557 HydrophobicContact CG2-CE2 3.54Å; I546-F557 HydrophobicContact CG2-CZ 4.26Å; I546-V561 HydrophobicContact CG2-CG1 3.38Å; I546-L562 HydrophobicContact CD1-CD2 4.33Å; I546-V565 HydrophobicContact CD1-CG2 4.01Å; I546-I583 HydrophobicContact CD1-CD1 4.43Å; I546-I583 HydrophobicContact CD1-CG2 3.48Å; I546-I583 VanDerWaalsContact CD1-CG2 3.48Å; I546-I583 HydrophobicContact CG1-CG2 3.91Å; I546-V584 PolarHBondContact N-O 2.85Å; I546-Q585 WeakPolarHBondContact O-CA 3.44Å; I546-Y586 VanDerWaalsContact C-CE1 3.43Å; I546-Y586 VanDerWaalsContact O-CD1 3.31Å; I546-Y586 WeakPolarHBondContact O-CD1 3.23Å; I546-Y586 PolarHBondContact O-N 2.91Å; I546-Y586 VanDerWaalsContact O-N 3.08Å; I546-I653 HydrophobicContact CG2-CB 4.39Å; I546-I653 HydrophobicContact CG2-CG2 3.81Å
547	D	88.6	Confident	80.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	140.5	169.1	-162.5	-49.1	0	0	0	109.6	S549 I552 F557 Y586 T619 I653 T654 D655	D547-S549 WeakPolarHBondContact OD1-CB 3.38Å; D547-S549 PolarHBondContact OD1-N 3.07Å; D547-S549 PolarHBondContact OD1-OG 3.12Å; D547-I552 HydrophobicContact CB-CD1 4.06Å; D547-I552 WeakPolarHBondContact O-CD1 3.47Å; D547-F557 WeakPolarHBondContact O-CE2 3.37Å; D547-Y586 VanDerWaalsContact CA-CE1 3.48Å; D547-Y586 HydrophobicContact CB-CE1 3.94Å; D547-Y586 HydrophobicContact CB-CE2 4.13Å; D547-Y586 PolarHBondContact OD2-OH 2.7Å; D547-T619 WeakPolarHBondContact OD2-CG2 3.29Å; D547-I653 WeakPolarHBondContact CB-O 3.35Å; D547-I653 PolarHBondContact N-O 2.89Å; D547-I653 VanDerWaalsContact N-O 3.1Å; D547-T654 PolarHBondContact OD2-OG1 2.9Å; D547-D655 HydrophobicContact CB-CB 3.99Å; D547-D655 WeakPolarHBondContact OD2-CB 3.49Å
548	G	84.5	Confident	81.8	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.133	C	C	.	.			trans	-126.3	11.4	178.2	0	0	0	0	0	113	I546 Y586 T587 Y614 G616	I546-G548 PolarHBondContact O-N 2.94Å; G548-Y586 PolarHBondContact N-O 3.1Å; G548-T587 VanDerWaalsContact O-CG2 3.22Å; G548-T587 WeakPolarHBondContact O-CG2 3.01Å; G548-Y614 VanDerWaalsContact O-CE2 3.22Å; G548-Y614 WeakPolarHBondContact O-CE2 3.06Å; G548-G616 WeakPolarHBondContact O-CA 3.31Å; G548-G616 PolarHBondContact O-N 3.12Å
549	S	81.6	Confident	82.3	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-70.7	168.2	-167.6	70.4	0	0	0	0	111.6	D547 S551 I552 Y614 G617 L618 T619 D655	D547-S549 WeakPolarHBondContact OD1-CB 3.38Å; D547-S549 PolarHBondContact OD1-N 3.07Å; D547-S549 PolarHBondContact OD1-OG 3.12Å; S549-S551 PolarHBondContact O-N 3.01Å; S549-S551 PolarHBondContact OG-OG 2.89Å; S549-I552 PolarHBondContact O-N 2.82Å; S549-Y614 PolarHBondContact O-OH 2.76Å; S549-G617 WeakPolarHBondContact CB-O 3.24Å; S549-L618 WeakPolarHBondContact CB-O 3.42Å; S549-T619 VanDerWaalsContact CB-OG1 3.31Å; S549-T619 WeakPolarHBondContact CB-OG1 3.24Å; S549-T619 PolarHBondContact OG-OG1 3.29Å; S549-T619 VanDerWaalsContact OG-OG1 3.08Å; S549-D655 PolarHBondContact OG-OD1 2.59Å
550	G	75.5	Confident	82.9	Confident	42 Å²	42	21.1 Å²	21.1	43%	0.433	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-5.5	-178	0	0	0	0	0	115	G617 K1625	G550-G617 PolarHBondContact N-O 3.37Å; G550-K1625 PolarHBondContact O-NZ 3.28Å
551	S	69.9	Low	83	Confident	25 Å²	25	20.7 Å²	20.7	18%	0.175	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-24.3	176.9	4.4	0	0	0	0	114.1	S549 D655 K1621	S549-S551 PolarHBondContact O-N 3.01Å; S549-S551 PolarHBondContact OG-OG 2.89Å; S551-D655 WeakPolarHBondContact CB-OD1 3.47Å; S551-D655 WeakPolarHBondContact CB-OD2 3.37Å; S551-D655 PolarHBondContact OG-OD1 3.33Å; S551-K1621 WeakPolarHBondContact O-CD 3.48Å
552	I	79.7	Confident	83	Confident	4 Å²	4	20.7 Å²	20.7	2%	0.021	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-47.9	175	-55.5	-175.3	0	0	0	109.8	D547 S549 I556 F557 V561 Y614 D655 F706	D547-I552 HydrophobicContact CB-CD1 4.06Å; D547-I552 WeakPolarHBondContact O-CD1 3.47Å; S549-I552 PolarHBondContact O-N 2.82Å; I552-I556 HydrophobicContact CG2-CB 4.08Å; I552-I556 HydrophobicContact CG2-CG2 3.61Å; I552-I556 WeakPolarHBondContact O-CB 3.23Å; I552-F557 HydrophobicContact CD1-CD2 4.08Å; I552-F557 HydrophobicContact CG2-CB 3.89Å; I552-V561 HydrophobicContact CG2-CG2 4.45Å; I552-Y614 HydrophobicContact CB-CE2 4.34Å; I552-D655 WeakPolarHBondContact CA-OD2 3.36Å; I552-D655 HydrophobicContact CD1-CB 4.32Å; I552-D655 HydrophobicContact CG1-CB 3.82Å; I552-D655 WeakPolarHBondContact CG1-OD2 3.38Å; I552-D655 PolarHBondContact N-OD2 2.81Å; I552-F706 HydrophobicContact CG2-CZ 4.15Å
553	G	77.3	Confident	82.6	Confident	25 Å²	25	26.8 Å²	26.8	26%	0.258	14%	0.142	S	C	.	.			trans	77.3	149.8	-167.8	0	0	0	0	0	113	E555 F557 Y614	G553-E555 PolarHBondContact O-N 3.36Å; G553-F557 PolarHBondContact O-N 3.47Å; G553-Y614 WeakPolarHBondContact CA-OH 3.45Å; G553-Y614 PolarHBondContact N-OH 3.2Å
554	T	76.3	Confident	82.3	Confident	76 Å²	76	27 Å²	27	47%	0.466	14%	0.142	S	C	.	.	H	α-helix	trans	-58.1	-50.9	-171.6	-46.2	0	0	0	0	113.2	I556 F557 Y558 Y614	T554-I556 PolarHBondContact O-N 2.04Å; T554-F557 PolarHBondContact O-N 2.74Å; T554-Y558 HydrophobicContact CG2-CD2 3.97Å; T554-Y558 HydrophobicContact CG2-CE2 3.6Å; T554-Y558 WeakPolarHBondContact O-CD2 3.31Å; T554-Y558 PolarHBondContact O-N 2.96Å; T554-Y614 HydrophobicContact CG2-CD1 4.14Å; T554-Y614 WeakPolarHBondContact OG1-CD1 3.48Å; T554-Y614 WeakPolarHBondContact OG1-CE1 3.4Å
555	E	69	Low	82.1	Confident	60 Å²	60	27 Å²	27	28%	0.28	14%	0.142	S	C	.	.	H	α-helix	trans	-61.7	-44.2	-173.5	-174.4	68.8	177.1	0	0	112.2	G553 Y558 R559 V1570	G553-E555 PolarHBondContact O-N 3.36Å; E555-Y558 PolarHBondContact O-N 3.34Å; E555-R559 HydrophobicContact CG-CG 4.42Å; E555-R559 WeakPolarHBondContact O-CB 3.39Å; E555-R559 PolarHBondContact O-N 2.86Å; E555-R559 IonicContact OE1-CZ 2.71Å; E555-R559 IonicContact OE1-NE 2.58Å; E555-R559 PolarHBondContact OE1-NE 3.31Å; E555-R559 IonicContact OE1-NH2 2.65Å; E555-R559 PolarHBondContact OE1-NH2 3.19Å; E555-V1570 WeakPolarHBondContact OE2-CG1 3.19Å
556	I	76.5	Confident	81.7	Confident	58 Å²	58	29 Å²	29	30%	0.297	15%	0.152	S	C	.	.	H	α-helix	trans	-67.5	-41.2	-177.4	-72.7	-179.6	0	0	0	111	I552 T554 Y558 Y560 V561 F706	I552-I556 HydrophobicContact CG2-CB 4.08Å; I552-I556 HydrophobicContact CG2-CG2 3.61Å; I552-I556 WeakPolarHBondContact O-CB 3.23Å; T554-I556 PolarHBondContact O-N 2.04Å; I556-Y558 VanDerWaalsContact C-N 3.31Å; I556-Y558 PolarHBondContact O-N 2.85Å; I556-Y560 HydrophobicContact CB-CD2 4.48Å; I556-Y560 HydrophobicContact CG2-CD2 4.32Å; I556-Y560 PolarHBondContact O-N 3.17Å; I556-Y560 VanDerWaalsContact O-N 3.1Å; I556-V561 PolarHBondContact O-N 2.68Å; I556-F706 HydrophobicContact CB-CE2 4.4Å; I556-F706 HydrophobicContact CD1-CD2 4.32Å; I556-F706 HydrophobicContact CD1-CE2 4.17Å; I556-F706 HydrophobicContact CG2-CD1 3.82Å; I556-F706 HydrophobicContact CG2-CD2 3.4Å; I556-F706 VanDerWaalsContact CG2-CD2 3.4Å; I556-F706 HydrophobicContact CG2-CE1 3.49Å; I556-F706 VanDerWaalsContact CG2-CE1 3.49Å; I556-F706 HydrophobicContact CG2-CE2 3.06Å; I556-F706 HydrophobicContact CG2-CG 3.79Å; I556-F706 HydrophobicContact CG2-CZ 3.11Å
557	F	86	Confident	81.2	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-57.6	-43.8	175	-176	-91.9	0	0	0	111.4	I546 D547 I552 G553 T554 V561 L562 I612 Y614	I546-F557 HydrophobicContact CB-CE2 4.39Å; I546-F557 HydrophobicContact CG2-CD2 4.37Å; I546-F557 HydrophobicContact CG2-CE2 3.54Å; I546-F557 HydrophobicContact CG2-CZ 4.26Å; D547-F557 WeakPolarHBondContact O-CE2 3.37Å; I552-F557 HydrophobicContact CD1-CD2 4.08Å; I552-F557 HydrophobicContact CG2-CB 3.89Å; G553-F557 PolarHBondContact O-N 3.47Å; T554-F557 PolarHBondContact O-N 2.74Å; F557-V561 HydrophobicContact CD2-CB 4.44Å; F557-V561 WeakPolarHBondContact O-CB 3.49Å; F557-V561 PolarHBondContact O-N 2.79Å; F557-L562 HydrophobicContact CD1-CD1 4.07Å; F557-L562 HydrophobicContact CD1-CG 4.06Å; F557-L562 HydrophobicContact CE1-CD1 3.71Å; F557-L562 HydrophobicContact CE1-CD2 3.9Å; F557-L562 HydrophobicContact CE1-CG 3.71Å; F557-L562 HydrophobicContact CZ-CD2 4.02Å; F557-L562 HydrophobicContact CZ-CG 4.26Å; F557-L562 PolarHBondContact O-N 2.91Å; F557-I612 HydrophobicContact CE1-CG2 3.77Å; F557-I612 HydrophobicContact CZ-CG2 3.84Å; F557-Y614 HydrophobicContact CB-CD2 3.82Å; F557-Y614 HydrophobicContact CB-CE2 4.43Å; F557-Y614 HydrophobicContact CB-CG 4.47Å; F557-Y614 HydrophobicContact CD1-CD2 4.23Å; F557-Y614 HydrophobicContact CD1-CG 4.49Å; F557-Y614 HydrophobicContact CD2-CD2 4.01Å; F557-Y614 AromaticContact CG-CD2 3.75Å; F557-Y614 HydrophobicContact CG-CD2 3.75Å; F557-Y614 HydrophobicContact CG-CG 4.42Å
558	Y	83.6	Confident	80.9	Confident	41 Å²	41	31.4 Å²	31.4	16%	0.161	16%	0.163	C	C	.	.	I	π-helix	trans	-71.9	-54.9	175.6	-70.7	-69	0	0	0	113	T554 E555 I556 Y560 L562 I612 Q1569 V1570	T554-Y558 HydrophobicContact CG2-CD2 3.97Å; T554-Y558 HydrophobicContact CG2-CE2 3.6Å; T554-Y558 WeakPolarHBondContact O-CD2 3.31Å; T554-Y558 PolarHBondContact O-N 2.96Å; E555-Y558 PolarHBondContact O-N 3.34Å; I556-Y558 VanDerWaalsContact C-N 3.31Å; I556-Y558 PolarHBondContact O-N 2.85Å; Y558-Y560 PolarHBondContact O-N 3.26Å; Y558-L562 HydrophobicContact CD1-CD1 3.66Å; Y558-L562 HydrophobicContact CE1-CD1 3.93Å; Y558-I612 WeakPolarHBondContact CE1-O 3.45Å; Y558-I612 PolarHBondContact OH-O 3.41Å; Y558-Q1569 HydrophobicContact CD1-CB 4.3Å; Y558-V1570 VanDerWaalsContact CB-CG2 3.43Å; Y558-V1570 HydrophobicContact CD2-CG2 4.08Å; Y558-V1570 HydrophobicContact CG-CG2 3.8Å
559	R	74	Confident	81	Confident	60 Å²	60	31.4 Å²	31.4	23%	0.226	16%	0.163	C	C	.	.	I	π-helix	trans	-64.5	-35.9	-171.2	-78.5	-160.9	-170.2	-153.8	4.7	114.8	E555 R563 Y1575	E555-R559 HydrophobicContact CG-CG 4.42Å; E555-R559 WeakPolarHBondContact O-CB 3.39Å; E555-R559 PolarHBondContact O-N 2.86Å; E555-R559 IonicContact OE1-CZ 2.71Å; E555-R559 IonicContact OE1-NE 2.58Å; E555-R559 PolarHBondContact OE1-NE 3.31Å; E555-R559 IonicContact OE1-NH2 2.65Å; E555-R559 PolarHBondContact OE1-NH2 3.19Å; R559-R563 WeakPolarHBondContact O-CB 3.26Å; R559-R563 WeakPolarHBondContact O-CD 3.46Å; R559-Y1575 PolarHBondContact NH1-OH 3.05Å
560	Y	83.3	Confident	80.8	Confident	39 Å²	39	34.2 Å²	34.2	15%	0.153	18%	0.18	C	C	.	.	I	π-helix	trans	-121.1	-46.5	-168.4	-52.3	-84.5	0	0	0	112.3	I556 Y558 F564 F706 T707 E1648	I556-Y560 HydrophobicContact CB-CD2 4.48Å; I556-Y560 HydrophobicContact CG2-CD2 4.32Å; I556-Y560 PolarHBondContact O-N 3.17Å; I556-Y560 VanDerWaalsContact O-N 3.1Å; Y558-Y560 PolarHBondContact O-N 3.26Å; Y560-F564 VanDerWaalsContact O-CB 3.31Å; Y560-F564 WeakPolarHBondContact O-CB 3.4Å; Y560-F564 PolarHBondContact O-N 3.2Å; Y560-F706 HydrophobicContact CD1-CB 3.96Å; Y560-F706 WeakPolarHBondContact CD1-O 3.47Å; Y560-F706 HydrophobicContact CD2-CB 3.85Å; Y560-F706 HydrophobicContact CD2-CG 4.32Å; Y560-F706 HydrophobicContact CE1-CB 4.48Å; Y560-F706 HydrophobicContact CE2-CB 4.41Å; Y560-F706 HydrophobicContact CG-CB 3.62Å; Y560-F706 HydrophobicContact CG-CD1 4.45Å; Y560-F706 HydrophobicContact CG-CG 4.31Å; Y560-T707 HydrophobicContact CE1-CG2 3.78Å; Y560-E1648 PolarHBondContact OH-OE1 3.08Å; Y560-E1648 VanDerWaalsContact OH-OE1 3.13Å
561	V	86.2	Confident	80.7	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.006	17%	0.172	C	C	.	.	I	π-helix	trans	-71.7	-54.2	-176.1	-172.3	0	0	0	0	111.4	I546 I552 I556 F557 R563 F564 V565 I653 F706	I546-V561 HydrophobicContact CG2-CG1 3.38Å; I552-V561 HydrophobicContact CG2-CG2 4.45Å; I556-V561 PolarHBondContact O-N 2.68Å; F557-V561 HydrophobicContact CD2-CB 4.44Å; F557-V561 WeakPolarHBondContact O-CB 3.49Å; F557-V561 PolarHBondContact O-N 2.79Å; V561-R563 VanDerWaalsContact C-N 3.28Å; V561-R563 PolarHBondContact O-N 3.49Å; V561-F564 PolarHBondContact O-N 3.09Å; V561-V565 WeakPolarHBondContact O-CG2 3.33Å; V561-V565 PolarHBondContact O-N 2.83Å; V561-I653 HydrophobicContact CG1-CD1 4.3Å; V561-I653 HydrophobicContact CG1-CG2 4.08Å; V561-F706 HydrophobicContact CG2-CD1 4.21Å; V561-F706 HydrophobicContact CG2-CE1 3.55Å; V561-F706 HydrophobicContact CG2-CZ 4.46Å
562	L	87.5	Confident	81.1	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	17%	0.17	C	C	.	.	I	π-helix	trans	-66.4	-31.6	175.7	-68.3	-175.5	0	0	0	112.2	I546 F557 Y558 V565 H566 I609 I612	I546-L562 HydrophobicContact CD1-CD2 4.33Å; F557-L562 HydrophobicContact CD1-CD1 4.07Å; F557-L562 HydrophobicContact CD1-CG 4.06Å; F557-L562 HydrophobicContact CE1-CD1 3.71Å; F557-L562 HydrophobicContact CE1-CD2 3.9Å; F557-L562 HydrophobicContact CE1-CG 3.71Å; F557-L562 HydrophobicContact CZ-CD2 4.02Å; F557-L562 HydrophobicContact CZ-CG 4.26Å; F557-L562 PolarHBondContact O-N 2.91Å; Y558-L562 HydrophobicContact CD1-CD1 3.66Å; Y558-L562 HydrophobicContact CE1-CD1 3.93Å; L562-V565 PolarHBondContact O-N 3.12Å; L562-H566 WeakPolarHBondContact O-CB 3.36Å; L562-H566 PolarHBondContact O-N 3.24Å; L562-I609 HydrophobicContact CB-CG2 4.47Å; L562-I609 HydrophobicContact CD2-CG2 4.28Å; L562-I612 HydrophobicContact CD1-CB 4.08Å; L562-I612 HydrophobicContact CD1-CG2 4.46Å; L562-I612 HydrophobicContact CD2-CB 4.05Å; L562-I612 HydrophobicContact CD2-CD1 3.85Å; L562-I612 HydrophobicContact CD2-CG1 4.47Å; L562-I612 HydrophobicContact CD2-CG2 4.14Å
563	R	83	Confident	80.8	Confident	129 Å²	129	38.6 Å²	38.6	49%	0.487	19%	0.187	S	C	.	.	H	α-helix	trans	-63.4	-46.3	172.5	-175.9	-176	170	-164.2	-10.4	112.1	R559 V561 H566 E567 N710	R559-R563 WeakPolarHBondContact O-CB 3.26Å; R559-R563 WeakPolarHBondContact O-CD 3.46Å; V561-R563 VanDerWaalsContact C-N 3.28Å; V561-R563 PolarHBondContact O-N 3.49Å; R563-H566 PolarHBondContact O-N 2.75Å; R563-E567 IonicContact CZ-OE1 3.81Å; R563-E567 IonicContact NE-OE1 2.66Å; R563-E567 PolarHBondContact NE-OE1 2.84Å; R563-E567 IonicContact NH2-OE1 3.53Å; R563-E567 PolarHBondContact NH2-OE1 3.33Å; R563-E567 PolarHBondContact O-N 3.21Å; R563-N710 PolarHBondContact NE-ND2 2.87Å
564	F	86.6	Confident	80.9	Confident	4 Å²	4	38 Å²	38	2%	0.018	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-48.2	174.9	165	-111.2	0	0	0	111.3	F544 Y560 V561 H566 E567 F568 I653 L709 L713 I717	F544-F564 HydrophobicContact CE1-CE1 4.39Å; Y560-F564 VanDerWaalsContact O-CB 3.31Å; Y560-F564 WeakPolarHBondContact O-CB 3.4Å; Y560-F564 PolarHBondContact O-N 3.2Å; V561-F564 PolarHBondContact O-N 3.09Å; F564-H566 VanDerWaalsContact C-N 3.29Å; F564-H566 PolarHBondContact O-N 3.04Å; F564-E567 PolarHBondContact O-N 2.8Å; F564-F568 HydrophobicContact CD2-CB 4.38Å; F564-F568 HydrophobicContact CE2-CB 4.12Å; F564-F568 AromaticContact CE2-CD2 3.76Å; F564-F568 HydrophobicContact CE2-CD2 3.76Å; F564-F568 HydrophobicContact CE2-CG 4.27Å; F564-F568 HydrophobicContact CZ-CB 4.3Å; F564-F568 AromaticContact CZ-CD2 3.76Å; F564-F568 HydrophobicContact CZ-CD2 3.76Å; F564-F568 HydrophobicContact CZ-CE2 4.4Å; F564-F568 HydrophobicContact CZ-CG 4.16Å; F564-F568 WeakPolarHBondContact O-CB 3.43Å; F564-F568 PolarHBondContact O-N 3.44Å; F564-I653 HydrophobicContact CD1-CD1 4.12Å; F564-I653 HydrophobicContact CE1-CD1 4.12Å; F564-L709 HydrophobicContact CB-CB 4.29Å; F564-L709 HydrophobicContact CB-CD2 3.4Å; F564-L709 VanDerWaalsContact CB-CD2 3.4Å; F564-L709 HydrophobicContact CB-CG 3.59Å; F564-L709 HydrophobicContact CD1-CD2 3.96Å; F564-L709 HydrophobicContact CD1-CG 4.05Å; F564-L709 HydrophobicContact CD2-CB 4.46Å; F564-L709 HydrophobicContact CD2-CD1 4.37Å; F564-L709 HydrophobicContact CD2-CD2 4.35Å; F564-L709 HydrophobicContact CD2-CG 3.66Å; F564-L709 WeakPolarHBondContact CD2-O 3.47Å; F564-L709 HydrophobicContact CE2-CG 4.32Å; F564-L709 HydrophobicContact CG-CD1 4.34Å; F564-L709 HydrophobicContact CG-CD2 3.66Å; F564-L709 HydrophobicContact CG-CG 3.49Å; F564-L709 VanDerWaalsContact CG-CG 3.49Å; F564-L713 HydrophobicContact CE2-CD2 4.01Å; F564-L713 HydrophobicContact CZ-CD2 3.91Å; F564-I717 HydrophobicContact CZ-CD1 4.28Å
565	V	89	Confident	80.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-38.2	179.7	176.9	0	0	0	0	111	F544 I546 V561 L562 V569 I583 I609 I653	F544-V565 HydrophobicContact CD1-CG1 4.42Å; F544-V565 HydrophobicContact CD1-CG2 3.84Å; F544-V565 HydrophobicContact CD2-CG1 3.86Å; F544-V565 HydrophobicContact CE1-CG1 4.36Å; F544-V565 HydrophobicContact CE1-CG2 3.94Å; F544-V565 HydrophobicContact CE2-CG1 3.8Å; F544-V565 HydrophobicContact CG-CG1 4.17Å; F544-V565 HydrophobicContact CG-CG2 4.23Å; F544-V565 HydrophobicContact CZ-CG1 4.06Å; F544-V565 HydrophobicContact CZ-CG2 4.41Å; I546-V565 HydrophobicContact CD1-CG2 4.01Å; V561-V565 WeakPolarHBondContact O-CG2 3.33Å; V561-V565 PolarHBondContact O-N 2.83Å; L562-V565 PolarHBondContact O-N 3.12Å; V565-V569 WeakPolarHBondContact O-CG1 3.21Å; V565-V569 WeakPolarHBondContact O-CG2 3.42Å; V565-V569 PolarHBondContact O-N 2.89Å; V565-V569 VanDerWaalsContact O-N 3.15Å; V565-I583 HydrophobicContact CG1-CD1 3.64Å; V565-I609 HydrophobicContact CG1-CD1 4.16Å; V565-I609 HydrophobicContact CG1-CG1 4.44Å; V565-I609 HydrophobicContact CG1-CG2 4.49Å; V565-I653 HydrophobicContact CG2-CD1 4.04Å
566	H	85.4	Confident	81.3	Confident	43 Å²	43	40.8 Å²	40.8	20%	0.199	18%	0.18	C	C	.	.	H	α-helix	trans	-62.3	-48.5	173.4	173.9	-90.7	0	0	0	112.9	L562 R563 F564 V569 Q606 I609 R610	L562-H566 WeakPolarHBondContact O-CB 3.36Å; L562-H566 PolarHBondContact O-N 3.24Å; R563-H566 PolarHBondContact O-N 2.75Å; F564-H566 VanDerWaalsContact C-N 3.29Å; F564-H566 PolarHBondContact O-N 3.04Å; H566-V569 WeakPolarHBondContact O-CG2 3.19Å; H566-Q606 WeakPolarHBondContact NE2-CG 3.24Å; H566-Q606 PolarHBondContact NE2-OE1 3.22Å; H566-I609 HydrophobicContact CB-CG2 4.1Å; H566-R610 PolarHBondContact NE2-NH1 3.01Å
567	E	80.8	Confident	81	Confident	48 Å²	48	44.9 Å²	44.9	22%	0.224	20%	0.198	C	C	.	.	H	α-helix	trans	-70.9	-35.5	177.9	-74.9	-176.5	-149.2	0	0	112.2	R563 F564 T570 N710	R563-E567 IonicContact CZ-OE1 3.81Å; R563-E567 IonicContact NE-OE1 2.66Å; R563-E567 PolarHBondContact NE-OE1 2.84Å; R563-E567 IonicContact NH2-OE1 3.53Å; R563-E567 PolarHBondContact NH2-OE1 3.33Å; R563-E567 PolarHBondContact O-N 3.21Å; F564-E567 PolarHBondContact O-N 2.8Å; E567-T570 WeakPolarHBondContact O-CB 3.38Å; E567-T570 PolarHBondContact O-N 2.93Å; E567-T570 PolarHBondContact O-OG1 3.37Å; E567-N710 PolarHBondContact OE1-ND2 2.99Å; E567-N710 PolarHBondContact OE2-ND2 2.98Å
568	F	84	Confident	80.8	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.018	21%	0.213	C	C	.	.	H	α-helix	trans	-68.7	-40.9	-177.7	-173.6	-86.5	0	0	0	112.2	L542 F544 F564 T570 L571 F572 I717	L542-F568 HydrophobicContact CD2-CD1 4.44Å; L542-F568 HydrophobicContact CD2-CE1 4.07Å; F544-F568 HydrophobicContact CE1-CD1 4.41Å; F544-F568 AromaticContact CZ-CD1 3.69Å; F544-F568 HydrophobicContact CZ-CD1 3.69Å; F544-F568 HydrophobicContact CZ-CE1 4.17Å; F544-F568 HydrophobicContact CZ-CG 4.45Å; F564-F568 HydrophobicContact CD2-CB 4.38Å; F564-F568 HydrophobicContact CE2-CB 4.12Å; F564-F568 AromaticContact CE2-CD2 3.76Å; F564-F568 HydrophobicContact CE2-CD2 3.76Å; F564-F568 HydrophobicContact CE2-CG 4.27Å; F564-F568 HydrophobicContact CZ-CB 4.3Å; F564-F568 AromaticContact CZ-CD2 3.76Å; F564-F568 HydrophobicContact CZ-CD2 3.76Å; F564-F568 HydrophobicContact CZ-CE2 4.4Å; F564-F568 HydrophobicContact CZ-CG 4.16Å; F564-F568 WeakPolarHBondContact O-CB 3.43Å; F564-F568 PolarHBondContact O-N 3.44Å; F568-T570 PolarHBondContact O-N 3Å; F568-T570 VanDerWaalsContact O-N 3.1Å; F568-L571 HydrophobicContact CD2-CD1 4.3Å; F568-L571 HydrophobicContact CE2-CD1 4.18Å; F568-L571 WeakPolarHBondContact O-CB 3.4Å; F568-L571 PolarHBondContact O-N 3.31Å; F568-F572 HydrophobicContact CD1-CD2 4.47Å; F568-F572 AromaticContact CD1-CE2 3.97Å; F568-F572 HydrophobicContact CD1-CE2 3.97Å; F568-F572 HydrophobicContact CE1-CD2 4.26Å; F568-F572 AromaticContact CE1-CE2 3.4Å; F568-F572 HydrophobicContact CE1-CE2 3.4Å; F568-F572 VanDerWaalsContact CE1-CE2 3.4Å; F568-F572 HydrophobicContact CE1-CZ 4.12Å; F568-F572 AromaticContact CZ-CE2 3.86Å; F568-F572 HydrophobicContact CZ-CE2 3.86Å; F568-F572 HydrophobicContact CZ-CZ 4.32Å; F568-I717 HydrophobicContact CD2-CD1 4.48Å; F568-I717 HydrophobicContact CE2-CB 4Å; F568-I717 HydrophobicContact CE2-CD1 3.7Å; F568-I717 HydrophobicContact CE2-CG1 4.41Å; F568-I717 HydrophobicContact CE2-CG2 3.97Å; F568-I717 HydrophobicContact CZ-CB 4.29Å; F568-I717 HydrophobicContact CZ-CD1 4.26Å; F568-I717 HydrophobicContact CZ-CG2 3.74Å
569	V	85.1	Confident	80.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-64.5	-15.1	176.7	-62.3	0	0	0	0	113.1	F544 V565 H566 L571 F572 I574 V581 L605 I609	F544-V569 HydrophobicContact CE2-CG1 4.09Å; V565-V569 WeakPolarHBondContact O-CG1 3.21Å; V565-V569 WeakPolarHBondContact O-CG2 3.42Å; V565-V569 PolarHBondContact O-N 2.89Å; V565-V569 VanDerWaalsContact O-N 3.15Å; H566-V569 WeakPolarHBondContact O-CG2 3.19Å; V569-L571 PolarHBondContact O-N 2.78Å; V569-F572 PolarHBondContact O-N 2.9Å; V569-I574 HydrophobicContact CB-CD1 4.4Å; V569-V581 HydrophobicContact CG1-CG1 4.17Å; V569-V581 HydrophobicContact CG1-CG2 4.12Å; V569-L605 HydrophobicContact CB-CD2 3.98Å; V569-L605 HydrophobicContact CG1-CD2 4.06Å; V569-L605 HydrophobicContact CG2-CD2 4.02Å; V569-I609 HydrophobicContact CG1-CD1 4.3Å; V569-I609 HydrophobicContact CG2-CD1 3.77Å
570	T	78.5	Confident	81.4	Confident	59 Å²	59	46.2 Å²	46.2	36%	0.362	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-71.4	-12	172.2	73.3	0	0	0	0	114.3	E567 F568 F572 I602 R714	E567-T570 WeakPolarHBondContact O-CB 3.38Å; E567-T570 PolarHBondContact O-N 2.93Å; E567-T570 PolarHBondContact O-OG1 3.37Å; F568-T570 PolarHBondContact O-N 3Å; F568-T570 VanDerWaalsContact O-N 3.1Å; T570-F572 PolarHBondContact O-N 3.14Å; T570-I602 HydrophobicContact CG2-CD1 4.48Å; T570-R714 PolarHBondContact OG1-NH2 3.36Å
571	L	72.5	Confident	81.8	Confident	49 Å²	49	44.3 Å²	44.3	26%	0.257	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-70.7	-18.4	168.9	-74.3	177.7	0	0	0	113.2	F568 V569 R714	F568-L571 HydrophobicContact CD2-CD1 4.3Å; F568-L571 HydrophobicContact CE2-CD1 4.18Å; F568-L571 WeakPolarHBondContact O-CB 3.4Å; F568-L571 PolarHBondContact O-N 3.31Å; V569-L571 PolarHBondContact O-N 2.78Å; L571-R714 HydrophobicContact CD1-CG 3.72Å; L571-R714 HydrophobicContact CD2-CG 4.32Å; L571-R714 HydrophobicContact CG-CG 4.18Å
572	F	78.9	Confident	82	Confident	29 Å²	29	44.3 Å²	44.3	13%	0.127	20%	0.197	C	C	.	.	S	Bend	trans	-118.3	135.5	-165.4	-66.9	-87.1	0	0	0	111.6	F568 V569 T570 I574 T579 M721	F568-F572 HydrophobicContact CD1-CD2 4.47Å; F568-F572 AromaticContact CD1-CE2 3.97Å; F568-F572 HydrophobicContact CD1-CE2 3.97Å; F568-F572 HydrophobicContact CE1-CD2 4.26Å; F568-F572 AromaticContact CE1-CE2 3.4Å; F568-F572 HydrophobicContact CE1-CE2 3.4Å; F568-F572 VanDerWaalsContact CE1-CE2 3.4Å; F568-F572 HydrophobicContact CE1-CZ 4.12Å; F568-F572 AromaticContact CZ-CE2 3.86Å; F568-F572 HydrophobicContact CZ-CE2 3.86Å; F568-F572 HydrophobicContact CZ-CZ 4.32Å; V569-F572 PolarHBondContact O-N 2.9Å; T570-F572 PolarHBondContact O-N 3.14Å; F572-I574 HydrophobicContact CB-CD1 3.94Å; F572-I574 WeakPolarHBondContact O-CD1 3.23Å; F572-I574 WeakPolarHBondContact O-CG1 3.5Å; F572-I574 PolarHBondContact O-N 3.13Å; F572-T579 HydrophobicContact CB-CG2 3.79Å; F572-T579 HydrophobicContact CD1-CG2 4Å; F572-T579 HydrophobicContact CG-CG2 4.06Å; F572-M721 HydrophobicContact CE1-CE 3.58Å; F572-M721 HydrophobicContact CZ-CE 3.6Å; F572-M721 HydrophobicContact CZ-SD 4.08Å
573	E	72.6	Confident	82.3	Confident	84 Å²	84	44.3 Å²	44.3	39%	0.393	20%	0.197	S	C	.	.			trans	-75.2	101.7	171.5	-168.1	-173.8	135.8	0	0	109.8	M537 N575 K578 T579	M537-E573 HydrophobicContact CE-CB 3.61Å; E573-N575 PolarHBondContact O-N 3.46Å; E573-N575 PolarHBondContact OE1-ND2 3.08Å; E573-K578 HydrophobicContact CB-CD 4.18Å; E573-K578 VanDerWaalsContact CD-CD 3.49Å; E573-K578 HydrophobicContact CG-CD 4.25Å; E573-K578 WeakPolarHBondContact OE1-CD 3.45Å; E573-K578 WeakPolarHBondContact OE1-CE 3.03Å; E573-K578 IonicContact OE1-NZ 2.75Å; E573-K578 PolarHBondContact OE1-NZ 2.8Å; E573-K578 WeakPolarHBondContact OE2-CD 3.37Å; E573-K578 IonicContact OE2-NZ 2.59Å; E573-K578 PolarHBondContact OE2-NZ 2.8Å; E573-T579 WeakPolarHBondContact O-CB 3.43Å; E573-T579 PolarHBondContact O-N 2.94Å; E573-T579 PolarHBondContact O-OG1 3.32Å
574	I	81	Confident	82.7	Confident	12 Å²	12	38.1 Å²	38.1	6%	0.062	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-77	100	-177.7	-49.3	-54.2	0	0	0	109.7	V569 F572 T579 V581 I602 L605	V569-I574 HydrophobicContact CB-CD1 4.4Å; F572-I574 HydrophobicContact CB-CD1 3.94Å; F572-I574 WeakPolarHBondContact O-CD1 3.23Å; F572-I574 WeakPolarHBondContact O-CG1 3.5Å; F572-I574 PolarHBondContact O-N 3.13Å; I574-T579 WeakPolarHBondContact CA-O 3.24Å; I574-T579 HydrophobicContact CD1-CG2 4.25Å; I574-V581 HydrophobicContact CD1-CG2 3.79Å; I574-I602 HydrophobicContact CB-CB 4.16Å; I574-I602 HydrophobicContact CG1-CB 4.03Å; I574-I602 HydrophobicContact CG1-CD1 4.38Å; I574-I602 HydrophobicContact CG1-CG1 4.05Å; I574-L605 HydrophobicContact CD1-CD2 3.82Å; I574-L605 HydrophobicContact CG1-CD2 3.81Å; I574-L605 HydrophobicContact CG2-CB 4.41Å; I574-L605 HydrophobicContact CG2-CD2 3.91Å
575	N	75.9	Confident	83	Confident	31 Å²	31	38 Å²	38	17%	0.166	17%	0.174	C	C	.	.	S	Bend	trans	-153.9	178	176.3	79.7	43.7	0	0	0	111.8	E573 Q577 K578 T579	E573-N575 PolarHBondContact O-N 3.46Å; E573-N575 PolarHBondContact OE1-ND2 3.08Å; N575-Q577 VanDerWaalsContact C-N 3.35Å; N575-Q577 PolarHBondContact O-N 2.75Å; N575-Q577 WeakPolarHBondContact OD1-CA 3.45Å; N575-Q577 PolarHBondContact OD1-N 3.25Å; N575-K578 PolarHBondContact OD1-N 2.74Å; N575-T579 PolarHBondContact N-O 3.13Å; N575-T579 VanDerWaalsContact N-O 3.1Å; N575-T579 VanDerWaalsContact O-O 3.06Å
576	R	76.7	Confident	83	Confident	164 Å²	164	38 Å²	38	62%	0.619	17%	0.174	S	C	*	.	S	Bend	trans	-68.2	-27.1	-174.6	-69	-173.8	177.1	-166	-3.5	114.6	R580 T600	R576-R580 PolarHBondContact O-NE 2.05Å; R576-R580 PolarHBondContact O-NH2 2.04Å; R576-T600 HydrophobicContact CG-CG2 3.7Å
577	Q	70.5	Confident	83	Confident	144 Å²	144	36 Å²	36	67%	0.673	16%	0.164	S	C	*	.	S	Bend	trans	-104.5	-26	-176.2	-65.4	99.1	-32.3	0	0	114.4	N575 R640	N575-Q577 VanDerWaalsContact C-N 3.35Å; N575-Q577 PolarHBondContact O-N 2.75Å; N575-Q577 WeakPolarHBondContact OD1-CA 3.45Å; N575-Q577 PolarHBondContact OD1-N 3.25Å; Q577-R640 VanDerWaalsContact C-NH1 3.27Å; Q577-R640 PolarHBondContact O-NH1 2.9Å
578	K	80.8	Confident	82.6	Confident	73 Å²	73	34.4 Å²	34.4	32%	0.317	16%	0.161	S	C	.	.	S	Bend	trans	-99.4	-96	-178.2	-64.4	-177.9	-172.4	161.2	0	111.5	P539 T540 E573 N575 R640	P539-K578 CarbonylContact C-O 3.56Å; P539-K578 WeakPolarHBondContact CA-O 3.49Å; T540-K578 PolarHBondContact N-O 3.43Å; E573-K578 HydrophobicContact CB-CD 4.18Å; E573-K578 VanDerWaalsContact CD-CD 3.49Å; E573-K578 HydrophobicContact CG-CD 4.25Å; E573-K578 WeakPolarHBondContact OE1-CD 3.45Å; E573-K578 WeakPolarHBondContact OE1-CE 3.03Å; E573-K578 IonicContact OE1-NZ 2.75Å; E573-K578 PolarHBondContact OE1-NZ 2.8Å; E573-K578 WeakPolarHBondContact OE2-CD 3.37Å; E573-K578 IonicContact OE2-NZ 2.59Å; E573-K578 PolarHBondContact OE2-NZ 2.8Å; N575-K578 PolarHBondContact OD1-N 2.74Å; K578-R640 VanDerWaalsContact O-CZ 3.28Å; K578-R640 PolarHBondContact O-NH1 2.72Å; K578-R640 PolarHBondContact O-NH2 2.81Å
579	T	85.1	Confident	82.4	Confident	4 Å²	4	41.1 Å²	41.1	3%	0.025	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.1	-178.2	-44.5	0	0	0	0	112.5	T540 L542 F572 E573 I574 N575 V581	T540-T579 HydrophobicContact CG2-CG2 4.46Å; T540-T579 VanDerWaalsContact O-CA 3.31Å; T540-T579 WeakPolarHBondContact O-CA 3.31Å; L542-T579 HydrophobicContact CB-CG2 4.47Å; F572-T579 HydrophobicContact CB-CG2 3.79Å; F572-T579 HydrophobicContact CD1-CG2 4Å; F572-T579 HydrophobicContact CG-CG2 4.06Å; E573-T579 WeakPolarHBondContact O-CB 3.43Å; E573-T579 PolarHBondContact O-N 2.94Å; E573-T579 PolarHBondContact O-OG1 3.32Å; I574-T579 WeakPolarHBondContact CA-O 3.24Å; I574-T579 HydrophobicContact CD1-CG2 4.25Å; N575-T579 PolarHBondContact N-O 3.13Å; N575-T579 VanDerWaalsContact N-O 3.1Å; N575-T579 VanDerWaalsContact O-O 3.06Å; T579-V581 HydrophobicContact CG2-CG2 4.25Å
580	R	87.1	Confident	82.4	Confident	52 Å²	52	42.9 Å²	42.9	20%	0.196	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.8	169.1	-62.7	-178.6	-174.9	-172.9	4.2	108.5	T540 D541 L542 R576 L596 G638	T540-R580 PolarHBondContact O-N 3.46Å; D541-R580 WeakPolarHBondContact OD1-CD 3.43Å; L542-R580 PolarHBondContact N-O 3.43Å; R576-R580 PolarHBondContact O-NE 2.05Å; R576-R580 PolarHBondContact O-NH2 2.04Å; R580-L596 HydrophobicContact CB-CD2 3.93Å; R580-L596 WeakPolarHBondContact O-CD2 3.03Å; R580-G638 PolarHBondContact NH1-O 3.27Å
581	V	90.8	Very high	82.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.7	-180	-178.3	0	0	0	0	110.7	L542 F544 V569 I574 T579 I583 F594 L605	L542-V581 HydrophobicContact CB-CG2 4.36Å; L542-V581 HydrophobicContact CD2-CG2 4.28Å; L542-V581 CarbonylContact O-C 3.22Å; L542-V581 VanDerWaalsContact O-CA 3.26Å; L542-V581 WeakPolarHBondContact O-CA 3.35Å; F544-V581 HydrophobicContact CD2-CG1 4.24Å; F544-V581 HydrophobicContact CE2-CG1 4.22Å; V569-V581 HydrophobicContact CG1-CG1 4.17Å; V569-V581 HydrophobicContact CG1-CG2 4.12Å; I574-V581 HydrophobicContact CD1-CG2 3.79Å; T579-V581 HydrophobicContact CG2-CG2 4.25Å; V581-I583 HydrophobicContact CG1-CG1 4.42Å; V581-F594 HydrophobicContact CG1-CE2 4.42Å; V581-L605 HydrophobicContact CB-CD1 3.9Å; V581-L605 HydrophobicContact CB-CD2 3.74Å; V581-L605 HydrophobicContact CB-CG 4.5Å; V581-L605 HydrophobicContact CG1-CD1 4.01Å; V581-L605 HydrophobicContact CG1-CD2 4.19Å; V581-L605 HydrophobicContact CG2-CD2 3.76Å
582	G	89.9	Confident	83.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	152.2	168.4	0	0	0	0	0	110.8	L542 V543 F544 F594	L542-G582 PolarHBondContact O-N 2.64Å; V543-G582 WeakPolarHBondContact CA-O 3.23Å; F544-G582 PolarHBondContact N-O 3.43Å; G582-F594 WeakPolarHBondContact CA-O 3.48Å
583	I	94.5	Very high	83.9	Confident	1 Å²	1	43 Å²	43	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.2	177.6	-60.4	-175.3	0	0	0	110.3	F544 I546 V565 V581 E593 F594 I609 I612	F544-I583 HydrophobicContact CB-CG1 4.25Å; F544-I583 HydrophobicContact CD2-CD1 4.49Å; F544-I583 HydrophobicContact CD2-CG1 4.19Å; I546-I583 HydrophobicContact CD1-CD1 4.43Å; I546-I583 HydrophobicContact CD1-CG2 3.48Å; I546-I583 VanDerWaalsContact CD1-CG2 3.48Å; I546-I583 HydrophobicContact CG1-CG2 3.91Å; V565-I583 HydrophobicContact CG1-CD1 3.64Å; V581-I583 HydrophobicContact CG1-CG1 4.42Å; I583-E593 HydrophobicContact CB-CB 4.49Å; I583-E593 HydrophobicContact CG2-CB 4.44Å; I583-E593 HydrophobicContact CG2-CG 4.26Å; I583-E593 PolarHBondContact O-N 2.68Å; I583-F594 HydrophobicContact CB-CE1 4.12Å; I583-F594 HydrophobicContact CB-CE2 4.18Å; I583-F594 HydrophobicContact CB-CZ 3.91Å; I583-F594 HydrophobicContact CD1-CE1 3.98Å; I583-F594 HydrophobicContact CD1-CE2 4.22Å; I583-F594 HydrophobicContact CD1-CZ 3.43Å; I583-F594 VanDerWaalsContact CD1-CZ 3.43Å; I583-F594 HydrophobicContact CG1-CE1 4.15Å; I583-F594 HydrophobicContact CG1-CE2 3.81Å; I583-F594 HydrophobicContact CG1-CZ 3.5Å; I583-F594 VanDerWaalsContact CG1-CZ 3.5Å; I583-F594 PolarHBondContact N-O 3.13Å; I583-F594 PolarHBondContact O-N 2.67Å; I583-I609 HydrophobicContact CD1-CD1 4.41Å; I583-I609 HydrophobicContact CD1-CG1 3.72Å; I583-I612 HydrophobicContact CB-CD1 4.24Å; I583-I612 HydrophobicContact CD1-CD1 3.85Å; I583-I612 HydrophobicContact CG2-CD1 3.73Å
584	V	92	Very high	84.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.6	177	179.6	0	0	0	0	108.2	V543 F544 L545 I546 V590 K591 F627 T632	V543-V584 HydrophobicContact CG1-CG2 4.45Å; F544-V584 PolarHBondContact O-N 3.3Å; L545-V584 HydrophobicContact CD2-CB 3.76Å; L545-V584 HydrophobicContact CD2-CG1 3.89Å; L545-V584 HydrophobicContact CD2-CG2 4.4Å; I546-V584 PolarHBondContact N-O 2.85Å; V584-V590 HydrophobicContact CG1-CG1 3.33Å; V584-K591 CarbonylContact C-O 3.01Å; V584-K591 WeakPolarHBondContact CA-O 3.23Å; V584-K591 WeakPolarHBondContact CG1-O 3.19Å; V584-F627 HydrophobicContact CG1-CD1 3.94Å; V584-F627 HydrophobicContact CG1-CE1 4.05Å; V584-F627 HydrophobicContact CG2-CD1 4.39Å; V584-F627 HydrophobicContact CG2-CE1 4.18Å; V584-T632 HydrophobicContact CG2-CG2 4.28Å; V584-T632 WeakPolarHBondContact CG2-OG1 3.09Å
585	Q	91.6	Very high	85.2	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	137.2	168.5	-170.1	165.9	42.1	0	0	110.6	I546 K591 E593 R613 I615	I546-Q585 WeakPolarHBondContact O-CA 3.44Å; Q585-K591 PolarHBondContact N-O 3.47Å; Q585-K591 CarbonylContact O-C 3.45Å; Q585-K591 PolarHBondContact O-N 3.21Å; Q585-E593 HydrophobicContact CB-CG 4.4Å; Q585-R613 PolarHBondContact OE1-O 3.45Å; Q585-I615 HydrophobicContact CB-CD1 4.25Å; Q585-I615 HydrophobicContact CG-CD1 3.88Å; Q585-I615 HydrophobicContact CG-CG1 4.08Å
586	Y	88.7	Confident	85.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	141.2	179.7	68.7	-85.2	0	0	0	113.2	L545 I546 D547 G548 T619 T621 A624 I653 T654	L545-Y586 HydrophobicContact CB-CD1 4.14Å; L545-Y586 HydrophobicContact CB-CE1 3.85Å; I546-Y586 VanDerWaalsContact C-CE1 3.43Å; I546-Y586 VanDerWaalsContact O-CD1 3.31Å; I546-Y586 WeakPolarHBondContact O-CD1 3.23Å; I546-Y586 PolarHBondContact O-N 2.91Å; I546-Y586 VanDerWaalsContact O-N 3.08Å; D547-Y586 VanDerWaalsContact CA-CE1 3.48Å; D547-Y586 HydrophobicContact CB-CE1 3.94Å; D547-Y586 HydrophobicContact CB-CE2 4.13Å; D547-Y586 PolarHBondContact OD2-OH 2.7Å; G548-Y586 PolarHBondContact N-O 3.1Å; Y586-T619 HydrophobicContact CE2-CG2 4.48Å; Y586-T621 HydrophobicContact CE2-CG2 4.11Å; Y586-A624 VanDerWaalsContact CB-CB 3.48Å; Y586-A624 HydrophobicContact CD1-CB 3.65Å; Y586-A624 HydrophobicContact CD2-CB 3.57Å; Y586-A624 HydrophobicContact CE1-CB 4.23Å; Y586-A624 HydrophobicContact CE2-CB 4.16Å; Y586-A624 HydrophobicContact CG-CB 3.27Å; Y586-I653 WeakPolarHBondContact CE1-O 3.38Å; Y586-I653 PolarHBondContact OH-O 3.04Å; Y586-T654 WeakPolarHBondContact OH-CB 3.41Å; Y586-T654 PolarHBondContact OH-OG1 3.09Å
587	T	85.5	Confident	85.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-139.1	-123.9	176.3	72.1	0	0	0	0	111	G548 H589 I615 G616 L618 K620	G548-T587 VanDerWaalsContact O-CG2 3.22Å; G548-T587 WeakPolarHBondContact O-CG2 3.01Å; T587-H589 PolarHBondContact N-O 3.38Å; T587-H589 PolarHBondContact O-N 2.88Å; T587-I615 HydrophobicContact CG2-CD1 3.91Å; T587-I615 HydrophobicContact CG2-CG1 3.54Å; T587-G616 VanDerWaalsContact CB-O 3.24Å; T587-G616 WeakPolarHBondContact CB-O 3.15Å; T587-G616 VanDerWaalsContact CG2-O 3.23Å; T587-G616 WeakPolarHBondContact CG2-O 3.4Å; T587-G616 PolarHBondContact OG1-O 3.14Å; T587-L618 CarbonylContact C-O 3.49Å; T587-L618 WeakPolarHBondContact CA-O 3.1Å; T587-L618 VanDerWaalsContact CB-O 3.26Å; T587-L618 WeakPolarHBondContact CB-O 3.24Å; T587-K620 VanDerWaalsContact O-CB 3.29Å; T587-K620 WeakPolarHBondContact O-CB 3.15Å; T587-K620 PolarHBondContact O-N 2.9Å
588	G	73.3	Confident	86.3	Confident	16 Å²	16	31.6 Å²	31.6	17%	0.165	16%	0.159	C	C	.	.	S	Bend	trans	-72.2	-11.1	165.4	0	0	0	0	0	113.1	L618	G588-L618 PolarHBondContact N-O 3.22Å
589	H	78.7	Confident	86.5	Confident	144 Å²	144	29.7 Å²	29.7	67%	0.667	15%	0.151	S	C	*	.	S	Bend	trans	-141.7	158.1	176.3	-0	-94	0	0	0	108.3	T587	T587-H589 PolarHBondContact N-O 3.38Å; T587-H589 PolarHBondContact O-N 2.88Å
590	V	86	Confident	86.1	Confident	38 Å²	38	31.8 Å²	31.8	23%	0.23	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.4	-177.7	-170.4	0	0	0	0	110.5	V584 A623 A624 F627	V584-V590 HydrophobicContact CG1-CG1 3.33Å; V590-A623 HydrophobicContact CG2-CB 4.29Å; V590-A624 HydrophobicContact CG2-CB 4.32Å; V590-F627 HydrophobicContact CB-CB 4.18Å; V590-F627 HydrophobicContact CB-CD2 4.15Å; V590-F627 HydrophobicContact CB-CG 4.05Å; V590-F627 HydrophobicContact CG1-CB 3.79Å; V590-F627 HydrophobicContact CG1-CD1 3.58Å; V590-F627 HydrophobicContact CG1-CD2 4.06Å; V590-F627 HydrophobicContact CG1-CE1 4.16Å; V590-F627 HydrophobicContact CG1-CG 3.54Å; V590-F627 HydrophobicContact CG2-CB 4.28Å
591	K	85.5	Confident	85.7	Confident	72 Å²	72	31.5 Å²	31.5	31%	0.313	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.3	-177.4	176.5	-174.2	168.1	-127.1	0	109.4	V584 Q585 E593 R613 I615	V584-K591 CarbonylContact C-O 3.01Å; V584-K591 WeakPolarHBondContact CA-O 3.23Å; V584-K591 WeakPolarHBondContact CG1-O 3.19Å; Q585-K591 PolarHBondContact N-O 3.47Å; Q585-K591 CarbonylContact O-C 3.45Å; Q585-K591 PolarHBondContact O-N 3.21Å; K591-E593 VanDerWaalsContact CD-OE1 3.26Å; K591-E593 WeakPolarHBondContact CD-OE1 3.36Å; K591-E593 WeakPolarHBondContact CE-OE1 3.47Å; K591-E593 WeakPolarHBondContact CG-OE1 3.48Å; K591-E593 IonicContact NZ-OE1 3.09Å; K591-E593 PolarHBondContact NZ-OE1 2.86Å; K591-E593 IonicContact NZ-OE2 3.25Å; K591-E593 PolarHBondContact NZ-OE2 3.2Å; K591-R613 PolarHBondContact NZ-O 3.43Å; K591-I615 HydrophobicContact CB-CD1 3.95Å; K591-I615 HydrophobicContact CD-CD1 3.99Å; K591-I615 HydrophobicContact CD-CG2 3.67Å
592	S	87.4	Confident	85.4	Confident	27 Å²	27	34 Å²	34	19%	0.189	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130.9	168.4	-156.9	0	0	0	0	109.6	F595	S592-F595 VanDerWaalsContact CB-CZ 3.44Å; S592-F595 WeakPolarHBondContact OG-CD1 3.43Å; S592-F595 VanDerWaalsContact OG-CE1 3.29Å; S592-F595 WeakPolarHBondContact OG-CE1 3.41Å
593	E	89.3	Confident	84.9	Confident	41 Å²	41	38.8 Å²	38.8	19%	0.192	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-45.3	170.1	-57.1	-56.8	120.6	0	0	110.1	I583 Q585 K591 I612	I583-E593 HydrophobicContact CB-CB 4.49Å; I583-E593 HydrophobicContact CG2-CB 4.44Å; I583-E593 HydrophobicContact CG2-CG 4.26Å; I583-E593 PolarHBondContact O-N 2.68Å; Q585-E593 HydrophobicContact CB-CG 4.4Å; K591-E593 VanDerWaalsContact CD-OE1 3.26Å; K591-E593 WeakPolarHBondContact CD-OE1 3.36Å; K591-E593 WeakPolarHBondContact CE-OE1 3.47Å; K591-E593 WeakPolarHBondContact CG-OE1 3.48Å; K591-E593 IonicContact NZ-OE1 3.09Å; K591-E593 PolarHBondContact NZ-OE1 2.86Å; K591-E593 IonicContact NZ-OE2 3.25Å; K591-E593 PolarHBondContact NZ-OE2 3.2Å; E593-I612 HydrophobicContact CB-CD1 4.18Å; E593-I612 HydrophobicContact CB-CG1 3.98Å; E593-I612 HydrophobicContact CG-CB 4.37Å; E593-I612 HydrophobicContact CG-CD1 4.02Å; E593-I612 HydrophobicContact CG-CG1 3.85Å; E593-I612 HydrophobicContact CG-CG2 3.79Å
594	F	91.1	Very high	84.3	Confident	5 Å²	5	44.6 Å²	44.6	2%	0.022	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	147.2	169.4	51.8	-97.1	0	0	0	111.5	V581 G582 I583 Q598 H599 L605 A608 I609 I612	V581-F594 HydrophobicContact CG1-CE2 4.42Å; G582-F594 WeakPolarHBondContact CA-O 3.48Å; I583-F594 HydrophobicContact CB-CE1 4.12Å; I583-F594 HydrophobicContact CB-CE2 4.18Å; I583-F594 HydrophobicContact CB-CZ 3.91Å; I583-F594 HydrophobicContact CD1-CE1 3.98Å; I583-F594 HydrophobicContact CD1-CE2 4.22Å; I583-F594 HydrophobicContact CD1-CZ 3.43Å; I583-F594 VanDerWaalsContact CD1-CZ 3.43Å; I583-F594 HydrophobicContact CG1-CE1 4.15Å; I583-F594 HydrophobicContact CG1-CE2 3.81Å; I583-F594 HydrophobicContact CG1-CZ 3.5Å; I583-F594 VanDerWaalsContact CG1-CZ 3.5Å; I583-F594 PolarHBondContact N-O 3.13Å; I583-F594 PolarHBondContact O-N 2.67Å; F594-Q598 VanDerWaalsContact CA-OE1 3.31Å; F594-Q598 HydrophobicContact CB-CB 4.36Å; F594-Q598 VanDerWaalsContact CB-CD 3.47Å; F594-Q598 HydrophobicContact CB-CG 4.28Å; F594-Q598 VanDerWaalsContact CB-OE1 3.32Å; F594-H599 AromaticContact CD2-CD2 3.7Å; F594-H599 AromaticContact CG-CD2 3.69Å; F594-H599 AromaticContact CG-NE2 3.89Å; F594-L605 HydrophobicContact CD2-CD1 4.46Å; F594-L605 HydrophobicContact CE2-CD1 3.39Å; F594-L605 HydrophobicContact CZ-CD1 3.47Å; F594-L605 VanDerWaalsContact CZ-CD1 3.47Å; F594-A608 HydrophobicContact CD1-CB 3.84Å; F594-A608 HydrophobicContact CE1-CB 3.61Å; F594-A608 HydrophobicContact CZ-CB 4.26Å; F594-I609 HydrophobicContact CE1-CG1 4.44Å; F594-I609 HydrophobicContact CZ-CG1 4.07Å; F594-I612 HydrophobicContact CE1-CD1 4.19Å
595	F	89.1	Confident	84.1	Confident	50 Å²	50	44.6 Å²	44.6	22%	0.219	23%	0.23	C	C	.	.			trans	-88.5	169.3	-178.6	-66.4	-75	0	0	0	112.3	S592 Q598 F627 T632 M637	S592-F595 VanDerWaalsContact CB-CZ 3.44Å; S592-F595 WeakPolarHBondContact OG-CD1 3.43Å; S592-F595 VanDerWaalsContact OG-CE1 3.29Å; S592-F595 WeakPolarHBondContact OG-CE1 3.41Å; F595-Q598 VanDerWaalsContact O-CB 3.27Å; F595-Q598 WeakPolarHBondContact O-CB 3.11Å; F595-Q598 PolarHBondContact O-N 3.34Å; F595-F627 HydrophobicContact CE1-CE1 4.46Å; F595-T632 HydrophobicContact CD1-CG2 4.29Å; F595-M637 HydrophobicContact CB-CB 4.13Å; F595-M637 HydrophobicContact CD1-CB 3.71Å; F595-M637 HydrophobicContact CD1-CG 3.75Å; F595-M637 HydrophobicContact CD1-SD 3.81Å; F595-M637 HydrophobicContact CD2-SD 3.8Å; F595-M637 HydrophobicContact CE1-CB 4.37Å; F595-M637 HydrophobicContact CE1-CE 4.08Å; F595-M637 HydrophobicContact CE1-CG 3.91Å; F595-M637 HydrophobicContact CE1-SD 3.85Å; F595-M637 HydrophobicContact CE2-CE 4.09Å; F595-M637 HydrophobicContact CE2-SD 3.83Å; F595-M637 HydrophobicContact CG-CB 4.05Å; F595-M637 HydrophobicContact CG-CG 4.2Å; F595-M637 HydrophobicContact CG-SD 3.79Å; F595-M637 HydrophobicContact CZ-CE 3.78Å; F595-M637 HydrophobicContact CZ-CG 4.49Å; F595-M637 HydrophobicContact CZ-SD 3.85Å
596	L	83.7	Confident	83.9	Confident	4 Å²	4	46 Å²	46	2%	0.021	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	140.4	178.3	-72.9	161.9	0	0	0	110.2	D541 V543 R580 Q598 F633 M637 G638 A639	D541-L596 HydrophobicContact CB-CD1 4.18Å; D541-L596 HydrophobicContact CB-CD2 4.24Å; V543-L596 HydrophobicContact CG2-CD1 3.84Å; V543-L596 HydrophobicContact CG2-CD2 4.01Å; V543-L596 HydrophobicContact CG2-CG 3.97Å; R580-L596 HydrophobicContact CB-CD2 3.93Å; R580-L596 WeakPolarHBondContact O-CD2 3.03Å; L596-Q598 PolarHBondContact O-N 3.05Å; L596-Q598 VanDerWaalsContact O-N 3.13Å; L596-F633 HydrophobicContact CD1-CD1 3.92Å; L596-F633 HydrophobicContact CD1-CE1 4.08Å; L596-M637 WeakPolarHBondContact CB-O 3.49Å; L596-M637 PolarHBondContact N-O 3.33Å; L596-M637 VanDerWaalsContact O-O 3.13Å; L596-G638 WeakPolarHBondContact O-CA 3.42Å; L596-A639 HydrophobicContact CD1-CB 3.73Å
597	G	78.2	Confident	83.6	Confident	25 Å²	25	49.7 Å²	49.7	26%	0.258	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	-4.3	179.7	0	0	0	0	0	116.1	H599 T600	G597-H599 VanDerWaalsContact C-N 3.26Å; G597-H599 PolarHBondContact O-N 3.01Å; G597-T600 WeakPolarHBondContact O-CG2 2.84Å
598	Q	83.5	Confident	83.6	Confident	110 Å²	110	50.4 Å²	50.4	51%	0.514	26%	0.263	S	S	.	.	S	Bend	trans	-64.7	-32	173.2	-174.1	173.2	-25.6	0	0	112	F594 F595 L596	F594-Q598 VanDerWaalsContact CA-OE1 3.31Å; F594-Q598 HydrophobicContact CB-CB 4.36Å; F594-Q598 VanDerWaalsContact CB-CD 3.47Å; F594-Q598 HydrophobicContact CB-CG 4.28Å; F594-Q598 VanDerWaalsContact CB-OE1 3.32Å; F595-Q598 VanDerWaalsContact O-CB 3.27Å; F595-Q598 WeakPolarHBondContact O-CB 3.11Å; F595-Q598 PolarHBondContact O-N 3.34Å; L596-Q598 PolarHBondContact O-N 3.05Å; L596-Q598 VanDerWaalsContact O-N 3.13Å
599	H	84.4	Confident	84.4	Confident	34 Å²	34	49.7 Å²	49.7	16%	0.157	26%	0.255	C	S	.	.			trans	-120.7	116.4	171.4	-57.2	-75.2	0	0	0	109	F594 G597 L605 A608	F594-H599 AromaticContact CD2-CD2 3.7Å; F594-H599 AromaticContact CG-CD2 3.69Å; F594-H599 AromaticContact CG-NE2 3.89Å; G597-H599 VanDerWaalsContact C-N 3.26Å; G597-H599 PolarHBondContact O-N 3.01Å; H599-L605 HydrophobicContact CB-CB 4Å; H599-L605 HydrophobicContact CB-CD1 4.17Å; H599-A608 WeakPolarHBondContact NE2-CB 3.48Å
600	T	78.2	Confident	84.6	Confident	48 Å²	48	46.1 Å²	46.1	29%	0.294	24%	0.235	S	C	.	.			trans	-114.8	27.7	-175.4	72.9	0	0	0	0	112.3	R576 G597	R576-T600 HydrophobicContact CG-CG2 3.7Å; G597-T600 WeakPolarHBondContact O-CG2 2.84Å
601	D	79	Confident	84.6	Confident	46 Å²	46	47.9 Å²	47.9	25%	0.246	24%	0.243	C	C	.	.	S	Bend	trans	-162	129.1	-164.5	167.8	-4.8	0	0	0	106.5	D603 K604 L605	D601-D603 PolarHBondContact O-N 3.35Å; D601-D603 PolarHBondContact OD1-N 3.34Å; D601-K604 HydrophobicContact CB-CB 4.25Å; D601-K604 HydrophobicContact CB-CD 4.25Å; D601-K604 HydrophobicContact CB-CG 4.27Å; D601-K604 PolarHBondContact O-N 2.83Å; D601-K604 WeakPolarHBondContact OD2-CG 3.46Å; D601-K604 IonicContact OD2-NZ 3.49Å; D601-K604 PolarHBondContact OD2-NZ 3.43Å; D601-L605 WeakPolarHBondContact O-CB 3.41Å; D601-L605 PolarHBondContact O-N 3.01Å
602	I	84.3	Confident	84.8	Confident	53 Å²	53	44.6 Å²	44.6	27%	0.272	23%	0.23	S	C	.	.	H	α-helix	trans	-63.5	-37.3	-173.1	-168.1	167.7	0	0	0	112.5	T570 I574 K604 L605 Q606	T570-I602 HydrophobicContact CG2-CD1 4.48Å; I574-I602 HydrophobicContact CB-CB 4.16Å; I574-I602 HydrophobicContact CG1-CB 4.03Å; I574-I602 HydrophobicContact CG1-CD1 4.38Å; I574-I602 HydrophobicContact CG1-CG1 4.05Å; I602-K604 PolarHBondContact O-N 3.04Å; I602-L605 PolarHBondContact O-N 2.97Å; I602-Q606 HydrophobicContact CG1-CG 4.25Å; I602-Q606 WeakPolarHBondContact O-CB 3.35Å; I602-Q606 WeakPolarHBondContact O-CG 3.09Å; I602-Q606 PolarHBondContact O-N 3.43Å
603	D	78.8	Confident	84.6	Confident	99 Å²	99	50.8 Å²	50.8	53%	0.529	25%	0.249	S	C	.	.	H	α-helix	trans	-70.3	-37.5	-178.5	-72.5	-32.8	0	0	0	111.1	D601 N607	D601-D603 PolarHBondContact O-N 3.35Å; D601-D603 PolarHBondContact OD1-N 3.34Å; D603-N607 WeakPolarHBondContact O-CB 3.37Å; D603-N607 PolarHBondContact O-N 2.89Å; D603-N607 PolarHBondContact O-ND2 2.83Å
604	K	81.7	Confident	84.4	Confident	123 Å²	123	50.9 Å²	50.9	54%	0.535	25%	0.248	S	C	.	.	H	α-helix	trans	-68.2	-39.5	173.9	-65.8	-175.3	-178.8	77.7	0	111.3	D601 I602 A608	D601-K604 HydrophobicContact CB-CB 4.25Å; D601-K604 HydrophobicContact CB-CD 4.25Å; D601-K604 HydrophobicContact CB-CG 4.27Å; D601-K604 PolarHBondContact O-N 2.83Å; D601-K604 WeakPolarHBondContact OD2-CG 3.46Å; D601-K604 IonicContact OD2-NZ 3.49Å; D601-K604 PolarHBondContact OD2-NZ 3.43Å; I602-K604 PolarHBondContact O-N 3.04Å; K604-A608 WeakPolarHBondContact O-CB 3.47Å; K604-A608 PolarHBondContact O-N 2.65Å
605	L	88.5	Confident	83.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.7	-48.3	175.8	178.8	66.4	0	0	0	111.7	V569 I574 V581 F594 H599 D601 I602 N607 A608 I609	V569-L605 HydrophobicContact CB-CD2 3.98Å; V569-L605 HydrophobicContact CG1-CD2 4.06Å; V569-L605 HydrophobicContact CG2-CD2 4.02Å; I574-L605 HydrophobicContact CD1-CD2 3.82Å; I574-L605 HydrophobicContact CG1-CD2 3.81Å; I574-L605 HydrophobicContact CG2-CB 4.41Å; I574-L605 HydrophobicContact CG2-CD2 3.91Å; V581-L605 HydrophobicContact CB-CD1 3.9Å; V581-L605 HydrophobicContact CB-CD2 3.74Å; V581-L605 HydrophobicContact CB-CG 4.5Å; V581-L605 HydrophobicContact CG1-CD1 4.01Å; V581-L605 HydrophobicContact CG1-CD2 4.19Å; V581-L605 HydrophobicContact CG2-CD2 3.76Å; F594-L605 HydrophobicContact CD2-CD1 4.46Å; F594-L605 HydrophobicContact CE2-CD1 3.39Å; F594-L605 HydrophobicContact CZ-CD1 3.47Å; F594-L605 VanDerWaalsContact CZ-CD1 3.47Å; H599-L605 HydrophobicContact CB-CB 4Å; H599-L605 HydrophobicContact CB-CD1 4.17Å; D601-L605 WeakPolarHBondContact O-CB 3.41Å; D601-L605 PolarHBondContact O-N 3.01Å; I602-L605 PolarHBondContact O-N 2.97Å; L605-N607 VanDerWaalsContact C-N 3.31Å; L605-N607 PolarHBondContact O-N 3.33Å; L605-A608 WeakPolarHBondContact O-CB 3.23Å; L605-A608 PolarHBondContact O-N 3.23Å; L605-A608 VanDerWaalsContact O-N 3.09Å; L605-I609 HydrophobicContact CD1-CD1 4.31Å; L605-I609 HydrophobicContact CD1-CG1 4.49Å; L605-I609 HydrophobicContact CG-CD1 3.94Å; L605-I609 WeakPolarHBondContact O-CG1 3.44Å; L605-I609 PolarHBondContact O-N 2.93Å
606	Q	87.5	Confident	83.4	Confident	30 Å²	30	52.3 Å²	52.3	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-39.5	177.4	-73.1	-171.8	17.6	0	0	112.2	H566 I602 A608 I609 R610	H566-Q606 WeakPolarHBondContact NE2-CG 3.24Å; H566-Q606 PolarHBondContact NE2-OE1 3.22Å; I602-Q606 HydrophobicContact CG1-CG 4.25Å; I602-Q606 WeakPolarHBondContact O-CB 3.35Å; I602-Q606 WeakPolarHBondContact O-CG 3.09Å; I602-Q606 PolarHBondContact O-N 3.43Å; Q606-A608 VanDerWaalsContact C-N 3.35Å; Q606-I609 PolarHBondContact O-N 3.44Å; Q606-R610 WeakPolarHBondContact O-CG 3.34Å; Q606-R610 PolarHBondContact O-N 3.38Å
607	N	81	Confident	83.1	Confident	78 Å²	78	54 Å²	54	42%	0.417	28%	0.28	S	S	.	.	H	α-helix	trans	-66.7	-35.1	173.4	-76.9	-48	0	0	0	112.3	D603 L605 R610 N611	D603-N607 WeakPolarHBondContact O-CB 3.37Å; D603-N607 PolarHBondContact O-N 2.89Å; D603-N607 PolarHBondContact O-ND2 2.83Å; L605-N607 VanDerWaalsContact C-N 3.31Å; L605-N607 PolarHBondContact O-N 3.33Å; N607-R610 PolarHBondContact OD1-NH2 2.93Å; N607-N611 PolarHBondContact O-N 2.99Å; N607-N611 PolarHBondContact O-ND2 2.73Å
608	A	85.8	Confident	83.3	Confident	16 Å²	16	58 Å²	58	13%	0.132	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-47.7	172.7	0	0	0	0	0	111.8	F594 H599 K604 L605 Q606 R610 N611 I612	F594-A608 HydrophobicContact CD1-CB 3.84Å; F594-A608 HydrophobicContact CE1-CB 3.61Å; F594-A608 HydrophobicContact CZ-CB 4.26Å; H599-A608 WeakPolarHBondContact NE2-CB 3.48Å; K604-A608 WeakPolarHBondContact O-CB 3.47Å; K604-A608 PolarHBondContact O-N 2.65Å; L605-A608 WeakPolarHBondContact O-CB 3.23Å; L605-A608 PolarHBondContact O-N 3.23Å; L605-A608 VanDerWaalsContact O-N 3.09Å; Q606-A608 VanDerWaalsContact C-N 3.35Å; A608-R610 VanDerWaalsContact C-N 3.3Å; A608-R610 PolarHBondContact O-N 2.9Å; A608-N611 PolarHBondContact O-N 3.08Å; A608-I612 PolarHBondContact O-N 3.23Å
609	I	90.8	Very high	83.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-54.5	-46.1	175.2	-66.1	163.4	0	0	0	110.8	L562 V565 H566 V569 I583 F594 L605 Q606 N611 I612	L562-I609 HydrophobicContact CB-CG2 4.47Å; L562-I609 HydrophobicContact CD2-CG2 4.28Å; V565-I609 HydrophobicContact CG1-CD1 4.16Å; V565-I609 HydrophobicContact CG1-CG1 4.44Å; V565-I609 HydrophobicContact CG1-CG2 4.49Å; H566-I609 HydrophobicContact CB-CG2 4.1Å; V569-I609 HydrophobicContact CG1-CD1 4.3Å; V569-I609 HydrophobicContact CG2-CD1 3.77Å; I583-I609 HydrophobicContact CD1-CD1 4.41Å; I583-I609 HydrophobicContact CD1-CG1 3.72Å; F594-I609 HydrophobicContact CE1-CG1 4.44Å; F594-I609 HydrophobicContact CZ-CG1 4.07Å; L605-I609 HydrophobicContact CD1-CD1 4.31Å; L605-I609 HydrophobicContact CD1-CG1 4.49Å; L605-I609 HydrophobicContact CG-CD1 3.94Å; L605-I609 WeakPolarHBondContact O-CG1 3.44Å; L605-I609 PolarHBondContact O-N 2.93Å; Q606-I609 PolarHBondContact O-N 3.44Å; I609-N611 PolarHBondContact O-N 3.45Å; I609-I612 PolarHBondContact O-N 2.97Å
610	R	84	Confident	83.4	Confident	69 Å²	69	55.4 Å²	55.4	26%	0.26	28%	0.282	S	S	.	.	H	α-helix	trans	-64.2	-18.3	178.4	-75.8	-173.1	-69.3	-106.1	3.2	114.3	H566 Q606 N607 A608 Q1569	H566-R610 PolarHBondContact NE2-NH1 3.01Å; Q606-R610 WeakPolarHBondContact O-CG 3.34Å; Q606-R610 PolarHBondContact O-N 3.38Å; N607-R610 PolarHBondContact OD1-NH2 2.93Å; A608-R610 VanDerWaalsContact C-N 3.3Å; A608-R610 PolarHBondContact O-N 2.9Å; R610-Q1569 HydrophobicContact CB-CG 4.29Å; R610-Q1569 HydrophobicContact CG-CG 4.43Å; R610-Q1569 PolarHBondContact O-NE2 3.13Å
611	N	84.5	Confident	83.9	Confident	75 Å²	75	53.1 Å²	53.1	40%	0.401	27%	0.268	S	S	.	.	H	α-helix	trans	-100.5	-3	-178.1	-81.4	-70.5	0	0	0	114.8	N607 A608 I609 R613 N1554	N607-N611 PolarHBondContact O-N 2.99Å; N607-N611 PolarHBondContact O-ND2 2.73Å; A608-N611 PolarHBondContact O-N 3.08Å; I609-N611 PolarHBondContact O-N 3.45Å; N611-R613 PolarHBondContact O-N 2.92Å; N611-N1554 PolarHBondContact OD1-ND2 2.9Å
612	I	89.2	Confident	84.4	Confident	4 Å²	4	51 Å²	51	2%	0.021	26%	0.257	C	S	.	.			trans	-57.6	135	176.7	-67.8	177.1	0	0	0	110.2	F557 Y558 L562 I583 E593 F594 A608 I609	F557-I612 HydrophobicContact CE1-CG2 3.77Å; F557-I612 HydrophobicContact CZ-CG2 3.84Å; Y558-I612 WeakPolarHBondContact CE1-O 3.45Å; Y558-I612 PolarHBondContact OH-O 3.41Å; L562-I612 HydrophobicContact CD1-CB 4.08Å; L562-I612 HydrophobicContact CD1-CG2 4.46Å; L562-I612 HydrophobicContact CD2-CB 4.05Å; L562-I612 HydrophobicContact CD2-CD1 3.85Å; L562-I612 HydrophobicContact CD2-CG1 4.47Å; L562-I612 HydrophobicContact CD2-CG2 4.14Å; I583-I612 HydrophobicContact CB-CD1 4.24Å; I583-I612 HydrophobicContact CD1-CD1 3.85Å; I583-I612 HydrophobicContact CG2-CD1 3.73Å; E593-I612 HydrophobicContact CB-CD1 4.18Å; E593-I612 HydrophobicContact CB-CG1 3.98Å; E593-I612 HydrophobicContact CG-CB 4.37Å; E593-I612 HydrophobicContact CG-CD1 4.02Å; E593-I612 HydrophobicContact CG-CG1 3.85Å; E593-I612 HydrophobicContact CG-CG2 3.79Å; F594-I612 HydrophobicContact CE1-CD1 4.19Å; A608-I612 PolarHBondContact O-N 3.23Å; I609-I612 PolarHBondContact O-N 2.97Å
613	R	84.1	Confident	84.5	Confident	157 Å²	157	50 Å²	50	59%	0.592	26%	0.257	S	S	*	.			trans	-110.8	113.7	-179.8	-65.5	-172.5	-176.6	-167.3	1.2	111.4	Q585 K591 N611 I615	Q585-R613 PolarHBondContact OE1-O 3.45Å; K591-R613 PolarHBondContact NZ-O 3.43Å; N611-R613 PolarHBondContact O-N 2.92Å; R613-I615 VanDerWaalsContact O-CG2 3.28Å; R613-I615 WeakPolarHBondContact O-CG2 3.42Å; R613-I615 PolarHBondContact O-N 2.85Å
614	Y	84.4	Confident	85.2	Confident	43 Å²	43	45.3 Å²	45.3	17%	0.169	23%	0.231	C	C	.	.			trans	-50.3	129.9	170.7	174.5	-97.9	0	0	0	112.2	G548 S549 I552 G553 T554 F557	G548-Y614 VanDerWaalsContact O-CE2 3.22Å; G548-Y614 WeakPolarHBondContact O-CE2 3.06Å; S549-Y614 PolarHBondContact O-OH 2.76Å; I552-Y614 HydrophobicContact CB-CE2 4.34Å; G553-Y614 WeakPolarHBondContact CA-OH 3.45Å; G553-Y614 PolarHBondContact N-OH 3.2Å; T554-Y614 HydrophobicContact CG2-CD1 4.14Å; T554-Y614 WeakPolarHBondContact OG1-CD1 3.48Å; T554-Y614 WeakPolarHBondContact OG1-CE1 3.4Å; F557-Y614 HydrophobicContact CB-CD2 3.82Å; F557-Y614 HydrophobicContact CB-CE2 4.43Å; F557-Y614 HydrophobicContact CB-CG 4.47Å; F557-Y614 HydrophobicContact CD1-CD2 4.23Å; F557-Y614 HydrophobicContact CD1-CG 4.49Å; F557-Y614 HydrophobicContact CD2-CD2 4.01Å; F557-Y614 AromaticContact CG-CD2 3.75Å; F557-Y614 HydrophobicContact CG-CD2 3.75Å; F557-Y614 HydrophobicContact CG-CG 4.42Å
615	I	80.5	Confident	85.7	Confident	65 Å²	65	39.4 Å²	39.4	33%	0.333	21%	0.206	S	C	.	.			trans	-109	-28.1	-171.3	63.9	-170.6	0	0	0	115.6	Q585 T587 K591 R613	Q585-I615 HydrophobicContact CB-CD1 4.25Å; Q585-I615 HydrophobicContact CG-CD1 3.88Å; Q585-I615 HydrophobicContact CG-CG1 4.08Å; T587-I615 HydrophobicContact CG2-CD1 3.91Å; T587-I615 HydrophobicContact CG2-CG1 3.54Å; K591-I615 HydrophobicContact CB-CD1 3.95Å; K591-I615 HydrophobicContact CD-CD1 3.99Å; K591-I615 HydrophobicContact CD-CG2 3.67Å; R613-I615 VanDerWaalsContact O-CG2 3.28Å; R613-I615 WeakPolarHBondContact O-CG2 3.42Å; R613-I615 PolarHBondContact O-N 2.85Å
616	G	78.5	Confident	85.8	Confident	19 Å²	19	43 Å²	43	20%	0.196	22%	0.223	C	C	.	.			trans	71.8	164.6	-177.1	0	0	0	0	0	114.8	G548 T587	G548-G616 WeakPolarHBondContact O-CA 3.31Å; G548-G616 PolarHBondContact O-N 3.12Å; T587-G616 VanDerWaalsContact CB-O 3.24Å; T587-G616 WeakPolarHBondContact CB-O 3.15Å; T587-G616 VanDerWaalsContact CG2-O 3.23Å; T587-G616 WeakPolarHBondContact CG2-O 3.4Å; T587-G616 PolarHBondContact OG1-O 3.14Å
617	G	78.7	Confident	85.9	Confident	40 Å²	40	44.1 Å²	44.1	41%	0.412	23%	0.227	S	C	.	.			trans	138.1	-158.8	177	0	0	0	0	0	113.6	S549 G550	S549-G617 WeakPolarHBondContact CB-O 3.24Å; G550-G617 PolarHBondContact N-O 3.37Å
618	L	81.1	Confident	86.5	Confident	109 Å²	109	40.4 Å²	40.4	57%	0.571	21%	0.207	S	C	*	.			trans	-77.7	-174.8	171	-59.4	176.2	0	0	0	111.2	S549 T587 G588	S549-L618 WeakPolarHBondContact CB-O 3.42Å; T587-L618 CarbonylContact C-O 3.49Å; T587-L618 WeakPolarHBondContact CA-O 3.1Å; T587-L618 VanDerWaalsContact CB-O 3.26Å; T587-L618 WeakPolarHBondContact CB-O 3.24Å; G588-L618 PolarHBondContact N-O 3.22Å
619	T	84.5	Confident	86.7	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.043	20%	0.202	C	C	.	.			trans	-120.1	84.9	-177.2	-48.8	0	0	0	0	111.4	D547 S549 Y586 G656 A658 Q659	D547-T619 WeakPolarHBondContact OD2-CG2 3.29Å; S549-T619 VanDerWaalsContact CB-OG1 3.31Å; S549-T619 WeakPolarHBondContact CB-OG1 3.24Å; S549-T619 PolarHBondContact OG-OG1 3.29Å; S549-T619 VanDerWaalsContact OG-OG1 3.08Å; Y586-T619 HydrophobicContact CE2-CG2 4.48Å; T619-G656 VanDerWaalsContact CG2-O 3.25Å; T619-G656 WeakPolarHBondContact CG2-O 3.41Å; T619-A658 WeakPolarHBondContact O-CA 3.48Å; T619-Q659 PolarHBondContact O-N 2.8Å
620	K	85.8	Confident	86.5	Confident	83 Å²	83	45.6 Å²	45.6	36%	0.361	22%	0.224	S	C	.	.			trans	-98.5	77.1	177.5	-72.2	-166.7	178.5	-179.6	0	112.6	T587 G622 A623 A624 D660	T587-K620 VanDerWaalsContact O-CB 3.29Å; T587-K620 WeakPolarHBondContact O-CB 3.15Å; T587-K620 PolarHBondContact O-N 2.9Å; K620-G622 VanDerWaalsContact C-N 3.34Å; K620-A623 HydrophobicContact CB-CB 4.13Å; K620-A624 PolarHBondContact O-N 2.82Å; K620-A624 VanDerWaalsContact O-N 3.16Å; K620-D660 VanDerWaalsContact C-OD1 3.29Å; K620-D660 VanDerWaalsContact CA-OD1 3.29Å; K620-D660 WeakPolarHBondContact CA-OD1 3.42Å; K620-D660 WeakPolarHBondContact CB-OD2 3.39Å; K620-D660 HydrophobicContact CG-CB 4.46Å
621	T	89.2	Confident	86.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68.6	-32.1	-178.4	-43.4	0	0	0	0	112.1	Y586 A624 I625 V652 D660 V662 I693	Y586-T621 HydrophobicContact CE2-CG2 4.11Å; T621-A624 WeakPolarHBondContact O-CB 3.45Å; T621-A624 PolarHBondContact O-N 3.42Å; T621-I625 HydrophobicContact CG2-CD1 4.16Å; T621-I625 VanDerWaalsContact O-CG1 3.31Å; T621-I625 WeakPolarHBondContact O-CG1 3.46Å; T621-I625 PolarHBondContact O-N 2.85Å; T621-V652 HydrophobicContact CG2-CG1 4.02Å; T621-D660 PolarHBondContact N-OD1 3.01Å; T621-D660 VanDerWaalsContact N-OD1 3.09Å; T621-V662 HydrophobicContact CG2-CG1 4.14Å; T621-I693 HydrophobicContact CG2-CD1 3.98Å
622	G	88.8	Confident	86.7	Confident	1 Å²	1	44 Å²	44	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-52.8	176.7	0	0	0	0	0	111.9	K620 A624 I625 E626 D660 E661 P665	K620-G622 VanDerWaalsContact C-N 3.34Å; G622-A624 PolarHBondContact O-N 3.4Å; G622-I625 PolarHBondContact O-N 3.09Å; G622-I625 VanDerWaalsContact O-N 3.16Å; G622-E626 PolarHBondContact O-N 3.11Å; G622-D660 PolarHBondContact N-OD1 3.38Å; G622-D660 PolarHBondContact N-OD2 2.7Å; G622-E661 WeakPolarHBondContact CA-O 3.36Å; G622-P665 VanDerWaalsContact O-CB 3.3Å; G622-P665 WeakPolarHBondContact O-CB 3.11Å; G622-P665 WeakPolarHBondContact O-CG 3.32Å
623	A	87.9	Confident	86.7	Confident	32 Å²	32	44.1 Å²	44.1	26%	0.264	22%	0.216	S	C	.	.	H	α-helix	trans	-60	-32.5	174.7	0	0	0	0	0	112.7	V590 K620 F627 D660	V590-A623 HydrophobicContact CG2-CB 4.29Å; K620-A623 HydrophobicContact CB-CB 4.13Å; A623-F627 VanDerWaalsContact O-CB 3.28Å; A623-F627 WeakPolarHBondContact O-CB 3.28Å; A623-F627 PolarHBondContact O-N 2.91Å; A623-D660 WeakPolarHBondContact CB-OD2 3.42Å; A623-D660 PolarHBondContact N-OD2 3.28Å
624	A	92.2	Very high	86.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-44.6	174.5	0	0	0	0	0	112.4	L545 Y586 V590 K620 T621 G622 F627 M628	L545-A624 HydrophobicContact CD1-CB 4Å; L545-A624 HydrophobicContact CD2-CB 4.18Å; Y586-A624 VanDerWaalsContact CB-CB 3.48Å; Y586-A624 HydrophobicContact CD1-CB 3.65Å; Y586-A624 HydrophobicContact CD2-CB 3.57Å; Y586-A624 HydrophobicContact CE1-CB 4.23Å; Y586-A624 HydrophobicContact CE2-CB 4.16Å; Y586-A624 HydrophobicContact CG-CB 3.27Å; V590-A624 HydrophobicContact CG2-CB 4.32Å; K620-A624 PolarHBondContact O-N 2.82Å; K620-A624 VanDerWaalsContact O-N 3.16Å; T621-A624 WeakPolarHBondContact O-CB 3.45Å; T621-A624 PolarHBondContact O-N 3.42Å; G622-A624 PolarHBondContact O-N 3.4Å; A624-F627 PolarHBondContact O-N 3.12Å; A624-M628 WeakPolarHBondContact O-CB 3.02Å; A624-M628 PolarHBondContact O-N 3.07Å
625	I	92.5	Very high	86.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67	-39	176.5	-64.5	164.6	0	0	0	110.9	L545 T621 G622 M628 T629 P665 A669 L676 I693	L545-I625 HydrophobicContact CD1-CB 4.35Å; L545-I625 HydrophobicContact CD1-CG1 3.66Å; T621-I625 HydrophobicContact CG2-CD1 4.16Å; T621-I625 VanDerWaalsContact O-CG1 3.31Å; T621-I625 WeakPolarHBondContact O-CG1 3.46Å; T621-I625 PolarHBondContact O-N 2.85Å; G622-I625 PolarHBondContact O-N 3.09Å; G622-I625 VanDerWaalsContact O-N 3.16Å; I625-M628 HydrophobicContact CG2-CE 4.46Å; I625-M628 PolarHBondContact O-N 2.84Å; I625-T629 WeakPolarHBondContact O-CB 3.21Å; I625-T629 PolarHBondContact O-N 3.43Å; I625-T629 PolarHBondContact O-OG1 3.39Å; I625-P665 HydrophobicContact CB-CB 3.94Å; I625-P665 HydrophobicContact CG2-CB 3.91Å; I625-P665 WeakPolarHBondContact CG2-O 3.05Å; I625-A669 HydrophobicContact CG2-CB 3.87Å; I625-L676 HydrophobicContact CG2-CD1 4.39Å; I625-I693 HydrophobicContact CD1-CD1 4.33Å; I625-I693 HydrophobicContact CD1-CG1 3.9Å; I625-I693 HydrophobicContact CD1-CG2 4.08Å
626	E	90.4	Very high	86.1	Confident	76 Å²	76	48 Å²	48	36%	0.355	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-48.1	172.7	-166	-160.9	149.8	0	0	111	G622 M628 T629 R630 P665	G622-E626 PolarHBondContact O-N 3.11Å; E626-M628 PolarHBondContact O-N 3.4Å; E626-T629 PolarHBondContact O-N 3.2Å; E626-R630 HydrophobicContact CG-CG 4.22Å; E626-R630 WeakPolarHBondContact O-CB 3.02Å; E626-R630 PolarHBondContact O-N 3.12Å; E626-R630 WeakPolarHBondContact OE1-CD 3.21Å; E626-R630 IonicContact OE1-CZ 2.72Å; E626-R630 IonicContact OE1-NE 3.92Å; E626-R630 IonicContact OE1-NH1 3.52Å; E626-R630 PolarHBondContact OE1-NH1 3.26Å; E626-P665 HydrophobicContact CB-CB 4.37Å
627	F	90.7	Very high	86.3	Confident	52 Å²	52	50 Å²	50	23%	0.228	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-45.3	177.7	-178	-83.6	0	0	0	111.9	V584 V590 F595 A623 A624 T629 K631 T632	V584-F627 HydrophobicContact CG1-CD1 3.94Å; V584-F627 HydrophobicContact CG1-CE1 4.05Å; V584-F627 HydrophobicContact CG2-CD1 4.39Å; V584-F627 HydrophobicContact CG2-CE1 4.18Å; V590-F627 HydrophobicContact CB-CB 4.18Å; V590-F627 HydrophobicContact CB-CD2 4.15Å; V590-F627 HydrophobicContact CB-CG 4.05Å; V590-F627 HydrophobicContact CG1-CB 3.79Å; V590-F627 HydrophobicContact CG1-CD1 3.58Å; V590-F627 HydrophobicContact CG1-CD2 4.06Å; V590-F627 HydrophobicContact CG1-CE1 4.16Å; V590-F627 HydrophobicContact CG1-CG 3.54Å; V590-F627 HydrophobicContact CG2-CB 4.28Å; F595-F627 HydrophobicContact CE1-CE1 4.46Å; A623-F627 VanDerWaalsContact O-CB 3.28Å; A623-F627 WeakPolarHBondContact O-CB 3.28Å; A623-F627 PolarHBondContact O-N 2.91Å; A624-F627 PolarHBondContact O-N 3.12Å; F627-T629 VanDerWaalsContact C-N 3.28Å; F627-T629 PolarHBondContact O-N 2.82Å; F627-K631 HydrophobicContact CD1-CB 4.37Å; F627-K631 HydrophobicContact CD2-CB 4.36Å; F627-K631 HydrophobicContact CD2-CG 3.92Å; F627-K631 HydrophobicContact CE1-CB 4.23Å; F627-K631 HydrophobicContact CE2-CB 4.24Å; F627-K631 HydrophobicContact CE2-CG 3.96Å; F627-K631 HydrophobicContact CG-CB 4.42Å; F627-K631 HydrophobicContact CG-CG 4.33Å; F627-K631 HydrophobicContact CZ-CB 4.17Å; F627-K631 HydrophobicContact CZ-CG 4.4Å; F627-K631 WeakPolarHBondContact O-CA 3.07Å; F627-K631 VanDerWaalsContact O-CB 3.23Å; F627-K631 WeakPolarHBondContact O-CB 3.1Å; F627-K631 PolarHBondContact O-N 2.84Å; F627-T632 PolarHBondContact O-N 3.09Å
628	M	93.4	Very high	86.5	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.238	C	C	.	.	I	π-helix	trans	-58.2	-41.9	175.3	172.3	174.8	69.7	0	0	111.7	V543 L545 A624 I625 E626 T632 F633 L676	V543-M628 HydrophobicContact CB-CG 4.49Å; V543-M628 HydrophobicContact CB-SD 4.09Å; V543-M628 HydrophobicContact CG1-CG 4.01Å; V543-M628 HydrophobicContact CG1-SD 3.81Å; L545-M628 HydrophobicContact CD1-CB 4.15Å; L545-M628 HydrophobicContact CD1-CE 3.73Å; L545-M628 HydrophobicContact CD1-SD 3.94Å; L545-M628 HydrophobicContact CD2-CB 3.86Å; L545-M628 HydrophobicContact CD2-SD 4.3Å; L545-M628 HydrophobicContact CG-CB 4.17Å; L545-M628 HydrophobicContact CG-CE 4.17Å; L545-M628 HydrophobicContact CG-SD 3.69Å; A624-M628 WeakPolarHBondContact O-CB 3.02Å; A624-M628 PolarHBondContact O-N 3.07Å; I625-M628 HydrophobicContact CG2-CE 4.46Å; I625-M628 PolarHBondContact O-N 2.84Å; E626-M628 PolarHBondContact O-N 3.4Å; M628-T632 WeakPolarHBondContact O-CB 3.4Å; M628-T632 PolarHBondContact O-N 3.06Å; M628-F633 HydrophobicContact CG-CD2 3.56Å; M628-F633 HydrophobicContact CG-CE2 3.61Å; M628-F633 PolarHBondContact O-N 3.49Å; M628-F633 HydrophobicContact SD-CD2 4.29Å; M628-F633 HydrophobicContact SD-CE2 3.73Å; M628-L676 HydrophobicContact CE-CD2 3.42Å; M628-L676 VanDerWaalsContact CE-CD2 3.42Å
629	T	88.9	Confident	86.5	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.018	21%	0.213	C	C	.	.	I	π-helix	trans	-73.2	-47	-178.4	-54.6	0	0	0	0	112.1	I625 E626 F627 E668 A669 H672 I674	I625-T629 WeakPolarHBondContact O-CB 3.21Å; I625-T629 PolarHBondContact O-N 3.43Å; I625-T629 PolarHBondContact O-OG1 3.39Å; E626-T629 PolarHBondContact O-N 3.2Å; F627-T629 VanDerWaalsContact C-N 3.28Å; F627-T629 PolarHBondContact O-N 2.82Å; T629-E668 HydrophobicContact CG2-CG 4.3Å; T629-A669 VanDerWaalsContact OG1-CB 3.3Å; T629-A669 WeakPolarHBondContact OG1-CB 3.02Å; T629-H672 HydrophobicContact CG2-CB 4.09Å; T629-I674 HydrophobicContact CG2-CD1 4.18Å
630	R	87.8	Confident	86.3	Confident	122 Å²	122	45 Å²	45	46%	0.46	22%	0.216	S	C	.	.	I	π-helix	trans	-90.8	-13.8	-172.7	-63	-172.3	178.9	175.1	-5.5	114.8	E626 E668	E626-R630 HydrophobicContact CG-CG 4.22Å; E626-R630 WeakPolarHBondContact O-CB 3.02Å; E626-R630 PolarHBondContact O-N 3.12Å; E626-R630 WeakPolarHBondContact OE1-CD 3.21Å; E626-R630 IonicContact OE1-CZ 2.72Å; E626-R630 IonicContact OE1-NE 3.92Å; E626-R630 IonicContact OE1-NH1 3.52Å; E626-R630 PolarHBondContact OE1-NH1 3.26Å; R630-E668 IonicContact CZ-OE1 3.44Å; R630-E668 IonicContact CZ-OE2 3.62Å; R630-E668 IonicContact NE-OE1 2.59Å; R630-E668 PolarHBondContact NE-OE1 3.34Å; R630-E668 IonicContact NE-OE2 3.45Å; R630-E668 IonicContact NH2-OE1 2.68Å; R630-E668 PolarHBondContact NH2-OE1 2.96Å; R630-E668 IonicContact NH2-OE2 2.88Å; R630-E668 PolarHBondContact NH2-OE2 3.39Å
631	K	85.2	Confident	85.7	Confident	111 Å²	111	44.3 Å²	44.3	48%	0.483	22%	0.221	S	C	.	.	I	π-helix	trans	-122.3	-59.2	177.8	-53.3	-64.4	172.8	-169.4	0	111.6	F627 T634 M637	F627-K631 HydrophobicContact CD1-CB 4.37Å; F627-K631 HydrophobicContact CD2-CB 4.36Å; F627-K631 HydrophobicContact CD2-CG 3.92Å; F627-K631 HydrophobicContact CE1-CB 4.23Å; F627-K631 HydrophobicContact CE2-CB 4.24Å; F627-K631 HydrophobicContact CE2-CG 3.96Å; F627-K631 HydrophobicContact CG-CB 4.42Å; F627-K631 HydrophobicContact CG-CG 4.33Å; F627-K631 HydrophobicContact CZ-CB 4.17Å; F627-K631 HydrophobicContact CZ-CG 4.4Å; F627-K631 WeakPolarHBondContact O-CA 3.07Å; F627-K631 VanDerWaalsContact O-CB 3.23Å; F627-K631 WeakPolarHBondContact O-CB 3.1Å; F627-K631 PolarHBondContact O-N 2.84Å; K631-T634 WeakPolarHBondContact O-CB 3.29Å; K631-T634 WeakPolarHBondContact O-CG2 3.4Å; K631-T634 PolarHBondContact O-OG1 3.01Å; K631-M637 WeakPolarHBondContact O-CB 3.35Å; K631-M637 WeakPolarHBondContact O-CG 3.24Å
632	T	87.2	Confident	84.3	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-70.5	-45.1	-169.8	-46.8	0	0	0	0	113.7	V543 V584 F595 F627 M628 T634	V543-T632 HydrophobicContact CG1-CG2 3.93Å; V543-T632 HydrophobicContact CG2-CG2 3.74Å; V584-T632 HydrophobicContact CG2-CG2 4.28Å; V584-T632 WeakPolarHBondContact CG2-OG1 3.09Å; F595-T632 HydrophobicContact CD1-CG2 4.29Å; F627-T632 PolarHBondContact O-N 3.09Å; M628-T632 WeakPolarHBondContact O-CB 3.4Å; M628-T632 PolarHBondContact O-N 3.06Å; T632-T634 PolarHBondContact O-N 2.7Å
633	F	88.5	Confident	83.2	Confident	7 Å²	7	54.7 Å²	54.7	3%	0.031	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	32.9	178.4	-81.1	-67.4	0	0	0	114.5	D541 V543 L596 M628 R648 I674	D541-F633 HydrophobicContact CB-CE1 3.96Å; D541-F633 WeakPolarHBondContact O-CE1 3.18Å; V543-F633 HydrophobicContact CB-CE2 3.87Å; V543-F633 HydrophobicContact CB-CZ 3.79Å; V543-F633 HydrophobicContact CG2-CD1 4.42Å; V543-F633 HydrophobicContact CG2-CD2 4.32Å; V543-F633 HydrophobicContact CG2-CE1 3.83Å; V543-F633 HydrophobicContact CG2-CE2 3.73Å; V543-F633 HydrophobicContact CG2-CZ 3.45Å; V543-F633 VanDerWaalsContact CG2-CZ 3.45Å; L596-F633 HydrophobicContact CD1-CD1 3.92Å; L596-F633 HydrophobicContact CD1-CE1 4.08Å; M628-F633 HydrophobicContact CG-CD2 3.56Å; M628-F633 HydrophobicContact CG-CE2 3.61Å; M628-F633 PolarHBondContact O-N 3.49Å; M628-F633 HydrophobicContact SD-CD2 4.29Å; M628-F633 HydrophobicContact SD-CE2 3.73Å; F633-R648 HydrophobicContact CD1-CB 4.24Å; F633-R648 HydrophobicContact CD1-CG 4.2Å; F633-R648 HydrophobicContact CE1-CB 3.86Å; F633-R648 HydrophobicContact CE1-CG 4.17Å; F633-R648 HydrophobicContact CZ-CB 4.4Å; F633-R648 PolarHBondContact O-NH1 2.96Å; F633-R648 VanDerWaalsContact O-NH1 3.08Å; F633-I674 HydrophobicContact CB-CD1 4.06Å; F633-I674 HydrophobicContact CD2-CD1 3.4Å; F633-I674 VanDerWaalsContact CD2-CD1 3.4Å; F633-I674 HydrophobicContact CD2-CG1 3.85Å; F633-I674 HydrophobicContact CD2-CG2 4.19Å; F633-I674 HydrophobicContact CE2-CD1 3.99Å; F633-I674 HydrophobicContact CE2-CG1 4.1Å; F633-I674 HydrophobicContact CE2-CG2 3.6Å; F633-I674 HydrophobicContact CG-CD1 3.89Å; F633-I674 HydrophobicContact CG-CG1 4.14Å; F633-I674 HydrophobicContact CZ-CG2 4.02Å
634	T	83.7	Confident	81.8	Confident	38 Å²	38	58.6 Å²	58.6	23%	0.233	29%	0.288	C	S	.	.	S	Bend	trans	-102.1	149.9	174.8	67.6	0	0	0	0	111.1	K631 T632 Q636 M637 G638 A639	K631-T634 WeakPolarHBondContact O-CB 3.29Å; K631-T634 WeakPolarHBondContact O-CG2 3.4Å; K631-T634 PolarHBondContact O-OG1 3.01Å; T632-T634 PolarHBondContact O-N 2.7Å; T634-Q636 PolarHBondContact O-N 3.36Å; T634-M637 CarbonylContact O-C 3.39Å; T634-M637 PolarHBondContact O-N 3.19Å; T634-M637 VanDerWaalsContact O-N 3.09Å; T634-M637 WeakPolarHBondContact OG1-CB 3.37Å; T634-M637 WeakPolarHBondContact OG1-CG 3.49Å; T634-M637 PolarHBondContact OG1-N 3.18Å; T634-G638 PolarHBondContact O-N 3.25Å; T634-A639 WeakPolarHBondContact O-CB 3.36Å; T634-A639 PolarHBondContact O-N 2.85Å; T634-A639 VanDerWaalsContact O-N 3.1Å
635	E	78.2	Confident	80.7	Confident	119 Å²	119	63.2 Å²	63.2	56%	0.556	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-61.8	-32.4	176	-63.8	177.2	-176.3	0	0	111.9	M637 G638 S641	E635-M637 VanDerWaalsContact C-N 3.29Å; E635-M637 PolarHBondContact O-N 2.93Å; E635-G638 PolarHBondContact O-N 3.03Å; E635-S641 WeakPolarHBondContact OE1-CA 3.42Å; E635-S641 WeakPolarHBondContact OE1-CB 3.3Å; E635-S641 PolarHBondContact OE1-OG 2.03Å
636	Q	74.9	Confident	79.8	Confident	188 Å²	188	64 Å²	64	88%	0.879	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-62.2	-35.4	174.4	-65.8	-179.3	-8	0	0	112.5	T634 G638	T634-Q636 PolarHBondContact O-N 3.36Å; Q636-G638 VanDerWaalsContact C-N 3.29Å
637	M	82.6	Confident	79.4	Confident	63 Å²	63	65.9 Å²	65.9	31%	0.31	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-94.1	23.2	173.6	-61.7	-56.4	-171.9	0	0	112.6	F595 L596 K631 T634 E635 A639	F595-M637 HydrophobicContact CB-CB 4.13Å; F595-M637 HydrophobicContact CD1-CB 3.71Å; F595-M637 HydrophobicContact CD1-CG 3.75Å; F595-M637 HydrophobicContact CD1-SD 3.81Å; F595-M637 HydrophobicContact CD2-SD 3.8Å; F595-M637 HydrophobicContact CE1-CB 4.37Å; F595-M637 HydrophobicContact CE1-CE 4.08Å; F595-M637 HydrophobicContact CE1-CG 3.91Å; F595-M637 HydrophobicContact CE1-SD 3.85Å; F595-M637 HydrophobicContact CE2-CE 4.09Å; F595-M637 HydrophobicContact CE2-SD 3.83Å; F595-M637 HydrophobicContact CG-CB 4.05Å; F595-M637 HydrophobicContact CG-CG 4.2Å; F595-M637 HydrophobicContact CG-SD 3.79Å; F595-M637 HydrophobicContact CZ-CE 3.78Å; F595-M637 HydrophobicContact CZ-CG 4.49Å; F595-M637 HydrophobicContact CZ-SD 3.85Å; L596-M637 WeakPolarHBondContact CB-O 3.49Å; L596-M637 PolarHBondContact N-O 3.33Å; L596-M637 VanDerWaalsContact O-O 3.13Å; K631-M637 WeakPolarHBondContact O-CB 3.35Å; K631-M637 WeakPolarHBondContact O-CG 3.24Å; T634-M637 CarbonylContact O-C 3.39Å; T634-M637 PolarHBondContact O-N 3.19Å; T634-M637 VanDerWaalsContact O-N 3.09Å; T634-M637 WeakPolarHBondContact OG1-CB 3.37Å; T634-M637 WeakPolarHBondContact OG1-CG 3.49Å; T634-M637 PolarHBondContact OG1-N 3.18Å; E635-M637 VanDerWaalsContact C-N 3.29Å; E635-M637 PolarHBondContact O-N 2.93Å; M637-A639 PolarHBondContact O-N 3.47Å
638	G	82.2	Confident	79.1	Confident	19 Å²	19	64.1 Å²	64.1	20%	0.196	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	12.2	167.7	0	0	0	0	0	116.5	R580 L596 T634 E635 Q636	R580-G638 PolarHBondContact NH1-O 3.27Å; L596-G638 WeakPolarHBondContact O-CA 3.42Å; T634-G638 PolarHBondContact O-N 3.25Å; E635-G638 PolarHBondContact O-N 3.03Å; Q636-G638 VanDerWaalsContact C-N 3.29Å
639	A	81.5	Confident	78.9	Confident	5 Å²	5	64.2 Å²	64.2	4%	0.041	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-60.8	153.9	159.2	0	0	0	0	0	110	D541 L596 T634 M637	D541-A639 WeakPolarHBondContact OD2-CA 3.36Å; L596-A639 HydrophobicContact CD1-CB 3.73Å; T634-A639 WeakPolarHBondContact O-CB 3.36Å; T634-A639 PolarHBondContact O-N 2.85Å; T634-A639 VanDerWaalsContact O-N 3.1Å; M637-A639 PolarHBondContact O-N 3.47Å
640	R	80.8	Confident	79	Confident	27 Å²	27	64 Å²	64	10%	0.102	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-74.4	163.7	166	-79.6	163.2	-81.1	-156	-3.9	110.1	T540 D541 Q577 K578 V646 R648	T540-R640 PolarHBondContact O-NH2 3.46Å; D541-R640 IonicContact OD1-CZ 3.67Å; D541-R640 IonicContact OD1-NE 2.76Å; D541-R640 PolarHBondContact OD1-NE 3.28Å; D541-R640 IonicContact OD1-NH2 2.88Å; D541-R640 PolarHBondContact OD1-NH2 2.9Å; D541-R640 PolarHBondContact OD2-N 3.41Å; D541-R640 IonicContact OD2-NE 2.89Å; Q577-R640 VanDerWaalsContact C-NH1 3.27Å; Q577-R640 PolarHBondContact O-NH1 2.9Å; K578-R640 VanDerWaalsContact O-CZ 3.28Å; K578-R640 PolarHBondContact O-NH1 2.72Å; K578-R640 PolarHBondContact O-NH2 2.81Å; R640-V646 HydrophobicContact CB-CG1 4.07Å; R640-V646 HydrophobicContact CB-CG2 4.04Å; R640-R648 PolarHBondContact O-NH2 3.45Å
641	S	73.6	Confident	79.2	Confident	67 Å²	67	58.3 Å²	58.3	47%	0.469	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-61.6	171.7	174.4	-157.5	0	0	0	0	112	E635 D643	E635-S641 WeakPolarHBondContact OE1-CA 3.42Å; E635-S641 WeakPolarHBondContact OE1-CB 3.3Å; E635-S641 PolarHBondContact OE1-OG 2.03Å; S641-D643 PolarHBondContact O-N 2.86Å
642	R	58.8	Low	79.5	Confident	141 Å²	141	53 Å²	53	53%	0.532	27%	0.269	S	S	.	.	S	Bend	trans	-76	52	177.2	-70.5	-170.5	178.8	-159.7	4.5	112.2	H672	R642-H672 PolarHBondContact NH2-CD2 3.44Å; R642-H672 PolarHBondContact NH2-NE2 2.73Å
643	D	65.6	Low	79.7	Confident	78 Å²	78	53 Å²	53	42%	0.417	27%	0.269	S	S	.	.			trans	-71.8	127.1	165.6	-177.1	-24.4	0	0	0	108.1	S641 N645 V646	S641-D643 PolarHBondContact O-N 2.86Å; D643-N645 PolarHBondContact O-N 3.08Å; D643-N645 VanDerWaalsContact O-N 3.16Å; D643-N645 WeakPolarHBondContact OD1-CB 3.41Å; D643-N645 PolarHBondContact OD1-N 2.04Å; D643-N645 PolarHBondContact OD1-ND2 3.04Å; D643-V646 HydrophobicContact CB-CG2 4.02Å; D643-V646 PolarHBondContact O-N 2.84Å
644	P	59.3	Low	79.6	Confident	115 Å²	115	52.7 Å²	52.7	75%	0.747	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.8	178.8	25.8	-35.2	0	0	0	113.7	V646	P644-V646 PolarHBondContact O-N 2.93Å
645	N	67.9	Low	79.5	Confident	97 Å²	97	50.9 Å²	50.9	52%	0.519	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-4.5	173.2	-55.3	-67.4	0	0	0	113.3	D643	D643-N645 PolarHBondContact O-N 3.08Å; D643-N645 VanDerWaalsContact O-N 3.16Å; D643-N645 WeakPolarHBondContact OD1-CB 3.41Å; D643-N645 PolarHBondContact OD1-N 2.04Å; D643-N645 PolarHBondContact OD1-ND2 3.04Å
646	V	74.7	Confident	79.6	Confident	16 Å²	16	45.4 Å²	45.4	10%	0.097	23%	0.232	C	C	.	.	S	Bend	trans	-100.9	106.9	177.2	-177.8	0	0	0	0	111.1	P539 R640 D643 P644 R648	P539-V646 HydrophobicContact CB-CB 4.47Å; P539-V646 HydrophobicContact CB-CG2 3.91Å; P539-V646 CarbonylContact O-C 3.58Å; P539-V646 VanDerWaalsContact O-CA 3.23Å; P539-V646 WeakPolarHBondContact O-CA 3.43Å; R640-V646 HydrophobicContact CB-CG1 4.07Å; R640-V646 HydrophobicContact CB-CG2 4.04Å; D643-V646 HydrophobicContact CB-CG2 4.02Å; D643-V646 PolarHBondContact O-N 2.84Å; P644-V646 PolarHBondContact O-N 2.93Å; V646-R648 PolarHBondContact O-N 3.4Å
647	Y	81.4	Confident	79.8	Confident	116 Å²	116	42.3 Å²	42.3	46%	0.455	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	113.6	172.6	-86.1	-97.3	0	0	0	110.9	Q538 P539 T540 D541	Q538-Y647 HydrophobicContact CB-CD2 3.9Å; Q538-Y647 HydrophobicContact CB-CE2 4.36Å; Q538-Y647 HydrophobicContact CG-CD2 4.27Å; Q538-Y647 HydrophobicContact CG-CE2 4.22Å; P539-Y647 PolarHBondContact O-N 2.8Å; T540-Y647 CarbonylContact C-O 3.47Å; T540-Y647 VanDerWaalsContact CA-O 3.32Å; T540-Y647 WeakPolarHBondContact CA-O 3.41Å; D541-Y647 PolarHBondContact N-O 2.91Å
648	R	85.2	Confident	79.8	Confident	14 Å²	14	40 Å²	40	5%	0.053	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.3	172.9	-66.6	173	169.5	-138	-5.8	109.3	D541 F633 R640 V646 I674 S675	D541-R648 HydrophobicContact CB-CG 4.43Å; F633-R648 HydrophobicContact CD1-CB 4.24Å; F633-R648 HydrophobicContact CD1-CG 4.2Å; F633-R648 HydrophobicContact CE1-CB 3.86Å; F633-R648 HydrophobicContact CE1-CG 4.17Å; F633-R648 HydrophobicContact CZ-CB 4.4Å; F633-R648 PolarHBondContact O-NH1 2.96Å; F633-R648 VanDerWaalsContact O-NH1 3.08Å; R640-R648 PolarHBondContact O-NH2 3.45Å; V646-R648 PolarHBondContact O-N 3.4Å; R648-I674 HydrophobicContact CB-CG1 4.29Å; R648-S675 PolarHBondContact O-N 2.89Å
649	I	88.9	Confident	79.8	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	115.6	-169.1	-61.2	-172.2	0	0	0	110.2	T540 D541 L542 V543 V651 S675 Y677 M721	T540-I649 HydrophobicContact CG2-CD1 3.75Å; T540-I649 HydrophobicContact CG2-CG1 4.2Å; D541-I649 PolarHBondContact O-N 2.98Å; L542-I649 CarbonylContact C-O 2.92Å; L542-I649 WeakPolarHBondContact CA-O 3.27Å; L542-I649 HydrophobicContact CD1-CB 4.05Å; L542-I649 HydrophobicContact CD1-CG2 3.65Å; V543-I649 PolarHBondContact N-O 3.04Å; I649-V651 HydrophobicContact CG2-CG2 4.21Å; I649-S675 WeakPolarHBondContact CA-O 3.4Å; I649-Y677 HydrophobicContact CG2-CD2 3.67Å; I649-Y677 HydrophobicContact CG2-CE2 3.78Å; I649-M721 HydrophobicContact CD1-CE 3.39Å; I649-M721 HydrophobicContact CD1-CG 4.44Å; I649-M721 HydrophobicContact CD1-SD 4.04Å
650	G	90.3	Very high	79.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	107.1	174.5	0	0	0	0	0	110.8	V543 S675 L676 Y677	V543-G650 CarbonylContact O-C 3.5Å; V543-G650 WeakPolarHBondContact O-CA 3.38Å; G650-S675 PolarHBondContact N-O 3.32Å; G650-L676 WeakPolarHBondContact O-CA 2.9Å; G650-Y677 PolarHBondContact O-N 2.89Å
651	V	92.2	Very high	79.9	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	110	173.7	178.2	0	0	0	0	108.2	L542 V543 F544 L545 I649 I653 V679	L542-V651 HydrophobicContact CD1-CG2 3.74Å; V543-V651 PolarHBondContact O-N 2.74Å; F544-V651 WeakPolarHBondContact CA-O 3.19Å; F544-V651 HydrophobicContact CD1-CB 3.75Å; F544-V651 HydrophobicContact CD1-CG1 3.76Å; F544-V651 HydrophobicContact CD1-CG2 4.48Å; F544-V651 HydrophobicContact CE1-CB 3.97Å; F544-V651 HydrophobicContact CE1-CG1 3.85Å; F544-V651 HydrophobicContact CE1-CG2 4.25Å; F544-V651 HydrophobicContact CG-CB 4.49Å; L545-V651 PolarHBondContact N-O 3.3Å; I649-V651 HydrophobicContact CG2-CG2 4.21Å; V651-I653 HydrophobicContact CG1-CG1 4.4Å; V651-I653 PolarHBondContact O-N 2.04Å; V651-V679 HydrophobicContact CG1-CB 4.08Å; V651-V679 HydrophobicContact CG1-CG2 3.76Å
652	V	91.7	Very high	80.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	96.1	-178.7	-170.1	0	0	0	0	109.3	L545 T621 L676 Y677 V679 G680 I693	L545-V652 HydrophobicContact CB-CG1 4.37Å; L545-V652 HydrophobicContact CD1-CG1 4.46Å; L545-V652 HydrophobicContact CD1-CG2 4.2Å; T621-V652 HydrophobicContact CG2-CG1 4.02Å; V652-L676 HydrophobicContact CG2-CD2 4.3Å; V652-Y677 PolarHBondContact N-O 2.79Å; V652-V679 CarbonylContact O-C 3.6Å; V652-V679 WeakPolarHBondContact O-CA 3.29Å; V652-V679 PolarHBondContact O-N 3.05Å; V652-G680 PolarHBondContact O-N 3.43Å; V652-I693 HydrophobicContact CB-CG2 3.98Å; V652-I693 HydrophobicContact CG1-CG2 4.25Å; V652-I693 HydrophobicContact CG2-CG2 3.72Å
653	I	91.2	Very high	81.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.6	167.3	-77.1	164.9	0	0	0	108.5	F544 L545 I546 D547 V561 F564 V565 Y586 V651 V679 V681	F544-I653 HydrophobicContact CD1-CD1 4.13Å; L545-I653 WeakPolarHBondContact O-CA 3.33Å; L545-I653 WeakPolarHBondContact O-CB 3.37Å; L545-I653 PolarHBondContact O-N 2.82Å; L545-I653 VanDerWaalsContact O-O 3.14Å; I546-I653 HydrophobicContact CG2-CB 4.39Å; I546-I653 HydrophobicContact CG2-CG2 3.81Å; D547-I653 WeakPolarHBondContact CB-O 3.35Å; D547-I653 PolarHBondContact N-O 2.89Å; D547-I653 VanDerWaalsContact N-O 3.1Å; V561-I653 HydrophobicContact CG1-CD1 4.3Å; V561-I653 HydrophobicContact CG1-CG2 4.08Å; F564-I653 HydrophobicContact CD1-CD1 4.12Å; F564-I653 HydrophobicContact CE1-CD1 4.12Å; V565-I653 HydrophobicContact CG2-CD1 4.04Å; Y586-I653 WeakPolarHBondContact CE1-O 3.38Å; Y586-I653 PolarHBondContact OH-O 3.04Å; V651-I653 HydrophobicContact CG1-CG1 4.4Å; V651-I653 PolarHBondContact O-N 2.04Å; I653-V679 WeakPolarHBondContact CA-O 3.36Å; I653-V679 HydrophobicContact CG1-CB 4.35Å; I653-V679 HydrophobicContact CG1-CG1 4.33Å; I653-V681 HydrophobicContact CB-CG2 4.23Å; I653-V681 HydrophobicContact CG1-CG2 4.03Å; I653-V681 HydrophobicContact CG2-CG2 3.62Å
654	T	86.9	Confident	82.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	-168.5	179.2	-170.4	0	0	0	0	111.6	D547 Y586 G656 V681 V685 L690 E1618	D547-T654 PolarHBondContact OD2-OG1 2.9Å; Y586-T654 WeakPolarHBondContact OH-CB 3.41Å; Y586-T654 PolarHBondContact OH-OG1 3.09Å; T654-G656 PolarHBondContact OG1-O 2.86Å; T654-V681 PolarHBondContact O-N 3.26Å; T654-V685 HydrophobicContact CG2-CG2 3.75Å; T654-L690 HydrophobicContact CG2-CD2 3.77Å; T654-E1618 HydrophobicContact CG2-CG 4.19Å
655	D	82.1	Confident	84.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.			trans	-174.3	-32.9	-143.9	157.5	-90.7	0	0	0	115.1	D547 S549 S551 I552 H684 E1618 K1621	D547-D655 HydrophobicContact CB-CB 3.99Å; D547-D655 WeakPolarHBondContact OD2-CB 3.49Å; S549-D655 PolarHBondContact OG-OD1 2.59Å; S551-D655 WeakPolarHBondContact CB-OD1 3.47Å; S551-D655 WeakPolarHBondContact CB-OD2 3.37Å; S551-D655 PolarHBondContact OG-OD1 3.33Å; I552-D655 WeakPolarHBondContact CA-OD2 3.36Å; I552-D655 HydrophobicContact CD1-CB 4.32Å; I552-D655 HydrophobicContact CG1-CB 3.82Å; I552-D655 WeakPolarHBondContact CG1-OD2 3.38Å; I552-D655 PolarHBondContact N-OD2 2.81Å; D655-H684 WeakPolarHBondContact O-CB 3.41Å; D655-H684 PolarHBondContact O-CD2 2.83Å; D655-E1618 WeakPolarHBondContact CA-OE1 3.39Å; D655-E1618 PolarHBondContact N-OE1 2.72Å; D655-E1618 VanDerWaalsContact N-OE1 3.16Å; D655-K1621 VanDerWaalsContact CG-NZ 3.34Å; D655-K1621 WeakPolarHBondContact O-CB 3.25Å; D655-K1621 WeakPolarHBondContact OD2-CD 3.22Å; D655-K1621 VanDerWaalsContact OD2-CE 3.3Å; D655-K1621 WeakPolarHBondContact OD2-CE 3.44Å; D655-K1621 IonicContact OD2-NZ 2.73Å; D655-K1621 PolarHBondContact OD2-NZ 2.03Å
656	G	80.1	Confident	85.3	Confident	3 Å²	3	33.4 Å²	33.4	3%	0.031	17%	0.166	C	C	.	.	S	Bend	trans	-151.4	143.6	-175.2	0	0	0	0	0	107.5	T619 T654 A658 V685 E1618	T619-G656 VanDerWaalsContact CG2-O 3.25Å; T619-G656 WeakPolarHBondContact CG2-O 3.41Å; T654-G656 PolarHBondContact OG1-O 2.86Å; G656-A658 PolarHBondContact O-N 2.66Å; G656-V685 WeakPolarHBondContact O-CG2 3.27Å; G656-E1618 PolarHBondContact N-OE1 3.15Å
657	R	79.4	Confident	85.9	Confident	123 Å²	123	35.8 Å²	35.8	46%	0.464	18%	0.178	S	C	.	.			trans	-47.2	135.4	169.9	-74.5	-176	70.1	-166.4	-5.2	109.8	Q659 L686 E689	R657-Q659 PolarHBondContact O-N 3.01Å; R657-Q659 PolarHBondContact O-NE2 2.71Å; R657-L686 HydrophobicContact CG-CG 4.5Å; R657-E689 IonicContact NE-OE2 2.73Å; R657-E689 PolarHBondContact NE-OE2 3.32Å
658	A	82.6	Confident	86.2	Confident	16 Å²	16	32.1 Å²	32.1	13%	0.132	17%	0.165	C	C	.	.			trans	-55.9	135.6	176.4	0	0	0	0	0	110.3	T619 G656 D660 V662 E689	T619-A658 WeakPolarHBondContact O-CA 3.48Å; G656-A658 PolarHBondContact O-N 2.66Å; A658-D660 WeakPolarHBondContact CB-O 3.37Å; A658-V662 HydrophobicContact CB-CG1 3.43Å; A658-V662 VanDerWaalsContact CB-CG1 3.43Å; A658-E689 WeakPolarHBondContact CB-OE1 3.37Å; A658-E689 PolarHBondContact N-OE1 2.95Å
659	Q	81.2	Confident	86.4	Confident	127 Å²	127	31.4 Å²	31.4	59%	0.593	16%	0.162	S	C	*	.	S	Bend	trans	-88.4	9.4	174.4	-55.2	-58.7	-68.3	0	0	111.4	T619 R657	T619-Q659 PolarHBondContact O-N 2.8Å; R657-Q659 PolarHBondContact O-N 3.01Å; R657-Q659 PolarHBondContact O-NE2 2.71Å
660	D	84.8	Confident	86.3	Confident	46 Å²	46	34.4 Å²	34.4	25%	0.246	17%	0.173	C	C	.	.	S	Bend	trans	-145.5	171.5	178.6	61.8	-12.3	0	0	0	110.8	K620 T621 G622 A623 A658 V662	K620-D660 VanDerWaalsContact C-OD1 3.29Å; K620-D660 VanDerWaalsContact CA-OD1 3.29Å; K620-D660 WeakPolarHBondContact CA-OD1 3.42Å; K620-D660 WeakPolarHBondContact CB-OD2 3.39Å; K620-D660 HydrophobicContact CG-CB 4.46Å; T621-D660 PolarHBondContact N-OD1 3.01Å; T621-D660 VanDerWaalsContact N-OD1 3.09Å; G622-D660 PolarHBondContact N-OD1 3.38Å; G622-D660 PolarHBondContact N-OD2 2.7Å; A623-D660 WeakPolarHBondContact CB-OD2 3.42Å; A623-D660 PolarHBondContact N-OD2 3.28Å; A658-D660 WeakPolarHBondContact CB-O 3.37Å; D660-V662 PolarHBondContact O-N 3.41Å
661	E	80	Confident	85.9	Confident	137 Å²	137	42.2 Å²	42.2	64%	0.64	20%	0.203	S	C	*	.			trans	-77.7	119	-177	-166.4	-163.5	135.9	0	0	111.5	G622 G664 P665	G622-E661 WeakPolarHBondContact CA-O 3.36Å; E661-G664 PolarHBondContact OE1-N 2.72Å; E661-P665 VanDerWaalsContact O-CD 3.29Å; E661-P665 WeakPolarHBondContact O-CD 3.5Å; E661-P665 WeakPolarHBondContact O-CG 3.4Å
662	V	87.6	Confident	85.5	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.03	21%	0.214	C	C	.	.			trans	-86.4	-25.6	178	-64.2	0	0	0	0	114.4	T621 A658 D660 P665 A666 E689 Q692 I693	T621-V662 HydrophobicContact CG2-CG1 4.14Å; A658-V662 HydrophobicContact CB-CG1 3.43Å; A658-V662 VanDerWaalsContact CB-CG1 3.43Å; D660-V662 PolarHBondContact O-N 3.41Å; V662-P665 WeakPolarHBondContact O-CD 3.1Å; V662-A666 WeakPolarHBondContact O-CB 3.47Å; V662-A666 PolarHBondContact O-N 3Å; V662-E689 HydrophobicContact CG2-CG 3.74Å; V662-Q692 HydrophobicContact CG2-CB 4.39Å; V662-I693 HydrophobicContact CB-CD1 4.36Å; V662-I693 HydrophobicContact CB-CG1 4.02Å; V662-I693 HydrophobicContact CG1-CD1 4.25Å; V662-I693 HydrophobicContact CG1-CG1 4.44Å; V662-I693 HydrophobicContact CG2-CD1 4.48Å; V662-I693 HydrophobicContact CG2-CG1 4.13Å
663	T	85.3	Confident	85	Confident	42 Å²	42	50.4 Å²	50.4	26%	0.258	25%	0.245	S	C	.	.	H	α-helix	trans	-64.7	-55.8	-170	-51.2	0	0	0	0	111.9	A666 D667	T663-A666 PolarHBondContact O-N 2.71Å; T663-A666 VanDerWaalsContact O-N 3.16Å; T663-D667 PolarHBondContact O-N 3.02Å
664	G	85.6	Confident	84.8	Confident	31 Å²	31	50.5 Å²	50.5	32%	0.32	25%	0.246	S	C	.	.	H	α-helix	trans	-51.7	-52.4	176.2	0	0	0	0	0	114	E661 D667 E668	E661-G664 PolarHBondContact OE1-N 2.72Å; G664-D667 PolarHBondContact O-N 2.67Å; G664-E668 PolarHBondContact O-N 2.91Å
665	P	88.2	Confident	84.9	Confident	22 Å²	22	51.6 Å²	51.6	14%	0.143	25%	0.253	C	S	.	.	H	α-helix	trans	-59.5	-42	173.9	-29	37.5	0	0	0	114.4	G622 I625 E626 E661 V662 E668 A669	G622-P665 VanDerWaalsContact O-CB 3.3Å; G622-P665 WeakPolarHBondContact O-CB 3.11Å; G622-P665 WeakPolarHBondContact O-CG 3.32Å; I625-P665 HydrophobicContact CB-CB 3.94Å; I625-P665 HydrophobicContact CG2-CB 3.91Å; I625-P665 WeakPolarHBondContact CG2-O 3.05Å; E626-P665 HydrophobicContact CB-CB 4.37Å; E661-P665 VanDerWaalsContact O-CD 3.29Å; E661-P665 WeakPolarHBondContact O-CD 3.5Å; E661-P665 WeakPolarHBondContact O-CG 3.4Å; V662-P665 WeakPolarHBondContact O-CD 3.1Å; P665-E668 PolarHBondContact O-N 3.35Å; P665-A669 PolarHBondContact O-N 2.95Å
666	A	91.5	Very high	85.2	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68	-37.4	179.1	0	0	0	0	0	112.7	V662 T663 A669 R670 L676 Q692	V662-A666 WeakPolarHBondContact O-CB 3.47Å; V662-A666 PolarHBondContact O-N 3Å; T663-A666 PolarHBondContact O-N 2.71Å; T663-A666 VanDerWaalsContact O-N 3.16Å; A666-A669 PolarHBondContact O-N 3.42Å; A666-R670 WeakPolarHBondContact O-CG 3.3Å; A666-R670 PolarHBondContact O-N 2.98Å; A666-L676 HydrophobicContact CB-CD1 4.07Å; A666-Q692 VanDerWaalsContact CB-O 3.28Å; A666-Q692 WeakPolarHBondContact CB-O 3.46Å
667	D	87.3	Confident	85.7	Confident	65 Å²	65	51.8 Å²	51.8	35%	0.348	25%	0.253	S	S	.	.	H	α-helix	trans	-70.9	-30.8	172	-77.2	-36.7	0	0	0	112.3	T663 G664 R670 R671	T663-D667 PolarHBondContact O-N 3.02Å; G664-D667 PolarHBondContact O-N 2.67Å; D667-R670 IonicContact OD1-CZ 2.72Å; D667-R670 IonicContact OD1-NE 3.04Å; D667-R670 PolarHBondContact OD1-NE 2.97Å; D667-R670 IonicContact OD1-NH2 3.13Å; D667-R670 PolarHBondContact OD1-NH2 3.18Å; D667-R670 IonicContact OD2-NH2 3.28Å; D667-R671 WeakPolarHBondContact O-CB 3.3Å; D667-R671 VanDerWaalsContact O-CG 3.23Å; D667-R671 WeakPolarHBondContact O-CG 3.06Å; D667-R671 PolarHBondContact O-N 3.23Å; D667-R671 VanDerWaalsContact O-N 3.1Å; D667-R671 PolarHBondContact O-NE 3.33Å
668	E	87.3	Confident	86.1	Confident	39 Å²	39	46 Å²	46	18%	0.182	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-44.8	168.1	-164.3	172.3	133	0	0	111.7	T629 R630 G664 P665 R671 H672	T629-E668 HydrophobicContact CG2-CG 4.3Å; R630-E668 IonicContact CZ-OE1 3.44Å; R630-E668 IonicContact CZ-OE2 3.62Å; R630-E668 IonicContact NE-OE1 2.59Å; R630-E668 PolarHBondContact NE-OE1 3.34Å; R630-E668 IonicContact NE-OE2 3.45Å; R630-E668 IonicContact NH2-OE1 2.68Å; R630-E668 PolarHBondContact NH2-OE1 2.96Å; R630-E668 IonicContact NH2-OE2 2.88Å; R630-E668 PolarHBondContact NH2-OE2 3.39Å; G664-E668 PolarHBondContact O-N 2.91Å; P665-E668 PolarHBondContact O-N 3.35Å; E668-R671 CarbonylContact O-C 3.57Å; E668-R671 PolarHBondContact O-N 3.2Å; E668-H672 PolarHBondContact O-N 2.98Å; E668-H672 VanDerWaalsContact O-N 3.16Å; E668-H672 PolarHBondContact O-ND1 3.25Å
669	A	90.5	Very high	86.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-46.3	176.7	0	0	0	0	0	112.6	I625 T629 P665 A666 R671 H672 I674 L676	I625-A669 HydrophobicContact CG2-CB 3.87Å; T629-A669 VanDerWaalsContact OG1-CB 3.3Å; T629-A669 WeakPolarHBondContact OG1-CB 3.02Å; P665-A669 PolarHBondContact O-N 2.95Å; A666-A669 PolarHBondContact O-N 3.42Å; A669-R671 VanDerWaalsContact C-N 3.35Å; A669-R671 PolarHBondContact O-N 2.74Å; A669-H672 WeakPolarHBondContact O-CA 3.4Å; A669-H672 WeakPolarHBondContact O-CB 3.19Å; A669-H672 PolarHBondContact O-N 3.09Å; A669-I674 HydrophobicContact CB-CD1 4.23Å; A669-I674 WeakPolarHBondContact O-CB 3.27Å; A669-I674 PolarHBondContact O-N 3.4Å; A669-L676 HydrophobicContact CB-CD1 3.79Å; A669-L676 HydrophobicContact CB-CD2 4.36Å; A669-L676 HydrophobicContact CB-CG 4.28Å
670	R	87	Confident	86.4	Confident	64 Å²	64	39.1 Å²	39.1	24%	0.242	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-41.6	175.1	-75.5	-173.2	-73.8	-96.5	6.5	111.9	A666 D667 H672 N673 Q692 I693	A666-R670 WeakPolarHBondContact O-CG 3.3Å; A666-R670 PolarHBondContact O-N 2.98Å; D667-R670 IonicContact OD1-CZ 2.72Å; D667-R670 IonicContact OD1-NE 3.04Å; D667-R670 PolarHBondContact OD1-NE 2.97Å; D667-R670 IonicContact OD1-NH2 3.13Å; D667-R670 PolarHBondContact OD1-NH2 3.18Å; D667-R670 IonicContact OD2-NH2 3.28Å; R670-H672 PolarHBondContact O-N 3.03Å; R670-H672 VanDerWaalsContact O-N 3.15Å; R670-N673 PolarHBondContact O-N 2.95Å; R670-Q692 VanDerWaalsContact CZ-O 3.29Å; R670-Q692 PolarHBondContact NH1-O 3.01Å; R670-Q692 PolarHBondContact NH2-O 3.21Å; R670-I693 VanDerWaalsContact NH1-C 3.31Å; R670-I693 PolarHBondContact NH1-O 2.65Å
671	R	81.8	Confident	85.9	Confident	164 Å²	164	37 Å²	37	62%	0.619	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-8.5	172	-73.7	176.1	-68.3	162.6	0.6	114.4	D667 E668 A669	D667-R671 WeakPolarHBondContact O-CB 3.3Å; D667-R671 VanDerWaalsContact O-CG 3.23Å; D667-R671 WeakPolarHBondContact O-CG 3.06Å; D667-R671 PolarHBondContact O-N 3.23Å; D667-R671 VanDerWaalsContact O-N 3.1Å; D667-R671 PolarHBondContact O-NE 3.33Å; E668-R671 CarbonylContact O-C 3.57Å; E668-R671 PolarHBondContact O-N 3.2Å; A669-R671 VanDerWaalsContact C-N 3.35Å; A669-R671 PolarHBondContact O-N 2.74Å
672	H	82.9	Confident	85.1	Confident	52 Å²	52	30.6 Å²	30.6	24%	0.241	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	13.5	170.8	-75.5	64.3	0	0	0	113.2	T629 R642 E668 A669 R670 I674	T629-H672 HydrophobicContact CG2-CB 4.09Å; R642-H672 PolarHBondContact NH2-CD2 3.44Å; R642-H672 PolarHBondContact NH2-NE2 2.73Å; E668-H672 PolarHBondContact O-N 2.98Å; E668-H672 VanDerWaalsContact O-N 3.16Å; E668-H672 PolarHBondContact O-ND1 3.25Å; A669-H672 WeakPolarHBondContact O-CA 3.4Å; A669-H672 WeakPolarHBondContact O-CB 3.19Å; A669-H672 PolarHBondContact O-N 3.09Å; R670-H672 PolarHBondContact O-N 3.03Å; R670-H672 VanDerWaalsContact O-N 3.15Å; H672-I674 HydrophobicContact CB-CD1 3.89Å; H672-I674 HydrophobicContact CB-CG1 4.1Å; H672-I674 PolarHBondContact O-N 3.13Å
673	N	82.5	Confident	83.5	Confident	122 Å²	122	30.3 Å²	30.3	65%	0.652	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	28.8	-172.1	-67.5	11.6	0	0	0	113.4	R670	R670-N673 PolarHBondContact O-N 2.95Å
674	I	87.1	Confident	82.3	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.015	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	114.2	173.4	-55.1	162.1	0	0	0	108	T629 F633 R648 A669 H672 L676	T629-I674 HydrophobicContact CG2-CD1 4.18Å; F633-I674 HydrophobicContact CB-CD1 4.06Å; F633-I674 HydrophobicContact CD2-CD1 3.4Å; F633-I674 VanDerWaalsContact CD2-CD1 3.4Å; F633-I674 HydrophobicContact CD2-CG1 3.85Å; F633-I674 HydrophobicContact CD2-CG2 4.19Å; F633-I674 HydrophobicContact CE2-CD1 3.99Å; F633-I674 HydrophobicContact CE2-CG1 4.1Å; F633-I674 HydrophobicContact CE2-CG2 3.6Å; F633-I674 HydrophobicContact CG-CD1 3.89Å; F633-I674 HydrophobicContact CG-CG1 4.14Å; F633-I674 HydrophobicContact CZ-CG2 4.02Å; R648-I674 HydrophobicContact CB-CG1 4.29Å; A669-I674 HydrophobicContact CB-CD1 4.23Å; A669-I674 WeakPolarHBondContact O-CB 3.27Å; A669-I674 PolarHBondContact O-N 3.4Å; H672-I674 HydrophobicContact CB-CD1 3.89Å; H672-I674 HydrophobicContact CB-CG1 4.1Å; H672-I674 PolarHBondContact O-N 3.13Å; I674-L676 HydrophobicContact CG2-CD2 3.82Å; I674-L676 HydrophobicContact CG2-CG 4.49Å; I674-L676 PolarHBondContact O-N 3.24Å
675	S	87.4	Confident	81.6	Confident	22 Å²	22	29.7 Å²	29.7	15%	0.154	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	104.4	169.8	-74.3	0	0	0	0	109.3	R648 I649 G650 R699	R648-S675 PolarHBondContact O-N 2.89Å; I649-S675 WeakPolarHBondContact CA-O 3.4Å; G650-S675 PolarHBondContact N-O 3.32Å; S675-R699 PolarHBondContact OG-NH1 2.04Å
676	L	89.6	Confident	80.8	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	127.8	176	-65.2	-176.3	0	0	0	110.5	I625 M628 G650 V652 A666 A669 I674 I693 A694	I625-L676 HydrophobicContact CG2-CD1 4.39Å; M628-L676 HydrophobicContact CE-CD2 3.42Å; M628-L676 VanDerWaalsContact CE-CD2 3.42Å; G650-L676 WeakPolarHBondContact O-CA 2.9Å; V652-L676 HydrophobicContact CG2-CD2 4.3Å; A666-L676 HydrophobicContact CB-CD1 4.07Å; A669-L676 HydrophobicContact CB-CD1 3.79Å; A669-L676 HydrophobicContact CB-CD2 4.36Å; A669-L676 HydrophobicContact CB-CG 4.28Å; I674-L676 HydrophobicContact CG2-CD2 3.82Å; I674-L676 HydrophobicContact CG2-CG 4.49Å; I674-L676 PolarHBondContact O-N 3.24Å; L676-I693 WeakPolarHBondContact CB-O 3.13Å; L676-I693 HydrophobicContact CD1-CG2 4.36Å; L676-I693 WeakPolarHBondContact CD1-O 3.3Å; L676-A694 WeakPolarHBondContact O-CA 3.34Å
677	Y	89.9	Confident	80.1	Confident	8 Å²	8	36 Å²	36	3%	0.031	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.6	168.5	-69.9	-87.6	0	0	0	107.9	I649 G650 V652 V679 R699 F701 M721	I649-Y677 HydrophobicContact CG2-CD2 3.67Å; I649-Y677 HydrophobicContact CG2-CE2 3.78Å; G650-Y677 PolarHBondContact O-N 2.89Å; V652-Y677 PolarHBondContact N-O 2.79Å; Y677-V679 PolarHBondContact O-N 3.11Å; Y677-R699 WeakPolarHBondContact CA-O 3.43Å; Y677-R699 HydrophobicContact CD1-CB 3.65Å; Y677-R699 HydrophobicContact CD1-CG 3.94Å; Y677-R699 HydrophobicContact CE1-CB 3.9Å; Y677-R699 HydrophobicContact CE1-CG 3.61Å; Y677-R699 HydrophobicContact CG-CB 4.44Å; Y677-F701 HydrophobicContact CD1-CD2 4.24Å; Y677-F701 AromaticContact CD1-CE2 3.64Å; Y677-F701 HydrophobicContact CD1-CE2 3.64Å; Y677-F701 HydrophobicContact CE1-CE2 4.1Å; Y677-M721 HydrophobicContact CE2-CG 4.41Å; Y677-M721 WeakPolarHBondContact OH-CG 3.45Å
678	A	87.7	Confident	79.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	108.6	179.1	0	0	0	0	0	108.3	L690 I693 A694 R699 V700 F701	A678-L690 HydrophobicContact CB-CB 3.83Å; A678-L690 HydrophobicContact CB-CD2 3.97Å; A678-L690 HydrophobicContact CB-CG 4.41Å; A678-L690 WeakPolarHBondContact CB-O 3.36Å; A678-I693 HydrophobicContact CB-CB 4.22Å; A678-I693 HydrophobicContact CB-CG2 4.05Å; A678-A694 HydrophobicContact CB-CB 3.87Å; A678-R699 PolarHBondContact N-O 2.82Å; A678-R699 VanDerWaalsContact N-O 3.09Å; A678-V700 HydrophobicContact CB-CG2 4.31Å; A678-F701 PolarHBondContact O-N 3.32Å
679	V	87.8	Confident	79.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	48.1	-175.9	-172.7	0	0	0	0	107.2	V651 V652 I653 Y677 V681 F701 L713 S1616	V651-V679 HydrophobicContact CG1-CB 4.08Å; V651-V679 HydrophobicContact CG1-CG2 3.76Å; V652-V679 CarbonylContact O-C 3.6Å; V652-V679 WeakPolarHBondContact O-CA 3.29Å; V652-V679 PolarHBondContact O-N 3.05Å; I653-V679 WeakPolarHBondContact CA-O 3.36Å; I653-V679 HydrophobicContact CG1-CB 4.35Å; I653-V679 HydrophobicContact CG1-CG1 4.33Å; Y677-V679 PolarHBondContact O-N 3.11Å; V679-V681 VanDerWaalsContact O-CG2 3.25Å; V679-V681 WeakPolarHBondContact O-CG2 3.08Å; V679-V681 PolarHBondContact O-N 3.19Å; V679-F701 HydrophobicContact CG2-CB 4.23Å; V679-F701 HydrophobicContact CG2-CD2 4.24Å; V679-L713 HydrophobicContact CG1-CD2 3.9Å; V679-S1616 WeakPolarHBondContact CG1-OG 3.19Å; V679-S1616 PolarHBondContact O-OG 3.28Å
680	G	82.5	Confident	79.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	131.6	175	0	0	0	0	0	109.8	V652 S1616 S1617	V652-G680 PolarHBondContact O-N 3.43Å; G680-S1616 VanDerWaalsContact C-OG 3.25Å; G680-S1616 CarbonylContact O-C 3.08Å; G680-S1616 PolarHBondContact O-OG 2.79Å; G680-S1617 CarbonylContact C-O 3.33Å; G680-S1617 VanDerWaalsContact C-O 3.23Å; G680-S1617 CarbonylContact O-C 3.59Å; G680-S1617 WeakPolarHBondContact O-CA 3.35Å; G680-S1617 PolarHBondContact O-N 3.23Å
681	V	75	Confident	79.1	Confident	1 Å²	1	34 Å²	34	1%	0.006	17%	0.167	C	C	.	.			trans	-107.3	143.8	-160.1	-171.3	0	0	0	0	113.9	I653 T654 V679 F706 L709 S1616 S1617 K1621	I653-V681 HydrophobicContact CB-CG2 4.23Å; I653-V681 HydrophobicContact CG1-CG2 4.03Å; I653-V681 HydrophobicContact CG2-CG2 3.62Å; T654-V681 PolarHBondContact O-N 3.26Å; V679-V681 VanDerWaalsContact O-CG2 3.25Å; V679-V681 WeakPolarHBondContact O-CG2 3.08Å; V679-V681 PolarHBondContact O-N 3.19Å; V681-F706 HydrophobicContact CB-CE1 4.05Å; V681-F706 HydrophobicContact CG1-CD1 3.45Å; V681-F706 VanDerWaalsContact CG1-CD1 3.45Å; V681-F706 HydrophobicContact CG1-CE1 3.21Å; V681-F706 HydrophobicContact CG1-CG 4.37Å; V681-F706 HydrophobicContact CG1-CZ 3.97Å; V681-L709 HydrophobicContact CG1-CD2 4.26Å; V681-S1616 WeakPolarHBondContact CA-OG 3.34Å; V681-S1616 WeakPolarHBondContact CG2-OG 3.05Å; V681-S1617 CarbonylContact C-O 3.54Å; V681-K1621 WeakPolarHBondContact O-CE 3.4Å; V681-K1621 PolarHBondContact O-NZ 2.96Å
682	T	61.9	Low	79.2	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.012	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	69	-111.9	-162	60.7	0	0	0	0	111	S705 F706 S1615 S1617 Y1620 K1621	T682-S705 VanDerWaalsContact CA-O 3.28Å; T682-S705 WeakPolarHBondContact CA-O 3.28Å; T682-S705 WeakPolarHBondContact CG2-O 3.07Å; T682-S705 PolarHBondContact N-O 2.93Å; T682-F706 HydrophobicContact CG2-CD1 4.37Å; T682-F706 HydrophobicContact CG2-CD2 3.03Å; T682-F706 HydrophobicContact CG2-CE1 4.38Å; T682-F706 HydrophobicContact CG2-CE2 3.02Å; T682-F706 HydrophobicContact CG2-CG 3.75Å; T682-F706 HydrophobicContact CG2-CZ 3.76Å; T682-S1615 VanDerWaalsContact CA-O 3.27Å; T682-S1615 WeakPolarHBondContact CA-O 3.14Å; T682-S1615 PolarHBondContact N-O 3.12Å; T682-S1615 VanDerWaalsContact O-O 3.06Å; T682-S1617 CarbonylContact C-O 3.59Å; T682-S1617 CarbonylContact O-C 3.51Å; T682-S1617 WeakPolarHBondContact O-CA 3.24Å; T682-S1617 PolarHBondContact O-N 3.16Å; T682-S1617 PolarHBondContact O-OG 3.22Å; T682-S1617 VanDerWaalsContact O-OG 3.12Å; T682-Y1620 VanDerWaalsContact CB-CD1 3.42Å; T682-Y1620 HydrophobicContact CG2-CD1 3.76Å; T682-Y1620 HydrophobicContact CG2-CE1 3.8Å; T682-K1621 HydrophobicContact CG2-CG 4.32Å; T682-K1621 WeakPolarHBondContact OG1-CB 3.31Å; T682-K1621 WeakPolarHBondContact OG1-CE 3.28Å; T682-K1621 WeakPolarHBondContact OG1-CG 3.21Å; T682-K1621 PolarHBondContact OG1-N 3.25Å
683	N	55.8	Low	79.5	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	-159.9	98.4	156.3	60.8	-90.5	0	0	0	120.8	G704 S1611 Y1612 S1617 E1618 P1619 Y1620 K1621 T1622	N683-G704 WeakPolarHBondContact OD1-CA 3.19Å; N683-S1611 PolarHBondContact ND2-O 2.78Å; N683-S1611 PolarHBondContact OD1-O 3.47Å; N683-Y1612 WeakPolarHBondContact ND2-CD1 3.26Å; N683-Y1612 VanDerWaalsContact ND2-CE1 3.31Å; N683-Y1612 WeakPolarHBondContact ND2-CE1 3.26Å; N683-Y1612 WeakPolarHBondContact OD1-CA 3.02Å; N683-S1617 VanDerWaalsContact CA-C 3.47Å; N683-S1617 WeakPolarHBondContact CA-O 3.31Å; N683-S1617 VanDerWaalsContact CB-O 3.27Å; N683-S1617 WeakPolarHBondContact CB-O 3.18Å; N683-S1617 WeakPolarHBondContact CB-OG 3.47Å; N683-S1617 PolarHBondContact N-O 3.18Å; N683-S1617 PolarHBondContact OD1-OG 2.79Å; N683-E1618 CarbonylContact C-O 3.57Å; N683-E1618 VanDerWaalsContact C-O 3.32Å; N683-E1618 VanDerWaalsContact C-OE2 3.27Å; N683-E1618 WeakPolarHBondContact CA-OE2 3.46Å; N683-E1618 CarbonylContact O-C 3.59Å; N683-P1619 VanDerWaalsContact C-C 3.42Å; N683-P1619 WeakPolarHBondContact ND2-CA 3.47Å; N683-P1619 VanDerWaalsContact ND2-CD 3.3Å; N683-P1619 WeakPolarHBondContact ND2-CD 3.21Å; N683-P1619 VanDerWaalsContact ND2-N 3.17Å; N683-P1619 CarbonylContact O-C 3.27Å; N683-P1619 WeakPolarHBondContact O-CA 3.05Å; N683-Y1620 VanDerWaalsContact C-C 3.49Å; N683-Y1620 VanDerWaalsContact C-CA 3.45Å; N683-Y1620 VanDerWaalsContact CG-CA 3.45Å; N683-Y1620 VanDerWaalsContact CG-N 3.29Å; N683-Y1620 VanDerWaalsContact N-CA 3.28Å; N683-Y1620 WeakPolarHBondContact ND2-CB 3.44Å; N683-Y1620 PolarHBondContact ND2-N 2.7Å; N683-Y1620 CarbonylContact O-C 3.58Å; N683-Y1620 WeakPolarHBondContact O-CA 3.34Å; N683-Y1620 PolarHBondContact O-N 3.33Å; N683-Y1620 WeakPolarHBondContact OD1-CB 3.47Å; N683-K1621 PolarHBondContact O-N 3Å; N683-T1622 PolarHBondContact O-N 3.13Å
684	H	59.6	Low	79.7	Confident	59 Å²	59	22.1 Å²	22.1	27%	0.273	12%	0.115	S	C	.	.			trans	-127.6	-44.6	172.4	-155.8	-20.3	0	0	0	122	D655 E1618 K1621 T1622	D655-H684 WeakPolarHBondContact O-CB 3.41Å; D655-H684 PolarHBondContact O-CD2 2.83Å; H684-E1618 CarbonylContact C-O 3.6Å; H684-E1618 WeakPolarHBondContact CA-O 3.39Å; H684-E1618 VanDerWaalsContact CA-OE1 3.3Å; H684-E1618 WeakPolarHBondContact CA-OE1 2.97Å; H684-E1618 VanDerWaalsContact CB-OE1 3.25Å; H684-E1618 WeakPolarHBondContact CB-OE1 3.02Å; H684-E1618 PolarHBondContact N-O 3.01Å; H684-E1618 PolarHBondContact N-OE1 2.84Å; H684-E1618 PolarHBondContact N-OE2 2.92Å; H684-E1618 VanDerWaalsContact O-O 3.07Å; H684-K1621 HydrophobicContact CB-CB 3.84Å; H684-K1621 VanDerWaalsContact CD2-C 3.44Å; H684-K1621 PolarHBondContact CD2-O 3.36Å; H684-K1621 VanDerWaalsContact CD2-O 3.24Å; H684-T1622 VanDerWaalsContact CG-N 3.32Å; H684-T1622 PolarHBondContact ND1-OG1 3.34Å; H684-T1622 VanDerWaalsContact ND1-OG1 3.12Å
685	V	70.6	Confident	79.4	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.006	14%	0.137	C	C	.	.	S	Bend	trans	-54.9	140.3	162.3	-177.5	0	0	0	0	118.1	T654 G656 K687 E689 L690 E1618	T654-V685 HydrophobicContact CG2-CG2 3.75Å; G656-V685 WeakPolarHBondContact O-CG2 3.27Å; V685-K687 PolarHBondContact O-N 2.98Å; V685-E689 HydrophobicContact CG1-CB 3.6Å; V685-E689 VanDerWaalsContact CG1-CD 3.41Å; V685-E689 HydrophobicContact CG1-CG 3.63Å; V685-E689 WeakPolarHBondContact CG1-OE1 3.49Å; V685-L690 HydrophobicContact CB-CD2 4.3Å; V685-L690 HydrophobicContact CB-CG 4.41Å; V685-L690 HydrophobicContact CG1-CD2 3.92Å; V685-L690 HydrophobicContact CG1-CG 3.97Å; V685-E1618 CarbonylContact C-O 3.58Å; V685-E1618 HydrophobicContact CB-CB 3.41Å; V685-E1618 VanDerWaalsContact CB-CB 3.41Å; V685-E1618 HydrophobicContact CB-CG 3.57Å; V685-E1618 HydrophobicContact CG1-CB 4.46Å; V685-E1618 HydrophobicContact CG2-CB 4.28Å; V685-E1618 HydrophobicContact CG2-CG 3.9Å; V685-E1618 WeakPolarHBondContact CG2-OE1 3.33Å; V685-E1618 VanDerWaalsContact N-CB 3.28Å; V685-E1618 PolarHBondContact N-O 3.44Å; V685-E1618 PolarHBondContact N-OE1 2.81Å; V685-E1618 CarbonylContact O-C 3.55Å; V685-E1618 WeakPolarHBondContact O-CA 3.01Å; V685-E1618 WeakPolarHBondContact O-CB 3.46Å
686	L	72.2	Confident	79	Confident	71 Å²	71	25 Å²	25	37%	0.372	14%	0.143	S	C	.	.			trans	-58.6	138.8	175.7	-49.9	173.7	0	0	0	113.1	R657 S688 E689 L690	R657-L686 HydrophobicContact CG-CG 4.5Å; L686-S688 WeakPolarHBondContact CB-OG 3.27Å; L686-S688 PolarHBondContact O-N 3.42Å; L686-S688 VanDerWaalsContact O-N 3.15Å; L686-E689 HydrophobicContact CB-CB 3.84Å; L686-E689 WeakPolarHBondContact O-CA 3.25Å; L686-E689 WeakPolarHBondContact O-CB 3.44Å; L686-E689 PolarHBondContact O-N 3.06Å; L686-L690 PolarHBondContact O-N 2.93Å
687	K	75.8	Confident	78.2	Confident	84 Å²	84	34.3 Å²	34.3	37%	0.365	18%	0.178	S	C	.	.	H	α-helix	trans	-57.6	-29.7	170.7	178.5	164.8	-175.1	174.3	0	112.2	V685 I691 I702	V685-K687 PolarHBondContact O-N 2.98Å; K687-I691 HydrophobicContact CG-CD1 4.1Å; K687-I691 WeakPolarHBondContact O-CB 3.29Å; K687-I691 WeakPolarHBondContact O-CD1 3.39Å; K687-I691 WeakPolarHBondContact O-CG1 3.4Å; K687-I691 PolarHBondContact O-N 3.42Å; K687-I702 HydrophobicContact CB-CD1 3.92Å; K687-I702 HydrophobicContact CD-CD1 3.74Å; K687-I702 HydrophobicContact CG-CD1 3.54Å
688	S	78.3	Confident	77.4	Confident	66 Å²	66	38.4 Å²	38.4	46%	0.462	20%	0.2	S	C	.	.	H	α-helix	trans	-66.4	-35.7	171.3	48.2	0	0	0	0	113.1	L686 I691 Q692	L686-S688 WeakPolarHBondContact CB-OG 3.27Å; L686-S688 PolarHBondContact O-N 3.42Å; L686-S688 VanDerWaalsContact O-N 3.15Å; S688-I691 PolarHBondContact O-N 3.02Å; S688-Q692 VanDerWaalsContact O-CG 3.3Å; S688-Q692 WeakPolarHBondContact O-CG 3.39Å; S688-Q692 PolarHBondContact O-N 3.03Å
689	E	80.7	Confident	77.1	Confident	12 Å²	12	42.1 Å²	42.1	6%	0.056	21%	0.214	C	C	.	.	H	α-helix	trans	-75.4	-38.3	178.4	-171.2	-176.9	144.7	0	0	110.4	R657 A658 V662 V685 L686 I691 Q692 I693	R657-E689 IonicContact NE-OE2 2.73Å; R657-E689 PolarHBondContact NE-OE2 3.32Å; A658-E689 WeakPolarHBondContact CB-OE1 3.37Å; A658-E689 PolarHBondContact N-OE1 2.95Å; V662-E689 HydrophobicContact CG2-CG 3.74Å; V685-E689 HydrophobicContact CG1-CB 3.6Å; V685-E689 VanDerWaalsContact CG1-CD 3.41Å; V685-E689 HydrophobicContact CG1-CG 3.63Å; V685-E689 WeakPolarHBondContact CG1-OE1 3.49Å; L686-E689 HydrophobicContact CB-CB 3.84Å; L686-E689 WeakPolarHBondContact O-CA 3.25Å; L686-E689 WeakPolarHBondContact O-CB 3.44Å; L686-E689 PolarHBondContact O-N 3.06Å; E689-I691 VanDerWaalsContact C-N 3.33Å; E689-I691 PolarHBondContact O-N 3.13Å; E689-Q692 WeakPolarHBondContact O-CB 3.09Å; E689-Q692 PolarHBondContact O-N 2.96Å; E689-I693 VanDerWaalsContact O-CG1 3.31Å; E689-I693 WeakPolarHBondContact O-CG1 3.39Å; E689-I693 PolarHBondContact O-N 3.48Å
690	L	87.7	Confident	76.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.5	-35.2	166.9	-64.6	-176.8	0	0	0	112.6	T654 A678 V685 L686 I693 A694 V700 I702 E1618	T654-L690 HydrophobicContact CG2-CD2 3.77Å; A678-L690 HydrophobicContact CB-CB 3.83Å; A678-L690 HydrophobicContact CB-CD2 3.97Å; A678-L690 HydrophobicContact CB-CG 4.41Å; A678-L690 WeakPolarHBondContact CB-O 3.36Å; V685-L690 HydrophobicContact CB-CD2 4.3Å; V685-L690 HydrophobicContact CB-CG 4.41Å; V685-L690 HydrophobicContact CG1-CD2 3.92Å; V685-L690 HydrophobicContact CG1-CG 3.97Å; L686-L690 PolarHBondContact O-N 2.93Å; L690-I693 HydrophobicContact CD2-CD1 4.49Å; L690-I693 PolarHBondContact O-N 3.15Å; L690-A694 WeakPolarHBondContact O-CB 3.49Å; L690-A694 PolarHBondContact O-N 2.64Å; L690-V700 HydrophobicContact CB-CG1 3.91Å; L690-V700 HydrophobicContact CD1-CG1 4.46Å; L690-I702 HydrophobicContact CD1-CD1 3.63Å; L690-I702 HydrophobicContact CD1-CG1 3.68Å; L690-E1618 HydrophobicContact CD1-CB 3.72Å; L690-E1618 HydrophobicContact CD1-CG 4.05Å; L690-E1618 HydrophobicContact CD2-CG 4.39Å; L690-E1618 HydrophobicContact CG-CB 4.31Å
691	I	84.8	Confident	76.7	Confident	48 Å²	48	43.6 Å²	43.6	25%	0.246	22%	0.222	C	C	.	.	H	α-helix	trans	-69.2	-39.4	171.5	-70.6	164.1	0	0	0	111.2	K687 S688 E689 I693 A694 G695 R697 V700	K687-I691 HydrophobicContact CG-CD1 4.1Å; K687-I691 WeakPolarHBondContact O-CB 3.29Å; K687-I691 WeakPolarHBondContact O-CD1 3.39Å; K687-I691 WeakPolarHBondContact O-CG1 3.4Å; K687-I691 PolarHBondContact O-N 3.42Å; S688-I691 PolarHBondContact O-N 3.02Å; E689-I691 VanDerWaalsContact C-N 3.33Å; E689-I691 PolarHBondContact O-N 3.13Å; I691-I693 PolarHBondContact O-N 3.13Å; I691-A694 PolarHBondContact O-N 3.5Å; I691-G695 WeakPolarHBondContact O-CA 3.46Å; I691-G695 PolarHBondContact O-N 3.41Å; I691-R697 HydrophobicContact CD1-CG 4.14Å; I691-V700 HydrophobicContact CG1-CG2 3.85Å
692	Q	83.8	Confident	76.7	Confident	83 Å²	83	44.3 Å²	44.3	39%	0.388	23%	0.225	S	C	.	.	H	α-helix	trans	-60.3	-32.3	172.1	-75.8	164.4	-14.9	0	0	111.6	V662 A666 R670 S688 E689	V662-Q692 HydrophobicContact CG2-CB 4.39Å; A666-Q692 VanDerWaalsContact CB-O 3.28Å; A666-Q692 WeakPolarHBondContact CB-O 3.46Å; R670-Q692 VanDerWaalsContact CZ-O 3.29Å; R670-Q692 PolarHBondContact NH1-O 3.01Å; R670-Q692 PolarHBondContact NH2-O 3.21Å; S688-Q692 VanDerWaalsContact O-CG 3.3Å; S688-Q692 WeakPolarHBondContact O-CG 3.39Å; S688-Q692 PolarHBondContact O-N 3.03Å; E689-Q692 WeakPolarHBondContact O-CB 3.09Å; E689-Q692 PolarHBondContact O-N 2.96Å
693	I	88.2	Confident	77.2	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-76	-50.1	173.7	-66.8	165.8	0	0	0	111.8	T621 I625 V652 V662 R670 L676 A678 E689 L690 I691	T621-I693 HydrophobicContact CG2-CD1 3.98Å; I625-I693 HydrophobicContact CD1-CD1 4.33Å; I625-I693 HydrophobicContact CD1-CG1 3.9Å; I625-I693 HydrophobicContact CD1-CG2 4.08Å; V652-I693 HydrophobicContact CB-CG2 3.98Å; V652-I693 HydrophobicContact CG1-CG2 4.25Å; V652-I693 HydrophobicContact CG2-CG2 3.72Å; V662-I693 HydrophobicContact CB-CD1 4.36Å; V662-I693 HydrophobicContact CB-CG1 4.02Å; V662-I693 HydrophobicContact CG1-CD1 4.25Å; V662-I693 HydrophobicContact CG1-CG1 4.44Å; V662-I693 HydrophobicContact CG2-CD1 4.48Å; V662-I693 HydrophobicContact CG2-CG1 4.13Å; R670-I693 VanDerWaalsContact NH1-C 3.31Å; R670-I693 PolarHBondContact NH1-O 2.65Å; L676-I693 WeakPolarHBondContact CB-O 3.13Å; L676-I693 HydrophobicContact CD1-CG2 4.36Å; L676-I693 WeakPolarHBondContact CD1-O 3.3Å; A678-I693 HydrophobicContact CB-CB 4.22Å; A678-I693 HydrophobicContact CB-CG2 4.05Å; E689-I693 VanDerWaalsContact O-CG1 3.31Å; E689-I693 WeakPolarHBondContact O-CG1 3.39Å; E689-I693 PolarHBondContact O-N 3.48Å; L690-I693 HydrophobicContact CD2-CD1 4.49Å; L690-I693 PolarHBondContact O-N 3.15Å; I691-I693 PolarHBondContact O-N 3.13Å
694	A	86.9	Confident	77.6	Confident	3 Å²	3	44.4 Å²	44.4	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-80.1	-33.1	-173.8	0	0	0	0	0	115.2	L676 A678 L690 I691 S696 R699 V700	L676-A694 WeakPolarHBondContact O-CA 3.34Å; A678-A694 HydrophobicContact CB-CB 3.87Å; L690-A694 WeakPolarHBondContact O-CB 3.49Å; L690-A694 PolarHBondContact O-N 2.64Å; I691-A694 PolarHBondContact O-N 3.5Å; A694-S696 VanDerWaalsContact C-N 3.31Å; A694-S696 PolarHBondContact O-N 2.99Å; A694-R699 HydrophobicContact CB-CB 4.08Å; A694-V700 HydrophobicContact CB-CG2 3.43Å; A694-V700 VanDerWaalsContact CB-CG2 3.43Å
695	G	81.2	Confident	77.9	Confident	46 Å²	46	41.6 Å²	41.6	47%	0.474	21%	0.213	S	C	.	.	S	Bend	trans	86.5	-28.2	-177.3	0	0	0	0	0	115.4	I691	I691-G695 WeakPolarHBondContact O-CA 3.46Å; I691-G695 PolarHBondContact O-N 3.41Å
696	S	78	Confident	77.8	Confident	39 Å²	39	42.5 Å²	42.5	27%	0.273	22%	0.217	S	C	.	.	S	Bend	trans	-127.9	159.6	171.3	78.4	0	0	0	0	111.7	A694 R699 V700	A694-S696 VanDerWaalsContact C-N 3.31Å; A694-S696 PolarHBondContact O-N 2.99Å; S696-R699 WeakPolarHBondContact OG-CG 3.38Å; S696-V700 WeakPolarHBondContact O-CG2 3.02Å
697	R	73.4	Confident	77.1	Confident	196 Å²	196	41.7 Å²	41.7	74%	0.74	22%	0.215	S	C	*	.	S	Bend	trans	-71.5	-30.1	-179.3	-73.8	-176.4	174.5	-173.8	1	112.9	I691 R699 V700	I691-R697 HydrophobicContact CD1-CG 4.14Å; R697-R699 VanDerWaalsContact C-N 3.3Å; R697-R699 PolarHBondContact O-N 2.85Å; R697-V700 PolarHBondContact O-N 3.26Å
698	D	72.6	Confident	76.5	Confident	94 Å²	94	39.4 Å²	39.4	50%	0.503	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-22.4	-174.3	-43.5	-71.4	0	0	0	112.5	V700 E720	D698-V700 VanDerWaalsContact C-N 3.35Å; D698-E720 HydrophobicContact CB-CG 4.37Å
699	R	82.5	Confident	76	Confident	78 Å²	78	36.3 Å²	36.3	29%	0.294	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	3.7	175.7	-60.1	178.3	-177.6	-162.8	-3.4	113.4	S675 Y677 A678 A694 S696 R697	S675-R699 PolarHBondContact OG-NH1 2.04Å; Y677-R699 WeakPolarHBondContact CA-O 3.43Å; Y677-R699 HydrophobicContact CD1-CB 3.65Å; Y677-R699 HydrophobicContact CD1-CG 3.94Å; Y677-R699 HydrophobicContact CE1-CB 3.9Å; Y677-R699 HydrophobicContact CE1-CG 3.61Å; Y677-R699 HydrophobicContact CG-CB 4.44Å; A678-R699 PolarHBondContact N-O 2.82Å; A678-R699 VanDerWaalsContact N-O 3.09Å; A694-R699 HydrophobicContact CB-CB 4.08Å; S696-R699 WeakPolarHBondContact OG-CG 3.38Å; R697-R699 VanDerWaalsContact C-N 3.3Å; R697-R699 PolarHBondContact O-N 2.85Å
700	V	81.1	Confident	75.1	Confident	14 Å²	14	37.5 Å²	37.5	9%	0.085	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-99.4	97.8	176.7	174.1	0	0	0	0	108.5	A678 L690 I691 A694 S696 R697 D698 I702	A678-V700 HydrophobicContact CB-CG2 4.31Å; L690-V700 HydrophobicContact CB-CG1 3.91Å; L690-V700 HydrophobicContact CD1-CG1 4.46Å; I691-V700 HydrophobicContact CG1-CG2 3.85Å; A694-V700 HydrophobicContact CB-CG2 3.43Å; A694-V700 VanDerWaalsContact CB-CG2 3.43Å; S696-V700 WeakPolarHBondContact O-CG2 3.02Å; R697-V700 PolarHBondContact O-N 3.26Å; D698-V700 VanDerWaalsContact C-N 3.35Å; V700-I702 HydrophobicContact CG1-CB 4.35Å; V700-I702 HydrophobicContact CG1-CD1 3.25Å; V700-I702 HydrophobicContact CG1-CG1 3.54Å
701	F	79.9	Confident	73.6	Confident	18 Å²	18	41.8 Å²	41.8	8%	0.079	22%	0.218	C	C	.	.			trans	-85.5	122	175.9	-66.9	-68.7	0	0	0	109.8	Y677 A678 V679 L713 K716 I717 E720 S1616	Y677-F701 HydrophobicContact CD1-CD2 4.24Å; Y677-F701 AromaticContact CD1-CE2 3.64Å; Y677-F701 HydrophobicContact CD1-CE2 3.64Å; Y677-F701 HydrophobicContact CE1-CE2 4.1Å; A678-F701 PolarHBondContact O-N 3.32Å; V679-F701 HydrophobicContact CG2-CB 4.23Å; V679-F701 HydrophobicContact CG2-CD2 4.24Å; F701-L713 HydrophobicContact CB-CD1 3.54Å; F701-L713 HydrophobicContact CD1-CD1 3.61Å; F701-L713 HydrophobicContact CD2-CD1 4.35Å; F701-L713 HydrophobicContact CE1-CD1 4.49Å; F701-L713 HydrophobicContact CG-CD1 3.54Å; F701-K716 HydrophobicContact CD1-CB 4.37Å; F701-K716 HydrophobicContact CE1-CB 3.78Å; F701-I717 HydrophobicContact CD1-CG1 4.49Å; F701-I717 HydrophobicContact CD2-CD1 4.3Å; F701-I717 HydrophobicContact CD2-CG1 3.7Å; F701-I717 HydrophobicContact CE1-CG1 4.41Å; F701-I717 HydrophobicContact CE2-CB 4.26Å; F701-I717 HydrophobicContact CE2-CG1 3.57Å; F701-I717 HydrophobicContact CE2-CG2 4.5Å; F701-I717 HydrophobicContact CG-CG1 4.17Å; F701-I717 HydrophobicContact CZ-CB 4.47Å; F701-I717 HydrophobicContact CZ-CG1 3.96Å; F701-E720 HydrophobicContact CZ-CB 4.32Å; F701-S1616 CarbonylContact C-O 3.54Å; F701-S1616 VanDerWaalsContact C-O 3.29Å
702	I	75.2	Confident	72	Confident	15 Å²	15	47 Å²	47	8%	0.077	24%	0.235	C	C	.	.			trans	-147.7	102.2	-164.1	-87.7	-171.6	0	0	0	106.8	K687 L690 V700 S1616	K687-I702 HydrophobicContact CB-CD1 3.92Å; K687-I702 HydrophobicContact CD-CD1 3.74Å; K687-I702 HydrophobicContact CG-CD1 3.54Å; L690-I702 HydrophobicContact CD1-CD1 3.63Å; L690-I702 HydrophobicContact CD1-CG1 3.68Å; V700-I702 HydrophobicContact CG1-CB 4.35Å; V700-I702 HydrophobicContact CG1-CD1 3.25Å; V700-I702 HydrophobicContact CG1-CG1 3.54Å; I702-S1616 CarbonylContact C-O 3.34Å; I702-S1616 WeakPolarHBondContact CA-O 3.46Å; I702-S1616 PolarHBondContact N-O 2.03Å
703	V	73.2	Confident	71	Confident	5 Å²	5	43 Å²	43	3%	0.03	22%	0.216	C	C	.	.			trans	-156.8	134.6	-151.3	153.7	0	0	0	0	100.6	L713 E1614 S1615 S1616 S1617	V703-L713 HydrophobicContact CG1-CB 4.38Å; V703-E1614 HydrophobicContact CB-CB 3.77Å; V703-E1614 HydrophobicContact CB-CG 4.4Å; V703-E1614 HydrophobicContact CG1-CB 3.55Å; V703-E1614 HydrophobicContact CG1-CG 3.76Å; V703-E1614 WeakPolarHBondContact CG1-OE2 3.29Å; V703-E1614 HydrophobicContact CG2-CB 4.03Å; V703-E1614 HydrophobicContact CG2-CG 4.37Å; V703-E1614 WeakPolarHBondContact CG2-OE2 3.4Å; V703-S1615 CarbonylContact C-O 3.46Å; V703-S1615 CarbonylContact O-C 3.58Å; V703-S1616 WeakPolarHBondContact CB-O 3.44Å; V703-S1616 VanDerWaalsContact CG1-N 3.29Å; V703-S1616 PolarHBondContact N-O 3.49Å; V703-S1616 CarbonylContact O-C 3.53Å; V703-S1616 WeakPolarHBondContact O-CA 3.46Å; V703-S1616 PolarHBondContact O-N 3.04Å; V703-S1617 VanDerWaalsContact C-OG 3.25Å; V703-S1617 PolarHBondContact N-OG 2.74Å; V703-S1617 WeakPolarHBondContact O-CA 3.45Å; V703-S1617 WeakPolarHBondContact O-CB 3.43Å; V703-S1617 PolarHBondContact O-N 3.44Å; V703-S1617 PolarHBondContact O-OG 2.79Å
704	G	64.9	Low	69.7	Low	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.			trans	-127.3	98.6	-168.3	0	0	0	0	0	122.5	N683 E1614 S1615 Y1620	N683-G704 WeakPolarHBondContact OD1-CA 3.19Å; G704-E1614 VanDerWaalsContact C-C 3.44Å; G704-E1614 CarbonylContact C-O 3.55Å; G704-E1614 VanDerWaalsContact N-CA 3.33Å; G704-E1614 PolarHBondContact N-O 2.89Å; G704-S1615 CarbonylContact C-O 3.6Å; G704-S1615 VanDerWaalsContact CA-O 3.25Å; G704-S1615 WeakPolarHBondContact CA-O 3.44Å; G704-Y1620 WeakPolarHBondContact O-CD2 3.45Å; G704-Y1620 WeakPolarHBondContact O-CE2 3.41Å
705	S	65.6	Low	68.2	Low	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.255	C	S	.	.	S	Bend	trans	167.7	-156.8	-177.5	85.7	0	0	0	0	112.2	T682 T707 D708 E1614 S1615 Y1620	T682-S705 VanDerWaalsContact CA-O 3.28Å; T682-S705 WeakPolarHBondContact CA-O 3.28Å; T682-S705 WeakPolarHBondContact CG2-O 3.07Å; T682-S705 PolarHBondContact N-O 2.93Å; S705-T707 PolarHBondContact OG-N 3.24Å; S705-T707 PolarHBondContact OG-OG1 3.15Å; S705-D708 PolarHBondContact OG-N 3.44Å; S705-D708 VanDerWaalsContact OG-N 3.13Å; S705-D708 PolarHBondContact OG-OD2 3.4Å; S705-E1614 WeakPolarHBondContact CB-O 3.34Å; S705-E1614 PolarHBondContact N-O 3.24Å; S705-E1614 PolarHBondContact OG-O 3.19Å; S705-S1615 CarbonylContact C-O 3.22Å; S705-S1615 VanDerWaalsContact N-C 3.32Å; S705-S1615 PolarHBondContact N-O 3.38Å; S705-S1615 CarbonylContact O-C 3.58Å; S705-S1615 PolarHBondContact O-OG 3.33Å; S705-S1615 WeakPolarHBondContact OG-CA 3.46Å; S705-S1615 WeakPolarHBondContact OG-CB 3.09Å; S705-Y1620 WeakPolarHBondContact CA-OH 3.28Å
706	F	66.9	Low	67.3	Low	19 Å²	19	51.3 Å²	51.3	8%	0.083	25%	0.249	C	C	.	.	S	Bend	trans	-128.8	-25.7	163.6	-93.7	-67.7	0	0	0	112	I552 I556 Y560 V561 V681 T682 L709 S1615 K1621	I552-F706 HydrophobicContact CG2-CZ 4.15Å; I556-F706 HydrophobicContact CB-CE2 4.4Å; I556-F706 HydrophobicContact CD1-CD2 4.32Å; I556-F706 HydrophobicContact CD1-CE2 4.17Å; I556-F706 HydrophobicContact CG2-CD1 3.82Å; I556-F706 HydrophobicContact CG2-CD2 3.4Å; I556-F706 VanDerWaalsContact CG2-CD2 3.4Å; I556-F706 HydrophobicContact CG2-CE1 3.49Å; I556-F706 VanDerWaalsContact CG2-CE1 3.49Å; I556-F706 HydrophobicContact CG2-CE2 3.06Å; I556-F706 HydrophobicContact CG2-CG 3.79Å; I556-F706 HydrophobicContact CG2-CZ 3.11Å; Y560-F706 HydrophobicContact CD1-CB 3.96Å; Y560-F706 WeakPolarHBondContact CD1-O 3.47Å; Y560-F706 HydrophobicContact CD2-CB 3.85Å; Y560-F706 HydrophobicContact CD2-CG 4.32Å; Y560-F706 HydrophobicContact CE1-CB 4.48Å; Y560-F706 HydrophobicContact CE2-CB 4.41Å; Y560-F706 HydrophobicContact CG-CB 3.62Å; Y560-F706 HydrophobicContact CG-CD1 4.45Å; Y560-F706 HydrophobicContact CG-CG 4.31Å; V561-F706 HydrophobicContact CG2-CD1 4.21Å; V561-F706 HydrophobicContact CG2-CE1 3.55Å; V561-F706 HydrophobicContact CG2-CZ 4.46Å; V681-F706 HydrophobicContact CB-CE1 4.05Å; V681-F706 HydrophobicContact CG1-CD1 3.45Å; V681-F706 VanDerWaalsContact CG1-CD1 3.45Å; V681-F706 HydrophobicContact CG1-CE1 3.21Å; V681-F706 HydrophobicContact CG1-CG 4.37Å; V681-F706 HydrophobicContact CG1-CZ 3.97Å; T682-F706 HydrophobicContact CG2-CD1 4.37Å; T682-F706 HydrophobicContact CG2-CD2 3.03Å; T682-F706 HydrophobicContact CG2-CE1 4.38Å; T682-F706 HydrophobicContact CG2-CE2 3.02Å; T682-F706 HydrophobicContact CG2-CG 3.75Å; T682-F706 HydrophobicContact CG2-CZ 3.76Å; F706-L709 WeakPolarHBondContact O-CB 3.48Å; F706-S1615 WeakPolarHBondContact CA-OG 3.44Å; F706-K1621 HydrophobicContact CE2-CD 4.12Å; F706-K1621 HydrophobicContact CZ-CD 4.25Å
707	T	58.3	Low	66.6	Low	55 Å²	55	49.5 Å²	49.5	34%	0.337	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-61	-47.3	174.7	28.8	0	0	0	0	113.3	Y560 S705 L709 R1650	Y560-T707 HydrophobicContact CE1-CG2 3.78Å; S705-T707 PolarHBondContact OG-N 3.24Å; S705-T707 PolarHBondContact OG-OG1 3.15Å; T707-L709 PolarHBondContact O-N 3Å; T707-L709 VanDerWaalsContact O-N 3.15Å; T707-R1650 PolarHBondContact OG1-O 3Å; T707-R1650 VanDerWaalsContact OG1-O 3.04Å
708	D	64.3	Low	66	Low	36 Å²	36	44.1 Å²	44.1	19%	0.193	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-81.5	9.4	-172	-60.4	-81.1	0	0	0	114.1	S705 N710 T711 E1614	S705-D708 PolarHBondContact OG-N 3.44Å; S705-D708 VanDerWaalsContact OG-N 3.13Å; S705-D708 PolarHBondContact OG-OD2 3.4Å; D708-N710 PolarHBondContact O-N 2.82Å; D708-N710 VanDerWaalsContact O-N 3.12Å; D708-T711 VanDerWaalsContact CA-OG1 3.28Å; D708-T711 WeakPolarHBondContact CA-OG1 3.46Å; D708-T711 WeakPolarHBondContact CB-OG1 3.5Å; D708-T711 PolarHBondContact O-N 2.03Å; D708-T711 PolarHBondContact O-OG1 2.78Å; D708-T711 VanDerWaalsContact O-OG1 3.09Å; D708-T711 PolarHBondContact OD1-OG1 3.06Å; D708-E1614 HydrophobicContact CB-CG 4.31Å; D708-E1614 WeakPolarHBondContact CB-O 3.32Å
709	L	67.6	Low	65.3	Low	1 Å²	1	47.9 Å²	47.9	1%	0.005	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-63.7	-23.5	-177.1	-158	50.5	0	0	0	111	F564 V681 F706 T707 L713 S1615	F564-L709 HydrophobicContact CB-CB 4.29Å; F564-L709 HydrophobicContact CB-CD2 3.4Å; F564-L709 VanDerWaalsContact CB-CD2 3.4Å; F564-L709 HydrophobicContact CB-CG 3.59Å; F564-L709 HydrophobicContact CD1-CD2 3.96Å; F564-L709 HydrophobicContact CD1-CG 4.05Å; F564-L709 HydrophobicContact CD2-CB 4.46Å; F564-L709 HydrophobicContact CD2-CD1 4.37Å; F564-L709 HydrophobicContact CD2-CD2 4.35Å; F564-L709 HydrophobicContact CD2-CG 3.66Å; F564-L709 WeakPolarHBondContact CD2-O 3.47Å; F564-L709 HydrophobicContact CE2-CG 4.32Å; F564-L709 HydrophobicContact CG-CD1 4.34Å; F564-L709 HydrophobicContact CG-CD2 3.66Å; F564-L709 HydrophobicContact CG-CG 3.49Å; F564-L709 VanDerWaalsContact CG-CG 3.49Å; V681-L709 HydrophobicContact CG1-CD2 4.26Å; F706-L709 WeakPolarHBondContact O-CB 3.48Å; T707-L709 PolarHBondContact O-N 3Å; T707-L709 VanDerWaalsContact O-N 3.15Å; L709-L713 HydrophobicContact CD1-CD2 3.65Å; L709-S1615 VanDerWaalsContact CA-CB 3.47Å; L709-S1615 WeakPolarHBondContact CB-OG 3.05Å; L709-S1615 PolarHBondContact N-OG 3.44Å
710	N	61.6	Low	64.2	Low	36 Å²	36	46.1 Å²	46.1	19%	0.193	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-15.4	-178.2	-56.4	5.9	0	0	0	112.9	R563 E567 D708	R563-N710 PolarHBondContact NE-ND2 2.87Å; E567-N710 PolarHBondContact OE1-ND2 2.99Å; E567-N710 PolarHBondContact OE2-ND2 2.98Å; D708-N710 PolarHBondContact O-N 2.82Å; D708-N710 VanDerWaalsContact O-N 3.12Å
711	T	54.9	Low	63.2	Low	90 Å²	90	47.4 Å²	47.4	55%	0.552	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-33.2	-172.2	53.6	0	0	0	0	114	D708	D708-T711 VanDerWaalsContact CA-OG1 3.28Å; D708-T711 WeakPolarHBondContact CA-OG1 3.46Å; D708-T711 WeakPolarHBondContact CB-OG1 3.5Å; D708-T711 PolarHBondContact O-N 2.03Å; D708-T711 PolarHBondContact O-OG1 2.78Å; D708-T711 VanDerWaalsContact O-OG1 3.09Å; D708-T711 PolarHBondContact OD1-OG1 3.06Å
712	R	53	Low	62	Low	158 Å²	158	48.8 Å²	48.8	60%	0.596	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-139	-29.7	-176.4	-75.7	-179.1	175.9	165.2	1.3	115.8	R714 E1614	R712-R714 VanDerWaalsContact C-N 3.33Å; R712-R714 PolarHBondContact O-N 3.23Å; R712-E1614 VanDerWaalsContact CB-CD 3.42Å; R712-E1614 HydrophobicContact CB-CG 4.12Å; R712-E1614 VanDerWaalsContact CB-OE2 3.28Å; R712-E1614 WeakPolarHBondContact CB-OE2 3.07Å; R712-E1614 WeakPolarHBondContact CD-OE1 3.17Å; R712-E1614 IonicContact NH1-OE1 2.64Å
713	L	61.7	Low	60.4	Low	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-39.3	-174.2	-179	60	0	0	0	113.1	F564 V679 F701 V703 L709 A715 K716 I717	F564-L713 HydrophobicContact CE2-CD2 4.01Å; F564-L713 HydrophobicContact CZ-CD2 3.91Å; V679-L713 HydrophobicContact CG1-CD2 3.9Å; F701-L713 HydrophobicContact CB-CD1 3.54Å; F701-L713 HydrophobicContact CD1-CD1 3.61Å; F701-L713 HydrophobicContact CD2-CD1 4.35Å; F701-L713 HydrophobicContact CE1-CD1 4.49Å; F701-L713 HydrophobicContact CG-CD1 3.54Å; V703-L713 HydrophobicContact CG1-CB 4.38Å; L709-L713 HydrophobicContact CD1-CD2 3.65Å; L713-A715 VanDerWaalsContact C-N 3.33Å; L713-A715 PolarHBondContact O-N 2.78Å; L713-K716 PolarHBondContact O-N 2.86Å; L713-K716 VanDerWaalsContact O-N 3.07Å; L713-I717 HydrophobicContact CD1-CD1 3.79Å; L713-I717 HydrophobicContact CD1-CG1 3.78Å; L713-I717 HydrophobicContact CD2-CD1 4Å; L713-I717 HydrophobicContact CG-CD1 3.62Å; L713-I717 HydrophobicContact CG-CG1 4.05Å; L713-I717 PolarHBondContact O-N 2.92Å; L713-I717 VanDerWaalsContact O-N 3.1Å
714	R	60.3	Low	58.8	Low	76 Å²	76	61.5 Å²	61.5	29%	0.287	31%	0.305	S	S	.	.	H	α-helix	trans	-49.4	-48.1	-177.1	-172.8	176.6	176.9	153.3	5	113.1	T570 L571 R712 Q718	T570-R714 PolarHBondContact OG1-NH2 3.36Å; L571-R714 HydrophobicContact CD1-CG 3.72Å; L571-R714 HydrophobicContact CD2-CG 4.32Å; L571-R714 HydrophobicContact CG-CG 4.18Å; R712-R714 VanDerWaalsContact C-N 3.33Å; R712-R714 PolarHBondContact O-N 3.23Å; R714-Q718 PolarHBondContact O-N 3.48Å
715	A	56.4	Low	57.2	Low	66 Å²	66	70.4 Å²	70.4	55%	0.545	35%	0.346	S	S	.	.	H	α-helix	trans	-74.8	-32.4	-179.5	0	0	0	0	0	113.3	L713 K719	L713-A715 VanDerWaalsContact C-N 3.33Å; L713-A715 PolarHBondContact O-N 2.78Å; A715-K719 PolarHBondContact O-N 2.67Å
716	K	62	Low	55.8	Low	82 Å²	82	77 Å²	77	36%	0.357	39%	0.387	S	S	.	.	H	α-helix	trans	-66.9	-47.4	178.5	-65.5	176.4	-174.4	163.5	0	111.8	F701 L713 Q718 K719 E720 E1614	F701-K716 HydrophobicContact CD1-CB 4.37Å; F701-K716 HydrophobicContact CE1-CB 3.78Å; L713-K716 PolarHBondContact O-N 2.86Å; L713-K716 VanDerWaalsContact O-N 3.07Å; K716-Q718 VanDerWaalsContact C-N 3.32Å; K716-Q718 PolarHBondContact O-N 3.36Å; K716-K719 PolarHBondContact O-N 3.22Å; K716-E720 PolarHBondContact O-N 3.28Å; K716-E720 VanDerWaalsContact O-N 3.1Å; K716-E1614 IonicContact NZ-OE1 3.35Å; K716-E1614 PolarHBondContact NZ-OE1 2.84Å; K716-E1614 IonicContact NZ-OE2 2.67Å; K716-E1614 PolarHBondContact NZ-OE2 2.8Å
717	I	64.2	Low	54.3	Low	1 Å²	1	83 Å²	83	1%	0.005	42%	0.424	C	S	.	.	H	α-helix	trans	-61.3	-45	177.8	-59.3	174.4	0	0	0	109.7	F564 F568 F701 L713 K719 E720 M721	F564-I717 HydrophobicContact CZ-CD1 4.28Å; F568-I717 HydrophobicContact CD2-CD1 4.48Å; F568-I717 HydrophobicContact CE2-CB 4Å; F568-I717 HydrophobicContact CE2-CD1 3.7Å; F568-I717 HydrophobicContact CE2-CG1 4.41Å; F568-I717 HydrophobicContact CE2-CG2 3.97Å; F568-I717 HydrophobicContact CZ-CB 4.29Å; F568-I717 HydrophobicContact CZ-CD1 4.26Å; F568-I717 HydrophobicContact CZ-CG2 3.74Å; F701-I717 HydrophobicContact CD1-CG1 4.49Å; F701-I717 HydrophobicContact CD2-CD1 4.3Å; F701-I717 HydrophobicContact CD2-CG1 3.7Å; F701-I717 HydrophobicContact CE1-CG1 4.41Å; F701-I717 HydrophobicContact CE2-CB 4.26Å; F701-I717 HydrophobicContact CE2-CG1 3.57Å; F701-I717 HydrophobicContact CE2-CG2 4.5Å; F701-I717 HydrophobicContact CG-CG1 4.17Å; F701-I717 HydrophobicContact CZ-CB 4.47Å; F701-I717 HydrophobicContact CZ-CG1 3.96Å; L713-I717 HydrophobicContact CD1-CD1 3.79Å; L713-I717 HydrophobicContact CD1-CG1 3.78Å; L713-I717 HydrophobicContact CD2-CD1 4Å; L713-I717 HydrophobicContact CG-CD1 3.62Å; L713-I717 HydrophobicContact CG-CG1 4.05Å; L713-I717 PolarHBondContact O-N 2.92Å; L713-I717 VanDerWaalsContact O-N 3.1Å; I717-K719 PolarHBondContact O-N 3.06Å; I717-E720 PolarHBondContact O-N 2.92Å; I717-M721 HydrophobicContact CG2-CG 4.37Å; I717-M721 HydrophobicContact CG2-SD 3.82Å; I717-M721 WeakPolarHBondContact O-CG 3.25Å; I717-M721 PolarHBondContact O-N 3.32Å; I717-M721 VanDerWaalsContact O-N 3.08Å
718	Q	60	Low	53	Low	83 Å²	83	87.8 Å²	87.8	39%	0.388	45%	0.448	S	S	.	.	H	α-helix	trans	-59.5	-43	177.8	-173.7	177.3	-6.9	0	0	112.5	R714 K716 M721 C722	R714-Q718 PolarHBondContact O-N 3.48Å; K716-Q718 VanDerWaalsContact C-N 3.32Å; K716-Q718 PolarHBondContact O-N 3.36Å; Q718-M721 PolarHBondContact O-N 2.87Å; Q718-C722 PolarHBondContact O-SG 3.47Å
719	K	57.8	Low	51.6	Low	172 Å²	172	93.1 Å²	93.1	75%	0.748	48%	0.482	S	S	*	.	H	α-helix	trans	-64.3	-42.8	177.5	-177.2	169.8	-179.1	169.8	0	112.6	A715 K716 I717 M721 C722	A715-K719 PolarHBondContact O-N 2.67Å; K716-K719 PolarHBondContact O-N 3.22Å; I717-K719 PolarHBondContact O-N 3.06Å; K719-M721 VanDerWaalsContact C-N 3.28Å; K719-M721 PolarHBondContact O-N 2.55Å; K719-C722 PolarHBondContact O-N 2.87Å
720	E	58.6	Low	50	Low	41 Å²	41	102.4 Å²	102.4	19%	0.192	53%	0.525	C	S	.	.	H	α-helix	trans	-74.4	-19	-177.6	-165.8	56.8	-153.2	0	0	113	D698 F701 K716 I717 C722 K723	D698-E720 HydrophobicContact CB-CG 4.37Å; F701-E720 HydrophobicContact CZ-CB 4.32Å; K716-E720 PolarHBondContact O-N 3.28Å; K716-E720 VanDerWaalsContact O-N 3.1Å; I717-E720 PolarHBondContact O-N 2.92Å; E720-C722 PolarHBondContact O-N 2.03Å; E720-K723 IonicContact OE1-NZ 2.7Å; E720-K723 PolarHBondContact OE1-NZ 3.32Å; E720-K723 WeakPolarHBondContact OE2-CE 3.39Å; E720-K723 IonicContact OE2-NZ 2.89Å; E720-K723 PolarHBondContact OE2-NZ 2.89Å
721	M	61.3	Low	48.8	Very low	42 Å²	42	112.3 Å²	112.3	21%	0.207	56%	0.56	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77	-0.9	171	-75.2	179	53.5	0	0	114.5	F572 I649 Y677 I717 Q718 K719	F572-M721 HydrophobicContact CE1-CE 3.58Å; F572-M721 HydrophobicContact CZ-CE 3.6Å; F572-M721 HydrophobicContact CZ-SD 4.08Å; I649-M721 HydrophobicContact CD1-CE 3.39Å; I649-M721 HydrophobicContact CD1-CG 4.44Å; I649-M721 HydrophobicContact CD1-SD 4.04Å; Y677-M721 HydrophobicContact CE2-CG 4.41Å; Y677-M721 WeakPolarHBondContact OH-CG 3.45Å; I717-M721 HydrophobicContact CG2-CG 4.37Å; I717-M721 HydrophobicContact CG2-SD 3.82Å; I717-M721 WeakPolarHBondContact O-CG 3.25Å; I717-M721 PolarHBondContact O-N 3.32Å; I717-M721 VanDerWaalsContact O-N 3.08Å; Q718-M721 PolarHBondContact O-N 2.87Å; K719-M721 VanDerWaalsContact C-N 3.28Å; K719-M721 PolarHBondContact O-N 2.55Å
722	C	54.1	Low	47.9	Very low	47 Å²	47	114.3 Å²	114.3	32%	0.318	57%	0.574	S	S	.	*			trans	-131.4	38.4	-165.6	-66.5	0	0	0	0	114.4	C535 Q718 K719 E720	C535-C722 HydrophobicContact CB-CB 3.87Å; C535-C722 WeakPolarHBondContact CB-SG 3.43Å; C535-C722 WeakPolarHBondContact SG-CB 3.32Å; C535-C722 CovalentContact SG-SG 2.03Å; C535-C722 PolarHBondContact SG-SG 2.61Å; Q718-C722 PolarHBondContact O-SG 3.47Å; K719-C722 PolarHBondContact O-N 2.87Å; E720-C722 PolarHBondContact O-N 2.03Å
723	K	42.3	Very low	47.4	Very low	137 Å²	137	111.8 Å²	111.8	60%	0.596	59%	0.587	S	S	*	*			trans	-93	149.8	170.4	-70.7	175	-179.3	164.5	0	111.3	E720	E720-K723 IonicContact OE1-NZ 2.7Å; E720-K723 PolarHBondContact OE1-NZ 3.32Å; E720-K723 WeakPolarHBondContact OE2-CE 3.39Å; E720-K723 IonicContact OE2-NZ 2.89Å; E720-K723 PolarHBondContact OE2-NZ 2.89Å
724	D	39.2	Very low	46.7	Very low	149 Å²	149	119.8 Å²	119.8	80%	0.797	63%	0.625	S	S	*	*			trans	-141.5	151.1	-176.2	-146.8	-10.4	0	0	0	109.5
725	E	31.1	Very low	46.1	Very low	187 Å²	187	124.1 Å²	124.1	87%	0.874	65%	0.646	S	S	*	*			trans	-122.3	120.2	-166.8	-64.5	-176.2	162.6	0	0	113.2
726	T	36.2	Very low	46	Very low	140 Å²	140	121.8 Å²	121.8	86%	0.859	63%	0.625	S	S	*	*			trans	-148.7	171.2	-178.4	47.9	0	0	0	0	114
727	V	34.8	Very low	45.5	Very low	143 Å²	143	120 Å²	120	87%	0.867	63%	0.626	S	S	*	*			trans	-143.7	151.7	-158.9	-178.7	0	0	0	0	114.3
728	D	32.6	Very low	45	Very low	157 Å²	157	125 Å²	125	84%	0.84	66%	0.656	S	S	*	*			trans	-90.2	153.1	-170.3	-53.3	-76.9	0	0	0	118.8
729	V	35.2	Very low	44.2	Very low	148 Å²	148	124.5 Å²	124.5	90%	0.897	66%	0.662	S	S	*	*			trans	-154.8	152	171.5	-172	0	0	0	0	113.7
730	E	32.5	Very low	43.8	Very low	196 Å²	196	126 Å²	126	92%	0.916	67%	0.672	S	S	*	*			trans	-104.9	177.7	-176.3	-64.9	-173.7	107.2	0	0	117.7
731	R	36.5	Very low	43.3	Very low	244 Å²	244	129.4 Å²	129.4	92%	0.921	70%	0.696	S	S	*	*			trans	-153.4	154.6	-178	-148.3	172.1	-166.4	-148.8	3.8	117.1
732	P	37.5	Very low	42	Very low	131 Å²	131	132.9 Å²	132.9	85%	0.851	72%	0.715	S	S	*	*			trans	-101.2	-173.1	-170.8	-1.6	25.1	0	0	0	118.7
733	A	41.6	Very low	41.5	Very low	106 Å²	106	137.6 Å²	137.6	88%	0.876	74%	0.736	S	S	*	*			trans	-118.2	178.8	-163.2	0	0	0	0	0	118.3
734	Q	47.2	Very low	41.6	Very low	167 Å²	167	140.7 Å²	140.7	78%	0.78	75%	0.752	S	S	*	*			trans	-136	169.7	-156.8	-165.1	166.6	-7.5	0	0	115.5
735	K	46.4	Very low	41.7	Very low	167 Å²	167	136.1 Å²	136.1	73%	0.726	73%	0.732	S	S	*	*	B	Isolated β-bridge	trans	-121.5	166.1	-172.3	-65.5	-174.1	178.4	-176.7	0	114.5	T759	K735-T759 HydrophobicContact CG-CG2 4.03Å
736	C	55.5	Low	42.7	Very low	17 Å²	17	133 Å²	133	12%	0.115	72%	0.719	C	S	.	*			trans	-147.6	-177.1	179.3	58.2	0	0	0	0	113.1	C755 G758 T759	C736-C755 HydrophobicContact CB-CB 3.93Å; C736-C755 WeakPolarHBondContact CB-SG 3.36Å; C736-C755 WeakPolarHBondContact SG-CA 3.34Å; C736-C755 WeakPolarHBondContact SG-CB 3.44Å; C736-C755 CovalentContact SG-SG 2.03Å; C736-C755 PolarHBondContact SG-SG 2.9Å; C736-G758 PolarHBondContact N-O 3.32Å; C736-G758 CarbonylContact O-C 3.57Å; C736-G758 VanDerWaalsContact O-CA 3.23Å; C736-G758 WeakPolarHBondContact O-CA 3.01Å; C736-G758 VanDerWaalsContact O-O 3.09Å; C736-T759 VanDerWaalsContact SG-CA 3.57Å; C736-T759 PolarHBondContact SG-N 3.1Å
737	A	51.1	Low	44	Very low	45 Å²	45	127 Å²	127	37%	0.372	68%	0.683	S	S	.	*			trans	-119.4	158.9	-176.4	0	0	0	0	0	114.4	C755	A737-C755 PolarHBondContact O-SG 3.17Å
738	T	54.7	Low	45.6	Very low	105 Å²	105	123.1 Å²	123.1	64%	0.644	66%	0.657	S	S	*	*			trans	-131.8	45.4	-172.9	65.3	0	0	0	0	113.6
739	S	41.5	Very low	47.1	Very low	73 Å²	73	122.8 Å²	122.8	51%	0.51	64%	0.644	S	S	.	*	S	Bend	trans	-138.2	137.2	176.6	-173	0	0	0	0	110.2	T741	S739-T741 PolarHBondContact O-N 3.01Å
740	E	49.9	Very low	48.5	Very low	203 Å²	203	120 Å²	120	95%	0.949	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	16.7	-166.2	-60.7	-175.5	126.2	0	0	115.4
741	T	47.7	Very low	50.2	Low	114 Å²	114	115.6 Å²	115.6	70%	0.699	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.7	-7.2	-177.4	56.4	0	0	0	0	115.3	S739	S739-T741 PolarHBondContact O-N 3.01Å
742	D	34.7	Very low	51.7	Low	114 Å²	114	104.3 Å²	104.3	61%	0.61	56%	0.564	S	S	*	*			trans	-112	101.4	179	-65.5	-41.8	0	0	0	110.6
743	I	44.5	Very low	53.6	Low	146 Å²	146	98.9 Å²	98.9	75%	0.749	53%	0.527	S	S	*	.			trans	-86.5	-17.8	-169.7	-66.8	176.8	0	0	0	113.3	S745	I743-S745 PolarHBondContact O-N 2.75Å
744	E	43.4	Very low	54.9	Low	203 Å²	203	95.1 Å²	95.1	95%	0.949	49%	0.493	S	S	*	.	S	Bend	trans	-79.3	22.9	-172.7	-60.8	-169.4	130	0	0	115.3
745	S	42.1	Very low	55.9	Low	52 Å²	52	89.3 Å²	89.3	36%	0.364	47%	0.47	S	S	.	.			trans	-146.7	56.3	178.3	-153.5	0	0	0	0	114.2	I743	I743-S745 PolarHBondContact O-N 2.75Å
746	M	52.1	Low	56.7	Low	123 Å²	123	84.1 Å²	84.1	61%	0.606	45%	0.453	S	S	*	.			trans	-81.1	149.4	169.2	-71.9	-157.6	74	0	0	112.7	R749	M746-R749 PolarHBondContact SD-NH2 2.83Å
747	C	62.9	Low	56.7	Low	14 Å²	14	92.2 Å²	92.2	10%	0.095	49%	0.488	C	S	.	.			trans	-81.8	163.5	171.4	-61.4	0	0	0	0	112.8	R749 E753 C760	C747-R749 PolarHBondContact O-N 3.11Å; C747-R749 VanDerWaalsContact O-N 3.15Å; C747-E753 HydrophobicContact CB-CB 3.94Å; C747-E753 WeakPolarHBondContact CB-O 3.43Å; C747-C760 WeakPolarHBondContact CA-SG 3.03Å; C747-C760 HydrophobicContact CB-CB 3.73Å; C747-C760 WeakPolarHBondContact CB-SG 3.04Å; C747-C760 WeakPolarHBondContact SG-CA 3.4Å; C747-C760 WeakPolarHBondContact SG-CB 3.29Å; C747-C760 CovalentContact SG-SG 2.04Å; C747-C760 PolarHBondContact SG-SG 3.2Å
748	D	68.1	Low	56.9	Low	60 Å²	60	90.9 Å²	90.9	32%	0.321	48%	0.479	S	S	.	.			trans	-71.5	105.5	-173	-175.9	-0.5	0	0	0	112.6	S750 R751 N752 E753	D748-S750 VanDerWaalsContact C-N 3.27Å; D748-S750 VanDerWaalsContact CG-OG 3.25Å; D748-S750 PolarHBondContact O-N 3.33Å; D748-S750 VanDerWaalsContact OD1-CB 3.32Å; D748-S750 WeakPolarHBondContact OD1-CB 3.49Å; D748-S750 PolarHBondContact OD1-N 3.34Å; D748-S750 PolarHBondContact OD1-OG 3.48Å; D748-S750 PolarHBondContact OD2-OG 2.88Å; D748-R751 HydrophobicContact CB-CB 4.44Å; D748-R751 PolarHBondContact O-N 3.18Å; D748-R751 WeakPolarHBondContact OD2-CD 3.5Å; D748-N752 PolarHBondContact O-N 3.31Å; D748-E753 PolarHBondContact O-N 2.83Å; D748-E753 VanDerWaalsContact O-N 3.1Å
749	R	64.4	Low	57.2	Low	151 Å²	151	89.2 Å²	89.2	57%	0.57	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-62.8	-31.6	176.6	-59.6	-173	-167.6	178.9	3.7	112.5	M746 C747 R751 N752 Y799	M746-R749 PolarHBondContact SD-NH2 2.83Å; C747-R749 PolarHBondContact O-N 3.11Å; C747-R749 VanDerWaalsContact O-N 3.15Å; R749-R751 PolarHBondContact O-N 3.17Å; R749-N752 PolarHBondContact O-N 3.1Å; R749-Y799 HydrophobicContact CG-CE1 4.37Å
750	S	64.5	Low	58.6	Low	89 Å²	89	87.4 Å²	87.4	62%	0.622	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-65.2	-23.3	179.9	75.4	0	0	0	0	112.4	D748	D748-S750 VanDerWaalsContact C-N 3.27Å; D748-S750 VanDerWaalsContact CG-OG 3.25Å; D748-S750 PolarHBondContact O-N 3.33Å; D748-S750 VanDerWaalsContact OD1-CB 3.32Å; D748-S750 WeakPolarHBondContact OD1-CB 3.49Å; D748-S750 PolarHBondContact OD1-N 3.34Å; D748-S750 PolarHBondContact OD1-OG 3.48Å; D748-S750 PolarHBondContact OD2-OG 2.88Å
751	R	67.5	Low	59.7	Low	103 Å²	103	78.6 Å²	78.6	39%	0.389	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-99	4.3	175.3	-73.9	-179.9	158.8	143.3	-3.5	114.5	D748 R749 E753 T772 G773 E774 C775	D748-R751 HydrophobicContact CB-CB 4.44Å; D748-R751 PolarHBondContact O-N 3.18Å; D748-R751 WeakPolarHBondContact OD2-CD 3.5Å; R749-R751 PolarHBondContact O-N 3.17Å; R751-E753 HydrophobicContact CB-CG 3.97Å; R751-E753 PolarHBondContact O-N 2.77Å; R751-T772 PolarHBondContact NE-O 3.01Å; R751-T772 PolarHBondContact NH2-O 2.8Å; R751-T772 VanDerWaalsContact NH2-O 3.07Å; R751-G773 WeakPolarHBondContact CD-O 3.2Å; R751-E774 HydrophobicContact CG-CG 4.34Å; R751-C775 WeakPolarHBondContact O-CB 3.3Å; R751-C775 PolarHBondContact O-N 3.32Å
752	N	68.7	Low	61.1	Low	8 Å²	8	74.6 Å²	74.6	4%	0.043	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	31.3	-171	-66.1	-50.6	0	0	0	113.7	D748 R749 C775 Y799 R803	D748-N752 PolarHBondContact O-N 3.31Å; R749-N752 PolarHBondContact O-N 3.1Å; N752-C775 HydrophobicContact CB-CB 4.01Å; N752-Y799 WeakPolarHBondContact OD1-CD2 3.47Å; N752-R803 WeakPolarHBondContact ND2-CD 3.11Å; N752-R803 PolarHBondContact ND2-NE 2.8Å
753	E	76.6	Confident	63	Low	17 Å²	17	70 Å²	70	8%	0.079	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	138.7	176.7	-66.8	-166.7	155.1	0	0	112.4	C747 D748 R751 C760 G761 K768	C747-E753 HydrophobicContact CB-CB 3.94Å; C747-E753 WeakPolarHBondContact CB-O 3.43Å; D748-E753 PolarHBondContact O-N 2.83Å; D748-E753 VanDerWaalsContact O-N 3.1Å; R751-E753 HydrophobicContact CB-CG 3.97Å; R751-E753 PolarHBondContact O-N 2.77Å; E753-C760 HydrophobicContact CB-CB 4.48Å; E753-C760 WeakPolarHBondContact OE2-CB 3.43Å; E753-G761 WeakPolarHBondContact CA-O 3.29Å; E753-K768 VanDerWaalsContact OE1-CE 3.26Å; E753-K768 WeakPolarHBondContact OE1-CE 3.19Å; E753-K768 IonicContact OE1-NZ 2.67Å; E753-K768 PolarHBondContact OE1-NZ 3.37Å
754	V	68.7	Low	64	Low	27 Å²	27	67.9 Å²	67.9	16%	0.164	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	158.5	175.1	-58.7	0	0	0	0	110	V756 G761 I798	V754-V756 HydrophobicContact CG2-CG2 3.84Å; V754-V756 PolarHBondContact O-N 2.88Å; V754-G761 PolarHBondContact N-O 3.29Å; V754-G761 PolarHBondContact O-N 2.94Å; V754-G761 VanDerWaalsContact O-N 3.08Å; V754-G761 VanDerWaalsContact O-O 3.06Å; V754-I798 HydrophobicContact CG1-CD1 3.6Å; V754-I798 HydrophobicContact CG1-CG1 4.39Å
755	C	69.5	Low	65.1	Low	45 Å²	45	59.3 Å²	59.3	30%	0.304	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	103.7	177.8	-167.6	0	0	0	0	110.7	C736 A737	C736-C755 HydrophobicContact CB-CB 3.93Å; C736-C755 WeakPolarHBondContact CB-SG 3.36Å; C736-C755 WeakPolarHBondContact SG-CA 3.34Å; C736-C755 WeakPolarHBondContact SG-CB 3.44Å; C736-C755 CovalentContact SG-SG 2.03Å; C736-C755 PolarHBondContact SG-SG 2.9Å; A737-C755 PolarHBondContact O-SG 3.17Å
756	V	62.3	Low	66.9	Low	58 Å²	58	57.6 Å²	57.6	35%	0.352	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	111.9	176.4	-170.3	0	0	0	0	108.6	V754 G758 T759	V754-V756 HydrophobicContact CG2-CG2 3.84Å; V754-V756 PolarHBondContact O-N 2.88Å; V756-G758 PolarHBondContact O-N 2.75Å; V756-G758 VanDerWaalsContact O-N 3.08Å; V756-T759 PolarHBondContact N-O 3.36Å; V756-T759 PolarHBondContact O-N 3.19Å; V756-T759 VanDerWaalsContact O-O 3.14Å; V756-T759 PolarHBondContact O-OG1 2.94Å; V756-T759 VanDerWaalsContact O-OG1 3.07Å
757	H	56.6	Low	67.9	Low	186 Å²	186	52.3 Å²	52.3	86%	0.861	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	33.5	178.5	-54.9	145.6	0	0	0	115.1
758	G	55.8	Low	68.2	Low	18 Å²	18	55.5 Å²	55.5	19%	0.186	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	13.8	-179.8	0	0	0	0	0	115.4	C736 V756	C736-G758 PolarHBondContact N-O 3.32Å; C736-G758 CarbonylContact O-C 3.57Å; C736-G758 VanDerWaalsContact O-CA 3.23Å; C736-G758 WeakPolarHBondContact O-CA 3.01Å; C736-G758 VanDerWaalsContact O-O 3.09Å; V756-G758 PolarHBondContact O-N 2.75Å; V756-G758 VanDerWaalsContact O-N 3.08Å
759	T	59.8	Low	68	Low	70 Å²	70	55 Å²	55	43%	0.429	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142	171.4	29.7	0	0	0	0	111.7	K735 C736 V756	K735-T759 HydrophobicContact CG-CG2 4.03Å; C736-T759 VanDerWaalsContact SG-CA 3.57Å; C736-T759 PolarHBondContact SG-N 3.1Å; V756-T759 PolarHBondContact N-O 3.36Å; V756-T759 PolarHBondContact O-N 3.19Å; V756-T759 VanDerWaalsContact O-O 3.14Å; V756-T759 PolarHBondContact O-OG1 2.94Å; V756-T759 VanDerWaalsContact O-OG1 3.07Å
760	C	71.9	Confident	67.5	Low	34 Å²	34	54.1 Å²	54.1	23%	0.23	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	127.8	176.5	-65.1	0	0	0	0	110.5	C747 E753	C747-C760 WeakPolarHBondContact CA-SG 3.03Å; C747-C760 HydrophobicContact CB-CB 3.73Å; C747-C760 WeakPolarHBondContact CB-SG 3.04Å; C747-C760 WeakPolarHBondContact SG-CA 3.4Å; C747-C760 WeakPolarHBondContact SG-CB 3.29Å; C747-C760 CovalentContact SG-SG 2.04Å; C747-C760 PolarHBondContact SG-SG 3.2Å; E753-C760 HydrophobicContact CB-CB 4.48Å; E753-C760 WeakPolarHBondContact OE2-CB 3.43Å
761	G	73	Confident	66.8	Low	19 Å²	19	59.4 Å²	59.4	20%	0.196	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	179.6	-177.6	0	0	0	0	0	111.8	E753 V754	E753-G761 WeakPolarHBondContact CA-O 3.29Å; V754-G761 PolarHBondContact N-O 3.29Å; V754-G761 PolarHBondContact O-N 2.94Å; V754-G761 VanDerWaalsContact O-N 3.08Å; V754-G761 VanDerWaalsContact O-O 3.06Å
762	C	76.4	Confident	66.5	Low	29 Å²	29	57.6 Å²	57.6	20%	0.196	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	147.2	-175.1	-55.6	0	0	0	0	112.8	F766 C775	C762-F766 HydrophobicContact CB-CB 4.21Å; C762-F766 WeakPolarHBondContact CB-O 3.01Å; C762-C775 WeakPolarHBondContact CA-SG 2.99Å; C762-C775 HydrophobicContact CB-CB 3.66Å; C762-C775 WeakPolarHBondContact CB-SG 3.1Å; C762-C775 WeakPolarHBondContact SG-CB 3.49Å; C762-C775 CovalentContact SG-SG 2.03Å; C762-C775 PolarHBondContact SG-SG 2.88Å
763	S	73.5	Confident	66.3	Low	19 Å²	19	57.7 Å²	57.7	13%	0.133	33%	0.334	C	S	.	.			trans	-66.8	156.8	170.7	55.3	0	0	0	0	111.5	G765 F766	S763-G765 PolarHBondContact O-N 2.03Å; S763-F766 PolarHBondContact O-N 3.05Å; S763-F766 VanDerWaalsContact OG-CD2 3.24Å; S763-F766 WeakPolarHBondContact OG-CD2 3.31Å
764	A	66.2	Low	65.9	Low	101 Å²	101	59.4 Å²	59.4	84%	0.835	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	108.3	-165.1	0	0	0	0	0	113.8
765	G	67.2	Low	66.2	Low	23 Å²	23	58.1 Å²	58.1	24%	0.237	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	109.4	-19.9	179	0	0	0	0	0	114.6	S763 A805 C806	S763-G765 PolarHBondContact O-N 2.03Å; G765-A805 CarbonylContact O-C 3.6Å; G765-A805 VanDerWaalsContact O-CA 3.31Å; G765-A805 WeakPolarHBondContact O-CA 3.37Å; G765-A805 WeakPolarHBondContact O-CB 3.42Å; G765-C806 PolarHBondContact O-N 3.3Å
766	F	79.5	Confident	66.4	Low	16 Å²	16	56 Å²	56	7%	0.07	32%	0.32	C	S	.	.			trans	-84	136.7	175.8	-61.1	-90.8	0	0	0	110	C762 S763 C775 K795 T797 R803 A805	C762-F766 HydrophobicContact CB-CB 4.21Å; C762-F766 WeakPolarHBondContact CB-O 3.01Å; S763-F766 PolarHBondContact O-N 3.05Å; S763-F766 VanDerWaalsContact OG-CD2 3.24Å; S763-F766 WeakPolarHBondContact OG-CD2 3.31Å; F766-C775 HydrophobicContact CB-CB 4.3Å; F766-K795 HydrophobicContact CE1-CB 4.35Å; F766-K795 HydrophobicContact CZ-CB 3.83Å; F766-T797 HydrophobicContact CD1-CG2 4.33Å; F766-T797 HydrophobicContact CE1-CG2 3.68Å; F766-T797 HydrophobicContact CE2-CG2 4.33Å; F766-T797 HydrophobicContact CZ-CG2 3.68Å; F766-R803 HydrophobicContact CD1-CB 4.32Å; F766-R803 HydrophobicContact CE1-CB 3.98Å; F766-A805 HydrophobicContact CD1-CB 3.75Å; F766-A805 HydrophobicContact CD2-CB 4.35Å; F766-A805 HydrophobicContact CE1-CB 3.79Å; F766-A805 HydrophobicContact CE2-CB 4.39Å; F766-A805 HydrophobicContact CG-CB 4.05Å; F766-A805 HydrophobicContact CZ-CB 4.13Å
767	C	73	Confident	66.5	Low	11 Å²	11	55.8 Å²	55.8	7%	0.074	32%	0.319	C	S	.	.			trans	-104.3	154.9	177.5	-45.6	0	0	0	0	110.9	C775 G776 F792 C806 C812	C767-C775 WeakPolarHBondContact O-CA 3.46Å; C767-G776 PolarHBondContact O-N 2.91Å; C767-F792 HydrophobicContact CB-CE1 4.5Å; C767-C806 VanDerWaalsContact SG-SG 3.66Å; C767-C812 WeakPolarHBondContact CA-SG 3.03Å; C767-C812 HydrophobicContact CB-CB 3.99Å; C767-C812 WeakPolarHBondContact CB-SG 3.33Å; C767-C812 WeakPolarHBondContact SG-CB 3.49Å; C767-C812 CovalentContact SG-SG 2.05Å; C767-C812 PolarHBondContact SG-SG 3.07Å
768	K	68.4	Low	66.9	Low	82 Å²	82	51 Å²	51	36%	0.357	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-95.5	132.9	-173.5	-164	171.3	176.9	173.9	0	113	E753 G773 E774 R817	E753-K768 VanDerWaalsContact OE1-CE 3.26Å; E753-K768 WeakPolarHBondContact OE1-CE 3.19Å; E753-K768 IonicContact OE1-NZ 2.67Å; E753-K768 PolarHBondContact OE1-NZ 3.37Å; K768-G773 WeakPolarHBondContact CE-O 3.5Å; K768-E774 CarbonylContact C-O 2.91Å; K768-E774 WeakPolarHBondContact CA-O 3.04Å; K768-R817 WeakPolarHBondContact O-CD 3.07Å; K768-R817 PolarHBondContact O-NH1 3.49Å
769	D	64.2	Low	67.7	Low	50 Å²	50	55.7 Å²	55.7	27%	0.267	32%	0.324	S	S	.	.			trans	-70.4	159.3	177.8	-169	-100.3	0	0	0	113.6	K771 T772 G773 E774 T777 R817	D769-K771 WeakPolarHBondContact OD1-CA 3.33Å; D769-K771 PolarHBondContact OD1-N 3.22Å; D769-T772 PolarHBondContact OD1-N 2.83Å; D769-G773 WeakPolarHBondContact O-CA 3.23Å; D769-E774 PolarHBondContact N-O 3.12Å; D769-T777 HydrophobicContact CB-CG2 4.08Å; D769-R817 PolarHBondContact O-NH1 3.09Å
770	I	53.6	Low	68.2	Low	131 Å²	131	53.1 Å²	53.1	67%	0.672	31%	0.309	S	S	*	.	S	Bend	trans	-89.5	-40.5	177.2	-67.9	172.8	0	0	0	112.1
771	K	50.5	Low	67.9	Low	200 Å²	200	54.7 Å²	54.7	87%	0.87	32%	0.315	S	S	*	.	S	Bend	trans	-87.9	-38	-172.5	-64.9	-175.7	176.9	-176	0	112.8	D769	D769-K771 WeakPolarHBondContact OD1-CA 3.33Å; D769-K771 PolarHBondContact OD1-N 3.22Å
772	T	60.7	Low	67.7	Low	65 Å²	65	57.7 Å²	57.7	40%	0.399	33%	0.331	S	S	.	.	S	Bend	trans	-100.4	-33.6	178	76.3	0	0	0	0	112.6	R751 D769 E774	R751-T772 PolarHBondContact NE-O 3.01Å; R751-T772 PolarHBondContact NH2-O 2.8Å; R751-T772 VanDerWaalsContact NH2-O 3.07Å; D769-T772 PolarHBondContact OD1-N 2.83Å; T772-E774 WeakPolarHBondContact CB-OE1 3.28Å; T772-E774 WeakPolarHBondContact OG1-CG 3.22Å; T772-E774 PolarHBondContact OG1-N 3.23Å; T772-E774 PolarHBondContact OG1-OE1 2.82Å; T772-E774 VanDerWaalsContact OG1-OE1 3.09Å
773	G	64.6	Low	67.1	Low	10 Å²	10	64.4 Å²	64.4	10%	0.103	36%	0.36	C	S	.	.			trans	78.3	14.4	-173.9	0	0	0	0	0	114.4	R751 K768 D769	R751-G773 WeakPolarHBondContact CD-O 3.2Å; K768-G773 WeakPolarHBondContact CE-O 3.5Å; D769-G773 WeakPolarHBondContact O-CA 3.23Å
774	E	67.6	Low	66.1	Low	54 Å²	54	67.7 Å²	67.7	25%	0.252	38%	0.375	S	S	.	.			trans	-76.5	156.2	173.2	-68.8	167.9	-111.1	0	0	112.8	R751 K768 D769 T772 R803	R751-E774 HydrophobicContact CG-CG 4.34Å; K768-E774 CarbonylContact C-O 2.91Å; K768-E774 WeakPolarHBondContact CA-O 3.04Å; D769-E774 PolarHBondContact N-O 3.12Å; T772-E774 WeakPolarHBondContact CB-OE1 3.28Å; T772-E774 WeakPolarHBondContact OG1-CG 3.22Å; T772-E774 PolarHBondContact OG1-N 3.23Å; T772-E774 PolarHBondContact OG1-OE1 2.82Å; T772-E774 VanDerWaalsContact OG1-OE1 3.09Å; E774-R803 IonicContact OE2-CZ 3.1Å; E774-R803 VanDerWaalsContact OE2-CZ 3.24Å; E774-R803 IonicContact OE2-NH1 2.65Å; E774-R803 PolarHBondContact OE2-NH1 2.98Å; E774-R803 IonicContact OE2-NH2 3.15Å; E774-R803 PolarHBondContact OE2-NH2 3.21Å
775	C	76.2	Confident	65.6	Low	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-93.4	120.6	170.5	-64.6	0	0	0	0	111.8	R751 N752 C762 F766 C767	R751-C775 WeakPolarHBondContact O-CB 3.3Å; R751-C775 PolarHBondContact O-N 3.32Å; N752-C775 HydrophobicContact CB-CB 4.01Å; C762-C775 WeakPolarHBondContact CA-SG 2.99Å; C762-C775 HydrophobicContact CB-CB 3.66Å; C762-C775 WeakPolarHBondContact CB-SG 3.1Å; C762-C775 WeakPolarHBondContact SG-CB 3.49Å; C762-C775 CovalentContact SG-SG 2.03Å; C762-C775 PolarHBondContact SG-SG 2.88Å; F766-C775 HydrophobicContact CB-CB 4.3Å; C767-C775 WeakPolarHBondContact O-CA 3.46Å
776	G	73.6	Confident	65.4	Low	0 Å²	0	72.3 Å²	72.3	0%	0	40%	0.395	C	S	.	.	S	Bend	trans	88.3	125.6	178.1	0	0	0	0	0	114	C767 R803 C804	C767-G776 PolarHBondContact O-N 2.91Å; G776-R803 PolarHBondContact O-NH1 2.86Å; G776-C804 WeakPolarHBondContact CA-O 3.27Å
777	T	64.7	Low	64.9	Low	54 Å²	54	73 Å²	73	33%	0.331	40%	0.402	S	S	.	.	S	Bend	trans	-142.2	128	-166.5	45.8	0	0	0	0	113.5	D769 C804	D769-T777 HydrophobicContact CB-CG2 4.08Å; T777-C804 VanDerWaalsContact O-CB 3.29Å; T777-C804 WeakPolarHBondContact O-CB 3.24Å
778	P	64.1	Low	64.8	Low	86 Å²	86	73 Å²	73	56%	0.558	40%	0.402	S	S	*	.	S	Bend	cis	-82.3	-159	-24.7	37.9	-34.3	0	0	0	111	C804	P778-C804 PolarHBondContact O-N 3.25Å
779	L	72.3	Confident	65	Low	115 Å²	115	72.9 Å²	72.9	60%	0.602	41%	0.41	S	S	*	.	B	Isolated β-bridge	trans	-60.8	142	162.2	-73.9	167.3	0	0	0	110.5	D801 A802 R803	L779-D801 HydrophobicContact CD2-CB 4.33Å; L779-A802 WeakPolarHBondContact CA-O 3.5Å; L779-A802 WeakPolarHBondContact CD2-O 3.33Å; L779-R803 HydrophobicContact CD2-CG 4.01Å
780	C	71.4	Confident	65.2	Low	17 Å²	17	80.3 Å²	80.3	12%	0.115	44%	0.436	C	S	.	.			trans	-137.2	162.8	-174.4	64.7	0	0	0	0	111.8	S787 C788 C794 A802 R803	C780-S787 WeakPolarHBondContact CB-OG 3.26Å; C780-C788 VanDerWaalsContact CB-SG 3.55Å; C780-C794 HydrophobicContact CB-CB 3.78Å; C780-C794 WeakPolarHBondContact CB-SG 3.44Å; C780-C794 WeakPolarHBondContact SG-CA 3.25Å; C780-C794 WeakPolarHBondContact SG-CB 3.23Å; C780-C794 CovalentContact SG-SG 2.03Å; C780-C794 PolarHBondContact SG-SG 3.41Å; C780-A802 PolarHBondContact N-O 2.99Å; C780-A802 VanDerWaalsContact O-CB 3.26Å; C780-A802 WeakPolarHBondContact O-CB 3.44Å; C780-A802 VanDerWaalsContact SG-C 3.51Å; C780-R803 WeakPolarHBondContact SG-CA 3.34Å; C780-R803 PolarHBondContact SG-N 2.59Å; C780-R803 VanDerWaalsContact SG-N 3.38Å; C780-R803 PolarHBondContact SG-O 3.34Å
781	N	66.3	Low	65.6	Low	67 Å²	67	75.4 Å²	75.4	36%	0.358	41%	0.412	S	S	.	.			trans	-102.9	117.9	176.4	177.8	-2.1	0	0	0	109.3	E783 L784 S787 C794	N781-E783 PolarHBondContact O-N 2.76Å; N781-E783 VanDerWaalsContact O-N 3.14Å; N781-E783 PolarHBondContact OD1-N 3.01Å; N781-L784 HydrophobicContact CB-CB 4.28Å; N781-L784 HydrophobicContact CB-CD1 4.25Å; N781-L784 HydrophobicContact CB-CG 4.47Å; N781-L784 PolarHBondContact O-N 3.14Å; N781-S787 PolarHBondContact N-OG 3.39Å; N781-S787 VanDerWaalsContact N-OG 3.16Å; N781-S787 PolarHBondContact O-OG 2.94Å; N781-C794 VanDerWaalsContact C-SG 3.54Å
782	P	68	Low	67	Low	81 Å²	81	67.4 Å²	67.4	53%	0.526	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.2	-179.1	25.9	-34.4	0	0	0	114.2	L784	P782-L784 VanDerWaalsContact C-N 3.34Å
783	E	62.6	Low	67.7	Low	170 Å²	170	67.2 Å²	67.2	79%	0.794	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-10.8	173.4	-60.9	-168	162.6	0	0	113.8	N781	N781-E783 PolarHBondContact O-N 2.76Å; N781-E783 VanDerWaalsContact O-N 3.14Å; N781-E783 PolarHBondContact OD1-N 3.01Å
784	L	54	Low	68.4	Low	88 Å²	88	67.9 Å²	67.9	46%	0.461	38%	0.379	S	S	.	.			trans	-116.7	103.4	-178.4	-71.6	173.5	0	0	0	111.1	N781 P782 S786 S787	N781-L784 HydrophobicContact CB-CB 4.28Å; N781-L784 HydrophobicContact CB-CD1 4.25Å; N781-L784 HydrophobicContact CB-CG 4.47Å; N781-L784 PolarHBondContact O-N 3.14Å; P782-L784 VanDerWaalsContact C-N 3.34Å; L784-S786 PolarHBondContact O-N 2.97Å; L784-S786 VanDerWaalsContact O-N 3.13Å; L784-S787 VanDerWaalsContact O-CB 3.3Å; L784-S787 WeakPolarHBondContact O-CB 3.35Å; L784-S787 PolarHBondContact O-N 3.08Å; L784-S787 PolarHBondContact O-OG 3.39Å
785	P	54.8	Low	68.7	Low	117 Å²	117	68.5 Å²	68.5	76%	0.76	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-58.4	-26.1	176.1	-26.4	35.4	0	0	0	114.1	S787	P785-S787 VanDerWaalsContact C-N 3.3Å
786	S	63.3	Low	68.5	Low	104 Å²	104	73.7 Å²	73.7	73%	0.727	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-80.1	-3	176.1	52.2	0	0	0	0	114.6	L784 C788	L784-S786 PolarHBondContact O-N 2.97Å; L784-S786 VanDerWaalsContact O-N 3.13Å; S786-C788 PolarHBondContact O-N 2.78Å
787	S	69.6	Low	68.4	Low	32 Å²	32	74.1 Å²	74.1	22%	0.224	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-74.3	-2.6	178.7	66.5	0	0	0	0	114.1	C780 N781 L784 P785	C780-S787 WeakPolarHBondContact CB-OG 3.26Å; N781-S787 PolarHBondContact N-OG 3.39Å; N781-S787 VanDerWaalsContact N-OG 3.16Å; N781-S787 PolarHBondContact O-OG 2.94Å; L784-S787 VanDerWaalsContact O-CB 3.3Å; L784-S787 WeakPolarHBondContact O-CB 3.35Å; L784-S787 PolarHBondContact O-N 3.08Å; L784-S787 PolarHBondContact O-OG 3.39Å; P785-S787 VanDerWaalsContact C-N 3.3Å
788	C	71.2	Confident	68.3	Low	9 Å²	9	77.3 Å²	77.3	6%	0.061	42%	0.424	C	S	.	.	S	Bend	trans	-129.8	144.8	171.3	-67.5	0	0	0	0	111	C780 S786 Y790 F792 C794 C804	C780-C788 VanDerWaalsContact CB-SG 3.55Å; S786-C788 PolarHBondContact O-N 2.78Å; C788-Y790 PolarHBondContact O-N 2.83Å; C788-F792 HydrophobicContact CB-CB 4.11Å; C788-F792 WeakPolarHBondContact CB-O 3.34Å; C788-C794 VanDerWaalsContact SG-CA 3.55Å; C788-C794 PolarHBondContact SG-N 2.67Å; C788-C794 VanDerWaalsContact SG-N 3.41Å; C788-C804 WeakPolarHBondContact CA-SG 3.26Å; C788-C804 HydrophobicContact CB-CB 3.82Å; C788-C804 WeakPolarHBondContact CB-SG 3.48Å; C788-C804 WeakPolarHBondContact SG-CA 2.99Å; C788-C804 WeakPolarHBondContact SG-CB 3.43Å; C788-C804 CovalentContact SG-SG 2.04Å; C788-C804 PolarHBondContact SG-SG 2.8Å
789	P	72.4	Confident	68.5	Low	81 Å²	81	77.6 Å²	77.6	53%	0.526	41%	0.414	S	S	.	.			trans	-72.5	123.6	176.7	29.2	-33.3	0	0	0	110.4	F792	P789-F792 HydrophobicContact CG-CD2 4.36Å; P789-F792 WeakPolarHBondContact O-CA 3.02Å; P789-F792 VanDerWaalsContact O-CB 3.3Å; P789-F792 WeakPolarHBondContact O-CB 3.44Å; P789-F792 WeakPolarHBondContact O-CD2 3.47Å; P789-F792 PolarHBondContact O-N 3.03Å
790	Y	68.1	Low	68	Low	206 Å²	206	74.7 Å²	74.7	81%	0.808	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	134.2	175.4	178.5	-86.9	0	0	0	110.9	C788	C788-Y790 PolarHBondContact O-N 2.83Å
791	P	62.3	Low	67.9	Low	28 Å²	28	77.6 Å²	77.6	18%	0.182	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	cis	-89.1	4.8	12	33	-33.1	0	0	0	116.6	P807 C819	P791-P807 WeakPolarHBondContact O-CD 3.36Å; P791-P807 VanDerWaalsContact O-CG 3.32Å; P791-P807 WeakPolarHBondContact O-CG 3.23Å; P791-C819 HydrophobicContact CG-CB 3.97Å; P791-C819 VanDerWaalsContact CG-O 3.3Å; P791-C819 WeakPolarHBondContact CG-O 3.12Å
792	F	80.4	Confident	68.4	Low	32 Å²	32	75.3 Å²	75.3	14%	0.14	42%	0.417	C	S	.	.			trans	-66.2	147.3	176.2	-62	-108.3	0	0	0	111.8	C767 C788 P789 C804 A805 C819	C767-F792 HydrophobicContact CB-CE1 4.5Å; C788-F792 HydrophobicContact CB-CB 4.11Å; C788-F792 WeakPolarHBondContact CB-O 3.34Å; P789-F792 HydrophobicContact CG-CD2 4.36Å; P789-F792 WeakPolarHBondContact O-CA 3.02Å; P789-F792 VanDerWaalsContact O-CB 3.3Å; P789-F792 WeakPolarHBondContact O-CB 3.44Å; P789-F792 WeakPolarHBondContact O-CD2 3.47Å; P789-F792 PolarHBondContact O-N 3.03Å; F792-C804 HydrophobicContact CB-CB 4.14Å; F792-C804 HydrophobicContact CD1-CB 4.37Å; F792-A805 CarbonylContact C-O 3.42Å; F792-A805 WeakPolarHBondContact CA-O 3.25Å; F792-C819 WeakPolarHBondContact CD1-SG 3.39Å; F792-C819 HydrophobicContact CD2-CB 4.45Å; F792-C819 WeakPolarHBondContact CE1-SG 3.44Å; F792-C819 HydrophobicContact CE2-CB 4.25Å; F792-C819 HydrophobicContact CZ-CB 4.32Å; F792-C819 VanDerWaalsContact CZ-SG 3.55Å
793	V	74.8	Confident	68.9	Low	60 Å²	60	72.9 Å²	72.9	36%	0.364	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.9	173.1	-75.8	0	0	0	0	110.5	K795 A805 P807	V793-K795 PolarHBondContact O-N 3.22Å; V793-A805 PolarHBondContact N-O 3.14Å; V793-A805 PolarHBondContact O-N 3.21Å; V793-A805 VanDerWaalsContact O-O 3.1Å; V793-P807 HydrophobicContact CG2-CB 3.93Å
794	C	78.2	Confident	69.8	Low	25 Å²	25	64.8 Å²	64.8	17%	0.169	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	126.4	178.4	-169.1	0	0	0	0	110.7	C780 N781 C788	C780-C794 HydrophobicContact CB-CB 3.78Å; C780-C794 WeakPolarHBondContact CB-SG 3.44Å; C780-C794 WeakPolarHBondContact SG-CA 3.25Å; C780-C794 WeakPolarHBondContact SG-CB 3.23Å; C780-C794 CovalentContact SG-SG 2.03Å; C780-C794 PolarHBondContact SG-SG 3.41Å; N781-C794 VanDerWaalsContact C-SG 3.54Å; C788-C794 VanDerWaalsContact SG-CA 3.55Å; C788-C794 PolarHBondContact SG-N 2.67Å; C788-C794 VanDerWaalsContact SG-N 3.41Å
795	K	73.6	Confident	70.9	Confident	66 Å²	66	60.6 Å²	60.6	29%	0.287	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.6	175.6	-70.3	-173.7	-178.2	166.1	0	110.6	F766 V793 R803 A805 C806	F766-K795 HydrophobicContact CE1-CB 4.35Å; F766-K795 HydrophobicContact CZ-CB 3.83Å; V793-K795 PolarHBondContact O-N 3.22Å; K795-R803 PolarHBondContact N-O 2.96Å; K795-R803 PolarHBondContact O-N 3.39Å; K795-A805 HydrophobicContact CB-CB 4.1Å; K795-A805 HydrophobicContact CD-CB 3.84Å; K795-A805 HydrophobicContact CG-CB 4.13Å; K795-C806 PolarHBondContact NZ-O 3.02Å
796	I	73.3	Confident	72	Confident	109 Å²	109	55 Å²	55	56%	0.559	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	126.8	172.3	-57.6	175.2	0	0	0	108.3	G800 A802	I796-G800 WeakPolarHBondContact CG2-O 3.48Å; I796-A802 HydrophobicContact CG1-CB 4.32Å
797	T	71.2	Confident	72.5	Confident	9 Å²	9	51.2 Å²	51.2	6%	0.055	27%	0.274	C	S	.	.			trans	-69.5	163.3	172.2	60.7	0	0	0	0	111	F766 Y799 G800 D801 R803	F766-T797 HydrophobicContact CD1-CG2 4.33Å; F766-T797 HydrophobicContact CE1-CG2 3.68Å; F766-T797 HydrophobicContact CE2-CG2 4.33Å; F766-T797 HydrophobicContact CZ-CG2 3.68Å; T797-Y799 PolarHBondContact O-N 2.9Å; T797-G800 PolarHBondContact O-N 3.17Å; T797-G800 VanDerWaalsContact O-N 3.09Å; T797-D801 WeakPolarHBondContact CB-O 3.45Å; T797-D801 WeakPolarHBondContact CG2-O 3.49Å; T797-D801 PolarHBondContact N-O 2.8Å; T797-D801 PolarHBondContact OG1-N 2.63Å; T797-D801 PolarHBondContact OG1-O 3.47Å; T797-R803 HydrophobicContact CG2-CB 4.36Å
798	I	62.8	Low	72.2	Confident	121 Å²	121	56.1 Å²	56.1	62%	0.621	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-8.6	176.4	66	164.3	0	0	0	114.3	V754	V754-I798 HydrophobicContact CG1-CD1 3.6Å; V754-I798 HydrophobicContact CG1-CG1 4.39Å
799	Y	67.5	Low	71.7	Confident	93 Å²	93	60.2 Å²	60.2	37%	0.365	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-0.7	178.2	-56.6	-60.4	0	0	0	113.4	R749 N752 T797	R749-Y799 HydrophobicContact CG-CE1 4.37Å; N752-Y799 WeakPolarHBondContact OD1-CD2 3.47Å; T797-Y799 PolarHBondContact O-N 2.9Å
800	G	61.7	Low	71.6	Confident	54 Å²	54	57.9 Å²	57.9	56%	0.557	31%	0.306	S	S	*	.	S	Bend	trans	101.4	-19.8	176.4	0	0	0	0	0	115.1	I796 T797	I796-G800 WeakPolarHBondContact CG2-O 3.48Å; T797-G800 PolarHBondContact O-N 3.17Å; T797-G800 VanDerWaalsContact O-N 3.09Å
801	D	69	Low	71.4	Confident	78 Å²	78	52.2 Å²	52.2	42%	0.417	29%	0.288	S	S	.	.			trans	-71.5	136.8	177.6	-72.6	-9	0	0	0	111.9	L779 T797	L779-D801 HydrophobicContact CD2-CB 4.33Å; T797-D801 WeakPolarHBondContact CB-O 3.45Å; T797-D801 WeakPolarHBondContact CG2-O 3.49Å; T797-D801 PolarHBondContact N-O 2.8Å; T797-D801 PolarHBondContact OG1-N 2.63Å; T797-D801 PolarHBondContact OG1-O 3.47Å
802	A	77	Confident	71.6	Confident	18 Å²	18	52.6 Å²	52.6	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	118	173	0	0	0	0	0	111.5	L779 C780 I796	L779-A802 WeakPolarHBondContact CA-O 3.5Å; L779-A802 WeakPolarHBondContact CD2-O 3.33Å; C780-A802 PolarHBondContact N-O 2.99Å; C780-A802 VanDerWaalsContact O-CB 3.26Å; C780-A802 WeakPolarHBondContact O-CB 3.44Å; C780-A802 VanDerWaalsContact SG-C 3.51Å; I796-A802 HydrophobicContact CG1-CB 4.32Å
803	R	78.4	Confident	70.6	Confident	30 Å²	30	53.4 Å²	53.4	11%	0.113	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	160.2	-179.5	-71.7	-179.5	173.5	-128.1	10.6	111.8	N752 F766 E774 G776 L779 C780 K795 T797	N752-R803 WeakPolarHBondContact ND2-CD 3.11Å; N752-R803 PolarHBondContact ND2-NE 2.8Å; F766-R803 HydrophobicContact CD1-CB 4.32Å; F766-R803 HydrophobicContact CE1-CB 3.98Å; E774-R803 IonicContact OE2-CZ 3.1Å; E774-R803 VanDerWaalsContact OE2-CZ 3.24Å; E774-R803 IonicContact OE2-NH1 2.65Å; E774-R803 PolarHBondContact OE2-NH1 2.98Å; E774-R803 IonicContact OE2-NH2 3.15Å; E774-R803 PolarHBondContact OE2-NH2 3.21Å; G776-R803 PolarHBondContact O-NH1 2.86Å; L779-R803 HydrophobicContact CD2-CG 4.01Å; C780-R803 WeakPolarHBondContact SG-CA 3.34Å; C780-R803 PolarHBondContact SG-N 2.59Å; C780-R803 VanDerWaalsContact SG-N 3.38Å; C780-R803 PolarHBondContact SG-O 3.34Å; K795-R803 PolarHBondContact N-O 2.96Å; K795-R803 PolarHBondContact O-N 3.39Å; T797-R803 HydrophobicContact CG2-CB 4.36Å
804	C	81.3	Confident	69.4	Low	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	136.9	-179.1	-59.9	0	0	0	0	113.2	G776 T777 P778 C788 F792	G776-C804 WeakPolarHBondContact CA-O 3.27Å; T777-C804 VanDerWaalsContact O-CB 3.29Å; T777-C804 WeakPolarHBondContact O-CB 3.24Å; P778-C804 PolarHBondContact O-N 3.25Å; C788-C804 WeakPolarHBondContact CA-SG 3.26Å; C788-C804 HydrophobicContact CB-CB 3.82Å; C788-C804 WeakPolarHBondContact CB-SG 3.48Å; C788-C804 WeakPolarHBondContact SG-CA 2.99Å; C788-C804 WeakPolarHBondContact SG-CB 3.43Å; C788-C804 CovalentContact SG-SG 2.04Å; C788-C804 PolarHBondContact SG-SG 2.8Å; F792-C804 HydrophobicContact CB-CB 4.14Å; F792-C804 HydrophobicContact CD1-CB 4.37Å
805	A	78.7	Confident	67.9	Low	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	158.9	-176.5	0	0	0	0	0	111.6	G765 F766 F792 V793 K795	G765-A805 CarbonylContact O-C 3.6Å; G765-A805 VanDerWaalsContact O-CA 3.31Å; G765-A805 WeakPolarHBondContact O-CA 3.37Å; G765-A805 WeakPolarHBondContact O-CB 3.42Å; F766-A805 HydrophobicContact CD1-CB 3.75Å; F766-A805 HydrophobicContact CD2-CB 4.35Å; F766-A805 HydrophobicContact CE1-CB 3.79Å; F766-A805 HydrophobicContact CE2-CB 4.39Å; F766-A805 HydrophobicContact CG-CB 4.05Å; F766-A805 HydrophobicContact CZ-CB 4.13Å; F792-A805 CarbonylContact C-O 3.42Å; F792-A805 WeakPolarHBondContact CA-O 3.25Å; V793-A805 PolarHBondContact N-O 3.14Å; V793-A805 PolarHBondContact O-N 3.21Å; V793-A805 VanDerWaalsContact O-O 3.1Å; K795-A805 HydrophobicContact CB-CB 4.1Å; K795-A805 HydrophobicContact CD-CB 3.84Å; K795-A805 HydrophobicContact CG-CB 4.13Å
806	C	78.2	Confident	66.8	Low	1 Å²	1	66.2 Å²	66.2	1%	0.007	36%	0.36	C	S	.	.			trans	-62.9	140	172.7	-54.3	0	0	0	0	111.5	G765 C767 K795 H810 C812 C819	G765-C806 PolarHBondContact O-N 3.3Å; C767-C806 VanDerWaalsContact SG-SG 3.66Å; K795-C806 PolarHBondContact NZ-O 3.02Å; C806-H810 HydrophobicContact CB-CB 4.04Å; C806-H810 WeakPolarHBondContact CB-O 3.44Å; C806-C812 VanDerWaalsContact SG-SG 3.64Å; C806-C819 WeakPolarHBondContact CA-SG 3.11Å; C806-C819 HydrophobicContact CB-CB 3.9Å; C806-C819 WeakPolarHBondContact CB-SG 3.12Å; C806-C819 WeakPolarHBondContact SG-CB 3.04Å; C806-C819 CovalentContact SG-SG 2.04Å; C806-C819 PolarHBondContact SG-SG 2.93Å
807	P	73.5	Confident	65.8	Low	24 Å²	24	65.8 Å²	65.8	16%	0.156	35%	0.351	C	S	.	.			trans	-66	166.2	165.8	29.3	-35.5	0	0	0	110	P791 V793 D809 H810	P791-P807 WeakPolarHBondContact O-CD 3.36Å; P791-P807 VanDerWaalsContact O-CG 3.32Å; P791-P807 WeakPolarHBondContact O-CG 3.23Å; V793-P807 HydrophobicContact CG2-CB 3.93Å; P807-D809 PolarHBondContact O-N 3.07Å; P807-D809 VanDerWaalsContact O-N 3.13Å; P807-H810 HydrophobicContact CG-CB 4.03Å; P807-H810 PolarHBondContact O-N 3.31Å
808	V	63.2	Low	65.1	Low	134 Å²	134	68.4 Å²	68.4	81%	0.812	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-31.2	-173	-172.2	0	0	0	0	112.1	H810	V808-H810 PolarHBondContact O-N 3.1Å
809	D	59.3	Low	65.2	Low	95 Å²	95	63 Å²	63	51%	0.508	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	5.9	179.8	-38.1	-69.4	0	0	0	114	P807 S821 A822	P807-D809 PolarHBondContact O-N 3.07Å; P807-D809 VanDerWaalsContact O-N 3.13Å; D809-S821 CarbonylContact O-C 2.69Å; D809-S821 VanDerWaalsContact O-CA 3.25Å; D809-S821 WeakPolarHBondContact O-CA 2.95Å; D809-S821 PolarHBondContact O-OG 2.74Å; D809-S821 VanDerWaalsContact O-OG 3.12Å; D809-A822 PolarHBondContact O-N 2.84Å
810	H	70.9	Confident	65.1	Low	32 Å²	32	61.5 Å²	61.5	15%	0.148	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	148.4	-174.3	-69.3	62.3	0	0	0	113.1	C806 P807 V808 C819 I820 S821	C806-H810 HydrophobicContact CB-CB 4.04Å; C806-H810 WeakPolarHBondContact CB-O 3.44Å; P807-H810 HydrophobicContact CG-CB 4.03Å; P807-H810 PolarHBondContact O-N 3.31Å; V808-H810 PolarHBondContact O-N 3.1Å; H810-C819 HydrophobicContact CB-CB 4.16Å; H810-I820 CarbonylContact C-O 3.58Å; H810-I820 WeakPolarHBondContact CA-O 3.39Å; H810-I820 WeakPolarHBondContact CB-O 3.25Å; H810-I820 VanDerWaalsContact CD2-C 3.46Å; H810-S821 PolarHBondContact CD2-N 3.36Å; H810-S821 VanDerWaalsContact CD2-N 3.33Å
811	I	64.9	Low	64.8	Low	87 Å²	87	59.9 Å²	59.9	45%	0.446	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	141.7	-176.1	-46.2	177.7	0	0	0	108.8	H813 I820 A822 L825	I811-H813 PolarHBondContact O-N 3.2Å; I811-I820 PolarHBondContact N-O 3.49Å; I811-I820 WeakPolarHBondContact O-CG1 3.38Å; I811-I820 PolarHBondContact O-N 2.83Å; I811-A822 HydrophobicContact CD1-CB 4.12Å; I811-A822 HydrophobicContact CG1-CB 4.23Å; I811-L825 HydrophobicContact CD1-CD1 3.9Å
812	C	64.8	Low	64.1	Low	37 Å²	37	58 Å²	58	25%	0.25	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	122	172.3	-60.6	0	0	0	0	110.4	C767 C806	C767-C812 WeakPolarHBondContact CA-SG 3.03Å; C767-C812 HydrophobicContact CB-CB 3.99Å; C767-C812 WeakPolarHBondContact CB-SG 3.33Å; C767-C812 WeakPolarHBondContact SG-CB 3.49Å; C767-C812 CovalentContact SG-SG 2.05Å; C767-C812 PolarHBondContact SG-SG 3.07Å; C806-C812 VanDerWaalsContact SG-SG 3.64Å
813	H	60.1	Low	62.7	Low	48 Å²	48	63.4 Å²	63.4	22%	0.222	34%	0.339	C	S	.	.			trans	-71.7	126.1	172	-165.7	-66.1	0	0	0	110.1	I811 Q815 E816 R817 T818 I820	I811-H813 PolarHBondContact O-N 3.2Å; H813-Q815 PolarHBondContact ND1-N 3.45Å; H813-Q815 VanDerWaalsContact ND1-N 3.2Å; H813-Q815 PolarHBondContact O-N 2.77Å; H813-E816 HydrophobicContact CB-CB 4.17Å; H813-E816 PolarHBondContact ND1-N 2.81Å; H813-E816 VanDerWaalsContact ND1-N 3.18Å; H813-R817 WeakPolarHBondContact O-CA 3.18Å; H813-R817 PolarHBondContact O-N 2.05Å; H813-T818 PolarHBondContact N-O 2.89Å; H813-I820 HydrophobicContact CB-CD1 4.28Å; H813-I820 HydrophobicContact CB-CG1 4.21Å
814	P	49.7	Very low	61.1	Low	117 Å²	117	68.9 Å²	68.9	76%	0.76	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-34.2	-173.5	23.5	-33.3	0	0	0	114
815	Q	46.5	Very low	58.9	Low	168 Å²	168	74.5 Å²	74.5	79%	0.785	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-58.4	175.5	-67.3	169.5	-33.7	0	0	113	H813 R817	H813-Q815 PolarHBondContact ND1-N 3.45Å; H813-Q815 VanDerWaalsContact ND1-N 3.2Å; H813-Q815 PolarHBondContact O-N 2.77Å; Q815-R817 VanDerWaalsContact C-N 3.31Å; Q815-R817 PolarHBondContact O-N 3.1Å
816	E	51.2	Low	56.6	Low	135 Å²	135	81.3 Å²	81.3	63%	0.631	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-12.8	-176.9	-57.8	-174.3	169.9	0	0	115.2	H813 T818	H813-E816 HydrophobicContact CB-CB 4.17Å; H813-E816 PolarHBondContact ND1-N 2.81Å; H813-E816 VanDerWaalsContact ND1-N 3.18Å; E816-T818 PolarHBondContact O-N 2.91Å
817	R	52.7	Low	54.2	Low	100 Å²	100	89.1 Å²	89.1	38%	0.377	48%	0.475	S	S	.	.			trans	56.4	11.7	177.1	-55.9	-166.6	-176.7	-157.8	12.9	117	K768 D769 H813 Q815	K768-R817 WeakPolarHBondContact O-CD 3.07Å; K768-R817 PolarHBondContact O-NH1 3.49Å; D769-R817 PolarHBondContact O-NH1 3.09Å; H813-R817 WeakPolarHBondContact O-CA 3.18Å; H813-R817 PolarHBondContact O-N 2.05Å; Q815-R817 VanDerWaalsContact C-N 3.31Å; Q815-R817 PolarHBondContact O-N 3.1Å
818	T	56.3	Low	51.9	Low	64 Å²	64	92.5 Å²	92.5	39%	0.393	50%	0.5	S	S	.	.	S	Bend	trans	-86.2	154.8	172.1	51	0	0	0	0	111.5	H813 E816 I820	H813-T818 PolarHBondContact N-O 2.89Å; E816-T818 PolarHBondContact O-N 2.91Å; T818-I820 PolarHBondContact O-N 2.93Å
819	C	64	Low	50.1	Low	7 Å²	7	92.6 Å²	92.6	5%	0.047	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	115.5	165.3	-70.1	0	0	0	0	109.5	P791 F792 C806 H810	P791-C819 HydrophobicContact CG-CB 3.97Å; P791-C819 VanDerWaalsContact CG-O 3.3Å; P791-C819 WeakPolarHBondContact CG-O 3.12Å; F792-C819 WeakPolarHBondContact CD1-SG 3.39Å; F792-C819 HydrophobicContact CD2-CB 4.45Å; F792-C819 WeakPolarHBondContact CE1-SG 3.44Å; F792-C819 HydrophobicContact CE2-CB 4.25Å; F792-C819 HydrophobicContact CZ-CB 4.32Å; F792-C819 VanDerWaalsContact CZ-SG 3.55Å; C806-C819 WeakPolarHBondContact CA-SG 3.11Å; C806-C819 HydrophobicContact CB-CB 3.9Å; C806-C819 WeakPolarHBondContact CB-SG 3.12Å; C806-C819 WeakPolarHBondContact SG-CB 3.04Å; C806-C819 CovalentContact SG-SG 2.04Å; C806-C819 PolarHBondContact SG-SG 2.93Å; H810-C819 HydrophobicContact CB-CB 4.16Å
820	I	66.7	Low	48.2	Very low	62 Å²	62	96.6 Å²	96.6	32%	0.318	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	143.2	177.8	50.1	154.8	0	0	0	111.3	H810 I811 H813 T818 A822	H810-I820 CarbonylContact C-O 3.58Å; H810-I820 WeakPolarHBondContact CA-O 3.39Å; H810-I820 WeakPolarHBondContact CB-O 3.25Å; H810-I820 VanDerWaalsContact CD2-C 3.46Å; I811-I820 PolarHBondContact N-O 3.49Å; I811-I820 WeakPolarHBondContact O-CG1 3.38Å; I811-I820 PolarHBondContact O-N 2.83Å; H813-I820 HydrophobicContact CB-CD1 4.28Å; H813-I820 HydrophobicContact CB-CG1 4.21Å; T818-I820 PolarHBondContact O-N 2.93Å; I820-A822 PolarHBondContact O-N 2.82Å
821	S	55.5	Low	46	Very low	21 Å²	21	100.6 Å²	100.6	15%	0.147	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	130.9	-174.5	-175.4	0	0	0	0	112.8	D809 H810 I823 L824	D809-S821 CarbonylContact O-C 2.69Å; D809-S821 VanDerWaalsContact O-CA 3.25Å; D809-S821 WeakPolarHBondContact O-CA 2.95Å; D809-S821 PolarHBondContact O-OG 2.74Å; D809-S821 VanDerWaalsContact O-OG 3.12Å; H810-S821 PolarHBondContact CD2-N 3.36Å; H810-S821 VanDerWaalsContact CD2-N 3.33Å; S821-I823 PolarHBondContact O-N 2.91Å; S821-I823 PolarHBondContact OG-N 3.44Å; S821-L824 WeakPolarHBondContact O-CB 3.44Å; S821-L824 PolarHBondContact O-N 3.1Å
822	A	53	Low	44	Very low	39 Å²	39	101.4 Å²	101.4	32%	0.322	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-58.4	-25.8	172.2	0	0	0	0	0	112.7	D809 I811 I820 L824 L825	D809-A822 PolarHBondContact O-N 2.84Å; I811-A822 HydrophobicContact CD1-CB 4.12Å; I811-A822 HydrophobicContact CG1-CB 4.23Å; I820-A822 PolarHBondContact O-N 2.82Å; A822-L824 PolarHBondContact O-N 2.69Å; A822-L825 WeakPolarHBondContact O-CB 3.05Å; A822-L825 PolarHBondContact O-N 3.03Å; A822-L825 VanDerWaalsContact O-N 3.11Å
823	I	47.9	Very low	42.2	Very low	130 Å²	130	108.5 Å²	108.5	67%	0.667	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-63.2	-30.6	176.9	-56.5	176	0	0	0	110.8	S821 L825 N826	S821-I823 PolarHBondContact O-N 2.91Å; S821-I823 PolarHBondContact OG-N 3.44Å; I823-L825 PolarHBondContact O-N 3.41Å; I823-N826 PolarHBondContact O-N 3.41Å
824	L	44.3	Very low	40.7	Very low	146 Å²	146	115.3 Å²	115.3	76%	0.764	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-76.2	-5.3	177.5	-71.2	168.5	0	0	0	114.1	S821 A822	S821-L824 WeakPolarHBondContact O-CB 3.44Å; S821-L824 PolarHBondContact O-N 3.1Å; A822-L824 PolarHBondContact O-N 2.69Å
825	L	35.9	Very low	40.1	Very low	118 Å²	118	117.7 Å²	117.7	62%	0.618	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-81.8	-1.9	169.1	-66.6	173.8	0	0	0	113.4	I811 A822 I823 I827	I811-L825 HydrophobicContact CD1-CD1 3.9Å; A822-L825 WeakPolarHBondContact O-CB 3.05Å; A822-L825 PolarHBondContact O-N 3.03Å; A822-L825 VanDerWaalsContact O-N 3.11Å; I823-L825 PolarHBondContact O-N 3.41Å; L825-I827 PolarHBondContact O-N 2.04Å
826	N	30.2	Very low	39.6	Very low	142 Å²	142	119 Å²	119	76%	0.759	62%	0.615	S	S	*	*			trans	56.9	49.5	148.6	-143.3	2.1	0	0	0	116.3	I823	I823-N826 PolarHBondContact O-N 3.41Å
827	I	27.3	Very low	40.1	Very low	166 Å²	166	114.3 Å²	114.3	85%	0.851	60%	0.597	S	S	*	*			trans	-77.5	125.1	168.1	-65.7	179.9	0	0	0	109.9	L825	L825-I827 PolarHBondContact O-N 2.04Å
828	S	24.8	Very low	40.5	Very low	95 Å²	95	111.3 Å²	111.3	66%	0.664	59%	0.586	S	S	*	*	S	Bend	trans	88.2	93.2	162.3	-168.6	0	0	0	0	120.1
829	V	25.7	Very low	40.3	Very low	135 Å²	135	112.6 Å²	112.6	82%	0.818	59%	0.588	S	S	*	*				97.6	119.6	127.4	171.3	0	0	0	0	119.7
830	K	20.7	Very low	39.3	Very low	180 Å²	180	117.6 Å²	117.6	78%	0.783	61%	0.614	S	S	*	*			trans	-74.3	161.6	167.4	-44.7	174.7	178.4	179	0	110.3
831	P	24.4	Very low	39	Very low	116 Å²	116	116.9 Å²	116.9	75%	0.753	61%	0.61	S	S	*	*				-136.6	146.2	81.3	33.6	-19.5	0	0	0	114.1
832	S	23.4	Very low	38.9	Very low	103 Å²	103	120.1 Å²	120.1	72%	0.72	62%	0.622	S	S	*	*			trans	-74.4	134.5	170.1	-54.9	0	0	0	0	110.7
833	F	25.8	Very low	39.1	Very low	187 Å²	187	120.7 Å²	120.7	82%	0.82	62%	0.618	S	S	*	*			trans	-125.1	135.4	150.9	-93.9	-88.5	0	0	0	108.4
834	Q	28.8	Very low	39.5	Very low	190 Å²	190	116.3 Å²	116.3	89%	0.888	60%	0.595	S	S	*	*			trans	-83.8	138.7	-170.6	-65.3	161.6	-91.5	0	0	110.6
835	Y	36.7	Very low	40	Very low	168 Å²	168	119.3 Å²	119.3	66%	0.659	60%	0.598	S	S	*	*			trans	-120.2	132	163.3	-84.5	-91.6	0	0	0	108.5	F843	Y835-F843 HydrophobicContact CD2-CE2 4.48Å
836	E	36.1	Very low	40.8	Very low	194 Å²	194	117.3 Å²	117.3	91%	0.907	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-85.2	125.2	172	-65.1	-175.8	146.9	0	0	109.1
837	C	62.4	Low	41.9	Very low	38 Å²	38	112.8 Å²	112.8	26%	0.257	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-95.7	148.9	176.4	-57.4	0	0	0	0	111	E841 F843 C850	C837-E841 HydrophobicContact CB-CB 4.03Å; C837-F843 VanDerWaalsContact SG-CA 3.57Å; C837-F843 PolarHBondContact SG-N 2.03Å; C837-C850 WeakPolarHBondContact CA-SG 3.33Å; C837-C850 HydrophobicContact CB-CB 3.68Å; C837-C850 WeakPolarHBondContact CB-SG 3.39Å; C837-C850 WeakPolarHBondContact SG-CA 3.48Å; C837-C850 WeakPolarHBondContact SG-CB 3.17Å; C837-C850 CovalentContact SG-SG 2.04Å; C837-C850 PolarHBondContact SG-SG 3.27Å
838	K	60.8	Low	42.9	Very low	37 Å²	37	107 Å²	107	16%	0.161	57%	0.566	C	S	.	*	P	Polyproline II helix	trans	-70.4	164.7	-176.5	-57.9	165.2	175.5	177.5	0	110.8	Y61 L82 N840 E841	Y61-K838 HydrophobicContact CD1-CD 3.77Å; Y61-K838 VanDerWaalsContact CD1-CE 3.46Å; Y61-K838 HydrophobicContact CD1-CG 4.4Å; Y61-K838 HydrophobicContact CD2-CB 3.76Å; Y61-K838 HydrophobicContact CD2-CD 3.68Å; Y61-K838 HydrophobicContact CD2-CG 3.5Å; Y61-K838 VanDerWaalsContact CD2-CG 3.5Å; Y61-K838 HydrophobicContact CE1-CD 4.28Å; Y61-K838 HydrophobicContact CE2-CB 4.36Å; Y61-K838 HydrophobicContact CE2-CD 4.18Å; Y61-K838 HydrophobicContact CE2-CG 3.76Å; Y61-K838 HydrophobicContact CG-CB 4.23Å; Y61-K838 HydrophobicContact CG-CD 3.43Å; Y61-K838 VanDerWaalsContact CG-CD 3.43Å; Y61-K838 HydrophobicContact CG-CG 3.84Å; L82-K838 VanDerWaalsContact CB-NZ 3.3Å; L82-K838 PolarHBondContact O-NZ 3.25Å; K838-N840 PolarHBondContact O-N 2.04Å; K838-E841 WeakPolarHBondContact CD-OE2 3.29Å; K838-E841 PolarHBondContact O-N 2.7Å
839	Q	52.4	Low	44.4	Very low	91 Å²	91	108.9 Å²	108.9	43%	0.425	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-51.7	-31.5	-174	-88.8	-165	-17.2	0	0	115.8	D58 A59 K853	D58-Q839 PolarHBondContact OD1-NE2 3.16Å; A59-Q839 PolarHBondContact O-OE1 3.19Å; Q839-K853 WeakPolarHBondContact O-CE 3.48Å; Q839-K853 PolarHBondContact O-NZ 2.03Å
840	N	43.1	Very low	46	Very low	112 Å²	112	104.3 Å²	104.3	60%	0.599	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	3.1	179.2	-70.3	-13.4	0	0	0	114.4	K838 P852 K853	K838-N840 PolarHBondContact O-N 2.04Å; N840-P852 WeakPolarHBondContact O-CA 2.92Å; N840-K853 PolarHBondContact O-N 3.04Å
841	E	59.6	Low	47.7	Very low	47 Å²	47	98 Å²	98	22%	0.22	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	158.5	179.6	-65.5	169.3	174.7	0	0	110.4	C837 K838 C850 E851	C837-E841 HydrophobicContact CB-CB 4.03Å; K838-E841 WeakPolarHBondContact CD-OE2 3.29Å; K838-E841 PolarHBondContact O-N 2.7Å; E841-C850 HydrophobicContact CB-CB 4.11Å; E841-E851 CarbonylContact C-O 3.33Å; E841-E851 VanDerWaalsContact CA-O 3.27Å; E841-E851 WeakPolarHBondContact CA-O 3.44Å
842	E	53.9	Low	49.1	Very low	88 Å²	88	96.1 Å²	96.1	41%	0.411	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.2	174.9	-133.9	164.9	121.9	0	0	110	N844 C850 E851 K853 F856	E842-N844 PolarHBondContact O-N 3.14Å; E842-C850 WeakPolarHBondContact O-CA 3.21Å; E842-E851 PolarHBondContact N-O 2.93Å; E842-E851 PolarHBondContact O-N 3.16Å; E842-K853 HydrophobicContact CB-CG 4.27Å; E842-K853 VanDerWaalsContact OE2-CE 3.24Å; E842-K853 WeakPolarHBondContact OE2-CE 3.24Å; E842-K853 WeakPolarHBondContact OE2-CG 3.25Å; E842-F856 HydrophobicContact CB-CD1 4.46Å; E842-F856 HydrophobicContact CB-CE1 3.48Å; E842-F856 VanDerWaalsContact CB-CE1 3.48Å; E842-F856 HydrophobicContact CB-CZ 3.58Å; E842-F856 HydrophobicContact CG-CZ 4.13Å
843	F	57.1	Low	50	Low	51 Å²	51	96.9 Å²	96.9	22%	0.224	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	107.5	-172.4	-170.6	-102.8	0	0	0	111.5	Y835 C837 Y845	Y835-F843 HydrophobicContact CD2-CE2 4.48Å; C837-F843 VanDerWaalsContact SG-CA 3.57Å; C837-F843 PolarHBondContact SG-N 2.03Å; F843-Y845 AromaticContact CD1-CD1 3.87Å; F843-Y845 HydrophobicContact CD1-CD1 3.87Å; F843-Y845 HydrophobicContact CD1-CD2 4.27Å; F843-Y845 AromaticContact CD1-CE1 3.97Å; F843-Y845 HydrophobicContact CD1-CE1 3.97Å; F843-Y845 HydrophobicContact CD1-CE2 4.35Å; F843-Y845 HydrophobicContact CD1-CG 4.03Å; F843-Y845 AromaticContact CE1-CD1 3.9Å; F843-Y845 HydrophobicContact CE1-CD1 3.9Å; F843-Y845 HydrophobicContact CE1-CE1 4.25Å; F843-Y845 HydrophobicContact CE1-CG 4.27Å; F843-Y845 WeakPolarHBondContact O-CD2 3.15Å; F843-Y845 PolarHBondContact O-N 2.96Å; F843-Y845 VanDerWaalsContact O-N 3.11Å
844	N	57	Low	51.4	Low	38 Å²	38	89.8 Å²	89.8	20%	0.203	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	96	174	-178.2	-9.7	0	0	0	109.9	E842 G846 S847 G848 K849 E851	E842-N844 PolarHBondContact O-N 3.14Å; N844-G846 PolarHBondContact O-N 3.38Å; N844-G846 WeakPolarHBondContact OD1-CA 3.29Å; N844-G846 PolarHBondContact OD1-N 3.38Å; N844-S847 WeakPolarHBondContact CB-OG 3.49Å; N844-S847 PolarHBondContact O-N 2.9Å; N844-S847 PolarHBondContact O-OG 3.09Å; N844-S847 PolarHBondContact OD1-N 3.29Å; N844-G848 PolarHBondContact O-N 3.3Å; N844-K849 PolarHBondContact N-O 2.96Å; N844-E851 HydrophobicContact CB-CG 4.32Å; N844-E851 PolarHBondContact ND2-OE1 3.46Å; N844-E851 PolarHBondContact ND2-OE2 2.94Å
845	Y	55	Low	52.6	Low	209 Å²	209	84.2 Å²	84.2	82%	0.82	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-22.5	175.4	-66	-87.8	0	0	0	114.4	F843	F843-Y845 AromaticContact CD1-CD1 3.87Å; F843-Y845 HydrophobicContact CD1-CD1 3.87Å; F843-Y845 HydrophobicContact CD1-CD2 4.27Å; F843-Y845 AromaticContact CD1-CE1 3.97Å; F843-Y845 HydrophobicContact CD1-CE1 3.97Å; F843-Y845 HydrophobicContact CD1-CE2 4.35Å; F843-Y845 HydrophobicContact CD1-CG 4.03Å; F843-Y845 AromaticContact CE1-CD1 3.9Å; F843-Y845 HydrophobicContact CE1-CD1 3.9Å; F843-Y845 HydrophobicContact CE1-CE1 4.25Å; F843-Y845 HydrophobicContact CE1-CG 4.27Å; F843-Y845 WeakPolarHBondContact O-CD2 3.15Å; F843-Y845 PolarHBondContact O-N 2.96Å; F843-Y845 VanDerWaalsContact O-N 3.11Å
846	G	51.5	Low	53.4	Low	76 Å²	76	78.3 Å²	78.3	78%	0.784	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-17.8	178	0	0	0	0	0	114.9	N844	N844-G846 PolarHBondContact O-N 3.38Å; N844-G846 WeakPolarHBondContact OD1-CA 3.29Å; N844-G846 PolarHBondContact OD1-N 3.38Å
847	S	53.3	Low	54.3	Low	48 Å²	48	69.2 Å²	69.2	34%	0.336	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-13.1	175.4	72.4	0	0	0	0	113.7	N844 K849 E851	N844-S847 WeakPolarHBondContact CB-OG 3.49Å; N844-S847 PolarHBondContact O-N 2.9Å; N844-S847 PolarHBondContact O-OG 3.09Å; N844-S847 PolarHBondContact OD1-N 3.29Å; S847-K849 VanDerWaalsContact C-N 3.29Å; S847-K849 PolarHBondContact OG-N 3.04Å; S847-E851 VanDerWaalsContact CB-OE1 3.25Å; S847-E851 WeakPolarHBondContact CB-OE1 3.24Å; S847-E851 PolarHBondContact OG-OE1 3.49Å
848	G	49.1	Very low	53.5	Low	43 Å²	43	76.3 Å²	76.3	44%	0.443	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	18.9	-176.1	0	0	0	0	0	113.8	N844	N844-G848 PolarHBondContact O-N 3.3Å
849	K	54.8	Low	52.9	Low	136 Å²	136	79.5 Å²	79.5	59%	0.591	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.2	-172.4	-64.2	177.2	-176.1	178.3	0	112.3	N844 S847 E851	N844-K849 PolarHBondContact N-O 2.96Å; S847-K849 VanDerWaalsContact C-N 3.29Å; S847-K849 PolarHBondContact OG-N 3.04Å; K849-E851 HydrophobicContact CB-CG 4.31Å
850	C	59.9	Low	53.2	Low	39 Å²	39	80 Å²	80	26%	0.264	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	125.5	160.4	-62.6	0	0	0	0	109.3	C837 E841 E842	C837-C850 WeakPolarHBondContact CA-SG 3.33Å; C837-C850 HydrophobicContact CB-CB 3.68Å; C837-C850 WeakPolarHBondContact CB-SG 3.39Å; C837-C850 WeakPolarHBondContact SG-CA 3.48Å; C837-C850 WeakPolarHBondContact SG-CB 3.17Å; C837-C850 CovalentContact SG-SG 2.04Å; C837-C850 PolarHBondContact SG-SG 3.27Å; E841-C850 HydrophobicContact CB-CB 4.11Å; E842-C850 WeakPolarHBondContact O-CA 3.21Å
851	E	57.1	Low	54.1	Low	48 Å²	48	75.4 Å²	75.4	22%	0.224	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.2	-178.8	-68.7	176.2	-172	0	0	109.9	E841 E842 N844 S847 K849	E841-E851 CarbonylContact C-O 3.33Å; E841-E851 VanDerWaalsContact CA-O 3.27Å; E841-E851 WeakPolarHBondContact CA-O 3.44Å; E842-E851 PolarHBondContact N-O 2.93Å; E842-E851 PolarHBondContact O-N 3.16Å; N844-E851 HydrophobicContact CB-CG 4.32Å; N844-E851 PolarHBondContact ND2-OE1 3.46Å; N844-E851 PolarHBondContact ND2-OE2 2.94Å; S847-E851 VanDerWaalsContact CB-OE1 3.25Å; S847-E851 WeakPolarHBondContact CB-OE1 3.24Å; S847-E851 PolarHBondContact OG-OE1 3.49Å; K849-E851 HydrophobicContact CB-CG 4.31Å
852	P	53.1	Low	54.1	Low	75 Å²	75	75 Å²	75	49%	0.487	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	142.2	-174.1	-26.6	35.6	0	0	0	113.9	N840 G854 T855	N840-P852 WeakPolarHBondContact O-CA 2.92Å; P852-G854 PolarHBondContact O-N 2.84Å; P852-T855 HydrophobicContact CB-CG2 4.05Å; P852-T855 HydrophobicContact CG-CG2 4.49Å; P852-T855 WeakPolarHBondContact O-CG2 3.22Å; P852-T855 PolarHBondContact O-N 3.16Å; P852-T855 VanDerWaalsContact O-N 3.08Å; P852-T855 PolarHBondContact O-OG1 2.66Å
853	K	43.4	Very low	53.9	Low	119 Å²	119	76.1 Å²	76.1	52%	0.517	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	126.3	-177.8	-79.7	-177.8	170.1	165.5	0	112.5	Q839 N840 E842	Q839-K853 WeakPolarHBondContact O-CE 3.48Å; Q839-K853 PolarHBondContact O-NZ 2.03Å; N840-K853 PolarHBondContact O-N 3.04Å; E842-K853 HydrophobicContact CB-CG 4.27Å; E842-K853 VanDerWaalsContact OE2-CE 3.24Å; E842-K853 WeakPolarHBondContact OE2-CE 3.24Å; E842-K853 WeakPolarHBondContact OE2-CG 3.25Å
854	G	54.6	Low	53.7	Low	39 Å²	39	81.8 Å²	81.8	40%	0.402	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-11.9	-179	0	0	0	0	0	116	P852 F856	P852-G854 PolarHBondContact O-N 2.84Å; G854-F856 PolarHBondContact O-N 2.78Å
855	T	53.6	Low	53.9	Low	73 Å²	73	83.7 Å²	83.7	45%	0.448	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-12.6	-179.1	60.4	0	0	0	0	114.4	P852	P852-T855 HydrophobicContact CB-CG2 4.05Å; P852-T855 HydrophobicContact CG-CG2 4.49Å; P852-T855 WeakPolarHBondContact O-CG2 3.22Å; P852-T855 PolarHBondContact O-N 3.16Å; P852-T855 VanDerWaalsContact O-N 3.08Å; P852-T855 PolarHBondContact O-OG1 2.66Å
856	F	54.7	Low	54.3	Low	44 Å²	44	78.8 Å²	78.8	19%	0.193	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-0.5	-171.9	46.5	-94.1	0	0	0	114.7	E842 G854 K858 L879	E842-F856 HydrophobicContact CB-CD1 4.46Å; E842-F856 HydrophobicContact CB-CE1 3.48Å; E842-F856 VanDerWaalsContact CB-CE1 3.48Å; E842-F856 HydrophobicContact CB-CZ 3.58Å; E842-F856 HydrophobicContact CG-CZ 4.13Å; G854-F856 PolarHBondContact O-N 2.78Å; F856-K858 PolarHBondContact O-N 2.98Å; F856-L879 HydrophobicContact CD2-CD1 3.86Å; F856-L879 HydrophobicContact CE2-CD1 3.56Å
857	C	54	Low	55.3	Low	2 Å²	2	76.4 Å²	76.4	1%	0.014	41%	0.411	C	S	.	.			trans	-62.3	124.2	164.8	-127	0	0	0	0	108.1	P859 V860 C869	C857-P859 VanDerWaalsContact C-C 3.49Å; C857-P859 CarbonylContact C-O 3.5Å; C857-P859 CarbonylContact O-C 2.9Å; C857-V860 WeakPolarHBondContact O-CA 3.43Å; C857-V860 VanDerWaalsContact O-CG2 3.31Å; C857-V860 WeakPolarHBondContact O-CG2 3.34Å; C857-V860 PolarHBondContact O-N 3.16Å; C857-V860 VanDerWaalsContact O-N 3.13Å; C857-C869 HydrophobicContact CB-CB 4.05Å; C857-C869 WeakPolarHBondContact CB-SG 3.41Å; C857-C869 WeakPolarHBondContact SG-CB 3.22Å; C857-C869 CovalentContact SG-SG 2.05Å; C857-C869 PolarHBondContact SG-SG 2.72Å
858	K	46.3	Very low	55.8	Low	188 Å²	188	78.1 Å²	78.1	82%	0.817	41%	0.413	S	S	*	.	S	Bend	trans	-127.3	109.9	176.6	-84.4	-167.9	174.2	-177.5	0	110	F856	F856-K858 PolarHBondContact O-N 2.98Å
859	P	48.5	Very low	56.5	Low	104 Å²	104	78.5 Å²	78.5	68%	0.675	41%	0.409	S	S	*	.	S	Bend	cis	-63.5	157.1	-2.6	29.3	-36.5	0	0	0	112.9	C857 C861	C857-P859 VanDerWaalsContact C-C 3.49Å; C857-P859 CarbonylContact C-O 3.5Å; C857-P859 CarbonylContact O-C 2.9Å; P859-C861 PolarHBondContact O-N 3.12Å
860	V	57.5	Low	57.2	Low	102 Å²	102	75.5 Å²	75.5	62%	0.618	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-69.2	126.9	170.8	179.2	0	0	0	0	107.6	C857 D862	C857-V860 WeakPolarHBondContact O-CA 3.43Å; C857-V860 VanDerWaalsContact O-CG2 3.31Å; C857-V860 WeakPolarHBondContact O-CG2 3.34Å; C857-V860 PolarHBondContact O-N 3.16Å; C857-V860 VanDerWaalsContact O-N 3.13Å; V860-D862 PolarHBondContact O-N 2.84Å
861	C	61.5	Low	57.4	Low	14 Å²	14	77.3 Å²	77.3	10%	0.095	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-66.1	132.2	-175	-53.8	0	0	0	0	111.3	P859 P863 E867 C869 C881	P859-C861 PolarHBondContact O-N 3.12Å; C861-P863 VanDerWaalsContact O-CD 3.24Å; C861-P863 WeakPolarHBondContact O-CD 3.17Å; C861-E867 HydrophobicContact CB-CB 4.4Å; C861-C869 VanDerWaalsContact SG-CA 3.57Å; C861-C881 WeakPolarHBondContact CA-SG 3.29Å; C861-C881 HydrophobicContact CB-CB 3.71Å; C861-C881 WeakPolarHBondContact CB-SG 3.34Å; C861-C881 WeakPolarHBondContact SG-CA 3.44Å; C861-C881 WeakPolarHBondContact SG-CB 3.32Å; C861-C881 CovalentContact SG-SG 2.04Å; C861-C881 PolarHBondContact SG-SG 3.19Å
862	D	60.3	Low	57.6	Low	39 Å²	39	76.9 Å²	76.9	21%	0.209	40%	0.404	C	S	.	.			trans	-79.6	113.8	-172	-169	-18.8	0	0	0	110.4	V860 R864 K865	V860-D862 PolarHBondContact O-N 2.84Å; D862-R864 PolarHBondContact O-N 3.36Å; D862-R864 WeakPolarHBondContact OD1-CB 3.15Å; D862-R864 VanDerWaalsContact OD1-CG 3.29Å; D862-R864 WeakPolarHBondContact OD1-CG 2.97Å; D862-R864 IonicContact OD1-CZ 2.78Å; D862-R864 PolarHBondContact OD1-N 2.8Å; D862-R864 IonicContact OD1-NE 3.58Å; D862-R864 PolarHBondContact OD1-NE 2.83Å; D862-R864 IonicContact OD1-NH2 2.77Å; D862-R864 IonicContact OD2-CZ 3.21Å; D862-R864 IonicContact OD2-NE 2.63Å; D862-R864 PolarHBondContact OD2-NE 3.37Å; D862-R864 VanDerWaalsContact OD2-NE 3.14Å; D862-R864 IonicContact OD2-NH2 2.73Å; D862-R864 PolarHBondContact OD2-NH2 3.45Å; D862-K865 HydrophobicContact CB-CB 4.41Å; D862-K865 HydrophobicContact CB-CD 4.38Å; D862-K865 HydrophobicContact CB-CG 4.13Å; D862-K865 PolarHBondContact O-N 2.65Å
863	P	50.9	Low	57.9	Low	111 Å²	111	78.1 Å²	78.1	72%	0.721	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-59.8	-24	178.7	-21.8	34.6	0	0	0	112.3	C861 K865 K866	C861-P863 VanDerWaalsContact O-CD 3.24Å; C861-P863 WeakPolarHBondContact O-CD 3.17Å; P863-K865 VanDerWaalsContact C-N 3.34Å; P863-K866 PolarHBondContact O-N 2.54Å; P863-K866 VanDerWaalsContact O-N 3.1Å
864	R	51.1	Low	58.7	Low	170 Å²	170	80.6 Å²	80.6	64%	0.642	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-74.3	-23.4	-179.9	-53.2	170.4	-64.3	175.7	5.9	112.7	D862 K866	D862-R864 PolarHBondContact O-N 3.36Å; D862-R864 WeakPolarHBondContact OD1-CB 3.15Å; D862-R864 VanDerWaalsContact OD1-CG 3.29Å; D862-R864 WeakPolarHBondContact OD1-CG 2.97Å; D862-R864 IonicContact OD1-CZ 2.78Å; D862-R864 PolarHBondContact OD1-N 2.8Å; D862-R864 IonicContact OD1-NE 3.58Å; D862-R864 PolarHBondContact OD1-NE 2.83Å; D862-R864 IonicContact OD1-NH2 2.77Å; D862-R864 IonicContact OD2-CZ 3.21Å; D862-R864 IonicContact OD2-NE 2.63Å; D862-R864 PolarHBondContact OD2-NE 3.37Å; D862-R864 VanDerWaalsContact OD2-NE 3.14Å; D862-R864 IonicContact OD2-NH2 2.73Å; D862-R864 PolarHBondContact OD2-NH2 3.45Å; R864-K866 VanDerWaalsContact C-N 3.28Å
865	K	62.2	Low	58.7	Low	78 Å²	78	79.9 Å²	79.9	34%	0.339	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-80.4	-11.5	168.8	-68.9	-172.2	172.2	-167.6	0	113	D862 P863 E867 C896	D862-K865 HydrophobicContact CB-CB 4.41Å; D862-K865 HydrophobicContact CB-CD 4.38Å; D862-K865 HydrophobicContact CB-CG 4.13Å; D862-K865 PolarHBondContact O-N 2.65Å; P863-K865 VanDerWaalsContact C-N 3.34Å; K865-E867 VanDerWaalsContact C-N 3.33Å; K865-E867 HydrophobicContact CB-CB 4.43Å; K865-E867 HydrophobicContact CB-CG 3.78Å; K865-E867 HydrophobicContact CD-CG 4.42Å; K865-C896 WeakPolarHBondContact O-CB 3.15Å; K865-C896 PolarHBondContact O-N 3.15Å; K865-C896 PolarHBondContact O-SG 3.12Å
866	K	63.8	Low	58.6	Low	107 Å²	107	81.5 Å²	81.5	47%	0.465	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	37.6	-166.5	-44.9	174.9	-165	158.7	0	112.6	P863 R864 P884 Y887 C896	P863-K866 PolarHBondContact O-N 2.54Å; P863-K866 VanDerWaalsContact O-N 3.1Å; R864-K866 VanDerWaalsContact C-N 3.28Å; K866-P884 WeakPolarHBondContact O-CD 3.21Å; K866-Y887 HydrophobicContact CD-CE1 4.33Å; K866-C896 HydrophobicContact CB-CB 4.22Å; K866-C896 PolarHBondContact NZ-O 2.78Å
867	E	72.6	Confident	58	Low	26 Å²	26	85.1 Å²	85.1	12%	0.121	46%	0.458	C	S	.	.			trans	-92.4	141.3	177.5	-71.5	175.3	164.1	0	0	112.2	C861 K865 C881 Q882 R889	C861-E867 HydrophobicContact CB-CB 4.4Å; K865-E867 VanDerWaalsContact C-N 3.33Å; K865-E867 HydrophobicContact CB-CB 4.43Å; K865-E867 HydrophobicContact CB-CG 3.78Å; K865-E867 HydrophobicContact CD-CG 4.42Å; E867-C881 HydrophobicContact CB-CB 4.26Å; E867-C881 WeakPolarHBondContact OE2-CB 3.31Å; E867-Q882 CarbonylContact C-O 3.53Å; E867-Q882 WeakPolarHBondContact CA-O 2.99Å; E867-R889 IonicContact OE1-CZ 2.65Å; E867-R889 IonicContact OE1-NH1 3.88Å; E867-R889 PolarHBondContact OE1-NH1 2.82Å
868	E	62.9	Low	57.8	Low	84 Å²	84	93.6 Å²	93.6	39%	0.393	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	147.4	173.2	-71.8	176.3	170.8	0	0	111.5	R870 C881 Q882 P884	E868-R870 HydrophobicContact CB-CG 4.18Å; E868-R870 PolarHBondContact O-N 3.13Å; E868-R870 IonicContact OE2-CZ 3.9Å; E868-R870 IonicContact OE2-NE 3.76Å; E868-R870 PolarHBondContact OE2-NE 2.03Å; E868-R870 IonicContact OE2-NH2 3.15Å; E868-R870 PolarHBondContact OE2-NH2 2.8Å; E868-C881 WeakPolarHBondContact O-CA 3.01Å; E868-Q882 PolarHBondContact N-O 2.83Å; E868-Q882 PolarHBondContact O-N 3.27Å; E868-P884 HydrophobicContact CG-CG 4.13Å
869	C	63.1	Low	58.4	Low	51 Å²	51	87.6 Å²	87.6	35%	0.345	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	105.5	171	-176.3	0	0	0	0	109.2	C857 C861	C857-C869 HydrophobicContact CB-CB 4.05Å; C857-C869 WeakPolarHBondContact CB-SG 3.41Å; C857-C869 WeakPolarHBondContact SG-CB 3.22Å; C857-C869 CovalentContact SG-SG 2.05Å; C857-C869 PolarHBondContact SG-SG 2.72Å; C861-C869 VanDerWaalsContact SG-CA 3.57Å
870	R	69.7	Low	59.2	Low	73 Å²	73	84.1 Å²	84.1	28%	0.275	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	154.9	-177.9	-67.1	-174.7	174.2	-145.6	-2.7	110.8	E868 A880 Q882 E885	E868-R870 HydrophobicContact CB-CG 4.18Å; E868-R870 PolarHBondContact O-N 3.13Å; E868-R870 IonicContact OE2-CZ 3.9Å; E868-R870 IonicContact OE2-NE 3.76Å; E868-R870 PolarHBondContact OE2-NE 2.03Å; E868-R870 IonicContact OE2-NH2 3.15Å; E868-R870 PolarHBondContact OE2-NH2 2.8Å; R870-A880 PolarHBondContact N-O 3.38Å; R870-A880 PolarHBondContact O-N 2.87Å; R870-Q882 HydrophobicContact CB-CB 4.49Å; R870-Q882 HydrophobicContact CB-CG 4.46Å; R870-E885 IonicContact NH1-OE1 2.74Å
871	P	64	Low	60	Low	77 Å²	77	80.4 Å²	80.4	50%	0.5	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	142.7	175.7	-25.3	35.2	0	0	0	112.5	P873 R878 L879 Q882	P871-P873 WeakPolarHBondContact O-CD 3.47Å; P871-R878 WeakPolarHBondContact CA-O 3.45Å; P871-L879 HydrophobicContact CG-CD2 4.07Å; P871-Q882 PolarHBondContact O-NE2 3.38Å
872	D	61.4	Low	60.2	Low	39 Å²	39	82.1 Å²	82.1	21%	0.209	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.9	173.7	-176.4	-18.9	0	0	0	109.7	H874 A875 R878 A880	D872-H874 PolarHBondContact O-N 2.6Å; D872-H874 VanDerWaalsContact O-N 3.09Å; D872-H874 IonicContact OD1-CG 2.68Å; D872-H874 PolarHBondContact OD1-N 2.97Å; D872-H874 IonicContact OD1-ND1 2.67Å; D872-H874 PolarHBondContact OD1-ND1 3.45Å; D872-A875 HydrophobicContact CB-CB 4.39Å; D872-A875 CarbonylContact O-C 2.89Å; D872-A875 PolarHBondContact O-N 3.25Å; D872-A875 VanDerWaalsContact O-N 3.1Å; D872-R878 HydrophobicContact CB-CB 4.35Å; D872-R878 PolarHBondContact N-O 2.92Å; D872-A880 HydrophobicContact CB-CB 4.47Å
873	P	59.4	Low	61	Low	100 Å²	100	81.3 Å²	81.3	65%	0.649	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-26.6	177.3	-26.9	35.5	0	0	0	114.7	P871	P871-P873 WeakPolarHBondContact O-CD 3.47Å
874	H	59.9	Low	61.9	Low	171 Å²	171	77 Å²	77	79%	0.792	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-20.5	-177.6	-44.9	86.6	0	0	0	112.5	D872	D872-H874 PolarHBondContact O-N 2.6Å; D872-H874 VanDerWaalsContact O-N 3.09Å; D872-H874 IonicContact OD1-CG 2.68Å; D872-H874 PolarHBondContact OD1-N 2.97Å; D872-H874 IonicContact OD1-ND1 2.67Å; D872-H874 PolarHBondContact OD1-ND1 3.45Å
875	A	56	Low	62.4	Low	24 Å²	24	76.2 Å²	76.2	20%	0.198	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	82.3	-178.4	0	0	0	0	0	110.1	D872 S877 R878	D872-A875 HydrophobicContact CB-CB 4.39Å; D872-A875 CarbonylContact O-C 2.89Å; D872-A875 PolarHBondContact O-N 3.25Å; D872-A875 VanDerWaalsContact O-N 3.1Å; A875-S877 PolarHBondContact O-N 2.94Å; A875-R878 HydrophobicContact CB-CB 4.28Å; A875-R878 HydrophobicContact CB-CG 4.43Å; A875-R878 PolarHBondContact O-N 2.69Å
876	P	50.6	Low	61.9	Low	107 Å²	107	80 Å²	80	70%	0.695	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.6	-11.6	-177.2	-27.1	36.1	0	0	0	115.6
877	S	41.5	Very low	62.2	Low	121 Å²	121	78.8 Å²	78.8	85%	0.846	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	-0.6	171.2	52.7	0	0	0	0	114.4	A875	A875-S877 PolarHBondContact O-N 2.94Å
878	R	50.7	Low	61.7	Low	179 Å²	179	84.6 Å²	84.6	68%	0.675	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	150.7	171.8	-74.7	-177.7	171.9	168.9	-2.6	110.3	P871 D872 A875	P871-R878 WeakPolarHBondContact CA-O 3.45Å; D872-R878 HydrophobicContact CB-CB 4.35Å; D872-R878 PolarHBondContact N-O 2.92Å; A875-R878 HydrophobicContact CB-CB 4.28Å; A875-R878 HydrophobicContact CB-CG 4.43Å; A875-R878 PolarHBondContact O-N 2.69Å
879	L	59.2	Low	62	Low	62 Å²	62	86.4 Å²	86.4	33%	0.325	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.5	174.9	-68.3	159.1	0	0	0	109.1	F856 P871	F856-L879 HydrophobicContact CD2-CD1 3.86Å; F856-L879 HydrophobicContact CE2-CD1 3.56Å; P871-L879 HydrophobicContact CG-CD2 4.07Å
880	A	66.2	Low	61.8	Low	32 Å²	32	86 Å²	86	26%	0.264	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	165.6	-173.9	0	0	0	0	0	111.7	R870 D872	R870-A880 PolarHBondContact N-O 3.38Å; R870-A880 PolarHBondContact O-N 2.87Å; D872-A880 HydrophobicContact CB-CB 4.47Å
881	C	73.1	Confident	60.9	Low	24 Å²	24	88.3 Å²	88.3	16%	0.162	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	118.3	-168.8	-54.4	0	0	0	0	113	C861 E867 E868 R889	C861-C881 WeakPolarHBondContact CA-SG 3.29Å; C861-C881 HydrophobicContact CB-CB 3.71Å; C861-C881 WeakPolarHBondContact CB-SG 3.34Å; C861-C881 WeakPolarHBondContact SG-CA 3.44Å; C861-C881 WeakPolarHBondContact SG-CB 3.32Å; C861-C881 CovalentContact SG-SG 2.04Å; C861-C881 PolarHBondContact SG-SG 3.19Å; E867-C881 HydrophobicContact CB-CB 4.26Å; E867-C881 WeakPolarHBondContact OE2-CB 3.31Å; E868-C881 WeakPolarHBondContact O-CA 3.01Å; C881-R889 PolarHBondContact O-NH1 2.49Å
882	Q	65.8	Low	60.2	Low	50 Å²	50	92.1 Å²	92.1	23%	0.234	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.3	-170.2	-59	176.9	33.6	0	0	110.6	E867 E868 R870 P871	E867-Q882 CarbonylContact C-O 3.53Å; E867-Q882 WeakPolarHBondContact CA-O 2.99Å; E868-Q882 PolarHBondContact N-O 2.83Å; E868-Q882 PolarHBondContact O-N 3.27Å; R870-Q882 HydrophobicContact CB-CB 4.49Å; R870-Q882 HydrophobicContact CB-CG 4.46Å; P871-Q882 PolarHBondContact O-NE2 3.38Å
883	C	76.7	Confident	60.1	Low	22 Å²	22	93.7 Å²	93.7	15%	0.149	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-68	148.1	172	-67.3	0	0	0	0	110.9	C896	C883-C896 WeakPolarHBondContact CA-SG 3.37Å; C883-C896 HydrophobicContact CB-CB 3.85Å; C883-C896 WeakPolarHBondContact CB-SG 3.19Å; C883-C896 WeakPolarHBondContact SG-CB 3.18Å; C883-C896 CovalentContact SG-SG 2.04Å; C883-C896 PolarHBondContact SG-SG 3.32Å
884	P	69.8	Low	60.1	Low	20 Å²	20	89.8 Å²	89.8	13%	0.13	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-62.9	158.8	167.7	-13.3	24.4	0	0	0	111.1	K866 E868 Y887	K866-P884 WeakPolarHBondContact O-CD 3.21Å; E868-P884 HydrophobicContact CG-CG 4.13Å; P884-Y887 HydrophobicContact CB-CD2 3.79Å; P884-Y887 HydrophobicContact CB-CE2 4.17Å; P884-Y887 HydrophobicContact CG-CD2 4.04Å; P884-Y887 HydrophobicContact CG-CE2 4.34Å; P884-Y887 PolarHBondContact O-N 2.86Å; P884-Y887 VanDerWaalsContact O-N 3.1Å
885	E	61.1	Low	60.7	Low	154 Å²	154	83.9 Å²	83.9	72%	0.72	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	144.6	175.9	-67.3	-179.7	-176	0	0	111.5	R870 Y887	R870-E885 IonicContact NH1-OE1 2.74Å; E885-Y887 PolarHBondContact O-N 2.81Å
886	K	52.3	Low	61.4	Low	157 Å²	157	82.8 Å²	82.8	68%	0.683	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	-4.1	-168.9	-47.7	176.1	-175.6	176	0	116.1
887	Y	69.7	Low	62.3	Low	81 Å²	81	80.5 Å²	80.5	32%	0.318	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-100.3	134.2	170.4	-63.5	-103.9	0	0	0	111.3	K866 P884 E885 C896 Q897 I898	K866-Y887 HydrophobicContact CD-CE1 4.33Å; P884-Y887 HydrophobicContact CB-CD2 3.79Å; P884-Y887 HydrophobicContact CB-CE2 4.17Å; P884-Y887 HydrophobicContact CG-CD2 4.04Å; P884-Y887 HydrophobicContact CG-CE2 4.34Å; P884-Y887 PolarHBondContact O-N 2.86Å; P884-Y887 VanDerWaalsContact O-N 3.1Å; E885-Y887 PolarHBondContact O-N 2.81Å; Y887-C896 HydrophobicContact CD1-CB 4.3Å; Y887-C896 HydrophobicContact CG-CB 4.38Å; Y887-Q897 VanDerWaalsContact CA-O 3.26Å; Y887-Q897 WeakPolarHBondContact CA-O 3.5Å; Y887-I898 HydrophobicContact CD1-CD1 4.05Å; Y887-I898 HydrophobicContact CD1-CG1 3.72Å; Y887-I898 HydrophobicContact CD2-CD1 4.1Å; Y887-I898 HydrophobicContact CD2-CG1 4.3Å; Y887-I898 HydrophobicContact CE1-CB 4.41Å; Y887-I898 HydrophobicContact CE1-CD1 3.57Å; Y887-I898 HydrophobicContact CE1-CG1 3.7Å; Y887-I898 HydrophobicContact CE2-CD1 3.65Å; Y887-I898 HydrophobicContact CE2-CG1 4.3Å; Y887-I898 HydrophobicContact CG-CD1 4.29Å; Y887-I898 HydrophobicContact CG-CG1 4.03Å
888	H	63.8	Low	63.6	Low	149 Å²	149	76.6 Å²	76.6	69%	0.69	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	144.2	172.2	-70.3	-83.4	0	0	0	110.8	C896 Q897	H888-C896 CarbonylContact O-C 3.43Å; H888-C896 WeakPolarHBondContact O-CA 3.5Å; H888-Q897 PolarHBondContact N-O 3.35Å; H888-Q897 VanDerWaalsContact N-O 3.07Å; H888-Q897 PolarHBondContact O-N 2.92Å
889	R	67.7	Low	64.6	Low	121 Å²	121	71 Å²	71	46%	0.457	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	117.4	178.3	-141.3	-178.7	-46.4	-134.9	13.6	108.5	E867 C881	E867-R889 IonicContact OE1-CZ 2.65Å; E867-R889 IonicContact OE1-NH1 3.88Å; E867-R889 PolarHBondContact OE1-NH1 2.82Å; C881-R889 PolarHBondContact O-NH1 2.49Å
890	D	60.2	Low	65.6	Low	42 Å²	42	70.4 Å²	70.4	23%	0.225	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-63.8	133.5	179.5	175.4	-110.9	0	0	0	111.6	D892 T893 G894 I895	D890-D892 PolarHBondContact O-N 3.45Å; D890-D892 PolarHBondContact OD1-N 2.75Å; D890-T893 WeakPolarHBondContact OD1-CA 3.11Å; D890-T893 VanDerWaalsContact OD1-CB 3.26Å; D890-T893 WeakPolarHBondContact OD1-CB 3.15Å; D890-T893 WeakPolarHBondContact OD1-CG2 3.24Å; D890-T893 PolarHBondContact OD1-N 3.04Å; D890-T893 PolarHBondContact OD1-OG1 3.39Å; D890-G894 VanDerWaalsContact O-CA 3.24Å; D890-G894 WeakPolarHBondContact O-CA 3.32Å; D890-G894 PolarHBondContact O-N 3.38Å; D890-I895 PolarHBondContact N-O 3.27Å
891	P	50.9	Low	66.3	Low	122 Å²	122	70.2 Å²	70.2	79%	0.792	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-37.6	-175.2	-23.5	34.7	0	0	0	114.7
892	D	47.4	Very low	66.3	Low	157 Å²	157	72.7 Å²	72.7	84%	0.84	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-29.2	-171	-66.2	-35.3	0	0	0	112.8	D890	D890-D892 PolarHBondContact O-N 3.45Å; D890-D892 PolarHBondContact OD1-N 2.75Å
893	T	60	Low	66.5	Low	73 Å²	73	74.9 Å²	74.9	45%	0.448	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-17.9	-177.3	69.9	0	0	0	0	114.6	D890 I895	D890-T893 WeakPolarHBondContact OD1-CA 3.11Å; D890-T893 VanDerWaalsContact OD1-CB 3.26Å; D890-T893 WeakPolarHBondContact OD1-CB 3.15Å; D890-T893 WeakPolarHBondContact OD1-CG2 3.24Å; D890-T893 PolarHBondContact OD1-N 3.04Å; D890-T893 PolarHBondContact OD1-OG1 3.39Å; T893-I895 VanDerWaalsContact C-N 3.29Å; T893-I895 PolarHBondContact O-N 2.84Å
894	G	59.9	Low	66	Low	18 Å²	18	81.8 Å²	81.8	19%	0.186	42%	0.419	C	S	.	.			trans	68.5	20.9	178.6	0	0	0	0	0	115.4	D890	D890-G894 VanDerWaalsContact O-CA 3.24Å; D890-G894 WeakPolarHBondContact O-CA 3.32Å; D890-G894 PolarHBondContact O-N 3.38Å
895	I	71.6	Confident	66.2	Low	47 Å²	47	86 Å²	86	24%	0.241	44%	0.44	C	S	.	.			trans	-96.5	144.9	178.5	-60.1	172.2	0	0	0	109.9	D890 T893	D890-I895 PolarHBondContact N-O 3.27Å; T893-I895 VanDerWaalsContact C-N 3.29Å; T893-I895 PolarHBondContact O-N 2.84Å
896	C	72.3	Confident	67	Low	0 Å²	0	82 Å²	82	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	122.3	175.1	-54.1	0	0	0	0	111.5	K865 K866 C883 Y887 H888	K865-C896 WeakPolarHBondContact O-CB 3.15Å; K865-C896 PolarHBondContact O-N 3.15Å; K865-C896 PolarHBondContact O-SG 3.12Å; K866-C896 HydrophobicContact CB-CB 4.22Å; K866-C896 PolarHBondContact NZ-O 2.78Å; C883-C896 WeakPolarHBondContact CA-SG 3.37Å; C883-C896 HydrophobicContact CB-CB 3.85Å; C883-C896 WeakPolarHBondContact CB-SG 3.19Å; C883-C896 WeakPolarHBondContact SG-CB 3.18Å; C883-C896 CovalentContact SG-SG 2.04Å; C883-C896 PolarHBondContact SG-SG 3.32Å; Y887-C896 HydrophobicContact CD1-CB 4.3Å; Y887-C896 HydrophobicContact CG-CB 4.38Å; H888-C896 CarbonylContact O-C 3.43Å; H888-C896 WeakPolarHBondContact O-CA 3.5Å
897	Q	69.2	Low	68.3	Low	59 Å²	59	78.2 Å²	78.2	28%	0.276	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	158.1	-176.3	-70.2	-174.9	-16.3	0	0	114	Y887 H888	Y887-Q897 VanDerWaalsContact CA-O 3.26Å; Y887-Q897 WeakPolarHBondContact CA-O 3.5Å; H888-Q897 PolarHBondContact N-O 3.35Å; H888-Q897 VanDerWaalsContact N-O 3.07Å; H888-Q897 PolarHBondContact O-N 2.92Å
898	I	68.3	Low	69	Low	40 Å²	40	75.5 Å²	75.5	21%	0.205	40%	0.401	C	S	.	.			trans	-120.2	155.5	170.6	-84.4	176.2	0	0	0	107.8	Y887 E900	Y887-I898 HydrophobicContact CD1-CD1 4.05Å; Y887-I898 HydrophobicContact CD1-CG1 3.72Å; Y887-I898 HydrophobicContact CD2-CD1 4.1Å; Y887-I898 HydrophobicContact CD2-CG1 4.3Å; Y887-I898 HydrophobicContact CE1-CB 4.41Å; Y887-I898 HydrophobicContact CE1-CD1 3.57Å; Y887-I898 HydrophobicContact CE1-CG1 3.7Å; Y887-I898 HydrophobicContact CE2-CD1 3.65Å; Y887-I898 HydrophobicContact CE2-CG1 4.3Å; Y887-I898 HydrophobicContact CG-CD1 4.29Å; Y887-I898 HydrophobicContact CG-CG1 4.03Å; I898-E900 HydrophobicContact CG2-CG 4.33Å; I898-E900 WeakPolarHBondContact CG2-OE1 3.41Å
899	N	71.8	Confident	69.9	Low	62 Å²	62	69 Å²	69	33%	0.332	37%	0.372	S	S	.	.			trans	-115.4	102.7	170.2	179.5	-62.5	0	0	0	108.9	C901 A902 H903 D916	N899-C901 PolarHBondContact O-N 2.66Å; N899-C901 PolarHBondContact OD1-N 2.9Å; N899-A902 HydrophobicContact CB-CB 4.28Å; N899-A902 WeakPolarHBondContact OD1-CB 3.3Å; N899-A902 PolarHBondContact OD1-N 2.84Å; N899-H903 PolarHBondContact O-CD2 3.49Å; N899-H903 VanDerWaalsContact O-CD2 3.3Å; N899-H903 PolarHBondContact O-N 2.72Å; N899-D916 WeakPolarHBondContact CA-OD1 3.07Å; N899-D916 PolarHBondContact ND2-OD2 3.15Å; N899-D916 PolarHBondContact OD1-OD1 2.76Å
900	E	79.9	Confident	70.4	Confident	48 Å²	48	69.2 Å²	69.2	22%	0.224	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-31.9	-174.4	-76.1	78.2	-163.1	0	0	113.1	I898 Q904 L905 D916 F921	I898-E900 HydrophobicContact CG2-CG 4.33Å; I898-E900 WeakPolarHBondContact CG2-OE1 3.41Å; E900-Q904 PolarHBondContact O-N 3.15Å; E900-Q904 VanDerWaalsContact O-N 3.11Å; E900-L905 HydrophobicContact CB-CB 4.08Å; E900-L905 HydrophobicContact CG-CB 4Å; E900-L905 PolarHBondContact O-N 2.8Å; E900-D916 PolarHBondContact N-OD1 3Å; E900-F921 HydrophobicContact CB-CB 4.37Å; E900-F921 HydrophobicContact CB-CD1 3.76Å; E900-F921 HydrophobicContact CB-CG 4.45Å; E900-F921 HydrophobicContact CG-CD1 4.1Å
901	C	80.3	Confident	71.2	Confident	29 Å²	29	72.4 Å²	72.4	20%	0.196	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-38.8	179.2	-65.6	0	0	0	0	112	N899 C914 T915 D916	N899-C901 PolarHBondContact O-N 2.66Å; N899-C901 PolarHBondContact OD1-N 2.9Å; C901-C914 VanDerWaalsContact CA-SG 3.6Å; C901-C914 HydrophobicContact CB-CB 4.01Å; C901-C914 WeakPolarHBondContact CB-SG 3.44Å; C901-C914 VanDerWaalsContact SG-C 3.5Å; C901-C914 WeakPolarHBondContact SG-CB 3.3Å; C901-C914 CovalentContact SG-SG 2.05Å; C901-C914 PolarHBondContact SG-SG 2.88Å; C901-T915 PolarHBondContact SG-N 3.19Å; C901-T915 VanDerWaalsContact SG-N 3.45Å; C901-D916 HydrophobicContact CB-CB 4.39Å; C901-D916 PolarHBondContact N-OD1 2.82Å; C901-D916 PolarHBondContact SG-N 2.98Å
902	A	73.9	Confident	72.7	Confident	76 Å²	76	67.3 Å²	67.3	63%	0.628	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-31.6	177.1	0	0	0	0	0	112.5	N899	N899-A902 HydrophobicContact CB-CB 4.28Å; N899-A902 WeakPolarHBondContact OD1-CB 3.3Å; N899-A902 PolarHBondContact OD1-N 2.84Å
903	H	70.5	Confident	74.5	Confident	95 Å²	95	63.5 Å²	63.5	44%	0.44	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	3.9	176.4	-72.5	-57.8	0	0	0	114.7	N899 L905	N899-H903 PolarHBondContact O-CD2 3.49Å; N899-H903 VanDerWaalsContact O-CD2 3.3Å; N899-H903 PolarHBondContact O-N 2.72Å; H903-L905 VanDerWaalsContact C-N 3.28Å; H903-L905 HydrophobicContact CB-CD1 4.02Å; H903-L905 HydrophobicContact CB-CG 4.03Å; H903-L905 PolarHBondContact O-N 3.33Å
904	Q	66.4	Low	75.6	Confident	167 Å²	167	61.3 Å²	61.3	78%	0.78	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	34.5	-178	-57.8	-175	-9.4	0	0	114.1	E900 H906	E900-Q904 PolarHBondContact O-N 3.15Å; E900-Q904 VanDerWaalsContact O-N 3.11Å; Q904-H906 VanDerWaalsContact C-N 3.33Å; Q904-H906 PolarHBondContact O-N 2.93Å
905	L	72.3	Confident	76.5	Confident	109 Å²	109	63.5 Å²	63.5	57%	0.571	35%	0.35	S	S	*	.			trans	-95.6	28.5	-179	-62.9	176.8	0	0	0	113	E900 H903 F921	E900-L905 HydrophobicContact CB-CB 4.08Å; E900-L905 HydrophobicContact CG-CB 4Å; E900-L905 PolarHBondContact O-N 2.8Å; H903-L905 VanDerWaalsContact C-N 3.28Å; H903-L905 HydrophobicContact CB-CD1 4.02Å; H903-L905 HydrophobicContact CB-CG 4.03Å; H903-L905 PolarHBondContact O-N 3.33Å; L905-F921 WeakPolarHBondContact O-CE1 3.3Å
906	H	78	Confident	76.4	Confident	69 Å²	69	64.3 Å²	64.3	32%	0.319	36%	0.355	S	S	.	.			trans	-116.3	150.4	-174	70.4	93.5	0	0	0	113.3	Q904 C908 C914 F921	Q904-H906 VanDerWaalsContact C-N 3.33Å; Q904-H906 PolarHBondContact O-N 2.93Å; H906-C908 PolarHBondContact ND1-SG 3.01Å; H906-C914 VanDerWaalsContact CB-SG 3.58Å; H906-C914 VanDerWaalsContact CD2-SG 3.56Å; H906-F921 HydrophobicContact CB-CD1 4.01Å; H906-F921 HydrophobicContact CB-CD2 3.56Å; H906-F921 HydrophobicContact CB-CE1 4.1Å; H906-F921 HydrophobicContact CB-CE2 3.67Å; H906-F921 HydrophobicContact CB-CG 3.75Å; H906-F921 HydrophobicContact CB-CZ 3.96Å
907	D	80.4	Confident	76.3	Confident	79 Å²	79	66.9 Å²	66.9	42%	0.422	37%	0.371	S	S	.	.			trans	-114.9	42.4	-176.3	64.1	-7	0	0	0	113.2	F921 R942	D907-F921 VanDerWaalsContact OD1-CE2 3.26Å; D907-F921 WeakPolarHBondContact OD1-CE2 3.46Å; D907-F921 VanDerWaalsContact OD1-CZ 3.24Å; D907-F921 WeakPolarHBondContact OD1-CZ 3.37Å; D907-R942 VanDerWaalsContact CG-CZ 3.42Å; D907-R942 VanDerWaalsContact CG-NH2 3.27Å; D907-R942 IonicContact OD1-CZ 3.76Å; D907-R942 IonicContact OD1-NE 3.84Å; D907-R942 IonicContact OD1-NH1 3.17Å; D907-R942 PolarHBondContact OD1-NH1 2.99Å; D907-R942 IonicContact OD1-NH2 2.88Å; D907-R942 PolarHBondContact OD1-NH2 3.38Å; D907-R942 IonicContact OD2-CZ 3.33Å; D907-R942 IonicContact OD2-NH1 3.14Å; D907-R942 PolarHBondContact OD2-NH1 2.98Å; D907-R942 IonicContact OD2-NH2 2.7Å; D907-R942 PolarHBondContact OD2-NH2 2.92Å; D907-R942 VanDerWaalsContact OD2-NH2 3.15Å
908	C	84.6	Confident	75.5	Confident	23 Å²	23	70.4 Å²	70.4	16%	0.155	39%	0.385	C	S	.	.			trans	-73.5	156.3	175.3	-54.2	0	0	0	0	112.8	H906 A912 C923	H906-C908 PolarHBondContact ND1-SG 3.01Å; C908-A912 HydrophobicContact CB-CB 4.39Å; C908-C923 WeakPolarHBondContact CA-SG 3.01Å; C908-C923 HydrophobicContact CB-CB 3.66Å; C908-C923 WeakPolarHBondContact CB-SG 3.39Å; C908-C923 WeakPolarHBondContact SG-CB 3.46Å; C908-C923 CovalentContact SG-SG 2.03Å; C908-C923 PolarHBondContact SG-SG 2.83Å
909	S	81.9	Confident	74.9	Confident	12 Å²	12	76.1 Å²	76.1	8%	0.084	42%	0.416	C	S	.	.			trans	-58.5	146.3	166.2	175.9	0	0	0	0	111	F911 A912 G941	S909-F911 PolarHBondContact O-N 3.49Å; S909-F911 PolarHBondContact OG-N 3.1Å; S909-F911 VanDerWaalsContact OG-N 3.12Å; S909-A912 PolarHBondContact O-N 2.03Å; S909-G941 WeakPolarHBondContact CB-O 3.24Å; S909-G941 PolarHBondContact N-O 3.49Å
910	P	78.3	Confident	75	Confident	127 Å²	127	73.9 Å²	73.9	83%	0.825	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-17.5	167.6	-24.2	34.7	0	0	0	114.1
911	F	76.4	Confident	75	Confident	108 Å²	108	74.3 Å²	74.3	47%	0.474	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	33.1	173.2	-49.8	-62.8	0	0	0	111.7	S909 C925 S926 F929 C944	S909-F911 PolarHBondContact O-N 3.49Å; S909-F911 PolarHBondContact OG-N 3.1Å; S909-F911 VanDerWaalsContact OG-N 3.12Å; F911-C925 WeakPolarHBondContact O-CA 3.02Å; F911-S926 PolarHBondContact O-N 3.13Å; F911-S926 PolarHBondContact O-OG 2.76Å; F911-F929 HydrophobicContact CD1-CZ 4.32Å; F911-F929 HydrophobicContact CG-CE1 4.44Å; F911-C944 HydrophobicContact CB-CB 4.5Å
912	A	84.4	Confident	75.2	Confident	16 Å²	16	76.9 Å²	76.9	13%	0.132	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	147.8	177.3	0	0	0	0	0	113	C908 S909 T924 G941	C908-A912 HydrophobicContact CB-CB 4.39Å; S909-A912 PolarHBondContact O-N 2.03Å; A912-T924 CarbonylContact C-O 3.44Å; A912-T924 WeakPolarHBondContact CA-O 2.95Å; A912-T924 WeakPolarHBondContact CB-O 3.48Å; A912-G941 WeakPolarHBondContact CB-O 3.39Å
913	T	83.4	Confident	75.6	Confident	77 Å²	77	73.5 Å²	73.5	47%	0.472	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.3	-178.5	-50.6	0	0	0	0	110.8	C923 T924	T913-C923 WeakPolarHBondContact O-CA 3.4Å; T913-T924 PolarHBondContact N-O 3.21Å; T913-T924 PolarHBondContact O-N 3.23Å; T913-T924 PolarHBondContact O-OG1 3.46Å
914	C	84	Confident	76.2	Confident	27 Å²	27	72.2 Å²	72.2	18%	0.182	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	135.5	169.6	-167.6	0	0	0	0	110.4	C901 H906 I922	C901-C914 VanDerWaalsContact CA-SG 3.6Å; C901-C914 HydrophobicContact CB-CB 4.01Å; C901-C914 WeakPolarHBondContact CB-SG 3.44Å; C901-C914 VanDerWaalsContact SG-C 3.5Å; C901-C914 WeakPolarHBondContact SG-CB 3.3Å; C901-C914 CovalentContact SG-SG 2.05Å; C901-C914 PolarHBondContact SG-SG 2.88Å; H906-C914 VanDerWaalsContact CB-SG 3.58Å; H906-C914 VanDerWaalsContact CD2-SG 3.56Å; C914-I922 CarbonylContact C-O 3.48Å; C914-I922 WeakPolarHBondContact CA-O 3.07Å
915	T	78.5	Confident	76.6	Confident	64 Å²	64	65.7 Å²	65.7	39%	0.393	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	129.1	169.2	54.9	0	0	0	0	110.6	C901 F921 I922	C901-T915 PolarHBondContact SG-N 3.19Å; C901-T915 VanDerWaalsContact SG-N 3.45Å; T915-F921 WeakPolarHBondContact O-CA 3.3Å; T915-I922 PolarHBondContact N-O 3.33Å; T915-I922 PolarHBondContact O-N 3.31Å; T915-I922 PolarHBondContact OG1-O 3.02Å
916	D	69.9	Low	76.6	Confident	63 Å²	63	62.2 Å²	62.2	34%	0.337	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	143.8	-175.8	-157.8	69.1	0	0	0	111.7	N899 E900 C901	N899-D916 WeakPolarHBondContact CA-OD1 3.07Å; N899-D916 PolarHBondContact ND2-OD2 3.15Å; N899-D916 PolarHBondContact OD1-OD1 2.76Å; E900-D916 PolarHBondContact N-OD1 3Å; C901-D916 HydrophobicContact CB-CB 4.39Å; C901-D916 PolarHBondContact N-OD1 2.82Å; C901-D916 PolarHBondContact SG-N 2.98Å
917	T	70	Confident	76	Confident	55 Å²	55	65.2 Å²	65.2	34%	0.337	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	162.3	-176.1	77.4	0	0	0	0	112	D919 G920 I922	T917-D919 PolarHBondContact O-N 2.74Å; T917-G920 CarbonylContact C-O 2.9Å; T917-G920 VanDerWaalsContact CA-O 3.29Å; T917-G920 WeakPolarHBondContact CA-O 3.4Å; T917-G920 WeakPolarHBondContact CB-O 3.43Å; T917-G920 PolarHBondContact N-O 3.39Å; T917-G920 PolarHBondContact O-N 3.32Å; T917-G920 VanDerWaalsContact O-N 3.09Å; T917-G920 PolarHBondContact OG1-N 3.03Å; T917-G920 PolarHBondContact OG1-O 2.85Å; T917-I922 HydrophobicContact CG2-CD1 3.98Å; T917-I922 HydrophobicContact CG2-CG1 4.13Å
918	F	52.8	Low	74.5	Confident	133 Å²	133	64.3 Å²	64.3	58%	0.583	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.1	-173.4	-165.8	-85.2	0	0	0	115.2
919	D	55.6	Low	73.6	Confident	160 Å²	160	66.3 Å²	66.3	86%	0.856	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	17	-179.7	-70.8	-52.8	0	0	0	113	T917	T917-D919 PolarHBondContact O-N 2.74Å
920	G	73	Confident	73.1	Confident	14 Å²	14	69.6 Å²	69.6	14%	0.144	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137.2	-146.1	176.5	0	0	0	0	0	113.8	T917	T917-G920 CarbonylContact C-O 2.9Å; T917-G920 VanDerWaalsContact CA-O 3.29Å; T917-G920 WeakPolarHBondContact CA-O 3.4Å; T917-G920 WeakPolarHBondContact CB-O 3.43Å; T917-G920 PolarHBondContact N-O 3.39Å; T917-G920 PolarHBondContact O-N 3.32Å; T917-G920 VanDerWaalsContact O-N 3.09Å; T917-G920 PolarHBondContact OG1-N 3.03Å; T917-G920 PolarHBondContact OG1-O 2.85Å
921	F	81.5	Confident	72.8	Confident	58 Å²	58	65 Å²	65	25%	0.254	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	156.5	-176.7	65.5	-90.6	0	0	0	114.4	E900 L905 H906 D907 T915	E900-F921 HydrophobicContact CB-CB 4.37Å; E900-F921 HydrophobicContact CB-CD1 3.76Å; E900-F921 HydrophobicContact CB-CG 4.45Å; E900-F921 HydrophobicContact CG-CD1 4.1Å; L905-F921 WeakPolarHBondContact O-CE1 3.3Å; H906-F921 HydrophobicContact CB-CD1 4.01Å; H906-F921 HydrophobicContact CB-CD2 3.56Å; H906-F921 HydrophobicContact CB-CE1 4.1Å; H906-F921 HydrophobicContact CB-CE2 3.67Å; H906-F921 HydrophobicContact CB-CG 3.75Å; H906-F921 HydrophobicContact CB-CZ 3.96Å; D907-F921 VanDerWaalsContact OD1-CE2 3.26Å; D907-F921 WeakPolarHBondContact OD1-CE2 3.46Å; D907-F921 VanDerWaalsContact OD1-CZ 3.24Å; D907-F921 WeakPolarHBondContact OD1-CZ 3.37Å; T915-F921 WeakPolarHBondContact O-CA 3.3Å
922	I	82.7	Confident	72.6	Confident	83 Å²	83	63.2 Å²	63.2	43%	0.426	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.6	174.7	-61.6	177.2	0	0	0	109.8	C914 T915 T917	C914-I922 CarbonylContact C-O 3.48Å; C914-I922 WeakPolarHBondContact CA-O 3.07Å; T915-I922 PolarHBondContact N-O 3.33Å; T915-I922 PolarHBondContact O-N 3.31Å; T915-I922 PolarHBondContact OG1-O 3.02Å; T917-I922 HydrophobicContact CG2-CD1 3.98Å; T917-I922 HydrophobicContact CG2-CG1 4.13Å
923	C	83.5	Confident	72.3	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.034	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138.2	-179.3	-57.3	0	0	0	0	111.1	C908 T913 P940	C908-C923 WeakPolarHBondContact CA-SG 3.01Å; C908-C923 HydrophobicContact CB-CB 3.66Å; C908-C923 WeakPolarHBondContact CB-SG 3.39Å; C908-C923 WeakPolarHBondContact SG-CB 3.46Å; C908-C923 CovalentContact SG-SG 2.03Å; C908-C923 PolarHBondContact SG-SG 2.83Å; T913-C923 WeakPolarHBondContact O-CA 3.4Å; C923-P940 WeakPolarHBondContact CB-O 3.45Å; C923-P940 CarbonylContact O-C 3.5Å
924	T	82	Confident	71.5	Confident	68 Å²	68	65.4 Å²	65.4	42%	0.417	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	125.1	-179.2	49.6	0	0	0	0	112.7	A912 T913 S926	A912-T924 CarbonylContact C-O 3.44Å; A912-T924 WeakPolarHBondContact CA-O 2.95Å; A912-T924 WeakPolarHBondContact CB-O 3.48Å; T913-T924 PolarHBondContact N-O 3.21Å; T913-T924 PolarHBondContact O-N 3.23Å; T913-T924 PolarHBondContact O-OG1 3.46Å; T924-S926 PolarHBondContact O-N 3.11Å
925	C	75.5	Confident	70.3	Confident	29 Å²	29	66.8 Å²	66.8	20%	0.196	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	136.1	179.7	-75.2	0	0	0	0	112.3	F911 C944	F911-C925 WeakPolarHBondContact O-CA 3.02Å; C925-C944 HydrophobicContact CB-CB 3.87Å; C925-C944 WeakPolarHBondContact CB-SG 3.3Å; C925-C944 WeakPolarHBondContact SG-CB 3.04Å; C925-C944 CovalentContact SG-SG 2.05Å; C925-C944 PolarHBondContact SG-SG 3.45Å
926	S	73.3	Confident	70	Confident	36 Å²	36	71 Å²	71	25%	0.252	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-66.2	150.1	-179.2	-54.3	0	0	0	0	112.5	F911 T924 G928 F929	F911-S926 PolarHBondContact O-N 3.13Å; F911-S926 PolarHBondContact O-OG 2.76Å; T924-S926 PolarHBondContact O-N 3.11Å; S926-G928 PolarHBondContact O-N 3.12Å; S926-F929 PolarHBondContact O-N 2.59Å; S926-F929 VanDerWaalsContact O-N 3.14Å
927	P	63.8	Low	69.4	Low	133 Å²	133	73.9 Å²	73.9	86%	0.864	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	137	-177.7	-29	35.9	0	0	0	113.9
928	G	49.3	Very low	69.2	Low	60 Å²	60	77.2 Å²	77.2	62%	0.619	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	5.1	-176.1	0	0	0	0	0	114.8	S926	S926-G928 PolarHBondContact O-N 3.12Å
929	F	66.5	Low	70.2	Confident	64 Å²	64	76 Å²	76	28%	0.281	43%	0.425	S	S	.	.			trans	-121.1	138.9	166.9	-60.5	-106.6	0	0	0	111.9	F911 S926 C944 T945 K946	F911-F929 HydrophobicContact CD1-CZ 4.32Å; F911-F929 HydrophobicContact CG-CE1 4.44Å; S926-F929 PolarHBondContact O-N 2.59Å; S926-F929 VanDerWaalsContact O-N 3.14Å; F929-C944 HydrophobicContact CB-CB 3.5Å; F929-C944 VanDerWaalsContact CB-CB 3.5Å; F929-C944 HydrophobicContact CD1-CB 4.38Å; F929-C944 HydrophobicContact CG-CB 4.28Å; F929-T945 CarbonylContact C-O 3.54Å; F929-T945 WeakPolarHBondContact CA-O 3.26Å; F929-K946 HydrophobicContact CD1-CG 4.39Å
930	I	70.5	Confident	71.2	Confident	81 Å²	81	69.9 Å²	69.9	42%	0.415	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.7	-178	-59	170.7	0	0	0	109.3	E932 C944 T945 P947	I930-E932 PolarHBondContact O-N 2.95Å; I930-C944 CarbonylContact O-C 3.53Å; I930-C944 WeakPolarHBondContact O-CA 3.44Å; I930-T945 PolarHBondContact N-O 2.97Å; I930-T945 PolarHBondContact O-N 3.38Å; I930-P947 HydrophobicContact CD1-CB 4.03Å; I930-P947 HydrophobicContact CD1-CG 4.18Å
931	D	72.7	Confident	71.7	Confident	31 Å²	31	69.2 Å²	69.2	17%	0.166	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	120.8	179.7	-163.1	-22.7	0	0	0	112.3	S933 R936 P940 G941	D931-S933 WeakPolarHBondContact OD1-CB 3.07Å; D931-S933 PolarHBondContact OD1-N 3.17Å; D931-S933 PolarHBondContact OD1-OG 2.99Å; D931-R936 PolarHBondContact O-NE 3.2Å; D931-R936 PolarHBondContact O-NH1 3.36Å; D931-R936 PolarHBondContact O-NH2 2.88Å; D931-P940 WeakPolarHBondContact OD2-CA 3.34Å; D931-P940 WeakPolarHBondContact OD2-CB 3.3Å; D931-G941 PolarHBondContact OD2-N 2.05Å
932	E	72.6	Confident	71.9	Confident	70 Å²	70	70.1 Å²	70.1	33%	0.327	39%	0.389	S	S	.	.			trans	-114.8	19.4	174.8	-75.9	-172	-159.9	0	0	112.6	I930 K943 T945	I930-E932 PolarHBondContact O-N 2.95Å; E932-K943 HydrophobicContact CB-CB 4.36Å; E932-K943 HydrophobicContact CB-CD 3.8Å; E932-K943 HydrophobicContact CB-CG 4.09Å; E932-K943 PolarHBondContact N-O 3.09Å; E932-K943 WeakPolarHBondContact OE2-CE 3.42Å; E932-K943 IonicContact OE2-NZ 3.77Å; E932-K943 PolarHBondContact OE2-NZ 3.4Å; E932-T945 VanDerWaalsContact CD-CG2 3.46Å; E932-T945 HydrophobicContact CG-CG2 4.25Å; E932-T945 WeakPolarHBondContact OE1-CB 3.24Å; E932-T945 WeakPolarHBondContact OE1-CG2 3.46Å; E932-T945 PolarHBondContact OE1-OG1 3.26Å
933	S	77.1	Confident	71.6	Confident	4 Å²	4	71.2 Å²	71.2	3%	0.028	39%	0.39	C	S	.	.			trans	-59	143.8	180	-54.6	0	0	0	0	111.5	D931 D935 R936 G941 R942 K943	D931-S933 WeakPolarHBondContact OD1-CB 3.07Å; D931-S933 PolarHBondContact OD1-N 3.17Å; D931-S933 PolarHBondContact OD1-OG 2.99Å; S933-D935 PolarHBondContact O-N 2.83Å; S933-R936 VanDerWaalsContact O-CG 3.26Å; S933-R936 WeakPolarHBondContact O-CG 3Å; S933-G941 PolarHBondContact OG-N 2.04Å; S933-R942 WeakPolarHBondContact OG-CA 3.36Å; S933-R942 PolarHBondContact OG-N 2.76Å; S933-K943 PolarHBondContact OG-N 2.95Å
934	P	67.4	Low	71.5	Confident	136 Å²	136	71.7 Å²	71.7	88%	0.883	39%	0.393	S	S	*	.	S	Bend	trans	-59.6	-30.9	-178.7	-26.3	35.3	0	0	0	114.2
935	D	58.6	Low	70.5	Confident	56 Å²	56	70.5 Å²	70.5	30%	0.299	39%	0.386	S	S	.	.			trans	-127.3	98.5	170.8	176.5	-8	0	0	0	108.3	S933 V937 N938 K939	S933-D935 PolarHBondContact O-N 2.83Å; D935-V937 PolarHBondContact O-N 3.02Å; D935-V937 PolarHBondContact OD1-N 3.26Å; D935-N938 PolarHBondContact OD1-N 2.04Å; D935-N938 PolarHBondContact OD1-ND2 3.46Å; D935-N938 WeakPolarHBondContact OD2-CB 3.26Å; D935-N938 PolarHBondContact OD2-ND2 3.18Å; D935-K939 HydrophobicContact CB-CB 4.29Å; D935-K939 CarbonylContact O-C 3.56Å; D935-K939 VanDerWaalsContact O-CA 3.3Å; D935-K939 WeakPolarHBondContact O-CA 3.1Å; D935-K939 PolarHBondContact O-N 2.87Å; D935-K939 VanDerWaalsContact O-N 3.15Å
936	R	70.6	Confident	69.3	Low	152 Å²	152	76.3 Å²	76.3	57%	0.574	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-1.7	-178.9	-52.9	-175.1	-168.3	-167.7	-0.8	113.6	D931 S933	D931-R936 PolarHBondContact O-NE 3.2Å; D931-R936 PolarHBondContact O-NH1 3.36Å; D931-R936 PolarHBondContact O-NH2 2.88Å; S933-R936 VanDerWaalsContact O-CG 3.26Å; S933-R936 WeakPolarHBondContact O-CG 3Å
937	V	57.7	Low	68.1	Low	123 Å²	123	79.5 Å²	79.5	75%	0.745	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-53.4	-174.1	-177.6	0	0	0	0	110.2	D935	D935-V937 PolarHBondContact O-N 3.02Å; D935-V937 PolarHBondContact OD1-N 3.26Å
938	N	65.8	Low	66.9	Low	126 Å²	126	81.9 Å²	81.9	67%	0.674	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-18.2	-179.4	-42.3	-74.7	0	0	0	112.7	D935	D935-N938 PolarHBondContact OD1-N 2.04Å; D935-N938 PolarHBondContact OD1-ND2 3.46Å; D935-N938 WeakPolarHBondContact OD2-CB 3.26Å; D935-N938 PolarHBondContact OD2-ND2 3.18Å
939	K	75.1	Confident	67.3	Low	107 Å²	107	82 Å²	82	47%	0.465	42%	0.417	S	S	.	.	S	Bend	trans	-138.1	49.1	-177.5	-71.2	-170	167.4	-159.5	0	114	D935	D935-K939 HydrophobicContact CB-CB 4.29Å; D935-K939 CarbonylContact O-C 3.56Å; D935-K939 VanDerWaalsContact O-CA 3.3Å; D935-K939 WeakPolarHBondContact O-CA 3.1Å; D935-K939 PolarHBondContact O-N 2.87Å; D935-K939 VanDerWaalsContact O-N 3.15Å
940	P	77	Confident	67	Low	32 Å²	32	80.3 Å²	80.3	21%	0.208	41%	0.412	C	S	.	.			trans	-60.1	169.4	175.6	28.8	-36.2	0	0	0	112.6	C923 D931 R942	C923-P940 WeakPolarHBondContact CB-O 3.45Å; C923-P940 CarbonylContact O-C 3.5Å; D931-P940 WeakPolarHBondContact OD2-CA 3.34Å; D931-P940 WeakPolarHBondContact OD2-CB 3.3Å; P940-R942 PolarHBondContact O-N 3Å
941	G	83.4	Confident	67.1	Low	0 Å²	0	77.9 Å²	77.9	0%	0	40%	0.402	C	S	.	.	S	Bend	trans	70.7	22.4	170.3	0	0	0	0	0	115.6	S909 A912 D931 S933	S909-G941 WeakPolarHBondContact CB-O 3.24Å; S909-G941 PolarHBondContact N-O 3.49Å; A912-G941 WeakPolarHBondContact CB-O 3.39Å; D931-G941 PolarHBondContact OD2-N 2.05Å; S933-G941 PolarHBondContact OG-N 2.04Å
942	R	85.7	Confident	66.5	Low	76 Å²	76	84.6 Å²	84.6	29%	0.287	43%	0.432	S	S	.	.	S	Bend	trans	-103.6	-12.1	179.3	-62.1	-177.9	-178.8	-132.9	-5.7	114.3	D907 S933 P940	D907-R942 VanDerWaalsContact CG-CZ 3.42Å; D907-R942 VanDerWaalsContact CG-NH2 3.27Å; D907-R942 IonicContact OD1-CZ 3.76Å; D907-R942 IonicContact OD1-NE 3.84Å; D907-R942 IonicContact OD1-NH1 3.17Å; D907-R942 PolarHBondContact OD1-NH1 2.99Å; D907-R942 IonicContact OD1-NH2 2.88Å; D907-R942 PolarHBondContact OD1-NH2 3.38Å; D907-R942 IonicContact OD2-CZ 3.33Å; D907-R942 IonicContact OD2-NH1 3.14Å; D907-R942 PolarHBondContact OD2-NH1 2.98Å; D907-R942 IonicContact OD2-NH2 2.7Å; D907-R942 PolarHBondContact OD2-NH2 2.92Å; D907-R942 VanDerWaalsContact OD2-NH2 3.15Å; S933-R942 WeakPolarHBondContact OG-CA 3.36Å; S933-R942 PolarHBondContact OG-N 2.76Å; P940-R942 PolarHBondContact O-N 3Å
943	K	75.3	Confident	65.9	Low	106 Å²	106	84.5 Å²	84.5	46%	0.461	44%	0.439	S	S	.	.			trans	-155.8	135.1	173.5	-171.2	-171	178.4	-146.8	0	110.7	E932 S933	E932-K943 HydrophobicContact CB-CB 4.36Å; E932-K943 HydrophobicContact CB-CD 3.8Å; E932-K943 HydrophobicContact CB-CG 4.09Å; E932-K943 PolarHBondContact N-O 3.09Å; E932-K943 WeakPolarHBondContact OE2-CE 3.42Å; E932-K943 IonicContact OE2-NZ 3.77Å; E932-K943 PolarHBondContact OE2-NZ 3.4Å; S933-K943 PolarHBondContact OG-N 2.95Å
944	C	81.1	Confident	64.9	Low	15 Å²	15	87.3 Å²	87.3	10%	0.101	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	139.4	-173.4	-35.2	0	0	0	0	114.8	F911 C925 F929 I930	F911-C944 HydrophobicContact CB-CB 4.5Å; C925-C944 HydrophobicContact CB-CB 3.87Å; C925-C944 WeakPolarHBondContact CB-SG 3.3Å; C925-C944 WeakPolarHBondContact SG-CB 3.04Å; C925-C944 CovalentContact SG-SG 2.05Å; C925-C944 PolarHBondContact SG-SG 3.45Å; F929-C944 HydrophobicContact CB-CB 3.5Å; F929-C944 VanDerWaalsContact CB-CB 3.5Å; F929-C944 HydrophobicContact CD1-CB 4.38Å; F929-C944 HydrophobicContact CG-CB 4.28Å; I930-C944 CarbonylContact O-C 3.53Å; I930-C944 WeakPolarHBondContact O-CA 3.44Å
945	T	62	Low	64.5	Low	44 Å²	44	90.7 Å²	90.7	27%	0.27	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	-172.5	-171.7	64.1	0	0	0	0	116	F929 I930 E932	F929-T945 CarbonylContact C-O 3.54Å; F929-T945 WeakPolarHBondContact CA-O 3.26Å; I930-T945 PolarHBondContact N-O 2.97Å; I930-T945 PolarHBondContact O-N 3.38Å; E932-T945 VanDerWaalsContact CD-CG2 3.46Å; E932-T945 HydrophobicContact CG-CG2 4.25Å; E932-T945 WeakPolarHBondContact OE1-CB 3.24Å; E932-T945 WeakPolarHBondContact OE1-CG2 3.46Å; E932-T945 PolarHBondContact OE1-OG1 3.26Å
946	K	50.1	Low	65.4	Low	150 Å²	150	92.5 Å²	92.5	65%	0.652	47%	0.47	S	S	*	.			trans	-134.5	151.9	-168.4	-71.6	-170.6	173.5	-176	0	117.6	F929	F929-K946 HydrophobicContact CD1-CG 4.39Å
947	P	48.7	Very low	65.6	Low	103 Å²	103	90.3 Å²	90.3	67%	0.669	47%	0.47	S	S	*	.			trans	-106.6	-174	-174.2	41.1	-37.1	0	0	0	118.4	I930	I930-P947 HydrophobicContact CD1-CB 4.03Å; I930-P947 HydrophobicContact CD1-CG 4.18Å
948	M	38.2	Very low	66.8	Low	184 Å²	184	85.6 Å²	85.6	91%	0.906	44%	0.442	S	S	*	.			trans	-129.3	170.2	-170.7	-77.7	-178.3	65.6	0	0	116.7
949	N	57.4	Low	67.4	Low	63 Å²	63	81.1 Å²	81.1	34%	0.337	42%	0.421	S	S	.	.			trans	-115.6	141.3	-170.5	176.3	12.9	0	0	0	114.4	C951 E952 P966	N949-C951 PolarHBondContact OD1-N 3.3Å; N949-E952 PolarHBondContact ND2-OE1 3.07Å; N949-P966 VanDerWaalsContact OD1-CB 3.3Å; N949-P966 WeakPolarHBondContact OD1-CB 3.37Å
950	P	59.9	Low	67.4	Low	28 Å²	28	83.8 Å²	83.8	18%	0.182	44%	0.439	C	S	.	.	S	Bend	trans	-100.4	-22.3	179.1	5.6	15.3	0	0	0	117.6	E952 S953 G970	P950-E952 VanDerWaalsContact C-N 3.26Å; P950-E952 PolarHBondContact O-N 2.91Å; P950-S953 WeakPolarHBondContact O-CA 3.23Å; P950-S953 WeakPolarHBondContact O-CB 3.49Å; P950-S953 PolarHBondContact O-N 3.11Å; P950-S953 PolarHBondContact O-OG 3.05Å; P950-G970 WeakPolarHBondContact CG-O 3.29Å
951	C	72.6	Confident	67.5	Low	30 Å²	30	85 Å²	85	20%	0.203	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-65.1	-32	-173.5	-83.8	0	0	0	0	112.7	N949 S953 Y965 P966	N949-C951 PolarHBondContact OD1-N 3.3Å; C951-S953 PolarHBondContact O-N 3.2Å; C951-Y965 VanDerWaalsContact SG-C 3.51Å; C951-P966 HydrophobicContact CB-CB 3.97Å; C951-P966 HydrophobicContact CB-CG 4.31Å; C951-P966 WeakPolarHBondContact SG-CA 3.19Å
952	E	61.1	Low	67.4	Low	171 Å²	171	85.6 Å²	85.6	80%	0.799	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-71.6	-12.5	173.2	-69.6	156.1	-157.5	0	0	113	N949 P950	N949-E952 PolarHBondContact ND2-OE1 3.07Å; P950-E952 VanDerWaalsContact C-N 3.26Å; P950-E952 PolarHBondContact O-N 2.91Å
953	S	58.5	Low	66.9	Low	68 Å²	68	86.8 Å²	86.8	48%	0.476	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-89.4	1.1	179.7	80.8	0	0	0	0	114.6	P950 C951 R955	P950-S953 WeakPolarHBondContact O-CA 3.23Å; P950-S953 WeakPolarHBondContact O-CB 3.49Å; P950-S953 PolarHBondContact O-N 3.11Å; P950-S953 PolarHBondContact O-OG 3.05Å; C951-S953 PolarHBondContact O-N 3.2Å; S953-R955 VanDerWaalsContact C-N 3.35Å; S953-R955 PolarHBondContact O-N 2.77Å
954	G	56.5	Low	67.2	Low	63 Å²	63	83.5 Å²	83.5	65%	0.649	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	16.9	174.6	0	0	0	0	0	116.1
955	R	60.3	Low	67	Low	208 Å²	208	88.1 Å²	88.1	79%	0.785	46%	0.464	S	S	*	.			trans	-103.7	61.3	-177.1	-66.6	-175	173.8	-165.5	-1.2	113.2	S953 F972	S953-R955 VanDerWaalsContact C-N 3.35Å; S953-R955 PolarHBondContact O-N 2.77Å; R955-F972 WeakPolarHBondContact O-CD1 3.23Å; R955-F972 WeakPolarHBondContact O-CE1 3.03Å
956	H	76.9	Confident	67.1	Low	93 Å²	93	89.2 Å²	89.2	43%	0.431	47%	0.472	S	S	.	.			trans	-132.7	163.7	176.6	71.2	54	0	0	0	113.2	C964 F972	H956-C964 VanDerWaalsContact CD2-SG 3.54Å; H956-F972 HydrophobicContact CB-CD1 4.1Å; H956-F972 HydrophobicContact CB-CD2 3.72Å; H956-F972 HydrophobicContact CB-CE1 4.19Å; H956-F972 HydrophobicContact CB-CE2 3.83Å; H956-F972 HydrophobicContact CB-CG 3.89Å; H956-F972 HydrophobicContact CB-CZ 4.07Å
957	N	74	Confident	67.7	Low	107 Å²	107	84.4 Å²	84.4	57%	0.572	46%	0.455	S	S	*	.			trans	-129	22.7	-176	70.6	-25.7	0	0	0	115.8	F972 L993	N957-F972 VanDerWaalsContact OD1-CE2 3.24Å; N957-F972 WeakPolarHBondContact OD1-CE2 3.35Å; N957-F972 WeakPolarHBondContact OD1-CZ 3.39Å; N957-L993 WeakPolarHBondContact O-CD2 3.37Å
958	C	82.8	Confident	68	Low	23 Å²	23	85.1 Å²	85.1	16%	0.155	47%	0.469	C	S	.	.			trans	-61.5	154	177.5	-49.6	0	0	0	0	113.7	A962 C964 C974	C958-A962 HydrophobicContact CB-CB 4.3Å; C958-C964 VanDerWaalsContact SG-CB 3.55Å; C958-C974 WeakPolarHBondContact CA-SG 3.12Å; C958-C974 HydrophobicContact CB-CB 3.66Å; C958-C974 WeakPolarHBondContact CB-SG 3.26Å; C958-C974 WeakPolarHBondContact SG-CB 3.46Å; C958-C974 CovalentContact SG-SG 2.03Å; C958-C974 PolarHBondContact SG-SG 3.24Å
959	S	78.8	Confident	68.6	Low	33 Å²	33	82.9 Å²	82.9	23%	0.231	47%	0.466	C	S	.	.			trans	-63	154.6	175.2	-158.7	0	0	0	0	113.3	N961 A962 G992 L993	S959-N961 PolarHBondContact O-N 3.46Å; S959-A962 WeakPolarHBondContact O-CB 3.44Å; S959-A962 PolarHBondContact O-N 2.59Å; S959-G992 WeakPolarHBondContact CB-O 3.37Å; S959-G992 PolarHBondContact N-O 3.49Å; S959-L993 WeakPolarHBondContact CB-O 3.3Å; S959-L993 PolarHBondContact OG-O 3.37Å
960	L	74.9	Confident	68.2	Low	162 Å²	162	81.9 Å²	81.9	85%	0.848	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.5	170.3	-67.2	173	0	0	0	112.4	A962 K977	L960-A962 VanDerWaalsContact C-N 3.31Å; L960-K977 PolarHBondContact O-NZ 2.87Å
961	N	78.7	Confident	68.7	Low	57 Å²	57	81.7 Å²	81.7	31%	0.305	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	21.3	174.2	-72.6	-14	0	0	0	113.1	S959 C976 K977 C995	S959-N961 PolarHBondContact O-N 3.46Å; N961-C976 CarbonylContact O-C 3.33Å; N961-C976 WeakPolarHBondContact O-CA 3.42Å; N961-K977 WeakPolarHBondContact O-CB 3.45Å; N961-K977 VanDerWaalsContact O-CG 3.32Å; N961-K977 WeakPolarHBondContact O-CG 3.35Å; N961-K977 PolarHBondContact O-N 2.92Å; N961-C995 HydrophobicContact CB-CB 4.11Å
962	A	82.4	Confident	68.9	Low	13 Å²	13	83.8 Å²	83.8	11%	0.107	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	170.6	176.9	0	0	0	0	0	112.9	C958 S959 L960 Q975 G992	C958-A962 HydrophobicContact CB-CB 4.3Å; S959-A962 WeakPolarHBondContact O-CB 3.44Å; S959-A962 PolarHBondContact O-N 2.59Å; L960-A962 VanDerWaalsContact C-N 3.31Å; A962-Q975 CarbonylContact C-O 3.58Å; A962-Q975 WeakPolarHBondContact CA-O 3.11Å; A962-Q975 WeakPolarHBondContact CB-O 3.4Å; A962-G992 WeakPolarHBondContact CB-O 3.42Å
963	Q	75.4	Confident	69.7	Low	101 Å²	101	79.4 Å²	79.4	47%	0.472	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	157.4	172.4	-63.7	-179.8	-2.9	0	0	110.1	Y965 C974 Q975	Q963-Y965 HydrophobicContact CB-CE2 4.14Å; Q963-Y965 PolarHBondContact OE1-OH 2.9Å; Q963-C974 VanDerWaalsContact O-CA 3.29Å; Q963-C974 WeakPolarHBondContact O-CA 3.03Å; Q963-Q975 PolarHBondContact N-O 2.78Å; Q963-Q975 PolarHBondContact O-N 3.48Å; Q963-Q975 VanDerWaalsContact O-N 3.12Å
964	C	80.1	Confident	70.7	Confident	37 Å²	37	76.9 Å²	76.9	25%	0.25	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138	-177.5	-170.2	0	0	0	0	112	H956 C958 T973	H956-C964 VanDerWaalsContact CD2-SG 3.54Å; C958-C964 VanDerWaalsContact SG-CB 3.55Å; C964-T973 WeakPolarHBondContact CA-O 3.4Å
965	Y	78.2	Confident	71.6	Confident	112 Å²	112	79.4 Å²	79.4	44%	0.439	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	138.3	-177.9	-64	-82.4	0	0	0	112.1	C951 Q963 F972 T973	C951-Y965 VanDerWaalsContact SG-C 3.51Å; Q963-Y965 HydrophobicContact CB-CE2 4.14Å; Q963-Y965 PolarHBondContact OE1-OH 2.9Å; Y965-F972 CarbonylContact O-C 3.46Å; Y965-F972 WeakPolarHBondContact O-CA 3.04Å; Y965-T973 PolarHBondContact N-O 3.07Å; Y965-T973 PolarHBondContact O-N 3.12Å
966	P	63.7	Low	72.5	Confident	67 Å²	67	70.5 Å²	70.5	44%	0.435	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	148.4	176.3	30.6	-32.9	0	0	0	112.3	N949 C951 G971	N949-P966 VanDerWaalsContact OD1-CB 3.3Å; N949-P966 WeakPolarHBondContact OD1-CB 3.37Å; C951-P966 HydrophobicContact CB-CB 3.97Å; C951-P966 HydrophobicContact CB-CG 4.31Å; C951-P966 WeakPolarHBondContact SG-CA 3.19Å; P966-G971 WeakPolarHBondContact CA-O 3.27Å
967	T	63.6	Low	72	Confident	49 Å²	49	70.1 Å²	70.1	30%	0.301	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	148.1	175.1	65.6	0	0	0	0	112.2	T969 G970 G971	T967-T969 PolarHBondContact O-N 3.31Å; T967-T969 PolarHBondContact OG1-OG1 3.47Å; T967-G970 PolarHBondContact O-N 3.45Å; T967-G971 PolarHBondContact N-O 2.05Å; T967-G971 VanDerWaalsContact OG1-C 3.28Å; T967-G971 WeakPolarHBondContact OG1-CA 3.34Å; T967-G971 PolarHBondContact OG1-N 3.05Å; T967-G971 PolarHBondContact OG1-O 3.47Å
968	A	54	Low	71.6	Confident	118 Å²	118	74.4 Å²	74.4	98%	0.975	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-12.3	-175.9	0	0	0	0	0	115
969	T	50.7	Low	70	Confident	137 Å²	137	76 Å²	76	84%	0.84	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	0.3	175	49	0	0	0	0	113.8	T967	T967-T969 PolarHBondContact O-N 3.31Å; T967-T969 PolarHBondContact OG1-OG1 3.47Å
970	G	49.9	Very low	69.6	Low	43 Å²	43	79.1 Å²	79.1	44%	0.443	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	34.5	-178.8	0	0	0	0	0	114.6	P950 T967	P950-G970 WeakPolarHBondContact CG-O 3.29Å; T967-G970 PolarHBondContact O-N 3.45Å
971	G	69.7	Low	69.4	Low	24 Å²	24	75.8 Å²	75.8	25%	0.247	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	-162.8	173.3	0	0	0	0	0	113.4	P966 T967	P966-G971 WeakPolarHBondContact CA-O 3.27Å; T967-G971 PolarHBondContact N-O 2.05Å; T967-G971 VanDerWaalsContact OG1-C 3.28Å; T967-G971 WeakPolarHBondContact OG1-CA 3.34Å; T967-G971 PolarHBondContact OG1-N 3.05Å; T967-G971 PolarHBondContact OG1-O 3.47Å
972	F	76.3	Confident	69.1	Low	73 Å²	73	74.9 Å²	74.9	32%	0.32	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	168.6	177.6	69.9	-93.3	0	0	0	112.8	R955 H956 N957 Y965	R955-F972 WeakPolarHBondContact O-CD1 3.23Å; R955-F972 WeakPolarHBondContact O-CE1 3.03Å; H956-F972 HydrophobicContact CB-CD1 4.1Å; H956-F972 HydrophobicContact CB-CD2 3.72Å; H956-F972 HydrophobicContact CB-CE1 4.19Å; H956-F972 HydrophobicContact CB-CE2 3.83Å; H956-F972 HydrophobicContact CB-CG 3.89Å; H956-F972 HydrophobicContact CB-CZ 4.07Å; N957-F972 VanDerWaalsContact OD1-CE2 3.24Å; N957-F972 WeakPolarHBondContact OD1-CE2 3.35Å; N957-F972 WeakPolarHBondContact OD1-CZ 3.39Å; Y965-F972 CarbonylContact O-C 3.46Å; Y965-F972 WeakPolarHBondContact O-CA 3.04Å
973	T	77.4	Confident	68.6	Low	79 Å²	79	77.5 Å²	77.5	49%	0.485	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	157.5	179.6	-59.4	0	0	0	0	111.2	C964 Y965	C964-T973 WeakPolarHBondContact CA-O 3.4Å; Y965-T973 PolarHBondContact N-O 3.07Å; Y965-T973 PolarHBondContact O-N 3.12Å
974	C	80.6	Confident	68.6	Low	15 Å²	15	73 Å²	73	10%	0.101	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	147.8	-170.4	-56.2	0	0	0	0	113.4	C958 Q963 A991	C958-C974 WeakPolarHBondContact CA-SG 3.12Å; C958-C974 HydrophobicContact CB-CB 3.66Å; C958-C974 WeakPolarHBondContact CB-SG 3.26Å; C958-C974 WeakPolarHBondContact SG-CB 3.46Å; C958-C974 CovalentContact SG-SG 2.03Å; C958-C974 PolarHBondContact SG-SG 3.24Å; Q963-C974 VanDerWaalsContact O-CA 3.29Å; Q963-C974 WeakPolarHBondContact O-CA 3.03Å; C974-A991 VanDerWaalsContact CB-O 3.3Å; C974-A991 WeakPolarHBondContact CB-O 3.17Å
975	Q	75.4	Confident	67.8	Low	116 Å²	116	77.3 Å²	77.3	54%	0.542	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	132.8	179.5	-177.2	-177.3	4	0	0	113.2	A962 Q963	A962-Q975 CarbonylContact C-O 3.58Å; A962-Q975 WeakPolarHBondContact CA-O 3.11Å; A962-Q975 WeakPolarHBondContact CB-O 3.4Å; Q963-Q975 PolarHBondContact N-O 2.78Å; Q963-Q975 PolarHBondContact O-N 3.48Å; Q963-Q975 VanDerWaalsContact O-N 3.12Å
976	C	78.4	Confident	66.5	Low	21 Å²	21	75.2 Å²	75.2	14%	0.142	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	148.5	176.7	-76.1	0	0	0	0	114.1	N961 D982 C995	N961-C976 CarbonylContact O-C 3.33Å; N961-C976 WeakPolarHBondContact O-CA 3.42Å; C976-D982 HydrophobicContact CB-CB 4.43Å; C976-C995 HydrophobicContact CB-CB 3.89Å; C976-C995 WeakPolarHBondContact CB-SG 3.49Å; C976-C995 WeakPolarHBondContact SG-CB 3.39Å; C976-C995 CovalentContact SG-SG 2.04Å; C976-C995 PolarHBondContact SG-SG 3.02Å
977	K	66.7	Low	66.5	Low	85 Å²	85	75.7 Å²	75.7	37%	0.37	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-73.8	150.9	175.6	-70.2	167.4	-173.3	168.4	0	112.4	L960 N961 Y980	L960-K977 PolarHBondContact O-NZ 2.87Å; N961-K977 WeakPolarHBondContact O-CB 3.45Å; N961-K977 VanDerWaalsContact O-CG 3.32Å; N961-K977 WeakPolarHBondContact O-CG 3.35Å; N961-K977 PolarHBondContact O-N 2.92Å; K977-Y980 HydrophobicContact CB-CD2 4.5Å; K977-Y980 PolarHBondContact O-N 3.03Å
978	E	66.6	Low	65.9	Low	197 Å²	197	82.3 Å²	82.3	92%	0.921	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	144.5	178.6	-163.4	167.6	-144.5	0	0	112.5	Y980	E978-Y980 VanDerWaalsContact C-N 3.29Å; E978-Y980 PolarHBondContact O-N 3.46Å
979	G	48.4	Very low	65.8	Low	56 Å²	56	84.8 Å²	84.8	58%	0.577	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	-10.3	-171.1	0	0	0	0	0	115.3
980	Y	71.4	Confident	66.2	Low	99 Å²	99	80.2 Å²	80.2	39%	0.388	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123	176.6	-58.5	-100.2	0	0	0	112	K977 E978 C995 K996	K977-Y980 HydrophobicContact CB-CD2 4.5Å; K977-Y980 PolarHBondContact O-N 3.03Å; E978-Y980 VanDerWaalsContact C-N 3.29Å; E978-Y980 PolarHBondContact O-N 3.46Å; Y980-C995 HydrophobicContact CD1-CB 4.46Å; Y980-C995 HydrophobicContact CG-CB 4.26Å; Y980-K996 CarbonylContact C-O 3.49Å; Y980-K996 WeakPolarHBondContact CA-O 3.06Å
981	L	69.7	Low	67.2	Low	92 Å²	92	79.6 Å²	79.6	48%	0.482	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	129.8	166.3	-176	72.7	0	0	0	110.3	V983 C995 K996	L981-V983 HydrophobicContact CD2-CG1 4.22Å; L981-V983 HydrophobicContact CG-CG1 4.37Å; L981-C995 CarbonylContact O-C 3.56Å; L981-C995 VanDerWaalsContact O-CA 3.28Å; L981-C995 WeakPolarHBondContact O-CA 3.08Å; L981-K996 WeakPolarHBondContact CA-O 3.12Å; L981-K996 WeakPolarHBondContact CB-O 3.36Å; L981-K996 PolarHBondContact N-O 3.44Å; L981-K996 PolarHBondContact O-N 2.89Å
982	D	71.9	Confident	67.5	Low	39 Å²	39	78.5 Å²	78.5	21%	0.209	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	128.4	171.9	-163.5	-29.8	0	0	0	110.2	C976 S984 G992	C976-D982 HydrophobicContact CB-CB 4.43Å; D982-S984 WeakPolarHBondContact OD1-CB 3.25Å; D982-S984 PolarHBondContact OD1-N 2.88Å; D982-S984 PolarHBondContact OD1-OG 2.92Å; D982-G992 PolarHBondContact OD2-N 2.88Å
983	V	73	Confident	67.8	Low	67 Å²	67	77.9 Å²	77.9	41%	0.406	42%	0.424	S	S	.	.			trans	-128.5	26.9	177.3	-61.4	0	0	0	0	111.2	L981 V994 K996	L981-V983 HydrophobicContact CD2-CG1 4.22Å; L981-V983 HydrophobicContact CG-CG1 4.37Å; V983-V994 HydrophobicContact CG2-CB 3.96Å; V983-V994 HydrophobicContact CG2-CG1 3.64Å; V983-V994 PolarHBondContact N-O 3.12Å; V983-K996 HydrophobicContact CG2-CB 4.34Å
984	S	76.1	Confident	67.6	Low	7 Å²	7	77.4 Å²	77.4	5%	0.049	42%	0.421	C	S	.	.			trans	-64.7	139.7	177.7	-53.9	0	0	0	0	111.2	D982 N986 V987 A990 L993 V994	D982-S984 WeakPolarHBondContact OD1-CB 3.25Å; D982-S984 PolarHBondContact OD1-N 2.88Å; D982-S984 PolarHBondContact OD1-OG 2.92Å; S984-N986 PolarHBondContact O-N 2.73Å; S984-V987 WeakPolarHBondContact O-CG2 3.38Å; S984-A990 WeakPolarHBondContact CB-O 3.44Å; S984-L993 PolarHBondContact OG-N 2.94Å; S984-V994 PolarHBondContact OG-N 2.61Å
985	P	63.1	Low	67.3	Low	127 Å²	127	77.6 Å²	77.6	83%	0.825	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.6	-173.7	-28.8	36.1	0	0	0	116.8
986	N	51.1	Low	66.8	Low	68 Å²	68	79 Å²	79	36%	0.364	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.7	86.7	168.2	-173.9	-6.1	0	0	0	110.7	S984 Q988 Q989 A990	S984-N986 PolarHBondContact O-N 2.73Å; N986-Q988 PolarHBondContact O-N 2.71Å; N986-Q988 VanDerWaalsContact O-N 3.11Å; N986-Q988 PolarHBondContact OD1-N 2.8Å; N986-Q989 PolarHBondContact ND2-OE1 3.42Å; N986-Q989 PolarHBondContact O-N 2.05Å; N986-Q989 VanDerWaalsContact O-N 3.16Å; N986-A990 CarbonylContact O-C 3.52Å; N986-A990 PolarHBondContact O-N 3.03Å
987	V	61.8	Low	66.1	Low	77 Å²	77	85.2 Å²	85.2	47%	0.467	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.9	-178.4	-173.6	0	0	0	0	113	S984 A991	S984-V987 WeakPolarHBondContact O-CG2 3.38Å; V987-A991 HydrophobicContact CG1-CB 4.33Å; V987-A991 WeakPolarHBondContact O-CB 3.47Å
988	Q	51.3	Low	65.7	Low	189 Å²	189	86.8 Å²	86.8	88%	0.883	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-22.5	-179.7	-65	-174	0.7	0	0	114.2	N986	N986-Q988 PolarHBondContact O-N 2.71Å; N986-Q988 VanDerWaalsContact O-N 3.11Å; N986-Q988 PolarHBondContact OD1-N 2.8Å
989	Q	52.3	Low	65.4	Low	170 Å²	170	84.6 Å²	84.6	79%	0.794	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-25.2	-178.4	-68.9	-178.2	-13.5	0	0	113.4	N986	N986-Q989 PolarHBondContact ND2-OE1 3.42Å; N986-Q989 PolarHBondContact O-N 2.05Å; N986-Q989 VanDerWaalsContact O-N 3.16Å
990	A	59.9	Low	66.3	Low	41 Å²	41	85.5 Å²	85.5	34%	0.339	45%	0.445	S	S	.	.	S	Bend	trans	-147.1	62.5	-179.4	0	0	0	0	0	110.8	S984 N986 L993	S984-A990 WeakPolarHBondContact CB-O 3.44Å; N986-A990 CarbonylContact O-C 3.52Å; N986-A990 PolarHBondContact O-N 3.03Å; A990-L993 HydrophobicContact CB-CD1 3.68Å; A990-L993 HydrophobicContact CB-CG 4.24Å
991	A	71.4	Confident	66.6	Low	30 Å²	30	83.6 Å²	83.6	25%	0.248	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	156.4	166.7	0	0	0	0	0	111.5	C974 V987 L993	C974-A991 VanDerWaalsContact CB-O 3.3Å; C974-A991 WeakPolarHBondContact CB-O 3.17Å; V987-A991 HydrophobicContact CG1-CB 4.33Å; V987-A991 WeakPolarHBondContact O-CB 3.47Å; A991-L993 PolarHBondContact O-N 3.48Å
992	G	75.2	Confident	67	Low	0 Å²	0	80.9 Å²	80.9	0%	0	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	69	30.2	173.1	0	0	0	0	0	114.9	S959 A962 D982	S959-G992 WeakPolarHBondContact CB-O 3.37Å; S959-G992 PolarHBondContact N-O 3.49Å; A962-G992 WeakPolarHBondContact CB-O 3.42Å; D982-G992 PolarHBondContact OD2-N 2.88Å
993	L	82	Confident	67	Low	60 Å²	60	83.4 Å²	83.4	31%	0.314	45%	0.454	S	S	.	.	S	Bend	trans	-94.1	-36	168.7	-65.7	-177.8	0	0	0	112.5	N957 S959 S984 A990 A991	N957-L993 WeakPolarHBondContact O-CD2 3.37Å; S959-L993 WeakPolarHBondContact CB-O 3.3Å; S959-L993 PolarHBondContact OG-O 3.37Å; S984-L993 PolarHBondContact OG-N 2.94Å; A990-L993 HydrophobicContact CB-CD1 3.68Å; A990-L993 HydrophobicContact CB-CG 4.24Å; A991-L993 PolarHBondContact O-N 3.48Å
994	V	73.1	Confident	66.7	Low	70 Å²	70	83.9 Å²	83.9	42%	0.424	45%	0.454	S	S	.	.			trans	-140.7	128.9	-177.9	-163.9	0	0	0	0	110.9	V983 S984	V983-V994 HydrophobicContact CG2-CB 3.96Å; V983-V994 HydrophobicContact CG2-CG1 3.64Å; V983-V994 PolarHBondContact N-O 3.12Å; S984-V994 PolarHBondContact OG-N 2.61Å
995	C	75.7	Confident	66.2	Low	18 Å²	18	92.6 Å²	92.6	12%	0.122	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.5	-174.4	-36	0	0	0	0	112.4	N961 C976 Y980 L981	N961-C995 HydrophobicContact CB-CB 4.11Å; C976-C995 HydrophobicContact CB-CB 3.89Å; C976-C995 WeakPolarHBondContact CB-SG 3.49Å; C976-C995 WeakPolarHBondContact SG-CB 3.39Å; C976-C995 CovalentContact SG-SG 2.04Å; C976-C995 PolarHBondContact SG-SG 3.02Å; Y980-C995 HydrophobicContact CD1-CB 4.46Å; Y980-C995 HydrophobicContact CG-CB 4.26Å; L981-C995 CarbonylContact O-C 3.56Å; L981-C995 VanDerWaalsContact O-CA 3.28Å; L981-C995 WeakPolarHBondContact O-CA 3.08Å
996	K	64.7	Low	66.5	Low	147 Å²	147	91.1 Å²	91.1	64%	0.639	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	149.6	-172.3	-175.5	-176.4	174.4	-168.7	0	113.5	Y980 L981 V983	Y980-K996 CarbonylContact C-O 3.49Å; Y980-K996 WeakPolarHBondContact CA-O 3.06Å; L981-K996 WeakPolarHBondContact CA-O 3.12Å; L981-K996 WeakPolarHBondContact CB-O 3.36Å; L981-K996 PolarHBondContact N-O 3.44Å; L981-K996 PolarHBondContact O-N 2.89Å; V983-K996 HydrophobicContact CG2-CB 4.34Å
997	Q	62	Low	67.5	Low	150 Å²	150	92.1 Å²	92.1	70%	0.701	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	158.4	-169.9	-163.9	171.6	2.4	0	0	116.1
998	K	59.8	Low	68.1	Low	118 Å²	118	90.1 Å²	90.1	51%	0.513	48%	0.475	S	S	.	.			trans	-106.1	161	177.1	-68.9	-166.7	174.1	-166.5	0	114.3	D1020	K998-D1020 IonicContact NZ-OD1 3.95Å; K998-D1020 PolarHBondContact NZ-OD1 2.78Å
999	I	60.7	Low	69.5	Low	152 Å²	152	85 Å²	85	78%	0.779	45%	0.454	S	S	*	.			trans	-141	168.4	-179.6	-61.3	179.4	0	0	0	109.7
1000	N	66	Low	70.9	Confident	74 Å²	74	78.3 Å²	78.3	40%	0.396	43%	0.426	S	S	.	.			trans	-133	135.9	178.1	162.9	-72.2	0	0	0	109.8	C1002 A1003 D1018	N1000-C1002 PolarHBondContact OD1-N 2.75Å; N1000-A1003 VanDerWaalsContact OD1-CB 3.26Å; N1000-A1003 WeakPolarHBondContact OD1-CB 3.24Å; N1000-A1003 PolarHBondContact OD1-N 3.46Å; N1000-D1018 PolarHBondContact ND2-OD1 2.82Å; N1000-D1018 VanDerWaalsContact ND2-OD1 3.12Å; N1000-D1018 PolarHBondContact ND2-OD2 2.73Å
1001	E	77.4	Confident	71.8	Confident	60 Å²	60	77.9 Å²	77.9	28%	0.28	42%	0.42	S	S	.	.	S	Bend	trans	-101.5	-27.6	-177.7	-70.6	77.2	-160.9	0	0	114.1	A1003 D1004 L1007 D1018 Y1023	E1001-A1003 PolarHBondContact O-N 3.29Å; E1001-D1004 PolarHBondContact O-N 2.9Å; E1001-L1007 HydrophobicContact CB-CB 4.38Å; E1001-L1007 HydrophobicContact CB-CD1 4.35Å; E1001-L1007 HydrophobicContact CG-CD1 4.37Å; E1001-D1018 PolarHBondContact N-OD1 2.86Å; E1001-Y1023 HydrophobicContact CB-CD1 4.16Å
1002	C	78.8	Confident	72.1	Confident	35 Å²	35	84.7 Å²	84.7	24%	0.236	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.3	-177.8	-81	0	0	0	0	114.7	N1000 D1004 C1016 D1018 Y1023	N1000-C1002 PolarHBondContact OD1-N 2.75Å; C1002-D1004 PolarHBondContact O-N 3.08Å; C1002-C1016 PolarHBondContact SG-SG 2.87Å; C1002-D1018 HydrophobicContact CB-CB 3.86Å; C1002-D1018 WeakPolarHBondContact CB-OD1 3.17Å; C1002-D1018 PolarHBondContact N-OD1 3.32Å; C1002-D1018 VanDerWaalsContact SG-CA 3.56Å; C1002-D1018 PolarHBondContact SG-N 2.97Å; C1002-Y1023 VanDerWaalsContact SG-CB 3.54Å
1003	A	72.5	Confident	72.3	Confident	91 Å²	91	87.3 Å²	87.3	75%	0.752	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-22.9	178.9	0	0	0	0	0	114.1	N1000 E1001	N1000-A1003 VanDerWaalsContact OD1-CB 3.26Å; N1000-A1003 WeakPolarHBondContact OD1-CB 3.24Å; N1000-A1003 PolarHBondContact OD1-N 3.46Å; E1001-A1003 PolarHBondContact O-N 3.29Å
1004	D	65.3	Low	72.3	Confident	78 Å²	78	85 Å²	85	42%	0.417	45%	0.45	S	S	.	.			trans	-119.6	122.4	-177.3	-166.7	-32.1	0	0	0	111.8	E1001 C1002 S1006 L1007 N1008	E1001-D1004 PolarHBondContact O-N 2.9Å; C1002-D1004 PolarHBondContact O-N 3.08Å; D1004-S1006 PolarHBondContact O-N 3.24Å; D1004-S1006 WeakPolarHBondContact OD1-CB 3.28Å; D1004-S1006 PolarHBondContact OD1-N 3.04Å; D1004-S1006 PolarHBondContact OD1-OG 2.89Å; D1004-S1006 PolarHBondContact OD2-OG 2.71Å; D1004-L1007 HydrophobicContact CB-CD1 3.98Å; D1004-L1007 HydrophobicContact CB-CG 4.05Å; D1004-L1007 PolarHBondContact O-N 2.04Å; D1004-L1007 VanDerWaalsContact O-N 3.09Å; D1004-N1008 PolarHBondContact O-ND2 2.78Å
1005	K	66.5	Low	72.7	Confident	190 Å²	190	85.3 Å²	85.3	83%	0.826	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.7	176.7	-82.1	-168.6	173.7	-173	0	114	L1007	K1005-L1007 VanDerWaalsContact C-N 3.29Å
1006	S	69.3	Low	73	Confident	95 Å²	95	86.3 Å²	86.3	66%	0.664	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-18.9	174.3	67.6	0	0	0	0	113.1	D1004	D1004-S1006 PolarHBondContact O-N 3.24Å; D1004-S1006 WeakPolarHBondContact OD1-CB 3.28Å; D1004-S1006 PolarHBondContact OD1-N 3.04Å; D1004-S1006 PolarHBondContact OD1-OG 2.89Å; D1004-S1006 PolarHBondContact OD2-OG 2.71Å
1007	L	72.8	Confident	73.7	Confident	90 Å²	90	82 Å²	82	47%	0.471	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-13.3	178.9	-58.4	177.6	0	0	0	113.2	E1001 D1004 K1005 Y1023	E1001-L1007 HydrophobicContact CB-CB 4.38Å; E1001-L1007 HydrophobicContact CB-CD1 4.35Å; E1001-L1007 HydrophobicContact CG-CD1 4.37Å; D1004-L1007 HydrophobicContact CB-CD1 3.98Å; D1004-L1007 HydrophobicContact CB-CG 4.05Å; D1004-L1007 PolarHBondContact O-N 2.04Å; D1004-L1007 VanDerWaalsContact O-N 3.09Å; K1005-L1007 VanDerWaalsContact C-N 3.29Å; L1007-Y1023 WeakPolarHBondContact O-CE1 3.44Å; L1007-Y1023 PolarHBondContact O-OH 2.86Å
1008	N	73	Confident	73.8	Confident	34 Å²	34	78 Å²	78	18%	0.182	43%	0.429	C	S	.	.			trans	-127.5	156.5	-177	71.5	86.3	0	0	0	115.4	D1004 Y1023	D1004-N1008 PolarHBondContact O-ND2 2.78Å; N1008-Y1023 HydrophobicContact CB-CD1 4.24Å; N1008-Y1023 HydrophobicContact CB-CD2 3.77Å; N1008-Y1023 HydrophobicContact CB-CE1 4.05Å; N1008-Y1023 HydrophobicContact CB-CE2 3.55Å; N1008-Y1023 HydrophobicContact CB-CG 4.12Å
1009	N	80.2	Confident	74.1	Confident	83 Å²	83	75.3 Å²	75.3	44%	0.444	42%	0.422	S	S	.	.			trans	-139.1	40.1	-169.5	64.8	5.8	0	0	0	113.9	Y1023 R1042	N1009-Y1023 PolarHBondContact OD1-OH 2.83Å; N1009-R1042 PolarHBondContact O-NE 2.96Å; N1009-R1042 PolarHBondContact OD1-NE 2.95Å; N1009-R1042 VanDerWaalsContact OD1-NE 3.1Å; N1009-R1042 PolarHBondContact OD1-NH2 3.31Å
1010	C	82.9	Confident	73.7	Confident	29 Å²	29	74.6 Å²	74.6	20%	0.196	42%	0.42	C	S	.	.			trans	-70.8	159.7	172.6	-52.7	0	0	0	0	111.8	A1014 C1016 C1025	C1010-A1014 HydrophobicContact CB-CB 4.2Å; C1010-C1016 VanDerWaalsContact SG-CB 3.57Å; C1010-C1025 WeakPolarHBondContact CA-SG 2.93Å; C1010-C1025 HydrophobicContact CB-CB 3.7Å; C1010-C1025 WeakPolarHBondContact CB-SG 3.39Å; C1010-C1025 WeakPolarHBondContact SG-CB 3.1Å; C1010-C1025 CovalentContact SG-SG 2.04Å; C1010-C1025 PolarHBondContact SG-SG 3.03Å
1011	S	79.5	Confident	73.1	Confident	31 Å²	31	77.7 Å²	77.7	22%	0.217	44%	0.442	C	S	.	.			trans	-61.5	152.3	169.4	-158.6	0	0	0	0	111.1	N1013 A1014 G1041 R1042	S1011-N1013 PolarHBondContact O-N 2.95Å; S1011-A1014 WeakPolarHBondContact O-CA 3.22Å; S1011-A1014 WeakPolarHBondContact O-CB 3.35Å; S1011-A1014 PolarHBondContact O-N 2.8Å; S1011-G1041 WeakPolarHBondContact CB-O 3.36Å; S1011-G1041 PolarHBondContact N-O 3Å; S1011-R1042 PolarHBondContact OG-O 3.19Å
1012	E	76.6	Confident	72.6	Confident	174 Å²	174	75.5 Å²	75.5	81%	0.813	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.1	168.3	-178.1	168.9	-153.9	0	0	111.5	A1014 K1028	E1012-A1014 PolarHBondContact O-N 3.47Å; E1012-K1028 WeakPolarHBondContact O-CE 3.07Å; E1012-K1028 PolarHBondContact O-NZ 2.92Å
1013	N	78.6	Confident	72.7	Confident	55 Å²	55	77.2 Å²	77.2	29%	0.294	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	24.4	171.9	-74.2	-24.2	0	0	0	113.4	S1011 C1027 K1028 F1031 C1044	S1011-N1013 PolarHBondContact O-N 2.95Å; N1013-C1027 CarbonylContact O-C 3.47Å; N1013-C1027 WeakPolarHBondContact O-CA 3.28Å; N1013-K1028 WeakPolarHBondContact O-CB 2.97Å; N1013-K1028 WeakPolarHBondContact O-CG 3.26Å; N1013-K1028 PolarHBondContact O-N 2.88Å; N1013-F1031 HydrophobicContact CB-CD1 4.48Å; N1013-F1031 HydrophobicContact CB-CG 4.46Å; N1013-F1031 WeakPolarHBondContact ND2-CE1 3.38Å; N1013-C1044 HydrophobicContact CB-CB 3.79Å; N1013-C1044 PolarHBondContact O-SG 3.48Å
1014	A	82.6	Confident	73.1	Confident	11 Å²	11	76.8 Å²	76.8	9%	0.091	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	172.5	177.1	0	0	0	0	0	113.3	C1010 S1011 E1012 H1026 K1028 G1041	C1010-A1014 HydrophobicContact CB-CB 4.2Å; S1011-A1014 WeakPolarHBondContact O-CA 3.22Å; S1011-A1014 WeakPolarHBondContact O-CB 3.35Å; S1011-A1014 PolarHBondContact O-N 2.8Å; E1012-A1014 PolarHBondContact O-N 3.47Å; A1014-H1026 CarbonylContact C-O 3.57Å; A1014-H1026 WeakPolarHBondContact CA-O 3.43Å; A1014-H1026 WeakPolarHBondContact CB-O 3.3Å; A1014-K1028 VanDerWaalsContact O-CE 3.29Å; A1014-K1028 WeakPolarHBondContact O-CE 3.21Å; A1014-G1041 WeakPolarHBondContact CB-O 3.15Å
1015	V	82.1	Confident	73.9	Confident	76 Å²	76	73.3 Å²	73.3	46%	0.461	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139.8	178.5	-178	0	0	0	0	108.4	C1025 H1026 K1028	V1015-C1025 CarbonylContact O-C 2.85Å; V1015-C1025 WeakPolarHBondContact O-CA 2.96Å; V1015-H1026 PolarHBondContact N-O 2.77Å; V1015-H1026 PolarHBondContact O-N 3.35Å; V1015-K1028 HydrophobicContact CG2-CG 4.1Å
1016	C	81.9	Confident	74.6	Confident	39 Å²	39	68.9 Å²	68.9	26%	0.264	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	141.6	178	-164.5	0	0	0	0	110.6	C1002 C1010 L1024	C1002-C1016 PolarHBondContact SG-SG 2.87Å; C1010-C1016 VanDerWaalsContact SG-CB 3.57Å; C1016-L1024 CarbonylContact C-O 3.39Å; C1016-L1024 VanDerWaalsContact CA-O 3.3Å; C1016-L1024 WeakPolarHBondContact CA-O 3.04Å
1017	T	79.9	Confident	75	Confident	57 Å²	57	66 Å²	66	35%	0.35	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	137.9	-177.8	45	0	0	0	0	112.4	Y1023 L1024	T1017-Y1023 CarbonylContact O-C 3.59Å; T1017-Y1023 WeakPolarHBondContact O-CA 3.3Å; T1017-Y1023 WeakPolarHBondContact O-CB 3.47Å; T1017-L1024 PolarHBondContact N-O 3.25Å; T1017-L1024 PolarHBondContact O-N 3.22Å
1018	D	62.9	Low	74.9	Confident	67 Å²	67	66 Å²	66	36%	0.358	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	149.7	-172.3	-156.9	74.8	0	0	0	111.6	N1000 E1001 C1002	N1000-D1018 PolarHBondContact ND2-OD1 2.82Å; N1000-D1018 VanDerWaalsContact ND2-OD1 3.12Å; N1000-D1018 PolarHBondContact ND2-OD2 2.73Å; E1001-D1018 PolarHBondContact N-OD1 2.86Å; C1002-D1018 HydrophobicContact CB-CB 3.86Å; C1002-D1018 WeakPolarHBondContact CB-OD1 3.17Å; C1002-D1018 PolarHBondContact N-OD1 3.32Å; C1002-D1018 VanDerWaalsContact SG-CA 3.56Å; C1002-D1018 PolarHBondContact SG-N 2.97Å
1019	T	67.5	Low	74.5	Confident	60 Å²	60	70.2 Å²	70.2	37%	0.368	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	159.8	-177	71.4	0	0	0	0	110.8	T1021 G1022	T1019-T1021 PolarHBondContact O-N 3.21Å; T1019-T1021 PolarHBondContact OG1-N 3.27Å; T1019-G1022 WeakPolarHBondContact CA-O 3.08Å; T1019-G1022 WeakPolarHBondContact CB-O 3.41Å; T1019-G1022 PolarHBondContact N-O 3.21Å; T1019-G1022 PolarHBondContact O-N 3.25Å; T1019-G1022 VanDerWaalsContact OG1-C 3.25Å; T1019-G1022 PolarHBondContact OG1-N 3.03Å; T1019-G1022 PolarHBondContact OG1-O 3.1Å
1020	D	50.9	Low	73	Confident	137 Å²	137	67.9 Å²	67.9	73%	0.733	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-2.2	176.1	-78.6	-71.9	0	0	0	115.3	K998	K998-D1020 IonicContact NZ-OD1 3.95Å; K998-D1020 PolarHBondContact NZ-OD1 2.78Å
1021	T	53.4	Low	72.5	Confident	140 Å²	140	69.8 Å²	69.8	86%	0.859	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.6	11.2	-179.7	57.9	0	0	0	0	114.8	T1019	T1019-T1021 PolarHBondContact O-N 3.21Å; T1019-T1021 PolarHBondContact OG1-N 3.27Å
1022	G	68.3	Low	72.2	Confident	14 Å²	14	76.1 Å²	76.1	14%	0.144	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136.2	-147.2	-176.7	0	0	0	0	0	113.6	T1019	T1019-G1022 WeakPolarHBondContact CA-O 3.08Å; T1019-G1022 WeakPolarHBondContact CB-O 3.41Å; T1019-G1022 PolarHBondContact N-O 3.21Å; T1019-G1022 PolarHBondContact O-N 3.25Å; T1019-G1022 VanDerWaalsContact OG1-C 3.25Å; T1019-G1022 PolarHBondContact OG1-N 3.03Å; T1019-G1022 PolarHBondContact OG1-O 3.1Å
1023	Y	80.4	Confident	72	Confident	71 Å²	71	69.3 Å²	69.3	28%	0.278	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	164.8	-175	70.5	-89	0	0	0	115.3	E1001 C1002 L1007 N1008 N1009 T1017	E1001-Y1023 HydrophobicContact CB-CD1 4.16Å; C1002-Y1023 VanDerWaalsContact SG-CB 3.54Å; L1007-Y1023 WeakPolarHBondContact O-CE1 3.44Å; L1007-Y1023 PolarHBondContact O-OH 2.86Å; N1008-Y1023 HydrophobicContact CB-CD1 4.24Å; N1008-Y1023 HydrophobicContact CB-CD2 3.77Å; N1008-Y1023 HydrophobicContact CB-CE1 4.05Å; N1008-Y1023 HydrophobicContact CB-CE2 3.55Å; N1008-Y1023 HydrophobicContact CB-CG 4.12Å; N1009-Y1023 PolarHBondContact OD1-OH 2.83Å; T1017-Y1023 CarbonylContact O-C 3.59Å; T1017-Y1023 WeakPolarHBondContact O-CA 3.3Å; T1017-Y1023 WeakPolarHBondContact O-CB 3.47Å
1024	L	80.8	Confident	71.3	Confident	81 Å²	81	71 Å²	71	42%	0.424	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	158.8	-177.3	-178.3	60.6	0	0	0	112.7	C1016 T1017	C1016-L1024 CarbonylContact C-O 3.39Å; C1016-L1024 VanDerWaalsContact CA-O 3.3Å; C1016-L1024 WeakPolarHBondContact CA-O 3.04Å; T1017-L1024 PolarHBondContact N-O 3.25Å; T1017-L1024 PolarHBondContact O-N 3.22Å
1025	C	82.1	Confident	70.5	Confident	5 Å²	5	72 Å²	72	3%	0.034	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.2	-174.5	-59.8	0	0	0	0	113.7	C1010 V1015	C1010-C1025 WeakPolarHBondContact CA-SG 2.93Å; C1010-C1025 HydrophobicContact CB-CB 3.7Å; C1010-C1025 WeakPolarHBondContact CB-SG 3.39Å; C1010-C1025 WeakPolarHBondContact SG-CB 3.1Å; C1010-C1025 CovalentContact SG-SG 2.04Å; C1010-C1025 PolarHBondContact SG-SG 3.03Å; V1015-C1025 CarbonylContact O-C 2.85Å; V1015-C1025 WeakPolarHBondContact O-CA 2.96Å
1026	H	81.2	Confident	69.6	Low	98 Å²	98	72.4 Å²	72.4	45%	0.454	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	135.9	177.9	-59.6	-45.8	0	0	0	113.9	A1014 V1015	A1014-H1026 CarbonylContact C-O 3.57Å; A1014-H1026 WeakPolarHBondContact CA-O 3.43Å; A1014-H1026 WeakPolarHBondContact CB-O 3.3Å; V1015-H1026 PolarHBondContact N-O 2.77Å; V1015-H1026 PolarHBondContact O-N 3.35Å
1027	C	77.8	Confident	68.3	Low	34 Å²	34	79 Å²	79	23%	0.23	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	146.3	177	-69.5	0	0	0	0	113.5	N1013 C1044	N1013-C1027 CarbonylContact O-C 3.47Å; N1013-C1027 WeakPolarHBondContact O-CA 3.28Å; C1027-C1044 VanDerWaalsContact CA-SG 3.58Å; C1027-C1044 HydrophobicContact CB-CB 3.8Å; C1027-C1044 WeakPolarHBondContact CB-SG 3.45Å; C1027-C1044 WeakPolarHBondContact SG-CB 3.45Å; C1027-C1044 CovalentContact SG-SG 2.04Å; C1027-C1044 PolarHBondContact SG-SG 3.45Å
1028	K	71.1	Confident	67.3	Low	89 Å²	89	84.2 Å²	84.2	39%	0.387	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-74.2	151.4	176.9	-67.7	169.5	-176.2	167.4	0	111.8	E1012 N1013 A1014 V1015 F1031	E1012-K1028 WeakPolarHBondContact O-CE 3.07Å; E1012-K1028 PolarHBondContact O-NZ 2.92Å; N1013-K1028 WeakPolarHBondContact O-CB 2.97Å; N1013-K1028 WeakPolarHBondContact O-CG 3.26Å; N1013-K1028 PolarHBondContact O-N 2.88Å; A1014-K1028 VanDerWaalsContact O-CE 3.29Å; A1014-K1028 WeakPolarHBondContact O-CE 3.21Å; V1015-K1028 HydrophobicContact CG2-CG 4.1Å; K1028-F1031 HydrophobicContact CB-CD2 4.4Å; K1028-F1031 PolarHBondContact O-N 2.96Å; K1028-F1031 VanDerWaalsContact O-N 3.12Å
1029	S	64.2	Low	67.3	Low	123 Å²	123	85 Å²	85	86%	0.86	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	142.3	175.5	-52.5	0	0	0	0	112.5	F1031	S1029-F1031 VanDerWaalsContact C-N 3.28Å
1030	G	49.3	Very low	67.5	Low	35 Å²	35	85 Å²	85	36%	0.361	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	-8.5	-171.6	0	0	0	0	0	114.6	D1047	G1030-D1047 PolarHBondContact O-N 2.94Å
1031	F	71.9	Confident	68.7	Low	69 Å²	69	78.5 Å²	78.5	30%	0.303	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.3	175.8	-58.6	-97.1	0	0	0	112.5	N1013 K1028 S1029 C1044 V1045 Q1046	N1013-F1031 HydrophobicContact CB-CD1 4.48Å; N1013-F1031 HydrophobicContact CB-CG 4.46Å; N1013-F1031 WeakPolarHBondContact ND2-CE1 3.38Å; K1028-F1031 HydrophobicContact CB-CD2 4.4Å; K1028-F1031 PolarHBondContact O-N 2.96Å; K1028-F1031 VanDerWaalsContact O-N 3.12Å; S1029-F1031 VanDerWaalsContact C-N 3.28Å; F1031-C1044 HydrophobicContact CB-CB 3.71Å; F1031-C1044 HydrophobicContact CG-CB 4.41Å; F1031-V1045 CarbonylContact C-O 3.5Å; F1031-V1045 VanDerWaalsContact CA-O 3.23Å; F1031-V1045 WeakPolarHBondContact CA-O 3.47Å; F1031-Q1046 HydrophobicContact CD1-CB 4.45Å; F1031-Q1046 HydrophobicContact CE1-CB 4.39Å
1032	R	72.8	Confident	70.1	Confident	164 Å²	164	76.3 Å²	76.3	62%	0.619	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	134.9	172.2	166.1	177.8	167	-178.2	-4.9	110.7	C1044 V1045	R1032-C1044 CarbonylContact O-C 3.44Å; R1032-C1044 WeakPolarHBondContact O-CA 3.04Å; R1032-V1045 PolarHBondContact N-O 3.22Å; R1032-V1045 PolarHBondContact O-N 3.15Å
1033	D	72.2	Confident	70.2	Confident	31 Å²	31	82 Å²	82	17%	0.166	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	134.6	172.2	-164.8	-35.2	0	0	0	110.8	S1035 P1036 P1040 G1041 K1043	D1033-S1035 PolarHBondContact OD1-N 3.41Å; D1033-P1036 HydrophobicContact CB-CG 4.15Å; D1033-P1040 WeakPolarHBondContact OD2-CA 3.39Å; D1033-G1041 PolarHBondContact OD2-N 2.63Å; D1033-K1043 WeakPolarHBondContact CA-O 3.18Å
1034	L	65.1	Low	70.2	Confident	91 Å²	91	79.2 Å²	79.2	48%	0.476	41%	0.412	S	S	.	.	S	Bend	trans	-93.4	-6.2	177.8	-70.4	-178.6	0	0	0	114.1	K1043 V1045	L1034-K1043 HydrophobicContact CB-CB 4.29Å; L1034-K1043 PolarHBondContact N-O 3.14Å; L1034-V1045 HydrophobicContact CD1-CG1 3.67Å; L1034-V1045 HydrophobicContact CD1-CG2 4.02Å; L1034-V1045 HydrophobicContact CD2-CG2 3.84Å; L1034-V1045 HydrophobicContact CG-CG1 4.19Å; L1034-V1045 HydrophobicContact CG-CG2 3.79Å
1035	S	65.4	Low	69.6	Low	32 Å²	32	78.3 Å²	78.3	22%	0.224	41%	0.409	C	S	.	.			trans	-145.8	54.1	179.6	-56	0	0	0	0	113.1	D1033 L1037 Q1038 L1039	D1033-S1035 PolarHBondContact OD1-N 3.41Å; S1035-L1037 PolarHBondContact O-N 3.37Å; S1035-Q1038 PolarHBondContact O-N 2.94Å; S1035-Q1038 VanDerWaalsContact O-N 3.09Å; S1035-L1039 CarbonylContact O-C 3.6Å; S1035-L1039 PolarHBondContact O-N 3.16Å
1036	P	61.9	Low	68.6	Low	84 Å²	84	84.6 Å²	84.6	55%	0.545	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-24.8	-166.4	-18.5	30.7	0	0	0	114.9	D1033	D1033-P1036 HydrophobicContact CB-CG 4.15Å
1037	L	55.5	Low	67.9	Low	178 Å²	178	82 Å²	82	93%	0.932	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-12.8	-177.3	-61.9	175.4	0	0	0	113.8	S1035	S1035-L1037 PolarHBondContact O-N 3.37Å
1038	Q	57.9	Low	67	Low	165 Å²	165	83.8 Å²	83.8	77%	0.771	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	-37.1	-166.5	-147.2	175.1	32.2	0	0	112.9	S1035	S1035-Q1038 PolarHBondContact O-N 2.94Å; S1035-Q1038 VanDerWaalsContact O-N 3.09Å
1039	L	64.6	Low	66.6	Low	85 Å²	85	81.4 Å²	81.4	45%	0.445	43%	0.428	S	S	.	.	S	Bend	trans	-146.7	61.9	175.1	-67.4	174.7	0	0	0	110.2	S1035 G1041 R1042	S1035-L1039 CarbonylContact O-C 3.6Å; S1035-L1039 PolarHBondContact O-N 3.16Å; L1039-G1041 PolarHBondContact O-N 3.5Å; L1039-R1042 HydrophobicContact CB-CB 4.19Å; L1039-R1042 VanDerWaalsContact CD2-NH1 3.31Å; L1039-R1042 WeakPolarHBondContact O-CB 3.38Å; L1039-R1042 PolarHBondContact O-N 3.12Å; L1039-R1042 VanDerWaalsContact O-N 3.17Å
1040	P	70.9	Confident	66.4	Low	58 Å²	58	81.4 Å²	81.4	38%	0.377	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	136.7	-175.6	21.7	-33.3	0	0	0	112.4	D1033 R1042	D1033-P1040 WeakPolarHBondContact OD2-CA 3.39Å; P1040-R1042 VanDerWaalsContact C-N 3.25Å; P1040-R1042 PolarHBondContact O-N 3.48Å
1041	G	75.8	Confident	66.7	Low	1 Å²	1	82.4 Å²	82.4	1%	0.01	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	15.1	-180	0	0	0	0	0	114.7	S1011 A1014 D1033 L1039	S1011-G1041 WeakPolarHBondContact CB-O 3.36Å; S1011-G1041 PolarHBondContact N-O 3Å; A1014-G1041 WeakPolarHBondContact CB-O 3.15Å; D1033-G1041 PolarHBondContact OD2-N 2.63Å; L1039-G1041 PolarHBondContact O-N 3.5Å
1042	R	82.4	Confident	65.8	Low	94 Å²	94	83.8 Å²	83.8	36%	0.355	43%	0.427	S	S	.	.	S	Bend	trans	-108.8	-19	178.8	-60.3	-170.4	178.3	133.9	6.2	114.9	N1009 S1011 L1039 P1040	N1009-R1042 PolarHBondContact O-NE 2.96Å; N1009-R1042 PolarHBondContact OD1-NE 2.95Å; N1009-R1042 VanDerWaalsContact OD1-NE 3.1Å; N1009-R1042 PolarHBondContact OD1-NH2 3.31Å; S1011-R1042 PolarHBondContact OG-O 3.19Å; L1039-R1042 HydrophobicContact CB-CB 4.19Å; L1039-R1042 VanDerWaalsContact CD2-NH1 3.31Å; L1039-R1042 WeakPolarHBondContact O-CB 3.38Å; L1039-R1042 PolarHBondContact O-N 3.12Å; L1039-R1042 VanDerWaalsContact O-N 3.17Å; P1040-R1042 VanDerWaalsContact C-N 3.25Å; P1040-R1042 PolarHBondContact O-N 3.48Å
1043	K	71.2	Confident	64.8	Low	133 Å²	133	84.2 Å²	84.2	58%	0.578	44%	0.436	S	S	*	.			trans	-134.2	105.3	172.3	-80	-175	174.4	179.6	0	111.9	D1033 L1034	D1033-K1043 WeakPolarHBondContact CA-O 3.18Å; L1034-K1043 HydrophobicContact CB-CB 4.29Å; L1034-K1043 PolarHBondContact N-O 3.14Å
1044	C	79.2	Confident	64.2	Low	14 Å²	14	90.2 Å²	90.2	10%	0.095	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	128.8	-177	-40.3	0	0	0	0	111.5	N1013 C1027 F1031 R1032	N1013-C1044 HydrophobicContact CB-CB 3.79Å; N1013-C1044 PolarHBondContact O-SG 3.48Å; C1027-C1044 VanDerWaalsContact CA-SG 3.58Å; C1027-C1044 HydrophobicContact CB-CB 3.8Å; C1027-C1044 WeakPolarHBondContact CB-SG 3.45Å; C1027-C1044 WeakPolarHBondContact SG-CB 3.45Å; C1027-C1044 CovalentContact SG-SG 2.04Å; C1027-C1044 PolarHBondContact SG-SG 3.45Å; F1031-C1044 HydrophobicContact CB-CB 3.71Å; F1031-C1044 HydrophobicContact CG-CB 4.41Å; R1032-C1044 CarbonylContact O-C 3.44Å; R1032-C1044 WeakPolarHBondContact O-CA 3.04Å
1045	V	68.5	Low	64	Low	62 Å²	62	86.8 Å²	86.8	38%	0.376	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153.9	-177.8	-60	0	0	0	0	112.8	F1031 R1032 L1034	F1031-V1045 CarbonylContact C-O 3.5Å; F1031-V1045 VanDerWaalsContact CA-O 3.23Å; F1031-V1045 WeakPolarHBondContact CA-O 3.47Å; R1032-V1045 PolarHBondContact N-O 3.22Å; R1032-V1045 PolarHBondContact O-N 3.15Å; L1034-V1045 HydrophobicContact CD1-CG1 3.67Å; L1034-V1045 HydrophobicContact CD1-CG2 4.02Å; L1034-V1045 HydrophobicContact CD2-CG2 3.84Å; L1034-V1045 HydrophobicContact CG-CG1 4.19Å; L1034-V1045 HydrophobicContact CG-CG2 3.79Å
1046	Q	62.5	Low	64.2	Low	136 Å²	136	88.9 Å²	88.9	64%	0.636	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	149.3	-167.8	-165.9	171.2	-3	0	0	114	F1031	F1031-Q1046 HydrophobicContact CD1-CB 4.45Å; F1031-Q1046 HydrophobicContact CE1-CB 4.39Å
1047	D	64.7	Low	65	Low	44 Å²	44	85.4 Å²	85.4	24%	0.235	43%	0.426	C	S	.	.			trans	-114.9	131.4	179.1	-174.3	-7.4	0	0	0	111.9	G1030 C1049 Q1050	G1030-D1047 PolarHBondContact O-N 2.94Å; D1047-C1049 PolarHBondContact OD1-N 3.07Å; D1047-Q1050 HydrophobicContact CB-CG 4.39Å; D1047-Q1050 PolarHBondContact OD2-NE2 3Å
1048	I	60.1	Low	65.6	Low	72 Å²	72	79.1 Å²	79.1	37%	0.369	39%	0.39	S	S	.	.	S	Bend	trans	-87.2	-32.7	-175.1	-56.8	174.2	0	0	0	112.1	Q1050 L1051	I1048-Q1050 PolarHBondContact O-N 3.44Å; I1048-L1051 PolarHBondContact O-N 3.06Å
1049	C	62	Low	66.1	Low	38 Å²	38	80.8 Å²	80.8	26%	0.257	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-22	-179.1	-79.2	0	0	0	0	112.5	D1047 L1051 C1062	D1047-C1049 PolarHBondContact OD1-N 3.07Å; C1049-L1051 VanDerWaalsContact C-N 3.3Å; C1049-C1062 VanDerWaalsContact SG-SG 3.7Å
1050	Q	60.3	Low	66.1	Low	123 Å²	123	78.2 Å²	78.2	58%	0.575	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-2.6	176	-60.3	-177.3	42.5	0	0	113.4	D1047 I1048 P1052	D1047-Q1050 HydrophobicContact CB-CG 4.39Å; D1047-Q1050 PolarHBondContact OD2-NE2 3Å; I1048-Q1050 PolarHBondContact O-N 3.44Å; Q1050-P1052 WeakPolarHBondContact O-CD 3.16Å
1051	L	55.5	Low	66.3	Low	57 Å²	57	78.4 Å²	78.4	30%	0.298	38%	0.376	S	S	.	.			trans	-107.7	95.9	-177.9	-61.6	174	0	0	0	110.6	I1048 C1049 E1053 Y1054 N1055	I1048-L1051 PolarHBondContact O-N 3.06Å; C1049-L1051 VanDerWaalsContact C-N 3.3Å; L1051-E1053 PolarHBondContact O-N 3.28Å; L1051-E1053 VanDerWaalsContact O-N 3.13Å; L1051-Y1054 HydrophobicContact CB-CD2 4.07Å; L1051-Y1054 PolarHBondContact O-N 3.4Å; L1051-N1055 PolarHBondContact O-ND2 3Å; L1051-N1055 VanDerWaalsContact O-ND2 3.16Å
1052	P	53	Low	65.9	Low	98 Å²	98	79.4 Å²	79.4	64%	0.636	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-68.7	-10.8	-174.4	28.7	-36.3	0	0	0	114.3	Q1050 Y1054	Q1050-P1052 WeakPolarHBondContact O-CD 3.16Å; P1052-Y1054 VanDerWaalsContact C-N 3.26Å; P1052-Y1054 PolarHBondContact O-N 3.14Å
1053	E	52.7	Low	65.2	Low	173 Å²	173	82.3 Å²	82.3	81%	0.808	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-74.2	-15.8	176.3	-61.7	178.8	155.5	0	0	113	L1051	L1051-E1053 PolarHBondContact O-N 3.28Å; L1051-E1053 VanDerWaalsContact O-N 3.13Å
1054	Y	59.7	Low	64.9	Low	157 Å²	157	79.1 Å²	79.1	62%	0.616	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-112.8	4	-173.5	-68.2	-86.2	0	0	0	114.4	L1051 P1052 Y1072	L1051-Y1054 HydrophobicContact CB-CD2 4.07Å; L1051-Y1054 PolarHBondContact O-N 3.4Å; P1052-Y1054 VanDerWaalsContact C-N 3.26Å; P1052-Y1054 PolarHBondContact O-N 3.14Å; Y1054-Y1072 WeakPolarHBondContact O-CE1 3.31Å
1055	N	59.6	Low	64	Low	19 Å²	19	83 Å²	83	10%	0.102	40%	0.404	C	S	.	.			trans	-135.7	139.5	176.3	70.2	92.2	0	0	0	113.4	L1051 G1060 C1062 Y1072	L1051-N1055 PolarHBondContact O-ND2 3Å; L1051-N1055 VanDerWaalsContact O-ND2 3.16Å; N1055-G1060 WeakPolarHBondContact OD1-CA 3.28Å; N1055-C1062 HydrophobicContact CB-CB 4.3Å; N1055-Y1072 WeakPolarHBondContact CA-OH 3.27Å; N1055-Y1072 HydrophobicContact CB-CD2 4.12Å; N1055-Y1072 HydrophobicContact CB-CE1 4.28Å; N1055-Y1072 HydrophobicContact CB-CE2 3.78Å
1056	D	70.4	Confident	63.1	Low	76 Å²	76	81.7 Å²	81.7	41%	0.406	40%	0.395	S	S	.	.			trans	-100.6	22.6	-172	70.1	-2.5	0	0	0	114.8	Y1072 R1093	D1056-Y1072 PolarHBondContact N-OH 2.9Å; D1056-R1093 IonicContact OD1-CZ 3.11Å; D1056-R1093 IonicContact OD1-NE 2.71Å; D1056-R1093 IonicContact OD1-NH1 2.68Å; D1056-R1093 IonicContact OD1-NH2 2.7Å; D1056-R1093 PolarHBondContact OD1-NH2 2.88Å; D1056-R1093 IonicContact OD2-CZ 3.19Å; D1056-R1093 IonicContact OD2-NE 2.77Å; D1056-R1093 IonicContact OD2-NH1 2.67Å; D1056-R1093 PolarHBondContact OD2-NH1 3.17Å; D1056-R1093 IonicContact OD2-NH2 2.7Å; D1056-R1093 PolarHBondContact OD2-NH2 3.03Å
1057	C	78.4	Confident	62.4	Low	10 Å²	10	79 Å²	79	7%	0.068	40%	0.397	C	S	.	.	S	Bend	trans	-87.2	145.2	-174.5	-53.3	0	0	0	0	113	R1059 G1060 R1061 C1062 C1074	C1057-R1059 PolarHBondContact O-N 2.96Å; C1057-G1060 PolarHBondContact O-N 2.88Å; C1057-R1061 VanDerWaalsContact CB-O 3.27Å; C1057-R1061 WeakPolarHBondContact CB-O 3.06Å; C1057-C1062 HydrophobicContact CB-CB 4.37Å; C1057-C1074 WeakPolarHBondContact CA-SG 3.46Å; C1057-C1074 HydrophobicContact CB-CB 3.63Å; C1057-C1074 WeakPolarHBondContact CB-SG 3.29Å; C1057-C1074 WeakPolarHBondContact SG-CA 3.07Å; C1057-C1074 WeakPolarHBondContact SG-CB 3.5Å; C1057-C1074 CovalentContact SG-SG 2.04Å; C1057-C1074 PolarHBondContact SG-SG 3.14Å
1058	W	67.6	Low	61.6	Low	47 Å²	47	85.8 Å²	85.8	18%	0.178	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-61.6	113.9	-178	-173.2	81.9	0	0	0	111.6	G1060 R1061 P1078 F1081 G1092 C1095	W1058-G1060 VanDerWaalsContact C-N 3.32Å; W1058-R1061 PolarHBondContact O-NE 2.93Å; W1058-P1078 HydrophobicContact CH2-CG 4.06Å; W1058-P1078 HydrophobicContact CZ3-CG 3.71Å; W1058-F1081 AromaticContact CH2-CD1 3.99Å; W1058-F1081 HydrophobicContact CH2-CD1 3.99Å; W1058-F1081 AromaticContact CH2-CE1 3.98Å; W1058-F1081 HydrophobicContact CH2-CE1 3.98Å; W1058-F1081 HydrophobicContact CH2-CG 4.28Å; W1058-F1081 HydrophobicContact CH2-CZ 4.27Å; W1058-F1081 AromaticContact CZ2-CD1 3.88Å; W1058-F1081 HydrophobicContact CZ2-CD1 3.88Å; W1058-F1081 AromaticContact CZ2-CE1 3.88Å; W1058-F1081 HydrophobicContact CZ2-CE1 3.88Å; W1058-G1092 WeakPolarHBondContact CB-O 3.32Å; W1058-G1092 PolarHBondContact N-O 2.81Å; W1058-G1092 VanDerWaalsContact N-O 3.15Å; W1058-C1095 HydrophobicContact CD2-CB 3.81Å; W1058-C1095 VanDerWaalsContact CD2-SG 3.57Å; W1058-C1095 HydrophobicContact CE3-CB 4.22Å; W1058-C1095 HydrophobicContact CG-CB 4.25Å; W1058-C1095 HydrophobicContact CH2-CB 4.13Å; W1058-C1095 HydrophobicContact CZ2-CB 3.74Å; W1058-C1095 HydrophobicContact CZ3-CB 4.37Å; W1058-C1095 PolarHBondContact NE1-O 3.29Å
1059	R	68.3	Low	61.1	Low	200 Å²	200	89.6 Å²	89.6	76%	0.755	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	59.3	33.4	-172.8	-61.8	179.1	165.5	-174.4	-4.9	114.4	C1057 R1061	C1057-R1059 PolarHBondContact O-N 2.96Å; R1059-R1061 VanDerWaalsContact C-N 3.27Å; R1059-R1061 PolarHBondContact O-N 2.94Å
1060	G	65	Low	60.6	Low	31 Å²	31	89.5 Å²	89.5	32%	0.32	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	73.8	12.3	172.9	0	0	0	0	0	115.2	N1055 C1057 W1058 C1062	N1055-G1060 WeakPolarHBondContact OD1-CA 3.28Å; C1057-G1060 PolarHBondContact O-N 2.88Å; W1058-G1060 VanDerWaalsContact C-N 3.32Å; G1060-C1062 VanDerWaalsContact C-N 3.34Å; G1060-C1062 PolarHBondContact O-N 3.5Å; G1060-C1062 PolarHBondContact O-SG 3.2Å
1061	R	74.7	Confident	60.3	Low	62 Å²	62	89 Å²	89	23%	0.234	44%	0.444	C	S	.	.			trans	-74.7	85.5	179.8	-65.7	-173.6	-56.8	134.3	8.8	110.9	C1057 W1058 R1059 C1074 E1075 P1076	C1057-R1061 VanDerWaalsContact CB-O 3.27Å; C1057-R1061 WeakPolarHBondContact CB-O 3.06Å; W1058-R1061 PolarHBondContact O-NE 2.93Å; R1059-R1061 VanDerWaalsContact C-N 3.27Å; R1059-R1061 PolarHBondContact O-N 2.94Å; R1061-C1074 WeakPolarHBondContact O-CA 3.35Å; R1061-E1075 HydrophobicContact CB-CB 4.1Å; R1061-E1075 HydrophobicContact CB-CG 4.19Å; R1061-E1075 IonicContact NH1-OE2 3.74Å; R1061-E1075 PolarHBondContact NH1-OE2 3.11Å; R1061-E1075 PolarHBondContact NH2-O 2.6Å; R1061-E1075 PolarHBondContact O-N 2.83Å; R1061-P1076 VanDerWaalsContact CZ-O 3.29Å; R1061-P1076 PolarHBondContact NH1-O 2.87Å; R1061-P1076 PolarHBondContact NH2-O 3.11Å
1062	C	67.9	Low	61.2	Low	22 Å²	22	89.9 Å²	89.9	15%	0.149	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151	-177.8	65.2	0	0	0	0	111.6	C1049 N1055 C1057 G1060 Y1072 A1073	C1049-C1062 VanDerWaalsContact SG-SG 3.7Å; N1055-C1062 HydrophobicContact CB-CB 4.3Å; C1057-C1062 HydrophobicContact CB-CB 4.37Å; G1060-C1062 VanDerWaalsContact C-N 3.34Å; G1060-C1062 PolarHBondContact O-N 3.5Å; G1060-C1062 PolarHBondContact O-SG 3.2Å; C1062-Y1072 HydrophobicContact CB-CD2 4.25Å; C1062-A1073 CarbonylContact C-O 3.46Å; C1062-A1073 VanDerWaalsContact CA-O 3.27Å; C1062-A1073 WeakPolarHBondContact CA-O 3.31Å
1063	R	68.6	Low	62	Low	155 Å²	155	86.5 Å²	86.5	59%	0.585	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	132.8	168.3	66	-174.1	-179.9	104.6	0.3	109.8	Y1072 A1073	R1063-Y1072 CarbonylContact O-C 3.44Å; R1063-Y1072 WeakPolarHBondContact O-CA 3.16Å; R1063-Y1072 WeakPolarHBondContact O-CB 3.1Å; R1063-A1073 HydrophobicContact CG-CB 4.35Å; R1063-A1073 PolarHBondContact N-O 3.42Å; R1063-A1073 PolarHBondContact O-N 3.42Å
1064	T	64.4	Low	63.2	Low	65 Å²	65	79.7 Å²	79.7	40%	0.399	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	136.4	168.5	19.2	0	0	0	0	110.1	Q1071	T1064-Q1071 WeakPolarHBondContact CA-O 3.14Å
1065	I	59.5	Low	64.1	Low	95 Å²	95	76.4 Å²	76.4	49%	0.487	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-40.4	177.8	-60	173.1	0	0	0	109.8	Q1071 A1073	I1065-Q1071 HydrophobicContact CB-CB 4.22Å; I1065-Q1071 PolarHBondContact N-O 2.88Å; I1065-A1073 HydrophobicContact CD1-CB 3.96Å
1066	D	49.6	Very low	64.9	Low	36 Å²	36	79.9 Å²	79.9	19%	0.193	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	117.2	177.8	-174.3	-34.2	0	0	0	108.6	E1068 K1069 G1070 Q1071	D1066-E1068 PolarHBondContact OD1-N 3.09Å; D1066-K1069 HydrophobicContact CB-CB 4.19Å; D1066-K1069 PolarHBondContact OD1-N 2.04Å; D1066-K1069 WeakPolarHBondContact OD2-CD 3.43Å; D1066-K1069 WeakPolarHBondContact OD2-CG 3.07Å; D1066-K1069 IonicContact OD2-NZ 2.97Å; D1066-K1069 PolarHBondContact OD2-NZ 3.42Å; D1066-G1070 WeakPolarHBondContact O-CA 3.47Å; D1066-G1070 PolarHBondContact O-N 2.9Å; D1066-Q1071 HydrophobicContact CB-CB 4.49Å; D1066-Q1071 PolarHBondContact O-N 2.88Å; D1066-Q1071 VanDerWaalsContact O-N 3.17Å
1067	A	48.7	Very low	65	Low	80 Å²	80	77.5 Å²	77.5	66%	0.661	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-17.8	-176.2	0	0	0	0	0	113.7
1068	E	48.3	Very low	64.6	Low	186 Å²	186	79.4 Å²	79.4	87%	0.869	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-29	174.2	-62.9	-172.8	163.1	0	0	111.3	D1066	D1066-E1068 PolarHBondContact OD1-N 3.09Å
1069	K	49	Very low	64.2	Low	152 Å²	152	82.1 Å²	82.1	66%	0.661	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-7.5	178.8	-56.5	-172.5	-165.6	76.6	0	115.1	D1066	D1066-K1069 HydrophobicContact CB-CB 4.19Å; D1066-K1069 PolarHBondContact OD1-N 2.04Å; D1066-K1069 WeakPolarHBondContact OD2-CD 3.43Å; D1066-K1069 WeakPolarHBondContact OD2-CG 3.07Å; D1066-K1069 IonicContact OD2-NZ 2.97Å; D1066-K1069 PolarHBondContact OD2-NZ 3.42Å
1070	G	50.7	Low	63.4	Low	36 Å²	36	75.1 Å²	75.1	37%	0.371	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	73	27.9	175.4	0	0	0	0	0	115.6	D1066	D1066-G1070 WeakPolarHBondContact O-CA 3.47Å; D1066-G1070 PolarHBondContact O-N 2.9Å
1071	Q	54.9	Low	63.6	Low	111 Å²	111	77 Å²	77	52%	0.519	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	143.6	-179.9	-69.7	-173.3	-31.4	0	0	112.5	T1064 I1065 D1066	T1064-Q1071 WeakPolarHBondContact CA-O 3.14Å; I1065-Q1071 HydrophobicContact CB-CB 4.22Å; I1065-Q1071 PolarHBondContact N-O 2.88Å; D1066-Q1071 HydrophobicContact CB-CB 4.49Å; D1066-Q1071 PolarHBondContact O-N 2.88Å; D1066-Q1071 VanDerWaalsContact O-N 3.17Å
1072	Y	73.5	Confident	62.9	Low	77 Å²	77	78.6 Å²	78.6	30%	0.302	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	168.4	178.7	70.4	-92	0	0	0	113.3	Y1054 N1055 D1056 C1062 R1063	Y1054-Y1072 WeakPolarHBondContact O-CE1 3.31Å; N1055-Y1072 WeakPolarHBondContact CA-OH 3.27Å; N1055-Y1072 HydrophobicContact CB-CD2 4.12Å; N1055-Y1072 HydrophobicContact CB-CE1 4.28Å; N1055-Y1072 HydrophobicContact CB-CE2 3.78Å; D1056-Y1072 PolarHBondContact N-OH 2.9Å; C1062-Y1072 HydrophobicContact CB-CD2 4.25Å; R1063-Y1072 CarbonylContact O-C 3.44Å; R1063-Y1072 WeakPolarHBondContact O-CA 3.16Å; R1063-Y1072 WeakPolarHBondContact O-CB 3.1Å
1073	A	70.4	Confident	62.9	Low	27 Å²	27	80.7 Å²	80.7	22%	0.223	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	159.4	169.3	0	0	0	0	0	112.4	C1062 R1063 I1065	C1062-A1073 CarbonylContact C-O 3.46Å; C1062-A1073 VanDerWaalsContact CA-O 3.27Å; C1062-A1073 WeakPolarHBondContact CA-O 3.31Å; R1063-A1073 HydrophobicContact CG-CB 4.35Å; R1063-A1073 PolarHBondContact N-O 3.42Å; R1063-A1073 PolarHBondContact O-N 3.42Å; I1065-A1073 HydrophobicContact CD1-CB 3.96Å
1074	C	77.8	Confident	62.9	Low	30 Å²	30	80.2 Å²	80.2	20%	0.203	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	160.3	-176	-55.7	0	0	0	0	114.4	C1057 R1061	C1057-C1074 WeakPolarHBondContact CA-SG 3.46Å; C1057-C1074 HydrophobicContact CB-CB 3.63Å; C1057-C1074 WeakPolarHBondContact CB-SG 3.29Å; C1057-C1074 WeakPolarHBondContact SG-CA 3.07Å; C1057-C1074 WeakPolarHBondContact SG-CB 3.5Å; C1057-C1074 CovalentContact SG-SG 2.04Å; C1057-C1074 PolarHBondContact SG-SG 3.14Å; R1061-C1074 WeakPolarHBondContact O-CA 3.35Å
1075	E	79.4	Confident	63.3	Low	88 Å²	88	78 Å²	78	41%	0.411	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-100.1	144	177.7	-62.5	-173.6	159.4	0	0	114.5	R1061 G1092	R1061-E1075 HydrophobicContact CB-CB 4.1Å; R1061-E1075 HydrophobicContact CB-CG 4.19Å; R1061-E1075 IonicContact NH1-OE2 3.74Å; R1061-E1075 PolarHBondContact NH1-OE2 3.11Å; R1061-E1075 PolarHBondContact NH2-O 2.6Å; R1061-E1075 PolarHBondContact O-N 2.83Å; E1075-G1092 VanDerWaalsContact O-CA 3.3Å; E1075-G1092 WeakPolarHBondContact O-CA 3.44Å
1076	P	76.2	Confident	63.3	Low	91 Å²	91	79 Å²	79	59%	0.591	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-55.8	156.6	177.9	-26.2	35	0	0	0	115.6	R1061	R1061-P1076 VanDerWaalsContact CZ-O 3.29Å; R1061-P1076 PolarHBondContact NH1-O 2.87Å; R1061-P1076 PolarHBondContact NH2-O 3.11Å
1077	C	72.4	Confident	63.5	Low	27 Å²	27	80.4 Å²	80.4	18%	0.182	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-62.4	140.1	177.2	-67.8	0	0	0	0	113	D1083 C1095	C1077-D1083 HydrophobicContact CB-CB 4.27Å; C1077-D1083 PolarHBondContact SG-OD2 3.12Å; C1077-D1083 VanDerWaalsContact SG-OD2 3.39Å; C1077-C1095 WeakPolarHBondContact CA-SG 3.47Å; C1077-C1095 HydrophobicContact CB-CB 3.73Å; C1077-C1095 WeakPolarHBondContact CB-SG 3.49Å; C1077-C1095 VanDerWaalsContact SG-CA 3.6Å; C1077-C1095 WeakPolarHBondContact SG-CB 3.48Å; C1077-C1095 CovalentContact SG-SG 2.03Å; C1077-C1095 PolarHBondContact SG-SG 2.79Å
1078	P	69.2	Low	63.9	Low	50 Å²	50	82.4 Å²	82.4	33%	0.325	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-77.3	158.5	-178.9	33.1	-37	0	0	0	112.9	W1058 G1080 F1081	W1058-P1078 HydrophobicContact CH2-CG 4.06Å; W1058-P1078 HydrophobicContact CZ3-CG 3.71Å; P1078-G1080 PolarHBondContact O-N 3.09Å; P1078-F1081 HydrophobicContact CG-CD2 3.99Å; P1078-F1081 HydrophobicContact CG-CG 4.48Å; P1078-F1081 PolarHBondContact O-N 2.93Å; P1078-F1081 VanDerWaalsContact O-N 3.13Å
1079	A	59.6	Low	64.5	Low	103 Å²	103	79.9 Å²	79.9	85%	0.851	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	137.8	175.7	0	0	0	0	0	112.2
1080	G	51.3	Low	65.6	Low	53 Å²	53	76.2 Å²	76.2	55%	0.546	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-17.4	-173.3	0	0	0	0	0	114.6	P1078	P1078-G1080 PolarHBondContact O-N 3.09Å
1081	F	69.2	Low	66.3	Low	72 Å²	72	77.5 Å²	77.5	32%	0.316	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	152.6	173.3	-64.9	-108.4	0	0	0	110.8	W1058 P1078 C1095 V1096 P1097	W1058-F1081 AromaticContact CH2-CD1 3.99Å; W1058-F1081 HydrophobicContact CH2-CD1 3.99Å; W1058-F1081 AromaticContact CH2-CE1 3.98Å; W1058-F1081 HydrophobicContact CH2-CE1 3.98Å; W1058-F1081 HydrophobicContact CH2-CG 4.28Å; W1058-F1081 HydrophobicContact CH2-CZ 4.27Å; W1058-F1081 AromaticContact CZ2-CD1 3.88Å; W1058-F1081 HydrophobicContact CZ2-CD1 3.88Å; W1058-F1081 AromaticContact CZ2-CE1 3.88Å; W1058-F1081 HydrophobicContact CZ2-CE1 3.88Å; P1078-F1081 HydrophobicContact CG-CD2 3.99Å; P1078-F1081 HydrophobicContact CG-CG 4.48Å; P1078-F1081 PolarHBondContact O-N 2.93Å; P1078-F1081 VanDerWaalsContact O-N 3.13Å; F1081-C1095 HydrophobicContact CB-CB 3.91Å; F1081-C1095 HydrophobicContact CD1-CB 4.33Å; F1081-C1095 HydrophobicContact CG-CB 4.44Å; F1081-V1096 CarbonylContact C-O 3.38Å; F1081-V1096 VanDerWaalsContact CA-O 3.28Å; F1081-V1096 WeakPolarHBondContact CA-O 3.15Å; F1081-P1097 HydrophobicContact CD1-CB 3.96Å; F1081-P1097 HydrophobicContact CD1-CG 4.38Å; F1081-P1097 HydrophobicContact CE1-CB 3.73Å; F1081-P1097 HydrophobicContact CE1-CG 4Å; F1081-P1097 HydrophobicContact CZ-CB 4.14Å
1082	M	60.8	Low	67.2	Low	95 Å²	95	72.2 Å²	72.2	47%	0.468	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.8	174.7	-55.4	-174.9	74.8	0	0	109.2	C1095 V1096 K1098	M1082-C1095 WeakPolarHBondContact O-CA 3.26Å; M1082-V1096 HydrophobicContact CB-CG2 4.22Å; M1082-V1096 PolarHBondContact N-O 2.8Å; M1082-V1096 PolarHBondContact O-N 2.92Å; M1082-K1098 HydrophobicContact CG-CG 4.29Å; M1082-K1098 HydrophobicContact SD-CD 4.41Å; M1082-K1098 WeakPolarHBondContact SD-CE 3.16Å; M1082-K1098 HydrophobicContact SD-CG 4.2Å
1083	D	67.4	Low	67.5	Low	65 Å²	65	72.3 Å²	72.3	35%	0.348	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	132.3	172.5	-156.6	-35.9	0	0	0	109.8	C1077 S1085 G1092 I1094	C1077-D1083 HydrophobicContact CB-CB 4.27Å; C1077-D1083 PolarHBondContact SG-OD2 3.12Å; C1077-D1083 VanDerWaalsContact SG-OD2 3.39Å; D1083-S1085 WeakPolarHBondContact OD1-CB 3.4Å; D1083-S1085 PolarHBondContact OD1-N 2.58Å; D1083-S1085 PolarHBondContact OD1-OG 2.81Å; D1083-G1092 PolarHBondContact OD2-N 3.42Å; D1083-I1094 WeakPolarHBondContact CA-O 3.42Å
1084	K	69.1	Low	67.5	Low	146 Å²	146	74.6 Å²	74.6	64%	0.635	43%	0.433	S	S	*	.			trans	-135.8	30.3	172.5	-73.3	-160.3	171.4	-168.2	0	111.2	I1094 V1096	K1084-I1094 HydrophobicContact CB-CG2 4.3Å; K1084-I1094 PolarHBondContact N-O 2.03Å; K1084-V1096 HydrophobicContact CD-CG2 4.3Å; K1084-V1096 HydrophobicContact CG-CG2 4.38Å
1085	S	71.6	Confident	67.3	Low	17 Å²	17	73.5 Å²	73.5	12%	0.119	43%	0.426	C	S	.	.			trans	-59.2	133.2	172.5	-53.4	0	0	0	0	109.5	D1083 D1087 R1093 I1094	D1083-S1085 WeakPolarHBondContact OD1-CB 3.4Å; D1083-S1085 PolarHBondContact OD1-N 2.58Å; D1083-S1085 PolarHBondContact OD1-OG 2.81Å; S1085-D1087 VanDerWaalsContact C-N 3.26Å; S1085-D1087 PolarHBondContact O-N 2.99Å; S1085-R1093 PolarHBondContact OG-N 3.13Å; S1085-I1094 PolarHBondContact OG-N 2.67Å
1086	P	60.7	Low	66.5	Low	117 Å²	117	72 Å²	72	76%	0.76	42%	0.422	S	S	*	.	S	Bend	trans	-68.2	-20.8	-169.7	-23.7	35.6	0	0	0	115.3	I1094	P1086-I1094 HydrophobicContact CG-CD1 4.26Å
1087	D	52.5	Low	65.5	Low	65 Å²	65	71.6 Å²	71.6	35%	0.348	42%	0.42	S	S	.	.	S	Bend	trans	-111	118.3	176.6	-178.6	-5.7	0	0	0	109.7	S1085 N1089 L1090	S1085-D1087 VanDerWaalsContact C-N 3.26Å; S1085-D1087 PolarHBondContact O-N 2.99Å; D1087-N1089 PolarHBondContact O-N 3.2Å; D1087-N1089 VanDerWaalsContact O-N 3.1Å; D1087-N1089 WeakPolarHBondContact OD1-CB 3.26Å; D1087-N1089 PolarHBondContact OD1-N 3.18Å; D1087-N1089 PolarHBondContact OD1-ND2 3.11Å; D1087-L1090 HydrophobicContact CB-CB 4.35Å; D1087-L1090 PolarHBondContact O-N 3.36Å
1088	P	58.9	Low	64.4	Low	122 Å²	122	77.6 Å²	77.6	79%	0.792	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-21.6	176	-26.1	35.5	0	0	0	115.1
1089	N	60.6	Low	63.2	Low	133 Å²	133	85 Å²	85	71%	0.711	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-11.3	179.9	-53.7	-79.1	0	0	0	113.2	D1087 P1091	D1087-N1089 PolarHBondContact O-N 3.2Å; D1087-N1089 VanDerWaalsContact O-N 3.1Å; D1087-N1089 WeakPolarHBondContact OD1-CB 3.26Å; D1087-N1089 PolarHBondContact OD1-N 3.18Å; D1087-N1089 PolarHBondContact OD1-ND2 3.11Å; N1089-P1091 VanDerWaalsContact C-CD 3.41Å; N1089-P1091 WeakPolarHBondContact O-CD 3.05Å
1090	L	72.2	Confident	63.1	Low	76 Å²	76	82.4 Å²	82.4	40%	0.398	45%	0.446	S	S	.	.	S	Bend	trans	-125.3	64.6	-176.7	-64.5	173.5	0	0	0	111.3	D1087	D1087-L1090 HydrophobicContact CB-CB 4.35Å; D1087-L1090 PolarHBondContact O-N 3.36Å
1091	P	64.4	Low	63.2	Low	63 Å²	63	82 Å²	82	41%	0.409	43%	0.433	S	S	.	.			trans	-67.4	164.4	-177.4	30.2	-37.3	0	0	0	113.1	N1089	N1089-P1091 VanDerWaalsContact C-CD 3.41Å; N1089-P1091 WeakPolarHBondContact O-CD 3.05Å
1092	G	74.2	Confident	63	Low	0 Å²	0	80.3 Å²	80.3	0%	0	43%	0.43	C	S	.	.	S	Bend	trans	81.2	15.8	172.9	0	0	0	0	0	115.8	W1058 E1075 D1083	W1058-G1092 WeakPolarHBondContact CB-O 3.32Å; W1058-G1092 PolarHBondContact N-O 2.81Å; W1058-G1092 VanDerWaalsContact N-O 3.15Å; E1075-G1092 VanDerWaalsContact O-CA 3.3Å; E1075-G1092 WeakPolarHBondContact O-CA 3.44Å; D1083-G1092 PolarHBondContact OD2-N 3.42Å
1093	R	78.8	Confident	63.1	Low	79 Å²	79	80.6 Å²	80.6	30%	0.298	44%	0.441	S	S	.	.	S	Bend	trans	-96	-34.4	179	-65.7	177.1	170.1	-141.1	-13.9	112.8	D1056 S1085	D1056-R1093 IonicContact OD1-CZ 3.11Å; D1056-R1093 IonicContact OD1-NE 2.71Å; D1056-R1093 IonicContact OD1-NH1 2.68Å; D1056-R1093 IonicContact OD1-NH2 2.7Å; D1056-R1093 PolarHBondContact OD1-NH2 2.88Å; D1056-R1093 IonicContact OD2-CZ 3.19Å; D1056-R1093 IonicContact OD2-NE 2.77Å; D1056-R1093 IonicContact OD2-NH1 2.67Å; D1056-R1093 PolarHBondContact OD2-NH1 3.17Å; D1056-R1093 IonicContact OD2-NH2 2.7Å; D1056-R1093 PolarHBondContact OD2-NH2 3.03Å; S1085-R1093 PolarHBondContact OG-N 3.13Å
1094	I	70.8	Confident	62.3	Low	74 Å²	74	80.1 Å²	80.1	38%	0.379	44%	0.439	S	S	.	.			trans	-131.5	112.4	176.8	-54.9	-177.4	0	0	0	110.2	D1083 K1084 S1085 P1086	D1083-I1094 WeakPolarHBondContact CA-O 3.42Å; K1084-I1094 HydrophobicContact CB-CG2 4.3Å; K1084-I1094 PolarHBondContact N-O 2.03Å; S1085-I1094 PolarHBondContact OG-N 2.67Å; P1086-I1094 HydrophobicContact CG-CD1 4.26Å
1095	C	73.9	Confident	61.7	Low	8 Å²	8	79.3 Å²	79.3	5%	0.054	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.5	177.1	-42.6	0	0	0	0	111.3	W1058 C1077 F1081 M1082	W1058-C1095 HydrophobicContact CD2-CB 3.81Å; W1058-C1095 VanDerWaalsContact CD2-SG 3.57Å; W1058-C1095 HydrophobicContact CE3-CB 4.22Å; W1058-C1095 HydrophobicContact CG-CB 4.25Å; W1058-C1095 HydrophobicContact CH2-CB 4.13Å; W1058-C1095 HydrophobicContact CZ2-CB 3.74Å; W1058-C1095 HydrophobicContact CZ3-CB 4.37Å; W1058-C1095 PolarHBondContact NE1-O 3.29Å; C1077-C1095 WeakPolarHBondContact CA-SG 3.47Å; C1077-C1095 HydrophobicContact CB-CB 3.73Å; C1077-C1095 WeakPolarHBondContact CB-SG 3.49Å; C1077-C1095 VanDerWaalsContact SG-CA 3.6Å; C1077-C1095 WeakPolarHBondContact SG-CB 3.48Å; C1077-C1095 CovalentContact SG-SG 2.03Å; C1077-C1095 PolarHBondContact SG-SG 2.79Å; F1081-C1095 HydrophobicContact CB-CB 3.91Å; F1081-C1095 HydrophobicContact CD1-CB 4.33Å; F1081-C1095 HydrophobicContact CG-CB 4.44Å; M1082-C1095 WeakPolarHBondContact O-CA 3.26Å
1096	V	62.3	Low	61.1	Low	56 Å²	56	83.2 Å²	83.2	34%	0.339	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	137.3	-176.8	-64.4	0	0	0	0	113.7	F1081 M1082 K1084	F1081-V1096 CarbonylContact C-O 3.38Å; F1081-V1096 VanDerWaalsContact CA-O 3.28Å; F1081-V1096 WeakPolarHBondContact CA-O 3.15Å; M1082-V1096 HydrophobicContact CB-CG2 4.22Å; M1082-V1096 PolarHBondContact N-O 2.8Å; M1082-V1096 PolarHBondContact O-N 2.92Å; K1084-V1096 HydrophobicContact CD-CG2 4.3Å; K1084-V1096 HydrophobicContact CG-CG2 4.38Å
1097	P	56.2	Low	61.1	Low	83 Å²	83	83.1 Å²	83.1	54%	0.539	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	157.4	-175.7	33.2	-35	0	0	0	113.8	F1081	F1081-P1097 HydrophobicContact CD1-CB 3.96Å; F1081-P1097 HydrophobicContact CD1-CG 4.38Å; F1081-P1097 HydrophobicContact CE1-CB 3.73Å; F1081-P1097 HydrophobicContact CE1-CG 4Å; F1081-P1097 HydrophobicContact CZ-CB 4.14Å
1098	K	47.8	Very low	61.7	Low	153 Å²	153	81.6 Å²	81.6	67%	0.665	45%	0.454	S	S	*	.			trans	-92.1	145.2	174.5	-57	179.1	-179.4	-178.3	0	111.5	M1082	M1082-K1098 HydrophobicContact CG-CG 4.29Å; M1082-K1098 HydrophobicContact SD-CD 4.41Å; M1082-K1098 WeakPolarHBondContact SD-CE 3.16Å; M1082-K1098 HydrophobicContact SD-CG 4.2Å
1099	K	45.8	Very low	62.3	Low	206 Å²	206	79 Å²	79	90%	0.896	43%	0.434	S	S	*	.			trans	-147.8	163.5	177.9	-79.8	-166.6	171.9	-169.2	0	111.6
1100	S	56.3	Low	63.2	Low	48 Å²	48	74 Å²	74	34%	0.336	41%	0.409	S	S	.	.			trans	-137.6	156.6	-174.3	87.9	0	0	0	0	113.4	S1103 E1118	S1100-S1103 WeakPolarHBondContact O-CB 3.04Å; S1100-S1103 PolarHBondContact O-N 3.23Å; S1100-S1103 PolarHBondContact OG-OG 3.09Å; S1100-E1118 WeakPolarHBondContact CB-OE1 3.17Å; S1100-E1118 WeakPolarHBondContact CB-OE2 3.46Å; S1100-E1118 PolarHBondContact OG-OE1 3.45Å
1101	P	54	Low	63.6	Low	43 Å²	43	71.4 Å²	71.4	28%	0.279	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-73.7	-29.6	-172.2	27.8	-35.9	0	0	0	116.2	S1103 D1104 E1118	P1101-S1103 PolarHBondContact O-N 2.8Å; P1101-S1103 VanDerWaalsContact O-N 3.12Å; P1101-D1104 PolarHBondContact O-N 3Å; P1101-D1104 VanDerWaalsContact O-N 3.11Å; P1101-E1118 VanDerWaalsContact CD-OE1 3.24Å; P1101-E1118 WeakPolarHBondContact CD-OE1 3.08Å; P1101-E1118 HydrophobicContact CG-CG 4.25Å
1102	C	65.3	Low	64.1	Low	38 Å²	38	74.5 Å²	74.5	26%	0.257	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-67.1	-11.3	175.2	-80.4	0	0	0	0	113.3	D1104 C1116 E1118	C1102-D1104 VanDerWaalsContact C-N 3.26Å; C1102-D1104 PolarHBondContact O-N 2.89Å; C1102-C1116 PolarHBondContact SG-SG 2.76Å; C1102-E1118 HydrophobicContact CB-CG 3.75Å; C1102-E1118 WeakPolarHBondContact CB-OE1 3.37Å; C1102-E1118 PolarHBondContact N-OE1 2.76Å; C1102-E1118 WeakPolarHBondContact SG-CG 3.37Å
1103	S	61.5	Low	64.2	Low	100 Å²	100	78.6 Å²	78.6	70%	0.699	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-77	-8.2	173.4	-56.2	0	0	0	0	113.8	S1100 P1101	S1100-S1103 WeakPolarHBondContact O-CB 3.04Å; S1100-S1103 PolarHBondContact O-N 3.23Å; S1100-S1103 PolarHBondContact OG-OG 3.09Å; P1101-S1103 PolarHBondContact O-N 2.8Å; P1101-S1103 VanDerWaalsContact O-N 3.12Å
1104	D	52.5	Low	64.1	Low	56 Å²	56	75.1 Å²	75.1	30%	0.299	41%	0.41	S	S	.	.			trans	-122.2	103.3	-174.1	-171.6	-14.5	0	0	0	111.6	P1101 C1102 S1106 Q1107 N1108	P1101-D1104 PolarHBondContact O-N 3Å; P1101-D1104 VanDerWaalsContact O-N 3.11Å; C1102-D1104 VanDerWaalsContact C-N 3.26Å; C1102-D1104 PolarHBondContact O-N 2.89Å; D1104-S1106 VanDerWaalsContact CG-OG 3.28Å; D1104-S1106 PolarHBondContact O-N 2.84Å; D1104-S1106 VanDerWaalsContact O-N 3.15Å; D1104-S1106 WeakPolarHBondContact OD1-CB 3.09Å; D1104-S1106 PolarHBondContact OD1-N 3.25Å; D1104-S1106 PolarHBondContact OD1-OG 2.99Å; D1104-S1106 PolarHBondContact OD2-OG 2.97Å; D1104-Q1107 HydrophobicContact CB-CG 4.37Å; D1104-Q1107 PolarHBondContact O-N 2.68Å; D1104-Q1107 PolarHBondContact OD2-NE2 2.75Å; D1104-N1108 PolarHBondContact O-ND2 2.88Å
1105	T	55.3	Low	64.5	Low	128 Å²	128	74.3 Å²	74.3	79%	0.785	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-3.1	178.5	48.9	0	0	0	0	114.5
1106	S	59.7	Low	64.7	Low	99 Å²	99	75.8 Å²	75.8	69%	0.692	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-14.1	168.7	72.4	0	0	0	0	113.4	D1104	D1104-S1106 VanDerWaalsContact CG-OG 3.28Å; D1104-S1106 PolarHBondContact O-N 2.84Å; D1104-S1106 VanDerWaalsContact O-N 3.15Å; D1104-S1106 WeakPolarHBondContact OD1-CB 3.09Å; D1104-S1106 PolarHBondContact OD1-N 3.25Å; D1104-S1106 PolarHBondContact OD1-OG 2.99Å; D1104-S1106 PolarHBondContact OD2-OG 2.97Å
1107	Q	59.7	Low	65.5	Low	116 Å²	116	76.8 Å²	76.8	54%	0.542	42%	0.424	S	S	.	.	S	Bend	trans	-108.5	-6.6	-174.3	-62.5	-173	57.6	0	0	114	D1104 Y1124	D1104-Q1107 HydrophobicContact CB-CG 4.37Å; D1104-Q1107 PolarHBondContact O-N 2.68Å; D1104-Q1107 PolarHBondContact OD2-NE2 2.75Å; Q1107-Y1124 WeakPolarHBondContact O-CE1 3.34Å; Q1107-Y1124 PolarHBondContact O-OH 3.2Å
1108	N	65.8	Low	65.9	Low	32 Å²	32	76.8 Å²	76.8	17%	0.171	42%	0.417	C	S	.	.			trans	-125	150.1	175.7	64.9	85.8	0	0	0	112.8	D1104 Y1124	D1104-N1108 PolarHBondContact O-ND2 2.88Å; N1108-Y1124 HydrophobicContact CB-CD1 4.44Å; N1108-Y1124 HydrophobicContact CB-CD2 3.86Å; N1108-Y1124 HydrophobicContact CB-CE1 4.31Å; N1108-Y1124 HydrophobicContact CB-CE2 3.74Å; N1108-Y1124 HydrophobicContact CB-CG 4.23Å
1109	D	71.3	Confident	66.5	Low	69 Å²	69	73.7 Å²	73.7	37%	0.369	41%	0.41	S	S	.	.			trans	-125.7	35.3	-171.6	63.4	1.5	0	0	0	113	Y1124 R1145	D1109-Y1124 PolarHBondContact OD1-OH 3.09Å; D1109-R1145 IonicContact OD1-CZ 3.8Å; D1109-R1145 IonicContact OD1-NE 2.75Å; D1109-R1145 IonicContact OD1-NH1 2.71Å; D1109-R1145 PolarHBondContact OD1-NH1 2.57Å; D1109-R1145 IonicContact OD1-NH2 2.89Å; D1109-R1145 PolarHBondContact OD1-NH2 3.2Å; D1109-R1145 IonicContact OD2-CZ 2.73Å; D1109-R1145 IonicContact OD2-NH1 2.78Å; D1109-R1145 PolarHBondContact OD2-NH1 3.37Å; D1109-R1145 IonicContact OD2-NH2 3.18Å; D1109-R1145 PolarHBondContact OD2-NH2 2.58Å
1110	C	80.3	Confident	66.8	Low	28 Å²	28	67 Å²	67	19%	0.189	40%	0.4	C	S	.	.			trans	-72.2	154.5	172.4	-53.9	0	0	0	0	112.1	A1114 C1116 C1126	C1110-A1114 HydrophobicContact CB-CB 4.23Å; C1110-C1116 PolarHBondContact SG-SG 2.85Å; C1110-C1126 WeakPolarHBondContact CA-SG 3.05Å; C1110-C1126 HydrophobicContact CB-CB 3.64Å; C1110-C1126 WeakPolarHBondContact CB-SG 3.1Å; C1110-C1126 WeakPolarHBondContact SG-CB 3.21Å; C1110-C1126 CovalentContact SG-SG 2.03Å; C1110-C1126 PolarHBondContact SG-SG 3.48Å
1111	S	78.9	Confident	66.6	Low	21 Å²	21	73.8 Å²	73.8	15%	0.147	43%	0.426	C	S	.	.			trans	-59.8	150.5	166.6	-172.2	0	0	0	0	111	Y1113 A1114 G1144	S1111-Y1113 PolarHBondContact O-N 3.06Å; S1111-Y1113 PolarHBondContact OG-N 2.93Å; S1111-A1114 WeakPolarHBondContact O-CA 3.35Å; S1111-A1114 WeakPolarHBondContact O-CB 3.18Å; S1111-A1114 PolarHBondContact O-N 2.86Å; S1111-G1144 WeakPolarHBondContact CB-O 3.32Å; S1111-G1144 PolarHBondContact N-O 3.17Å
1112	H	76.7	Confident	66.3	Low	127 Å²	127	80.7 Å²	80.7	59%	0.588	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.7	171.9	71.8	-68	0	0	0	112.7	A1114 R1129	H1112-A1114 VanDerWaalsContact C-N 3.3Å; H1112-R1129 PolarHBondContact O-NH2 3.44Å; H1112-R1129 VanDerWaalsContact O-NH2 3.15Å
1113	Y	76.3	Confident	65.8	Low	87 Å²	87	80 Å²	80	34%	0.341	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	5.6	166.4	-61.7	-45.9	0	0	0	113.4	S1111 R1129 Y1132	S1111-Y1113 PolarHBondContact O-N 3.06Å; S1111-Y1113 PolarHBondContact OG-N 2.93Å; Y1113-R1129 WeakPolarHBondContact O-CB 3.36Å; Y1113-R1129 VanDerWaalsContact O-CG 3.22Å; Y1113-R1129 WeakPolarHBondContact O-CG 3.19Å; Y1113-R1129 PolarHBondContact O-N 3.23Å; Y1113-Y1132 HydrophobicContact CD1-CD1 4.48Å; Y1113-Y1132 AromaticContact CD1-CE1 3.82Å; Y1113-Y1132 HydrophobicContact CD1-CE1 3.82Å; Y1113-Y1132 HydrophobicContact CD1-CE2 4.31Å; Y1113-Y1132 AromaticContact CD1-CZ 3.73Å; Y1113-Y1132 AromaticContact CD2-CD1 3.87Å; Y1113-Y1132 HydrophobicContact CD2-CD1 3.87Å; Y1113-Y1132 AromaticContact CD2-CE1 3.64Å; Y1113-Y1132 HydrophobicContact CD2-CE1 3.64Å; Y1113-Y1132 AromaticContact CE1-CE1 3.94Å; Y1113-Y1132 HydrophobicContact CE1-CE1 3.94Å; Y1113-Y1132 AromaticContact CE1-CZ 3.86Å; Y1113-Y1132 HydrophobicContact CE2-CD1 4.36Å; Y1113-Y1132 AromaticContact CE2-CE1 3.75Å; Y1113-Y1132 HydrophobicContact CE2-CE1 3.75Å; Y1113-Y1132 AromaticContact CG-CD1 3.95Å; Y1113-Y1132 HydrophobicContact CG-CD1 3.95Å; Y1113-Y1132 AromaticContact CG-CE1 3.69Å; Y1113-Y1132 HydrophobicContact CG-CE1 3.69Å; Y1113-Y1132 AromaticContact CZ-CE1 3.91Å
1114	A	76.8	Confident	66.6	Low	6 Å²	6	79.2 Å²	79.2	5%	0.05	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	165.1	174.2	0	0	0	0	0	112.3	C1110 S1111 H1112 Q1127 R1129 G1144	C1110-A1114 HydrophobicContact CB-CB 4.23Å; S1111-A1114 WeakPolarHBondContact O-CA 3.35Å; S1111-A1114 WeakPolarHBondContact O-CB 3.18Å; S1111-A1114 PolarHBondContact O-N 2.86Å; H1112-A1114 VanDerWaalsContact C-N 3.3Å; A1114-Q1127 CarbonylContact C-O 3.54Å; A1114-Q1127 WeakPolarHBondContact CA-O 3.09Å; A1114-Q1127 VanDerWaalsContact CB-O 3.23Å; A1114-Q1127 WeakPolarHBondContact CB-O 3.41Å; A1114-R1129 PolarHBondContact O-NH2 2.83Å; A1114-G1144 WeakPolarHBondContact CB-O 3.17Å
1115	S	78.6	Confident	67.7	Low	57 Å²	57	78.9 Å²	78.9	40%	0.399	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.7	170	-64.9	0	0	0	0	109	C1126 Q1127	S1115-C1126 WeakPolarHBondContact O-CA 3.22Å; S1115-Q1127 PolarHBondContact N-O 3.12Å; S1115-Q1127 PolarHBondContact O-N 3.45Å
1116	C	78.4	Confident	69	Low	39 Å²	39	73 Å²	73	26%	0.264	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.4	174	-161	0	0	0	0	109.6	C1102 C1110 S1125	C1102-C1116 PolarHBondContact SG-SG 2.76Å; C1110-C1116 PolarHBondContact SG-SG 2.85Å; C1116-S1125 CarbonylContact C-O 3.57Å; C1116-S1125 WeakPolarHBondContact CA-O 3.48Å
1117	I	77.6	Confident	69.8	Low	76 Å²	76	73.9 Å²	73.9	39%	0.39	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.2	-173.8	-52.6	175.8	0	0	0	108.5	Y1124 S1125 Q1127	I1117-Y1124 CarbonylContact O-C 3.44Å; I1117-Y1124 WeakPolarHBondContact O-CA 3.15Å; I1117-S1125 PolarHBondContact N-O 3.45Å; I1117-S1125 PolarHBondContact O-N 3.14Å; I1117-Q1127 HydrophobicContact CD1-CB 4.44Å
1118	E	65.7	Low	70.7	Confident	84 Å²	84	69.2 Å²	69.2	39%	0.393	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	130.4	177.5	-60.2	-173.4	171.2	0	0	110.9	S1100 P1101 C1102	S1100-E1118 WeakPolarHBondContact CB-OE1 3.17Å; S1100-E1118 WeakPolarHBondContact CB-OE2 3.46Å; S1100-E1118 PolarHBondContact OG-OE1 3.45Å; P1101-E1118 VanDerWaalsContact CD-OE1 3.24Å; P1101-E1118 WeakPolarHBondContact CD-OE1 3.08Å; P1101-E1118 HydrophobicContact CG-CG 4.25Å; C1102-E1118 HydrophobicContact CB-CG 3.75Å; C1102-E1118 WeakPolarHBondContact CB-OE1 3.37Å; C1102-E1118 PolarHBondContact N-OE1 2.76Å; C1102-E1118 WeakPolarHBondContact SG-CG 3.37Å
1119	V	61	Low	71.1	Confident	88 Å²	88	73.8 Å²	73.8	53%	0.533	39%	0.389	S	S	.	.			trans	-134.2	95.1	-175.1	-174.1	0	0	0	0	109.6	G1123	V1119-G1123 PolarHBondContact N-O 2.77Å; V1119-G1123 CarbonylContact O-C 3.49Å; V1119-G1123 VanDerWaalsContact O-CA 3.24Å; V1119-G1123 WeakPolarHBondContact O-CA 3.07Å
1120	G	51.4	Low	70.9	Confident	65 Å²	65	78.3 Å²	78.3	67%	0.67	41%	0.413	S	S	*	.	S	Bend	trans	79.5	175.6	-176.5	0	0	0	0	0	113.7	H1122 G1123	G1120-H1122 PolarHBondContact O-N 3.37Å; G1120-G1123 PolarHBondContact O-N 3.21Å
1121	E	52.1	Low	69.4	Low	190 Å²	190	79.4 Å²	79.4	89%	0.888	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.5	-165.7	-61.2	-173.9	124.8	0	0	114.7
1122	H	47.4	Very low	69.1	Low	189 Å²	189	82 Å²	82	88%	0.875	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.3	21.4	-179.2	-62.5	-31.6	0	0	0	113.9	G1120	G1120-H1122 PolarHBondContact O-N 3.37Å
1123	G	55.4	Low	68.6	Low	22 Å²	22	82.3 Å²	82.3	23%	0.227	44%	0.439	C	S	.	.			trans	-117.9	157.3	-174.1	0	0	0	0	0	114.9	V1119 G1120	V1119-G1123 PolarHBondContact N-O 2.77Å; V1119-G1123 CarbonylContact O-C 3.49Å; V1119-G1123 VanDerWaalsContact O-CA 3.24Å; V1119-G1123 WeakPolarHBondContact O-CA 3.07Å; G1120-G1123 PolarHBondContact O-N 3.21Å
1124	Y	76.8	Confident	68.4	Low	85 Å²	85	80.3 Å²	80.3	33%	0.333	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	159.9	172.5	68	-91.4	0	0	0	112.2	Q1107 N1108 D1109 I1117	Q1107-Y1124 WeakPolarHBondContact O-CE1 3.34Å; Q1107-Y1124 PolarHBondContact O-OH 3.2Å; N1108-Y1124 HydrophobicContact CB-CD1 4.44Å; N1108-Y1124 HydrophobicContact CB-CD2 3.86Å; N1108-Y1124 HydrophobicContact CB-CE1 4.31Å; N1108-Y1124 HydrophobicContact CB-CE2 3.74Å; N1108-Y1124 HydrophobicContact CB-CG 4.23Å; D1109-Y1124 PolarHBondContact OD1-OH 3.09Å; I1117-Y1124 CarbonylContact O-C 3.44Å; I1117-Y1124 WeakPolarHBondContact O-CA 3.15Å
1125	S	76.8	Confident	68.2	Low	48 Å²	48	83.3 Å²	83.3	34%	0.336	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	161.8	174.9	-168.9	0	0	0	0	110.7	C1116 I1117	C1116-S1125 CarbonylContact C-O 3.57Å; C1116-S1125 WeakPolarHBondContact CA-O 3.48Å; I1117-S1125 PolarHBondContact N-O 3.45Å; I1117-S1125 PolarHBondContact O-N 3.14Å
1126	C	82.8	Confident	67.9	Low	6 Å²	6	80.9 Å²	80.9	4%	0.041	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.3	-174.4	-53.4	0	0	0	0	111	C1110 S1115 P1143	C1110-C1126 WeakPolarHBondContact CA-SG 3.05Å; C1110-C1126 HydrophobicContact CB-CB 3.64Å; C1110-C1126 WeakPolarHBondContact CB-SG 3.1Å; C1110-C1126 WeakPolarHBondContact SG-CB 3.21Å; C1110-C1126 CovalentContact SG-SG 2.03Å; C1110-C1126 PolarHBondContact SG-SG 3.48Å; S1115-C1126 WeakPolarHBondContact O-CA 3.22Å; C1126-P1143 WeakPolarHBondContact CB-O 3.38Å; C1126-P1143 CarbonylContact O-C 3.47Å; C1126-P1143 WeakPolarHBondContact O-CB 3.42Å; C1126-P1143 WeakPolarHBondContact O-CG 3.41Å
1127	Q	75	Confident	67.4	Low	117 Å²	117	85 Å²	85	55%	0.547	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	127.3	178.9	-179.8	-177.7	-4.6	0	0	110.4	A1114 S1115 I1117	A1114-Q1127 CarbonylContact C-O 3.54Å; A1114-Q1127 WeakPolarHBondContact CA-O 3.09Å; A1114-Q1127 VanDerWaalsContact CB-O 3.23Å; A1114-Q1127 WeakPolarHBondContact CB-O 3.41Å; S1115-Q1127 PolarHBondContact N-O 3.12Å; S1115-Q1127 PolarHBondContact O-N 3.45Å; I1117-Q1127 HydrophobicContact CD1-CB 4.44Å
1128	C	79.6	Confident	66.5	Low	17 Å²	17	85.8 Å²	85.8	12%	0.115	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	141.6	174.7	-63.4	0	0	0	0	111.3	C1147	C1128-C1147 VanDerWaalsContact CA-SG 3.54Å; C1128-C1147 HydrophobicContact CB-CB 3.82Å; C1128-C1147 WeakPolarHBondContact CB-SG 3.2Å; C1128-C1147 WeakPolarHBondContact SG-CB 3.27Å; C1128-C1147 CovalentContact SG-SG 2.04Å; C1128-C1147 PolarHBondContact SG-SG 3.1Å
1129	R	74.6	Confident	66.6	Low	128 Å²	128	85 Å²	85	48%	0.483	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-72.3	152.8	176.1	-67.9	171.9	-167.1	172.6	11.3	111.1	H1112 Y1113 A1114 G1131 Y1132	H1112-R1129 PolarHBondContact O-NH2 3.44Å; H1112-R1129 VanDerWaalsContact O-NH2 3.15Å; Y1113-R1129 WeakPolarHBondContact O-CB 3.36Å; Y1113-R1129 VanDerWaalsContact O-CG 3.22Å; Y1113-R1129 WeakPolarHBondContact O-CG 3.19Å; Y1113-R1129 PolarHBondContact O-N 3.23Å; A1114-R1129 PolarHBondContact O-NH2 2.83Å; R1129-G1131 PolarHBondContact O-N 3.37Å; R1129-Y1132 PolarHBondContact O-N 3.41Å
1130	D	66.8	Low	66.8	Low	164 Å²	164	91 Å²	91	88%	0.877	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	131.3	178.1	-54.7	-58.1	0	0	0	111.8
1131	G	48.5	Very low	67.5	Low	52 Å²	52	96.2 Å²	96.2	54%	0.536	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	-4.4	-172.6	0	0	0	0	0	115.5	R1129 V1150	R1129-G1131 PolarHBondContact O-N 3.37Å; G1131-V1150 WeakPolarHBondContact O-CB 3.48Å; G1131-V1150 PolarHBondContact O-N 3.18Å
1132	Y	71.9	Confident	68.7	Low	76 Å²	76	91.9 Å²	91.9	30%	0.298	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.2	173.9	-60.8	-104.7	0	0	0	111.4	Y1113 R1129 E1148 P1149	Y1113-Y1132 HydrophobicContact CD1-CD1 4.48Å; Y1113-Y1132 AromaticContact CD1-CE1 3.82Å; Y1113-Y1132 HydrophobicContact CD1-CE1 3.82Å; Y1113-Y1132 HydrophobicContact CD1-CE2 4.31Å; Y1113-Y1132 AromaticContact CD1-CZ 3.73Å; Y1113-Y1132 AromaticContact CD2-CD1 3.87Å; Y1113-Y1132 HydrophobicContact CD2-CD1 3.87Å; Y1113-Y1132 AromaticContact CD2-CE1 3.64Å; Y1113-Y1132 HydrophobicContact CD2-CE1 3.64Å; Y1113-Y1132 AromaticContact CE1-CE1 3.94Å; Y1113-Y1132 HydrophobicContact CE1-CE1 3.94Å; Y1113-Y1132 AromaticContact CE1-CZ 3.86Å; Y1113-Y1132 HydrophobicContact CE2-CD1 4.36Å; Y1113-Y1132 AromaticContact CE2-CE1 3.75Å; Y1113-Y1132 HydrophobicContact CE2-CE1 3.75Å; Y1113-Y1132 AromaticContact CG-CD1 3.95Å; Y1113-Y1132 HydrophobicContact CG-CD1 3.95Å; Y1113-Y1132 AromaticContact CG-CE1 3.69Å; Y1113-Y1132 HydrophobicContact CG-CE1 3.69Å; Y1113-Y1132 AromaticContact CZ-CE1 3.91Å; R1129-Y1132 PolarHBondContact O-N 3.41Å; Y1132-E1148 CarbonylContact C-O 3.58Å; Y1132-E1148 WeakPolarHBondContact CA-O 3.29Å; Y1132-P1149 HydrophobicContact CD1-CB 4.16Å; Y1132-P1149 HydrophobicContact CE1-CB 3.97Å
1133	E	67	Low	70	Confident	133 Å²	133	84.7 Å²	84.7	62%	0.621	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	139.5	178.8	-174	166.3	-169.5	0	0	110.9	V1135 C1147 E1148 V1150	E1133-V1135 PolarHBondContact O-N 3.42Å; E1133-C1147 WeakPolarHBondContact O-CA 3.25Å; E1133-E1148 PolarHBondContact N-O 3.46Å; E1133-E1148 PolarHBondContact O-N 3.49Å; E1133-V1150 HydrophobicContact CB-CG2 3.67Å
1134	D	72.4	Confident	71.1	Confident	45 Å²	45	83.6 Å²	83.6	24%	0.241	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	95.4	-175.9	-170.5	-0.9	0	0	0	111.5	S1136 P1143 G1144	D1134-S1136 VanDerWaalsContact C-N 3.33Å; D1134-S1136 WeakPolarHBondContact OD1-CB 3.09Å; D1134-S1136 PolarHBondContact OD1-N 3.21Å; D1134-S1136 VanDerWaalsContact OD1-N 3.1Å; D1134-S1136 PolarHBondContact OD1-OG 2.94Å; D1134-P1143 WeakPolarHBondContact OD2-CA 3.3Å; D1134-P1143 VanDerWaalsContact OD2-CB 3.24Å; D1134-P1143 WeakPolarHBondContact OD2-CB 3.44Å; D1134-G1144 PolarHBondContact OD1-N 3.24Å; D1134-G1144 PolarHBondContact OD2-N 3.03Å
1135	V	72.4	Confident	71.3	Confident	69 Å²	69	83.1 Å²	83.1	42%	0.418	43%	0.426	S	S	.	.			trans	-97.5	20.8	177.1	-58.7	0	0	0	0	112.1	E1133 V1146 E1148	E1133-V1135 PolarHBondContact O-N 3.42Å; V1135-V1146 HydrophobicContact CG2-CB 4.02Å; V1135-V1146 HydrophobicContact CG2-CG1 3.63Å; V1135-V1146 PolarHBondContact N-O 3.41Å; V1135-E1148 HydrophobicContact CG2-CB 4.32Å; V1135-E1148 HydrophobicContact CG2-CG 3.87Å
1136	S	73.1	Confident	71.1	Confident	5 Å²	5	84 Å²	84	4%	0.035	43%	0.429	C	S	.	.			trans	-55.8	144.7	173.5	-57.1	0	0	0	0	110.9	D1134 D1138 P1139 R1145 V1146	D1134-S1136 VanDerWaalsContact C-N 3.33Å; D1134-S1136 WeakPolarHBondContact OD1-CB 3.09Å; D1134-S1136 PolarHBondContact OD1-N 3.21Å; D1134-S1136 VanDerWaalsContact OD1-N 3.1Å; D1134-S1136 PolarHBondContact OD1-OG 2.94Å; S1136-D1138 PolarHBondContact O-N 2.8Å; S1136-P1139 WeakPolarHBondContact O-CD 3.05Å; S1136-P1139 VanDerWaalsContact O-CG 3.22Å; S1136-P1139 WeakPolarHBondContact O-CG 3.4Å; S1136-R1145 PolarHBondContact OG-N 2.98Å; S1136-V1146 PolarHBondContact N-O 2.69Å; S1136-V1146 PolarHBondContact OG-N 2.77Å
1137	P	66.6	Low	70.7	Confident	126 Å²	126	84.1 Å²	84.1	82%	0.818	43%	0.43	S	S	*	.	S	Bend	trans	-60.3	-16.4	-179.2	-28.1	36.2	0	0	0	116.1
1138	D	58.4	Low	70	Confident	93 Å²	93	84.2 Å²	84.2	50%	0.497	43%	0.43	S	S	.	.			trans	-139.7	59.6	-174.6	-119.7	-32.2	0	0	0	111.5	S1136 K1140 K1141 K1142	S1136-D1138 PolarHBondContact O-N 2.8Å; D1138-K1140 PolarHBondContact O-N 3.45Å; D1138-K1141 PolarHBondContact O-N 2.88Å; D1138-K1142 HydrophobicContact CB-CB 4.41Å; D1138-K1142 CarbonylContact O-C 3.51Å; D1138-K1142 PolarHBondContact O-N 2.92Å
1139	P	67.7	Low	69	Low	67 Å²	67	87.3 Å²	87.3	44%	0.435	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-28	-168.2	-22.4	33.9	0	0	0	113.7	S1136 K1141 P1143	S1136-P1139 WeakPolarHBondContact O-CD 3.05Å; S1136-P1139 VanDerWaalsContact O-CG 3.22Å; S1136-P1139 WeakPolarHBondContact O-CG 3.4Å; P1139-K1141 VanDerWaalsContact C-N 3.31Å; P1139-K1141 PolarHBondContact O-N 3.46Å; P1139-P1143 WeakPolarHBondContact O-CB 2.89Å; P1139-P1143 WeakPolarHBondContact O-CD 3.35Å
1140	K	65.6	Low	68.1	Low	213 Å²	213	84.2 Å²	84.2	93%	0.926	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-13.6	178.4	-67.9	-173.2	175.8	-176.5	0	114.7	D1138	D1138-K1140 PolarHBondContact O-N 3.45Å
1141	K	66.9	Low	67.5	Low	175 Å²	175	82.4 Å²	82.4	76%	0.761	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.1	-24.4	-169.9	-161.6	175.5	-176	-179.5	0	113.8	D1138 P1139	D1138-K1141 PolarHBondContact O-N 2.88Å; P1139-K1141 VanDerWaalsContact C-N 3.31Å; P1139-K1141 PolarHBondContact O-N 3.46Å
1142	K	76.9	Confident	67.8	Low	100 Å²	100	82 Å²	82	44%	0.435	43%	0.425	S	S	.	.	S	Bend	trans	-142.8	62.8	174.6	-76.4	-170.4	160.7	-152.3	0	110	D1138	D1138-K1142 HydrophobicContact CB-CB 4.41Å; D1138-K1142 CarbonylContact O-C 3.51Å; D1138-K1142 PolarHBondContact O-N 2.92Å
1143	P	75.7	Confident	67.2	Low	37 Å²	37	79.6 Å²	79.6	24%	0.24	42%	0.419	C	S	.	.			trans	-60.8	166.5	173.4	25.8	-33.1	0	0	0	112.2	C1126 D1134 P1139 R1145	C1126-P1143 WeakPolarHBondContact CB-O 3.38Å; C1126-P1143 CarbonylContact O-C 3.47Å; C1126-P1143 WeakPolarHBondContact O-CB 3.42Å; C1126-P1143 WeakPolarHBondContact O-CG 3.41Å; D1134-P1143 WeakPolarHBondContact OD2-CA 3.3Å; D1134-P1143 VanDerWaalsContact OD2-CB 3.24Å; D1134-P1143 WeakPolarHBondContact OD2-CB 3.44Å; P1139-P1143 WeakPolarHBondContact O-CB 2.89Å; P1139-P1143 WeakPolarHBondContact O-CD 3.35Å; P1143-R1145 PolarHBondContact O-N 2.77Å
1144	G	78	Confident	67.3	Low	0 Å²	0	74.8 Å²	74.8	0%	0	40%	0.4	C	S	.	.	S	Bend	trans	70.5	23.2	165.4	0	0	0	0	0	116.3	S1111 A1114 D1134	S1111-G1144 WeakPolarHBondContact CB-O 3.32Å; S1111-G1144 PolarHBondContact N-O 3.17Å; A1114-G1144 WeakPolarHBondContact CB-O 3.17Å; D1134-G1144 PolarHBondContact OD1-N 3.24Å; D1134-G1144 PolarHBondContact OD2-N 3.03Å
1145	R	81	Confident	66.9	Low	75 Å²	75	83.5 Å²	83.5	28%	0.283	43%	0.429	S	S	.	.	S	Bend	trans	-103	-32.4	-179.2	-64.5	-176.1	177.5	-127.3	-7.8	113.6	D1109 S1136 P1143	D1109-R1145 IonicContact OD1-CZ 3.8Å; D1109-R1145 IonicContact OD1-NE 2.75Å; D1109-R1145 IonicContact OD1-NH1 2.71Å; D1109-R1145 PolarHBondContact OD1-NH1 2.57Å; D1109-R1145 IonicContact OD1-NH2 2.89Å; D1109-R1145 PolarHBondContact OD1-NH2 3.2Å; D1109-R1145 IonicContact OD2-CZ 2.73Å; D1109-R1145 IonicContact OD2-NH1 2.78Å; D1109-R1145 PolarHBondContact OD2-NH1 3.37Å; D1109-R1145 IonicContact OD2-NH2 3.18Å; D1109-R1145 PolarHBondContact OD2-NH2 2.58Å; S1136-R1145 PolarHBondContact OG-N 2.98Å; P1143-R1145 PolarHBondContact O-N 2.77Å
1146	V	71.4	Confident	66.3	Low	65 Å²	65	83.8 Å²	83.8	39%	0.394	43%	0.428	S	S	.	.	S	Bend	trans	-128.8	115.8	171	-165.5	0	0	0	0	108	V1135 S1136	V1135-V1146 HydrophobicContact CG2-CB 4.02Å; V1135-V1146 HydrophobicContact CG2-CG1 3.63Å; V1135-V1146 PolarHBondContact N-O 3.41Å; S1136-V1146 PolarHBondContact N-O 2.69Å; S1136-V1146 PolarHBondContact OG-N 2.77Å
1147	C	76.2	Confident	65.9	Low	9 Å²	9	91.1 Å²	91.1	6%	0.061	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	115	-175	-55.7	0	0	0	0	108.6	C1128 E1133	C1128-C1147 VanDerWaalsContact CA-SG 3.54Å; C1128-C1147 HydrophobicContact CB-CB 3.82Å; C1128-C1147 WeakPolarHBondContact CB-SG 3.2Å; C1128-C1147 WeakPolarHBondContact SG-CB 3.27Å; C1128-C1147 CovalentContact SG-SG 2.04Å; C1128-C1147 PolarHBondContact SG-SG 3.1Å; E1133-C1147 WeakPolarHBondContact O-CA 3.25Å
1148	E	59.3	Low	65.7	Low	119 Å²	119	89.8 Å²	89.8	56%	0.556	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	144.2	-178.6	-77.3	-167.7	161.3	0	0	112.4	Y1132 E1133 V1135	Y1132-E1148 CarbonylContact C-O 3.58Å; Y1132-E1148 WeakPolarHBondContact CA-O 3.29Å; E1133-E1148 PolarHBondContact N-O 3.46Å; E1133-E1148 PolarHBondContact O-N 3.49Å; V1135-E1148 HydrophobicContact CG2-CB 4.32Å; V1135-E1148 HydrophobicContact CG2-CG 3.87Å
1149	P	59.4	Low	66	Low	83 Å²	83	90.1 Å²	90.1	54%	0.539	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.3	-172.9	28.9	-35.2	0	0	0	112.7	Y1132 V1151	Y1132-P1149 HydrophobicContact CD1-CB 4.16Å; Y1132-P1149 HydrophobicContact CE1-CB 3.97Å; P1149-V1151 PolarHBondContact O-N 3.01Å
1150	V	55.9	Low	66	Low	63 Å²	63	88.1 Å²	88.1	38%	0.382	44%	0.442	S	S	.	.			trans	-83	78.6	-172.6	177.3	0	0	0	0	111.1	G1131 E1133 D1152	G1131-V1150 WeakPolarHBondContact O-CB 3.48Å; G1131-V1150 PolarHBondContact O-N 3.18Å; E1133-V1150 HydrophobicContact CB-CG2 3.67Å; V1150-D1152 PolarHBondContact O-N 3.09Å
1151	V	52.5	Low	66.3	Low	125 Å²	125	83.8 Å²	83.8	76%	0.758	43%	0.426	S	S	*	.			trans	-57.3	129	177.5	-177.2	0	0	0	0	110.8	P1149 K1170	P1149-V1151 PolarHBondContact O-N 3.01Å; V1151-K1170 WeakPolarHBondContact O-CE 3.44Å; V1151-K1170 PolarHBondContact O-NZ 3.28Å
1152	D	55.4	Low	66.9	Low	43 Å²	43	76.6 Å²	76.6	23%	0.23	40%	0.397	C	S	.	.			trans	-123.1	117.5	-169.8	174.9	27.5	0	0	0	111.9	V1150 C1154 R1155 K1170	V1150-D1152 PolarHBondContact O-N 3.09Å; D1152-C1154 PolarHBondContact O-N 3.44Å; D1152-C1154 WeakPolarHBondContact OD1-CB 3.3Å; D1152-C1154 PolarHBondContact OD1-N 3.29Å; D1152-R1155 PolarHBondContact O-N 3.11Å; D1152-K1170 HydrophobicContact CB-CD 4.28Å; D1152-K1170 WeakPolarHBondContact OD1-CD 3.47Å
1153	P	58.9	Low	67	Low	26 Å²	26	73.6 Å²	73.6	17%	0.169	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-66.1	-18.6	177.1	29.4	-36	0	0	0	113.1	R1155 D1156 L1159 N1160	P1153-R1155 VanDerWaalsContact C-N 3.28Å; P1153-R1155 PolarHBondContact O-N 3Å; P1153-D1156 PolarHBondContact O-N 2.84Å; P1153-L1159 HydrophobicContact CB-CB 4.18Å; P1153-N1160 PolarHBondContact O-ND2 2.7Å
1154	C	70.2	Confident	67	Low	32 Å²	32	77.7 Å²	77.7	22%	0.216	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-77	-11.9	177	-64.3	0	0	0	0	113.8	D1152 C1168	D1152-C1154 PolarHBondContact O-N 3.44Å; D1152-C1154 WeakPolarHBondContact OD1-CB 3.3Å; D1152-C1154 PolarHBondContact OD1-N 3.29Å; C1154-C1168 WeakPolarHBondContact CA-SG 3.1Å; C1154-C1168 HydrophobicContact CB-CB 3.57Å; C1154-C1168 WeakPolarHBondContact CB-SG 3.36Å; C1154-C1168 WeakPolarHBondContact SG-CB 3.39Å; C1154-C1168 PolarHBondContact SG-O 2.96Å; C1154-C1168 CovalentContact SG-SG 2.04Å; C1154-C1168 PolarHBondContact SG-SG 3.45Å
1155	R	63.6	Low	66.8	Low	229 Å²	229	80.2 Å²	80.2	86%	0.864	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-87.4	-18.2	171.1	-86.1	-174.4	166.9	-170.9	-2.9	114.3	D1152 P1153	D1152-R1155 PolarHBondContact O-N 3.11Å; P1153-R1155 VanDerWaalsContact C-N 3.28Å; P1153-R1155 PolarHBondContact O-N 3Å
1156	D	59.9	Low	66.6	Low	74 Å²	74	77 Å²	77	40%	0.396	41%	0.408	S	S	.	.			trans	-113.5	108	-179.6	-170	-29.5	0	0	0	109.4	P1153 S1158 L1159 N1160	P1153-D1156 PolarHBondContact O-N 2.84Å; D1156-S1158 PolarHBondContact O-N 3.02Å; D1156-S1158 VanDerWaalsContact O-N 3.09Å; D1156-S1158 WeakPolarHBondContact OD1-CB 3.11Å; D1156-S1158 PolarHBondContact OD1-N 2.84Å; D1156-S1158 PolarHBondContact OD1-OG 3.12Å; D1156-L1159 HydrophobicContact CB-CB 4.27Å; D1156-L1159 HydrophobicContact CB-CD1 3.98Å; D1156-L1159 HydrophobicContact CB-CG 4.08Å; D1156-L1159 PolarHBondContact O-N 3.39Å; D1156-N1160 PolarHBondContact O-ND2 3.36Å
1157	Q	63.6	Low	66.9	Low	160 Å²	160	78.3 Å²	78.3	75%	0.748	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-4.8	-176.9	-152.1	170.9	16.4	0	0	113.3
1158	S	63.5	Low	67	Low	97 Å²	97	79.1 Å²	79.1	68%	0.678	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-10	168.8	74.2	0	0	0	0	113.9	D1156	D1156-S1158 PolarHBondContact O-N 3.02Å; D1156-S1158 VanDerWaalsContact O-N 3.09Å; D1156-S1158 WeakPolarHBondContact OD1-CB 3.11Å; D1156-S1158 PolarHBondContact OD1-N 2.84Å; D1156-S1158 PolarHBondContact OD1-OG 3.12Å
1159	L	64.3	Low	67.5	Low	100 Å²	100	77.5 Å²	77.5	52%	0.524	41%	0.41	S	S	.	.	S	Bend	trans	-109.7	2.5	-177.1	-62.9	-178.8	0	0	0	114.2	P1153 D1156 Y1175	P1153-L1159 HydrophobicContact CB-CB 4.18Å; D1156-L1159 HydrophobicContact CB-CB 4.27Å; D1156-L1159 HydrophobicContact CB-CD1 3.98Å; D1156-L1159 HydrophobicContact CB-CG 4.08Å; D1156-L1159 PolarHBondContact O-N 3.39Å; L1159-Y1175 WeakPolarHBondContact O-CE1 3.27Å
1160	N	67.6	Low	67.6	Low	25 Å²	25	78 Å²	78	13%	0.134	40%	0.403	C	S	.	.			trans	-137.8	149.6	175.4	72	85.7	0	0	0	112.7	P1153 D1156 Y1175	P1153-N1160 PolarHBondContact O-ND2 2.7Å; D1156-N1160 PolarHBondContact O-ND2 3.36Å; N1160-Y1175 HydrophobicContact CB-CD1 3.84Å; N1160-Y1175 HydrophobicContact CB-CD2 3.93Å; N1160-Y1175 HydrophobicContact CB-CE1 4.07Å; N1160-Y1175 HydrophobicContact CB-CE2 4.14Å; N1160-Y1175 HydrophobicContact CB-CG 3.8Å
1161	E	72.6	Confident	67.7	Low	122 Å²	122	83.6 Å²	83.6	57%	0.57	42%	0.418	S	S	*	.			trans	-112.5	39.9	-178.7	-58.8	177.2	133.1	0	0	111.1	Y1175 R1196	E1161-Y1175 HydrophobicContact CB-CE2 4.43Å; E1161-Y1175 WeakPolarHBondContact CB-OH 3.46Å; E1161-Y1175 WeakPolarHBondContact CG-OH 3.23Å; E1161-Y1175 PolarHBondContact N-OH 3.16Å; E1161-Y1175 PolarHBondContact OE2-OH 2.91Å; E1161-R1196 IonicContact OE2-CZ 3.11Å; E1161-R1196 IonicContact OE2-NH1 2.66Å; E1161-R1196 PolarHBondContact OE2-NH1 3.48Å; E1161-R1196 IonicContact OE2-NH2 3.87Å; E1161-R1196 PolarHBondContact OE2-NH2 2.91Å
1162	C	79.5	Confident	67.8	Low	25 Å²	25	89.7 Å²	89.7	17%	0.169	43%	0.427	C	S	.	.			trans	-86.6	149.5	178	-61.4	0	0	0	0	112	A1166 C1168 C1177	C1162-A1166 HydrophobicContact CB-CB 4.24Å; C1162-C1168 HydrophobicContact CB-CB 4.41Å; C1162-C1177 WeakPolarHBondContact CA-SG 3.47Å; C1162-C1177 HydrophobicContact CB-CB 3.74Å; C1162-C1177 WeakPolarHBondContact CB-SG 3.4Å; C1162-C1177 WeakPolarHBondContact SG-CB 3.49Å; C1162-C1177 CovalentContact SG-SG 2.04Å; C1162-C1177 PolarHBondContact SG-SG 2.05Å
1163	D	78.6	Confident	67.6	Low	36 Å²	36	100 Å²	100	19%	0.193	46%	0.463	C	S	.	.			trans	-59.4	147.5	168.9	-166.5	-47	0	0	0	110	N1165 A1166 G1195 Q1197 C1198	D1163-N1165 PolarHBondContact O-N 3.36Å; D1163-N1165 WeakPolarHBondContact OD1-CB 3.23Å; D1163-N1165 PolarHBondContact OD1-N 3.17Å; D1163-A1166 HydrophobicContact CB-CB 3.93Å; D1163-A1166 WeakPolarHBondContact O-CB 3.22Å; D1163-A1166 PolarHBondContact O-N 2.95Å; D1163-G1195 PolarHBondContact N-O 3.16Å; D1163-Q1197 WeakPolarHBondContact OD2-CA 3.18Å; D1163-C1198 HydrophobicContact CB-CB 4.32Å; D1163-C1198 PolarHBondContact OD2-N 3.41Å
1164	I	76.4	Confident	67.5	Low	123 Å²	123	100.1 Å²	100.1	63%	0.631	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-24.2	171.5	-165.7	168.9	0	0	0	112	K1180	I1164-K1180 PolarHBondContact O-NZ 2.71Å
1165	N	73.6	Confident	67.8	Low	53 Å²	53	101.6 Å²	101.6	28%	0.283	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	5.1	173.6	-62.9	-38.6	0	0	0	113.8	D1163 K1180 Y1183 C1198	D1163-N1165 PolarHBondContact O-N 3.36Å; D1163-N1165 WeakPolarHBondContact OD1-CB 3.23Å; D1163-N1165 PolarHBondContact OD1-N 3.17Å; N1165-K1180 VanDerWaalsContact O-CB 3.31Å; N1165-K1180 WeakPolarHBondContact O-CB 3.33Å; N1165-K1180 WeakPolarHBondContact O-CD 3.48Å; N1165-K1180 WeakPolarHBondContact O-CG 3.47Å; N1165-K1180 PolarHBondContact O-N 2.94Å; N1165-Y1183 HydrophobicContact CB-CD1 3.71Å; N1165-Y1183 HydrophobicContact CB-CE1 3.69Å; N1165-Y1183 HydrophobicContact CB-CG 4.3Å; N1165-C1198 HydrophobicContact CB-CB 3.92Å
1166	A	76.6	Confident	68.3	Low	9 Å²	9	92.5 Å²	92.5	7%	0.074	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	150.8	168.4	0	0	0	0	0	112	C1162 D1163 C1177 T1178 K1180 G1195	C1162-A1166 HydrophobicContact CB-CB 4.24Å; D1163-A1166 HydrophobicContact CB-CB 3.93Å; D1163-A1166 WeakPolarHBondContact O-CB 3.22Å; D1163-A1166 PolarHBondContact O-N 2.95Å; A1166-C1177 HydrophobicContact CB-CB 4.2Å; A1166-T1178 CarbonylContact C-O 3.53Å; A1166-T1178 VanDerWaalsContact CA-O 3.24Å; A1166-T1178 WeakPolarHBondContact CA-O 3.5Å; A1166-T1178 WeakPolarHBondContact CB-O 3.28Å; A1166-K1180 VanDerWaalsContact O-CE 3.26Å; A1166-K1180 WeakPolarHBondContact O-CE 3.19Å; A1166-G1195 WeakPolarHBondContact CB-O 3.16Å
1167	L	78.2	Confident	69.3	Low	91 Å²	91	89.2 Å²	89.2	48%	0.476	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.4	159	-179.9	66.1	0	0	0	107.6	E1169 C1177 T1178	L1167-E1169 HydrophobicContact CD2-CG 3.8Å; L1167-E1169 HydrophobicContact CG-CG 4Å; L1167-E1169 PolarHBondContact O-N 3.47Å; L1167-C1177 WeakPolarHBondContact O-CA 3.04Å; L1167-T1178 PolarHBondContact N-O 2.88Å; L1167-T1178 PolarHBondContact O-N 3.27Å
1168	C	77.4	Confident	69.9	Low	26 Å²	26	83.6 Å²	83.6	18%	0.176	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	111.9	164.6	-176.9	0	0	0	0	107.8	C1154 C1162	C1154-C1168 WeakPolarHBondContact CA-SG 3.1Å; C1154-C1168 HydrophobicContact CB-CB 3.57Å; C1154-C1168 WeakPolarHBondContact CB-SG 3.36Å; C1154-C1168 WeakPolarHBondContact SG-CB 3.39Å; C1154-C1168 PolarHBondContact SG-O 2.96Å; C1154-C1168 CovalentContact SG-SG 2.04Å; C1154-C1168 PolarHBondContact SG-SG 3.45Å; C1162-C1168 HydrophobicContact CB-CB 4.41Å
1169	E	70.3	Confident	70.7	Confident	85 Å²	85	80.2 Å²	80.2	40%	0.397	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.3	174.4	-74.3	177.8	-140	0	0	110.4	L1167 R1171 Y1175 T1176 T1178	L1167-E1169 HydrophobicContact CD2-CG 3.8Å; L1167-E1169 HydrophobicContact CG-CG 4Å; L1167-E1169 PolarHBondContact O-N 3.47Å; E1169-R1171 PolarHBondContact O-N 2.84Å; E1169-Y1175 CarbonylContact O-C 3.49Å; E1169-Y1175 WeakPolarHBondContact O-CA 3.26Å; E1169-T1176 HydrophobicContact CB-CG2 3.7Å; E1169-T1176 PolarHBondContact N-O 3.24Å; E1169-T1176 PolarHBondContact O-N 3.33Å; E1169-T1178 WeakPolarHBondContact OE1-CB 3.08Å; E1169-T1178 VanDerWaalsContact OE1-CG2 3.26Å; E1169-T1178 WeakPolarHBondContact OE1-CG2 2.98Å; E1169-T1178 PolarHBondContact OE1-OG1 3.19Å
1170	K	61.9	Low	71.1	Confident	93 Å²	93	79.6 Å²	79.6	40%	0.404	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	111.7	180	-174.7	177.6	-175.1	169.6	0	111.5	V1151 D1152	V1151-K1170 WeakPolarHBondContact O-CE 3.44Å; V1151-K1170 PolarHBondContact O-NZ 3.28Å; D1152-K1170 HydrophobicContact CB-CD 4.28Å; D1152-K1170 WeakPolarHBondContact OD1-CD 3.47Å
1171	R	56	Low	71.3	Confident	181 Å²	181	85.7 Å²	85.7	68%	0.683	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	155.1	169.1	-146.4	168.4	-175.5	175.5	1.6	109.3	E1169 R1173 G1174	E1169-R1171 PolarHBondContact O-N 2.84Å; R1171-R1173 PolarHBondContact O-N 3.41Å; R1171-G1174 CarbonylContact C-O 3.45Å; R1171-G1174 PolarHBondContact N-O 2.8Å; R1171-G1174 PolarHBondContact O-N 3.11Å
1172	R	56.1	Low	70.3	Confident	253 Å²	253	81.5 Å²	81.5	96%	0.955	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-23.8	-165.3	-70.3	-172.1	179.2	-175.4	-0.3	117.6
1173	R	51.4	Low	70.1	Confident	260 Å²	260	83.7 Å²	83.7	98%	0.981	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.3	33.6	171.1	-72.5	-168.1	171.3	-173.2	-3.7	112.9	R1171	R1171-R1173 PolarHBondContact O-N 3.41Å
1174	G	56.8	Low	69.8	Low	28 Å²	28	85.1 Å²	85.1	29%	0.289	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	-165	-178.6	0	0	0	0	0	112.4	R1171	R1171-G1174 CarbonylContact C-O 3.45Å; R1171-G1174 PolarHBondContact N-O 2.8Å; R1171-G1174 PolarHBondContact O-N 3.11Å
1175	Y	76.2	Confident	69.6	Low	64 Å²	64	80.7 Å²	80.7	25%	0.251	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	160.2	174	63.8	-85.8	0	0	0	110.7	L1159 N1160 E1161 E1169 R1196	L1159-Y1175 WeakPolarHBondContact O-CE1 3.27Å; N1160-Y1175 HydrophobicContact CB-CD1 3.84Å; N1160-Y1175 HydrophobicContact CB-CD2 3.93Å; N1160-Y1175 HydrophobicContact CB-CE1 4.07Å; N1160-Y1175 HydrophobicContact CB-CE2 4.14Å; N1160-Y1175 HydrophobicContact CB-CG 3.8Å; E1161-Y1175 HydrophobicContact CB-CE2 4.43Å; E1161-Y1175 WeakPolarHBondContact CB-OH 3.46Å; E1161-Y1175 WeakPolarHBondContact CG-OH 3.23Å; E1161-Y1175 PolarHBondContact N-OH 3.16Å; E1161-Y1175 PolarHBondContact OE2-OH 2.91Å; E1169-Y1175 CarbonylContact O-C 3.49Å; E1169-Y1175 WeakPolarHBondContact O-CA 3.26Å; Y1175-R1196 PolarHBondContact OH-NH2 2.88Å
1176	T	73	Confident	69.6	Low	38 Å²	38	80.7 Å²	80.7	23%	0.233	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.5	162	-166.9	0	0	0	0	107.2	E1169	E1169-T1176 HydrophobicContact CB-CG2 3.7Å; E1169-T1176 PolarHBondContact N-O 3.24Å; E1169-T1176 PolarHBondContact O-N 3.33Å
1177	C	81.7	Confident	69.5	Low	4 Å²	4	80.4 Å²	80.4	3%	0.027	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.6	-179.2	-43.4	0	0	0	0	108.9	C1162 A1166 L1167 P1194 G1195	C1162-C1177 WeakPolarHBondContact CA-SG 3.47Å; C1162-C1177 HydrophobicContact CB-CB 3.74Å; C1162-C1177 WeakPolarHBondContact CB-SG 3.4Å; C1162-C1177 WeakPolarHBondContact SG-CB 3.49Å; C1162-C1177 CovalentContact SG-SG 2.04Å; C1162-C1177 PolarHBondContact SG-SG 2.05Å; A1166-C1177 HydrophobicContact CB-CB 4.2Å; L1167-C1177 WeakPolarHBondContact O-CA 3.04Å; C1177-P1194 WeakPolarHBondContact CB-O 3.21Å; C1177-P1194 CarbonylContact O-C 3.57Å; C1177-P1194 VanDerWaalsContact O-C 3.3Å; C1177-P1194 VanDerWaalsContact O-O 3.12Å; C1177-G1195 VanDerWaalsContact CB-O 3.24Å; C1177-G1195 WeakPolarHBondContact CB-O 3.24Å
1178	T	76.8	Confident	68.8	Low	42 Å²	42	82.1 Å²	82.1	26%	0.258	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	136	174.5	48.2	0	0	0	0	107.8	A1166 L1167 E1169 K1180	A1166-T1178 CarbonylContact C-O 3.53Å; A1166-T1178 VanDerWaalsContact CA-O 3.24Å; A1166-T1178 WeakPolarHBondContact CA-O 3.5Å; A1166-T1178 WeakPolarHBondContact CB-O 3.28Å; L1167-T1178 PolarHBondContact N-O 2.88Å; L1167-T1178 PolarHBondContact O-N 3.27Å; E1169-T1178 WeakPolarHBondContact OE1-CB 3.08Å; E1169-T1178 VanDerWaalsContact OE1-CG2 3.26Å; E1169-T1178 WeakPolarHBondContact OE1-CG2 2.98Å; E1169-T1178 PolarHBondContact OE1-OG1 3.19Å; T1178-K1180 PolarHBondContact O-N 3Å
1179	C	80	Confident	68	Low	26 Å²	26	83.7 Å²	83.7	18%	0.176	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	137.2	179.2	-66	0	0	0	0	110.5	Y1183 D1185 C1198	C1179-Y1183 WeakPolarHBondContact CB-O 3.36Å; C1179-D1185 VanDerWaalsContact SG-CA 3.54Å; C1179-C1198 WeakPolarHBondContact CA-SG 3.01Å; C1179-C1198 HydrophobicContact CB-CB 3.81Å; C1179-C1198 WeakPolarHBondContact CB-SG 3.01Å; C1179-C1198 VanDerWaalsContact SG-CA 3.55Å; C1179-C1198 WeakPolarHBondContact SG-CB 3.46Å; C1179-C1198 CovalentContact SG-SG 2.04Å; C1179-C1198 PolarHBondContact SG-SG 3.49Å
1180	K	72.4	Confident	68.2	Low	88 Å²	88	85.7 Å²	85.7	38%	0.383	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-57.8	149.9	178.5	-72.5	167.7	-176.6	168.1	0	109.9	I1164 N1165 A1166 T1178 G1182 Y1183	I1164-K1180 PolarHBondContact O-NZ 2.71Å; N1165-K1180 VanDerWaalsContact O-CB 3.31Å; N1165-K1180 WeakPolarHBondContact O-CB 3.33Å; N1165-K1180 WeakPolarHBondContact O-CD 3.48Å; N1165-K1180 WeakPolarHBondContact O-CG 3.47Å; N1165-K1180 PolarHBondContact O-N 2.94Å; A1166-K1180 VanDerWaalsContact O-CE 3.26Å; A1166-K1180 WeakPolarHBondContact O-CE 3.19Å; T1178-K1180 PolarHBondContact O-N 3Å; K1180-G1182 PolarHBondContact O-N 2.92Å; K1180-Y1183 HydrophobicContact CB-CD2 3.94Å; K1180-Y1183 HydrophobicContact CB-CE2 4.4Å; K1180-Y1183 WeakPolarHBondContact O-CB 3.22Å; K1180-Y1183 WeakPolarHBondContact O-CD2 2.96Å; K1180-Y1183 PolarHBondContact O-N 2.83Å
1181	T	71	Confident	68.4	Low	153 Å²	153	85.5 Å²	85.5	94%	0.939	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	125.4	175.4	-37.9	0	0	0	0	110
1182	G	53	Low	69.1	Low	34 Å²	34	82.3 Å²	82.3	35%	0.351	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	14	-169.3	0	0	0	0	0	115.3	K1180 L1201	K1180-G1182 PolarHBondContact O-N 2.92Å; G1182-L1201 PolarHBondContact O-N 3.07Å
1183	Y	75	Confident	70	Confident	71 Å²	71	76.6 Å²	76.6	28%	0.278	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	131.4	173.6	-65.2	-104.7	0	0	0	111.9	N1165 C1179 K1180 C1198 T1199 R1200	N1165-Y1183 HydrophobicContact CB-CD1 3.71Å; N1165-Y1183 HydrophobicContact CB-CE1 3.69Å; N1165-Y1183 HydrophobicContact CB-CG 4.3Å; C1179-Y1183 WeakPolarHBondContact CB-O 3.36Å; K1180-Y1183 HydrophobicContact CB-CD2 3.94Å; K1180-Y1183 HydrophobicContact CB-CE2 4.4Å; K1180-Y1183 WeakPolarHBondContact O-CB 3.22Å; K1180-Y1183 WeakPolarHBondContact O-CD2 2.96Å; K1180-Y1183 PolarHBondContact O-N 2.83Å; Y1183-C1198 HydrophobicContact CD1-CB 4.5Å; Y1183-T1199 CarbonylContact C-O 3.45Å; Y1183-T1199 WeakPolarHBondContact CA-O 3.02Å; Y1183-T1199 WeakPolarHBondContact CB-O 3.24Å; Y1183-R1200 HydrophobicContact CD1-CB 4.05Å; Y1183-R1200 HydrophobicContact CE1-CB 3.86Å; Y1183-R1200 HydrophobicContact CE1-CG 4.26Å
1184	K	71.1	Confident	71.2	Confident	66 Å²	66	65.7 Å²	65.7	29%	0.287	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	133.4	177.3	-158.4	166	-169.1	158.5	0	109.1	T1186 T1199 L1201 E1223 D1224	K1184-T1186 PolarHBondContact O-N 3.27Å; K1184-T1199 PolarHBondContact N-O 2.76Å; K1184-T1199 PolarHBondContact O-N 3.17Å; K1184-T1199 PolarHBondContact O-OG1 3.17Å; K1184-L1201 HydrophobicContact CB-CD2 3.81Å; K1184-L1201 HydrophobicContact CB-CG 3.95Å; K1184-L1201 HydrophobicContact CD-CD2 3.88Å; K1184-L1201 HydrophobicContact CG-CD2 4.12Å; K1184-E1223 PolarHBondContact NZ-O 3.21Å; K1184-D1224 IonicContact NZ-OD1 2.85Å; K1184-D1224 PolarHBondContact NZ-OD1 2.99Å; K1184-D1224 IonicContact NZ-OD2 4Å; K1184-D1224 PolarHBondContact NZ-OD2 3.48Å
1185	D	73.1	Confident	72.2	Confident	30 Å²	30	64.4 Å²	64.4	16%	0.16	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.5	175.3	-161.7	-23.9	0	0	0	110.5	C1179 S1187 K1190 P1194 G1195	C1179-D1185 VanDerWaalsContact SG-CA 3.54Å; D1185-S1187 WeakPolarHBondContact OD1-CB 3.11Å; D1185-S1187 PolarHBondContact OD1-N 3.3Å; D1185-S1187 PolarHBondContact OD1-OG 3.19Å; D1185-K1190 WeakPolarHBondContact O-CE 3.15Å; D1185-K1190 PolarHBondContact O-NZ 3.35Å; D1185-P1194 WeakPolarHBondContact OD2-CA 3.37Å; D1185-P1194 WeakPolarHBondContact OD2-CB 3.19Å; D1185-G1195 PolarHBondContact OD2-N 3.43Å
1186	T	73.3	Confident	72.4	Confident	52 Å²	52	65.4 Å²	65.4	32%	0.319	36%	0.358	S	S	.	.			trans	-116.7	4.6	177.4	56.9	0	0	0	0	112.9	K1184 Q1197 T1199	K1184-T1186 PolarHBondContact O-N 3.27Å; T1186-Q1197 PolarHBondContact N-O 2.67Å; T1186-Q1197 PolarHBondContact OG1-O 3.44Å; T1186-T1199 HydrophobicContact CG2-CG2 3.86Å; T1186-T1199 WeakPolarHBondContact CG2-OG1 3.28Å
1187	S	75.3	Confident	72.3	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.021	37%	0.37	C	S	.	.			trans	-53.2	133.3	-178.9	-48.1	0	0	0	0	110.8	D1185 D1189 K1190 Y1193 G1195 R1196 Q1197	D1185-S1187 WeakPolarHBondContact OD1-CB 3.11Å; D1185-S1187 PolarHBondContact OD1-N 3.3Å; D1185-S1187 PolarHBondContact OD1-OG 3.19Å; S1187-D1189 PolarHBondContact O-N 2.71Å; S1187-D1189 VanDerWaalsContact O-N 3.12Å; S1187-K1190 WeakPolarHBondContact O-CG 3.04Å; S1187-K1190 PolarHBondContact O-N 3.31Å; S1187-Y1193 WeakPolarHBondContact CB-O 3.06Å; S1187-G1195 PolarHBondContact OG-N 3.03Å; S1187-R1196 PolarHBondContact OG-N 3.25Å; S1187-Q1197 PolarHBondContact N-O 2.85Å; S1187-Q1197 PolarHBondContact OG-N 2.05Å
1188	P	64	Low	72.1	Confident	128 Å²	128	68.6 Å²	68.6	83%	0.831	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.6	-175.2	-29.6	36.1	0	0	0	114.9
1189	D	60.5	Low	71.9	Confident	59 Å²	59	69.9 Å²	69.9	32%	0.316	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	82.1	170.5	-177	-7.7	0	0	0	110.3	S1187 A1191 N1192 Y1193	S1187-D1189 PolarHBondContact O-N 2.71Å; S1187-D1189 VanDerWaalsContact O-N 3.12Å; D1189-A1191 PolarHBondContact O-N 3.04Å; D1189-A1191 VanDerWaalsContact O-N 3.17Å; D1189-A1191 WeakPolarHBondContact OD1-CB 3.28Å; D1189-A1191 PolarHBondContact OD1-N 2.7Å; D1189-N1192 PolarHBondContact OD1-N 2.91Å; D1189-N1192 PolarHBondContact OD1-ND2 3.02Å; D1189-N1192 WeakPolarHBondContact OD2-CB 3.33Å; D1189-N1192 PolarHBondContact OD2-ND2 2.67Å; D1189-Y1193 HydrophobicContact CB-CD2 4.36Å; D1189-Y1193 CarbonylContact O-C 3.55Å; D1189-Y1193 WeakPolarHBondContact O-CA 3.23Å; D1189-Y1193 PolarHBondContact O-N 3.2Å
1190	K	73.6	Confident	71.4	Confident	127 Å²	127	74.7 Å²	74.7	55%	0.552	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-12.2	175.3	-50.1	-170.2	-168.1	-167	0	113.8	D1185 S1187	D1185-K1190 WeakPolarHBondContact O-CE 3.15Å; D1185-K1190 PolarHBondContact O-NZ 3.35Å; S1187-K1190 WeakPolarHBondContact O-CG 3.04Å; S1187-K1190 PolarHBondContact O-N 3.31Å
1191	A	66.3	Low	71	Confident	88 Å²	88	74.3 Å²	74.3	73%	0.727	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-40.2	-175.6	0	0	0	0	0	112.2	D1189	D1189-A1191 PolarHBondContact O-N 3.04Å; D1189-A1191 VanDerWaalsContact O-N 3.17Å; D1189-A1191 WeakPolarHBondContact OD1-CB 3.28Å; D1189-A1191 PolarHBondContact OD1-N 2.7Å
1192	N	71	Confident	70.6	Confident	115 Å²	115	69.1 Å²	69.1	62%	0.615	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-28.4	179.4	-53.8	-72.7	0	0	0	113.5	D1189 P1194	D1189-N1192 PolarHBondContact OD1-N 2.91Å; D1189-N1192 PolarHBondContact OD1-ND2 3.02Å; D1189-N1192 WeakPolarHBondContact OD2-CB 3.33Å; D1189-N1192 PolarHBondContact OD2-ND2 2.67Å; N1192-P1194 VanDerWaalsContact C-CD 3.44Å
1193	Y	75.4	Confident	71.2	Confident	132 Å²	132	69.7 Å²	69.7	52%	0.518	36%	0.358	S	S	.	.	S	Bend	trans	-132.8	56.6	-175	-59.7	-75.4	0	0	0	112.9	S1187 D1189	S1187-Y1193 WeakPolarHBondContact CB-O 3.06Å; D1189-Y1193 HydrophobicContact CB-CD2 4.36Å; D1189-Y1193 CarbonylContact O-C 3.55Å; D1189-Y1193 WeakPolarHBondContact O-CA 3.23Å; D1189-Y1193 PolarHBondContact O-N 3.2Å
1194	P	75.7	Confident	71.3	Confident	32 Å²	32	68.3 Å²	68.3	21%	0.208	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	164.4	170.4	29.7	-36.1	0	0	0	111.7	C1177 D1185 N1192 R1196	C1177-P1194 WeakPolarHBondContact CB-O 3.21Å; C1177-P1194 CarbonylContact O-C 3.57Å; C1177-P1194 VanDerWaalsContact O-C 3.3Å; C1177-P1194 VanDerWaalsContact O-O 3.12Å; D1185-P1194 WeakPolarHBondContact OD2-CA 3.37Å; D1185-P1194 WeakPolarHBondContact OD2-CB 3.19Å; N1192-P1194 VanDerWaalsContact C-CD 3.44Å; P1194-R1196 VanDerWaalsContact C-N 3.25Å; P1194-R1196 PolarHBondContact O-N 2.85Å
1195	G	77.4	Confident	71.5	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	18.3	173.1	0	0	0	0	0	115.8	D1163 A1166 C1177 D1185 S1187	D1163-G1195 PolarHBondContact N-O 3.16Å; A1166-G1195 WeakPolarHBondContact CB-O 3.16Å; C1177-G1195 VanDerWaalsContact CB-O 3.24Å; C1177-G1195 WeakPolarHBondContact CB-O 3.24Å; D1185-G1195 PolarHBondContact OD2-N 3.43Å; S1187-G1195 PolarHBondContact OG-N 3.03Å
1196	R	80.7	Confident	71.2	Confident	86 Å²	86	73 Å²	73	33%	0.325	38%	0.379	S	S	.	.	S	Bend	trans	-91.6	-15.9	173	-65.5	-164.1	173.9	-140.7	-10.8	113.3	E1161 Y1175 S1187 P1194	E1161-R1196 IonicContact OE2-CZ 3.11Å; E1161-R1196 IonicContact OE2-NH1 2.66Å; E1161-R1196 PolarHBondContact OE2-NH1 3.48Å; E1161-R1196 IonicContact OE2-NH2 3.87Å; E1161-R1196 PolarHBondContact OE2-NH2 2.91Å; Y1175-R1196 PolarHBondContact OH-NH2 2.88Å; S1187-R1196 PolarHBondContact OG-N 3.25Å; P1194-R1196 VanDerWaalsContact C-N 3.25Å; P1194-R1196 PolarHBondContact O-N 2.85Å
1197	Q	70.6	Confident	70.8	Confident	101 Å²	101	74.4 Å²	74.4	47%	0.472	38%	0.382	S	S	.	.	S	Bend	trans	-149.9	103	178.6	-154.8	167.7	7.4	0	0	110.5	D1163 T1186 S1187	D1163-Q1197 WeakPolarHBondContact OD2-CA 3.18Å; T1186-Q1197 PolarHBondContact N-O 2.67Å; T1186-Q1197 PolarHBondContact OG1-O 3.44Å; S1187-Q1197 PolarHBondContact N-O 2.85Å; S1187-Q1197 PolarHBondContact OG-N 2.05Å
1198	C	78.2	Confident	70.2	Confident	7 Å²	7	81.4 Å²	81.4	5%	0.047	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	107.6	-167.8	-65.9	0	0	0	0	111.8	D1163 N1165 C1179 Y1183	D1163-C1198 HydrophobicContact CB-CB 4.32Å; D1163-C1198 PolarHBondContact OD2-N 3.41Å; N1165-C1198 HydrophobicContact CB-CB 3.92Å; C1179-C1198 WeakPolarHBondContact CA-SG 3.01Å; C1179-C1198 HydrophobicContact CB-CB 3.81Å; C1179-C1198 WeakPolarHBondContact CB-SG 3.01Å; C1179-C1198 VanDerWaalsContact SG-CA 3.55Å; C1179-C1198 WeakPolarHBondContact SG-CB 3.46Å; C1179-C1198 CovalentContact SG-SG 2.04Å; C1179-C1198 PolarHBondContact SG-SG 3.49Å; Y1183-C1198 HydrophobicContact CD1-CB 4.5Å
1199	T	72.1	Confident	69.9	Low	70 Å²	70	84.6 Å²	84.6	43%	0.429	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	142.3	177.1	55	0	0	0	0	110.7	Y1183 K1184 T1186 L1201	Y1183-T1199 CarbonylContact C-O 3.45Å; Y1183-T1199 WeakPolarHBondContact CA-O 3.02Å; Y1183-T1199 WeakPolarHBondContact CB-O 3.24Å; K1184-T1199 PolarHBondContact N-O 2.76Å; K1184-T1199 PolarHBondContact O-N 3.17Å; K1184-T1199 PolarHBondContact O-OG1 3.17Å; T1186-T1199 HydrophobicContact CG2-CG2 3.86Å; T1186-T1199 WeakPolarHBondContact CG2-OG1 3.28Å; T1199-L1201 PolarHBondContact O-N 3Å
1200	R	68.9	Low	69.9	Low	126 Å²	126	85.6 Å²	85.6	48%	0.475	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	127.8	-178.8	-168.1	-179	72.3	127.7	-3.6	110.6	Y1183 V1202	Y1183-R1200 HydrophobicContact CD1-CB 4.05Å; Y1183-R1200 HydrophobicContact CE1-CB 3.86Å; Y1183-R1200 HydrophobicContact CE1-CG 4.26Å; R1200-V1202 PolarHBondContact O-N 3.37Å
1201	L	65.8	Low	69.7	Low	81 Å²	81	80.1 Å²	80.1	42%	0.424	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-69.5	123.7	161.9	-76.7	166.9	0	0	0	107.6	G1182 K1184 T1199	G1182-L1201 PolarHBondContact O-N 3.07Å; K1184-L1201 HydrophobicContact CB-CD2 3.81Å; K1184-L1201 HydrophobicContact CB-CG 3.95Å; K1184-L1201 HydrophobicContact CD-CD2 3.88Å; K1184-L1201 HydrophobicContact CG-CD2 4.12Å; T1199-L1201 PolarHBondContact O-N 3Å
1202	V	62	Low	70.2	Confident	43 Å²	43	79.6 Å²	79.6	26%	0.261	38%	0.379	S	S	.	.			trans	-105.5	109.8	-179.8	-175.7	0	0	0	0	107.6	R1200 E1204 M1210	R1200-V1202 PolarHBondContact O-N 3.37Å; V1202-E1204 HydrophobicContact CG1-CG 4.42Å; V1202-E1204 PolarHBondContact O-N 3.08Å; V1202-M1210 HydrophobicContact CG1-CE 3.32Å; V1202-M1210 HydrophobicContact CG1-SD 3.86Å
1203	N	66	Low	70.6	Confident	46 Å²	46	74.5 Å²	74.5	25%	0.246	35%	0.352	C	S	.	.			trans	-71.7	107.6	164.6	-178.2	-60.5	0	0	0	107.2	C1205 E1206 D1221	N1203-C1205 PolarHBondContact O-N 3.08Å; N1203-C1205 WeakPolarHBondContact OD1-CA 3.44Å; N1203-C1205 WeakPolarHBondContact OD1-CB 3.34Å; N1203-C1205 PolarHBondContact OD1-N 3.22Å; N1203-E1206 HydrophobicContact CB-CB 4.38Å; N1203-E1206 HydrophobicContact CB-CG 4.23Å; N1203-E1206 PolarHBondContact OD1-N 3.1Å; N1203-D1221 VanDerWaalsContact CA-OD1 3.26Å; N1203-D1221 WeakPolarHBondContact CA-OD1 3.23Å; N1203-D1221 VanDerWaalsContact CG-OD2 3.27Å; N1203-D1221 PolarHBondContact ND2-OD1 3.01Å; N1203-D1221 PolarHBondContact ND2-OD2 3.46Å; N1203-D1221 PolarHBondContact OD1-OD1 2.72Å
1204	E	76.9	Confident	70.7	Confident	42 Å²	42	69 Å²	69	20%	0.196	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-20	-179.7	-74.8	106.2	-169.2	0	0	112	V1202 H1207 M1210 N1211 D1221 G1225 Y1226	V1202-E1204 HydrophobicContact CG1-CG 4.42Å; V1202-E1204 PolarHBondContact O-N 3.08Å; E1204-H1207 CarbonylContact O-C 3.58Å; E1204-H1207 PolarHBondContact O-N 3.35Å; E1204-M1210 HydrophobicContact CB-CB 4.16Å; E1204-M1210 HydrophobicContact CG-CB 3.69Å; E1204-N1211 HydrophobicContact CB-CB 4.23Å; E1204-N1211 WeakPolarHBondContact O-CB 3.31Å; E1204-N1211 PolarHBondContact O-ND2 3.27Å; E1204-D1221 PolarHBondContact N-OD1 2.87Å; E1204-G1225 VanDerWaalsContact OE2-C 3.24Å; E1204-G1225 VanDerWaalsContact OE2-CA 3.23Å; E1204-G1225 WeakPolarHBondContact OE2-CA 3.32Å; E1204-Y1226 HydrophobicContact CB-CD1 3.43Å; E1204-Y1226 VanDerWaalsContact CB-CD1 3.43Å; E1204-Y1226 HydrophobicContact CB-CE1 4.02Å; E1204-Y1226 HydrophobicContact CB-CG 4.16Å; E1204-Y1226 HydrophobicContact CG-CD1 3.88Å; E1204-Y1226 HydrophobicContact CG-CE1 4.19Å
1205	C	75.7	Confident	70.6	Confident	35 Å²	35	72.8 Å²	72.8	24%	0.236	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-30.6	176.4	-62.7	0	0	0	0	113.5	N1203 H1207 C1219 D1221	N1203-C1205 PolarHBondContact O-N 3.08Å; N1203-C1205 WeakPolarHBondContact OD1-CA 3.44Å; N1203-C1205 WeakPolarHBondContact OD1-CB 3.34Å; N1203-C1205 PolarHBondContact OD1-N 3.22Å; C1205-H1207 VanDerWaalsContact C-N 3.32Å; C1205-C1219 WeakPolarHBondContact CA-SG 3.47Å; C1205-C1219 HydrophobicContact CB-CB 3.75Å; C1205-C1219 WeakPolarHBondContact CB-SG 3.41Å; C1205-C1219 WeakPolarHBondContact SG-CB 3.11Å; C1205-C1219 CovalentContact SG-SG 2.04Å; C1205-C1219 PolarHBondContact SG-SG 3.06Å; C1205-D1221 PolarHBondContact SG-N 2.83Å
1206	E	64.9	Low	70.6	Confident	160 Å²	160	75.5 Å²	75.5	75%	0.748	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-31.4	170.6	-77.2	-169.6	151.7	0	0	111.8	N1203	N1203-E1206 HydrophobicContact CB-CB 4.38Å; N1203-E1206 HydrophobicContact CB-CG 4.23Å; N1203-E1206 PolarHBondContact OD1-N 3.1Å
1207	H	65.6	Low	70.5	Confident	82 Å²	82	72 Å²	72	38%	0.38	34%	0.343	S	S	.	.			trans	-110.2	93	-177.4	-76.2	-70.3	0	0	0	111.9	E1204 C1205 Q1209 M1210 N1211	E1204-H1207 CarbonylContact O-C 3.58Å; E1204-H1207 PolarHBondContact O-N 3.35Å; C1205-H1207 VanDerWaalsContact C-N 3.32Å; H1207-Q1209 PolarHBondContact O-N 2.8Å; H1207-M1210 HydrophobicContact CB-CB 4.48Å; H1207-M1210 HydrophobicContact CB-CE 3.34Å; H1207-M1210 WeakPolarHBondContact CD2-CE 3.21Å; H1207-M1210 VanDerWaalsContact CG-CE 3.42Å; H1207-M1210 PolarHBondContact O-N 2.85Å; H1207-N1211 PolarHBondContact O-N 3.22Å
1208	Y	63.3	Low	70.8	Confident	150 Å²	150	71.9 Å²	71.9	59%	0.588	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-8.8	-179.8	-153	-85.2	0	0	0	116.2
1209	Q	58.4	Low	70.9	Confident	195 Å²	195	73.3 Å²	73.3	91%	0.911	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-16.9	171.8	-68.4	-177.3	-8.3	0	0	113.9	H1207	H1207-Q1209 PolarHBondContact O-N 2.8Å
1210	M	59.1	Low	71	Confident	80 Å²	80	74 Å²	74	39%	0.394	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-23.1	-177.8	-63.3	-170.7	-75.3	0	0	112.1	V1202 E1204 H1207 Y1226	V1202-M1210 HydrophobicContact CG1-CE 3.32Å; V1202-M1210 HydrophobicContact CG1-SD 3.86Å; E1204-M1210 HydrophobicContact CB-CB 4.16Å; E1204-M1210 HydrophobicContact CG-CB 3.69Å; H1207-M1210 HydrophobicContact CB-CB 4.48Å; H1207-M1210 HydrophobicContact CB-CE 3.34Å; H1207-M1210 WeakPolarHBondContact CD2-CE 3.21Å; H1207-M1210 VanDerWaalsContact CG-CE 3.42Å; H1207-M1210 PolarHBondContact O-N 2.85Å; M1210-Y1226 VanDerWaalsContact O-CE1 3.23Å; M1210-Y1226 WeakPolarHBondContact O-CE1 3.4Å; M1210-Y1226 PolarHBondContact O-OH 2.83Å
1211	N	69.1	Low	71.2	Confident	12 Å²	12	71.1 Å²	71.1	6%	0.064	35%	0.349	C	S	.	.			trans	-94.1	167.5	161	86.4	80.5	0	0	0	113.5	E1204 H1207 C1213 Y1226	E1204-N1211 HydrophobicContact CB-CB 4.23Å; E1204-N1211 WeakPolarHBondContact O-CB 3.31Å; E1204-N1211 PolarHBondContact O-ND2 3.27Å; H1207-N1211 PolarHBondContact O-N 3.22Å; N1211-C1213 PolarHBondContact OD1-N 2.71Å; N1211-Y1226 VanDerWaalsContact CA-CZ 3.47Å; N1211-Y1226 HydrophobicContact CB-CD1 4.06Å; N1211-Y1226 HydrophobicContact CB-CD2 3.7Å; N1211-Y1226 HydrophobicContact CB-CE1 4.05Å; N1211-Y1226 HydrophobicContact CB-CE2 3.71Å; N1211-Y1226 HydrophobicContact CB-CG 3.9Å
1212	N	77.7	Confident	71	Confident	77 Å²	77	72.1 Å²	72.1	41%	0.412	35%	0.352	S	S	.	.			trans	-145.6	36.1	177.2	53	32	0	0	0	111.3	Y1226 R1244	N1212-Y1226 PolarHBondContact ND2-OH 3.47Å; N1212-Y1226 WeakPolarHBondContact OD1-CE2 3.47Å; N1212-Y1226 PolarHBondContact OD1-OH 3.38Å; N1212-Y1226 VanDerWaalsContact OD1-OH 3.04Å; N1212-R1244 PolarHBondContact ND2-NH1 3.06Å; N1212-R1244 PolarHBondContact OD1-NE 3.05Å; N1212-R1244 PolarHBondContact OD1-NH1 2.89Å; N1212-R1244 PolarHBondContact OD1-NH2 2.84Å; N1212-R1244 VanDerWaalsContact OD1-NH2 3.09Å
1213	C	79.8	Confident	70.7	Confident	8 Å²	8	78.3 Å²	78.3	5%	0.054	38%	0.378	C	S	.	.			trans	-65.9	155.5	169.4	-60.9	0	0	0	0	110.7	N1211 A1217 C1219 C1228	N1211-C1213 PolarHBondContact OD1-N 2.71Å; C1213-A1217 HydrophobicContact CB-CB 4.43Å; C1213-C1219 HydrophobicContact CB-CB 4.3Å; C1213-C1228 WeakPolarHBondContact CA-SG 3.29Å; C1213-C1228 HydrophobicContact CB-CB 3.65Å; C1213-C1228 WeakPolarHBondContact CB-SG 3.45Å; C1213-C1228 WeakPolarHBondContact SG-CB 3.05Å; C1213-C1228 CovalentContact SG-SG 2.03Å; C1213-C1228 PolarHBondContact SG-SG 3.09Å
1214	S	77.9	Confident	70.2	Confident	17 Å²	17	83 Å²	83	12%	0.119	40%	0.403	C	S	.	.			trans	-59.5	144.2	166.8	-167.4	0	0	0	0	108.7	Y1216 A1217 G1243 R1244 C1246	S1214-Y1216 PolarHBondContact O-N 2.8Å; S1214-Y1216 VanDerWaalsContact O-N 3.13Å; S1214-A1217 WeakPolarHBondContact O-CB 3.44Å; S1214-A1217 PolarHBondContact O-N 2.73Å; S1214-G1243 VanDerWaalsContact CB-O 3.25Å; S1214-G1243 WeakPolarHBondContact CB-O 3.12Å; S1214-G1243 PolarHBondContact N-O 3.27Å; S1214-R1244 WeakPolarHBondContact CB-O 3.22Å; S1214-C1246 VanDerWaalsContact CB-SG 3.52Å; S1214-C1246 PolarHBondContact OG-N 3.5Å
1215	R	73.4	Confident	69.7	Low	110 Å²	110	81.8 Å²	81.8	42%	0.415	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.6	172.9	65.8	178.8	-57.7	170.7	4.6	113.3	L474 Y475	L474-R1215 PolarHBondContact O-NH2 3.01Å; Y475-R1215 VanDerWaalsContact CD1-NH2 3.28Å; Y475-R1215 HydrophobicContact CE1-CG 4.26Å; Y475-R1215 WeakPolarHBondContact OH-CB 3.47Å; Y475-R1215 WeakPolarHBondContact OH-CG 3.23Å; Y475-R1215 PolarHBondContact OH-NE 2.98Å; Y475-R1215 PolarHBondContact OH-O 3.44Å
1216	Y	75.8	Confident	69.9	Low	58 Å²	58	82.2 Å²	82.2	23%	0.227	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	21	172.6	-46.5	-78.9	0	0	0	113.1	Y475 S1214 I1231 Y1234 C1246	Y475-Y1216 HydrophobicContact CD1-CE1 4.06Å; Y475-Y1216 AromaticContact CE1-CD1 3.91Å; Y475-Y1216 HydrophobicContact CE1-CD1 3.91Å; Y475-Y1216 AromaticContact CE1-CE1 3.23Å; Y475-Y1216 HydrophobicContact CE1-CE1 3.23Å; Y475-Y1216 AromaticContact CE1-CZ 3.68Å; Y475-Y1216 AromaticContact CZ-CE1 3.88Å; S1214-Y1216 PolarHBondContact O-N 2.8Å; S1214-Y1216 VanDerWaalsContact O-N 3.13Å; Y1216-I1231 WeakPolarHBondContact O-CB 3.36Å; Y1216-I1231 WeakPolarHBondContact O-CG1 3.22Å; Y1216-I1231 PolarHBondContact O-N 3.33Å; Y1216-Y1234 AromaticContact CD1-CD1 3.98Å; Y1216-Y1234 HydrophobicContact CD1-CD1 3.98Å; Y1216-Y1234 AromaticContact CD1-CE1 3.17Å; Y1216-Y1234 HydrophobicContact CD1-CE1 3.17Å; Y1216-Y1234 HydrophobicContact CD1-CE2 4.31Å; Y1216-Y1234 AromaticContact CD1-CZ 3.38Å; Y1216-Y1234 WeakPolarHBondContact CD1-OH 3.19Å; Y1216-Y1234 HydrophobicContact CD2-CD1 4.1Å; Y1216-Y1234 AromaticContact CD2-CE1 3.9Å; Y1216-Y1234 HydrophobicContact CD2-CE1 3.9Å; Y1216-Y1234 AromaticContact CE1-CE1 3.58Å; Y1216-Y1234 HydrophobicContact CE1-CE1 3.58Å; Y1216-Y1234 AromaticContact CE1-CZ 3.85Å; Y1216-Y1234 WeakPolarHBondContact CE1-OH 3.38Å; Y1216-Y1234 HydrophobicContact CE2-CE1 4.28Å; Y1216-Y1234 AromaticContact CG-CD1 3.65Å; Y1216-Y1234 HydrophobicContact CG-CD1 3.65Å; Y1216-Y1234 AromaticContact CG-CE1 3.32Å; Y1216-Y1234 HydrophobicContact CG-CE1 3.32Å; Y1216-Y1234 HydrophobicContact CG-CG 4.49Å; Y1216-Y1234 AromaticContact CG-CZ 3.94Å; Y1216-C1246 WeakPolarHBondContact CD2-O 3.32Å
1217	A	78.7	Confident	70.3	Confident	12 Å²	12	77.6 Å²	77.6	10%	0.099	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	147.5	170.4	0	0	0	0	0	111.1	C1213 S1214 C1219 C1228 K1229 G1243	C1213-A1217 HydrophobicContact CB-CB 4.43Å; S1214-A1217 WeakPolarHBondContact O-CB 3.44Å; S1214-A1217 PolarHBondContact O-N 2.73Å; A1217-C1219 PolarHBondContact O-N 3.08Å; A1217-C1228 HydrophobicContact CB-CB 4.47Å; A1217-K1229 CarbonylContact C-O 3.48Å; A1217-K1229 WeakPolarHBondContact CA-O 3.2Å; A1217-K1229 VanDerWaalsContact CB-O 3.26Å; A1217-K1229 WeakPolarHBondContact CB-O 3.38Å; A1217-G1243 WeakPolarHBondContact CB-O 3.23Å
1218	N	78.2	Confident	71.1	Confident	98 Å²	98	74.1 Å²	74.1	52%	0.524	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	121.3	163.2	-69.2	-3.3	0	0	0	108.2	C1228 K1229 I1231	N1218-C1228 WeakPolarHBondContact O-CA 3.36Å; N1218-K1229 PolarHBondContact N-O 3.46Å; N1218-K1229 PolarHBondContact O-N 3Å; N1218-I1231 WeakPolarHBondContact OD1-CG1 3.29Å
1219	C	80.1	Confident	71.6	Confident	38 Å²	38	73.8 Å²	73.8	26%	0.257	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	128	160.8	-172.2	0	0	0	0	108.1	C1205 C1213 A1217	C1205-C1219 WeakPolarHBondContact CA-SG 3.47Å; C1205-C1219 HydrophobicContact CB-CB 3.75Å; C1205-C1219 WeakPolarHBondContact CB-SG 3.41Å; C1205-C1219 WeakPolarHBondContact SG-CB 3.11Å; C1205-C1219 CovalentContact SG-SG 2.04Å; C1205-C1219 PolarHBondContact SG-SG 3.06Å; C1213-C1219 HydrophobicContact CB-CB 4.3Å; A1217-C1219 PolarHBondContact O-N 3.08Å
1220	I	74.2	Confident	72.7	Confident	84 Å²	84	65.5 Å²	65.5	43%	0.431	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	111.8	179.1	-54.8	176.5	0	0	0	107.1	Y1226 T1227	I1220-Y1226 WeakPolarHBondContact O-CA 3.42Å; I1220-T1227 PolarHBondContact N-O 3.27Å; I1220-T1227 PolarHBondContact O-N 3.24Å
1221	D	72.1	Confident	73.4	Confident	66 Å²	66	64.9 Å²	64.9	35%	0.353	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	143.8	179	-155.1	59	0	0	0	111	N1203 E1204 C1205	N1203-D1221 VanDerWaalsContact CA-OD1 3.26Å; N1203-D1221 WeakPolarHBondContact CA-OD1 3.23Å; N1203-D1221 VanDerWaalsContact CG-OD2 3.27Å; N1203-D1221 PolarHBondContact ND2-OD1 3.01Å; N1203-D1221 PolarHBondContact ND2-OD2 3.46Å; N1203-D1221 PolarHBondContact OD1-OD1 2.72Å; E1204-D1221 PolarHBondContact N-OD1 2.87Å; C1205-D1221 PolarHBondContact SG-N 2.83Å
1222	Q	62.8	Low	73.3	Confident	101 Å²	101	70.3 Å²	70.3	47%	0.472	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	157.2	-178.6	-58.6	-180	-49.5	0	0	110	D1224 G1225 T1227	Q1222-D1224 PolarHBondContact O-N 3.27Å; Q1222-G1225 CarbonylContact C-O 3.52Å; Q1222-G1225 VanDerWaalsContact CA-O 3.31Å; Q1222-G1225 WeakPolarHBondContact CA-O 3.47Å; Q1222-G1225 WeakPolarHBondContact CB-O 3.3Å; Q1222-G1225 PolarHBondContact N-O 2.72Å; Q1222-G1225 PolarHBondContact O-N 2.8Å; Q1222-T1227 VanDerWaalsContact CD-OG1 3.31Å; Q1222-T1227 PolarHBondContact NE2-OG1 3.14Å; Q1222-T1227 PolarHBondContact OE1-OG1 3.46Å
1223	E	56.1	Low	72.3	Confident	173 Å²	173	68.3 Å²	68.3	81%	0.808	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-10.3	-171.6	-58.3	-172	147.6	0	0	115.6	K1184	K1184-E1223 PolarHBondContact NZ-O 3.21Å
1224	D	54.1	Low	72	Confident	146 Å²	146	70.9 Å²	70.9	78%	0.781	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.6	33.8	176.5	-79.8	-64	0	0	0	111.6	K1184 Q1222	K1184-D1224 IonicContact NZ-OD1 2.85Å; K1184-D1224 PolarHBondContact NZ-OD1 2.99Å; K1184-D1224 IonicContact NZ-OD2 4Å; K1184-D1224 PolarHBondContact NZ-OD2 3.48Å; Q1222-D1224 PolarHBondContact O-N 3.27Å
1225	G	66.5	Low	71.5	Confident	15 Å²	15	73.7 Å²	73.7	16%	0.155	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.6	-155.5	173.8	0	0	0	0	0	114.9	E1204 Q1222	E1204-G1225 VanDerWaalsContact OE2-C 3.24Å; E1204-G1225 VanDerWaalsContact OE2-CA 3.23Å; E1204-G1225 WeakPolarHBondContact OE2-CA 3.32Å; Q1222-G1225 CarbonylContact C-O 3.52Å; Q1222-G1225 VanDerWaalsContact CA-O 3.31Å; Q1222-G1225 WeakPolarHBondContact CA-O 3.47Å; Q1222-G1225 WeakPolarHBondContact CB-O 3.3Å; Q1222-G1225 PolarHBondContact N-O 2.72Å; Q1222-G1225 PolarHBondContact O-N 2.8Å
1226	Y	80.4	Confident	71.4	Confident	45 Å²	45	70.3 Å²	70.3	18%	0.176	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	152	175.3	61	-82.5	0	0	0	112.4	E1204 M1210 N1211 N1212 I1220	E1204-Y1226 HydrophobicContact CB-CD1 3.43Å; E1204-Y1226 VanDerWaalsContact CB-CD1 3.43Å; E1204-Y1226 HydrophobicContact CB-CE1 4.02Å; E1204-Y1226 HydrophobicContact CB-CG 4.16Å; E1204-Y1226 HydrophobicContact CG-CD1 3.88Å; E1204-Y1226 HydrophobicContact CG-CE1 4.19Å; M1210-Y1226 VanDerWaalsContact O-CE1 3.23Å; M1210-Y1226 WeakPolarHBondContact O-CE1 3.4Å; M1210-Y1226 PolarHBondContact O-OH 2.83Å; N1211-Y1226 VanDerWaalsContact CA-CZ 3.47Å; N1211-Y1226 HydrophobicContact CB-CD1 4.06Å; N1211-Y1226 HydrophobicContact CB-CD2 3.7Å; N1211-Y1226 HydrophobicContact CB-CE1 4.05Å; N1211-Y1226 HydrophobicContact CB-CE2 3.71Å; N1211-Y1226 HydrophobicContact CB-CG 3.9Å; N1212-Y1226 PolarHBondContact ND2-OH 3.47Å; N1212-Y1226 WeakPolarHBondContact OD1-CE2 3.47Å; N1212-Y1226 PolarHBondContact OD1-OH 3.38Å; N1212-Y1226 VanDerWaalsContact OD1-OH 3.04Å; I1220-Y1226 WeakPolarHBondContact O-CA 3.42Å
1227	T	72.7	Confident	71.1	Confident	63 Å²	63	70.7 Å²	70.7	39%	0.387	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148.9	173.8	-68.5	0	0	0	0	110.3	I1220 Q1222	I1220-T1227 PolarHBondContact N-O 3.27Å; I1220-T1227 PolarHBondContact O-N 3.24Å; Q1222-T1227 VanDerWaalsContact CD-OG1 3.31Å; Q1222-T1227 PolarHBondContact NE2-OG1 3.14Å; Q1222-T1227 PolarHBondContact OE1-OG1 3.46Å
1228	C	82.9	Confident	70.5	Confident	8 Å²	8	72.3 Å²	72.3	5%	0.054	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.8	-176.6	-47.1	0	0	0	0	111.3	C1213 A1217 N1218 P1242 G1243	C1213-C1228 WeakPolarHBondContact CA-SG 3.29Å; C1213-C1228 HydrophobicContact CB-CB 3.65Å; C1213-C1228 WeakPolarHBondContact CB-SG 3.45Å; C1213-C1228 WeakPolarHBondContact SG-CB 3.05Å; C1213-C1228 CovalentContact SG-SG 2.03Å; C1213-C1228 PolarHBondContact SG-SG 3.09Å; A1217-C1228 HydrophobicContact CB-CB 4.47Å; N1218-C1228 WeakPolarHBondContact O-CA 3.36Å; C1228-P1242 WeakPolarHBondContact CB-O 3.4Å; C1228-G1243 WeakPolarHBondContact CB-O 3.47Å
1229	K	74	Confident	69.8	Low	144 Å²	144	73.4 Å²	73.4	63%	0.626	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.5	128.3	172.4	179	-180	175.6	178.7	0	112	A1217 N1218	A1217-K1229 CarbonylContact C-O 3.48Å; A1217-K1229 WeakPolarHBondContact CA-O 3.2Å; A1217-K1229 VanDerWaalsContact CB-O 3.26Å; A1217-K1229 WeakPolarHBondContact CB-O 3.38Å; N1218-K1229 PolarHBondContact N-O 3.46Å; N1218-K1229 PolarHBondContact O-N 3Å
1230	C	80.7	Confident	69.2	Low	20 Å²	20	82.9 Å²	82.9	14%	0.135	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	143.5	177.7	-60.3	0	0	0	0	113.2	D1236 C1246	C1230-D1236 WeakPolarHBondContact SG-CB 3.47Å; C1230-C1246 WeakPolarHBondContact CA-SG 2.84Å; C1230-C1246 HydrophobicContact CB-CB 3.83Å; C1230-C1246 WeakPolarHBondContact CB-SG 3.4Å; C1230-C1246 VanDerWaalsContact SG-CA 3.59Å; C1230-C1246 WeakPolarHBondContact SG-CB 3.16Å; C1230-C1246 CovalentContact SG-SG 2.03Å; C1230-C1246 PolarHBondContact SG-SG 2.79Å
1231	I	74.1	Confident	69.2	Low	68 Å²	68	83.1 Å²	83.1	35%	0.349	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-75.5	149	177.1	-64.4	166.7	0	0	0	109.5	Y1216 N1218 G1233 Y1234	Y1216-I1231 WeakPolarHBondContact O-CB 3.36Å; Y1216-I1231 WeakPolarHBondContact O-CG1 3.22Å; Y1216-I1231 PolarHBondContact O-N 3.33Å; N1218-I1231 WeakPolarHBondContact OD1-CG1 3.29Å; I1231-G1233 PolarHBondContact O-N 3.36Å; I1231-Y1234 HydrophobicContact CB-CD2 4.35Å; I1231-Y1234 WeakPolarHBondContact O-CB 3.36Å; I1231-Y1234 PolarHBondContact O-N 3.35Å
1232	S	66.9	Low	69	Low	125 Å²	125	83.3 Å²	83.3	87%	0.874	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	135.8	178.6	-161.8	0	0	0	0	111.6
1233	G	56.8	Low	69.7	Low	35 Å²	35	78.5 Å²	78.5	36%	0.361	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	-0.5	-169.2	0	0	0	0	0	114.8	I1231 I1249	I1231-G1233 PolarHBondContact O-N 3.36Å; G1233-I1249 PolarHBondContact O-N 2.7Å
1234	Y	73.5	Confident	71.1	Confident	62 Å²	62	74 Å²	74	24%	0.243	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.8	173.7	-62.6	-106.5	0	0	0	110.8	Y1216 I1231 T1247 L1248	Y1216-Y1234 AromaticContact CD1-CD1 3.98Å; Y1216-Y1234 HydrophobicContact CD1-CD1 3.98Å; Y1216-Y1234 AromaticContact CD1-CE1 3.17Å; Y1216-Y1234 HydrophobicContact CD1-CE1 3.17Å; Y1216-Y1234 HydrophobicContact CD1-CE2 4.31Å; Y1216-Y1234 AromaticContact CD1-CZ 3.38Å; Y1216-Y1234 WeakPolarHBondContact CD1-OH 3.19Å; Y1216-Y1234 HydrophobicContact CD2-CD1 4.1Å; Y1216-Y1234 AromaticContact CD2-CE1 3.9Å; Y1216-Y1234 HydrophobicContact CD2-CE1 3.9Å; Y1216-Y1234 AromaticContact CE1-CE1 3.58Å; Y1216-Y1234 HydrophobicContact CE1-CE1 3.58Å; Y1216-Y1234 AromaticContact CE1-CZ 3.85Å; Y1216-Y1234 WeakPolarHBondContact CE1-OH 3.38Å; Y1216-Y1234 HydrophobicContact CE2-CE1 4.28Å; Y1216-Y1234 AromaticContact CG-CD1 3.65Å; Y1216-Y1234 HydrophobicContact CG-CD1 3.65Å; Y1216-Y1234 AromaticContact CG-CE1 3.32Å; Y1216-Y1234 HydrophobicContact CG-CE1 3.32Å; Y1216-Y1234 HydrophobicContact CG-CG 4.49Å; Y1216-Y1234 AromaticContact CG-CZ 3.94Å; I1231-Y1234 HydrophobicContact CB-CD2 4.35Å; I1231-Y1234 WeakPolarHBondContact O-CB 3.36Å; I1231-Y1234 PolarHBondContact O-N 3.35Å; Y1234-T1247 CarbonylContact C-O 2.94Å; Y1234-T1247 WeakPolarHBondContact CA-O 3.14Å; Y1234-L1248 HydrophobicContact CD1-CB 3.95Å; Y1234-L1248 HydrophobicContact CD1-CD1 4.36Å; Y1234-L1248 VanDerWaalsContact CD1-N 3.34Å; Y1234-L1248 HydrophobicContact CD2-CD1 4.36Å; Y1234-L1248 HydrophobicContact CE1-CB 3.69Å; Y1234-L1248 HydrophobicContact CE1-CD1 3.86Å; Y1234-L1248 HydrophobicContact CE1-CG 4.36Å; Y1234-L1248 HydrophobicContact CE2-CD1 3.88Å
1235	H	67.4	Low	72	Confident	77 Å²	77	72.2 Å²	72.2	36%	0.356	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	154.4	172.9	-174.6	75.2	0	0	0	111	C1246 T1247 I1249 V1272	H1235-C1246 CarbonylContact O-C 3.45Å; H1235-C1246 VanDerWaalsContact O-CA 3.23Å; H1235-C1246 WeakPolarHBondContact O-CA 3.11Å; H1235-T1247 PolarHBondContact N-O 3.46Å; H1235-T1247 PolarHBondContact O-N 3.44Å; H1235-I1249 HydrophobicContact CB-CD1 4.48Å; H1235-I1249 HydrophobicContact CB-CG1 4.24Å; H1235-V1272 HydrophobicContact CB-CG2 4.11Å
1236	D	72.3	Confident	72.5	Confident	39 Å²	39	71.8 Å²	71.8	21%	0.209	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	104.7	-172	-165.7	-6.8	0	0	0	111.5	C1230 N1238 P1242 G1243	C1230-D1236 WeakPolarHBondContact SG-CB 3.47Å; D1236-N1238 PolarHBondContact O-N 2.82Å; D1236-N1238 PolarHBondContact OD1-N 2.88Å; D1236-P1242 WeakPolarHBondContact OD2-CA 3.2Å; D1236-P1242 VanDerWaalsContact OD2-CB 3.32Å; D1236-P1242 WeakPolarHBondContact OD2-CB 3.46Å; D1236-G1243 PolarHBondContact OD1-N 3.47Å; D1236-G1243 PolarHBondContact OD2-N 3.28Å
1237	N	68.1	Low	72	Confident	66 Å²	66	72.2 Å²	72.2	35%	0.353	38%	0.378	S	S	.	.	S	Bend	trans	-79.2	-1.4	-173.2	-55.2	-60.5	0	0	0	113.8	P1239 E1245 T1247	N1237-P1239 WeakPolarHBondContact O-CD 3.37Å; N1237-E1245 HydrophobicContact CB-CB 4.38Å; N1237-E1245 HydrophobicContact CB-CG 4.13Å; N1237-E1245 PolarHBondContact N-O 3.44Å; N1237-E1245 PolarHBondContact ND2-O 2.86Å; N1237-E1245 VanDerWaalsContact ND2-O 3.09Å; N1237-T1247 VanDerWaalsContact ND2-CG2 3.29Å; N1237-T1247 WeakPolarHBondContact ND2-CG2 3.36Å; N1237-T1247 PolarHBondContact ND2-OG1 3.33Å
1238	N	66.8	Low	71.7	Confident	45 Å²	45	73.4 Å²	73.4	24%	0.241	38%	0.382	C	S	.	.			trans	-124.9	81.3	-174.9	-167.6	-23.9	0	0	0	113.3	D1236 R1240 M1241 E1245	D1236-N1238 PolarHBondContact O-N 2.82Å; D1236-N1238 PolarHBondContact OD1-N 2.88Å; N1238-R1240 PolarHBondContact O-N 3.18Å; N1238-R1240 PolarHBondContact OD1-N 2.06Å; N1238-M1241 CarbonylContact O-C 3.12Å; N1238-M1241 PolarHBondContact O-N 2.04Å; N1238-M1241 PolarHBondContact OD1-N 2.86Å; N1238-M1241 VanDerWaalsContact OD1-N 3.08Å; N1238-E1245 HydrophobicContact CB-CB 4Å
1239	P	63	Low	70.9	Confident	122 Å²	122	76.6 Å²	76.6	79%	0.792	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.6	178.6	-26.1	34.9	0	0	0	115.5	N1237	N1237-P1239 WeakPolarHBondContact O-CD 3.37Å
1240	R	68.5	Low	70.4	Confident	237 Å²	237	73.1 Å²	73.1	89%	0.894	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-27.8	177.3	-91.6	-176.2	171.1	171	-1	113.5	N1238	N1238-R1240 PolarHBondContact O-N 3.18Å; N1238-R1240 PolarHBondContact OD1-N 2.06Å
1241	M	73	Confident	69.8	Low	89 Å²	89	74.9 Å²	74.9	44%	0.438	39%	0.393	S	S	.	.	S	Bend	trans	-139.7	72.9	179.2	-54.7	-163.9	103.4	0	0	108.3	N1238 R1244	N1238-M1241 CarbonylContact O-C 3.12Å; N1238-M1241 PolarHBondContact O-N 2.04Å; N1238-M1241 PolarHBondContact OD1-N 2.86Å; N1238-M1241 VanDerWaalsContact OD1-N 3.08Å; M1241-R1244 HydrophobicContact CB-CG 4.14Å; M1241-R1244 WeakPolarHBondContact O-CB 3.27Å; M1241-R1244 WeakPolarHBondContact O-CG 3.25Å; M1241-R1244 PolarHBondContact O-N 3.45Å; M1241-R1244 PolarHBondContact SD-NH1 2.98Å
1242	P	69.1	Low	70.1	Confident	69 Å²	69	73 Å²	73	45%	0.448	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	151.7	-173.4	24.1	-34.6	0	0	0	111.7	C1228 D1236 R1244	C1228-P1242 WeakPolarHBondContact CB-O 3.4Å; D1236-P1242 WeakPolarHBondContact OD2-CA 3.2Å; D1236-P1242 VanDerWaalsContact OD2-CB 3.32Å; D1236-P1242 WeakPolarHBondContact OD2-CB 3.46Å; P1242-R1244 PolarHBondContact O-N 2.78Å
1243	G	77.8	Confident	70.7	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	10.9	-175.5	0	0	0	0	0	114.4	S1214 A1217 C1228 D1236	S1214-G1243 VanDerWaalsContact CB-O 3.25Å; S1214-G1243 WeakPolarHBondContact CB-O 3.12Å; S1214-G1243 PolarHBondContact N-O 3.27Å; A1217-G1243 WeakPolarHBondContact CB-O 3.23Å; C1228-G1243 WeakPolarHBondContact CB-O 3.47Å; D1236-G1243 PolarHBondContact OD1-N 3.47Å; D1236-G1243 PolarHBondContact OD2-N 3.28Å
1244	R	84.2	Confident	71.4	Confident	79 Å²	79	74.8 Å²	74.8	30%	0.298	37%	0.371	S	S	.	.	S	Bend	trans	-99.5	-22.7	176.7	-60.1	-164.5	-171.9	-167.5	-9.2	114.1	N1212 S1214 M1241 P1242	N1212-R1244 PolarHBondContact ND2-NH1 3.06Å; N1212-R1244 PolarHBondContact OD1-NE 3.05Å; N1212-R1244 PolarHBondContact OD1-NH1 2.89Å; N1212-R1244 PolarHBondContact OD1-NH2 2.84Å; N1212-R1244 VanDerWaalsContact OD1-NH2 3.09Å; S1214-R1244 WeakPolarHBondContact CB-O 3.22Å; M1241-R1244 HydrophobicContact CB-CG 4.14Å; M1241-R1244 WeakPolarHBondContact O-CB 3.27Å; M1241-R1244 WeakPolarHBondContact O-CG 3.25Å; M1241-R1244 PolarHBondContact O-N 3.45Å; M1241-R1244 PolarHBondContact SD-NH1 2.98Å; P1242-R1244 PolarHBondContact O-N 2.78Å
1245	E	73.6	Confident	71.2	Confident	109 Å²	109	74.3 Å²	74.3	51%	0.509	38%	0.377	S	S	.	.	S	Bend	trans	-134.3	63.6	-176.4	-161.4	160.5	-164	0	0	112.5	N1237 N1238	N1237-E1245 HydrophobicContact CB-CB 4.38Å; N1237-E1245 HydrophobicContact CB-CG 4.13Å; N1237-E1245 PolarHBondContact N-O 3.44Å; N1237-E1245 PolarHBondContact ND2-O 2.86Å; N1237-E1245 VanDerWaalsContact ND2-O 3.09Å; N1238-E1245 HydrophobicContact CB-CB 4Å
1246	C	76.1	Confident	70.9	Confident	6 Å²	6	76 Å²	76	4%	0.041	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122.9	-176.8	-52.3	0	0	0	0	112.5	S1214 Y1216 C1230 H1235	S1214-C1246 VanDerWaalsContact CB-SG 3.52Å; S1214-C1246 PolarHBondContact OG-N 3.5Å; Y1216-C1246 WeakPolarHBondContact CD2-O 3.32Å; C1230-C1246 WeakPolarHBondContact CA-SG 2.84Å; C1230-C1246 HydrophobicContact CB-CB 3.83Å; C1230-C1246 WeakPolarHBondContact CB-SG 3.4Å; C1230-C1246 VanDerWaalsContact SG-CA 3.59Å; C1230-C1246 WeakPolarHBondContact SG-CB 3.16Å; C1230-C1246 CovalentContact SG-SG 2.03Å; C1230-C1246 PolarHBondContact SG-SG 2.79Å; H1235-C1246 CarbonylContact O-C 3.45Å; H1235-C1246 VanDerWaalsContact O-CA 3.23Å; H1235-C1246 WeakPolarHBondContact O-CA 3.11Å
1247	T	71.6	Confident	70.6	Confident	53 Å²	53	81.7 Å²	81.7	33%	0.325	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.4	176.6	44.2	0	0	0	0	112.1	Y1234 H1235 N1237	Y1234-T1247 CarbonylContact C-O 2.94Å; Y1234-T1247 WeakPolarHBondContact CA-O 3.14Å; H1235-T1247 PolarHBondContact N-O 3.46Å; H1235-T1247 PolarHBondContact O-N 3.44Å; N1237-T1247 VanDerWaalsContact ND2-CG2 3.29Å; N1237-T1247 WeakPolarHBondContact ND2-CG2 3.36Å; N1237-T1247 PolarHBondContact ND2-OG1 3.33Å
1248	L	66.4	Low	70.8	Confident	89 Å²	89	82.9 Å²	82.9	47%	0.466	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	134.5	-178.6	-177.5	68.8	0	0	0	111.1	Y1234 I1250	Y1234-L1248 HydrophobicContact CD1-CB 3.95Å; Y1234-L1248 HydrophobicContact CD1-CD1 4.36Å; Y1234-L1248 VanDerWaalsContact CD1-N 3.34Å; Y1234-L1248 HydrophobicContact CD2-CD1 4.36Å; Y1234-L1248 HydrophobicContact CE1-CB 3.69Å; Y1234-L1248 HydrophobicContact CE1-CD1 3.86Å; Y1234-L1248 HydrophobicContact CE1-CG 4.36Å; Y1234-L1248 HydrophobicContact CE2-CD1 3.88Å; L1248-I1250 HydrophobicContact CB-CG1 4.4Å; L1248-I1250 HydrophobicContact CD2-CD1 4.04Å; L1248-I1250 HydrophobicContact CD2-CG1 3.77Å; L1248-I1250 HydrophobicContact CG-CG1 3.88Å
1249	I	66.1	Low	71.1	Confident	74 Å²	74	82 Å²	82	38%	0.379	43%	0.427	S	S	.	.			trans	-80	118.1	169	-55.5	176	0	0	0	107.6	G1233 H1235	G1233-I1249 PolarHBondContact O-N 2.7Å; H1235-I1249 HydrophobicContact CB-CD1 4.48Å; H1235-I1249 HydrophobicContact CB-CG1 4.24Å
1250	I	63.2	Low	71.9	Confident	71 Å²	71	79.6 Å²	79.6	36%	0.364	41%	0.407	S	S	.	.			trans	-121.5	137.4	178.9	-56.1	176.3	0	0	0	107.2	L1248 E1252 L1258	L1248-I1250 HydrophobicContact CB-CG1 4.4Å; L1248-I1250 HydrophobicContact CD2-CD1 4.04Å; L1248-I1250 HydrophobicContact CD2-CG1 3.77Å; L1248-I1250 HydrophobicContact CG-CG1 3.88Å; I1250-E1252 HydrophobicContact CG2-CG 4.09Å; I1250-L1258 HydrophobicContact CG2-CD1 4.35Å
1251	N	68.3	Low	72.7	Confident	57 Å²	57	69.4 Å²	69.4	31%	0.305	37%	0.372	S	S	.	.			trans	-90.6	93.3	166	179.5	-68.6	0	0	0	108.3	C1253 Q1254 D1269	N1251-C1253 PolarHBondContact O-N 2.95Å; N1251-C1253 PolarHBondContact OD1-N 3.24Å; N1251-Q1254 WeakPolarHBondContact OD1-CB 3.28Å; N1251-Q1254 VanDerWaalsContact OD1-CG 3.23Å; N1251-Q1254 WeakPolarHBondContact OD1-CG 3.47Å; N1251-Q1254 PolarHBondContact OD1-N 2.98Å; N1251-D1269 WeakPolarHBondContact CA-OD1 3.49Å; N1251-D1269 WeakPolarHBondContact CB-OD2 3.34Å; N1251-D1269 PolarHBondContact ND2-OD1 2.74Å; N1251-D1269 PolarHBondContact ND2-OD2 2.78Å; N1251-D1269 PolarHBondContact OD1-OD1 2.96Å
1252	E	79.7	Confident	73.1	Confident	30 Å²	30	67.7 Å²	67.7	14%	0.14	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-71.3	-20.2	178.8	-65.5	92.2	175.6	0	0	112.6	I1250 Q1254 S1255 L1258 N1259 D1269 G1273 Y1274	I1250-E1252 HydrophobicContact CG2-CG 4.09Å; E1252-Q1254 PolarHBondContact O-N 3.23Å; E1252-S1255 PolarHBondContact O-N 3.11Å; E1252-S1255 VanDerWaalsContact O-O 3.1Å; E1252-L1258 HydrophobicContact CB-CB 3.73Å; E1252-L1258 HydrophobicContact CG-CB 3.84Å; E1252-N1259 HydrophobicContact CB-CB 4.31Å; E1252-N1259 PolarHBondContact O-ND2 2.94Å; E1252-D1269 PolarHBondContact N-OD1 2.75Å; E1252-G1273 WeakPolarHBondContact OE2-CA 3.13Å; E1252-Y1274 HydrophobicContact CB-CD1 3.44Å; E1252-Y1274 VanDerWaalsContact CB-CD1 3.44Å; E1252-Y1274 HydrophobicContact CB-CE1 4Å; E1252-Y1274 HydrophobicContact CB-CG 4.11Å; E1252-Y1274 HydrophobicContact CG-CD1 3.7Å; E1252-Y1274 HydrophobicContact CG-CE1 4.05Å
1253	C	78.7	Confident	73.4	Confident	37 Å²	37	69.9 Å²	69.9	25%	0.25	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-66.9	-21.8	179.8	-64.3	0	0	0	0	113.7	N1251 S1255 C1267	N1251-C1253 PolarHBondContact O-N 2.95Å; N1251-C1253 PolarHBondContact OD1-N 3.24Å; C1253-S1255 VanDerWaalsContact C-N 3.27Å; C1253-S1255 PolarHBondContact O-N 2.96Å; C1253-C1267 WeakPolarHBondContact CA-SG 3.43Å; C1253-C1267 HydrophobicContact CB-CB 3.75Å; C1253-C1267 WeakPolarHBondContact CB-SG 3.12Å; C1253-C1267 WeakPolarHBondContact SG-CB 3.48Å; C1253-C1267 CovalentContact SG-SG 2.04Å; C1253-C1267 PolarHBondContact SG-SG 2.88Å
1254	Q	72.5	Confident	73.5	Confident	159 Å²	159	73 Å²	73	74%	0.743	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-73	-8.9	174.8	-87.8	179	48.8	0	0	114.7	N1251 E1252	N1251-Q1254 WeakPolarHBondContact OD1-CB 3.28Å; N1251-Q1254 VanDerWaalsContact OD1-CG 3.23Å; N1251-Q1254 WeakPolarHBondContact OD1-CG 3.47Å; N1251-Q1254 PolarHBondContact OD1-N 2.98Å; E1252-Q1254 PolarHBondContact O-N 3.23Å
1255	S	68.9	Low	73.4	Confident	53 Å²	53	69.6 Å²	69.6	37%	0.371	38%	0.38	S	S	.	.			trans	-141.4	122.3	178.6	-83.9	0	0	0	0	113.1	E1252 C1253 N1257 L1258 N1259	E1252-S1255 PolarHBondContact O-N 3.11Å; E1252-S1255 VanDerWaalsContact O-O 3.1Å; C1253-S1255 VanDerWaalsContact C-N 3.27Å; C1253-S1255 PolarHBondContact O-N 2.96Å; S1255-N1257 PolarHBondContact O-N 2.71Å; S1255-L1258 PolarHBondContact O-N 3.43Å; S1255-N1259 PolarHBondContact O-N 3.38Å; S1255-N1259 PolarHBondContact O-ND2 3.4Å; S1255-N1259 VanDerWaalsContact O-ND2 3.08Å
1256	P	61.6	Low	73.7	Confident	112 Å²	112	66.4 Å²	66.4	73%	0.727	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	1.4	-178	31.2	-37.4	0	0	0	114.4
1257	N	66.1	Low	74.1	Confident	158 Å²	158	68 Å²	68	85%	0.845	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-6.6	170.5	-64.6	-7.6	0	0	0	112.7	S1255	S1255-N1257 PolarHBondContact O-N 2.71Å
1258	L	72.3	Confident	74.3	Confident	91 Å²	91	68.7 Å²	68.7	48%	0.476	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-32.1	179.7	-60.9	-177.1	0	0	0	112.3	I1250 E1252 S1255 Y1274	I1250-L1258 HydrophobicContact CG2-CD1 4.35Å; E1252-L1258 HydrophobicContact CB-CB 3.73Å; E1252-L1258 HydrophobicContact CG-CB 3.84Å; S1255-L1258 PolarHBondContact O-N 3.43Å; L1258-Y1274 WeakPolarHBondContact O-CE1 3.33Å
1259	N	73.5	Confident	74.6	Confident	28 Å²	28	67.6 Å²	67.6	15%	0.15	37%	0.372	C	S	.	.			trans	-101.8	144.2	171.7	69.6	89.8	0	0	0	112.3	E1252 S1255 Y1274	E1252-N1259 HydrophobicContact CB-CB 4.31Å; E1252-N1259 PolarHBondContact O-ND2 2.94Å; S1255-N1259 PolarHBondContact O-N 3.38Å; S1255-N1259 PolarHBondContact O-ND2 3.4Å; S1255-N1259 VanDerWaalsContact O-ND2 3.08Å; N1259-Y1274 VanDerWaalsContact CA-CZ 3.49Å; N1259-Y1274 HydrophobicContact CB-CD1 4.26Å; N1259-Y1274 HydrophobicContact CB-CD2 3.67Å; N1259-Y1274 HydrophobicContact CB-CE1 4.22Å; N1259-Y1274 HydrophobicContact CB-CE2 3.66Å; N1259-Y1274 HydrophobicContact CB-CG 3.98Å
1260	D	79.6	Confident	74.8	Confident	71 Å²	71	68 Å²	68	38%	0.38	37%	0.374	S	S	.	.			trans	-105.1	29.1	176.6	62.3	19.1	0	0	0	113.1	Y1274 R1294	D1260-Y1274 PolarHBondContact N-OH 3.39Å; D1260-Y1274 VanDerWaalsContact N-OH 3.15Å; D1260-Y1274 PolarHBondContact OD1-OH 2.91Å; D1260-Y1274 VanDerWaalsContact OD1-OH 3.12Å; D1260-Y1274 PolarHBondContact OD2-OH 3.36Å; D1260-R1294 IonicContact OD1-CZ 3.23Å; D1260-R1294 IonicContact OD1-NE 3.53Å; D1260-R1294 PolarHBondContact OD1-NE 2.81Å; D1260-R1294 VanDerWaalsContact OD1-NE 3.13Å; D1260-R1294 IonicContact OD1-NH1 2.68Å; D1260-R1294 PolarHBondContact OD1-NH1 2.83Å; D1260-R1294 IonicContact OD1-NH2 3.74Å; D1260-R1294 PolarHBondContact OD1-NH2 3.37Å; D1260-R1294 IonicContact OD2-CZ 3.85Å; D1260-R1294 IonicContact OD2-NE 3.56Å; D1260-R1294 IonicContact OD2-NH1 2.86Å; D1260-R1294 PolarHBondContact OD2-NH1 2.84Å; D1260-R1294 IonicContact OD2-NH2 2.71Å; D1260-R1294 PolarHBondContact OD2-NH2 3.15Å
1261	C	83.9	Confident	74.4	Confident	22 Å²	22	69 Å²	69	15%	0.149	38%	0.38	C	S	.	.			trans	-66.2	141.3	175.4	-59.1	0	0	0	0	111.8	A1265 C1276	C1261-A1265 HydrophobicContact CB-CB 4.35Å; C1261-C1276 WeakPolarHBondContact CA-SG 3.19Å; C1261-C1276 HydrophobicContact CB-CB 3.64Å; C1261-C1276 WeakPolarHBondContact CB-SG 3.49Å; C1261-C1276 WeakPolarHBondContact SG-CB 3.41Å; C1261-C1276 CovalentContact SG-SG 2.03Å; C1261-C1276 PolarHBondContact SG-SG 2.83Å
1262	H	81.7	Confident	73.9	Confident	53 Å²	53	70 Å²	70	25%	0.245	39%	0.388	C	S	.	.			trans	-61.1	146.6	174.4	-163.7	-110.1	0	0	0	110.2	Q1264 A1265 G1293 R1294 C1296	H1262-Q1264 PolarHBondContact CE1-OE1 2.99Å; H1262-Q1264 PolarHBondContact O-N 3.45Å; H1262-A1265 HydrophobicContact CB-CB 4.29Å; H1262-A1265 WeakPolarHBondContact O-CB 3.13Å; H1262-A1265 PolarHBondContact O-N 3.04Å; H1262-G1293 WeakPolarHBondContact CB-O 3.22Å; H1262-G1293 PolarHBondContact N-O 3.19Å; H1262-R1294 PolarHBondContact CD2-O 3.05Å; H1262-C1296 HydrophobicContact CB-CB 4.35Å; H1262-C1296 PolarHBondContact CE1-O 3.23Å; H1262-C1296 WeakPolarHBondContact ND1-CB 3.5Å; H1262-C1296 PolarHBondContact ND1-N 3.2Å
1263	P	76.7	Confident	73.4	Confident	115 Å²	115	69.6 Å²	69.6	75%	0.747	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-7.3	177.4	-26.8	36.1	0	0	0	115.9
1264	Q	78.9	Confident	73.5	Confident	67 Å²	67	70.5 Å²	70.5	31%	0.313	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	13.3	175.3	-66.4	159.5	-17.5	0	0	112.4	H1262 R1279 Y1282 C1296	H1262-Q1264 PolarHBondContact CE1-OE1 2.99Å; H1262-Q1264 PolarHBondContact O-N 3.45Å; Q1264-R1279 WeakPolarHBondContact O-CB 3.44Å; Q1264-R1279 WeakPolarHBondContact O-CG 3.38Å; Q1264-R1279 PolarHBondContact O-N 2.95Å; Q1264-Y1282 HydrophobicContact CB-CD1 4.07Å; Q1264-Y1282 HydrophobicContact CB-CE1 4.34Å; Q1264-Y1282 HydrophobicContact CB-CG 4.2Å; Q1264-Y1282 HydrophobicContact CG-CD1 4.2Å; Q1264-Y1282 HydrophobicContact CG-CE1 3.96Å; Q1264-Y1282 VanDerWaalsContact NE2-CE1 3.29Å; Q1264-C1296 HydrophobicContact CB-CB 4.14Å; Q1264-C1296 PolarHBondContact OE1-O 3.04Å
1265	A	82.4	Confident	73.7	Confident	7 Å²	7	67.9 Å²	67.9	6%	0.058	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	157.3	166.6	0	0	0	0	0	111.2	C1261 H1262 C1276 R1277 R1279 G1293	C1261-A1265 HydrophobicContact CB-CB 4.35Å; H1262-A1265 HydrophobicContact CB-CB 4.29Å; H1262-A1265 WeakPolarHBondContact O-CB 3.13Å; H1262-A1265 PolarHBondContact O-N 3.04Å; A1265-C1276 HydrophobicContact CB-CB 4.35Å; A1265-R1277 CarbonylContact C-O 3.4Å; A1265-R1277 WeakPolarHBondContact CA-O 3.28Å; A1265-R1277 WeakPolarHBondContact CB-O 3.46Å; A1265-R1279 PolarHBondContact O-NH2 3.46Å; A1265-G1293 VanDerWaalsContact CB-O 3.27Å; A1265-G1293 WeakPolarHBondContact CB-O 3.12Å
1266	D	79.4	Confident	74.5	Confident	41 Å²	41	65.6 Å²	65.6	22%	0.219	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	147.3	156	-61.8	-45.6	0	0	0	109.3	C1276 R1277 R1279	D1266-C1276 CarbonylContact O-C 3.45Å; D1266-C1276 WeakPolarHBondContact O-CA 3.39Å; D1266-R1277 PolarHBondContact N-O 3.35Å; D1266-R1277 PolarHBondContact O-N 2.82Å; D1266-R1277 IonicContact OD2-CZ 3Å; D1266-R1277 IonicContact OD2-NH2 3.19Å; D1266-R1277 PolarHBondContact OD2-NH2 3.25Å; D1266-R1279 IonicContact OD1-CZ 3.31Å; D1266-R1279 IonicContact OD1-NE 2.72Å; D1266-R1279 PolarHBondContact OD1-NE 3.48Å; D1266-R1279 IonicContact OD1-NH2 3.71Å; D1266-R1279 PolarHBondContact OD1-NH2 3.01Å
1267	C	85	Confident	75.2	Confident	40 Å²	40	65.8 Å²	65.8	27%	0.27	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.1	166.3	-173.1	0	0	0	0	107.5	C1253	C1253-C1267 WeakPolarHBondContact CA-SG 3.43Å; C1253-C1267 HydrophobicContact CB-CB 3.75Å; C1253-C1267 WeakPolarHBondContact CB-SG 3.12Å; C1253-C1267 WeakPolarHBondContact SG-CB 3.48Å; C1253-C1267 CovalentContact SG-SG 2.04Å; C1253-C1267 PolarHBondContact SG-SG 2.88Å
1268	E	74.6	Confident	76	Confident	67 Å²	67	59 Å²	59	31%	0.313	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.5	176.3	-71	164.7	-165.1	0	0	107.6	Y1274 K1275 R1277	E1268-Y1274 WeakPolarHBondContact O-CA 3.2Å; E1268-K1275 HydrophobicContact CB-CB 4.32Å; E1268-K1275 PolarHBondContact N-O 2.77Å; E1268-K1275 PolarHBondContact O-N 3.33Å; E1268-R1277 WeakPolarHBondContact OE1-CD 3.15Å; E1268-R1277 IonicContact OE1-CZ 2.84Å; E1268-R1277 IonicContact OE1-NE 2.71Å; E1268-R1277 PolarHBondContact OE1-NE 2.72Å
1269	D	74.1	Confident	76.3	Confident	67 Å²	67	60.2 Å²	60.2	36%	0.358	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	140.2	-176.1	-148	63.6	0	0	0	110.6	N1251 E1252	N1251-D1269 WeakPolarHBondContact CA-OD1 3.49Å; N1251-D1269 WeakPolarHBondContact CB-OD2 3.34Å; N1251-D1269 PolarHBondContact ND2-OD1 2.74Å; N1251-D1269 PolarHBondContact ND2-OD2 2.78Å; N1251-D1269 PolarHBondContact OD1-OD1 2.96Å; E1252-D1269 PolarHBondContact N-OD1 2.75Å
1270	L	69.2	Low	75.8	Confident	83 Å²	83	64 Å²	64	44%	0.435	34%	0.336	S	S	.	.			trans	-122.9	162.5	177.4	-51.1	173.6	0	0	0	110	V1272 G1273 K1275	L1270-V1272 PolarHBondContact O-N 3.36Å; L1270-V1272 VanDerWaalsContact O-N 3.12Å; L1270-G1273 CarbonylContact C-O 3.48Å; L1270-G1273 WeakPolarHBondContact CA-O 3.11Å; L1270-G1273 VanDerWaalsContact CB-O 3.23Å; L1270-G1273 WeakPolarHBondContact CB-O 3.04Å; L1270-G1273 PolarHBondContact N-O 2.66Å; L1270-K1275 HydrophobicContact CD1-CB 4.22Å
1271	L	54.8	Low	74.5	Confident	91 Å²	91	64.2 Å²	64.2	48%	0.476	34%	0.341	S	S	.	.	S	Bend	trans	-61.4	-20.8	174.7	-88	86.6	0	0	0	113.4
1272	V	58.6	Low	74.2	Confident	79 Å²	79	66.6 Å²	66.6	48%	0.479	35%	0.347	S	S	.	.	S	Bend	trans	-138.7	90.6	173.1	-175.1	0	0	0	0	108.5	H1235 L1270	H1235-V1272 HydrophobicContact CB-CG2 4.11Å; L1270-V1272 PolarHBondContact O-N 3.36Å; L1270-V1272 VanDerWaalsContact O-N 3.12Å
1273	G	68.6	Low	73.9	Confident	20 Å²	20	67.4 Å²	67.4	21%	0.206	36%	0.356	C	S	.	.	S	Bend	trans	91.5	-159.9	177.7	0	0	0	0	0	114.5	E1252 L1270	E1252-G1273 WeakPolarHBondContact OE2-CA 3.13Å; L1270-G1273 CarbonylContact C-O 3.48Å; L1270-G1273 WeakPolarHBondContact CA-O 3.11Å; L1270-G1273 VanDerWaalsContact CB-O 3.23Å; L1270-G1273 WeakPolarHBondContact CB-O 3.04Å; L1270-G1273 PolarHBondContact N-O 2.66Å
1274	Y	80.7	Confident	73.9	Confident	56 Å²	56	64.5 Å²	64.5	22%	0.22	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	160.1	-174.9	62	-83.4	0	0	0	112.4	E1252 L1258 N1259 D1260 E1268	E1252-Y1274 HydrophobicContact CB-CD1 3.44Å; E1252-Y1274 VanDerWaalsContact CB-CD1 3.44Å; E1252-Y1274 HydrophobicContact CB-CE1 4Å; E1252-Y1274 HydrophobicContact CB-CG 4.11Å; E1252-Y1274 HydrophobicContact CG-CD1 3.7Å; E1252-Y1274 HydrophobicContact CG-CE1 4.05Å; L1258-Y1274 WeakPolarHBondContact O-CE1 3.33Å; N1259-Y1274 VanDerWaalsContact CA-CZ 3.49Å; N1259-Y1274 HydrophobicContact CB-CD1 4.26Å; N1259-Y1274 HydrophobicContact CB-CD2 3.67Å; N1259-Y1274 HydrophobicContact CB-CE1 4.22Å; N1259-Y1274 HydrophobicContact CB-CE2 3.66Å; N1259-Y1274 HydrophobicContact CB-CG 3.98Å; D1260-Y1274 PolarHBondContact N-OH 3.39Å; D1260-Y1274 VanDerWaalsContact N-OH 3.15Å; D1260-Y1274 PolarHBondContact OD1-OH 2.91Å; D1260-Y1274 VanDerWaalsContact OD1-OH 3.12Å; D1260-Y1274 PolarHBondContact OD2-OH 3.36Å; E1268-Y1274 WeakPolarHBondContact O-CA 3.2Å
1275	K	77	Confident	73.8	Confident	105 Å²	105	66 Å²	66	46%	0.457	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138	176.8	-176.3	-178.5	-177	-176.1	0	109.8	E1268 L1270	E1268-K1275 HydrophobicContact CB-CB 4.32Å; E1268-K1275 PolarHBondContact N-O 2.77Å; E1268-K1275 PolarHBondContact O-N 3.33Å; L1270-K1275 HydrophobicContact CD1-CB 4.22Å
1276	C	85.4	Confident	73.6	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.034	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	139.5	178.3	-47.6	0	0	0	0	110.5	C1261 A1265 D1266 P1292	C1261-C1276 WeakPolarHBondContact CA-SG 3.19Å; C1261-C1276 HydrophobicContact CB-CB 3.64Å; C1261-C1276 WeakPolarHBondContact CB-SG 3.49Å; C1261-C1276 WeakPolarHBondContact SG-CB 3.41Å; C1261-C1276 CovalentContact SG-SG 2.03Å; C1261-C1276 PolarHBondContact SG-SG 2.83Å; A1265-C1276 HydrophobicContact CB-CB 4.35Å; D1266-C1276 CarbonylContact O-C 3.45Å; D1266-C1276 WeakPolarHBondContact O-CA 3.39Å; C1276-P1292 WeakPolarHBondContact CB-O 3.43Å; C1276-P1292 CarbonylContact O-C 3.53Å; C1276-P1292 VanDerWaalsContact O-O 3.14Å
1277	R	77.6	Confident	73.1	Confident	116 Å²	116	70.4 Å²	70.4	44%	0.438	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	120.3	-178	-174	-175.1	65.2	103.2	16.6	111.2	A1265 D1266 E1268 R1279	A1265-R1277 CarbonylContact C-O 3.4Å; A1265-R1277 WeakPolarHBondContact CA-O 3.28Å; A1265-R1277 WeakPolarHBondContact CB-O 3.46Å; D1266-R1277 PolarHBondContact N-O 3.35Å; D1266-R1277 PolarHBondContact O-N 2.82Å; D1266-R1277 IonicContact OD2-CZ 3Å; D1266-R1277 IonicContact OD2-NH2 3.19Å; D1266-R1277 PolarHBondContact OD2-NH2 3.25Å; E1268-R1277 WeakPolarHBondContact OE1-CD 3.15Å; E1268-R1277 IonicContact OE1-CZ 2.84Å; E1268-R1277 IonicContact OE1-NE 2.71Å; E1268-R1277 PolarHBondContact OE1-NE 2.72Å; R1277-R1279 PolarHBondContact O-N 3.23Å
1278	C	82.9	Confident	71.7	Confident	16 Å²	16	71.3 Å²	71.3	11%	0.108	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	131.6	180	-62.8	0	0	0	0	112.6	Y1282 D1284 C1296	C1278-Y1282 VanDerWaalsContact CB-O 3.25Å; C1278-Y1282 WeakPolarHBondContact CB-O 3.43Å; C1278-D1284 VanDerWaalsContact SG-CA 3.56Å; C1278-C1296 WeakPolarHBondContact CA-SG 3.11Å; C1278-C1296 HydrophobicContact CB-CB 3.7Å; C1278-C1296 WeakPolarHBondContact CB-SG 3.46Å; C1278-C1296 WeakPolarHBondContact SG-CA 3.37Å; C1278-C1296 WeakPolarHBondContact SG-CB 3.18Å; C1278-C1296 CovalentContact SG-SG 2.03Å; C1278-C1296 PolarHBondContact SG-SG 3.23Å
1279	R	78.3	Confident	71.2	Confident	115 Å²	115	73.6 Å²	73.6	43%	0.434	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-69.8	129	174.3	-66.7	173.5	174.4	141.5	12.6	109.2	Q1264 A1265 D1266 R1277 Y1282	Q1264-R1279 WeakPolarHBondContact O-CB 3.44Å; Q1264-R1279 WeakPolarHBondContact O-CG 3.38Å; Q1264-R1279 PolarHBondContact O-N 2.95Å; A1265-R1279 PolarHBondContact O-NH2 3.46Å; D1266-R1279 IonicContact OD1-CZ 3.31Å; D1266-R1279 IonicContact OD1-NE 2.72Å; D1266-R1279 PolarHBondContact OD1-NE 3.48Å; D1266-R1279 IonicContact OD1-NH2 3.71Å; D1266-R1279 PolarHBondContact OD1-NH2 3.01Å; R1277-R1279 PolarHBondContact O-N 3.23Å; R1279-Y1282 WeakPolarHBondContact O-CA 3.24Å; R1279-Y1282 VanDerWaalsContact O-CB 3.23Å; R1279-Y1282 WeakPolarHBondContact O-CB 3.44Å; R1279-Y1282 VanDerWaalsContact O-CD2 3.25Å; R1279-Y1282 WeakPolarHBondContact O-CD2 3.17Å; R1279-Y1282 PolarHBondContact O-N 2.04Å
1280	P	62.3	Low	70.9	Confident	109 Å²	109	78.2 Å²	78.2	71%	0.708	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	143.2	171.9	-24.9	35.3	0	0	0	111.8
1281	P	52	Low	71.2	Confident	75 Å²	75	79.1 Å²	79.1	49%	0.487	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.8	19.4	5.2	38.6	-37.8	0	0	0	114.3
1282	Y	78.1	Confident	72.3	Confident	72 Å²	72	76.5 Å²	76.5	28%	0.282	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.1	178.1	-55.8	-106.1	0	0	0	109.7	Q1264 C1278 R1279 K1297 C1298	Q1264-Y1282 HydrophobicContact CB-CD1 4.07Å; Q1264-Y1282 HydrophobicContact CB-CE1 4.34Å; Q1264-Y1282 HydrophobicContact CB-CG 4.2Å; Q1264-Y1282 HydrophobicContact CG-CD1 4.2Å; Q1264-Y1282 HydrophobicContact CG-CE1 3.96Å; Q1264-Y1282 VanDerWaalsContact NE2-CE1 3.29Å; C1278-Y1282 VanDerWaalsContact CB-O 3.25Å; C1278-Y1282 WeakPolarHBondContact CB-O 3.43Å; R1279-Y1282 WeakPolarHBondContact O-CA 3.24Å; R1279-Y1282 VanDerWaalsContact O-CB 3.23Å; R1279-Y1282 WeakPolarHBondContact O-CB 3.44Å; R1279-Y1282 VanDerWaalsContact O-CD2 3.25Å; R1279-Y1282 WeakPolarHBondContact O-CD2 3.17Å; R1279-Y1282 PolarHBondContact O-N 2.04Å; Y1282-K1297 CarbonylContact C-O 3.52Å; Y1282-K1297 WeakPolarHBondContact CA-O 3.02Å; Y1282-C1298 HydrophobicContact CD1-CB 3.64Å; Y1282-C1298 HydrophobicContact CE1-CB 3.5Å; Y1282-C1298 VanDerWaalsContact CE1-CB 3.5Å; Y1282-C1298 HydrophobicContact CG-CB 4.46Å
1283	V	74.6	Confident	73.4	Confident	70 Å²	70	72.7 Å²	72.7	42%	0.424	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	143.2	-178.3	-173.3	0	0	0	0	109.7	C1296 K1297 T1299	V1283-C1296 WeakPolarHBondContact O-CA 3.07Å; V1283-K1297 PolarHBondContact N-O 2.79Å; V1283-K1297 PolarHBondContact O-N 3.42Å; V1283-T1299 HydrophobicContact CB-CG2 4.46Å; V1283-T1299 HydrophobicContact CG2-CG2 4.14Å
1284	D	77.1	Confident	74.1	Confident	53 Å²	53	75.2 Å²	75.2	28%	0.283	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	130.5	176.5	-174	44.7	0	0	0	112	C1278 S1286 P1292 G1293	C1278-D1284 VanDerWaalsContact SG-CA 3.56Å; D1284-S1286 VanDerWaalsContact OD1-CB 3.3Å; D1284-S1286 WeakPolarHBondContact OD1-CB 3.01Å; D1284-S1286 PolarHBondContact OD1-N 2.89Å; D1284-S1286 PolarHBondContact OD1-OG 2.64Å; D1284-P1292 VanDerWaalsContact OD2-CA 3.22Å; D1284-P1292 WeakPolarHBondContact OD2-CA 3.4Å; D1284-P1292 VanDerWaalsContact OD2-CB 3.24Å; D1284-P1292 WeakPolarHBondContact OD2-CB 3.37Å; D1284-G1293 PolarHBondContact OD1-N 3.07Å
1285	H	76.3	Confident	73.9	Confident	100 Å²	100	75.5 Å²	75.5	46%	0.463	39%	0.389	S	S	.	.			trans	-129.7	24.4	175.4	-82	-84.3	0	0	0	110.8	V1295 K1297	H1285-V1295 HydrophobicContact CB-CB 4.44Å; H1285-V1295 HydrophobicContact CB-CG1 4.07Å; H1285-V1295 PolarHBondContact N-O 3.26Å; H1285-K1297 VanDerWaalsContact CD2-CB 3.48Å; H1285-K1297 WeakPolarHBondContact CD2-CB 3.38Å
1286	S	78.6	Confident	73.9	Confident	12 Å²	12	70.7 Å²	70.7	8%	0.084	37%	0.369	C	S	.	.			trans	-62.2	132.1	179.7	-60.3	0	0	0	0	110.9	D1284 N1288 K1291 G1293 R1294 V1295	D1284-S1286 VanDerWaalsContact OD1-CB 3.3Å; D1284-S1286 WeakPolarHBondContact OD1-CB 3.01Å; D1284-S1286 PolarHBondContact OD1-N 2.89Å; D1284-S1286 PolarHBondContact OD1-OG 2.64Å; S1286-N1288 PolarHBondContact O-N 3.43Å; S1286-N1288 VanDerWaalsContact O-N 3.12Å; S1286-K1291 VanDerWaalsContact CB-O 3.28Å; S1286-K1291 WeakPolarHBondContact CB-O 3.06Å; S1286-G1293 PolarHBondContact OG-N 3.21Å; S1286-R1294 PolarHBondContact OG-N 3.23Å; S1286-V1295 PolarHBondContact OG-N 2.62Å
1287	P	69.6	Low	73	Confident	127 Å²	127	76.4 Å²	76.4	83%	0.825	39%	0.393	S	S	*	.	S	Bend	trans	-63.1	-18.5	-174.9	-27.2	35.8	0	0	0	116.1
1288	N	55.5	Low	71.9	Confident	60 Å²	60	73.7 Å²	73.7	32%	0.321	39%	0.392	S	S	.	.	S	Bend	trans	-113.1	118	168.9	-179.4	-2	0	0	0	109.4	S1286 E1290 K1291	S1286-N1288 PolarHBondContact O-N 3.43Å; S1286-N1288 VanDerWaalsContact O-N 3.12Å; N1288-E1290 PolarHBondContact ND2-OE2 3.13Å; N1288-E1290 PolarHBondContact O-N 3.13Å; N1288-E1290 WeakPolarHBondContact OD1-CB 3.37Å; N1288-E1290 WeakPolarHBondContact OD1-CG 3.04Å; N1288-E1290 PolarHBondContact OD1-N 2.79Å; N1288-K1291 HydrophobicContact CB-CB 4.34Å; N1288-K1291 CarbonylContact O-C 3.48Å; N1288-K1291 PolarHBondContact O-N 2.91Å
1289	P	64.3	Low	70.2	Confident	114 Å²	114	77 Å²	77	74%	0.74	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.2	174.7	-25.5	35.3	0	0	0	115.5	K1291	P1289-K1291 PolarHBondContact O-N 3.31Å
1290	E	67.9	Low	68.1	Low	164 Å²	164	77.3 Å²	77.3	77%	0.766	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.8	175.5	-55.1	170.6	145.9	0	0	112.4	N1288 P1292	N1288-E1290 PolarHBondContact ND2-OE2 3.13Å; N1288-E1290 PolarHBondContact O-N 3.13Å; N1288-E1290 WeakPolarHBondContact OD1-CB 3.37Å; N1288-E1290 WeakPolarHBondContact OD1-CG 3.04Å; N1288-E1290 PolarHBondContact OD1-N 2.79Å; E1290-P1292 WeakPolarHBondContact O-CD 3.21Å
1291	K	75.6	Confident	66.5	Low	103 Å²	103	77.7 Å²	77.7	45%	0.448	43%	0.427	S	S	.	.	S	Bend	trans	-124.6	61.6	-177.8	-73.7	-173.2	159.1	-143.2	0	110.6	S1286 N1288 P1289 R1294	S1286-K1291 VanDerWaalsContact CB-O 3.28Å; S1286-K1291 WeakPolarHBondContact CB-O 3.06Å; N1288-K1291 HydrophobicContact CB-CB 4.34Å; N1288-K1291 CarbonylContact O-C 3.48Å; N1288-K1291 PolarHBondContact O-N 2.91Å; P1289-K1291 PolarHBondContact O-N 3.31Å; K1291-R1294 WeakPolarHBondContact O-CD 3.28Å
1292	P	77	Confident	65.3	Low	35 Å²	35	79.5 Å²	79.5	23%	0.227	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	169.7	-178.9	31.1	-36.8	0	0	0	111.7	C1276 D1284 E1290 R1294	C1276-P1292 WeakPolarHBondContact CB-O 3.43Å; C1276-P1292 CarbonylContact O-C 3.53Å; C1276-P1292 VanDerWaalsContact O-O 3.14Å; D1284-P1292 VanDerWaalsContact OD2-CA 3.22Å; D1284-P1292 WeakPolarHBondContact OD2-CA 3.4Å; D1284-P1292 VanDerWaalsContact OD2-CB 3.24Å; D1284-P1292 WeakPolarHBondContact OD2-CB 3.37Å; E1290-P1292 WeakPolarHBondContact O-CD 3.21Å; P1292-R1294 VanDerWaalsContact C-N 3.29Å; P1292-R1294 PolarHBondContact O-N 2.78Å
1293	G	81.6	Confident	62.7	Low	0 Å²	0	80.3 Å²	80.3	0%	0	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	7.2	170.3	0	0	0	0	0	115.6	H1262 A1265 D1284 S1286	H1262-G1293 WeakPolarHBondContact CB-O 3.22Å; H1262-G1293 PolarHBondContact N-O 3.19Å; A1265-G1293 VanDerWaalsContact CB-O 3.27Å; A1265-G1293 WeakPolarHBondContact CB-O 3.12Å; D1284-G1293 PolarHBondContact OD1-N 3.07Å; S1286-G1293 PolarHBondContact OG-N 3.21Å
1294	R	83.4	Confident	60.3	Low	73 Å²	73	86.3 Å²	86.3	28%	0.275	48%	0.483	S	S	.	.	S	Bend	trans	-90.1	-23.5	177	-61.7	176.3	174.2	-131.1	-11	112.6	D1260 H1262 S1286 K1291 P1292	D1260-R1294 IonicContact OD1-CZ 3.23Å; D1260-R1294 IonicContact OD1-NE 3.53Å; D1260-R1294 PolarHBondContact OD1-NE 2.81Å; D1260-R1294 VanDerWaalsContact OD1-NE 3.13Å; D1260-R1294 IonicContact OD1-NH1 2.68Å; D1260-R1294 PolarHBondContact OD1-NH1 2.83Å; D1260-R1294 IonicContact OD1-NH2 3.74Å; D1260-R1294 PolarHBondContact OD1-NH2 3.37Å; D1260-R1294 IonicContact OD2-CZ 3.85Å; D1260-R1294 IonicContact OD2-NE 3.56Å; D1260-R1294 IonicContact OD2-NH1 2.86Å; D1260-R1294 PolarHBondContact OD2-NH1 2.84Å; D1260-R1294 IonicContact OD2-NH2 2.71Å; D1260-R1294 PolarHBondContact OD2-NH2 3.15Å; H1262-R1294 PolarHBondContact CD2-O 3.05Å; S1286-R1294 PolarHBondContact OG-N 3.23Å; K1291-R1294 WeakPolarHBondContact O-CD 3.28Å; P1292-R1294 VanDerWaalsContact C-N 3.29Å; P1292-R1294 PolarHBondContact O-N 2.78Å
1295	V	76.1	Confident	57.7	Low	61 Å²	61	89.5 Å²	89.5	37%	0.37	50%	0.504	S	S	.	.	S	Bend	trans	-133.5	101.3	171.2	-176.8	0	0	0	0	109.1	H1285 S1286	H1285-V1295 HydrophobicContact CB-CB 4.44Å; H1285-V1295 HydrophobicContact CB-CG1 4.07Å; H1285-V1295 PolarHBondContact N-O 3.26Å; S1286-V1295 PolarHBondContact OG-N 2.62Å
1296	C	78.2	Confident	55.1	Low	5 Å²	5	91.3 Å²	91.3	3%	0.034	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	118.3	178.1	-56.4	0	0	0	0	110.7	H1262 Q1264 C1278 V1283	H1262-C1296 HydrophobicContact CB-CB 4.35Å; H1262-C1296 PolarHBondContact CE1-O 3.23Å; H1262-C1296 WeakPolarHBondContact ND1-CB 3.5Å; H1262-C1296 PolarHBondContact ND1-N 3.2Å; Q1264-C1296 HydrophobicContact CB-CB 4.14Å; Q1264-C1296 PolarHBondContact OE1-O 3.04Å; C1278-C1296 WeakPolarHBondContact CA-SG 3.11Å; C1278-C1296 HydrophobicContact CB-CB 3.7Å; C1278-C1296 WeakPolarHBondContact CB-SG 3.46Å; C1278-C1296 WeakPolarHBondContact SG-CA 3.37Å; C1278-C1296 WeakPolarHBondContact SG-CB 3.18Å; C1278-C1296 CovalentContact SG-SG 2.03Å; C1278-C1296 PolarHBondContact SG-SG 3.23Å; V1283-C1296 WeakPolarHBondContact O-CA 3.07Å
1297	K	66	Low	52.4	Low	124 Å²	124	98.6 Å²	98.6	54%	0.539	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.7	127.8	-175.2	-162.2	177.9	-177.1	178.8	0	111.1	Y1282 V1283 H1285 T1299	Y1282-K1297 CarbonylContact C-O 3.52Å; Y1282-K1297 WeakPolarHBondContact CA-O 3.02Å; V1283-K1297 PolarHBondContact N-O 2.79Å; V1283-K1297 PolarHBondContact O-N 3.42Å; H1285-K1297 VanDerWaalsContact CD2-CB 3.48Å; H1285-K1297 WeakPolarHBondContact CD2-CB 3.38Å; K1297-T1299 PolarHBondContact O-N 3.33Å
1298	C	53.7	Low	50.2	Low	60 Å²	60	100.1 Å²	100.1	41%	0.405	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	116.9	172.1	-158.8	0	0	0	0	109.8	Y1282	Y1282-C1298 HydrophobicContact CD1-CB 3.64Å; Y1282-C1298 HydrophobicContact CE1-CB 3.5Å; Y1282-C1298 VanDerWaalsContact CE1-CB 3.5Å; Y1282-C1298 HydrophobicContact CG-CB 4.46Å
1299	T	48	Very low	48.6	Very low	85 Å²	85	101.8 Å²	101.8	52%	0.521	56%	0.563	S	S	.	*			trans	-102.2	62.8	178.6	55.5	0	0	0	0	110.9	V1283 K1297	V1283-T1299 HydrophobicContact CB-CG2 4.46Å; V1283-T1299 HydrophobicContact CG2-CG2 4.14Å; K1297-T1299 PolarHBondContact O-N 3.33Å
1300	D	33.7	Very low	46.6	Very low	122 Å²	122	105 Å²	105	65%	0.652	57%	0.565	S	S	*	*			trans	-122.5	89.4	-174.7	-145.2	-14.7	0	0	0	112.5
1301	S	30.2	Very low	44.5	Very low	116 Å²	116	103.4 Å²	103.4	81%	0.811	56%	0.562	S	S	*	*	S	Bend	trans	-155.9	30.6	167.3	55.7	0	0	0	0	112.2
1302	S	26.3	Very low	42.2	Very low	113 Å²	113	105.9 Å²	105.9	79%	0.79	58%	0.579	S	S	*	*			trans	-148.2	99.5	172.6	-77.4	0	0	0	0	109.8
1303	A	24.2	Very low	39.7	Very low	89 Å²	89	113.7 Å²	113.7	74%	0.736	60%	0.604	S	S	*	*			trans	-73.6	161.9	179.6	0	0	0	0	0	112.2
1304	K	22.7	Very low	37.1	Very low	197 Å²	197	121.5 Å²	121.5	86%	0.857	64%	0.638	S	S	*	*			trans	83.8	138.3	159.3	-66.9	179.3	175.4	175.7	0	119.3
1305	V	23	Very low	34.5	Very low	120 Å²	120	125.6 Å²	125.6	73%	0.727	66%	0.66	S	S	*	*			trans	98.1	99.1	131.8	156	0	0	0	0	119.5
1306	I	22.4	Very low	32.4	Very low	138 Å²	138	127.4 Å²	127.4	71%	0.708	67%	0.671	S	S	*	*				69.5	105.4	126.6	-60.6	175.8	0	0	0	119.2
1307	M	21	Very low	30.4	Very low	164 Å²	164	135.7 Å²	135.7	81%	0.808	71%	0.714	S	S	*	*			trans	60.6	153.4	131.2	-68.3	-174.2	159.9	0	0	123.4
1308	H	23.8	Very low	29.6	Very low	159 Å²	159	135.9 Å²	135.9	74%	0.736	72%	0.721	S	S	*	*			trans	79.6	102.4	145.7	-91.2	-138.2	0	0	0	119.8
1309	S	22.4	Very low	29.8	Very low	95 Å²	95	135.7 Å²	135.7	66%	0.664	72%	0.716	S	S	*	*				69.5	142.9	113.3	-62.9	0	0	0	0	122.8
1310	F	20.8	Very low	31	Very low	181 Å²	181	134.7 Å²	134.7	79%	0.794	71%	0.705	S	S	*	*			trans	92.9	104.8	144.4	-101.5	-129.6	0	0	0	121.1
1311	L	23.6	Very low	33.1	Very low	132 Å²	132	130.3 Å²	130.3	69%	0.691	68%	0.684	S	S	*	*			trans	58.8	126.5	140.2	-51.5	178.1	0	0	0	118.5
1312	L	28.5	Very low	35	Very low	155 Å²	155	131.9 Å²	131.9	81%	0.812	68%	0.682	S	S	*	*				-161.7	159.4	70.8	-91.8	168.1	0	0	0	114.9
1313	R	24.5	Very low	36.8	Very low	199 Å²	199	130.1 Å²	130.1	75%	0.751	66%	0.664	S	S	*	*			trans	-46	156.8	179.8	-56.4	170.2	-175.9	-153.4	-2.5	115.3
1314	F	27.2	Very low	38.6	Very low	164 Å²	164	131.1 Å²	131.1	72%	0.719	66%	0.663	S	S	*	*				-167.5	157.1	62.8	-96.6	-82.8	0	0	0	114.5
1315	H	28.2	Very low	40.5	Very low	159 Å²	159	125.8 Å²	125.8	74%	0.736	66%	0.656	S	S	*	*			trans	44.9	116.2	167.3	-66.5	-73.4	0	0	0	118.5
1316	V	32.7	Very low	42.6	Very low	99 Å²	99	124.4 Å²	124.4	60%	0.6	64%	0.644	S	S	*	*			cis	74.1	92.5	46.4	-173.2	0	0	0	0	113.7
1317	L	36	Very low	44.9	Very low	178 Å²	178	118.9 Å²	118.9	93%	0.932	62%	0.616	S	S	*	*				-117.6	141.5	129.7	-75.8	167	0	0	0	105.5
1318	D	48.9	Very low	47.5	Very low	128 Å²	128	114.5 Å²	114.5	68%	0.684	60%	0.596	S	S	*	*			trans	-90.9	162.1	-169	-59.8	-70.5	0	0	0	112.6
1319	N	58.3	Low	50.3	Low	57 Å²	57	108 Å²	108	31%	0.305	57%	0.568	S	S	.	*			trans	-137.6	109.8	179.1	166.7	-67.8	0	0	0	106.9	C1321 L1322 D1337	N1319-C1321 VanDerWaalsContact C-N 3.32Å; N1319-C1321 PolarHBondContact O-N 3.23Å; N1319-C1321 PolarHBondContact OD1-N 3.3Å; N1319-L1322 HydrophobicContact CB-CD1 4.23Å; N1319-L1322 PolarHBondContact O-N 3.25Å; N1319-L1322 VanDerWaalsContact OD1-CG 3.27Å; N1319-L1322 WeakPolarHBondContact OD1-CG 2.97Å; N1319-L1322 PolarHBondContact OD1-N 3.09Å; N1319-D1337 VanDerWaalsContact CG-OD1 3.28Å; N1319-D1337 VanDerWaalsContact CG-OD2 3.23Å; N1319-D1337 WeakPolarHBondContact ND2-CB 3.35Å; N1319-D1337 PolarHBondContact ND2-OD1 3.12Å; N1319-D1337 PolarHBondContact ND2-OD2 2.98Å; N1319-D1337 PolarHBondContact OD1-OD1 2.94Å
1320	E	73.1	Confident	52.9	Low	63 Å²	63	104.7 Å²	104.7	29%	0.294	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-73	-22.3	-173	-71	86.9	172.5	0	0	113.3	L1322 D1323 L1326 N1327 D1337 Y1342	E1320-L1322 VanDerWaalsContact C-N 3.27Å; E1320-L1322 PolarHBondContact O-N 3.23Å; E1320-D1323 PolarHBondContact O-N 2.95Å; E1320-L1326 HydrophobicContact CB-CB 3.92Å; E1320-L1326 HydrophobicContact CG-CB 3.96Å; E1320-L1326 HydrophobicContact CG-CD1 4.27Å; E1320-N1327 PolarHBondContact O-ND2 2.85Å; E1320-D1337 PolarHBondContact N-OD1 3.02Å; E1320-D1337 VanDerWaalsContact N-OD1 3.14Å; E1320-Y1342 HydrophobicContact CB-CD1 3.63Å; E1320-Y1342 HydrophobicContact CB-CE1 4.19Å; E1320-Y1342 HydrophobicContact CG-CD1 4.36Å
1321	C	77.8	Confident	55.6	Low	30 Å²	30	101.5 Å²	101.5	20%	0.203	54%	0.54	C	S	.	.	G	3₁₀ helix	trans	-69.7	-19.1	176.4	-76.8	0	0	0	0	114.4	N1319 N1327 C1335 Q1336 D1337 Y1342	N1319-C1321 VanDerWaalsContact C-N 3.32Å; N1319-C1321 PolarHBondContact O-N 3.23Å; N1319-C1321 PolarHBondContact OD1-N 3.3Å; C1321-N1327 WeakPolarHBondContact CA-ND2 3.46Å; C1321-N1327 PolarHBondContact O-ND2 3.08Å; C1321-C1335 WeakPolarHBondContact CA-SG 3.41Å; C1321-C1335 HydrophobicContact CB-CB 3.85Å; C1321-C1335 WeakPolarHBondContact CB-SG 3.49Å; C1321-C1335 WeakPolarHBondContact SG-CB 3.28Å; C1321-C1335 CovalentContact SG-SG 2.05Å; C1321-C1335 PolarHBondContact SG-SG 3.45Å; C1321-Q1336 PolarHBondContact SG-N 2.55Å; C1321-Q1336 VanDerWaalsContact SG-N 3.45Å; C1321-D1337 HydrophobicContact CB-CB 4.22Å; C1321-D1337 PolarHBondContact N-OD1 2.78Å; C1321-D1337 PolarHBondContact SG-N 2.89Å; C1321-D1337 VanDerWaalsContact SG-N 3.41Å; C1321-Y1342 VanDerWaalsContact SG-CB 3.58Å
1322	L	69.1	Low	58.1	Low	149 Å²	149	98 Å²	98	78%	0.78	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-75.6	-20.2	175.8	-78.8	172	0	0	0	114.2	N1319 E1320	N1319-L1322 HydrophobicContact CB-CD1 4.23Å; N1319-L1322 PolarHBondContact O-N 3.25Å; N1319-L1322 VanDerWaalsContact OD1-CG 3.27Å; N1319-L1322 WeakPolarHBondContact OD1-CG 2.97Å; N1319-L1322 PolarHBondContact OD1-N 3.09Å; E1320-L1322 VanDerWaalsContact C-N 3.27Å; E1320-L1322 PolarHBondContact O-N 3.23Å
1323	D	65.1	Low	60.6	Low	76 Å²	76	90.8 Å²	90.8	41%	0.406	49%	0.485	S	S	.	.			trans	-119	110.9	178.3	-171	-10.4	0	0	0	111.4	E1320 A1325 L1326 N1327	E1320-D1323 PolarHBondContact O-N 2.95Å; D1323-A1325 PolarHBondContact O-N 2.82Å; D1323-A1325 WeakPolarHBondContact OD1-CB 3.38Å; D1323-A1325 PolarHBondContact OD1-N 3.44Å; D1323-L1326 HydrophobicContact CB-CB 4.32Å; D1323-L1326 HydrophobicContact CB-CD1 4.01Å; D1323-L1326 HydrophobicContact CB-CG 3.98Å; D1323-L1326 PolarHBondContact O-N 2.7Å; D1323-N1327 PolarHBondContact O-N 2.81Å; D1323-N1327 VanDerWaalsContact O-N 3.12Å; D1323-N1327 PolarHBondContact O-ND2 3.47Å
1324	P	61.5	Low	63.2	Low	111 Å²	111	87.2 Å²	87.2	72%	0.721	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	9.8	176	31.9	-36.4	0	0	0	114.3
1325	A	62.3	Low	65.7	Low	85 Å²	85	81.1 Å²	81.1	70%	0.702	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-15.6	160.9	0	0	0	0	0	113.6	D1323	D1323-A1325 PolarHBondContact O-N 2.82Å; D1323-A1325 WeakPolarHBondContact OD1-CB 3.38Å; D1323-A1325 PolarHBondContact OD1-N 3.44Å
1326	L	66.8	Low	68	Low	91 Å²	91	77.6 Å²	77.6	48%	0.476	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-35.6	175	-61.2	179.8	0	0	0	111.9	E1320 D1323 Y1342	E1320-L1326 HydrophobicContact CB-CB 3.92Å; E1320-L1326 HydrophobicContact CG-CB 3.96Å; E1320-L1326 HydrophobicContact CG-CD1 4.27Å; D1323-L1326 HydrophobicContact CB-CB 4.32Å; D1323-L1326 HydrophobicContact CB-CD1 4.01Å; D1323-L1326 HydrophobicContact CB-CG 3.98Å; D1323-L1326 PolarHBondContact O-N 2.7Å; L1326-Y1342 WeakPolarHBondContact O-CE1 3.43Å; L1326-Y1342 PolarHBondContact O-OH 2.83Å; L1326-Y1342 VanDerWaalsContact O-OH 3.13Å
1327	N	70.5	Confident	69.7	Low	22 Å²	22	75.7 Å²	75.7	12%	0.118	42%	0.424	C	S	.	.			trans	-95.7	147.7	169.6	72.1	87.1	0	0	0	113.3	E1320 C1321 D1323 C1335 Y1342	E1320-N1327 PolarHBondContact O-ND2 2.85Å; C1321-N1327 WeakPolarHBondContact CA-ND2 3.46Å; C1321-N1327 PolarHBondContact O-ND2 3.08Å; D1323-N1327 PolarHBondContact O-N 2.81Å; D1323-N1327 VanDerWaalsContact O-N 3.12Å; D1323-N1327 PolarHBondContact O-ND2 3.47Å; N1327-C1335 VanDerWaalsContact CB-SG 3.59Å; N1327-Y1342 VanDerWaalsContact CA-CZ 3.49Å; N1327-Y1342 HydrophobicContact CB-CD1 4.11Å; N1327-Y1342 HydrophobicContact CB-CD2 3.78Å; N1327-Y1342 HydrophobicContact CB-CE1 4.11Å; N1327-Y1342 HydrophobicContact CB-CE2 3.81Å; N1327-Y1342 HydrophobicContact CB-CG 3.94Å
1328	D	77.6	Confident	71.1	Confident	72 Å²	72	69.4 Å²	69.4	39%	0.385	39%	0.394	S	S	.	.			trans	-125.7	36.3	-178	62.8	6	0	0	0	112.4	Y1342 R1360	D1328-Y1342 VanDerWaalsContact CG-OH 3.31Å; D1328-Y1342 PolarHBondContact N-OH 2.97Å; D1328-Y1342 WeakPolarHBondContact OD1-CE2 3.42Å; D1328-Y1342 PolarHBondContact OD1-OH 3.06Å; D1328-R1360 IonicContact OD1-CZ 3.57Å; D1328-R1360 IonicContact OD1-NE 3.14Å; D1328-R1360 PolarHBondContact OD1-NE 2.81Å; D1328-R1360 IonicContact OD1-NH1 2.62Å; D1328-R1360 PolarHBondContact OD1-NH1 3.1Å; D1328-R1360 IonicContact OD1-NH2 2.63Å; D1328-R1360 PolarHBondContact OD1-NH2 2.97Å; D1328-R1360 IonicContact OD2-CZ 2.78Å; D1328-R1360 IonicContact OD2-NH1 2.86Å; D1328-R1360 PolarHBondContact OD2-NH1 3.43Å; D1328-R1360 IonicContact OD2-NH2 3.84Å; D1328-R1360 PolarHBondContact OD2-NH2 3.41Å
1329	C	80.9	Confident	71.4	Confident	22 Å²	22	71.8 Å²	71.8	15%	0.149	41%	0.406	C	S	.	.			trans	-71.7	155.3	170.7	-57.1	0	0	0	0	112.2	A1333 C1344	C1329-A1333 HydrophobicContact CB-CB 4.42Å; C1329-C1344 WeakPolarHBondContact CA-SG 3.1Å; C1329-C1344 HydrophobicContact CB-CB 3.65Å; C1329-C1344 WeakPolarHBondContact CB-SG 3.32Å; C1329-C1344 WeakPolarHBondContact SG-CB 3.49Å; C1329-C1344 CovalentContact SG-SG 2.03Å; C1329-C1344 PolarHBondContact SG-SG 2.04Å
1330	D	78.4	Confident	71.4	Confident	26 Å²	26	75.3 Å²	75.3	14%	0.139	43%	0.43	C	S	.	.			trans	-65.1	141.7	169.5	-167.3	-53.6	0	0	0	110.2	N1332 A1333 G1359 N1361 C1362	D1330-N1332 PolarHBondContact O-N 3.48Å; D1330-N1332 WeakPolarHBondContact OD1-CA 3.44Å; D1330-N1332 VanDerWaalsContact OD1-CB 3.29Å; D1330-N1332 WeakPolarHBondContact OD1-CB 3.41Å; D1330-N1332 PolarHBondContact OD1-N 2.88Å; D1330-A1333 HydrophobicContact CB-CB 3.91Å; D1330-A1333 WeakPolarHBondContact O-CA 3.05Å; D1330-A1333 VanDerWaalsContact O-CB 3.27Å; D1330-A1333 WeakPolarHBondContact O-CB 3.36Å; D1330-A1333 PolarHBondContact O-N 2.84Å; D1330-G1359 WeakPolarHBondContact CB-O 3.31Å; D1330-G1359 PolarHBondContact N-O 3.38Å; D1330-N1361 WeakPolarHBondContact OD2-CA 3.4Å; D1330-C1362 HydrophobicContact CB-CB 4.21Å; D1330-C1362 PolarHBondContact OD2-N 2.82Å
1331	P	76.8	Confident	71.2	Confident	113 Å²	113	74.7 Å²	74.7	73%	0.734	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27	169.8	-27.8	36.4	0	0	0	114.7	A1333 K1347	P1331-A1333 VanDerWaalsContact C-N 3.3Å; P1331-K1347 PolarHBondContact O-NZ 3.21Å
1332	N	76.6	Confident	71.2	Confident	58 Å²	58	76 Å²	76	31%	0.31	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.9	171.7	-58	-35.7	0	0	0	112.9	D1330 K1347 Y1350 C1362	D1330-N1332 PolarHBondContact O-N 3.48Å; D1330-N1332 WeakPolarHBondContact OD1-CA 3.44Å; D1330-N1332 VanDerWaalsContact OD1-CB 3.29Å; D1330-N1332 WeakPolarHBondContact OD1-CB 3.41Å; D1330-N1332 PolarHBondContact OD1-N 2.88Å; N1332-K1347 VanDerWaalsContact O-CB 3.28Å; N1332-K1347 WeakPolarHBondContact O-CB 3.47Å; N1332-K1347 WeakPolarHBondContact O-CD 3.27Å; N1332-K1347 VanDerWaalsContact O-CG 3.29Å; N1332-K1347 WeakPolarHBondContact O-CG 3.03Å; N1332-K1347 PolarHBondContact O-N 2.95Å; N1332-Y1350 HydrophobicContact CB-CD1 3.63Å; N1332-Y1350 HydrophobicContact CB-CE1 3.83Å; N1332-Y1350 HydrophobicContact CB-CG 4.1Å; N1332-Y1350 VanDerWaalsContact CG-CE1 3.43Å; N1332-C1362 HydrophobicContact CB-CB 3.76Å; N1332-C1362 PolarHBondContact ND2-O 3.04Å; N1332-C1362 VanDerWaalsContact ND2-O 3.11Å
1333	A	79.8	Confident	71.7	Confident	5 Å²	5	71.7 Å²	71.7	4%	0.041	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	166	167.1	0	0	0	0	0	112.1	C1329 D1330 P1331 C1344 F1345 K1347 G1359	C1329-A1333 HydrophobicContact CB-CB 4.42Å; D1330-A1333 HydrophobicContact CB-CB 3.91Å; D1330-A1333 WeakPolarHBondContact O-CA 3.05Å; D1330-A1333 VanDerWaalsContact O-CB 3.27Å; D1330-A1333 WeakPolarHBondContact O-CB 3.36Å; D1330-A1333 PolarHBondContact O-N 2.84Å; P1331-A1333 VanDerWaalsContact C-N 3.3Å; A1333-C1344 HydrophobicContact CB-CB 4.44Å; A1333-F1345 CarbonylContact C-O 3.38Å; A1333-F1345 WeakPolarHBondContact CA-O 3.45Å; A1333-F1345 VanDerWaalsContact CB-O 3.26Å; A1333-F1345 WeakPolarHBondContact CB-O 3.39Å; A1333-K1347 VanDerWaalsContact O-CE 3.29Å; A1333-K1347 WeakPolarHBondContact O-CE 3.15Å; A1333-K1347 PolarHBondContact O-NZ 2.04Å; A1333-G1359 WeakPolarHBondContact CB-O 3.04Å
1334	E	79.5	Confident	72.6	Confident	124 Å²	124	68.3 Å²	68.3	58%	0.579	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	128.3	171.9	-176.2	163.6	-165.5	0	0	108.7	C1344 F1345 K1347	E1334-C1344 WeakPolarHBondContact O-CA 3.38Å; E1334-F1345 PolarHBondContact N-O 2.94Å; E1334-F1345 PolarHBondContact O-N 2.74Å; E1334-K1347 HydrophobicContact CB-CG 4.5Å
1335	C	80.7	Confident	73.5	Confident	36 Å²	36	67.8 Å²	67.8	24%	0.243	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.9	174.8	-171.1	0	0	0	0	108.6	C1321 N1327	C1321-C1335 WeakPolarHBondContact CA-SG 3.41Å; C1321-C1335 HydrophobicContact CB-CB 3.85Å; C1321-C1335 WeakPolarHBondContact CB-SG 3.49Å; C1321-C1335 WeakPolarHBondContact SG-CB 3.28Å; C1321-C1335 CovalentContact SG-SG 2.05Å; C1321-C1335 PolarHBondContact SG-SG 3.45Å; N1327-C1335 VanDerWaalsContact CB-SG 3.59Å
1336	Q	75	Confident	74.3	Confident	85 Å²	85	65.3 Å²	65.3	40%	0.397	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120	175	-165.2	167.9	57.8	0	0	110	C1321 Y1342 V1343 F1345	C1321-Q1336 PolarHBondContact SG-N 2.55Å; C1321-Q1336 VanDerWaalsContact SG-N 3.45Å; Q1336-Y1342 WeakPolarHBondContact O-CA 3.39Å; Q1336-V1343 PolarHBondContact N-O 2.88Å; Q1336-V1343 PolarHBondContact O-N 2.96Å; Q1336-F1345 HydrophobicContact CB-CD2 4.45Å; Q1336-F1345 HydrophobicContact CB-CE2 4.06Å
1337	D	69.5	Low	74.6	Confident	58 Å²	58	65.2 Å²	65.2	31%	0.31	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	142.9	-178.5	-151.1	69.4	0	0	0	110.3	N1319 E1320 C1321	N1319-D1337 VanDerWaalsContact CG-OD1 3.28Å; N1319-D1337 VanDerWaalsContact CG-OD2 3.23Å; N1319-D1337 WeakPolarHBondContact ND2-CB 3.35Å; N1319-D1337 PolarHBondContact ND2-OD1 3.12Å; N1319-D1337 PolarHBondContact ND2-OD2 2.98Å; N1319-D1337 PolarHBondContact OD1-OD1 2.94Å; E1320-D1337 PolarHBondContact N-OD1 3.02Å; E1320-D1337 VanDerWaalsContact N-OD1 3.14Å; C1321-D1337 HydrophobicContact CB-CB 4.22Å; C1321-D1337 PolarHBondContact N-OD1 2.78Å; C1321-D1337 PolarHBondContact SG-N 2.89Å; C1321-D1337 VanDerWaalsContact SG-N 3.41Å
1338	T	64.6	Low	74.6	Confident	47 Å²	47	73.9 Å²	73.9	29%	0.288	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	153.9	179.7	68.7	0	0	0	0	109.3	T1340 S1341 V1343	T1338-T1340 PolarHBondContact O-N 2.78Å; T1338-S1341 CarbonylContact C-O 3.43Å; T1338-S1341 WeakPolarHBondContact CA-O 3.34Å; T1338-S1341 WeakPolarHBondContact CB-O 3.44Å; T1338-S1341 PolarHBondContact N-O 2.89Å; T1338-S1341 PolarHBondContact O-N 3.29Å; T1338-S1341 PolarHBondContact OG1-N 2.94Å; T1338-S1341 PolarHBondContact OG1-O 3.21Å; T1338-S1341 PolarHBondContact OG1-OG 3.28Å; T1338-V1343 HydrophobicContact CG2-CG2 4.08Å
1339	D	55.8	Low	73.8	Confident	177 Å²	177	72.3 Å²	72.3	95%	0.947	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-1.6	-171	-54.8	-33	0	0	0	116.5
1340	T	57.3	Low	73.4	Confident	132 Å²	132	74.4 Å²	74.4	81%	0.81	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.1	0.3	173.2	61.3	0	0	0	0	115.5	T1338	T1338-T1340 PolarHBondContact O-N 2.78Å
1341	S	68.8	Low	72.9	Confident	50 Å²	50	79.5 Å²	79.5	35%	0.35	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	-176.1	-167.6	49.9	0	0	0	0	112.7	T1338	T1338-S1341 CarbonylContact C-O 3.43Å; T1338-S1341 WeakPolarHBondContact CA-O 3.34Å; T1338-S1341 WeakPolarHBondContact CB-O 3.44Å; T1338-S1341 PolarHBondContact N-O 2.89Å; T1338-S1341 PolarHBondContact O-N 3.29Å; T1338-S1341 PolarHBondContact OG1-N 2.94Å; T1338-S1341 PolarHBondContact OG1-O 3.21Å; T1338-S1341 PolarHBondContact OG1-OG 3.28Å
1342	Y	79.6	Confident	72.5	Confident	56 Å²	56	76.6 Å²	76.6	22%	0.22	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	156.6	166	56.5	-87.3	0	0	0	111.9	E1320 C1321 L1326 N1327 D1328 Q1336	E1320-Y1342 HydrophobicContact CB-CD1 3.63Å; E1320-Y1342 HydrophobicContact CB-CE1 4.19Å; E1320-Y1342 HydrophobicContact CG-CD1 4.36Å; C1321-Y1342 VanDerWaalsContact SG-CB 3.58Å; L1326-Y1342 WeakPolarHBondContact O-CE1 3.43Å; L1326-Y1342 PolarHBondContact O-OH 2.83Å; L1326-Y1342 VanDerWaalsContact O-OH 3.13Å; N1327-Y1342 VanDerWaalsContact CA-CZ 3.49Å; N1327-Y1342 HydrophobicContact CB-CD1 4.11Å; N1327-Y1342 HydrophobicContact CB-CD2 3.78Å; N1327-Y1342 HydrophobicContact CB-CE1 4.11Å; N1327-Y1342 HydrophobicContact CB-CE2 3.81Å; N1327-Y1342 HydrophobicContact CB-CG 3.94Å; D1328-Y1342 VanDerWaalsContact CG-OH 3.31Å; D1328-Y1342 PolarHBondContact N-OH 2.97Å; D1328-Y1342 WeakPolarHBondContact OD1-CE2 3.42Å; D1328-Y1342 PolarHBondContact OD1-OH 3.06Å; Q1336-Y1342 WeakPolarHBondContact O-CA 3.39Å
1343	V	79.3	Confident	72.1	Confident	59 Å²	59	79.6 Å²	79.6	36%	0.358	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.5	174.6	-174.7	0	0	0	0	109.3	Q1336 T1338 F1345	Q1336-V1343 PolarHBondContact N-O 2.88Å; Q1336-V1343 PolarHBondContact O-N 2.96Å; T1338-V1343 HydrophobicContact CG2-CG2 4.08Å; V1343-F1345 HydrophobicContact CB-CE2 4.15Å; V1343-F1345 HydrophobicContact CB-CZ 4.28Å; V1343-F1345 HydrophobicContact CG1-CE1 4.07Å; V1343-F1345 HydrophobicContact CG1-CE2 3.76Å; V1343-F1345 HydrophobicContact CG1-CZ 3.52Å
1344	C	82.4	Confident	71	Confident	6 Å²	6	81.7 Å²	81.7	4%	0.041	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.2	-178.3	-46.1	0	0	0	0	111.1	C1329 A1333 E1334 P1358 G1359	C1329-C1344 WeakPolarHBondContact CA-SG 3.1Å; C1329-C1344 HydrophobicContact CB-CB 3.65Å; C1329-C1344 WeakPolarHBondContact CB-SG 3.32Å; C1329-C1344 WeakPolarHBondContact SG-CB 3.49Å; C1329-C1344 CovalentContact SG-SG 2.03Å; C1329-C1344 PolarHBondContact SG-SG 2.04Å; A1333-C1344 HydrophobicContact CB-CB 4.44Å; E1334-C1344 WeakPolarHBondContact O-CA 3.38Å; C1344-P1358 WeakPolarHBondContact CB-O 3.4Å; C1344-P1358 CarbonylContact O-C 3.53Å; C1344-G1359 WeakPolarHBondContact CB-O 3.48Å; C1344-G1359 WeakPolarHBondContact O-CA 3.27Å; C1344-G1359 PolarHBondContact O-N 2.04Å
1345	F	81.6	Confident	70.2	Confident	100 Å²	100	82.9 Å²	82.9	44%	0.439	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.2	177.5	-56.9	-81.8	0	0	0	112	A1333 E1334 Q1336 V1343 K1347	A1333-F1345 CarbonylContact C-O 3.38Å; A1333-F1345 WeakPolarHBondContact CA-O 3.45Å; A1333-F1345 VanDerWaalsContact CB-O 3.26Å; A1333-F1345 WeakPolarHBondContact CB-O 3.39Å; E1334-F1345 PolarHBondContact N-O 2.94Å; E1334-F1345 PolarHBondContact O-N 2.74Å; Q1336-F1345 HydrophobicContact CB-CD2 4.45Å; Q1336-F1345 HydrophobicContact CB-CE2 4.06Å; V1343-F1345 HydrophobicContact CB-CE2 4.15Å; V1343-F1345 HydrophobicContact CB-CZ 4.28Å; V1343-F1345 HydrophobicContact CG1-CE1 4.07Å; V1343-F1345 HydrophobicContact CG1-CE2 3.76Å; V1343-F1345 HydrophobicContact CG1-CZ 3.52Å; F1345-K1347 PolarHBondContact O-N 3.3Å
1346	C	78.1	Confident	69.3	Low	33 Å²	33	86.8 Å²	86.8	22%	0.223	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	132.8	175.9	-61.7	0	0	0	0	112.1	Y1350 D1352 C1362	C1346-Y1350 WeakPolarHBondContact CB-O 3.04Å; C1346-D1352 VanDerWaalsContact SG-CA 3.58Å; C1346-C1362 WeakPolarHBondContact CA-SG 2.79Å; C1346-C1362 HydrophobicContact CB-CB 3.72Å; C1346-C1362 WeakPolarHBondContact CB-SG 3.2Å; C1346-C1362 VanDerWaalsContact SG-CA 3.54Å; C1346-C1362 WeakPolarHBondContact SG-CB 3.23Å; C1346-C1362 CovalentContact SG-SG 2.03Å; C1346-C1362 PolarHBondContact SG-SG 3.09Å
1347	K	73.4	Confident	68.8	Low	89 Å²	89	87.2 Å²	87.2	39%	0.387	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-64.9	153.5	179.1	-70.7	167	172.5	127.7	0	111.2	P1331 N1332 A1333 E1334 F1345 G1349 Y1350	P1331-K1347 PolarHBondContact O-NZ 3.21Å; N1332-K1347 VanDerWaalsContact O-CB 3.28Å; N1332-K1347 WeakPolarHBondContact O-CB 3.47Å; N1332-K1347 WeakPolarHBondContact O-CD 3.27Å; N1332-K1347 VanDerWaalsContact O-CG 3.29Å; N1332-K1347 WeakPolarHBondContact O-CG 3.03Å; N1332-K1347 PolarHBondContact O-N 2.95Å; A1333-K1347 VanDerWaalsContact O-CE 3.29Å; A1333-K1347 WeakPolarHBondContact O-CE 3.15Å; A1333-K1347 PolarHBondContact O-NZ 2.04Å; E1334-K1347 HydrophobicContact CB-CG 4.5Å; F1345-K1347 PolarHBondContact O-N 3.3Å; K1347-G1349 PolarHBondContact O-N 3.46Å; K1347-Y1350 HydrophobicContact CB-CD2 4.43Å; K1347-Y1350 WeakPolarHBondContact O-CA 3.33Å; K1347-Y1350 WeakPolarHBondContact O-CB 3.43Å; K1347-Y1350 PolarHBondContact O-N 2.03Å
1348	E	70.6	Confident	68.9	Low	203 Å²	203	88.1 Å²	88.1	95%	0.949	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	132.7	-178.1	-160.3	175.3	-138.1	0	0	111.6
1349	G	60.3	Low	69.3	Low	39 Å²	39	85.9 Å²	85.9	40%	0.402	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	5.3	-168.6	0	0	0	0	0	115.1	K1347 Q1364 V1365	K1347-G1349 PolarHBondContact O-N 3.46Å; G1349-Q1364 CarbonylContact O-C 3.36Å; G1349-Q1364 WeakPolarHBondContact O-CA 3.03Å; G1349-V1365 PolarHBondContact O-N 3.01Å
1350	Y	72.9	Confident	70.5	Confident	66 Å²	66	80.8 Å²	80.8	26%	0.259	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	139.9	168.6	-64.5	-106.9	0	0	0	110.3	N1332 C1346 K1347 C1362 M1363 Q1364	N1332-Y1350 HydrophobicContact CB-CD1 3.63Å; N1332-Y1350 HydrophobicContact CB-CE1 3.83Å; N1332-Y1350 HydrophobicContact CB-CG 4.1Å; N1332-Y1350 VanDerWaalsContact CG-CE1 3.43Å; C1346-Y1350 WeakPolarHBondContact CB-O 3.04Å; K1347-Y1350 HydrophobicContact CB-CD2 4.43Å; K1347-Y1350 WeakPolarHBondContact O-CA 3.33Å; K1347-Y1350 WeakPolarHBondContact O-CB 3.43Å; K1347-Y1350 PolarHBondContact O-N 2.03Å; Y1350-C1362 WeakPolarHBondContact CD1-O 3.4Å; Y1350-M1363 CarbonylContact C-O 3.44Å; Y1350-M1363 VanDerWaalsContact CA-O 3.24Å; Y1350-M1363 WeakPolarHBondContact CA-O 3.3Å; Y1350-Q1364 HydrophobicContact CD1-CB 3.83Å; Y1350-Q1364 HydrophobicContact CD1-CG 4.32Å; Y1350-Q1364 HydrophobicContact CE1-CB 3.52Å; Y1350-Q1364 HydrophobicContact CE1-CG 3.86Å; Y1350-Q1364 HydrophobicContact CE2-CG 4.13Å; Y1350-Q1364 HydrophobicContact CG-CB 4.5Å
1351	Q	69	Low	71.3	Confident	134 Å²	134	78.5 Å²	78.5	63%	0.626	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	144.9	179.5	-174.2	170.3	1.3	0	0	111.5	M1363 V1365	Q1351-M1363 PolarHBondContact N-O 2.92Å; Q1351-M1363 PolarHBondContact O-N 3.21Å; Q1351-V1365 HydrophobicContact CB-CG2 3.67Å
1352	D	68.4	Low	71.7	Confident	52 Å²	52	76.2 Å²	76.2	28%	0.278	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	149	-179.1	-148.8	-39.6	0	0	0	113.1	C1346 D1354 P1358 G1359 N1361	C1346-D1352 VanDerWaalsContact SG-CA 3.58Å; D1352-D1354 PolarHBondContact OD1-N 3.15Å; D1352-P1358 WeakPolarHBondContact OD2-CA 3.22Å; D1352-G1359 PolarHBondContact OD2-N 2.89Å; D1352-N1361 WeakPolarHBondContact CA-O 3.36Å
1353	M	68.3	Low	71.1	Confident	120 Å²	120	79.1 Å²	79.1	59%	0.591	41%	0.412	S	S	*	.			trans	-124.3	-6.5	172.2	-63.4	-159.9	-58.3	0	0	114.7	N1361 M1363	M1353-N1361 HydrophobicContact CB-CB 4.35Å; M1353-N1361 PolarHBondContact N-O 2.6Å; M1353-N1361 VanDerWaalsContact N-O 3.1Å; M1353-M1363 HydrophobicContact CE-CG 4.08Å; M1353-M1363 HydrophobicContact CE-SD 3.44Å; M1353-M1363 WeakPolarHBondContact CE-SD 3.49Å; M1353-M1363 HydrophobicContact SD-SD 3.91Å
1354	D	56.6	Low	70.2	Confident	49 Å²	49	82.3 Å²	82.3	26%	0.262	42%	0.423	S	S	.	.			trans	-105.2	93.2	177.8	-166.6	-22.4	0	0	0	111.9	D1352 T1356 K1357	D1352-D1354 PolarHBondContact OD1-N 3.15Å; D1354-T1356 PolarHBondContact O-N 3.07Å; D1354-T1356 WeakPolarHBondContact OD1-CA 3.4Å; D1354-T1356 WeakPolarHBondContact OD1-CB 3.2Å; D1354-T1356 PolarHBondContact OD1-N 3.29Å; D1354-T1356 PolarHBondContact OD1-OG1 3.23Å; D1354-K1357 CarbonylContact O-C 3.57Å; D1354-K1357 PolarHBondContact O-N 3.21Å; D1354-K1357 VanDerWaalsContact O-N 3.1Å; D1354-K1357 PolarHBondContact OD1-N 3.22Å
1355	V	62.2	Low	68.8	Low	149 Å²	149	85.3 Å²	85.3	90%	0.903	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-18.2	177.4	-173.3	0	0	0	0	112.9
1356	T	60.7	Low	66.4	Low	118 Å²	118	85.8 Å²	85.8	72%	0.724	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-23.3	178.7	73.1	0	0	0	0	113.6	D1354	D1354-T1356 PolarHBondContact O-N 3.07Å; D1354-T1356 WeakPolarHBondContact OD1-CA 3.4Å; D1354-T1356 WeakPolarHBondContact OD1-CB 3.2Å; D1354-T1356 PolarHBondContact OD1-N 3.29Å; D1354-T1356 PolarHBondContact OD1-OG1 3.23Å
1357	K	66.2	Low	64.3	Low	95 Å²	95	90.1 Å²	90.1	41%	0.413	48%	0.478	S	S	.	.	S	Bend	trans	-147.3	90.3	-177	-66.5	-155.1	-178	-167.5	0	111.6	D1354 R1360	D1354-K1357 CarbonylContact O-C 3.57Å; D1354-K1357 PolarHBondContact O-N 3.21Å; D1354-K1357 VanDerWaalsContact O-N 3.1Å; D1354-K1357 PolarHBondContact OD1-N 3.22Å; K1357-R1360 HydrophobicContact CB-CG 4.27Å
1358	P	71.6	Confident	61.9	Low	77 Å²	77	94.4 Å²	94.4	50%	0.5	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	148.9	179.2	-27.5	35.8	0	0	0	113.7	C1344 D1352 R1360	C1344-P1358 WeakPolarHBondContact CB-O 3.4Å; C1344-P1358 CarbonylContact O-C 3.53Å; D1352-P1358 WeakPolarHBondContact OD2-CA 3.22Å; P1358-R1360 PolarHBondContact O-N 2.62Å
1359	G	72.7	Confident	59.9	Low	0 Å²	0	91.2 Å²	91.2	0%	0	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	22.9	175.3	0	0	0	0	0	115.4	D1330 A1333 C1344 D1352	D1330-G1359 WeakPolarHBondContact CB-O 3.31Å; D1330-G1359 PolarHBondContact N-O 3.38Å; A1333-G1359 WeakPolarHBondContact CB-O 3.04Å; C1344-G1359 WeakPolarHBondContact CB-O 3.48Å; C1344-G1359 WeakPolarHBondContact O-CA 3.27Å; C1344-G1359 PolarHBondContact O-N 2.04Å; D1352-G1359 PolarHBondContact OD2-N 2.89Å
1360	R	79.8	Confident	58.3	Low	70 Å²	70	94.6 Å²	94.6	26%	0.264	51%	0.507	S	S	.	.	S	Bend	trans	-114.9	-9.2	-179.5	-61.5	-163.3	-175.5	-155.2	-3.1	115.9	D1328 K1357 P1358	D1328-R1360 IonicContact OD1-CZ 3.57Å; D1328-R1360 IonicContact OD1-NE 3.14Å; D1328-R1360 PolarHBondContact OD1-NE 2.81Å; D1328-R1360 IonicContact OD1-NH1 2.62Å; D1328-R1360 PolarHBondContact OD1-NH1 3.1Å; D1328-R1360 IonicContact OD1-NH2 2.63Å; D1328-R1360 PolarHBondContact OD1-NH2 2.97Å; D1328-R1360 IonicContact OD2-CZ 2.78Å; D1328-R1360 IonicContact OD2-NH1 2.86Å; D1328-R1360 PolarHBondContact OD2-NH1 3.43Å; D1328-R1360 IonicContact OD2-NH2 3.84Å; D1328-R1360 PolarHBondContact OD2-NH2 3.41Å; K1357-R1360 HydrophobicContact CB-CG 4.27Å; P1358-R1360 PolarHBondContact O-N 2.62Å
1361	N	74.2	Confident	56.3	Low	83 Å²	83	97.5 Å²	97.5	44%	0.444	53%	0.534	S	S	.	.	S	Bend	trans	-145.5	94.7	169.4	-95.3	-65.9	0	0	0	108.5	D1330 D1352 M1353	D1330-N1361 WeakPolarHBondContact OD2-CA 3.4Å; D1352-N1361 WeakPolarHBondContact CA-O 3.36Å; M1353-N1361 HydrophobicContact CB-CB 4.35Å; M1353-N1361 PolarHBondContact N-O 2.6Å; M1353-N1361 VanDerWaalsContact N-O 3.1Å
1362	C	78.7	Confident	54.4	Low	3 Å²	3	96.7 Å²	96.7	2%	0.02	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	109.9	-171.3	-65	0	0	0	0	110.4	D1330 N1332 C1346 Y1350	D1330-C1362 HydrophobicContact CB-CB 4.21Å; D1330-C1362 PolarHBondContact OD2-N 2.82Å; N1332-C1362 HydrophobicContact CB-CB 3.76Å; N1332-C1362 PolarHBondContact ND2-O 3.04Å; N1332-C1362 VanDerWaalsContact ND2-O 3.11Å; C1346-C1362 WeakPolarHBondContact CA-SG 2.79Å; C1346-C1362 HydrophobicContact CB-CB 3.72Å; C1346-C1362 WeakPolarHBondContact CB-SG 3.2Å; C1346-C1362 VanDerWaalsContact SG-CA 3.54Å; C1346-C1362 WeakPolarHBondContact SG-CB 3.23Å; C1346-C1362 CovalentContact SG-SG 2.03Å; C1346-C1362 PolarHBondContact SG-SG 3.09Å; Y1350-C1362 WeakPolarHBondContact CD1-O 3.4Å
1363	M	67	Low	52.7	Low	116 Å²	116	100.4 Å²	100.4	57%	0.571	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.5	137.5	-173.9	-89.2	-166.3	70.4	0	0	113.3	Y1350 Q1351 M1353 V1365	Y1350-M1363 CarbonylContact C-O 3.44Å; Y1350-M1363 VanDerWaalsContact CA-O 3.24Å; Y1350-M1363 WeakPolarHBondContact CA-O 3.3Å; Q1351-M1363 PolarHBondContact N-O 2.92Å; Q1351-M1363 PolarHBondContact O-N 3.21Å; M1353-M1363 HydrophobicContact CE-CG 4.08Å; M1353-M1363 HydrophobicContact CE-SD 3.44Å; M1353-M1363 WeakPolarHBondContact CE-SD 3.49Å; M1353-M1363 HydrophobicContact SD-SD 3.91Å; M1363-V1365 PolarHBondContact O-N 3.36Å
1364	Q	58.6	Low	51.2	Low	127 Å²	127	102.9 Å²	102.9	59%	0.593	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.7	118	-170.5	-160	174.2	18.8	0	0	113.5	G1349 Y1350	G1349-Q1364 CarbonylContact O-C 3.36Å; G1349-Q1364 WeakPolarHBondContact O-CA 3.03Å; Y1350-Q1364 HydrophobicContact CD1-CB 3.83Å; Y1350-Q1364 HydrophobicContact CD1-CG 4.32Å; Y1350-Q1364 HydrophobicContact CE1-CB 3.52Å; Y1350-Q1364 HydrophobicContact CE1-CG 3.86Å; Y1350-Q1364 HydrophobicContact CE2-CG 4.13Å; Y1350-Q1364 HydrophobicContact CG-CB 4.5Å
1365	V	53.6	Low	50.5	Low	68 Å²	68	108 Å²	108	41%	0.412	60%	0.595	S	S	.	*			trans	-84.4	115	175.5	-177.8	0	0	0	0	109.2	G1349 Q1351 M1363 T1367	G1349-V1365 PolarHBondContact O-N 3.01Å; Q1351-V1365 HydrophobicContact CB-CG2 3.67Å; M1363-V1365 PolarHBondContact O-N 3.36Å; V1365-T1367 HydrophobicContact CG1-CG2 4.48Å
1366	T	31.8	Very low	49.6	Very low	110 Å²	110	108.3 Å²	108.3	68%	0.675	59%	0.587	S	S	*	*			trans	-105.7	90.7	-174.4	-56.3	0	0	0	0	111.4
1367	T	33.2	Very low	49.5	Very low	125 Å²	125	103.7 Å²	103.7	77%	0.767	56%	0.559	S	S	*	*			trans	-114.8	104.7	172.3	47.5	0	0	0	0	111.1	V1365	V1365-T1367 HydrophobicContact CG1-CG2 4.48Å
1368	Q	23.9	Very low	49.4	Very low	179 Å²	179	104.2 Å²	104.2	84%	0.836	57%	0.566	S	S	*	*			trans	-83.4	126.8	173.1	-65.7	-179.9	-3.1	0	0	110.5
1369	T	27.8	Very low	49.2	Very low	136 Å²	136	103.3 Å²	103.3	83%	0.834	56%	0.557	S	S	*	*			trans	-146.8	132.5	151.5	-29.2	0	0	0	0	108.8
1370	T	28.1	Very low	48.7	Very low	110 Å²	110	109.1 Å²	109.1	68%	0.675	58%	0.584	S	S	*	*			trans	-70.3	146.8	-176.1	48.1	0	0	0	0	111.3	V1372	T1370-V1372 VanDerWaalsContact C-N 3.33Å; T1370-V1372 PolarHBondContact O-N 2.84Å
1371	P	29.9	Very low	47.8	Very low	126 Å²	126	106 Å²	106	82%	0.818	57%	0.572	S	S	*	*			trans	-62.8	98.9	162.8	28.4	-32.9	0	0	0	108.5	T1373	P1371-T1373 PolarHBondContact O-N 3.12Å; P1371-T1373 VanDerWaalsContact O-N 3.16Å
1372	V	29.2	Very low	47.5	Very low	118 Å²	118	105.6 Å²	105.6	72%	0.715	58%	0.581	S	S	*	*			trans	-64.7	112.6	163.1	175.8	0	0	0	0	105.3	T1370 E1374	T1370-V1372 VanDerWaalsContact C-N 3.33Å; T1370-V1372 PolarHBondContact O-N 2.84Å; V1372-E1374 PolarHBondContact O-N 2.83Å
1373	T	33.4	Very low	46.6	Very low	130 Å²	130	110.9 Å²	110.9	80%	0.798	62%	0.618	S	S	*	*			trans	-49.5	113.4	178.3	-47.5	0	0	0	0	108.7	P1371 Q1375	P1371-T1373 PolarHBondContact O-N 3.12Å; P1371-T1373 VanDerWaalsContact O-N 3.16Å; T1373-Q1375 PolarHBondContact O-N 2.83Å
1374	E	35.5	Very low	46.3	Very low	171 Å²	171	114.6 Å²	114.6	80%	0.799	63%	0.625	S	S	*	*			trans	-60.4	113.1	-161.7	-167	167.6	-141	0	0	109.9	V1372 Q1376	V1372-E1374 PolarHBondContact O-N 2.83Å; E1374-Q1376 VanDerWaalsContact C-N 3.26Å; E1374-Q1376 PolarHBondContact O-N 2.03Å
1375	Q	42.9	Very low	46.8	Very low	158 Å²	158	112.1 Å²	112.1	74%	0.738	62%	0.616	S	S	*	*			trans	-73.3	90.1	178	-77	-167.8	-45.6	0	0	108.1	T1373 C1377	T1373-Q1375 PolarHBondContact O-N 2.83Å; Q1375-C1377 PolarHBondContact O-N 3.2Å
1376	Q	42.9	Very low	47.8	Very low	154 Å²	154	108.9 Å²	108.9	72%	0.72	60%	0.596	S	S	*	*			trans	-26.9	100.8	-177	-166.3	76.4	41.2	0	0	112.7	E1374 D1378	E1374-Q1376 VanDerWaalsContact C-N 3.26Å; E1374-Q1376 PolarHBondContact O-N 2.03Å; Q1376-D1378 PolarHBondContact O-N 2.79Å
1377	C	59.1	Low	49.8	Very low	22 Å²	22	104.5 Å²	104.5	15%	0.149	57%	0.57	C	S	.	*			trans	-63.3	132.6	175.6	-62.6	0	0	0	0	109.2	Q1375 L1385 C1387	Q1375-C1377 PolarHBondContact O-N 3.2Å; C1377-L1385 HydrophobicContact CB-CB 4.16Å; C1377-L1385 WeakPolarHBondContact O-CB 3.48Å; C1377-L1385 WeakPolarHBondContact O-CD2 3.35Å; C1377-C1387 HydrophobicContact CB-CB 3.89Å; C1377-C1387 WeakPolarHBondContact CB-SG 3.31Å; C1377-C1387 VanDerWaalsContact SG-CA 3.59Å; C1377-C1387 WeakPolarHBondContact SG-CB 3.09Å; C1377-C1387 CovalentContact SG-SG 2.04Å; C1377-C1387 PolarHBondContact SG-SG 3.36Å
1378	D	63.6	Low	51.7	Low	105 Å²	105	101.4 Å²	101.4	56%	0.561	55%	0.553	S	S	*	*			trans	-117.8	-4.8	-150.8	52.6	-38.7	0	0	0	113.7	Q1376 S1388	Q1376-D1378 PolarHBondContact O-N 2.79Å; D1378-S1388 WeakPolarHBondContact OD1-CB 3.38Å; D1378-S1388 PolarHBondContact OD1-N 2.72Å; D1378-S1388 WeakPolarHBondContact OD2-CB 3.32Å
1379	I	67.7	Low	53.8	Low	58 Å²	58	96.4 Å²	96.4	30%	0.297	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	95	177.5	-55.5	173.9	0	0	0	109.4	C1381 L1385 C1386 C1394	I1379-C1381 PolarHBondContact O-N 2.61Å; I1379-L1385 CarbonylContact O-C 3.58Å; I1379-L1385 WeakPolarHBondContact O-CA 3.31Å; I1379-C1386 HydrophobicContact CB-CB 4.21Å; I1379-C1386 HydrophobicContact CG2-CB 4.47Å; I1379-C1386 PolarHBondContact N-O 3.34Å; I1379-C1386 PolarHBondContact O-N 2.89Å; I1379-C1394 HydrophobicContact CG2-CB 4.41Å
1380	Q	61.7	Low	56	Low	123 Å²	123	92.3 Å²	92.3	58%	0.575	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.8	126.3	174.1	-170.8	73.3	36.5	0	0	111	A1382	Q1380-A1382 PolarHBondContact NE2-O 2.05Å
1381	C	61.9	Low	58.1	Low	3 Å²	3	88.8 Å²	88.8	2%	0.02	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	94	-177.5	-170.1	0	0	0	0	110.3	I1379 S1383 R1384 C1386 C1394	I1379-C1381 PolarHBondContact O-N 2.61Å; C1381-S1383 PolarHBondContact O-N 3.41Å; C1381-R1384 CarbonylContact C-O 3.45Å; C1381-R1384 WeakPolarHBondContact CA-O 3.48Å; C1381-R1384 PolarHBondContact N-O 2.88Å; C1381-R1384 PolarHBondContact O-N 3.45Å; C1381-C1386 WeakPolarHBondContact CB-SG 3.17Å; C1381-C1394 VanDerWaalsContact CA-SG 3.53Å; C1381-C1394 HydrophobicContact CB-CB 3.67Å; C1381-C1394 WeakPolarHBondContact CB-SG 3.2Å; C1381-C1394 VanDerWaalsContact SG-CA 3.5Å; C1381-C1394 WeakPolarHBondContact SG-CB 3.3Å; C1381-C1394 CovalentContact SG-SG 2.03Å; C1381-C1394 PolarHBondContact SG-SG 3.39Å
1382	A	67.9	Low	60.4	Low	76 Å²	76	83.6 Å²	83.6	63%	0.628	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	-124.1	-165.2	0	0	0	0	0	111	Q1380	Q1380-A1382 PolarHBondContact NE2-O 2.05Å
1383	S	58.6	Low	62.6	Low	113 Å²	113	80.5 Å²	80.5	79%	0.79	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	5.7	-176.6	55.4	0	0	0	0	115.3	C1381	C1381-S1383 PolarHBondContact O-N 3.41Å
1384	R	61.2	Low	64.6	Low	194 Å²	194	76.9 Å²	76.9	73%	0.732	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	156.3	176.1	-66.2	-177.4	174.8	127.3	-2.8	110.3	C1381	C1381-R1384 CarbonylContact C-O 3.45Å; C1381-R1384 WeakPolarHBondContact CA-O 3.48Å; C1381-R1384 PolarHBondContact N-O 2.88Å; C1381-R1384 PolarHBondContact O-N 3.45Å
1385	L	68.9	Low	65.7	Low	75 Å²	75	72.2 Å²	72.2	39%	0.393	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.6	172.6	-62.4	98.3	0	0	0	109.2	C1377 I1379	C1377-L1385 HydrophobicContact CB-CB 4.16Å; C1377-L1385 WeakPolarHBondContact O-CB 3.48Å; C1377-L1385 WeakPolarHBondContact O-CD2 3.35Å; I1379-L1385 CarbonylContact O-C 3.58Å; I1379-L1385 WeakPolarHBondContact O-CA 3.31Å
1386	C	75.7	Confident	66.2	Low	0 Å²	0	77 Å²	77	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	145.1	171.7	-54.8	0	0	0	0	110.2	I1379 C1381 S1388 E1392 C1399	I1379-C1386 HydrophobicContact CB-CB 4.21Å; I1379-C1386 HydrophobicContact CG2-CB 4.47Å; I1379-C1386 PolarHBondContact N-O 3.34Å; I1379-C1386 PolarHBondContact O-N 2.89Å; C1381-C1386 WeakPolarHBondContact CB-SG 3.17Å; C1386-S1388 PolarHBondContact O-N 2.96Å; C1386-E1392 HydrophobicContact CB-CB 4.18Å; C1386-C1399 WeakPolarHBondContact CA-SG 3.49Å; C1386-C1399 HydrophobicContact CB-CB 3.74Å; C1386-C1399 WeakPolarHBondContact CB-SG 3.35Å; C1386-C1399 WeakPolarHBondContact SG-CA 3.26Å; C1386-C1399 WeakPolarHBondContact SG-CB 3.34Å; C1386-C1399 CovalentContact SG-SG 2.03Å; C1386-C1399 PolarHBondContact SG-SG 3Å
1387	C	72.6	Confident	67.1	Low	18 Å²	18	71.7 Å²	71.7	12%	0.122	40%	0.398	C	S	.	.			trans	-92.6	103.9	-173.9	-58.2	0	0	0	0	110.2	C1377 S1389 K1390 E1392	C1377-C1387 HydrophobicContact CB-CB 3.89Å; C1377-C1387 WeakPolarHBondContact CB-SG 3.31Å; C1377-C1387 VanDerWaalsContact SG-CA 3.59Å; C1377-C1387 WeakPolarHBondContact SG-CB 3.09Å; C1377-C1387 CovalentContact SG-SG 2.04Å; C1377-C1387 PolarHBondContact SG-SG 3.36Å; C1387-S1389 PolarHBondContact O-N 3.39Å; C1387-K1390 HydrophobicContact CB-CB 4.05Å; C1387-K1390 HydrophobicContact CB-CD 4.19Å; C1387-K1390 HydrophobicContact CB-CG 3.77Å; C1387-K1390 PolarHBondContact O-N 2.88Å; C1387-E1392 PolarHBondContact N-OE2 3.13Å; C1387-E1392 PolarHBondContact O-N 3Å
1388	S	73.3	Confident	67.5	Low	60 Å²	60	77.1 Å²	77.1	42%	0.42	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-50.9	-39.7	171.1	-173.7	0	0	0	0	111	D1378 C1386 K1390 G1391	D1378-S1388 WeakPolarHBondContact OD1-CB 3.38Å; D1378-S1388 PolarHBondContact OD1-N 2.72Å; D1378-S1388 WeakPolarHBondContact OD2-CB 3.32Å; C1386-S1388 PolarHBondContact O-N 2.96Å; S1388-K1390 VanDerWaalsContact C-N 3.27Å; S1388-K1390 PolarHBondContact O-N 2.55Å; S1388-G1391 PolarHBondContact O-N 3.16Å
1389	S	68.2	Low	68	Low	74 Å²	74	73.2 Å²	73.2	52%	0.517	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-57.8	-27.1	173.9	52	0	0	0	0	115.3	C1387	C1387-S1389 PolarHBondContact O-N 3.39Å
1390	K	73.9	Confident	68.5	Low	51 Å²	51	72.1 Å²	72.1	22%	0.222	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-89	-4.1	174.5	-65.2	-164.8	-179.7	-159.9	0	113.5	C1387 S1388 E1392 N1411 N1413 C1414	C1387-K1390 HydrophobicContact CB-CB 4.05Å; C1387-K1390 HydrophobicContact CB-CD 4.19Å; C1387-K1390 HydrophobicContact CB-CG 3.77Å; C1387-K1390 PolarHBondContact O-N 2.88Å; S1388-K1390 VanDerWaalsContact C-N 3.27Å; S1388-K1390 PolarHBondContact O-N 2.55Å; K1390-E1392 HydrophobicContact CB-CG 4.03Å; K1390-E1392 PolarHBondContact O-N 3.31Å; K1390-N1411 PolarHBondContact NZ-O 2.87Å; K1390-N1411 PolarHBondContact NZ-OD1 2.82Å; K1390-N1413 WeakPolarHBondContact CA-OD1 3.25Å; K1390-N1413 WeakPolarHBondContact O-CA 3.14Å; K1390-C1414 PolarHBondContact O-N 3.4Å
1391	G	72.6	Confident	69.2	Low	35 Å²	35	67.2 Å²	67.2	36%	0.361	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	17	-168.7	0	0	0	0	0	113.5	S1388 P1402	S1388-G1391 PolarHBondContact O-N 3.16Å; G1391-P1402 WeakPolarHBondContact O-CD 3.39Å
1392	E	77.6	Confident	69.8	Low	17 Å²	17	68.6 Å²	68.6	8%	0.079	39%	0.385	C	S	.	.			trans	-73.4	136.8	174.5	-70.7	-173.2	134.2	0	0	111	C1386 C1387 K1390 C1399 R1407	C1386-E1392 HydrophobicContact CB-CB 4.18Å; C1387-E1392 PolarHBondContact N-OE2 3.13Å; C1387-E1392 PolarHBondContact O-N 3Å; K1390-E1392 HydrophobicContact CB-CG 4.03Å; K1390-E1392 PolarHBondContact O-N 3.31Å; E1392-C1399 HydrophobicContact CB-CB 4.36Å; E1392-C1399 HydrophobicContact CG-CB 4.46Å; E1392-R1407 IonicContact OE1-CZ 2.62Å; E1392-R1407 VanDerWaalsContact OE1-CZ 3.23Å; E1392-R1407 IonicContact OE1-NH1 3.12Å; E1392-R1407 PolarHBondContact OE1-NH1 2.89Å; E1392-R1407 IonicContact OE1-NH2 3.92Å; E1392-R1407 PolarHBondContact OE1-NH2 3.35Å
1393	V	76.1	Confident	69.9	Low	54 Å²	54	70.7 Å²	70.7	33%	0.327	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	148.4	168.9	-73.4	0	0	0	0	110	L1395 S1400 P1402	V1393-L1395 HydrophobicContact CG2-CD1 3.89Å; V1393-L1395 HydrophobicContact CG2-CD2 4.34Å; V1393-L1395 HydrophobicContact CG2-CG 3.81Å; V1393-L1395 PolarHBondContact O-N 2.91Å; V1393-L1395 VanDerWaalsContact O-N 3.09Å; V1393-S1400 VanDerWaalsContact CG2-O 3.31Å; V1393-S1400 WeakPolarHBondContact CG2-O 3.27Å; V1393-S1400 PolarHBondContact N-O 3.49Å; V1393-S1400 PolarHBondContact O-N 2.85Å; V1393-S1400 VanDerWaalsContact O-N 3.07Å; V1393-S1400 VanDerWaalsContact O-O 3.07Å; V1393-P1402 HydrophobicContact CG2-CB 3.82Å; V1393-P1402 HydrophobicContact CG2-CG 4.4Å
1394	C	75	Confident	70.3	Confident	54 Å²	54	67.1 Å²	67.1	37%	0.365	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	97.4	173.9	-172.8	0	0	0	0	109.6	I1379 C1381	I1379-C1394 HydrophobicContact CG2-CB 4.41Å; C1381-C1394 VanDerWaalsContact CA-SG 3.53Å; C1381-C1394 HydrophobicContact CB-CB 3.67Å; C1381-C1394 WeakPolarHBondContact CB-SG 3.2Å; C1381-C1394 VanDerWaalsContact SG-CA 3.5Å; C1381-C1394 WeakPolarHBondContact SG-CB 3.3Å; C1381-C1394 CovalentContact SG-SG 2.03Å; C1381-C1394 PolarHBondContact SG-SG 3.39Å
1395	L	59.2	Low	71	Confident	73 Å²	73	62.2 Å²	62.2	38%	0.382	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.9	175.7	-68.4	172	0	0	0	108.7	V1393 G1397 K1398 C1401	V1393-L1395 HydrophobicContact CG2-CD1 3.89Å; V1393-L1395 HydrophobicContact CG2-CD2 4.34Å; V1393-L1395 HydrophobicContact CG2-CG 3.81Å; V1393-L1395 PolarHBondContact O-N 2.91Å; V1393-L1395 VanDerWaalsContact O-N 3.09Å; L1395-G1397 PolarHBondContact O-N 2.03Å; L1395-K1398 PolarHBondContact N-O 3.3Å; L1395-K1398 PolarHBondContact O-N 2.81Å; L1395-K1398 VanDerWaalsContact O-O 3.12Å; L1395-C1401 VanDerWaalsContact CD1-O 3.26Å; L1395-C1401 WeakPolarHBondContact CD1-O 2.83Å
1396	R	52.4	Low	71.2	Confident	258 Å²	258	59.4 Å²	59.4	97%	0.974	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	39.6	179.9	-59.8	177.2	169.8	177.3	-6.4	113.4	K1398	R1396-K1398 VanDerWaalsContact C-N 3.28Å; R1396-K1398 PolarHBondContact O-N 3.47Å
1397	G	60.9	Low	70.8	Confident	43 Å²	43	61.3 Å²	61.3	44%	0.443	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	6.2	179.7	0	0	0	0	0	115.4	L1395	L1395-G1397 PolarHBondContact O-N 2.03Å
1398	K	67.7	Low	70.3	Confident	136 Å²	136	64.9 Å²	64.9	59%	0.591	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	139.9	173.2	-169.9	179.4	179.3	-178.2	0	110.2	L1395 R1396 S1400	L1395-K1398 PolarHBondContact N-O 3.3Å; L1395-K1398 PolarHBondContact O-N 2.81Å; L1395-K1398 VanDerWaalsContact O-O 3.12Å; R1396-K1398 VanDerWaalsContact C-N 3.28Å; R1396-K1398 PolarHBondContact O-N 3.47Å; K1398-S1400 PolarHBondContact O-N 2.79Å
1399	C	73.9	Confident	69.8	Low	23 Å²	23	65.4 Å²	65.4	16%	0.155	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	120	169.9	-51.9	0	0	0	0	109.4	C1386 E1392	C1386-C1399 WeakPolarHBondContact CA-SG 3.49Å; C1386-C1399 HydrophobicContact CB-CB 3.74Å; C1386-C1399 WeakPolarHBondContact CB-SG 3.35Å; C1386-C1399 WeakPolarHBondContact SG-CA 3.26Å; C1386-C1399 WeakPolarHBondContact SG-CB 3.34Å; C1386-C1399 CovalentContact SG-SG 2.03Å; C1386-C1399 PolarHBondContact SG-SG 3Å; E1392-C1399 HydrophobicContact CB-CB 4.36Å; E1392-C1399 HydrophobicContact CG-CB 4.46Å
1400	S	78.4	Confident	69.4	Low	34 Å²	34	69 Å²	69	24%	0.238	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	163	-173.3	-70.8	0	0	0	0	110.9	V1393 K1398	V1393-S1400 VanDerWaalsContact CG2-O 3.31Å; V1393-S1400 WeakPolarHBondContact CG2-O 3.27Å; V1393-S1400 PolarHBondContact N-O 3.49Å; V1393-S1400 PolarHBondContact O-N 2.85Å; V1393-S1400 VanDerWaalsContact O-N 3.07Å; V1393-S1400 VanDerWaalsContact O-O 3.07Å; K1398-S1400 PolarHBondContact O-N 2.79Å
1401	C	77.1	Confident	68.9	Low	20 Å²	20	72.6 Å²	72.6	14%	0.135	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-73.9	145.5	-178.7	-61.8	0	0	0	0	112.1	L1395 F1405 C1414	L1395-C1401 VanDerWaalsContact CD1-O 3.26Å; L1395-C1401 WeakPolarHBondContact CD1-O 2.83Å; C1401-F1405 HydrophobicContact CB-CB 4.12Å; C1401-F1405 VanDerWaalsContact CB-O 3.29Å; C1401-F1405 WeakPolarHBondContact CB-O 3.43Å; C1401-C1414 WeakPolarHBondContact CA-SG 3.38Å; C1401-C1414 HydrophobicContact CB-CB 3.63Å; C1401-C1414 WeakPolarHBondContact CB-SG 3.17Å; C1401-C1414 VanDerWaalsContact SG-CA 3.54Å; C1401-C1414 WeakPolarHBondContact SG-CB 3.26Å; C1401-C1414 CovalentContact SG-SG 2.04Å; C1401-C1414 PolarHBondContact SG-SG 2.77Å
1402	P	74.4	Confident	68.8	Low	33 Å²	33	74.2 Å²	74.2	21%	0.214	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-66.3	151.9	178.2	25.4	-31.5	0	0	0	111.1	G1391 V1393 G1404 F1405	G1391-P1402 WeakPolarHBondContact O-CD 3.39Å; V1393-P1402 HydrophobicContact CG2-CB 3.82Å; V1393-P1402 HydrophobicContact CG2-CG 4.4Å; P1402-G1404 PolarHBondContact O-N 2.73Å; P1402-F1405 HydrophobicContact CB-CD2 4.44Å; P1402-F1405 HydrophobicContact CG-CB 4.06Å; P1402-F1405 HydrophobicContact CG-CD2 3.76Å; P1402-F1405 HydrophobicContact CG-CE2 4.39Å; P1402-F1405 HydrophobicContact CG-CG 3.95Å; P1402-F1405 WeakPolarHBondContact O-CA 3.5Å; P1402-F1405 WeakPolarHBondContact O-CB 2.82Å; P1402-F1405 PolarHBondContact O-N 3.03Å
1403	P	69.5	Low	68.6	Low	120 Å²	120	78 Å²	78	78%	0.779	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	128.6	-178.7	-27.9	35.7	0	0	0	113.2
1404	G	67.2	Low	68.7	Low	37 Å²	37	76.3 Å²	76.3	38%	0.381	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	5.6	-170.2	0	0	0	0	0	114.6	P1402 V1417	P1402-G1404 PolarHBondContact O-N 2.73Å; G1404-V1417 PolarHBondContact O-N 3.42Å
1405	F	75.4	Confident	68.7	Low	92 Å²	92	76.7 Å²	76.7	40%	0.404	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	144.6	171.1	-63.1	-112.6	0	0	0	109.8	C1401 P1402 C1414 V1415 A1416	C1401-F1405 HydrophobicContact CB-CB 4.12Å; C1401-F1405 VanDerWaalsContact CB-O 3.29Å; C1401-F1405 WeakPolarHBondContact CB-O 3.43Å; P1402-F1405 HydrophobicContact CB-CD2 4.44Å; P1402-F1405 HydrophobicContact CG-CB 4.06Å; P1402-F1405 HydrophobicContact CG-CD2 3.76Å; P1402-F1405 HydrophobicContact CG-CE2 4.39Å; P1402-F1405 HydrophobicContact CG-CG 3.95Å; P1402-F1405 WeakPolarHBondContact O-CA 3.5Å; P1402-F1405 WeakPolarHBondContact O-CB 2.82Å; P1402-F1405 PolarHBondContact O-N 3.03Å; F1405-C1414 HydrophobicContact CB-CB 4.27Å; F1405-V1415 CarbonylContact C-O 2.89Å; F1405-V1415 WeakPolarHBondContact CA-O 3.03Å; F1405-V1415 WeakPolarHBondContact CB-O 3.1Å; F1405-A1416 HydrophobicContact CD1-CB 3.98Å; F1405-A1416 HydrophobicContact CE1-CB 3.83Å; F1405-A1416 HydrophobicContact CZ-CB 4.25Å
1406	G	74.3	Confident	69.4	Low	15 Å²	15	74.6 Å²	74.6	16%	0.155	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	-178	176	0	0	0	0	0	111.3	V1415	G1406-V1415 PolarHBondContact N-O 2.88Å; G1406-V1415 WeakPolarHBondContact O-CG2 3.29Å; G1406-V1415 PolarHBondContact O-N 2.82Å
1407	R	67.3	Low	70.6	Confident	41 Å²	41	62.7 Å²	62.7	16%	0.155	37%	0.37	C	S	.	.			trans	-154.7	148.9	171.7	62.2	-177.6	175	-169.8	-8.5	108.9	E1392 T1409 Q1410 D1412	E1392-R1407 IonicContact OE1-CZ 2.62Å; E1392-R1407 VanDerWaalsContact OE1-CZ 3.23Å; E1392-R1407 IonicContact OE1-NH1 3.12Å; E1392-R1407 PolarHBondContact OE1-NH1 2.89Å; E1392-R1407 IonicContact OE1-NH2 3.92Å; E1392-R1407 PolarHBondContact OE1-NH2 3.35Å; R1407-T1409 VanDerWaalsContact CD-O 3.23Å; R1407-T1409 WeakPolarHBondContact CD-O 3.48Å; R1407-T1409 WeakPolarHBondContact CG-O 3.2Å; R1407-Q1410 PolarHBondContact NH1-O 2.9Å; R1407-D1412 HydrophobicContact CB-CB 4.21Å; R1407-D1412 WeakPolarHBondContact CD-O 3.29Å; R1407-D1412 PolarHBondContact NH1-O 2.53Å
1408	S	61.9	Low	71.2	Confident	92 Å²	92	63.3 Å²	63.3	64%	0.643	36%	0.364	S	S	*	.	S	Bend	trans	-79.3	-48.3	179.6	-175.2	0	0	0	0	111.3
1409	T	63.3	Low	71.2	Confident	71 Å²	71	60.2 Å²	60.2	44%	0.436	36%	0.356	S	S	.	.	S	Bend	trans	-111.3	160	174.5	84.8	0	0	0	0	112.1	R1407 N1411 D1412	R1407-T1409 VanDerWaalsContact CD-O 3.23Å; R1407-T1409 WeakPolarHBondContact CD-O 3.48Å; R1407-T1409 WeakPolarHBondContact CG-O 3.2Å; T1409-N1411 PolarHBondContact O-N 2.96Å; T1409-N1411 PolarHBondContact OG1-N 3.39Å; T1409-D1412 WeakPolarHBondContact CA-OD2 3.08Å; T1409-D1412 VanDerWaalsContact CB-OD2 3.27Å; T1409-D1412 WeakPolarHBondContact CB-OD2 3.33Å; T1409-D1412 WeakPolarHBondContact CG2-OD2 3.33Å; T1409-D1412 PolarHBondContact N-OD2 3.36Å; T1409-D1412 PolarHBondContact O-N 3.15Å; T1409-D1412 PolarHBondContact OG1-OD2 2.98Å
1410	Q	60.1	Low	71.3	Confident	150 Å²	150	59.8 Å²	59.8	70%	0.701	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-13.5	-178.8	-169.7	167.6	-20.7	0	0	113.8	R1407	R1407-Q1410 PolarHBondContact NH1-O 2.9Å
1411	N	62.9	Low	71.2	Confident	126 Å²	126	61 Å²	61	67%	0.674	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-20	176.4	-91.5	-26.3	0	0	0	114	K1390 T1409	K1390-N1411 PolarHBondContact NZ-O 2.87Å; K1390-N1411 PolarHBondContact NZ-OD1 2.82Å; T1409-N1411 PolarHBondContact O-N 2.96Å; T1409-N1411 PolarHBondContact OG1-N 3.39Å
1412	D	69.8	Low	71.3	Confident	70 Å²	70	60.2 Å²	60.2	37%	0.374	35%	0.353	S	S	.	.	S	Bend	trans	-73.4	157.5	-174.6	-59.5	-49.2	0	0	0	113.4	R1407 T1409	R1407-D1412 HydrophobicContact CB-CB 4.21Å; R1407-D1412 WeakPolarHBondContact CD-O 3.29Å; R1407-D1412 PolarHBondContact NH1-O 2.53Å; T1409-D1412 WeakPolarHBondContact CA-OD2 3.08Å; T1409-D1412 VanDerWaalsContact CB-OD2 3.27Å; T1409-D1412 WeakPolarHBondContact CB-OD2 3.33Å; T1409-D1412 WeakPolarHBondContact CG2-OD2 3.33Å; T1409-D1412 PolarHBondContact N-OD2 3.36Å; T1409-D1412 PolarHBondContact O-N 3.15Å; T1409-D1412 PolarHBondContact OG1-OD2 2.98Å
1413	N	74.7	Confident	71.5	Confident	96 Å²	96	60.3 Å²	60.3	51%	0.513	35%	0.354	S	S	.	.			trans	-72.1	146.7	171.2	-66.9	-5.5	0	0	0	110.7	K1390 V1415	K1390-N1413 WeakPolarHBondContact CA-OD1 3.25Å; K1390-N1413 WeakPolarHBondContact O-CA 3.14Å; N1413-V1415 PolarHBondContact O-N 3.41Å
1414	C	76.7	Confident	72.2	Confident	18 Å²	18	54.6 Å²	54.6	12%	0.122	32%	0.316	C	S	.	.			trans	-70.5	113.6	179.9	-66.6	0	0	0	0	112.1	K1390 C1401 F1405	K1390-C1414 PolarHBondContact O-N 3.4Å; C1401-C1414 WeakPolarHBondContact CA-SG 3.38Å; C1401-C1414 HydrophobicContact CB-CB 3.63Å; C1401-C1414 WeakPolarHBondContact CB-SG 3.17Å; C1401-C1414 VanDerWaalsContact SG-CA 3.54Å; C1401-C1414 WeakPolarHBondContact SG-CB 3.26Å; C1401-C1414 CovalentContact SG-SG 2.04Å; C1401-C1414 PolarHBondContact SG-SG 2.77Å; F1405-C1414 HydrophobicContact CB-CB 4.27Å
1415	V	75	Confident	73	Confident	63 Å²	63	52.8 Å²	52.8	38%	0.382	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	146.5	-179.9	-70.1	0	0	0	0	111.4	F1405 G1406 N1413 L1503	F1405-V1415 CarbonylContact C-O 2.89Å; F1405-V1415 WeakPolarHBondContact CA-O 3.03Å; F1405-V1415 WeakPolarHBondContact CB-O 3.1Å; G1406-V1415 PolarHBondContact N-O 2.88Å; G1406-V1415 WeakPolarHBondContact O-CG2 3.29Å; G1406-V1415 PolarHBondContact O-N 2.82Å; N1413-V1415 PolarHBondContact O-N 3.41Å; V1415-L1503 HydrophobicContact CB-CD2 4.1Å; V1415-L1503 HydrophobicContact CG2-CD2 3.65Å
1416	A	74.8	Confident	73.4	Confident	29 Å²	29	48.4 Å²	48.4	24%	0.24	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133.9	-178.3	0	0	0	0	0	111.3	F1405 R1504	F1405-A1416 HydrophobicContact CD1-CB 3.98Å; F1405-A1416 HydrophobicContact CE1-CB 3.83Å; F1405-A1416 HydrophobicContact CZ-CB 4.25Å; A1416-R1504 HydrophobicContact CB-CB 4.31Å; A1416-R1504 PolarHBondContact O-N 2.98Å; A1416-R1504 VanDerWaalsContact O-N 3.16Å
1417	V	77.5	Confident	73.8	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.6	-177.3	-63.2	0	0	0	0	112.2	G1404 V1473 N1501 I1502	G1404-V1417 PolarHBondContact O-N 3.42Å; V1417-V1473 HydrophobicContact CG1-CB 4.21Å; V1417-V1473 HydrophobicContact CG1-CG1 4.27Å; V1417-V1473 HydrophobicContact CG1-CG2 3.76Å; V1417-N1501 HydrophobicContact CB-CB 4.43Å; V1417-N1501 HydrophobicContact CG2-CB 4.4Å; V1417-I1502 CarbonylContact C-O 3.59Å; V1417-I1502 WeakPolarHBondContact CA-O 3.26Å; V1417-I1502 VanDerWaalsContact CB-O 3.25Å; V1417-I1502 WeakPolarHBondContact CB-O 3.46Å
1418	D	73.7	Confident	74.3	Confident	56 Å²	56	51.5 Å²	51.5	30%	0.299	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	143.8	161.4	-62.9	-48	0	0	0	108.7	I1502 R1504 G1505	D1418-I1502 PolarHBondContact N-O 2.8Å; D1418-I1502 WeakPolarHBondContact O-CG1 3.43Å; D1418-I1502 PolarHBondContact O-N 2.03Å; D1418-R1504 VanDerWaalsContact OD1-CG 3.3Å; D1418-R1504 WeakPolarHBondContact OD1-CG 3.41Å; D1418-R1504 IonicContact OD1-CZ 3.77Å; D1418-R1504 IonicContact OD1-NE 3.12Å; D1418-R1504 PolarHBondContact OD1-NE 2.9Å; D1418-R1504 IonicContact OD1-NH2 3.9Å; D1418-R1504 PolarHBondContact OD1-NH2 3.37Å; D1418-R1504 WeakPolarHBondContact OD2-CA 3.38Å; D1418-R1504 WeakPolarHBondContact OD2-CG 3.32Å; D1418-G1505 PolarHBondContact OD2-N 2.03Å; D1418-G1505 VanDerWaalsContact OD2-N 3.09Å
1419	T	68.3	Low	75.2	Confident	72 Å²	72	50.9 Å²	50.9	44%	0.442	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.2	-175.9	-52.9	0	0	0	0	111	K1499 V1500 N1501	T1419-K1499 HydrophobicContact CG2-CB 3.65Å; T1419-K1499 HydrophobicContact CG2-CD 4.01Å; T1419-K1499 HydrophobicContact CG2-CG 3.73Å; T1419-V1500 WeakPolarHBondContact CA-O 3.03Å; T1419-N1501 WeakPolarHBondContact CB-OD1 3.49Å; T1419-N1501 WeakPolarHBondContact CG2-OD1 3Å; T1419-N1501 PolarHBondContact OG1-OD1 2.79Å
1420	V	74.4	Confident	75.7	Confident	13 Å²	13	48.5 Å²	48.5	8%	0.079	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128.4	-178.7	178.5	0	0	0	0	110	I1422 K1499 V1500 Q1509 I1512	V1420-I1422 HydrophobicContact CG1-CG2 4.35Å; V1420-K1499 CarbonylContact O-C 3.44Å; V1420-K1499 WeakPolarHBondContact O-CA 3.02Å; V1420-V1500 PolarHBondContact N-O 2.76Å; V1420-V1500 PolarHBondContact O-N 2.83Å; V1420-Q1509 HydrophobicContact CG1-CB 4.24Å; V1420-Q1509 HydrophobicContact CG1-CG 3.67Å; V1420-I1512 HydrophobicContact CG2-CD1 3.96Å
1421	V	77.5	Confident	75.8	Confident	60 Å²	60	50.6 Å²	50.6	36%	0.364	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.9	174.5	-175.8	0	0	0	0	110	A1498 K1499 Q1509	V1421-A1498 CarbonylContact C-O 3.48Å; V1421-A1498 WeakPolarHBondContact CA-O 3.38Å; V1421-K1499 HydrophobicContact CG2-CG 3.92Å; V1421-Q1509 PolarHBondContact O-NE2 3.17Å
1422	I	78.2	Confident	75.7	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.7	174	54.7	172.9	0	0	0	111	V1420 V1424 A1498 V1500 L1516 I1540	V1420-I1422 HydrophobicContact CG1-CG2 4.35Å; I1422-V1424 HydrophobicContact CD1-CG2 4.16Å; I1422-V1424 HydrophobicContact CG1-CG2 4.35Å; I1422-A1498 HydrophobicContact CG1-CB 4.34Å; I1422-A1498 PolarHBondContact N-O 2.99Å; I1422-A1498 PolarHBondContact O-N 2.92Å; I1422-V1500 HydrophobicContact CD1-CG2 3.69Å; I1422-V1500 HydrophobicContact CG1-CG2 4.06Å; I1422-L1516 HydrophobicContact CD1-CD2 3.47Å; I1422-L1516 VanDerWaalsContact CD1-CD2 3.47Å; I1422-I1540 HydrophobicContact CB-CG2 4.37Å
1423	P	79.2	Confident	75.5	Confident	34 Å²	34	49.6 Å²	49.6	22%	0.221	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	110.5	172.9	33.7	-27.3	0	0	0	110.7	L1495 V1496 E1497 Y1538 I1540	P1423-L1495 HydrophobicContact CB-CD1 4.08Å; P1423-V1496 CarbonylContact C-O 3.48Å; P1423-V1496 WeakPolarHBondContact CA-O 3.08Å; P1423-E1497 HydrophobicContact CB-CG 4.46Å; P1423-Y1538 WeakPolarHBondContact O-CE1 3.25Å; P1423-Y1538 PolarHBondContact O-OH 2.87Å; P1423-I1540 WeakPolarHBondContact CG-O 3.45Å
1424	V	83.5	Confident	75.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.3	-177.5	-175.9	0	0	0	0	109.9	I1422 V1426 F1455 V1496 T1534 I1540	I1422-V1424 HydrophobicContact CD1-CG2 4.16Å; I1422-V1424 HydrophobicContact CG1-CG2 4.35Å; V1424-V1426 HydrophobicContact CG1-CG2 4.46Å; V1424-F1455 HydrophobicContact CB-CE2 4.03Å; V1424-F1455 HydrophobicContact CB-CZ 3.83Å; V1424-F1455 HydrophobicContact CG1-CE2 4.05Å; V1424-F1455 HydrophobicContact CG1-CZ 4.24Å; V1424-F1455 HydrophobicContact CG2-CZ 3.96Å; V1424-V1496 PolarHBondContact N-O 3.14Å; V1424-V1496 WeakPolarHBondContact O-CB 3.42Å; V1424-V1496 PolarHBondContact O-N 2.84Å; V1424-T1534 HydrophobicContact CG1-CG2 3.81Å; V1424-I1540 HydrophobicContact CG1-CD1 4.4Å; V1424-I1540 HydrophobicContact CG2-CD1 4.19Å; V1424-I1540 HydrophobicContact CG2-CG1 4.44Å; V1424-I1540 HydrophobicContact CG2-CG2 4.16Å
1425	V	84.3	Confident	74.8	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	126.5	170.5	-179.7	0	0	0	0	109.7	P1491 L1494 L1495 P1535 Y1538	V1425-P1491 HydrophobicContact CG1-CG 4.39Å; V1425-L1494 CarbonylContact C-O 3.56Å; V1425-L1494 VanDerWaalsContact CA-O 3.32Å; V1425-L1494 WeakPolarHBondContact CA-O 3.04Å; V1425-L1495 HydrophobicContact CG2-CB 4.44Å; V1425-L1495 HydrophobicContact CG2-CD1 3.77Å; V1425-P1535 HydrophobicContact CB-CG 4.26Å; V1425-P1535 HydrophobicContact CG1-CG 3.96Å; V1425-P1535 WeakPolarHBondContact O-CD 3.48Å; V1425-Y1538 HydrophobicContact CB-CD1 3.9Å; V1425-Y1538 HydrophobicContact CB-CE1 4.05Å; V1425-Y1538 HydrophobicContact CB-CG 4.19Å; V1425-Y1538 HydrophobicContact CG2-CD1 4.02Å; V1425-Y1538 HydrophobicContact CG2-CD2 4.16Å; V1425-Y1538 HydrophobicContact CG2-CE1 3.77Å; V1425-Y1538 HydrophobicContact CG2-CE2 3.95Å; V1425-Y1538 HydrophobicContact CG2-CG 4.2Å
1426	V	85	Confident	74.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.1	174	-164.9	0	0	0	0	108.7	V1424 L1434 F1451 F1455 G1493 L1494 V1496 I1527 L1532 Y1533	V1424-V1426 HydrophobicContact CG1-CG2 4.46Å; V1426-L1434 HydrophobicContact CB-CD1 4.07Å; V1426-L1434 HydrophobicContact CG1-CD1 3.59Å; V1426-F1451 HydrophobicContact CB-CZ 4.11Å; V1426-F1451 HydrophobicContact CG1-CZ 4.31Å; V1426-F1451 HydrophobicContact CG2-CZ 4.15Å; V1426-F1455 HydrophobicContact CG2-CD2 4.04Å; V1426-F1455 HydrophobicContact CG2-CE2 3.88Å; V1426-G1493 CarbonylContact O-C 3.59Å; V1426-G1493 VanDerWaalsContact O-CA 3.28Å; V1426-G1493 WeakPolarHBondContact O-CA 3.1Å; V1426-L1494 PolarHBondContact N-O 3.31Å; V1426-L1494 PolarHBondContact O-N 2.95Å; V1426-V1496 HydrophobicContact CG2-CG2 3.91Å; V1426-I1527 HydrophobicContact CG1-CD1 4.48Å; V1426-I1527 HydrophobicContact CG2-CD1 4.04Å; V1426-L1532 HydrophobicContact CG1-CB 3.99Å; V1426-L1532 HydrophobicContact CG1-CD2 3.99Å; V1426-Y1533 WeakPolarHBondContact CA-O 3.45Å; V1426-Y1533 WeakPolarHBondContact CG1-O 3.05Å
1427	N	82.7	Confident	74.2	Confident	37 Å²	37	51.8 Å²	51.8	20%	0.198	29%	0.285	C	S	.	.			trans	-113.8	-16.8	-172.5	81	-24.3	0	0	0	115.1	P1433 L1434 E1492 Y1533 P1535	N1427-P1433 WeakPolarHBondContact O-CA 3.22Å; N1427-L1434 PolarHBondContact O-N 2.88Å; N1427-E1492 VanDerWaalsContact CB-O 3.29Å; N1427-E1492 WeakPolarHBondContact CB-O 3.31Å; N1427-Y1533 PolarHBondContact N-O 2.66Å; N1427-Y1533 PolarHBondContact OD1-O 2.75Å; N1427-P1535 HydrophobicContact CB-CB 4.25Å; N1427-P1535 HydrophobicContact CB-CG 4.26Å
1428	R	77.7	Confident	73.5	Confident	83 Å²	83	55.8 Å²	55.8	31%	0.313	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.7	177.5	-65.7	169.7	-73.9	-175	-0.7	112.1	S1432 Y1533	R1428-S1432 CarbonylContact C-O 3.49Å; R1428-S1432 WeakPolarHBondContact CA-O 3.44Å; R1428-S1432 WeakPolarHBondContact CB-O 3.44Å; R1428-Y1533 HydrophobicContact CB-CD2 4.29Å; R1428-Y1533 PolarHBondContact O-N 2.85Å
1429	F	80.6	Confident	73	Confident	79 Å²	79	55.2 Å²	55.2	35%	0.346	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	111	165.6	-179.6	-105.9	0	0	0	108.7	E1431 S1432 L1434 L1454 N1531 L1532	F1429-E1431 PolarHBondContact O-N 3.37Å; F1429-S1432 PolarHBondContact N-O 2.94Å; F1429-S1432 WeakPolarHBondContact O-CB 3.33Å; F1429-S1432 PolarHBondContact O-N 2.99Å; F1429-L1434 HydrophobicContact CB-CD1 4.39Å; F1429-L1434 HydrophobicContact CB-CD2 3.93Å; F1429-L1434 HydrophobicContact CB-CG 4.14Å; F1429-L1454 HydrophobicContact CE2-CD1 3.96Å; F1429-L1454 HydrophobicContact CZ-CD1 4.29Å; F1429-N1531 CarbonylContact C-O 3.6Å; F1429-N1531 WeakPolarHBondContact CA-O 3.25Å; F1429-N1531 HydrophobicContact CD2-CB 4.13Å; F1429-N1531 HydrophobicContact CE2-CB 3.99Å; F1429-N1531 HydrophobicContact CZ-CB 4.49Å; F1429-L1532 HydrophobicContact CD2-CD2 3.78Å; F1429-L1532 HydrophobicContact CD2-CG 4.28Å
1430	G	72.4	Confident	73.2	Confident	22 Å²	22	52.6 Å²	52.6	23%	0.227	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	-129.7	-164	0	0	0	0	0	109.7	N1531	G1430-N1531 PolarHBondContact N-O 3.27Å
1431	E	63.9	Low	72.9	Confident	193 Å²	193	56.9 Å²	56.9	90%	0.902	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-10.3	173.7	-57.6	-173.5	158.4	0	0	112.7	F1429	F1429-E1431 PolarHBondContact O-N 3.37Å
1432	S	59.7	Low	72	Confident	78 Å²	78	57.7 Å²	57.7	55%	0.545	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	133.1	-175.8	-64.9	0	0	0	0	112.5	R1428 F1429	R1428-S1432 CarbonylContact C-O 3.49Å; R1428-S1432 WeakPolarHBondContact CA-O 3.44Å; R1428-S1432 WeakPolarHBondContact CB-O 3.44Å; F1429-S1432 PolarHBondContact N-O 2.94Å; F1429-S1432 WeakPolarHBondContact O-CB 3.33Å; F1429-S1432 PolarHBondContact O-N 2.99Å
1433	P	66	Low	71.2	Confident	98 Å²	98	61.1 Å²	61.1	64%	0.636	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.9	172.8	29.6	-33.8	0	0	0	111.8	N1427 V1435	N1427-P1433 WeakPolarHBondContact O-CA 3.22Å; P1433-V1435 PolarHBondContact O-N 3.35Å
1434	L	71.5	Confident	69.8	Low	29 Å²	29	64.7 Å²	64.7	15%	0.152	36%	0.36	C	S	.	.			trans	-83.7	97.1	178	-75.4	166.3	0	0	0	110.9	V1426 N1427 F1429 F1451 L1494	V1426-L1434 HydrophobicContact CB-CD1 4.07Å; V1426-L1434 HydrophobicContact CG1-CD1 3.59Å; N1427-L1434 PolarHBondContact O-N 2.88Å; F1429-L1434 HydrophobicContact CB-CD1 4.39Å; F1429-L1434 HydrophobicContact CB-CD2 3.93Å; F1429-L1434 HydrophobicContact CB-CG 4.14Å; L1434-F1451 HydrophobicContact CD1-CE2 3.79Å; L1434-F1451 HydrophobicContact CD1-CZ 4.28Å; L1434-F1451 HydrophobicContact CD2-CE2 4.18Å; L1434-L1494 HydrophobicContact CB-CD1 4.33Å; L1434-L1494 HydrophobicContact CB-CG 4.27Å; L1434-L1494 HydrophobicContact CD1-CD1 4.35Å; L1434-L1494 HydrophobicContact CD2-CD1 4.25Å
1435	V	64.3	Low	68.8	Low	113 Å²	113	65.5 Å²	65.5	69%	0.685	37%	0.365	S	S	*	.			trans	-80.1	139.1	172.9	-175	0	0	0	0	110	P1433 S1437	P1433-V1435 PolarHBondContact O-N 3.35Å; V1435-S1437 PolarHBondContact O-N 3.05Å
1436	W	67.5	Low	67.5	Low	79 Å²	79	68.7 Å²	68.7	30%	0.299	39%	0.386	S	S	.	.			trans	-61.4	135	174.9	170.9	-99.3	0	0	0	112.1	F1440 T1441 I1480 N1482 L1494	W1436-F1440 HydrophobicContact CE3-CB 4.3Å; W1436-F1440 HydrophobicContact CH2-CB 4.04Å; W1436-F1440 HydrophobicContact CZ3-CB 3.69Å; W1436-T1441 HydrophobicContact CH2-CG2 4.15Å; W1436-T1441 HydrophobicContact CZ2-CG2 4.17Å; W1436-I1480 WeakPolarHBondContact CH2-O 3.39Å; W1436-I1480 HydrophobicContact CZ3-CG2 4.39Å; W1436-I1480 WeakPolarHBondContact CZ3-O 3.49Å; W1436-N1482 HydrophobicContact CB-CB 4.3Å; W1436-N1482 VanDerWaalsContact CB-ND2 3.3Å; W1436-N1482 WeakPolarHBondContact CB-ND2 3.24Å; W1436-N1482 VanDerWaalsContact CD1-ND2 3.32Å; W1436-N1482 HydrophobicContact CD2-CB 3.52Å; W1436-N1482 HydrophobicContact CE3-CB 3.8Å; W1436-N1482 HydrophobicContact CG-CB 3.71Å; W1436-N1482 HydrophobicContact CZ2-CB 4.47Å; W1436-N1482 HydrophobicContact CZ3-CB 4.39Å; W1436-N1482 VanDerWaalsContact CZ3-N 3.28Å; W1436-L1494 HydrophobicContact CE3-CD2 3.74Å; W1436-L1494 HydrophobicContact CZ3-CD2 4.43Å
1437	S	71.2	Confident	66.5	Low	31 Å²	31	76.1 Å²	76.1	22%	0.217	41%	0.414	C	S	.	.			trans	-130.3	144.4	175	172.6	0	0	0	0	109.4	V1435 T1439 F1440	V1435-S1437 PolarHBondContact O-N 3.05Å; S1437-T1439 WeakPolarHBondContact CB-OG1 3.37Å; S1437-T1439 PolarHBondContact O-N 2.78Å; S1437-T1439 VanDerWaalsContact O-N 3.09Å; S1437-T1439 PolarHBondContact OG-N 2.63Å; S1437-T1439 PolarHBondContact OG-OG1 2.64Å; S1437-F1440 PolarHBondContact O-N 2.92Å
1438	S	62.4	Low	66.4	Low	90 Å²	90	75 Å²	75	63%	0.629	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-60.2	-17	171.9	50.6	0	0	0	0	113.1	F1440 T1441	S1438-F1440 PolarHBondContact O-N 2.74Å; S1438-T1441 PolarHBondContact O-N 3.05Å; S1438-T1441 VanDerWaalsContact O-N 3.17Å; S1438-T1441 PolarHBondContact O-OG1 2.7Å
1439	T	63.1	Low	65.9	Low	45 Å²	45	75.5 Å²	75.5	28%	0.276	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-66	-16.6	172.9	59.8	0	0	0	0	113.7	S1437 S1445	S1437-T1439 WeakPolarHBondContact CB-OG1 3.37Å; S1437-T1439 PolarHBondContact O-N 2.78Å; S1437-T1439 VanDerWaalsContact O-N 3.09Å; S1437-T1439 PolarHBondContact OG-N 2.63Å; S1437-T1439 PolarHBondContact OG-OG1 2.64Å; T1439-S1445 VanDerWaalsContact O-CB 3.25Å; T1439-S1445 WeakPolarHBondContact O-CB 3.41Å; T1439-S1445 PolarHBondContact O-OG 3.31Å
1440	F	72.9	Confident	65.6	Low	17 Å²	17	77.6 Å²	77.6	8%	0.075	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-85.8	-13	174.1	-66.7	-64.8	0	0	0	113.5	W1436 S1437 S1438 D1442 F1448 F1451 I1480 L1494	W1436-F1440 HydrophobicContact CE3-CB 4.3Å; W1436-F1440 HydrophobicContact CH2-CB 4.04Å; W1436-F1440 HydrophobicContact CZ3-CB 3.69Å; S1437-F1440 PolarHBondContact O-N 2.92Å; S1438-F1440 PolarHBondContact O-N 2.74Å; F1440-D1442 VanDerWaalsContact C-N 3.3Å; F1440-F1448 WeakPolarHBondContact O-CD2 3.5Å; F1440-F1451 HydrophobicContact CE1-CB 4.23Å; F1440-F1451 HydrophobicContact CE1-CD2 4.31Å; F1440-F1451 HydrophobicContact CE1-CG 4.17Å; F1440-I1480 HydrophobicContact CB-CB 4.2Å; F1440-I1480 HydrophobicContact CB-CG2 3.96Å; F1440-I1480 HydrophobicContact CD1-CD1 4.1Å; F1440-I1480 HydrophobicContact CD1-CG2 4.35Å; F1440-I1480 HydrophobicContact CG-CG2 4.25Å; F1440-L1494 HydrophobicContact CD1-CD1 4.25Å; F1440-L1494 HydrophobicContact CD2-CD1 4.01Å; F1440-L1494 HydrophobicContact CD2-CD2 3.72Å; F1440-L1494 HydrophobicContact CE1-CD1 3.88Å; F1440-L1494 HydrophobicContact CE2-CD1 3.61Å; F1440-L1494 HydrophobicContact CE2-CD2 3.9Å; F1440-L1494 HydrophobicContact CE2-CG 4.42Å; F1440-L1494 HydrophobicContact CG-CD1 4.32Å; F1440-L1494 HydrophobicContact CG-CD2 4.34Å; F1440-L1494 HydrophobicContact CZ-CD1 3.54Å
1441	T	66.6	Low	66.1	Low	103 Å²	103	77.2 Å²	77.2	63%	0.632	42%	0.417	S	S	*	.	S	Bend	trans	-79.1	-10.9	173	3.6	0	0	0	0	113.5	W1436 S1438	W1436-T1441 HydrophobicContact CH2-CG2 4.15Å; W1436-T1441 HydrophobicContact CZ2-CG2 4.17Å; S1438-T1441 PolarHBondContact O-N 3.05Å; S1438-T1441 VanDerWaalsContact O-N 3.17Å; S1438-T1441 PolarHBondContact O-OG1 2.7Å
1442	D	59.1	Low	67	Low	77 Å²	77	68.5 Å²	68.5	41%	0.412	38%	0.379	S	S	.	.			trans	-108.2	112.4	174.2	178.9	10.2	0	0	0	110.1	F1440 K1444 S1445 F1448	F1440-D1442 VanDerWaalsContact C-N 3.3Å; D1442-K1444 PolarHBondContact O-N 2.92Å; D1442-K1444 WeakPolarHBondContact OD1-CB 3.2Å; D1442-K1444 PolarHBondContact OD1-N 2.66Å; D1442-S1445 VanDerWaalsContact O-CB 3.29Å; D1442-S1445 WeakPolarHBondContact O-CB 3.07Å; D1442-S1445 PolarHBondContact O-N 3.12Å; D1442-S1445 VanDerWaalsContact O-N 3.14Å; D1442-F1448 VanDerWaalsContact O-CB 3.27Å; D1442-F1448 WeakPolarHBondContact O-CB 3.39Å
1443	S	60.9	Low	67.7	Low	76 Å²	76	70.5 Å²	70.5	53%	0.531	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-5.5	179.4	55.6	0	0	0	0	114.7	F1448	S1443-F1448 WeakPolarHBondContact O-CD1 3.31Å
1444	K	50.9	Low	68.4	Low	109 Å²	109	68.3 Å²	68.3	47%	0.474	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-6.8	173	-59.6	174.7	-178.3	174	0	113.1	D1442	D1442-K1444 PolarHBondContact O-N 2.92Å; D1442-K1444 WeakPolarHBondContact OD1-CB 3.2Å; D1442-K1444 PolarHBondContact OD1-N 2.66Å
1445	S	61.1	Low	69.2	Low	17 Å²	17	67 Å²	67	12%	0.119	36%	0.359	C	S	.	.	S	Bend	trans	-60.6	136	177.1	-177.9	0	0	0	0	110.5	T1439 D1442 R1447 F1448 M1449	T1439-S1445 VanDerWaalsContact O-CB 3.25Å; T1439-S1445 WeakPolarHBondContact O-CB 3.41Å; T1439-S1445 PolarHBondContact O-OG 3.31Å; D1442-S1445 VanDerWaalsContact O-CB 3.29Å; D1442-S1445 WeakPolarHBondContact O-CB 3.07Å; D1442-S1445 PolarHBondContact O-N 3.12Å; D1442-S1445 VanDerWaalsContact O-N 3.14Å; S1445-R1447 PolarHBondContact O-N 2.84Å; S1445-R1447 PolarHBondContact OG-N 2.91Å; S1445-F1448 WeakPolarHBondContact O-CA 3.38Å; S1445-F1448 WeakPolarHBondContact O-CB 3.15Å; S1445-F1448 PolarHBondContact O-N 3.2Å; S1445-M1449 PolarHBondContact O-N 3.15Å
1446	P	58.5	Low	70.1	Confident	67 Å²	67	62.3 Å²	62.3	44%	0.435	33%	0.331	S	S	.	.	H	α-helix	trans	-53.8	-37.7	171.6	-28.9	36.3	0	0	0	112.6	F1448 M1449 E1450	P1446-F1448 VanDerWaalsContact C-N 3.32Å; P1446-F1448 PolarHBondContact O-N 2.75Å; P1446-M1449 PolarHBondContact O-N 2.62Å; P1446-E1450 VanDerWaalsContact O-CB 3.23Å; P1446-E1450 WeakPolarHBondContact O-CB 3.48Å; P1446-E1450 PolarHBondContact O-N 3.43Å
1447	R	63.1	Low	70.6	Confident	155 Å²	155	63.4 Å²	63.4	59%	0.585	34%	0.339	S	S	*	.	H	α-helix	trans	-68.4	-24	173.7	-82.6	-173.2	172.2	178.1	-1.2	114.3	S1445 F1451	S1445-R1447 PolarHBondContact O-N 2.84Å; S1445-R1447 PolarHBondContact OG-N 2.91Å; R1447-F1451 WeakPolarHBondContact O-CB 3.06Å; R1447-F1451 PolarHBondContact O-N 2.76Å
1448	F	80.1	Confident	71.2	Confident	14 Å²	14	61.9 Å²	61.9	6%	0.061	33%	0.329	C	S	.	.	H	α-helix	trans	-77.1	-47.4	170	-178.4	-78.4	0	0	0	110.1	F1440 D1442 S1443 S1445 P1446 F1451 A1452 V1477 I1480	F1440-F1448 WeakPolarHBondContact O-CD2 3.5Å; D1442-F1448 VanDerWaalsContact O-CB 3.27Å; D1442-F1448 WeakPolarHBondContact O-CB 3.39Å; S1443-F1448 WeakPolarHBondContact O-CD1 3.31Å; S1445-F1448 WeakPolarHBondContact O-CA 3.38Å; S1445-F1448 WeakPolarHBondContact O-CB 3.15Å; S1445-F1448 PolarHBondContact O-N 3.2Å; P1446-F1448 VanDerWaalsContact C-N 3.32Å; P1446-F1448 PolarHBondContact O-N 2.75Å; F1448-F1451 PolarHBondContact O-N 3.41Å; F1448-A1452 HydrophobicContact CD1-CB 4.3Å; F1448-A1452 HydrophobicContact CE1-CB 4.18Å; F1448-A1452 WeakPolarHBondContact O-CB 3.13Å; F1448-A1452 PolarHBondContact O-N 3.29Å; F1448-V1477 HydrophobicContact CZ-CG1 4.09Å; F1448-I1480 HydrophobicContact CD2-CB 4.48Å; F1448-I1480 HydrophobicContact CD2-CD1 3.68Å; F1448-I1480 HydrophobicContact CD2-CG1 4.09Å; F1448-I1480 HydrophobicContact CE2-CB 4.16Å; F1448-I1480 HydrophobicContact CE2-CD1 3.7Å; F1448-I1480 HydrophobicContact CE2-CG1 3.64Å; F1448-I1480 HydrophobicContact CG-CD1 4.39Å; F1448-I1480 HydrophobicContact CZ-CD1 4.41Å; F1448-I1480 HydrophobicContact CZ-CG1 4.36Å
1449	M	68.7	Low	72.3	Confident	94 Å²	94	57.6 Å²	57.6	46%	0.463	30%	0.299	S	S	.	.	H	α-helix	trans	-65.2	-48.5	-177.5	-65	-171.3	-64.6	0	0	112	S1445 P1446 F1451 A1452 D1453	S1445-M1449 PolarHBondContact O-N 3.15Å; P1446-M1449 PolarHBondContact O-N 2.62Å; M1449-F1451 VanDerWaalsContact C-N 3.34Å; M1449-F1451 PolarHBondContact O-N 3.06Å; M1449-A1452 PolarHBondContact O-N 2.8Å; M1449-D1453 WeakPolarHBondContact O-CB 3.2Å; M1449-D1453 PolarHBondContact O-N 2.92Å
1450	E	72.9	Confident	72.8	Confident	122 Å²	122	57.7 Å²	57.7	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-56.8	-46.8	174.9	-176.4	-170.3	-173.6	0	0	111.4	P1446 L1454	P1446-E1450 VanDerWaalsContact O-CB 3.23Å; P1446-E1450 WeakPolarHBondContact O-CB 3.48Å; P1446-E1450 PolarHBondContact O-N 3.43Å; E1450-L1454 HydrophobicContact CG-CD1 4.03Å; E1450-L1454 VanDerWaalsContact O-CB 3.28Å; E1450-L1454 WeakPolarHBondContact O-CB 3.46Å; E1450-L1454 WeakPolarHBondContact O-CD1 3.13Å; E1450-L1454 VanDerWaalsContact O-CG 3.23Å; E1450-L1454 WeakPolarHBondContact O-CG 3.07Å; E1450-L1454 PolarHBondContact O-N 3.29Å
1451	F	84.2	Confident	72.9	Confident	14 Å²	14	58.4 Å²	58.4	6%	0.061	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-36.9	178.3	-174.4	-83.1	0	0	0	112.3	V1426 L1434 F1440 R1447 F1448 M1449 F1455 I1480 L1494 V1496 L1532	V1426-F1451 HydrophobicContact CB-CZ 4.11Å; V1426-F1451 HydrophobicContact CG1-CZ 4.31Å; V1426-F1451 HydrophobicContact CG2-CZ 4.15Å; L1434-F1451 HydrophobicContact CD1-CE2 3.79Å; L1434-F1451 HydrophobicContact CD1-CZ 4.28Å; L1434-F1451 HydrophobicContact CD2-CE2 4.18Å; F1440-F1451 HydrophobicContact CE1-CB 4.23Å; F1440-F1451 HydrophobicContact CE1-CD2 4.31Å; F1440-F1451 HydrophobicContact CE1-CG 4.17Å; R1447-F1451 WeakPolarHBondContact O-CB 3.06Å; R1447-F1451 PolarHBondContact O-N 2.76Å; F1448-F1451 PolarHBondContact O-N 3.41Å; M1449-F1451 VanDerWaalsContact C-N 3.34Å; M1449-F1451 PolarHBondContact O-N 3.06Å; F1451-F1455 WeakPolarHBondContact O-CB 3.05Å; F1451-F1455 PolarHBondContact O-N 3.12Å; F1451-I1480 HydrophobicContact CD1-CD1 3.55Å; F1451-I1480 HydrophobicContact CE1-CD1 3.96Å; F1451-I1480 HydrophobicContact CG-CD1 4.48Å; F1451-L1494 HydrophobicContact CD2-CD1 4.42Å; F1451-L1494 HydrophobicContact CE1-CD1 4.37Å; F1451-L1494 HydrophobicContact CE2-CD1 3.81Å; F1451-L1494 HydrophobicContact CZ-CD1 3.78Å; F1451-V1496 HydrophobicContact CE1-CG2 3.73Å; F1451-V1496 HydrophobicContact CZ-CG2 4.28Å; F1451-L1532 HydrophobicContact CD2-CD2 4Å; F1451-L1532 HydrophobicContact CE2-CD2 3.44Å; F1451-L1532 VanDerWaalsContact CE2-CD2 3.44Å; F1451-L1532 HydrophobicContact CZ-CD2 3.95Å
1452	A	82.1	Confident	73.5	Confident	11 Å²	11	53.7 Å²	53.7	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-70.1	-42.7	178	0	0	0	0	0	112.1	F1448 M1449 F1455 S1456 V1477	F1448-A1452 HydrophobicContact CD1-CB 4.3Å; F1448-A1452 HydrophobicContact CE1-CB 4.18Å; F1448-A1452 WeakPolarHBondContact O-CB 3.13Å; F1448-A1452 PolarHBondContact O-N 3.29Å; M1449-A1452 PolarHBondContact O-N 2.8Å; A1452-F1455 PolarHBondContact O-N 2.76Å; A1452-S1456 WeakPolarHBondContact O-CB 3.42Å; A1452-S1456 PolarHBondContact O-N 3.5Å; A1452-V1477 HydrophobicContact CB-CB 3.97Å; A1452-V1477 HydrophobicContact CB-CG1 4.46Å; A1452-V1477 HydrophobicContact CB-CG2 3.98Å
1453	D	75.2	Confident	74.6	Confident	119 Å²	119	50.2 Å²	50.2	64%	0.636	25%	0.254	S	S	*	.	H	α-helix	trans	-66.2	-43.4	175.6	-76.9	-11.2	0	0	0	110.9	M1449 F1455 H1457	M1449-D1453 WeakPolarHBondContact O-CB 3.2Å; M1449-D1453 PolarHBondContact O-N 2.92Å; D1453-F1455 VanDerWaalsContact C-N 3.34Å; D1453-F1455 PolarHBondContact O-N 2.91Å; D1453-H1457 WeakPolarHBondContact O-CB 3.3Å; D1453-H1457 PolarHBondContact O-N 3.21Å
1454	L	81	Confident	75.2	Confident	53 Å²	53	50.4 Å²	50.4	28%	0.277	25%	0.249	S	C	.	.	H	α-helix	trans	-60	-42.9	171.6	-76.5	166.8	0	0	0	111.7	F1429 E1450 G1458 L1532	F1429-L1454 HydrophobicContact CE2-CD1 3.96Å; F1429-L1454 HydrophobicContact CZ-CD1 4.29Å; E1450-L1454 HydrophobicContact CG-CD1 4.03Å; E1450-L1454 VanDerWaalsContact O-CB 3.28Å; E1450-L1454 WeakPolarHBondContact O-CB 3.46Å; E1450-L1454 WeakPolarHBondContact O-CD1 3.13Å; E1450-L1454 VanDerWaalsContact O-CG 3.23Å; E1450-L1454 WeakPolarHBondContact O-CG 3.07Å; E1450-L1454 PolarHBondContact O-N 3.29Å; L1454-G1458 PolarHBondContact O-N 2.92Å; L1454-L1532 HydrophobicContact CB-CD1 4.06Å
1455	F	87.9	Confident	76.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.2	-50.8	178.5	-177	-85.3	0	0	0	111.4	V1424 V1426 F1451 A1452 D1453 H1457 G1458 I1459 V1477 V1496 A1498 I1527 L1532	V1424-F1455 HydrophobicContact CB-CE2 4.03Å; V1424-F1455 HydrophobicContact CB-CZ 3.83Å; V1424-F1455 HydrophobicContact CG1-CE2 4.05Å; V1424-F1455 HydrophobicContact CG1-CZ 4.24Å; V1424-F1455 HydrophobicContact CG2-CZ 3.96Å; V1426-F1455 HydrophobicContact CG2-CD2 4.04Å; V1426-F1455 HydrophobicContact CG2-CE2 3.88Å; F1451-F1455 WeakPolarHBondContact O-CB 3.05Å; F1451-F1455 PolarHBondContact O-N 3.12Å; A1452-F1455 PolarHBondContact O-N 2.76Å; D1453-F1455 VanDerWaalsContact C-N 3.34Å; D1453-F1455 PolarHBondContact O-N 2.91Å; F1455-H1457 PolarHBondContact O-N 3.04Å; F1455-G1458 PolarHBondContact O-N 3.24Å; F1455-I1459 HydrophobicContact CD1-CG1 4Å; F1455-I1459 HydrophobicContact CE1-CD1 4.23Å; F1455-I1459 HydrophobicContact CE1-CG1 3.65Å; F1455-I1459 HydrophobicContact CZ-CD1 4.16Å; F1455-I1459 HydrophobicContact CZ-CG1 4.06Å; F1455-I1459 WeakPolarHBondContact O-CG1 2.96Å; F1455-I1459 PolarHBondContact O-N 3.45Å; F1455-V1477 HydrophobicContact CB-CG2 4.34Å; F1455-V1477 HydrophobicContact CD1-CG2 3.62Å; F1455-V1477 HydrophobicContact CE1-CG2 4.32Å; F1455-V1477 HydrophobicContact CG-CG2 4.25Å; F1455-V1496 HydrophobicContact CD1-CG1 4.16Å; F1455-V1496 HydrophobicContact CD2-CB 4.49Å; F1455-V1496 HydrophobicContact CD2-CG1 4.2Å; F1455-V1496 HydrophobicContact CD2-CG2 4.26Å; F1455-V1496 HydrophobicContact CE1-CG1 3.98Å; F1455-V1496 HydrophobicContact CE2-CB 4.04Å; F1455-V1496 HydrophobicContact CE2-CG1 4.02Å; F1455-V1496 HydrophobicContact CE2-CG2 4.12Å; F1455-V1496 HydrophobicContact CG-CG1 4.27Å; F1455-V1496 HydrophobicContact CZ-CB 4.18Å; F1455-V1496 HydrophobicContact CZ-CG1 3.91Å; F1455-A1498 HydrophobicContact CD1-CB 4.49Å; F1455-A1498 HydrophobicContact CE1-CB 3.69Å; F1455-A1498 HydrophobicContact CZ-CB 4.44Å; F1455-I1527 HydrophobicContact CD2-CD1 4.28Å; F1455-I1527 HydrophobicContact CE2-CD1 4.07Å; F1455-L1532 HydrophobicContact CB-CD1 4.06Å; F1455-L1532 HydrophobicContact CD2-CD1 4.46Å
1456	S	83.1	Confident	76.9	Confident	16 Å²	16	52.4 Å²	52.4	11%	0.112	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-42.9	177.6	-77.9	0	0	0	0	112	A1452 G1458 I1459 N1460 T1475	A1452-S1456 WeakPolarHBondContact O-CB 3.42Å; A1452-S1456 PolarHBondContact O-N 3.5Å; S1456-G1458 VanDerWaalsContact C-N 3.32Å; S1456-G1458 PolarHBondContact O-N 3.24Å; S1456-I1459 PolarHBondContact O-N 3.47Å; S1456-N1460 VanDerWaalsContact O-CG 3.3Å; S1456-N1460 PolarHBondContact O-N 3.02Å; S1456-N1460 PolarHBondContact O-OD1 3.36Å; S1456-N1460 VanDerWaalsContact O-OD1 3.06Å; S1456-T1475 WeakPolarHBondContact CB-O 3.4Å; S1456-T1475 PolarHBondContact OG-O 2.58Å
1457	H	78.1	Confident	77.4	Confident	101 Å²	101	53.5 Å²	53.5	47%	0.468	27%	0.266	S	S	.	.	H	α-helix	trans	-63.8	-37.6	175.5	-167.7	85.8	0	0	0	112.3	D1453 F1455 N1460 Q1461	D1453-H1457 WeakPolarHBondContact O-CB 3.3Å; D1453-H1457 PolarHBondContact O-N 3.21Å; F1455-H1457 PolarHBondContact O-N 3.04Å; H1457-N1460 PolarHBondContact O-N 2.82Å; H1457-Q1461 PolarHBondContact CD2-NE2 3.01Å; H1457-Q1461 PolarHBondContact NE2-NE2 3.13Å; H1457-Q1461 WeakPolarHBondContact O-CG 3.31Å; H1457-Q1461 PolarHBondContact O-N 2.7Å
1458	G	82.4	Confident	78	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-37.8	173.1	0	0	0	0	0	113.1	L1454 F1455 S1456 A1462 G1528	L1454-G1458 PolarHBondContact O-N 2.92Å; F1455-G1458 PolarHBondContact O-N 3.24Å; S1456-G1458 VanDerWaalsContact C-N 3.32Å; S1456-G1458 PolarHBondContact O-N 3.24Å; G1458-A1462 WeakPolarHBondContact O-CB 3.21Å; G1458-A1462 PolarHBondContact O-N 3.37Å; G1458-G1528 WeakPolarHBondContact O-CA 3.43Å; G1458-G1528 PolarHBondContact O-N 3.02Å
1459	I	86.4	Confident	77.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.7	-41.9	174.7	-67.2	-64.7	0	0	0	111.1	F1455 S1456 Q1461 A1462 I1463 T1475 L1516 I1527	F1455-I1459 HydrophobicContact CD1-CG1 4Å; F1455-I1459 HydrophobicContact CE1-CD1 4.23Å; F1455-I1459 HydrophobicContact CE1-CG1 3.65Å; F1455-I1459 HydrophobicContact CZ-CD1 4.16Å; F1455-I1459 HydrophobicContact CZ-CG1 4.06Å; F1455-I1459 WeakPolarHBondContact O-CG1 2.96Å; F1455-I1459 PolarHBondContact O-N 3.45Å; S1456-I1459 PolarHBondContact O-N 3.47Å; I1459-Q1461 PolarHBondContact O-N 2.03Å; I1459-A1462 PolarHBondContact O-N 3.43Å; I1459-A1462 VanDerWaalsContact O-N 3.16Å; I1459-I1463 HydrophobicContact CG2-CD1 3.61Å; I1459-I1463 HydrophobicContact CG2-CG1 4.29Å; I1459-I1463 WeakPolarHBondContact O-CG1 3.27Å; I1459-I1463 PolarHBondContact O-N 2.72Å; I1459-T1475 HydrophobicContact CB-CG2 4.34Å; I1459-T1475 HydrophobicContact CG2-CG2 4.05Å; I1459-L1516 HydrophobicContact CD1-CD1 4.1Å; I1459-L1516 HydrophobicContact CD1-CD2 4.15Å; I1459-I1527 HydrophobicContact CD1-CG2 4Å; I1459-I1527 HydrophobicContact CG1-CG2 4.36Å
1460	N	73.2	Confident	77.3	Confident	46 Å²	46	50.9 Å²	50.9	25%	0.246	27%	0.267	C	S	.	.	H	α-helix	trans	-51.3	-59.4	172.9	-65.9	1	0	0	0	110.3	S1456 H1457 A1462 I1463 D1464 Y1472	S1456-N1460 VanDerWaalsContact O-CG 3.3Å; S1456-N1460 PolarHBondContact O-N 3.02Å; S1456-N1460 PolarHBondContact O-OD1 3.36Å; S1456-N1460 VanDerWaalsContact O-OD1 3.06Å; H1457-N1460 PolarHBondContact O-N 2.82Å; N1460-A1462 PolarHBondContact O-N 3.04Å; N1460-A1462 VanDerWaalsContact O-N 3.12Å; N1460-I1463 CarbonylContact O-C 3.58Å; N1460-I1463 WeakPolarHBondContact O-CA 3.17Å; N1460-I1463 PolarHBondContact O-N 3.14Å; N1460-D1464 PolarHBondContact O-N 2.9Å; N1460-D1464 VanDerWaalsContact O-OD1 3.09Å; N1460-Y1472 HydrophobicContact CB-CE1 4.29Å; N1460-Y1472 WeakPolarHBondContact OD1-CE1 3.08Å; N1460-Y1472 PolarHBondContact OD1-OH 2.83Å
1461	Q	74.7	Confident	77.5	Confident	33 Å²	33	48.9 Å²	48.9	15%	0.154	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-19.6	-178.8	-65.6	176.5	-19.8	0	0	115.1	H1457 I1459 D1464 T1529	H1457-Q1461 PolarHBondContact CD2-NE2 3.01Å; H1457-Q1461 PolarHBondContact NE2-NE2 3.13Å; H1457-Q1461 WeakPolarHBondContact O-CG 3.31Å; H1457-Q1461 PolarHBondContact O-N 2.7Å; I1459-Q1461 PolarHBondContact O-N 2.03Å; Q1461-D1464 WeakPolarHBondContact CA-OD2 3.29Å; Q1461-T1529 PolarHBondContact NE2-OG1 2.89Å; Q1461-T1529 VanDerWaalsContact NE2-OG1 3.16Å; Q1461-T1529 PolarHBondContact OE1-OG1 3.39Å
1462	A	79.6	Confident	77.2	Confident	3 Å²	3	49.7 Å²	49.7	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-81.2	-33.1	171.9	0	0	0	0	0	111.5	G1458 I1459 N1460 T1466 L1516 S1519	G1458-A1462 WeakPolarHBondContact O-CB 3.21Å; G1458-A1462 PolarHBondContact O-N 3.37Å; I1459-A1462 PolarHBondContact O-N 3.43Å; I1459-A1462 VanDerWaalsContact O-N 3.16Å; N1460-A1462 PolarHBondContact O-N 3.04Å; N1460-A1462 VanDerWaalsContact O-N 3.12Å; A1462-T1466 WeakPolarHBondContact O-CG2 3.18Å; A1462-L1516 HydrophobicContact CB-CD1 3.93Å; A1462-S1519 WeakPolarHBondContact O-CB 2.94Å; A1462-S1519 PolarHBondContact O-OG 2.97Å
1463	I	83.1	Confident	76.9	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-79.8	-36.7	177.1	-66.7	171.2	0	0	0	111.6	I1459 N1460 K1465 T1466 I1468 Y1472 V1500 L1516	I1459-I1463 HydrophobicContact CG2-CD1 3.61Å; I1459-I1463 HydrophobicContact CG2-CG1 4.29Å; I1459-I1463 WeakPolarHBondContact O-CG1 3.27Å; I1459-I1463 PolarHBondContact O-N 2.72Å; N1460-I1463 CarbonylContact O-C 3.58Å; N1460-I1463 WeakPolarHBondContact O-CA 3.17Å; N1460-I1463 PolarHBondContact O-N 3.14Å; I1463-K1465 PolarHBondContact O-N 2.79Å; I1463-T1466 WeakPolarHBondContact O-CB 2.84Å; I1463-T1466 PolarHBondContact O-N 3.18Å; I1463-T1466 PolarHBondContact O-OG1 2.85Å; I1463-I1468 HydrophobicContact CG2-CB 4.23Å; I1463-I1468 HydrophobicContact CG2-CG2 4.25Å; I1463-Y1472 HydrophobicContact CB-CD1 4.43Å; I1463-Y1472 HydrophobicContact CB-CG 4.49Å; I1463-Y1472 HydrophobicContact CD1-CD2 3.8Å; I1463-Y1472 HydrophobicContact CD1-CE1 4.46Å; I1463-Y1472 HydrophobicContact CD1-CE2 3.73Å; I1463-Y1472 HydrophobicContact CD1-CG 4.23Å; I1463-Y1472 HydrophobicContact CG2-CD1 4Å; I1463-Y1472 HydrophobicContact CG2-CD2 4.29Å; I1463-Y1472 HydrophobicContact CG2-CG 3.74Å; I1463-V1500 HydrophobicContact CD1-CG1 4.25Å; I1463-L1516 HydrophobicContact CG1-CD1 4.28Å
1464	D	71.8	Confident	77	Confident	80 Å²	80	47.4 Å²	47.4	43%	0.428	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-18.9	175.4	-62.6	-15.2	0	0	0	113.8	N1460 Q1461	N1460-D1464 PolarHBondContact O-N 2.9Å; N1460-D1464 VanDerWaalsContact O-OD1 3.09Å; Q1461-D1464 WeakPolarHBondContact CA-OD2 3.29Å
1465	K	70.6	Confident	76.9	Confident	148 Å²	148	45 Å²	45	64%	0.643	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	9.9	-179.2	-65.2	170.5	-172.5	159.7	0	113.3	I1463	I1463-K1465 PolarHBondContact O-N 2.79Å
1466	T	77.7	Confident	76.3	Confident	19 Å²	19	47.6 Å²	47.6	12%	0.117	25%	0.25	C	S	.	.	S	Bend	trans	-119	164.4	-178.6	70.3	0	0	0	0	111	A1462 I1463 I1468 E1469 E1515	A1462-T1466 WeakPolarHBondContact O-CG2 3.18Å; I1463-T1466 WeakPolarHBondContact O-CB 2.84Å; I1463-T1466 PolarHBondContact O-N 3.18Å; I1463-T1466 PolarHBondContact O-OG1 2.85Å; T1466-I1468 PolarHBondContact O-N 2.69Å; T1466-I1468 WeakPolarHBondContact OG1-CB 3.46Å; T1466-I1468 PolarHBondContact OG1-N 2.85Å; T1466-E1469 PolarHBondContact O-N 2.03Å; T1466-E1515 HydrophobicContact CG2-CG 4.1Å
1467	S	70	Confident	76.2	Confident	90 Å²	90	48 Å²	48	63%	0.629	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	5.4	170.9	53.8	0	0	0	0	114.6
1468	I	76.2	Confident	76	Confident	12 Å²	12	45.8 Å²	45.8	6%	0.062	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-19.2	-179.8	-55.7	174.1	0	0	0	111.4	I1463 T1466 P1470 F1471 Y1472 I1502 I1512 E1515	I1463-I1468 HydrophobicContact CG2-CB 4.23Å; I1463-I1468 HydrophobicContact CG2-CG2 4.25Å; T1466-I1468 PolarHBondContact O-N 2.69Å; T1466-I1468 WeakPolarHBondContact OG1-CB 3.46Å; T1466-I1468 PolarHBondContact OG1-N 2.85Å; I1468-P1470 VanDerWaalsContact C-N 3.33Å; I1468-P1470 VanDerWaalsContact O-N 3.15Å; I1468-F1471 CarbonylContact O-C 3.44Å; I1468-F1471 WeakPolarHBondContact O-CA 3.19Å; I1468-F1471 PolarHBondContact O-N 3.34Å; I1468-Y1472 PolarHBondContact O-N 3.46Å; I1468-I1502 HydrophobicContact CG2-CG2 4.48Å; I1468-I1512 HydrophobicContact CD1-CB 4.26Å; I1468-I1512 HydrophobicContact CD1-CG1 4.18Å; I1468-I1512 HydrophobicContact CD1-CG2 4.33Å; I1468-E1515 HydrophobicContact CD1-CB 3.77Å
1469	E	68.6	Low	75.6	Confident	111 Å²	111	49.7 Å²	49.7	52%	0.519	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-41.1	-49.8	174.9	175.9	-151.8	-158.4	0	0	113.4	T1466 F1471 Y1472	T1466-E1469 PolarHBondContact O-N 2.03Å; E1469-F1471 PolarHBondContact O-N 3.02Å; E1469-Y1472 PolarHBondContact O-N 3.16Å; E1469-Y1472 VanDerWaalsContact O-N 3.09Å
1470	P	65.4	Low	75.4	Confident	85 Å²	85	50 Å²	50	55%	0.552	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-68.5	-9.5	-176.6	-18.5	33.9	0	0	0	114.7	I1468	I1468-P1470 VanDerWaalsContact C-N 3.33Å; I1468-P1470 VanDerWaalsContact O-N 3.15Å
1471	F	76.3	Confident	75.6	Confident	80 Å²	80	50.3 Å²	50.3	35%	0.351	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-114.2	-5.4	179.1	-49.8	-65.5	0	0	0	112.6	I1468 E1469 I1502 L1503 S1506	I1468-F1471 CarbonylContact O-C 3.44Å; I1468-F1471 WeakPolarHBondContact O-CA 3.19Å; I1468-F1471 PolarHBondContact O-N 3.34Å; E1469-F1471 PolarHBondContact O-N 3.02Å; F1471-I1502 CarbonylContact O-C 3.37Å; F1471-I1502 WeakPolarHBondContact O-CA 3.01Å; F1471-L1503 HydrophobicContact CB-CB 4.46Å; F1471-L1503 PolarHBondContact O-N 3.39Å; F1471-S1506 VanDerWaalsContact CD1-CB 3.41Å; F1471-S1506 VanDerWaalsContact CG-CB 3.46Å
1472	Y	77.7	Confident	75.5	Confident	32 Å²	32	50.6 Å²	50.6	13%	0.125	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	146.8	-178.1	-178	-125.3	0	0	0	111.4	N1460 I1463 I1468 E1469 D1474 T1475 V1500	N1460-Y1472 HydrophobicContact CB-CE1 4.29Å; N1460-Y1472 WeakPolarHBondContact OD1-CE1 3.08Å; N1460-Y1472 PolarHBondContact OD1-OH 2.83Å; I1463-Y1472 HydrophobicContact CB-CD1 4.43Å; I1463-Y1472 HydrophobicContact CB-CG 4.49Å; I1463-Y1472 HydrophobicContact CD1-CD2 3.8Å; I1463-Y1472 HydrophobicContact CD1-CE1 4.46Å; I1463-Y1472 HydrophobicContact CD1-CE2 3.73Å; I1463-Y1472 HydrophobicContact CD1-CG 4.23Å; I1463-Y1472 HydrophobicContact CG2-CD1 4Å; I1463-Y1472 HydrophobicContact CG2-CD2 4.29Å; I1463-Y1472 HydrophobicContact CG2-CG 3.74Å; I1468-Y1472 PolarHBondContact O-N 3.46Å; E1469-Y1472 PolarHBondContact O-N 3.16Å; E1469-Y1472 VanDerWaalsContact O-N 3.09Å; Y1472-D1474 WeakPolarHBondContact CE2-O 3.36Å; Y1472-T1475 WeakPolarHBondContact CE2-OG1 3.47Å; Y1472-T1475 WeakPolarHBondContact OH-CB 3.15Å; Y1472-T1475 PolarHBondContact OH-N 2.82Å; Y1472-T1475 PolarHBondContact OH-OG1 3.15Å; Y1472-V1500 HydrophobicContact CD2-CG1 4.05Å; Y1472-V1500 HydrophobicContact CE2-CG1 3.84Å
1473	V	76.6	Confident	74.9	Confident	11 Å²	11	50.5 Å²	50.5	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	-54.1	-179	-174	0	0	0	0	112.2	V1417 N1501 L1503	V1417-V1473 HydrophobicContact CG1-CB 4.21Å; V1417-V1473 HydrophobicContact CG1-CG1 4.27Å; V1417-V1473 HydrophobicContact CG1-CG2 3.76Å; V1473-N1501 HydrophobicContact CB-CB 4.39Å; V1473-N1501 PolarHBondContact N-O 3.33Å; V1473-L1503 HydrophobicContact CG2-CD2 3.92Å; V1473-L1503 HydrophobicContact CG2-CG 4.17Å
1474	D	75.8	Confident	74.1	Confident	70 Å²	70	54.7 Å²	54.7	37%	0.374	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	160.5	179.8	-173.4	26.8	0	0	0	111.9	Y1472 N1501	Y1472-D1474 WeakPolarHBondContact CE2-O 3.36Å; D1474-N1501 PolarHBondContact O-N 3.07Å
1475	T	80.8	Confident	73.6	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.018	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130.2	174.6	-68.4	0	0	0	0	111.1	S1456 I1459 Y1472 A1498 K1499 V1500	S1456-T1475 WeakPolarHBondContact CB-O 3.4Å; S1456-T1475 PolarHBondContact OG-O 2.58Å; I1459-T1475 HydrophobicContact CB-CG2 4.34Å; I1459-T1475 HydrophobicContact CG2-CG2 4.05Å; Y1472-T1475 WeakPolarHBondContact CE2-OG1 3.47Å; Y1472-T1475 WeakPolarHBondContact OH-CB 3.15Å; Y1472-T1475 PolarHBondContact OH-N 2.82Å; Y1472-T1475 PolarHBondContact OH-OG1 3.15Å; T1475-A1498 HydrophobicContact CG2-CB 4.27Å; T1475-K1499 WeakPolarHBondContact CA-O 3.11Å; T1475-V1500 HydrophobicContact CG2-CG2 4.31Å
1476	T	73.7	Confident	73.2	Confident	55 Å²	55	55.6 Å²	55.6	34%	0.337	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.5	-177.4	50.2	0	0	0	0	111.3	K1499	T1476-K1499 PolarHBondContact N-O 2.88Å; T1476-K1499 PolarHBondContact O-N 2.85Å; T1476-K1499 WeakPolarHBondContact OG1-CB 3.36Å; T1476-K1499 PolarHBondContact OG1-O 3.47Å
1477	V	81.9	Confident	72.1	Confident	25 Å²	25	56.8 Å²	56.8	15%	0.152	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	131.4	174	178.9	0	0	0	0	109.7	F1448 A1452 F1455 I1480 V1496 A1498	F1448-V1477 HydrophobicContact CZ-CG1 4.09Å; A1452-V1477 HydrophobicContact CB-CB 3.97Å; A1452-V1477 HydrophobicContact CB-CG1 4.46Å; A1452-V1477 HydrophobicContact CB-CG2 3.98Å; F1455-V1477 HydrophobicContact CB-CG2 4.34Å; F1455-V1477 HydrophobicContact CD1-CG2 3.62Å; F1455-V1477 HydrophobicContact CE1-CG2 4.32Å; F1455-V1477 HydrophobicContact CG-CG2 4.25Å; V1477-I1480 HydrophobicContact CG1-CG1 4.14Å; V1477-V1496 HydrophobicContact CG1-CG1 3.7Å; V1477-V1496 HydrophobicContact CG2-CG1 4.09Å; V1477-A1498 HydrophobicContact CG2-CB 4.45Å
1478	T	74.5	Confident	71.7	Confident	53 Å²	53	60.8 Å²	60.8	33%	0.325	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-41.4	178.1	40.5	0	0	0	0	113.8	E1497 K1499	T1478-E1497 PolarHBondContact N-O 2.93Å; T1478-E1497 PolarHBondContact OG1-O 2.84Å; T1478-K1499 HydrophobicContact CG2-CD 3.54Å; T1478-K1499 HydrophobicContact CG2-CG 3.94Å
1479	E	73.3	Confident	70.6	Confident	83 Å²	83	69.3 Å²	69.3	39%	0.388	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	157.9	179.8	50.7	-178.6	162.3	0	0	111.6	K1481 E1497	E1479-K1481 VanDerWaalsContact OE1-CE 3.31Å; E1479-K1481 WeakPolarHBondContact OE1-CE 3.26Å; E1479-K1481 IonicContact OE1-NZ 2.99Å; E1479-K1481 PolarHBondContact OE1-NZ 2.87Å; E1479-K1481 WeakPolarHBondContact OE2-CE 3.28Å; E1479-K1481 IonicContact OE2-NZ 3.53Å; E1479-K1481 PolarHBondContact OE2-NZ 3.11Å; E1479-E1497 HydrophobicContact CG-CB 4.12Å; E1479-E1497 PolarHBondContact N-O 2.04Å; E1479-E1497 PolarHBondContact O-N 2.86Å
1480	I	82.1	Confident	70.5	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.7	179.4	-57	174.7	0	0	0	108.3	W1436 F1440 F1448 F1451 V1477 L1494 L1495 V1496	W1436-I1480 WeakPolarHBondContact CH2-O 3.39Å; W1436-I1480 HydrophobicContact CZ3-CG2 4.39Å; W1436-I1480 WeakPolarHBondContact CZ3-O 3.49Å; F1440-I1480 HydrophobicContact CB-CB 4.2Å; F1440-I1480 HydrophobicContact CB-CG2 3.96Å; F1440-I1480 HydrophobicContact CD1-CD1 4.1Å; F1440-I1480 HydrophobicContact CD1-CG2 4.35Å; F1440-I1480 HydrophobicContact CG-CG2 4.25Å; F1448-I1480 HydrophobicContact CD2-CB 4.48Å; F1448-I1480 HydrophobicContact CD2-CD1 3.68Å; F1448-I1480 HydrophobicContact CD2-CG1 4.09Å; F1448-I1480 HydrophobicContact CE2-CB 4.16Å; F1448-I1480 HydrophobicContact CE2-CD1 3.7Å; F1448-I1480 HydrophobicContact CE2-CG1 3.64Å; F1448-I1480 HydrophobicContact CG-CD1 4.39Å; F1448-I1480 HydrophobicContact CZ-CD1 4.41Å; F1448-I1480 HydrophobicContact CZ-CG1 4.36Å; F1451-I1480 HydrophobicContact CD1-CD1 3.55Å; F1451-I1480 HydrophobicContact CE1-CD1 3.96Å; F1451-I1480 HydrophobicContact CG-CD1 4.48Å; V1477-I1480 HydrophobicContact CG1-CG1 4.14Å; I1480-L1494 HydrophobicContact CG2-CB 3.81Å; I1480-L1494 HydrophobicContact CG2-CD1 4.37Å; I1480-L1494 HydrophobicContact CG2-CD2 4.38Å; I1480-L1494 HydrophobicContact CG2-CG 4.41Å; I1480-L1495 CarbonylContact C-O 3.31Å; I1480-L1495 WeakPolarHBondContact CA-O 3.23Å; I1480-V1496 HydrophobicContact CG1-CG1 4.39Å; I1480-V1496 HydrophobicContact CG1-CG2 4.44Å
1481	K	76.8	Confident	70.7	Confident	53 Å²	53	63 Å²	63	23%	0.23	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	155	-173.9	-64.3	171.2	-176.4	158.1	0	111.8	E1479 S1483 V1486 L1495 E1497	E1479-K1481 VanDerWaalsContact OE1-CE 3.31Å; E1479-K1481 WeakPolarHBondContact OE1-CE 3.26Å; E1479-K1481 IonicContact OE1-NZ 2.99Å; E1479-K1481 PolarHBondContact OE1-NZ 2.87Å; E1479-K1481 WeakPolarHBondContact OE2-CE 3.28Å; E1479-K1481 IonicContact OE2-NZ 3.53Å; E1479-K1481 PolarHBondContact OE2-NZ 3.11Å; K1481-S1483 PolarHBondContact O-N 3.1Å; K1481-V1486 HydrophobicContact CB-CG2 3.72Å; K1481-V1486 HydrophobicContact CD-CG2 3.89Å; K1481-V1486 HydrophobicContact CG-CG2 4.27Å; K1481-L1495 HydrophobicContact CB-CB 4.28Å; K1481-L1495 HydrophobicContact CB-CD2 4.42Å; K1481-L1495 PolarHBondContact N-O 3.09Å; K1481-L1495 PolarHBondContact O-N 2.86Å; K1481-E1497 IonicContact NZ-OE1 2.7Å; K1481-E1497 PolarHBondContact NZ-OE1 3.45Å; K1481-E1497 IonicContact NZ-OE2 3.26Å
1482	N	73.2	Confident	70.3	Confident	39 Å²	39	65.4 Å²	65.4	21%	0.209	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	116.9	168	-177.5	-50.6	0	0	0	109.5	W1436 K1484 H1485 V1486	W1436-N1482 HydrophobicContact CB-CB 4.3Å; W1436-N1482 VanDerWaalsContact CB-ND2 3.3Å; W1436-N1482 WeakPolarHBondContact CB-ND2 3.24Å; W1436-N1482 VanDerWaalsContact CD1-ND2 3.32Å; W1436-N1482 HydrophobicContact CD2-CB 3.52Å; W1436-N1482 HydrophobicContact CE3-CB 3.8Å; W1436-N1482 HydrophobicContact CG-CB 3.71Å; W1436-N1482 HydrophobicContact CZ2-CB 4.47Å; W1436-N1482 HydrophobicContact CZ3-CB 4.39Å; W1436-N1482 VanDerWaalsContact CZ3-N 3.28Å; N1482-K1484 PolarHBondContact O-N 2.83Å; N1482-K1484 PolarHBondContact OD1-N 3.16Å; N1482-K1484 VanDerWaalsContact OD1-N 3.13Å; N1482-H1485 HydrophobicContact CB-CB 3.75Å; N1482-H1485 PolarHBondContact O-N 2.98Å; N1482-H1485 PolarHBondContact OD1-N 3.26Å; N1482-V1486 WeakPolarHBondContact O-CG2 3.1Å; N1482-V1486 PolarHBondContact O-N 3.27Å
1483	S	67.9	Low	70.3	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.007	32%	0.321	C	S	.	.	H	α-helix	trans	-57	-53	-176.1	64.8	0	0	0	0	112.5	K1481 H1485 V1486 N1487 P1491 G1493	K1481-S1483 PolarHBondContact O-N 3.1Å; S1483-H1485 VanDerWaalsContact C-N 3.34Å; S1483-H1485 PolarHBondContact O-N 3.46Å; S1483-V1486 PolarHBondContact O-N 3.31Å; S1483-N1487 PolarHBondContact O-N 3.15Å; S1483-N1487 VanDerWaalsContact O-O 3.09Å; S1483-P1491 VanDerWaalsContact CB-O 3.29Å; S1483-P1491 WeakPolarHBondContact CB-O 3.05Å; S1483-P1491 PolarHBondContact OG-O 3.4Å; S1483-G1493 PolarHBondContact OG-N 2.84Å; S1483-G1493 PolarHBondContact OG-O 3Å
1484	K	66.1	Low	70.7	Confident	93 Å²	93	63.7 Å²	63.7	40%	0.404	32%	0.318	S	S	.	.	H	α-helix	trans	-65.8	-30.2	179.8	-86	-168.6	172.5	175.5	0	113.9	N1482 N1487 Q1488 E1492	N1482-K1484 PolarHBondContact O-N 2.83Å; N1482-K1484 PolarHBondContact OD1-N 3.16Å; N1482-K1484 VanDerWaalsContact OD1-N 3.13Å; K1484-N1487 CarbonylContact O-C 3.45Å; K1484-Q1488 WeakPolarHBondContact O-CA 3.03Å; K1484-Q1488 PolarHBondContact O-N 2.57Å; K1484-E1492 HydrophobicContact CD-CG 3.78Å; K1484-E1492 VanDerWaalsContact CE-CG 3.43Å; K1484-E1492 WeakPolarHBondContact CE-OE1 3.45Å; K1484-E1492 HydrophobicContact CG-CG 4.33Å; K1484-E1492 IonicContact NZ-OE1 2.65Å; K1484-E1492 PolarHBondContact NZ-OE1 2.95Å
1485	H	60.1	Low	71	Confident	165 Å²	165	60.8 Å²	60.8	76%	0.764	30%	0.302	S	S	*	.	H	α-helix	trans	-76.6	-33.2	177.8	-162.3	-58.4	0	0	0	112.4	N1482 S1483	N1482-H1485 HydrophobicContact CB-CB 3.75Å; N1482-H1485 PolarHBondContact O-N 2.98Å; N1482-H1485 PolarHBondContact OD1-N 3.26Å; S1483-H1485 VanDerWaalsContact C-N 3.34Å; S1483-H1485 PolarHBondContact O-N 3.46Å
1486	V	62.1	Low	71.2	Confident	83 Å²	83	60.7 Å²	60.7	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-71.4	-42.4	172.4	173.2	0	0	0	0	110.5	K1481 N1482 S1483 L1495	K1481-V1486 HydrophobicContact CB-CG2 3.72Å; K1481-V1486 HydrophobicContact CD-CG2 3.89Å; K1481-V1486 HydrophobicContact CG-CG2 4.27Å; N1482-V1486 WeakPolarHBondContact O-CG2 3.1Å; N1482-V1486 PolarHBondContact O-N 3.27Å; S1483-V1486 PolarHBondContact O-N 3.31Å; V1486-L1495 HydrophobicContact CB-CD2 4.41Å; V1486-L1495 HydrophobicContact CG1-CD2 4.23Å; V1486-L1495 HydrophobicContact CG2-CD2 4.43Å
1487	N	54.7	Low	71.5	Confident	43 Å²	43	60.3 Å²	60.3	23%	0.23	30%	0.296	C	S	.	.			trans	-156.1	117.2	177.1	172.2	11.6	0	0	0	110	S1483 K1484 K1489 L1490	S1483-N1487 PolarHBondContact O-N 3.15Å; S1483-N1487 VanDerWaalsContact O-O 3.09Å; K1484-N1487 CarbonylContact O-C 3.45Å; N1487-K1489 PolarHBondContact O-N 3.3Å; N1487-K1489 WeakPolarHBondContact OD1-CB 3.45Å; N1487-K1489 PolarHBondContact OD1-N 2.91Å; N1487-L1490 HydrophobicContact CB-CD1 4.04Å; N1487-L1490 HydrophobicContact CB-CG 4.04Å; N1487-L1490 PolarHBondContact O-N 2.8Å
1488	Q	61.5	Low	71.6	Confident	174 Å²	174	59.1 Å²	59.1	81%	0.813	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-12.5	-179.1	-66.1	-179.5	-7.1	0	0	114.6	K1484	K1484-Q1488 WeakPolarHBondContact O-CA 3.03Å; K1484-Q1488 PolarHBondContact O-N 2.57Å
1489	K	53.6	Low	71.8	Confident	192 Å²	192	60.7 Å²	60.7	84%	0.835	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-6.7	174	-60.5	-172.2	176.3	-173.2	0	114.8	N1487	N1487-K1489 PolarHBondContact O-N 3.3Å; N1487-K1489 WeakPolarHBondContact OD1-CB 3.45Å; N1487-K1489 PolarHBondContact OD1-N 2.91Å
1490	L	66.5	Low	72.2	Confident	29 Å²	29	56.8 Å²	56.8	15%	0.152	27%	0.273	C	S	.	.	S	Bend	trans	-80.1	144.7	175	-67.4	174	0	0	0	110.6	N1487 L1495 Y1538	N1487-L1490 HydrophobicContact CB-CD1 4.04Å; N1487-L1490 HydrophobicContact CB-CG 4.04Å; N1487-L1490 PolarHBondContact O-N 2.8Å; L1490-L1495 HydrophobicContact CD1-CD2 4.1Å; L1490-Y1538 HydrophobicContact CD2-CD2 4.25Å; L1490-Y1538 HydrophobicContact CD2-CE2 3.6Å
1491	P	69.4	Low	71.9	Confident	34 Å²	34	57.8 Å²	57.8	22%	0.221	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-66.6	155.3	175.5	26.8	-31.6	0	0	0	111.3	V1425 S1483 G1493 P1535 Y1538	V1425-P1491 HydrophobicContact CG1-CG 4.39Å; S1483-P1491 VanDerWaalsContact CB-O 3.29Å; S1483-P1491 WeakPolarHBondContact CB-O 3.05Å; S1483-P1491 PolarHBondContact OG-O 3.4Å; P1491-G1493 PolarHBondContact O-N 3.38Å; P1491-P1535 HydrophobicContact CB-CB 4.29Å; P1491-P1535 HydrophobicContact CB-CG 4.17Å; P1491-P1535 HydrophobicContact CG-CB 4.25Å; P1491-P1535 HydrophobicContact CG-CG 3.69Å; P1491-Y1538 HydrophobicContact CG-CD2 4.28Å; P1491-Y1538 HydrophobicContact CG-CG 4.42Å
1492	E	67.2	Low	72	Confident	131 Å²	131	55.5 Å²	55.5	61%	0.612	27%	0.268	S	S	*	.	S	Bend	trans	-64.9	135	-178.2	-64.6	-170	153.6	0	0	112	N1427 K1484	N1427-E1492 VanDerWaalsContact CB-O 3.29Å; N1427-E1492 WeakPolarHBondContact CB-O 3.31Å; K1484-E1492 HydrophobicContact CD-CG 3.78Å; K1484-E1492 VanDerWaalsContact CE-CG 3.43Å; K1484-E1492 WeakPolarHBondContact CE-OE1 3.45Å; K1484-E1492 HydrophobicContact CG-CG 4.33Å; K1484-E1492 IonicContact NZ-OE1 2.65Å; K1484-E1492 PolarHBondContact NZ-OE1 2.95Å
1493	G	77.9	Confident	72	Confident	7 Å²	7	56.3 Å²	56.3	7%	0.072	27%	0.272	C	S	.	.	S	Bend	trans	151.3	-167.6	-176.3	0	0	0	0	0	111.8	V1426 S1483 P1491	V1426-G1493 CarbonylContact O-C 3.59Å; V1426-G1493 VanDerWaalsContact O-CA 3.28Å; V1426-G1493 WeakPolarHBondContact O-CA 3.1Å; S1483-G1493 PolarHBondContact OG-N 2.84Å; S1483-G1493 PolarHBondContact OG-O 3Å; P1491-G1493 PolarHBondContact O-N 3.38Å
1494	L	85	Confident	72	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.8	177.4	-56	178.7	0	0	0	109	V1425 V1426 L1434 W1436 F1440 F1451 I1480 V1496	V1425-L1494 CarbonylContact C-O 3.56Å; V1425-L1494 VanDerWaalsContact CA-O 3.32Å; V1425-L1494 WeakPolarHBondContact CA-O 3.04Å; V1426-L1494 PolarHBondContact N-O 3.31Å; V1426-L1494 PolarHBondContact O-N 2.95Å; L1434-L1494 HydrophobicContact CB-CD1 4.33Å; L1434-L1494 HydrophobicContact CB-CG 4.27Å; L1434-L1494 HydrophobicContact CD1-CD1 4.35Å; L1434-L1494 HydrophobicContact CD2-CD1 4.25Å; W1436-L1494 HydrophobicContact CE3-CD2 3.74Å; W1436-L1494 HydrophobicContact CZ3-CD2 4.43Å; F1440-L1494 HydrophobicContact CD1-CD1 4.25Å; F1440-L1494 HydrophobicContact CD2-CD1 4.01Å; F1440-L1494 HydrophobicContact CD2-CD2 3.72Å; F1440-L1494 HydrophobicContact CE1-CD1 3.88Å; F1440-L1494 HydrophobicContact CE2-CD1 3.61Å; F1440-L1494 HydrophobicContact CE2-CD2 3.9Å; F1440-L1494 HydrophobicContact CE2-CG 4.42Å; F1440-L1494 HydrophobicContact CG-CD1 4.32Å; F1440-L1494 HydrophobicContact CG-CD2 4.34Å; F1440-L1494 HydrophobicContact CZ-CD1 3.54Å; F1451-L1494 HydrophobicContact CD2-CD1 4.42Å; F1451-L1494 HydrophobicContact CE1-CD1 4.37Å; F1451-L1494 HydrophobicContact CE2-CD1 3.81Å; F1451-L1494 HydrophobicContact CZ-CD1 3.78Å; I1480-L1494 HydrophobicContact CG2-CB 3.81Å; I1480-L1494 HydrophobicContact CG2-CD1 4.37Å; I1480-L1494 HydrophobicContact CG2-CD2 4.38Å; I1480-L1494 HydrophobicContact CG2-CG 4.41Å; L1494-V1496 PolarHBondContact O-N 3.34Å
1495	L	83.1	Confident	71.7	Confident	9 Å²	9	62.9 Å²	62.9	5%	0.047	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	104.5	171.9	175.8	67.4	0	0	0	108.5	P1423 V1425 I1480 K1481 V1486 L1490	P1423-L1495 HydrophobicContact CB-CD1 4.08Å; V1425-L1495 HydrophobicContact CG2-CB 4.44Å; V1425-L1495 HydrophobicContact CG2-CD1 3.77Å; I1480-L1495 CarbonylContact C-O 3.31Å; I1480-L1495 WeakPolarHBondContact CA-O 3.23Å; K1481-L1495 HydrophobicContact CB-CB 4.28Å; K1481-L1495 HydrophobicContact CB-CD2 4.42Å; K1481-L1495 PolarHBondContact N-O 3.09Å; K1481-L1495 PolarHBondContact O-N 2.86Å; V1486-L1495 HydrophobicContact CB-CD2 4.41Å; V1486-L1495 HydrophobicContact CG1-CD2 4.23Å; V1486-L1495 HydrophobicContact CG2-CD2 4.43Å; L1490-L1495 HydrophobicContact CD1-CD2 4.1Å
1496	V	85.2	Confident	71.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.1	179.7	-171.5	0	0	0	0	108.8	P1423 V1424 V1426 F1451 F1455 V1477 I1480 L1494	P1423-V1496 CarbonylContact C-O 3.48Å; P1423-V1496 WeakPolarHBondContact CA-O 3.08Å; V1424-V1496 PolarHBondContact N-O 3.14Å; V1424-V1496 WeakPolarHBondContact O-CB 3.42Å; V1424-V1496 PolarHBondContact O-N 2.84Å; V1426-V1496 HydrophobicContact CG2-CG2 3.91Å; F1451-V1496 HydrophobicContact CE1-CG2 3.73Å; F1451-V1496 HydrophobicContact CZ-CG2 4.28Å; F1455-V1496 HydrophobicContact CD1-CG1 4.16Å; F1455-V1496 HydrophobicContact CD2-CB 4.49Å; F1455-V1496 HydrophobicContact CD2-CG1 4.2Å; F1455-V1496 HydrophobicContact CD2-CG2 4.26Å; F1455-V1496 HydrophobicContact CE1-CG1 3.98Å; F1455-V1496 HydrophobicContact CE2-CB 4.04Å; F1455-V1496 HydrophobicContact CE2-CG1 4.02Å; F1455-V1496 HydrophobicContact CE2-CG2 4.12Å; F1455-V1496 HydrophobicContact CG-CG1 4.27Å; F1455-V1496 HydrophobicContact CZ-CB 4.18Å; F1455-V1496 HydrophobicContact CZ-CG1 3.91Å; V1477-V1496 HydrophobicContact CG1-CG1 3.7Å; V1477-V1496 HydrophobicContact CG2-CG1 4.09Å; I1480-V1496 HydrophobicContact CG1-CG1 4.39Å; I1480-V1496 HydrophobicContact CG1-CG2 4.44Å; L1494-V1496 PolarHBondContact O-N 3.34Å
1497	E	80	Confident	71.4	Confident	47 Å²	47	54.6 Å²	54.6	22%	0.22	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	122.4	166.9	-68.7	-174.7	-138	0	0	108.8	P1423 T1478 E1479 K1481	P1423-E1497 HydrophobicContact CB-CG 4.46Å; T1478-E1497 PolarHBondContact N-O 2.93Å; T1478-E1497 PolarHBondContact OG1-O 2.84Å; E1479-E1497 HydrophobicContact CG-CB 4.12Å; E1479-E1497 PolarHBondContact N-O 2.04Å; E1479-E1497 PolarHBondContact O-N 2.86Å; K1481-E1497 IonicContact NZ-OE1 2.7Å; K1481-E1497 PolarHBondContact NZ-OE1 3.45Å; K1481-E1497 IonicContact NZ-OE2 3.26Å
1498	A	83.6	Confident	71.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.5	-176.4	0	0	0	0	0	112.3	V1421 I1422 F1455 T1475 V1477	V1421-A1498 CarbonylContact C-O 3.48Å; V1421-A1498 WeakPolarHBondContact CA-O 3.38Å; I1422-A1498 HydrophobicContact CG1-CB 4.34Å; I1422-A1498 PolarHBondContact N-O 2.99Å; I1422-A1498 PolarHBondContact O-N 2.92Å; F1455-A1498 HydrophobicContact CD1-CB 4.49Å; F1455-A1498 HydrophobicContact CE1-CB 3.69Å; F1455-A1498 HydrophobicContact CZ-CB 4.44Å; T1475-A1498 HydrophobicContact CG2-CB 4.27Å; V1477-A1498 HydrophobicContact CG2-CB 4.45Å
1499	K	78.6	Confident	72.1	Confident	86 Å²	86	52.7 Å²	52.7	37%	0.374	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	107.8	178.2	-81.3	173.9	-178.9	160	0	110.4	T1419 V1420 V1421 T1475 T1476 T1478	T1419-K1499 HydrophobicContact CG2-CB 3.65Å; T1419-K1499 HydrophobicContact CG2-CD 4.01Å; T1419-K1499 HydrophobicContact CG2-CG 3.73Å; V1420-K1499 CarbonylContact O-C 3.44Å; V1420-K1499 WeakPolarHBondContact O-CA 3.02Å; V1421-K1499 HydrophobicContact CG2-CG 3.92Å; T1475-K1499 WeakPolarHBondContact CA-O 3.11Å; T1476-K1499 PolarHBondContact N-O 2.88Å; T1476-K1499 PolarHBondContact O-N 2.85Å; T1476-K1499 WeakPolarHBondContact OG1-CB 3.36Å; T1476-K1499 PolarHBondContact OG1-O 3.47Å; T1478-K1499 HydrophobicContact CG2-CD 3.54Å; T1478-K1499 HydrophobicContact CG2-CG 3.94Å
1500	V	81	Confident	72.6	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.3	172.2	-176.7	0	0	0	0	108.4	T1419 V1420 I1422 I1463 Y1472 T1475 I1502	T1419-V1500 WeakPolarHBondContact CA-O 3.03Å; V1420-V1500 PolarHBondContact N-O 2.76Å; V1420-V1500 PolarHBondContact O-N 2.83Å; I1422-V1500 HydrophobicContact CD1-CG2 3.69Å; I1422-V1500 HydrophobicContact CG1-CG2 4.06Å; I1463-V1500 HydrophobicContact CD1-CG1 4.25Å; Y1472-V1500 HydrophobicContact CD2-CG1 4.05Å; Y1472-V1500 HydrophobicContact CE2-CG1 3.84Å; T1475-V1500 HydrophobicContact CG2-CG2 4.31Å; V1500-I1502 HydrophobicContact CG1-CG2 4.3Å
1501	N	77.2	Confident	72.7	Confident	27 Å²	27	53.4 Å²	53.4	14%	0.144	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.7	175.1	-63.5	-57.3	0	0	0	110	V1417 T1419 V1473 D1474	V1417-N1501 HydrophobicContact CB-CB 4.43Å; V1417-N1501 HydrophobicContact CG2-CB 4.4Å; T1419-N1501 WeakPolarHBondContact CB-OD1 3.49Å; T1419-N1501 WeakPolarHBondContact CG2-OD1 3Å; T1419-N1501 PolarHBondContact OG1-OD1 2.79Å; V1473-N1501 HydrophobicContact CB-CB 4.39Å; V1473-N1501 PolarHBondContact N-O 3.33Å; D1474-N1501 PolarHBondContact O-N 3.07Å
1502	I	79	Confident	72.7	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	153	179.1	51.5	150.3	0	0	0	111.8	V1417 D1418 I1468 F1471 V1500 R1504 S1506 I1512	V1417-I1502 CarbonylContact C-O 3.59Å; V1417-I1502 WeakPolarHBondContact CA-O 3.26Å; V1417-I1502 VanDerWaalsContact CB-O 3.25Å; V1417-I1502 WeakPolarHBondContact CB-O 3.46Å; D1418-I1502 PolarHBondContact N-O 2.8Å; D1418-I1502 WeakPolarHBondContact O-CG1 3.43Å; D1418-I1502 PolarHBondContact O-N 2.03Å; I1468-I1502 HydrophobicContact CG2-CG2 4.48Å; F1471-I1502 CarbonylContact O-C 3.37Å; F1471-I1502 WeakPolarHBondContact O-CA 3.01Å; V1500-I1502 HydrophobicContact CG1-CG2 4.3Å; I1502-R1504 PolarHBondContact O-N 3.4Å; I1502-S1506 WeakPolarHBondContact CD1-OG 3.32Å; I1502-I1512 HydrophobicContact CD1-CD1 3.58Å; I1502-I1512 HydrophobicContact CG1-CD1 4.4Å
1503	L	72.7	Confident	73	Confident	56 Å²	56	46 Å²	46	29%	0.293	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	135.7	172.9	-68.5	-176.5	0	0	0	111.1	V1415 F1471 V1473 G1505 S1506	V1415-L1503 HydrophobicContact CB-CD2 4.1Å; V1415-L1503 HydrophobicContact CG2-CD2 3.65Å; F1471-L1503 HydrophobicContact CB-CB 4.46Å; F1471-L1503 PolarHBondContact O-N 3.39Å; V1473-L1503 HydrophobicContact CG2-CD2 3.92Å; V1473-L1503 HydrophobicContact CG2-CG 4.17Å; L1503-G1505 PolarHBondContact O-N 2.85Å; L1503-S1506 VanDerWaalsContact O-CB 3.28Å; L1503-S1506 WeakPolarHBondContact O-CB 3.23Å; L1503-S1506 PolarHBondContact O-N 3.26Å; L1503-S1506 PolarHBondContact O-OG 2.74Å
1504	R	68.3	Low	72.9	Confident	160 Å²	160	50.2 Å²	50.2	60%	0.604	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	127.7	-167.6	-139.7	177.9	-166.1	163.1	9.7	113.8	A1416 D1418 I1502 S1506	A1416-R1504 HydrophobicContact CB-CB 4.31Å; A1416-R1504 PolarHBondContact O-N 2.98Å; A1416-R1504 VanDerWaalsContact O-N 3.16Å; D1418-R1504 VanDerWaalsContact OD1-CG 3.3Å; D1418-R1504 WeakPolarHBondContact OD1-CG 3.41Å; D1418-R1504 IonicContact OD1-CZ 3.77Å; D1418-R1504 IonicContact OD1-NE 3.12Å; D1418-R1504 PolarHBondContact OD1-NE 2.9Å; D1418-R1504 IonicContact OD1-NH2 3.9Å; D1418-R1504 PolarHBondContact OD1-NH2 3.37Å; D1418-R1504 WeakPolarHBondContact OD2-CA 3.38Å; D1418-R1504 WeakPolarHBondContact OD2-CG 3.32Å; I1502-R1504 PolarHBondContact O-N 3.4Å; R1504-S1506 VanDerWaalsContact C-N 3.34Å; R1504-S1506 PolarHBondContact O-N 2.86Å
1505	G	60.1	Low	72.6	Confident	73 Å²	73	52.8 Å²	52.8	75%	0.753	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	20.9	177.1	0	0	0	0	0	116.2	D1418 L1503	D1418-G1505 PolarHBondContact OD2-N 2.03Å; D1418-G1505 VanDerWaalsContact OD2-N 3.09Å; L1503-G1505 PolarHBondContact O-N 2.85Å
1506	S	56.8	Low	72.5	Confident	36 Å²	36	52.6 Å²	52.6	25%	0.252	27%	0.274	S	S	.	.	S	Bend	trans	-79	-43.7	-177	51.8	0	0	0	0	115.4	F1471 I1502 L1503 R1504	F1471-S1506 VanDerWaalsContact CD1-CB 3.41Å; F1471-S1506 VanDerWaalsContact CG-CB 3.46Å; I1502-S1506 WeakPolarHBondContact CD1-OG 3.32Å; L1503-S1506 VanDerWaalsContact O-CB 3.28Å; L1503-S1506 WeakPolarHBondContact O-CB 3.23Å; L1503-S1506 PolarHBondContact O-N 3.26Å; L1503-S1506 PolarHBondContact O-OG 2.74Å; R1504-S1506 VanDerWaalsContact C-N 3.34Å; R1504-S1506 PolarHBondContact O-N 2.86Å
1507	S	58.4	Low	72.2	Confident	38 Å²	38	54.4 Å²	54.4	27%	0.266	28%	0.283	S	S	.	.	S	Bend	trans	-157.4	165.8	-174.3	54.6	0	0	0	0	111.9	I1512	S1507-I1512 WeakPolarHBondContact OG-CG1 3.43Å
1508	S	66.1	Low	72.1	Confident	60 Å²	60	57.1 Å²	57.1	42%	0.42	29%	0.294	S	S	.	.			trans	-92	150.9	-175.6	68.1	0	0	0	0	113.9	E1510 E1511 I1512	S1508-E1510 VanDerWaalsContact C-N 3.29Å; S1508-E1510 PolarHBondContact O-N 3.01Å; S1508-E1511 PolarHBondContact N-OE2 3.23Å; S1508-E1511 WeakPolarHBondContact O-CB 3.15Å; S1508-E1511 PolarHBondContact O-N 2.83Å; S1508-E1511 WeakPolarHBondContact OG-CB 3.34Å; S1508-E1511 PolarHBondContact OG-OE2 2.58Å; S1508-I1512 WeakPolarHBondContact O-CG1 3.18Å; S1508-I1512 PolarHBondContact O-N 2.93Å
1509	Q	64	Low	71.9	Confident	117 Å²	117	58 Å²	58	55%	0.547	30%	0.299	S	S	.	.	H	α-helix	trans	-56.3	-38.1	-177.2	172.5	165.8	15.9	0	0	113.7	V1420 V1421 E1511 C1513	V1420-Q1509 HydrophobicContact CG1-CB 4.24Å; V1420-Q1509 HydrophobicContact CG1-CG 3.67Å; V1421-Q1509 PolarHBondContact O-NE2 3.17Å; Q1509-E1511 VanDerWaalsContact C-N 3.32Å; Q1509-C1513 WeakPolarHBondContact O-CB 3.03Å; Q1509-C1513 PolarHBondContact O-N 3.13Å; Q1509-C1513 VanDerWaalsContact O-N 3.09Å
1510	E	64.5	Low	72.1	Confident	129 Å²	129	54 Å²	54	60%	0.603	28%	0.282	S	S	*	.	H	α-helix	trans	-68.9	-31.7	176.2	-71.4	-161	177	0	0	113.2	S1508 C1513 K1514	S1508-E1510 VanDerWaalsContact C-N 3.29Å; S1508-E1510 PolarHBondContact O-N 3.01Å; E1510-C1513 PolarHBondContact O-N 3.14Å; E1510-K1514 WeakPolarHBondContact O-CB 3.04Å; E1510-K1514 VanDerWaalsContact O-CD 3.25Å; E1510-K1514 WeakPolarHBondContact O-CD 3.42Å; E1510-K1514 WeakPolarHBondContact O-CG 3.27Å; E1510-K1514 PolarHBondContact O-N 3.33Å; E1510-K1514 IonicContact OE2-NZ 3.65Å; E1510-K1514 PolarHBondContact OE2-NZ 2.87Å
1511	E	68	Low	71.9	Confident	106 Å²	106	59.2 Å²	59.2	50%	0.495	31%	0.306	S	S	.	.	H	α-helix	trans	-76.5	-39.2	-175.6	-168.9	163.8	-139.2	0	0	110.3	S1508 Q1509 K1514 E1515	S1508-E1511 PolarHBondContact N-OE2 3.23Å; S1508-E1511 WeakPolarHBondContact O-CB 3.15Å; S1508-E1511 PolarHBondContact O-N 2.83Å; S1508-E1511 WeakPolarHBondContact OG-CB 3.34Å; S1508-E1511 PolarHBondContact OG-OE2 2.58Å; Q1509-E1511 VanDerWaalsContact C-N 3.32Å; E1511-K1514 PolarHBondContact O-N 2.7Å; E1511-E1515 PolarHBondContact O-N 3.16Å
1512	I	70.6	Confident	71.7	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.015	34%	0.34	C	S	.	.	H	α-helix	trans	-62.1	-44.8	168.1	-58.4	158.2	0	0	0	110.9	V1420 I1468 I1502 S1507 S1508 K1514 L1516	V1420-I1512 HydrophobicContact CG2-CD1 3.96Å; I1468-I1512 HydrophobicContact CD1-CB 4.26Å; I1468-I1512 HydrophobicContact CD1-CG1 4.18Å; I1468-I1512 HydrophobicContact CD1-CG2 4.33Å; I1502-I1512 HydrophobicContact CD1-CD1 3.58Å; I1502-I1512 HydrophobicContact CG1-CD1 4.4Å; S1507-I1512 WeakPolarHBondContact OG-CG1 3.43Å; S1508-I1512 WeakPolarHBondContact O-CG1 3.18Å; S1508-I1512 PolarHBondContact O-N 2.93Å; I1512-K1514 PolarHBondContact O-N 2.84Å; I1512-L1516 WeakPolarHBondContact O-CB 3Å; I1512-L1516 PolarHBondContact O-N 3.46Å
1513	C	73.2	Confident	71.5	Confident	8 Å²	8	69.1 Å²	69.1	5%	0.054	36%	0.357	C	S	.	.	H	α-helix	trans	-58.5	-47.8	176.1	-157.8	0	0	0	0	111	Q1509 E1510 E1517 C1541	Q1509-C1513 WeakPolarHBondContact O-CB 3.03Å; Q1509-C1513 PolarHBondContact O-N 3.13Å; Q1509-C1513 VanDerWaalsContact O-N 3.09Å; E1510-C1513 PolarHBondContact O-N 3.14Å; C1513-E1517 VanDerWaalsContact O-CB 3.25Å; C1513-E1517 WeakPolarHBondContact O-CB 3.25Å; C1513-E1517 PolarHBondContact O-N 2.99Å; C1513-C1541 HydrophobicContact CB-CB 4.31Å; C1513-C1541 WeakPolarHBondContact CB-SG 3.33Å; C1513-C1541 WeakPolarHBondContact SG-CB 3.42Å; C1513-C1541 CovalentContact SG-SG 2.05Å; C1513-C1541 PolarHBondContact SG-SG 3.15Å
1514	K	76.8	Confident	71.6	Confident	95 Å²	95	68.7 Å²	68.7	41%	0.413	37%	0.366	S	S	.	.	H	α-helix	trans	-68.2	-40.4	-177.7	-71.6	160.1	-163.8	163.4	0	113.9	E1510 E1511 I1512 E1517 K1518	E1510-K1514 WeakPolarHBondContact O-CB 3.04Å; E1510-K1514 VanDerWaalsContact O-CD 3.25Å; E1510-K1514 WeakPolarHBondContact O-CD 3.42Å; E1510-K1514 WeakPolarHBondContact O-CG 3.27Å; E1510-K1514 PolarHBondContact O-N 3.33Å; E1510-K1514 IonicContact OE2-NZ 3.65Å; E1510-K1514 PolarHBondContact OE2-NZ 2.87Å; E1511-K1514 PolarHBondContact O-N 2.7Å; I1512-K1514 PolarHBondContact O-N 2.84Å; K1514-E1517 PolarHBondContact O-N 2.77Å; K1514-K1518 WeakPolarHBondContact O-CG 3.46Å; K1514-K1518 PolarHBondContact O-N 3.31Å; K1514-K1518 VanDerWaalsContact O-N 3.07Å
1515	E	77.1	Confident	72.3	Confident	54 Å²	54	63 Å²	63	25%	0.252	35%	0.346	S	S	.	.	H	α-helix	trans	-74.8	-33	-178.7	-143.6	63.3	-150.2	0	0	112.1	T1466 I1468 E1511 K1518 S1519	T1466-E1515 HydrophobicContact CG2-CG 4.1Å; I1468-E1515 HydrophobicContact CD1-CB 3.77Å; E1511-E1515 PolarHBondContact O-N 3.16Å; E1515-K1518 VanDerWaalsContact CD-NZ 3.26Å; E1515-K1518 WeakPolarHBondContact OE1-CD 3.4Å; E1515-K1518 IonicContact OE1-NZ 2.71Å; E1515-K1518 PolarHBondContact OE1-NZ 3.18Å; E1515-K1518 VanDerWaalsContact OE1-NZ 3.12Å; E1515-K1518 IonicContact OE2-NZ 2.73Å; E1515-K1518 PolarHBondContact OE2-NZ 3.24Å; E1515-S1519 WeakPolarHBondContact O-CB 3.1Å; E1515-S1519 PolarHBondContact O-N 3.36Å
1516	L	82.5	Confident	73.2	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-44.1	170.4	-178.7	63.8	0	0	0	111.7	I1422 I1459 A1462 I1463 I1512 K1518 S1519 I1520	I1422-L1516 HydrophobicContact CD1-CD2 3.47Å; I1422-L1516 VanDerWaalsContact CD1-CD2 3.47Å; I1459-L1516 HydrophobicContact CD1-CD1 4.1Å; I1459-L1516 HydrophobicContact CD1-CD2 4.15Å; A1462-L1516 HydrophobicContact CB-CD1 3.93Å; I1463-L1516 HydrophobicContact CG1-CD1 4.28Å; I1512-L1516 WeakPolarHBondContact O-CB 3Å; I1512-L1516 PolarHBondContact O-N 3.46Å; L1516-K1518 PolarHBondContact O-N 3.02Å; L1516-S1519 PolarHBondContact O-N 3.38Å; L1516-S1519 VanDerWaalsContact O-N 3.13Å; L1516-I1520 HydrophobicContact CD1-CD1 4.03Å; L1516-I1520 HydrophobicContact CD1-CG1 4.41Å; L1516-I1520 HydrophobicContact CG-CD1 3.99Å; L1516-I1520 WeakPolarHBondContact O-CG1 3.43Å; L1516-I1520 PolarHBondContact O-N 3.39Å
1517	E	78.5	Confident	74.4	Confident	38 Å²	38	60 Å²	60	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-56.5	-50	176.2	-164.9	166.1	-123.4	0	0	110.4	C1513 K1514 S1519 I1520 E1521 S1539 I1540	C1513-E1517 VanDerWaalsContact O-CB 3.25Å; C1513-E1517 WeakPolarHBondContact O-CB 3.25Å; C1513-E1517 PolarHBondContact O-N 2.99Å; K1514-E1517 PolarHBondContact O-N 2.77Å; E1517-S1519 PolarHBondContact O-N 2.98Å; E1517-I1520 PolarHBondContact O-N 2.85Å; E1517-E1521 WeakPolarHBondContact O-CG 3.12Å; E1517-E1521 PolarHBondContact O-N 2.9Å; E1517-S1539 WeakPolarHBondContact OE1-CA 3.46Å; E1517-S1539 VanDerWaalsContact OE1-CB 3.25Å; E1517-S1539 WeakPolarHBondContact OE1-CB 3.47Å; E1517-S1539 PolarHBondContact OE1-OG 3.43Å; E1517-I1540 PolarHBondContact OE1-N 2.7Å
1518	K	76.7	Confident	75.2	Confident	104 Å²	104	58.8 Å²	58.8	45%	0.452	30%	0.301	S	S	.	.	H	α-helix	trans	-58.4	-39.9	172.5	-69.5	170	-171.8	167.1	0	114.1	K1514 E1515 L1516 K1522	K1514-K1518 WeakPolarHBondContact O-CG 3.46Å; K1514-K1518 PolarHBondContact O-N 3.31Å; K1514-K1518 VanDerWaalsContact O-N 3.07Å; E1515-K1518 VanDerWaalsContact CD-NZ 3.26Å; E1515-K1518 WeakPolarHBondContact OE1-CD 3.4Å; E1515-K1518 IonicContact OE1-NZ 2.71Å; E1515-K1518 PolarHBondContact OE1-NZ 3.18Å; E1515-K1518 VanDerWaalsContact OE1-NZ 3.12Å; E1515-K1518 IonicContact OE2-NZ 2.73Å; E1515-K1518 PolarHBondContact OE2-NZ 3.24Å; L1516-K1518 PolarHBondContact O-N 3.02Å; K1518-K1522 WeakPolarHBondContact O-CB 3.41Å; K1518-K1522 PolarHBondContact O-N 2.89Å
1519	S	80	Confident	75.5	Confident	17 Å²	17	60 Å²	60	12%	0.119	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-42.5	-177.8	-165.3	0	0	0	0	110.8	A1462 E1515 L1516 E1517 A1523	A1462-S1519 WeakPolarHBondContact O-CB 2.94Å; A1462-S1519 PolarHBondContact O-OG 2.97Å; E1515-S1519 WeakPolarHBondContact O-CB 3.1Å; E1515-S1519 PolarHBondContact O-N 3.36Å; L1516-S1519 PolarHBondContact O-N 3.38Å; L1516-S1519 VanDerWaalsContact O-N 3.13Å; E1517-S1519 PolarHBondContact O-N 2.98Å; S1519-A1523 WeakPolarHBondContact O-CB 3.48Å; S1519-A1523 PolarHBondContact O-N 3.02Å; S1519-A1523 VanDerWaalsContact O-N 3.12Å
1520	I	82.2	Confident	76.3	Confident	3 Å²	3	55 Å²	55	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-68.8	-43.6	175.7	-66.3	169.7	0	0	0	111.1	L1516 E1517 K1522 A1523 G1524 H1525 T1534 I1540	L1516-I1520 HydrophobicContact CD1-CD1 4.03Å; L1516-I1520 HydrophobicContact CD1-CG1 4.41Å; L1516-I1520 HydrophobicContact CG-CD1 3.99Å; L1516-I1520 WeakPolarHBondContact O-CG1 3.43Å; L1516-I1520 PolarHBondContact O-N 3.39Å; E1517-I1520 PolarHBondContact O-N 2.85Å; I1520-K1522 PolarHBondContact O-N 3.16Å; I1520-A1523 PolarHBondContact O-N 3.32Å; I1520-G1524 PolarHBondContact O-N 3.42Å; I1520-H1525 VanDerWaalsContact O-CA 3.25Å; I1520-H1525 WeakPolarHBondContact O-CA 3.18Å; I1520-H1525 PolarHBondContact O-N 3.24Å; I1520-T1534 HydrophobicContact CG2-CG2 4.19Å; I1520-I1540 HydrophobicContact CD1-CD1 4.41Å
1521	E	76.5	Confident	76.9	Confident	110 Å²	110	52.6 Å²	52.6	51%	0.514	28%	0.275	S	S	.	.	H	α-helix	trans	-55.9	-49.8	172.4	-76.6	179.1	163.9	0	0	111.7	E1517 A1523 G1524	E1517-E1521 WeakPolarHBondContact O-CG 3.12Å; E1517-E1521 PolarHBondContact O-N 2.9Å; E1521-A1523 PolarHBondContact O-N 2.72Å; E1521-G1524 PolarHBondContact O-N 3.27Å
1522	K	73.5	Confident	77.7	Confident	193 Å²	193	47.5 Å²	47.5	84%	0.839	25%	0.251	S	S	*	.	H	α-helix	trans	-64.3	-23.1	-180	-172.7	179.4	177.5	-173.2	0	113.2	K1518 I1520 G1524	K1518-K1522 WeakPolarHBondContact O-CB 3.41Å; K1518-K1522 PolarHBondContact O-N 2.89Å; I1520-K1522 PolarHBondContact O-N 3.16Å; K1522-G1524 VanDerWaalsContact C-N 3.31Å
1523	A	75.8	Confident	78.2	Confident	46 Å²	46	50.1 Å²	50.1	38%	0.38	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	4.1	172.2	0	0	0	0	0	113.8	S1519 I1520 E1521 K1526	S1519-A1523 WeakPolarHBondContact O-CB 3.48Å; S1519-A1523 PolarHBondContact O-N 3.02Å; S1519-A1523 VanDerWaalsContact O-N 3.12Å; I1520-A1523 PolarHBondContact O-N 3.32Å; E1521-A1523 PolarHBondContact O-N 2.72Å; A1523-K1526 HydrophobicContact CB-CB 4.35Å; A1523-K1526 WeakPolarHBondContact CB-O 2.96Å; A1523-K1526 WeakPolarHBondContact O-CB 3.43Å
1524	G	74.4	Confident	78.7	Confident	47 Å²	47	50 Å²	50	49%	0.485	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	40.5	-176.8	0	0	0	0	0	112.6	I1520 E1521 K1522 K1526	I1520-G1524 PolarHBondContact O-N 3.42Å; E1521-G1524 PolarHBondContact O-N 3.27Å; K1522-G1524 VanDerWaalsContact C-N 3.31Å; G1524-K1526 PolarHBondContact O-N 2.92Å
1525	H	82.5	Confident	78.8	Confident	40 Å²	40	45.8 Å²	45.8	19%	0.185	24%	0.242	C	C	.	.	S	Bend	trans	59.9	17.3	-172.2	-58	-83.5	0	0	0	114.8	I1520 Y1533 T1534	I1520-H1525 VanDerWaalsContact O-CA 3.25Å; I1520-H1525 WeakPolarHBondContact O-CA 3.18Å; I1520-H1525 PolarHBondContact O-N 3.24Å; H1525-Y1533 CarbonylContact O-C 3.46Å; H1525-Y1533 VanDerWaalsContact O-CA 3.25Å; H1525-Y1533 WeakPolarHBondContact O-CA 3.34Å; H1525-T1534 PolarHBondContact O-N 3.14Å
1526	K	78.8	Confident	78.4	Confident	47 Å²	47	50.2 Å²	50.2	20%	0.204	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-88.3	135.2	174.6	-166.7	172.5	-175.6	170.6	0	110.7	A1523 G1524 G1528 T1529 T1530 N1531 Y1533	A1523-K1526 HydrophobicContact CB-CB 4.35Å; A1523-K1526 WeakPolarHBondContact CB-O 2.96Å; A1523-K1526 WeakPolarHBondContact O-CB 3.43Å; G1524-K1526 PolarHBondContact O-N 2.92Å; K1526-G1528 PolarHBondContact O-N 2.87Å; K1526-T1529 VanDerWaalsContact CE-O 3.23Å; K1526-T1529 WeakPolarHBondContact CE-O 3.4Å; K1526-T1529 PolarHBondContact NZ-O 3.18Å; K1526-T1530 VanDerWaalsContact CE-C 3.5Å; K1526-T1530 WeakPolarHBondContact CE-O 3.14Å; K1526-T1530 VanDerWaalsContact CG-O 3.32Å; K1526-T1530 WeakPolarHBondContact CG-O 3.26Å; K1526-N1531 PolarHBondContact NZ-OD1 3.31Å; K1526-N1531 VanDerWaalsContact NZ-OD1 3.14Å; K1526-Y1533 HydrophobicContact CB-CD1 3.96Å; K1526-Y1533 HydrophobicContact CB-CE1 3.71Å; K1526-Y1533 HydrophobicContact CD-CE1 4.16Å; K1526-Y1533 HydrophobicContact CG-CD1 4.33Å; K1526-Y1533 HydrophobicContact CG-CE1 3.91Å
1527	I	82.4	Confident	77.4	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.			trans	-87.1	97.6	-179.3	-49.9	-178.5	0	0	0	109.5	V1426 F1455 I1459 T1530 L1532 T1534	V1426-I1527 HydrophobicContact CG1-CD1 4.48Å; V1426-I1527 HydrophobicContact CG2-CD1 4.04Å; F1455-I1527 HydrophobicContact CD2-CD1 4.28Å; F1455-I1527 HydrophobicContact CE2-CD1 4.07Å; I1459-I1527 HydrophobicContact CD1-CG2 4Å; I1459-I1527 HydrophobicContact CG1-CG2 4.36Å; I1527-T1530 PolarHBondContact O-N 2.95Å; I1527-T1530 PolarHBondContact O-OG1 2.03Å; I1527-L1532 HydrophobicContact CB-CB 4.22Å; I1527-L1532 HydrophobicContact CD1-CB 4.05Å; I1527-L1532 HydrophobicContact CG1-CB 4.28Å; I1527-L1532 PolarHBondContact N-O 2.77Å; I1527-T1534 HydrophobicContact CD1-CG2 3.88Å; I1527-T1534 HydrophobicContact CG1-CG2 4.06Å
1528	G	75.5	Confident	77.1	Confident	12 Å²	12	55 Å²	55	12%	0.124	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-137.6	-176.6	0	0	0	0	0	112.1	G1458 K1526	G1458-G1528 WeakPolarHBondContact O-CA 3.43Å; G1458-G1528 PolarHBondContact O-N 3.02Å; K1526-G1528 PolarHBondContact O-N 2.87Å
1529	T	72.5	Confident	76.8	Confident	85 Å²	85	52.9 Å²	52.9	52%	0.521	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-11.4	167	73.6	0	0	0	0	112.4	Q1461 K1526	Q1461-T1529 PolarHBondContact NE2-OG1 2.89Å; Q1461-T1529 VanDerWaalsContact NE2-OG1 3.16Å; Q1461-T1529 PolarHBondContact OE1-OG1 3.39Å; K1526-T1529 VanDerWaalsContact CE-O 3.23Å; K1526-T1529 WeakPolarHBondContact CE-O 3.4Å; K1526-T1529 PolarHBondContact NZ-O 3.18Å
1530	T	79.9	Confident	76.2	Confident	13 Å²	13	52.4 Å²	52.4	8%	0.08	29%	0.29	C	S	.	.	S	Bend	trans	-67.3	153.4	-175.7	79.8	0	0	0	0	111.8	K1526 I1527 L1532	K1526-T1530 VanDerWaalsContact CE-C 3.5Å; K1526-T1530 WeakPolarHBondContact CE-O 3.14Å; K1526-T1530 VanDerWaalsContact CG-O 3.32Å; K1526-T1530 WeakPolarHBondContact CG-O 3.26Å; I1527-T1530 PolarHBondContact O-N 2.95Å; I1527-T1530 PolarHBondContact O-OG1 2.03Å; T1530-L1532 PolarHBondContact O-N 3.07Å
1531	N	76.8	Confident	75.2	Confident	78 Å²	78	54.8 Å²	54.8	42%	0.417	31%	0.306	S	S	.	.	S	Bend	trans	-74.8	11.3	-176	-70.2	-19.2	0	0	0	114.4	F1429 G1430 K1526 Y1533	F1429-N1531 CarbonylContact C-O 3.6Å; F1429-N1531 WeakPolarHBondContact CA-O 3.25Å; F1429-N1531 HydrophobicContact CD2-CB 4.13Å; F1429-N1531 HydrophobicContact CE2-CB 3.99Å; F1429-N1531 HydrophobicContact CZ-CB 4.49Å; G1430-N1531 PolarHBondContact N-O 3.27Å; K1526-N1531 PolarHBondContact NZ-OD1 3.31Å; K1526-N1531 VanDerWaalsContact NZ-OD1 3.14Å; N1531-Y1533 VanDerWaalsContact O-CD2 3.28Å; N1531-Y1533 WeakPolarHBondContact O-CD2 3.38Å; N1531-Y1533 WeakPolarHBondContact O-CE2 3.43Å
1532	L	85.6	Confident	74.3	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	135	176.9	-62.4	166.5	0	0	0	110.9	V1426 F1429 F1451 L1454 F1455 I1527 T1530	V1426-L1532 HydrophobicContact CG1-CB 3.99Å; V1426-L1532 HydrophobicContact CG1-CD2 3.99Å; F1429-L1532 HydrophobicContact CD2-CD2 3.78Å; F1429-L1532 HydrophobicContact CD2-CG 4.28Å; F1451-L1532 HydrophobicContact CD2-CD2 4Å; F1451-L1532 HydrophobicContact CE2-CD2 3.44Å; F1451-L1532 VanDerWaalsContact CE2-CD2 3.44Å; F1451-L1532 HydrophobicContact CZ-CD2 3.95Å; L1454-L1532 HydrophobicContact CB-CD1 4.06Å; F1455-L1532 HydrophobicContact CB-CD1 4.06Å; F1455-L1532 HydrophobicContact CD2-CD1 4.46Å; I1527-L1532 HydrophobicContact CB-CB 4.22Å; I1527-L1532 HydrophobicContact CD1-CB 4.05Å; I1527-L1532 HydrophobicContact CG1-CB 4.28Å; I1527-L1532 PolarHBondContact N-O 2.77Å; T1530-L1532 PolarHBondContact O-N 3.07Å
1533	Y	81.8	Confident	72.9	Confident	57 Å²	57	54.7 Å²	54.7	22%	0.224	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141.8	176	-63.3	-99.4	0	0	0	112.6	V1426 N1427 R1428 H1525 K1526 N1531	V1426-Y1533 WeakPolarHBondContact CA-O 3.45Å; V1426-Y1533 WeakPolarHBondContact CG1-O 3.05Å; N1427-Y1533 PolarHBondContact N-O 2.66Å; N1427-Y1533 PolarHBondContact OD1-O 2.75Å; R1428-Y1533 HydrophobicContact CB-CD2 4.29Å; R1428-Y1533 PolarHBondContact O-N 2.85Å; H1525-Y1533 CarbonylContact O-C 3.46Å; H1525-Y1533 VanDerWaalsContact O-CA 3.25Å; H1525-Y1533 WeakPolarHBondContact O-CA 3.34Å; K1526-Y1533 HydrophobicContact CB-CD1 3.96Å; K1526-Y1533 HydrophobicContact CB-CE1 3.71Å; K1526-Y1533 HydrophobicContact CD-CE1 4.16Å; K1526-Y1533 HydrophobicContact CG-CD1 4.33Å; K1526-Y1533 HydrophobicContact CG-CE1 3.91Å; N1531-Y1533 VanDerWaalsContact O-CD2 3.28Å; N1531-Y1533 WeakPolarHBondContact O-CD2 3.38Å; N1531-Y1533 WeakPolarHBondContact O-CE2 3.43Å
1534	T	83.8	Confident	71.1	Confident	6 Å²	6	57.1 Å²	57.1	4%	0.037	33%	0.328	C	S	.	.			trans	-87.9	154.2	169.1	62.1	0	0	0	0	111.1	V1424 I1520 H1525 I1527	V1424-T1534 HydrophobicContact CG1-CG2 3.81Å; I1520-T1534 HydrophobicContact CG2-CG2 4.19Å; H1525-T1534 PolarHBondContact O-N 3.14Å; I1527-T1534 HydrophobicContact CD1-CG2 3.88Å; I1527-T1534 HydrophobicContact CG1-CG2 4.06Å
1535	P	78.7	Confident	69.3	Low	6 Å²	6	65 Å²	65	4%	0.039	35%	0.349	C	S	.	.			trans	-75	130.3	171	25.1	-24.9	0	0	0	110.9	V1425 N1427 P1491 S1537 Y1538	V1425-P1535 HydrophobicContact CB-CG 4.26Å; V1425-P1535 HydrophobicContact CG1-CG 3.96Å; V1425-P1535 WeakPolarHBondContact O-CD 3.48Å; N1427-P1535 HydrophobicContact CB-CB 4.25Å; N1427-P1535 HydrophobicContact CB-CG 4.26Å; P1491-P1535 HydrophobicContact CB-CB 4.29Å; P1491-P1535 HydrophobicContact CB-CG 4.17Å; P1491-P1535 HydrophobicContact CG-CB 4.25Å; P1491-P1535 HydrophobicContact CG-CG 3.69Å; P1535-S1537 PolarHBondContact O-N 3.09Å; P1535-Y1538 PolarHBondContact O-N 2.8Å
1536	E	67.2	Low	67	Low	148 Å²	148	72.1 Å²	72.1	69%	0.692	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-20.6	-175.5	-48.1	-178.9	170.3	0	0	114.4
1537	S	62.2	Low	64.9	Low	105 Å²	105	76.6 Å²	76.6	73%	0.734	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	1.3	-178.4	57.6	0	0	0	0	115	P1535	P1535-S1537 PolarHBondContact O-N 3.09Å
1538	Y	72.5	Confident	62.5	Low	37 Å²	37	86 Å²	86	15%	0.145	46%	0.458	C	S	.	.			trans	-106	112.1	-177.1	-175.8	-108	0	0	0	112.9	P1423 V1425 L1490 P1491 P1535 I1540	P1423-Y1538 WeakPolarHBondContact O-CE1 3.25Å; P1423-Y1538 PolarHBondContact O-OH 2.87Å; V1425-Y1538 HydrophobicContact CB-CD1 3.9Å; V1425-Y1538 HydrophobicContact CB-CE1 4.05Å; V1425-Y1538 HydrophobicContact CB-CG 4.19Å; V1425-Y1538 HydrophobicContact CG2-CD1 4.02Å; V1425-Y1538 HydrophobicContact CG2-CD2 4.16Å; V1425-Y1538 HydrophobicContact CG2-CE1 3.77Å; V1425-Y1538 HydrophobicContact CG2-CE2 3.95Å; V1425-Y1538 HydrophobicContact CG2-CG 4.2Å; L1490-Y1538 HydrophobicContact CD2-CD2 4.25Å; L1490-Y1538 HydrophobicContact CD2-CE2 3.6Å; P1491-Y1538 HydrophobicContact CG-CD2 4.28Å; P1491-Y1538 HydrophobicContact CG-CG 4.42Å; P1535-Y1538 PolarHBondContact O-N 2.8Å; Y1538-I1540 HydrophobicContact CD1-CG1 4.23Å; Y1538-I1540 HydrophobicContact CE1-CG1 4.08Å
1539	S	69.4	Low	60.6	Low	61 Å²	61	94.4 Å²	94.4	43%	0.427	49%	0.494	S	S	.	.			trans	-85.8	134	164.5	174.7	0	0	0	0	110.6	E1517 C1541	E1517-S1539 WeakPolarHBondContact OE1-CA 3.46Å; E1517-S1539 VanDerWaalsContact OE1-CB 3.25Å; E1517-S1539 WeakPolarHBondContact OE1-CB 3.47Å; E1517-S1539 PolarHBondContact OE1-OG 3.43Å; S1539-C1541 PolarHBondContact O-N 2.76Å
1540	I	68.1	Low	58.9	Low	7 Å²	7	94.9 Å²	94.9	4%	0.036	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-15.7	-167.7	-69.3	167.6	0	0	0	112.3	I1422 P1423 V1424 E1517 I1520 Y1538	I1422-I1540 HydrophobicContact CB-CG2 4.37Å; P1423-I1540 WeakPolarHBondContact CG-O 3.45Å; V1424-I1540 HydrophobicContact CG1-CD1 4.4Å; V1424-I1540 HydrophobicContact CG2-CD1 4.19Å; V1424-I1540 HydrophobicContact CG2-CG1 4.44Å; V1424-I1540 HydrophobicContact CG2-CG2 4.16Å; E1517-I1540 PolarHBondContact OE1-N 2.7Å; I1520-I1540 HydrophobicContact CD1-CD1 4.41Å; Y1538-I1540 HydrophobicContact CD1-CG1 4.23Å; Y1538-I1540 HydrophobicContact CE1-CG1 4.08Å
1541	C	62.1	Low	57.1	Low	52 Å²	52	101.7 Å²	101.7	35%	0.351	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	17	-159.4	-38.6	0	0	0	0	117.6	C1513 S1539	C1513-C1541 HydrophobicContact CB-CB 4.31Å; C1513-C1541 WeakPolarHBondContact CB-SG 3.33Å; C1513-C1541 WeakPolarHBondContact SG-CB 3.42Å; C1513-C1541 CovalentContact SG-SG 2.05Å; C1513-C1541 PolarHBondContact SG-SG 3.15Å; S1539-C1541 PolarHBondContact O-N 2.76Å
1542	K	56.3	Low	56	Low	185 Å²	185	99.2 Å²	99.2	80%	0.804	52%	0.522	S	S	*	.			trans	-149.6	111.9	-173.6	-64.8	179.8	-177.7	163.8	0	119.5
1543	P	44.4	Very low	54.9	Low	117 Å²	117	100.7 Å²	100.7	76%	0.76	54%	0.537	S	S	*	.			trans	-130	174	177.6	38.3	-23.1	0	0	0	120.1
1544	P	38.7	Very low	54.2	Low	97 Å²	97	102.6 Å²	102.6	63%	0.63	55%	0.552	S	S	*	*			trans	-122.6	-172	-167.9	31.6	-9.7	0	0	0	120.2
1545	K	37.2	Very low	52.7	Low	211 Å²	211	109.7 Å²	109.7	92%	0.917	58%	0.582	S	S	*	*			trans	-140.6	179.1	-161	-58.9	-173.2	177.4	-174.8	0	120.4
1546	Q	33	Very low	52	Low	191 Å²	191	118.8 Å²	118.8	89%	0.893	62%	0.621	S	S	*	*			trans	-135.3	-173.8	-165.4	-62.4	176.7	-14.1	0	0	119.3
1547	T	34	Very low	52	Low	141 Å²	141	112.4 Å²	112.4	87%	0.865	59%	0.592	S	S	*	*			trans	-161.3	-171.1	-170.8	-24.3	0	0	0	0	119.8
1548	E	33.8	Very low	52	Low	196 Å²	196	111.2 Å²	111.2	92%	0.916	58%	0.578	S	S	*	*			trans	-120.7	-157.8	-145.1	-53.6	172.4	143.7	0	0	123.1
1549	E	34.4	Very low	51.7	Low	189 Å²	189	114.8 Å²	114.8	88%	0.883	60%	0.604	S	S	*	*			trans	-113.6	170.8	-147.9	-76	-147.8	125.9	0	0	124.4
1550	P	37.1	Very low	51.1	Low	96 Å²	96	115.4 Å²	115.4	62%	0.623	61%	0.612	S	S	*	*			trans	-142	171.5	-172.3	35.5	-11.6	0	0	0	122.9	K1568	P1550-K1568 WeakPolarHBondContact O-CE 3.46Å; P1550-K1568 PolarHBondContact O-NZ 3.38Å
1551	L	41.8	Very low	51	Low	155 Å²	155	117.5 Å²	117.5	81%	0.812	62%	0.623	S	S	*	*			trans	-58.3	175.7	-173.2	-106.3	86.3	0	0	0	122.2	K1568	L1551-K1568 WeakPolarHBondContact O-CD 3.09Å; L1551-K1568 WeakPolarHBondContact O-CE 3.41Å; L1551-K1568 WeakPolarHBondContact O-CG 3.2Å
1552	C	54.4	Low	51.2	Low	26 Å²	26	115.8 Å²	115.8	18%	0.176	62%	0.615	C	S	.	*			trans	-116.4	117.9	172	-176.2	0	0	0	0	114.8	C1565	C1552-C1565 HydrophobicContact CB-CB 3.72Å; C1552-C1565 WeakPolarHBondContact CB-SG 2.91Å; C1552-C1565 WeakPolarHBondContact SG-CB 3.3Å; C1552-C1565 CovalentContact SG-SG 2.02Å; C1552-C1565 PolarHBondContact SG-SG 3.21Å
1553	G	63.1	Low	51.8	Low	31 Å²	31	108.1 Å²	108.1	32%	0.32	58%	0.582	S	S	.	*	S	Bend	trans	54.8	-150.7	162.4	0	0	0	0	0	116.7	K1568	G1553-K1568 WeakPolarHBondContact CA-O 3.38Å; G1553-K1568 PolarHBondContact N-O 3.28Å
1554	N	65.5	Low	53.1	Low	98 Å²	98	105.3 Å²	105.3	52%	0.524	56%	0.562	S	S	.	*	S	Bend	trans	-113.6	9.7	176	-70.4	-73.1	0	0	0	113.4	N611	N611-N1554 PolarHBondContact OD1-ND2 2.9Å
1555	K	53.1	Low	54.4	Low	155 Å²	155	103.2 Å²	103.2	67%	0.674	55%	0.55	S	S	*	.	S	Bend	trans	-136.5	134.3	169.8	-82.1	-169.4	174.2	-171.7	0	108.1	C1557	K1555-C1557 PolarHBondContact O-N 3.06Å
1556	K	63.4	Low	55.4	Low	197 Å²	197	94.9 Å²	94.9	86%	0.857	52%	0.515	S	S	*	.			trans	-62.4	127	155.2	-167	177.3	-177	-176.9	0	106.4
1557	C	66.8	Low	56.3	Low	14 Å²	14	88.5 Å²	88.5	10%	0.095	50%	0.5	C	S	.	.			trans	-63.2	144.4	-179.3	-55.7	0	0	0	0	109.6	K1555 T1559 E1563 C1565 C1571	K1555-C1557 PolarHBondContact O-N 3.06Å; C1557-T1559 PolarHBondContact O-N 2.8Å; C1557-E1563 HydrophobicContact CB-CB 4.37Å; C1557-E1563 VanDerWaalsContact CB-O 3.28Å; C1557-E1563 WeakPolarHBondContact CB-O 3.21Å; C1557-C1565 WeakPolarHBondContact SG-CA 3.36Å; C1557-C1565 PolarHBondContact SG-N 3.25Å; C1557-C1571 HydrophobicContact CB-CB 4.03Å
1558	D	63.6	Low	57.2	Low	80 Å²	80	86 Å²	86	43%	0.428	48%	0.477	S	S	.	.			trans	-79.4	90.7	-176.7	-161.5	-19	0	0	0	110.9	A1560 L1561 G1562 E1563	D1558-A1560 PolarHBondContact O-N 2.81Å; D1558-A1560 VanDerWaalsContact O-N 3.12Å; D1558-A1560 VanDerWaalsContact OD1-CB 3.27Å; D1558-A1560 WeakPolarHBondContact OD1-CB 3.22Å; D1558-A1560 PolarHBondContact OD1-N 3.45Å; D1558-L1561 HydrophobicContact CB-CB 4.42Å; D1558-L1561 HydrophobicContact CB-CD1 4.45Å; D1558-L1561 PolarHBondContact O-N 2.9Å; D1558-G1562 PolarHBondContact O-N 3.13Å; D1558-E1563 PolarHBondContact O-N 3.01Å
1559	T	65	Low	57.9	Low	112 Å²	112	78.7 Å²	78.7	69%	0.687	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.9	175.6	49.5	0	0	0	0	113.2	C1557 G1562	C1557-T1559 PolarHBondContact O-N 2.8Å; T1559-G1562 PolarHBondContact O-N 3.48Å
1560	A	56.4	Low	59.2	Low	74 Å²	74	70.4 Å²	70.4	61%	0.612	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-18.3	172.6	0	0	0	0	0	113.2	D1558 H1585	D1558-A1560 PolarHBondContact O-N 2.81Å; D1558-A1560 VanDerWaalsContact O-N 3.12Å; D1558-A1560 VanDerWaalsContact OD1-CB 3.27Å; D1558-A1560 WeakPolarHBondContact OD1-CB 3.22Å; D1558-A1560 PolarHBondContact OD1-N 3.45Å; A1560-H1585 PolarHBondContact O-CE1 3.37Å; A1560-H1585 VanDerWaalsContact O-CE1 3.24Å; A1560-H1585 PolarHBondContact O-ND1 2.92Å
1561	L	67.4	Low	60.7	Low	50 Å²	50	67.3 Å²	67.3	26%	0.262	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.9	166.4	-71.9	176.3	0	0	0	112.9	D1558 E1563 H1585 C1586	D1558-L1561 HydrophobicContact CB-CB 4.42Å; D1558-L1561 HydrophobicContact CB-CD1 4.45Å; D1558-L1561 PolarHBondContact O-N 2.9Å; L1561-E1563 VanDerWaalsContact C-N 3.34Å; L1561-E1563 HydrophobicContact CB-CG 4.07Å; L1561-H1585 VanDerWaalsContact C-CE1 3.46Å; L1561-H1585 VanDerWaalsContact C-ND1 3.34Å; L1561-H1585 WeakPolarHBondContact CA-ND1 3.23Å; L1561-C1586 WeakPolarHBondContact O-CB 3.2Å; L1561-C1586 PolarHBondContact O-N 2.98Å; L1561-C1586 PolarHBondContact O-SG 2.87Å
1562	G	65.7	Low	62	Low	17 Å²	17	60.8 Å²	60.8	18%	0.175	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	11.6	-173	0	0	0	0	0	113.7	D1558 T1559 P1574 H1585	D1558-G1562 PolarHBondContact O-N 3.13Å; T1559-G1562 PolarHBondContact O-N 3.48Å; G1562-P1574 WeakPolarHBondContact O-CD 3.28Å; G1562-H1585 PolarHBondContact N-CE1 3.47Å
1563	E	69.7	Low	62.8	Low	23 Å²	23	60 Å²	60	11%	0.107	35%	0.346	C	S	.	.			trans	-75.8	129.8	-175.7	-65.9	-170.5	158.9	0	0	112.4	C1557 D1558 L1561 C1571 T1572 R1579	C1557-E1563 HydrophobicContact CB-CB 4.37Å; C1557-E1563 VanDerWaalsContact CB-O 3.28Å; C1557-E1563 WeakPolarHBondContact CB-O 3.21Å; D1558-E1563 PolarHBondContact O-N 3.01Å; L1561-E1563 VanDerWaalsContact C-N 3.34Å; L1561-E1563 HydrophobicContact CB-CG 4.07Å; E1563-C1571 HydrophobicContact CB-CB 4.31Å; E1563-C1571 WeakPolarHBondContact OE2-CB 3.45Å; E1563-T1572 CarbonylContact C-O 3.59Å; E1563-T1572 VanDerWaalsContact CA-O 3.31Å; E1563-T1572 WeakPolarHBondContact CA-O 3.16Å; E1563-R1579 IonicContact OE1-CZ 3.51Å; E1563-R1579 VanDerWaalsContact OE1-CZ 3.31Å; E1563-R1579 IonicContact OE1-NH1 2.84Å; E1563-R1579 PolarHBondContact OE1-NH1 2.04Å; E1563-R1579 IonicContact OE1-NH2 3.78Å; E1563-R1579 PolarHBondContact OE1-NH2 3.49Å
1564	V	70.2	Confident	63.1	Low	59 Å²	59	60 Å²	60	36%	0.358	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	162.5	174.7	-58.9	0	0	0	0	111.2	I1566 T1572 P1574	V1564-I1566 HydrophobicContact CG2-CG1 4.17Å; V1564-I1566 PolarHBondContact O-N 2.88Å; V1564-T1572 PolarHBondContact N-O 3.47Å; V1564-T1572 PolarHBondContact O-N 3.36Å; V1564-P1574 HydrophobicContact CG1-CB 4.12Å; V1564-P1574 HydrophobicContact CG1-CG 4.32Å; V1564-P1574 HydrophobicContact CG2-CB 3.7Å; V1564-P1574 HydrophobicContact CG2-CG 4.48Å
1565	C	66.8	Low	63.1	Low	53 Å²	53	64.2 Å²	64.2	36%	0.358	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	115.4	172.8	179.6	0	0	0	0	111.2	C1552 C1557 K1568	C1552-C1565 HydrophobicContact CB-CB 3.72Å; C1552-C1565 WeakPolarHBondContact CB-SG 2.91Å; C1552-C1565 WeakPolarHBondContact SG-CB 3.3Å; C1552-C1565 CovalentContact SG-SG 2.02Å; C1552-C1565 PolarHBondContact SG-SG 3.21Å; C1557-C1565 WeakPolarHBondContact SG-CA 3.36Å; C1557-C1565 PolarHBondContact SG-N 3.25Å; C1565-K1568 VanDerWaalsContact SG-CA 3.51Å
1566	I	57.3	Low	63.6	Low	36 Å²	36	59 Å²	59	19%	0.185	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.6	165.3	-54.4	-171.8	0	0	0	109.2	V1564 K1568 Q1569 V1570 T1572 Y1575	V1564-I1566 HydrophobicContact CG2-CG1 4.17Å; V1564-I1566 PolarHBondContact O-N 2.88Å; I1566-K1568 PolarHBondContact O-N 2.64Å; I1566-K1568 VanDerWaalsContact O-N 3.1Å; I1566-Q1569 PolarHBondContact O-N 3.02Å; I1566-V1570 PolarHBondContact N-O 2.91Å; I1566-V1570 VanDerWaalsContact N-O 3.1Å; I1566-V1570 PolarHBondContact O-N 3.46Å; I1566-T1572 HydrophobicContact CB-CG2 4.36Å; I1566-T1572 HydrophobicContact CD1-CG2 3.65Å; I1566-T1572 HydrophobicContact CG1-CG2 3.91Å; I1566-Y1575 HydrophobicContact CD1-CD2 4.03Å; I1566-Y1575 HydrophobicContact CD1-CE2 3.94Å
1567	G	53.2	Low	63.9	Low	57 Å²	57	51.8 Å²	51.8	59%	0.588	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	12.3	172.6	0	0	0	0	0	116.6	Q1569	G1567-Q1569 PolarHBondContact O-N 3.27Å
1568	K	53.5	Low	64.3	Low	89 Å²	89	51.6 Å²	51.6	39%	0.387	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	29.9	-170.4	-65.8	-179.7	166.8	178.7	0	113.6	P1550 L1551 G1553 C1565 I1566	P1550-K1568 WeakPolarHBondContact O-CE 3.46Å; P1550-K1568 PolarHBondContact O-NZ 3.38Å; L1551-K1568 WeakPolarHBondContact O-CD 3.09Å; L1551-K1568 WeakPolarHBondContact O-CE 3.41Å; L1551-K1568 WeakPolarHBondContact O-CG 3.2Å; G1553-K1568 WeakPolarHBondContact CA-O 3.38Å; G1553-K1568 PolarHBondContact N-O 3.28Å; C1565-K1568 VanDerWaalsContact SG-CA 3.51Å; I1566-K1568 PolarHBondContact O-N 2.64Å; I1566-K1568 VanDerWaalsContact O-N 3.1Å
1569	Q	48.3	Very low	64.5	Low	42 Å²	42	50.6 Å²	50.6	20%	0.196	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.8	-45.1	179.9	-65	-173.7	-85.5	0	0	114.3	Y558 R610 I1566 G1567	Y558-Q1569 HydrophobicContact CD1-CB 4.3Å; R610-Q1569 HydrophobicContact CB-CG 4.29Å; R610-Q1569 HydrophobicContact CG-CG 4.43Å; R610-Q1569 PolarHBondContact O-NE2 3.13Å; I1566-Q1569 PolarHBondContact O-N 3.02Å; G1567-Q1569 PolarHBondContact O-N 3.27Å
1570	V	61.2	Low	64.9	Low	14 Å²	14	48.6 Å²	48.6	9%	0.085	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.1	-165.5	174.5	0	0	0	0	111.3	E555 Y558 I1566 T1572	E555-V1570 WeakPolarHBondContact OE2-CG1 3.19Å; Y558-V1570 VanDerWaalsContact CB-CG2 3.43Å; Y558-V1570 HydrophobicContact CD2-CG2 4.08Å; Y558-V1570 HydrophobicContact CG-CG2 3.8Å; I1566-V1570 PolarHBondContact N-O 2.91Å; I1566-V1570 VanDerWaalsContact N-O 3.1Å; I1566-V1570 PolarHBondContact O-N 3.46Å; V1570-T1572 HydrophobicContact CG1-CG2 3.71Å
1571	C	67.9	Low	65.2	Low	31 Å²	31	47.3 Å²	47.3	21%	0.209	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116	162.9	-41.4	0	0	0	0	107.3	C1557 E1563	C1557-C1571 HydrophobicContact CB-CB 4.03Å; E1563-C1571 HydrophobicContact CB-CB 4.31Å; E1563-C1571 WeakPolarHBondContact OE2-CB 3.45Å
1572	T	70.1	Confident	65	Low	19 Å²	19	49.1 Å²	49.1	12%	0.117	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	165.8	-176.9	-172.9	0	0	0	0	109.5	E1563 V1564 I1566 V1570	E1563-T1572 CarbonylContact C-O 3.59Å; E1563-T1572 VanDerWaalsContact CA-O 3.31Å; E1563-T1572 WeakPolarHBondContact CA-O 3.16Å; V1564-T1572 PolarHBondContact N-O 3.47Å; V1564-T1572 PolarHBondContact O-N 3.36Å; I1566-T1572 HydrophobicContact CB-CG2 4.36Å; I1566-T1572 HydrophobicContact CD1-CG2 3.65Å; I1566-T1572 HydrophobicContact CG1-CG2 3.91Å; V1570-T1572 HydrophobicContact CG1-CG2 3.71Å
1573	C	71.2	Confident	64.9	Low	8 Å²	8	54.5 Å²	54.5	5%	0.054	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-60.8	142	172.8	-58.9	0	0	0	0	110.3	Q1577 C1586	C1573-Q1577 HydrophobicContact CB-CB 3.9Å; C1573-Q1577 WeakPolarHBondContact CB-O 3.47Å; C1573-C1586 WeakPolarHBondContact CA-SG 3.33Å; C1573-C1586 HydrophobicContact CB-CB 3.69Å; C1573-C1586 WeakPolarHBondContact CB-SG 3.04Å; C1573-C1586 VanDerWaalsContact SG-CA 3.59Å; C1573-C1586 WeakPolarHBondContact SG-CB 3.27Å; C1573-C1586 CovalentContact SG-SG 2.04Å; C1573-C1586 PolarHBondContact SG-SG 2.77Å
1574	P	68.4	Low	64.9	Low	33 Å²	33	56.1 Å²	56.1	21%	0.214	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-59.8	158.1	176.5	24.1	-33.2	0	0	0	111.3	G1562 V1564 G1576 Q1577	G1562-P1574 WeakPolarHBondContact O-CD 3.28Å; V1564-P1574 HydrophobicContact CG1-CB 4.12Å; V1564-P1574 HydrophobicContact CG1-CG 4.32Å; V1564-P1574 HydrophobicContact CG2-CB 3.7Å; V1564-P1574 HydrophobicContact CG2-CG 4.48Å; P1574-G1576 PolarHBondContact O-N 3.03Å; P1574-G1576 VanDerWaalsContact O-N 3.13Å; P1574-Q1577 HydrophobicContact CG-CB 4.05Å; P1574-Q1577 HydrophobicContact CG-CG 3.92Å; P1574-Q1577 PolarHBondContact O-N 2.74Å
1575	Y	66.8	Low	64.9	Low	185 Å²	185	57.1 Å²	57.1	73%	0.725	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	122.4	173.6	-82.1	-77.5	0	0	0	110.5	R559 I1566	R559-Y1575 PolarHBondContact NH1-OH 3.05Å; I1566-Y1575 HydrophobicContact CD1-CD2 4.03Å; I1566-Y1575 HydrophobicContact CD1-CE2 3.94Å
1576	G	63.3	Low	65.1	Low	45 Å²	45	54.7 Å²	54.7	46%	0.464	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.7	-4	-172.6	0	0	0	0	0	114.9	P1574 D1588 I1589	P1574-G1576 PolarHBondContact O-N 3.03Å; P1574-G1576 VanDerWaalsContact O-N 3.13Å; G1576-D1588 WeakPolarHBondContact O-CA 3.15Å; G1576-I1589 PolarHBondContact O-N 3.33Å
1577	Q	70	Confident	65.6	Low	46 Å²	46	55.6 Å²	55.6	22%	0.215	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	156.3	176	-60.3	-164.7	-32.3	0	0	112.9	C1573 P1574 C1586 Q1587 D1588 I1589	C1573-Q1577 HydrophobicContact CB-CB 3.9Å; C1573-Q1577 WeakPolarHBondContact CB-O 3.47Å; P1574-Q1577 HydrophobicContact CG-CB 4.05Å; P1574-Q1577 HydrophobicContact CG-CG 3.92Å; P1574-Q1577 PolarHBondContact O-N 2.74Å; Q1577-C1586 HydrophobicContact CB-CB 4.24Å; Q1577-Q1587 CarbonylContact C-O 3.01Å; Q1577-Q1587 WeakPolarHBondContact CA-O 2.89Å; Q1577-Q1587 WeakPolarHBondContact CB-O 3.32Å; Q1577-D1588 PolarHBondContact NE2-OD1 2.83Å; Q1577-I1589 WeakPolarHBondContact O-CD1 3.32Å
1578	G	74.2	Confident	66.3	Low	10 Å²	10	55.6 Å²	55.6	10%	0.103	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	-170.6	-177.8	0	0	0	0	0	112.1	Q1587	G1578-Q1587 PolarHBondContact N-O 3.37Å; G1578-Q1587 PolarHBondContact O-N 2.79Å; G1578-Q1587 VanDerWaalsContact O-O 3.04Å
1579	R	68.6	Low	67.2	Low	60 Å²	60	53 Å²	53	23%	0.226	29%	0.289	C	S	.	.			trans	-153	150.5	-173.6	50.3	-173.3	173.6	-142.4	-0.9	111	E1563 A1581 D1584	E1563-R1579 IonicContact OE1-CZ 3.51Å; E1563-R1579 VanDerWaalsContact OE1-CZ 3.31Å; E1563-R1579 IonicContact OE1-NH1 2.84Å; E1563-R1579 PolarHBondContact OE1-NH1 2.04Å; E1563-R1579 IonicContact OE1-NH2 3.78Å; E1563-R1579 PolarHBondContact OE1-NH2 3.49Å; R1579-A1581 WeakPolarHBondContact CB-O 3.01Å; R1579-A1581 WeakPolarHBondContact CD-O 2.86Å; R1579-A1581 WeakPolarHBondContact CG-O 3.3Å; R1579-D1584 HydrophobicContact CB-CB 4.01Å; R1579-D1584 WeakPolarHBondContact CD-O 2.94Å
1580	H	72.1	Confident	68.3	Low	70 Å²	70	53.5 Å²	53.5	32%	0.324	29%	0.292	S	S	.	.	S	Bend	trans	-82.1	-49.1	178.8	174.7	60.1	0	0	0	110.8	D1584 W1641 Y1644 L1675	H1580-D1584 PolarHBondContact N-OD2 3.04Å; H1580-W1641 PolarHBondContact CE1-O 3.33Å; H1580-W1641 PolarHBondContact ND1-O 2.88Å; H1580-Y1644 PolarHBondContact ND1-O 3.22Å; H1580-L1675 HydrophobicContact CB-CD1 4.12Å
1581	A	64.4	Low	68.8	Low	46 Å²	46	54.6 Å²	54.6	38%	0.38	31%	0.306	S	S	.	.	S	Bend	trans	-100.9	158.5	168.9	0	0	0	0	0	111.4	R1579 N1583 D1584	R1579-A1581 WeakPolarHBondContact CB-O 3.01Å; R1579-A1581 WeakPolarHBondContact CD-O 2.86Å; R1579-A1581 WeakPolarHBondContact CG-O 3.3Å; A1581-N1583 PolarHBondContact O-N 2.79Å; A1581-D1584 PolarHBondContact N-OD2 2.03Å; A1581-D1584 PolarHBondContact O-N 2.69Å
1582	S	61.5	Low	68.9	Low	89 Å²	89	53.8 Å²	53.8	62%	0.622	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.1	179.2	53.6	0	0	0	0	114.9
1583	N	64.2	Low	69	Low	130 Å²	130	55.8 Å²	55.8	70%	0.695	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-4.7	-170.6	-56.3	7.2	0	0	0	112.5	A1581	A1581-N1583 PolarHBondContact O-N 2.79Å
1584	D	70.3	Confident	69.1	Low	57 Å²	57	55.4 Å²	55.4	31%	0.305	31%	0.305	S	S	.	.	S	Bend	trans	-75.2	148.1	176.4	-49.9	-40.1	0	0	0	110.4	R1579 H1580 A1581	R1579-D1584 HydrophobicContact CB-CB 4.01Å; R1579-D1584 WeakPolarHBondContact CD-O 2.94Å; H1580-D1584 PolarHBondContact N-OD2 3.04Å; A1581-D1584 PolarHBondContact N-OD2 2.03Å; A1581-D1584 PolarHBondContact O-N 2.69Å
1585	H	70	Confident	69.3	Low	79 Å²	79	54 Å²	54	37%	0.366	30%	0.296	S	S	.	.			trans	-61.6	144.3	168.3	-168.1	98	0	0	0	110.3	A1560 L1561 G1562 Q1587	A1560-H1585 PolarHBondContact O-CE1 3.37Å; A1560-H1585 VanDerWaalsContact O-CE1 3.24Å; A1560-H1585 PolarHBondContact O-ND1 2.92Å; L1561-H1585 VanDerWaalsContact C-CE1 3.46Å; L1561-H1585 VanDerWaalsContact C-ND1 3.34Å; L1561-H1585 WeakPolarHBondContact CA-ND1 3.23Å; G1562-H1585 PolarHBondContact N-CE1 3.47Å; H1585-Q1587 PolarHBondContact O-N 2.82Å; H1585-Q1587 VanDerWaalsContact O-N 3.09Å
1586	C	70.9	Confident	70	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.014	26%	0.262	C	S	.	.			trans	-58.3	112	178.7	-67	0	0	0	0	111.4	L1561 C1573 Q1577	L1561-C1586 WeakPolarHBondContact O-CB 3.2Å; L1561-C1586 PolarHBondContact O-N 2.98Å; L1561-C1586 PolarHBondContact O-SG 2.87Å; C1573-C1586 WeakPolarHBondContact CA-SG 3.33Å; C1573-C1586 HydrophobicContact CB-CB 3.69Å; C1573-C1586 WeakPolarHBondContact CB-SG 3.04Å; C1573-C1586 VanDerWaalsContact SG-CA 3.59Å; C1573-C1586 WeakPolarHBondContact SG-CB 3.27Å; C1573-C1586 CovalentContact SG-SG 2.04Å; C1573-C1586 PolarHBondContact SG-SG 2.77Å; Q1577-C1586 HydrophobicContact CB-CB 4.24Å
1587	Q	67.1	Low	70.9	Confident	55 Å²	55	43.2 Å²	43.2	26%	0.257	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	149	174.3	-73.7	168.5	59.9	0	0	108.8	Q1577 G1578 H1585 L1675	Q1577-Q1587 CarbonylContact C-O 3.01Å; Q1577-Q1587 WeakPolarHBondContact CA-O 2.89Å; Q1577-Q1587 WeakPolarHBondContact CB-O 3.32Å; G1578-Q1587 PolarHBondContact N-O 3.37Å; G1578-Q1587 PolarHBondContact O-N 2.79Å; G1578-Q1587 VanDerWaalsContact O-O 3.04Å; H1585-Q1587 PolarHBondContact O-N 2.82Å; H1585-Q1587 VanDerWaalsContact O-N 3.09Å; Q1587-L1675 HydrophobicContact CB-CD2 4.19Å
1588	D	68.8	Low	71.5	Confident	58 Å²	58	41 Å²	41	31%	0.31	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	143.1	171.4	-72.5	10.7	0	0	0	111.7	G1576 Q1577 K1676	G1576-D1588 WeakPolarHBondContact O-CA 3.15Å; Q1577-D1588 PolarHBondContact NE2-OD1 2.83Å; D1588-K1676 HydrophobicContact CB-CB 3.66Å; D1588-K1676 HydrophobicContact CB-CD 3.3Å; D1588-K1676 HydrophobicContact CB-CG 4.15Å; D1588-K1676 WeakPolarHBondContact O-CB 3.08Å; D1588-K1676 PolarHBondContact O-N 2.65Å; D1588-K1676 WeakPolarHBondContact OD2-CD 3.37Å; D1588-K1676 IonicContact OD2-NZ 3.88Å; D1588-K1676 PolarHBondContact OD2-NZ 3.37Å
1589	I	72.3	Confident	71.6	Confident	35 Å²	35	40.5 Å²	40.5	18%	0.179	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	153.5	177.9	55.2	174.8	0	0	0	112.1	G1576 Q1577 A1645 Y1673 F1674 L1675	G1576-I1589 PolarHBondContact O-N 3.33Å; Q1577-I1589 WeakPolarHBondContact O-CD1 3.32Å; I1589-A1645 HydrophobicContact CG2-CB 3.81Å; I1589-Y1673 HydrophobicContact CD1-CD1 3.73Å; I1589-Y1673 HydrophobicContact CD1-CE1 4.33Å; I1589-Y1673 HydrophobicContact CD1-CG 3.98Å; I1589-Y1673 HydrophobicContact CG1-CD1 4.32Å; I1589-F1674 CarbonylContact C-O 3.19Å; I1589-F1674 VanDerWaalsContact CA-O 3.25Å; I1589-F1674 WeakPolarHBondContact CA-O 3.39Å; I1589-L1675 HydrophobicContact CG2-CD2 4.11Å
1590	I	70.4	Confident	71.8	Confident	51 Å²	51	40.3 Å²	40.3	26%	0.262	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.3	175.1	-64.7	174.9	0	0	0	108.3	Y1673 F1674 K1676 E1679	I1590-Y1673 WeakPolarHBondContact O-CA 3.34Å; I1590-F1674 PolarHBondContact N-O 3.05Å; I1590-F1674 PolarHBondContact O-N 2.71Å; I1590-K1676 HydrophobicContact CD1-CB 4.32Å; I1590-K1676 HydrophobicContact CD1-CG 4.06Å; I1590-K1676 HydrophobicContact CG1-CB 4.27Å; I1590-K1676 HydrophobicContact CG1-CG 4.34Å; I1590-E1679 HydrophobicContact CD1-CG 3.45Å; I1590-E1679 VanDerWaalsContact CD1-CG 3.45Å; I1590-E1679 VanDerWaalsContact CD1-OE1 3.31Å; I1590-E1679 WeakPolarHBondContact CD1-OE1 3.27Å
1591	G	72	Confident	72	Confident	37 Å²	37	39.4 Å²	39.4	38%	0.381	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130.2	177.9	0	0	0	0	0	112.3	T1672	G1591-T1672 CarbonylContact C-O 3.3Å; G1591-T1672 WeakPolarHBondContact CA-O 3.36Å
1592	I	71	Confident	72.2	Confident	14 Å²	14	41.4 Å²	41.4	7%	0.072	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.4	176.4	-56	-174.4	0	0	0	109.2	L1594 T1671 T1672 F1674 P1680 P1682	I1592-L1594 HydrophobicContact CG2-CD2 3.83Å; I1592-L1594 HydrophobicContact CG2-CG 3.97Å; I1592-T1671 CarbonylContact O-C 3.48Å; I1592-T1671 VanDerWaalsContact O-CA 3.31Å; I1592-T1671 WeakPolarHBondContact O-CA 3.32Å; I1592-T1672 PolarHBondContact N-O 3.35Å; I1592-T1672 PolarHBondContact O-N 3.11Å; I1592-F1674 HydrophobicContact CD1-CD2 3.85Å; I1592-F1674 HydrophobicContact CD1-CE2 3.86Å; I1592-F1674 HydrophobicContact CG1-CD2 4.2Å; I1592-F1674 HydrophobicContact CG1-CE2 4.32Å; I1592-P1680 HydrophobicContact CD1-CG 4.02Å; I1592-P1680 WeakPolarHBondContact CD1-O 3.42Å; I1592-P1682 HydrophobicContact CG2-CB 3.82Å; I1592-P1682 HydrophobicContact CG2-CG 3.98Å
1593	H	70.9	Confident	72.5	Confident	61 Å²	61	46 Å²	46	28%	0.282	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	134.8	171.9	-59.2	-41.1	0	0	0	110.6	R1650 F1670 T1671 F1714	H1593-R1650 PolarHBondContact CE1-NH1 3.39Å; H1593-R1650 VanDerWaalsContact CE1-NH1 3.25Å; H1593-R1650 PolarHBondContact CE1-NH2 3.31Å; H1593-R1650 PolarHBondContact NE2-NH1 2.71Å; H1593-R1650 PolarHBondContact NE2-NH2 2.89Å; H1593-F1670 CarbonylContact C-O 3.34Å; H1593-F1670 VanDerWaalsContact CA-O 3.25Å; H1593-F1670 WeakPolarHBondContact CA-O 3.19Å; H1593-T1671 PolarHBondContact CE1-OG1 3.47Å; H1593-T1671 PolarHBondContact ND1-OG1 3.1Å; H1593-F1714 WeakPolarHBondContact O-CE2 3.11Å; H1593-F1714 WeakPolarHBondContact O-CZ 3.28Å
1594	L	74.2	Confident	72.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.			trans	-142	53.7	-172.6	-67.6	177	0	0	0	113.1	I1592 L1596 F1635 F1670 A1685 W1686 L1689 F1714	I1592-L1594 HydrophobicContact CG2-CD2 3.83Å; I1592-L1594 HydrophobicContact CG2-CG 3.97Å; L1594-L1596 PolarHBondContact O-N 2.76Å; L1594-F1635 HydrophobicContact CD1-CZ 4.3Å; L1594-F1670 HydrophobicContact CB-CE1 4Å; L1594-F1670 HydrophobicContact CB-CE2 4.35Å; L1594-F1670 HydrophobicContact CB-CZ 3.82Å; L1594-F1670 PolarHBondContact N-O 2.04Å; L1594-F1670 WeakPolarHBondContact O-CD1 3.08Å; L1594-F1670 WeakPolarHBondContact O-CE1 3.37Å; L1594-A1685 HydrophobicContact CD1-CB 4.01Å; L1594-A1685 HydrophobicContact CD2-CB 4.18Å; L1594-W1686 HydrophobicContact CB-CE3 4.46Å; L1594-W1686 HydrophobicContact CD2-CB 4.17Å; L1594-W1686 HydrophobicContact CD2-CE3 4.45Å; L1594-L1689 HydrophobicContact CD1-CD2 4.34Å; L1594-F1714 HydrophobicContact CD2-CD2 4.5Å; L1594-F1714 HydrophobicContact CD2-CE2 3.94Å; L1594-F1714 HydrophobicContact CD2-CZ 4.48Å
1595	P	73.2	Confident	73.1	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.032	23%	0.234	C	C	.	.			trans	-66.5	137.2	-160.4	31.2	-38.7	0	0	0	114.5	W1667 F1668 W1686	P1595-W1667 HydrophobicContact CB-CH2 3.53Å; P1595-W1667 HydrophobicContact CB-CZ2 3.32Å; P1595-W1667 HydrophobicContact CB-CZ3 4.15Å; P1595-W1667 HydrophobicContact CG-CH2 3.6Å; P1595-W1667 HydrophobicContact CG-CZ2 3.51Å; P1595-F1668 CarbonylContact C-O 3.53Å; P1595-F1668 WeakPolarHBondContact CA-O 3.04Å; P1595-F1668 VanDerWaalsContact CB-O 3.25Å; P1595-F1668 WeakPolarHBondContact CB-O 3.26Å; P1595-W1686 VanDerWaalsContact O-CH2 3.29Å; P1595-W1686 WeakPolarHBondContact O-CH2 3.46Å; P1595-W1686 WeakPolarHBondContact O-CZ3 3.25Å
1596	L	80.4	Confident	73.6	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	134.8	-171.9	-82.8	172.4	0	0	0	112.7	L1594 V1598 F1627 I1631 F1668 F1670 W1686 L1689 I1693 I1707	L1594-L1596 PolarHBondContact O-N 2.76Å; L1596-V1598 PolarHBondContact O-N 3.41Å; L1596-F1627 HydrophobicContact CB-CE2 3.91Å; L1596-F1627 HydrophobicContact CB-CZ 4.05Å; L1596-F1627 HydrophobicContact CD1-CE2 3.71Å; L1596-F1627 HydrophobicContact CD1-CZ 3.84Å; L1596-F1627 HydrophobicContact CG-CE2 4.45Å; L1596-F1627 HydrophobicContact CG-CZ 4.47Å; L1596-I1631 HydrophobicContact CD1-CD1 4.01Å; L1596-F1668 PolarHBondContact N-O 2.85Å; L1596-F1668 VanDerWaalsContact N-O 3.1Å; L1596-F1668 PolarHBondContact O-N 3.48Å; L1596-F1670 HydrophobicContact CB-CE1 4.44Å; L1596-F1670 HydrophobicContact CD1-CE1 3.9Å; L1596-F1670 HydrophobicContact CD1-CZ 4.34Å; L1596-F1670 HydrophobicContact CG-CE1 4.1Å; L1596-W1686 HydrophobicContact CD2-CH2 3.58Å; L1596-W1686 HydrophobicContact CD2-CZ2 4.49Å; L1596-W1686 HydrophobicContact CD2-CZ3 3.67Å; L1596-W1686 HydrophobicContact CG-CH2 4.31Å; L1596-W1686 HydrophobicContact CG-CZ3 4Å; L1596-L1689 HydrophobicContact CD1-CD2 4.26Å; L1596-I1693 HydrophobicContact CD1-CD1 4.21Å; L1596-I1707 HydrophobicContact CD2-CG2 4.31Å
1597	L	81.5	Confident	73.9	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	92.4	169.2	-177.9	52.5	0	0	0	109.9	R188 P1655 W1662 L1666 W1667 D1708 Q1711 P1712	R188-L1597 VanDerWaalsContact NE-CD2 3.33Å; L1597-P1655 HydrophobicContact CD1-CB 3.99Å; L1597-P1655 HydrophobicContact CD1-CG 3.68Å; L1597-W1662 HydrophobicContact CD2-CD2 4.17Å; L1597-W1662 HydrophobicContact CD2-CG 3.94Å; L1597-L1666 WeakPolarHBondContact CA-O 3.32Å; L1597-W1667 HydrophobicContact CB-CE3 4.2Å; L1597-W1667 HydrophobicContact CB-CZ3 4.42Å; L1597-D1708 PolarHBondContact O-N 2.84Å; L1597-D1708 VanDerWaalsContact O-N 3.15Å; L1597-Q1711 PolarHBondContact O-NE2 2.81Å; L1597-P1712 HydrophobicContact CB-CG 4.27Å
1598	V	83.4	Confident	74.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	135	176.5	-175.5	0	0	0	0	109.2	L1596 L1606 I1623 F1627 G1665 L1666 F1668 I1700 L1705	L1596-V1598 PolarHBondContact O-N 3.41Å; V1598-L1606 HydrophobicContact CG1-CD1 3.94Å; V1598-I1623 HydrophobicContact CG1-CD1 4.22Å; V1598-F1627 HydrophobicContact CG2-CD2 3.86Å; V1598-F1627 HydrophobicContact CG2-CE2 3.7Å; V1598-G1665 CarbonylContact O-C 3.47Å; V1598-G1665 WeakPolarHBondContact O-CA 3.43Å; V1598-L1666 PolarHBondContact N-O 3.2Å; V1598-L1666 PolarHBondContact O-N 2.68Å; V1598-F1668 HydrophobicContact CB-CD2 4.09Å; V1598-F1668 HydrophobicContact CB-CE2 3.58Å; V1598-F1668 HydrophobicContact CB-CZ 4.33Å; V1598-F1668 HydrophobicContact CG1-CE2 4.36Å; V1598-F1668 HydrophobicContact CG2-CD2 3.51Å; V1598-F1668 HydrophobicContact CG2-CE2 3.24Å; V1598-F1668 HydrophobicContact CG2-CG 4.29Å; V1598-F1668 HydrophobicContact CG2-CZ 3.79Å; V1598-I1700 HydrophobicContact CG1-CD1 4.47Å; V1598-I1700 HydrophobicContact CG2-CD1 3.89Å; V1598-L1705 HydrophobicContact CG1-CB 4.16Å
1599	R	76.5	Confident	74.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-58.8	-164.8	-175.2	-167.5	-171.7	48.4	57.6	114.5	I181 Q190 L1606 S1664 Y1706 D1708	I181-R1599 VanDerWaalsContact CG2-CZ 3.43Å; I181-R1599 VanDerWaalsContact CG2-NH1 3.33Å; Q190-R1599 VanDerWaalsContact OE1-CD 3.29Å; R1599-L1606 VanDerWaalsContact O-CB 3.3Å; R1599-L1606 WeakPolarHBondContact O-CB 3.49Å; R1599-L1606 PolarHBondContact O-N 3.07Å; R1599-S1664 PolarHBondContact NH2-O 2.93Å; R1599-S1664 PolarHBondContact NH2-OG 3.37Å; R1599-Y1706 WeakPolarHBondContact CA-O 3.16Å; R1599-Y1706 WeakPolarHBondContact CB-O 3.34Å; R1599-Y1706 PolarHBondContact N-O 2.79Å; R1599-D1708 HydrophobicContact CB-CB 4.02Å; R1599-D1708 WeakPolarHBondContact CD-OD1 3.05Å; R1599-D1708 HydrophobicContact CG-CB 4.44Å; R1599-D1708 IonicContact CZ-OD1 3.32Å; R1599-D1708 IonicContact NE-OD1 2.7Å; R1599-D1708 IonicContact NH1-OD1 2.69Å; R1599-D1708 PolarHBondContact NH1-OD1 3.38Å; R1599-D1708 IonicContact NH1-OD2 2.98Å
1600	R	72	Confident	74.1	Confident	55 Å²	55	56.3 Å²	56.3	21%	0.208	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	156	-171.2	-42.2	-174.8	-171.4	-128.1	0.8	109	E1604 I1605 Y1706	R1600-E1604 CarbonylContact C-O 3.55Å; R1600-E1604 WeakPolarHBondContact CA-O 3.5Å; R1600-E1604 WeakPolarHBondContact CB-O 3.1Å; R1600-I1605 HydrophobicContact CG-CG1 4.45Å; R1600-Y1706 PolarHBondContact N-O 3.22Å; R1600-Y1706 PolarHBondContact O-N 3.46Å
1601	K	78	Confident	73.7	Confident	51 Å²	51	54.1 Å²	54.1	22%	0.222	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114.9	161.1	-171.3	176.7	175.2	-167.3	0	107.2	Q1603 E1604 L1606 T1622 D1704 L1705	K1601-Q1603 PolarHBondContact O-N 2.93Å; K1601-E1604 PolarHBondContact N-O 2.89Å; K1601-E1604 WeakPolarHBondContact O-CB 3.45Å; K1601-E1604 PolarHBondContact O-N 3.09Å; K1601-L1606 HydrophobicContact CB-CD2 4.11Å; K1601-L1606 HydrophobicContact CB-CG 4.42Å; K1601-T1622 HydrophobicContact CD-CG2 3.97Å; K1601-D1704 CarbonylContact C-O 3.41Å; K1601-D1704 VanDerWaalsContact CA-O 3.27Å; K1601-D1704 WeakPolarHBondContact CA-O 3.34Å; K1601-D1704 WeakPolarHBondContact CE-OD2 3.36Å; K1601-D1704 HydrophobicContact CG-CB 4.43Å; K1601-D1704 WeakPolarHBondContact CG-OD2 3.38Å; K1601-D1704 IonicContact NZ-OD2 3.23Å; K1601-L1705 HydrophobicContact CB-CD2 4.47Å; K1601-L1705 HydrophobicContact CD-CD2 4.35Å; K1601-L1705 HydrophobicContact CG-CD2 4.15Å
1602	N	67.4	Low	73.8	Confident	89 Å²	89	53.2 Å²	53.2	48%	0.476	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	-124.3	-161.7	-54.9	-81.5	0	0	0	110.2	D1704 Y1706	N1602-D1704 PolarHBondContact N-O 2.87Å; N1602-D1704 WeakPolarHBondContact ND2-CB 3.28Å; N1602-D1704 PolarHBondContact ND2-OD2 3.34Å; N1602-D1704 WeakPolarHBondContact OD1-CB 3.36Å; N1602-Y1706 WeakPolarHBondContact O-CD2 3.16Å
1603	Q	68.6	Low	73.4	Confident	184 Å²	184	53.5 Å²	53.5	86%	0.86	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-12.5	177.3	-63.4	176.9	-8.2	0	0	113.2	K1601	K1601-Q1603 PolarHBondContact O-N 2.93Å
1604	E	70.1	Confident	72.9	Confident	138 Å²	138	51.4 Å²	51.4	65%	0.645	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	127.5	-175.6	-175.7	177.6	-142.5	0	0	111	R1600 K1601	R1600-E1604 CarbonylContact C-O 3.55Å; R1600-E1604 WeakPolarHBondContact CA-O 3.5Å; R1600-E1604 WeakPolarHBondContact CB-O 3.1Å; K1601-E1604 PolarHBondContact N-O 2.89Å; K1601-E1604 WeakPolarHBondContact O-CB 3.45Å; K1601-E1604 PolarHBondContact O-N 3.09Å
1605	I	76.2	Confident	72.1	Confident	65 Å²	65	51.4 Å²	51.4	33%	0.333	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	125.5	177.3	-61.4	176.8	0	0	0	109	R1600 S1664	R1600-I1605 HydrophobicContact CG-CG1 4.45Å; I1605-S1664 VanDerWaalsContact CG2-CB 3.46Å
1606	L	81.5	Confident	71.1	Confident	11 Å²	11	51.1 Å²	51.1	6%	0.058	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-74.4	143.8	175.6	-62.1	159	0	0	0	109	V1598 R1599 K1601 I1623 S1664 G1665 L1666	V1598-L1606 HydrophobicContact CG1-CD1 3.94Å; R1599-L1606 VanDerWaalsContact O-CB 3.3Å; R1599-L1606 WeakPolarHBondContact O-CB 3.49Å; R1599-L1606 PolarHBondContact O-N 3.07Å; K1601-L1606 HydrophobicContact CB-CD2 4.11Å; K1601-L1606 HydrophobicContact CB-CG 4.42Å; L1606-I1623 HydrophobicContact CD1-CD1 3.67Å; L1606-I1623 HydrophobicContact CD2-CD1 4.29Å; L1606-S1664 CarbonylContact O-C 3.57Å; L1606-S1664 WeakPolarHBondContact O-CA 3.25Å; L1606-G1665 PolarHBondContact O-N 3.41Å; L1606-L1666 HydrophobicContact CB-CD1 4.11Å; L1606-L1666 HydrophobicContact CB-CG 4.32Å; L1606-L1666 HydrophobicContact CD1-CD1 4.08Å; L1606-L1666 HydrophobicContact CD2-CD1 4.29Å; L1606-L1666 HydrophobicContact CG-CD1 4.4Å
1607	H	76.2	Confident	70.2	Confident	97 Å²	97	51 Å²	51	45%	0.449	24%	0.235	S	C	.	.			trans	-126.6	139.7	169.8	-76.4	-98.7	0	0	0	108.8	Y1612	H1607-Y1612 WeakPolarHBondContact O-CE2 3.22Å
1608	Y	75.6	Confident	69	Low	49 Å²	49	51.1 Å²	51.1	19%	0.192	24%	0.235	C	C	.	.			trans	-63.2	146.7	171.3	-178	-96.4	0	0	0	111.8	A1613 R1653 D1654 G1665 L1666	Y1608-A1613 HydrophobicContact CE2-CB 3.92Å; Y1608-A1613 WeakPolarHBondContact OH-CB 3.36Å; Y1608-R1653 WeakPolarHBondContact CD2-O 3.49Å; Y1608-D1654 HydrophobicContact CD1-CB 3.46Å; Y1608-D1654 VanDerWaalsContact CD1-CB 3.46Å; Y1608-D1654 WeakPolarHBondContact CD1-OD2 2.99Å; Y1608-D1654 HydrophobicContact CD2-CB 4.29Å; Y1608-D1654 HydrophobicContact CE1-CB 3.29Å; Y1608-D1654 VanDerWaalsContact CE1-CG 3.46Å; Y1608-D1654 VanDerWaalsContact CE1-OD2 3.29Å; Y1608-D1654 WeakPolarHBondContact CE1-OD2 3.45Å; Y1608-D1654 HydrophobicContact CE2-CB 4.16Å; Y1608-D1654 HydrophobicContact CG-CB 3.91Å; Y1608-D1654 VanDerWaalsContact CZ-N 3.3Å; Y1608-G1665 PolarHBondContact N-O 3.32Å; Y1608-L1666 HydrophobicContact CD2-CD2 4.03Å
1609	N	72	Confident	68.5	Low	69 Å²	69	52.7 Å²	52.7	37%	0.369	25%	0.245	S	C	.	.			trans	-156.3	156.3	-174.2	178.3	-20.2	0	0	0	105.2	S1611 Y1612	N1609-S1611 WeakPolarHBondContact CB-OG 3.32Å; N1609-S1611 PolarHBondContact ND2-OG 3.08Å; N1609-S1611 PolarHBondContact O-N 2.83Å; N1609-S1611 PolarHBondContact OD1-N 3.26Å; N1609-S1611 VanDerWaalsContact OD1-N 3.11Å; N1609-Y1612 HydrophobicContact CB-CD2 4.06Å; N1609-Y1612 HydrophobicContact CB-CE2 4.34Å; N1609-Y1612 PolarHBondContact O-N 3.1Å
1610	R	65.7	Low	68.6	Low	204 Å²	204	53 Å²	53	77%	0.77	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-53.9	-21	169.1	-68.7	-177	180	171.8	0.8	112.4	Y1612 A1613	R1610-Y1612 PolarHBondContact O-N 3.36Å; R1610-A1613 VanDerWaalsContact O-CB 3.31Å; R1610-A1613 WeakPolarHBondContact O-CB 3.46Å; R1610-A1613 PolarHBondContact O-N 2.98Å
1611	S	62.2	Low	68.4	Low	5 Å²	5	50.8 Å²	50.8	4%	0.035	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-68.5	26.5	166.4	77	0	0	0	0	116.7	N683 N1609 S1617	N683-S1611 PolarHBondContact ND2-O 2.78Å; N683-S1611 PolarHBondContact OD1-O 3.47Å; N1609-S1611 WeakPolarHBondContact CB-OG 3.32Å; N1609-S1611 PolarHBondContact ND2-OG 3.08Å; N1609-S1611 PolarHBondContact O-N 2.83Å; N1609-S1611 PolarHBondContact OD1-N 3.26Å; N1609-S1611 VanDerWaalsContact OD1-N 3.11Å; S1611-S1617 PolarHBondContact O-OG 3.35Å
1612	Y	73.6	Confident	68.2	Low	19 Å²	19	48.7 Å²	48.7	8%	0.075	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-143.3	1.3	170.2	-68.2	-82.8	0	0	0	112.5	N683 H1607 N1609 R1610 P1619 I1623 I1652 L1666	N683-Y1612 WeakPolarHBondContact ND2-CD1 3.26Å; N683-Y1612 VanDerWaalsContact ND2-CE1 3.31Å; N683-Y1612 WeakPolarHBondContact ND2-CE1 3.26Å; N683-Y1612 WeakPolarHBondContact OD1-CA 3.02Å; H1607-Y1612 WeakPolarHBondContact O-CE2 3.22Å; N1609-Y1612 HydrophobicContact CB-CD2 4.06Å; N1609-Y1612 HydrophobicContact CB-CE2 4.34Å; N1609-Y1612 PolarHBondContact O-N 3.1Å; R1610-Y1612 PolarHBondContact O-N 3.36Å; Y1612-P1619 HydrophobicContact CE1-CB 4.15Å; Y1612-P1619 WeakPolarHBondContact CE1-O 3.36Å; Y1612-I1623 HydrophobicContact CE1-CG2 4.49Å; Y1612-I1652 VanDerWaalsContact O-CB 3.32Å; Y1612-I1652 WeakPolarHBondContact O-CB 3.03Å; Y1612-L1666 HydrophobicContact CD1-CD1 3.51Å; Y1612-L1666 HydrophobicContact CD1-CD2 3.62Å; Y1612-L1666 HydrophobicContact CD1-CG 4.15Å; Y1612-L1666 HydrophobicContact CD2-CD1 4.49Å; Y1612-L1666 HydrophobicContact CD2-CD2 3.47Å; Y1612-L1666 VanDerWaalsContact CD2-CD2 3.47Å; Y1612-L1666 HydrophobicContact CE1-CD1 3.17Å; Y1612-L1666 HydrophobicContact CE1-CD2 3.95Å; Y1612-L1666 HydrophobicContact CE1-CG 4.18Å; Y1612-L1666 HydrophobicContact CE2-CD1 4.22Å; Y1612-L1666 HydrophobicContact CE2-CD2 3.8Å; Y1612-L1666 HydrophobicContact CG-CD1 4.18Å; Y1612-L1666 HydrophobicContact CG-CD2 3.38Å; Y1612-L1666 HydrophobicContact CG-CG 4.39Å
1613	A	61.3	Low	68.9	Low	19 Å²	19	44.4 Å²	44.4	16%	0.157	21%	0.207	C	C	.	.	S	Bend	trans	-115.4	11.4	-138	0	0	0	0	0	119.7	Y1608 R1610	Y1608-A1613 HydrophobicContact CE2-CB 3.92Å; Y1608-A1613 WeakPolarHBondContact OH-CB 3.36Å; R1610-A1613 VanDerWaalsContact O-CB 3.31Å; R1610-A1613 WeakPolarHBondContact O-CB 3.46Å; R1610-A1613 PolarHBondContact O-N 2.98Å
1614	E	60.7	Low	69.5	Low	17 Å²	17	36.7 Å²	36.7	8%	0.079	17%	0.172	C	C	.	.	S	Bend	trans	-172.4	-113	-159	-151.9	174.7	-86	0	0	106.9	V703 G704 S705 D708 R712 K716	V703-E1614 HydrophobicContact CB-CB 3.77Å; V703-E1614 HydrophobicContact CB-CG 4.4Å; V703-E1614 HydrophobicContact CG1-CB 3.55Å; V703-E1614 HydrophobicContact CG1-CG 3.76Å; V703-E1614 WeakPolarHBondContact CG1-OE2 3.29Å; V703-E1614 HydrophobicContact CG2-CB 4.03Å; V703-E1614 HydrophobicContact CG2-CG 4.37Å; V703-E1614 WeakPolarHBondContact CG2-OE2 3.4Å; G704-E1614 VanDerWaalsContact C-C 3.44Å; G704-E1614 CarbonylContact C-O 3.55Å; G704-E1614 VanDerWaalsContact N-CA 3.33Å; G704-E1614 PolarHBondContact N-O 2.89Å; S705-E1614 WeakPolarHBondContact CB-O 3.34Å; S705-E1614 PolarHBondContact N-O 3.24Å; S705-E1614 PolarHBondContact OG-O 3.19Å; D708-E1614 HydrophobicContact CB-CG 4.31Å; D708-E1614 WeakPolarHBondContact CB-O 3.32Å; R712-E1614 VanDerWaalsContact CB-CD 3.42Å; R712-E1614 HydrophobicContact CB-CG 4.12Å; R712-E1614 VanDerWaalsContact CB-OE2 3.28Å; R712-E1614 WeakPolarHBondContact CB-OE2 3.07Å; R712-E1614 WeakPolarHBondContact CD-OE1 3.17Å; R712-E1614 IonicContact NH1-OE1 2.64Å; K716-E1614 IonicContact NZ-OE1 3.35Å; K716-E1614 PolarHBondContact NZ-OE1 2.84Å; K716-E1614 IonicContact NZ-OE2 2.67Å; K716-E1614 PolarHBondContact NZ-OE2 2.8Å
1615	S	59	Low	69.7	Low	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-122.9	-68.7	167.9	175.4	0	0	0	0	121.3	T682 V703 G704 S705 F706 L709	T682-S1615 VanDerWaalsContact CA-O 3.27Å; T682-S1615 WeakPolarHBondContact CA-O 3.14Å; T682-S1615 PolarHBondContact N-O 3.12Å; T682-S1615 VanDerWaalsContact O-O 3.06Å; V703-S1615 CarbonylContact C-O 3.46Å; V703-S1615 CarbonylContact O-C 3.58Å; G704-S1615 CarbonylContact C-O 3.6Å; G704-S1615 VanDerWaalsContact CA-O 3.25Å; G704-S1615 WeakPolarHBondContact CA-O 3.44Å; S705-S1615 CarbonylContact C-O 3.22Å; S705-S1615 VanDerWaalsContact N-C 3.32Å; S705-S1615 PolarHBondContact N-O 3.38Å; S705-S1615 CarbonylContact O-C 3.58Å; S705-S1615 PolarHBondContact O-OG 3.33Å; S705-S1615 WeakPolarHBondContact OG-CA 3.46Å; S705-S1615 WeakPolarHBondContact OG-CB 3.09Å; F706-S1615 WeakPolarHBondContact CA-OG 3.44Å; L709-S1615 VanDerWaalsContact CA-CB 3.47Å; L709-S1615 WeakPolarHBondContact CB-OG 3.05Å; L709-S1615 PolarHBondContact N-OG 3.44Å
1616	S	52.1	Low	69.9	Low	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-95.3	100.6	-172.1	169.1	0	0	0	0	115.6	V679 G680 V681 F701 I702 V703	V679-S1616 WeakPolarHBondContact CG1-OG 3.19Å; V679-S1616 PolarHBondContact O-OG 3.28Å; G680-S1616 VanDerWaalsContact C-OG 3.25Å; G680-S1616 CarbonylContact O-C 3.08Å; G680-S1616 PolarHBondContact O-OG 2.79Å; V681-S1616 WeakPolarHBondContact CA-OG 3.34Å; V681-S1616 WeakPolarHBondContact CG2-OG 3.05Å; F701-S1616 CarbonylContact C-O 3.54Å; F701-S1616 VanDerWaalsContact C-O 3.29Å; I702-S1616 CarbonylContact C-O 3.34Å; I702-S1616 WeakPolarHBondContact CA-O 3.46Å; I702-S1616 PolarHBondContact N-O 2.03Å; V703-S1616 WeakPolarHBondContact CB-O 3.44Å; V703-S1616 VanDerWaalsContact CG1-N 3.29Å; V703-S1616 PolarHBondContact N-O 3.49Å; V703-S1616 CarbonylContact O-C 3.53Å; V703-S1616 WeakPolarHBondContact O-CA 3.46Å; V703-S1616 PolarHBondContact O-N 3.04Å
1617	S	61.5	Low	70.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.			trans	-141.8	-169.7	171.7	40.1	0	0	0	0	109.9	G680 V681 T682 N683 V703 S1611	G680-S1617 CarbonylContact C-O 3.33Å; G680-S1617 VanDerWaalsContact C-O 3.23Å; G680-S1617 CarbonylContact O-C 3.59Å; G680-S1617 WeakPolarHBondContact O-CA 3.35Å; G680-S1617 PolarHBondContact O-N 3.23Å; V681-S1617 CarbonylContact C-O 3.54Å; T682-S1617 CarbonylContact C-O 3.59Å; T682-S1617 CarbonylContact O-C 3.51Å; T682-S1617 WeakPolarHBondContact O-CA 3.24Å; T682-S1617 PolarHBondContact O-N 3.16Å; T682-S1617 PolarHBondContact O-OG 3.22Å; T682-S1617 VanDerWaalsContact O-OG 3.12Å; N683-S1617 VanDerWaalsContact CA-C 3.47Å; N683-S1617 WeakPolarHBondContact CA-O 3.31Å; N683-S1617 VanDerWaalsContact CB-O 3.27Å; N683-S1617 WeakPolarHBondContact CB-O 3.18Å; N683-S1617 WeakPolarHBondContact CB-OG 3.47Å; N683-S1617 PolarHBondContact N-O 3.18Å; N683-S1617 PolarHBondContact OD1-OG 2.79Å; V703-S1617 VanDerWaalsContact C-OG 3.25Å; V703-S1617 PolarHBondContact N-OG 2.74Å; V703-S1617 WeakPolarHBondContact O-CA 3.45Å; V703-S1617 WeakPolarHBondContact O-CB 3.43Å; V703-S1617 PolarHBondContact O-N 3.44Å; V703-S1617 PolarHBondContact O-OG 2.79Å; S1611-S1617 PolarHBondContact O-OG 3.35Å
1618	E	56.6	Low	70.5	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	14%	0.141	C	C	.	.	S	Bend	trans	-128.8	29.8	178	-76.3	-63.4	-79.6	0	0	126.2	T654 D655 G656 N683 H684 V685 L690	T654-E1618 HydrophobicContact CG2-CG 4.19Å; D655-E1618 WeakPolarHBondContact CA-OE1 3.39Å; D655-E1618 PolarHBondContact N-OE1 2.72Å; D655-E1618 VanDerWaalsContact N-OE1 3.16Å; G656-E1618 PolarHBondContact N-OE1 3.15Å; N683-E1618 CarbonylContact C-O 3.57Å; N683-E1618 VanDerWaalsContact C-O 3.32Å; N683-E1618 VanDerWaalsContact C-OE2 3.27Å; N683-E1618 WeakPolarHBondContact CA-OE2 3.46Å; N683-E1618 CarbonylContact O-C 3.59Å; H684-E1618 CarbonylContact C-O 3.6Å; H684-E1618 WeakPolarHBondContact CA-O 3.39Å; H684-E1618 VanDerWaalsContact CA-OE1 3.3Å; H684-E1618 WeakPolarHBondContact CA-OE1 2.97Å; H684-E1618 VanDerWaalsContact CB-OE1 3.25Å; H684-E1618 WeakPolarHBondContact CB-OE1 3.02Å; H684-E1618 PolarHBondContact N-O 3.01Å; H684-E1618 PolarHBondContact N-OE1 2.84Å; H684-E1618 PolarHBondContact N-OE2 2.92Å; H684-E1618 VanDerWaalsContact O-O 3.07Å; V685-E1618 CarbonylContact C-O 3.58Å; V685-E1618 HydrophobicContact CB-CB 3.41Å; V685-E1618 VanDerWaalsContact CB-CB 3.41Å; V685-E1618 HydrophobicContact CB-CG 3.57Å; V685-E1618 HydrophobicContact CG1-CB 4.46Å; V685-E1618 HydrophobicContact CG2-CB 4.28Å; V685-E1618 HydrophobicContact CG2-CG 3.9Å; V685-E1618 WeakPolarHBondContact CG2-OE1 3.33Å; V685-E1618 VanDerWaalsContact N-CB 3.28Å; V685-E1618 PolarHBondContact N-O 3.44Å; V685-E1618 PolarHBondContact N-OE1 2.81Å; V685-E1618 CarbonylContact O-C 3.55Å; V685-E1618 WeakPolarHBondContact O-CA 3.01Å; V685-E1618 WeakPolarHBondContact O-CB 3.46Å; L690-E1618 HydrophobicContact CD1-CB 3.72Å; L690-E1618 HydrophobicContact CD1-CG 4.05Å; L690-E1618 HydrophobicContact CD2-CG 4.39Å; L690-E1618 HydrophobicContact CG-CB 4.31Å
1619	P	71.9	Confident	70.6	Confident	34 Å²	34	30.8 Å²	30.8	22%	0.221	15%	0.148	C	C	.	.	S	Bend	trans	-122.7	0	142.5	-5.2	28.9	0	0	0	132.2	N683 Y1612 I1623	N683-P1619 VanDerWaalsContact C-C 3.42Å; N683-P1619 WeakPolarHBondContact ND2-CA 3.47Å; N683-P1619 VanDerWaalsContact ND2-CD 3.3Å; N683-P1619 WeakPolarHBondContact ND2-CD 3.21Å; N683-P1619 VanDerWaalsContact ND2-N 3.17Å; N683-P1619 CarbonylContact O-C 3.27Å; N683-P1619 WeakPolarHBondContact O-CA 3.05Å; Y1612-P1619 HydrophobicContact CE1-CB 4.15Å; Y1612-P1619 WeakPolarHBondContact CE1-O 3.36Å; P1619-I1623 WeakPolarHBondContact O-CB 3.4Å
1620	Y	79.3	Confident	71.1	Confident	5 Å²	5	27.5 Å²	27.5	2%	0.02	13%	0.13	C	C	.	.	S	Bend		0	-75	0	-143.8	-45.7	0	0	0	128	T682 N683 G704 S705 T1622 I1623 V1624 K1625 V1649 I1652	T682-Y1620 VanDerWaalsContact CB-CD1 3.42Å; T682-Y1620 HydrophobicContact CG2-CD1 3.76Å; T682-Y1620 HydrophobicContact CG2-CE1 3.8Å; N683-Y1620 VanDerWaalsContact C-C 3.49Å; N683-Y1620 VanDerWaalsContact C-CA 3.45Å; N683-Y1620 VanDerWaalsContact CG-CA 3.45Å; N683-Y1620 VanDerWaalsContact CG-N 3.29Å; N683-Y1620 VanDerWaalsContact N-CA 3.28Å; N683-Y1620 WeakPolarHBondContact ND2-CB 3.44Å; N683-Y1620 PolarHBondContact ND2-N 2.7Å; N683-Y1620 CarbonylContact O-C 3.58Å; N683-Y1620 WeakPolarHBondContact O-CA 3.34Å; N683-Y1620 PolarHBondContact O-N 3.33Å; N683-Y1620 WeakPolarHBondContact OD1-CB 3.47Å; G704-Y1620 WeakPolarHBondContact O-CD2 3.45Å; G704-Y1620 WeakPolarHBondContact O-CE2 3.41Å; S705-Y1620 WeakPolarHBondContact CA-OH 3.28Å; Y1620-T1622 CarbonylContact O-C 3.51Å; Y1620-T1622 VanDerWaalsContact O-C 3.23Å; Y1620-T1622 PolarHBondContact O-N 3.3Å; Y1620-I1623 HydrophobicContact CG-CG2 4.32Å; Y1620-I1623 CarbonylContact O-C 3.17Å; Y1620-I1623 PolarHBondContact O-N 2.72Å; Y1620-V1624 HydrophobicContact CD1-CB 3.24Å; Y1620-V1624 HydrophobicContact CD1-CG1 4.09Å; Y1620-V1624 HydrophobicContact CD1-CG2 3.24Å; Y1620-V1624 HydrophobicContact CD2-CG2 3.89Å; Y1620-V1624 HydrophobicContact CE1-CB 3.24Å; Y1620-V1624 HydrophobicContact CE1-CG1 3.62Å; Y1620-V1624 HydrophobicContact CE1-CG2 3.09Å; Y1620-V1624 HydrophobicContact CE2-CG2 3.72Å; Y1620-V1624 HydrophobicContact CG-CB 4.03Å; Y1620-V1624 HydrophobicContact CG-CG2 3.63Å; Y1620-V1624 VanDerWaalsContact O-CA 3.32Å; Y1620-V1624 WeakPolarHBondContact O-CA 3.34Å; Y1620-V1624 WeakPolarHBondContact O-CB 3.39Å; Y1620-V1624 PolarHBondContact O-N 3.12Å; Y1620-K1625 PolarHBondContact O-N 3.09Å; Y1620-V1649 PolarHBondContact OH-O 3.25Å; Y1620-I1652 HydrophobicContact CD2-CB 4.15Å; Y1620-I1652 HydrophobicContact CD2-CD1 3.37Å; Y1620-I1652 HydrophobicContact CD2-CG1 3.74Å; Y1620-I1652 HydrophobicContact CE2-CB 4.07Å; Y1620-I1652 HydrophobicContact CE2-CD1 3.65Å; Y1620-I1652 HydrophobicContact CE2-CG1 3.54Å; Y1620-I1652 HydrophobicContact CG-CD1 4.09Å
1621	K	68.1	Low	72.1	Confident	10 Å²	10	17.8 Å²	17.8	4%	0.043	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7	156.7	-102.1	174.4	-64.9	167.7	0	113.5	S551 D655 V681 T682 N683 H684 F706 K1625	S551-K1621 WeakPolarHBondContact O-CD 3.48Å; D655-K1621 VanDerWaalsContact CG-NZ 3.34Å; D655-K1621 WeakPolarHBondContact O-CB 3.25Å; D655-K1621 WeakPolarHBondContact OD2-CD 3.22Å; D655-K1621 VanDerWaalsContact OD2-CE 3.3Å; D655-K1621 WeakPolarHBondContact OD2-CE 3.44Å; D655-K1621 IonicContact OD2-NZ 2.73Å; D655-K1621 PolarHBondContact OD2-NZ 2.03Å; V681-K1621 WeakPolarHBondContact O-CE 3.4Å; V681-K1621 PolarHBondContact O-NZ 2.96Å; T682-K1621 HydrophobicContact CG2-CG 4.32Å; T682-K1621 WeakPolarHBondContact OG1-CB 3.31Å; T682-K1621 WeakPolarHBondContact OG1-CE 3.28Å; T682-K1621 WeakPolarHBondContact OG1-CG 3.21Å; T682-K1621 PolarHBondContact OG1-N 3.25Å; N683-K1621 PolarHBondContact O-N 3Å; H684-K1621 HydrophobicContact CB-CB 3.84Å; H684-K1621 VanDerWaalsContact CD2-C 3.44Å; H684-K1621 PolarHBondContact CD2-O 3.36Å; H684-K1621 VanDerWaalsContact CD2-O 3.24Å; F706-K1621 HydrophobicContact CE2-CD 4.12Å; F706-K1621 HydrophobicContact CZ-CD 4.25Å; K1621-K1625 HydrophobicContact CG-CB 4.3Å; K1621-K1625 VanDerWaalsContact O-CB 3.22Å; K1621-K1625 WeakPolarHBondContact O-CB 3.33Å
1622	T	71.8	Confident	73	Confident	6 Å²	6	17.9 Å²	17.9	4%	0.037	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-79.6	134.8	-63.2	0	0	0	0	107.5	N683 H684 K1601 Y1620 V1624 K1625 T1626	N683-T1622 PolarHBondContact O-N 3.13Å; H684-T1622 VanDerWaalsContact CG-N 3.32Å; H684-T1622 PolarHBondContact ND1-OG1 3.34Å; H684-T1622 VanDerWaalsContact ND1-OG1 3.12Å; K1601-T1622 HydrophobicContact CD-CG2 3.97Å; Y1620-T1622 CarbonylContact O-C 3.51Å; Y1620-T1622 VanDerWaalsContact O-C 3.23Å; Y1620-T1622 PolarHBondContact O-N 3.3Å; T1622-V1624 PolarHBondContact O-N 2.56Å; T1622-K1625 PolarHBondContact O-N 2.85Å; T1622-T1626 WeakPolarHBondContact O-CA 3.07Å; T1622-T1626 WeakPolarHBondContact O-CB 3.32Å; T1622-T1626 PolarHBondContact O-N 2.67Å; T1622-T1626 PolarHBondContact O-OG1 2.77Å
1623	I	83.3	Confident	73.3	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.8	-47.5	-151.1	-124.7	-179.8	0	0	0	115.1	V1598 L1606 Y1612 P1619 Y1620 F1627 I1652 L1666 F1668 L1705	V1598-I1623 HydrophobicContact CG1-CD1 4.22Å; L1606-I1623 HydrophobicContact CD1-CD1 3.67Å; L1606-I1623 HydrophobicContact CD2-CD1 4.29Å; Y1612-I1623 HydrophobicContact CE1-CG2 4.49Å; P1619-I1623 WeakPolarHBondContact O-CB 3.4Å; Y1620-I1623 HydrophobicContact CG-CG2 4.32Å; Y1620-I1623 CarbonylContact O-C 3.17Å; Y1620-I1623 PolarHBondContact O-N 2.72Å; I1623-F1627 WeakPolarHBondContact O-CA 3.4Å; I1623-F1627 WeakPolarHBondContact O-CB 3.47Å; I1623-F1627 PolarHBondContact O-N 3.12Å; I1623-I1652 HydrophobicContact CG2-CD1 3.37Å; I1623-L1666 HydrophobicContact CD1-CD1 3.3Å; I1623-F1668 HydrophobicContact CB-CZ 3.79Å; I1623-F1668 HydrophobicContact CD1-CE2 4.06Å; I1623-F1668 HydrophobicContact CD1-CZ 3.94Å; I1623-F1668 HydrophobicContact CG1-CE2 4.34Å; I1623-F1668 HydrophobicContact CG1-CZ 3.72Å; I1623-F1668 HydrophobicContact CG2-CE1 3.8Å; I1623-F1668 HydrophobicContact CG2-CE2 3.82Å; I1623-F1668 HydrophobicContact CG2-CZ 3.17Å; I1623-L1705 HydrophobicContact CD1-CD2 3.99Å; I1623-L1705 HydrophobicContact CG1-CD1 3.78Å; I1623-L1705 HydrophobicContact CG1-CD2 3.4Å; I1623-L1705 HydrophobicContact CG1-CG 4.23Å; I1623-L1705 VanDerWaalsContact O-CD1 3.27Å; I1623-L1705 WeakPolarHBondContact O-CD1 3.37Å
1624	V	80.9	Confident	74.4	Confident	21 Å²	21	20.3 Å²	20.3	13%	0.127	10%	0.103	C	C	.	.	H	α-helix	trans	-72.7	-29.6	168.6	169.9	0	0	0	0	116.4	Y1620 T1622 H1628 V1649 I1652 F1668	Y1620-V1624 HydrophobicContact CD1-CB 3.24Å; Y1620-V1624 HydrophobicContact CD1-CG1 4.09Å; Y1620-V1624 HydrophobicContact CD1-CG2 3.24Å; Y1620-V1624 HydrophobicContact CD2-CG2 3.89Å; Y1620-V1624 HydrophobicContact CE1-CB 3.24Å; Y1620-V1624 HydrophobicContact CE1-CG1 3.62Å; Y1620-V1624 HydrophobicContact CE1-CG2 3.09Å; Y1620-V1624 HydrophobicContact CE2-CG2 3.72Å; Y1620-V1624 HydrophobicContact CG-CB 4.03Å; Y1620-V1624 HydrophobicContact CG-CG2 3.63Å; Y1620-V1624 VanDerWaalsContact O-CA 3.32Å; Y1620-V1624 WeakPolarHBondContact O-CA 3.34Å; Y1620-V1624 WeakPolarHBondContact O-CB 3.39Å; Y1620-V1624 PolarHBondContact O-N 3.12Å; T1622-V1624 PolarHBondContact O-N 2.56Å; V1624-H1628 WeakPolarHBondContact O-CA 3.23Å; V1624-H1628 WeakPolarHBondContact O-CB 3.06Å; V1624-H1628 PolarHBondContact O-N 2.74Å; V1624-V1649 HydrophobicContact CB-CB 4.35Å; V1624-V1649 HydrophobicContact CB-CG2 4.12Å; V1624-V1649 HydrophobicContact CG1-CB 3.74Å; V1624-V1649 HydrophobicContact CG1-CG2 3.49Å; V1624-V1649 VanDerWaalsContact CG1-CG2 3.49Å; V1624-V1649 HydrophobicContact CG2-CB 3.66Å; V1624-V1649 HydrophobicContact CG2-CG1 3.62Å; V1624-V1649 HydrophobicContact CG2-CG2 3.66Å; V1624-I1652 HydrophobicContact CG2-CD1 3.97Å; V1624-F1668 HydrophobicContact CG2-CD1 3.94Å; V1624-F1668 HydrophobicContact CG2-CE1 3.65Å
1625	K	73.7	Confident	75.5	Confident	72 Å²	72	19.5 Å²	19.5	31%	0.313	10%	0.099	S	C	.	.	H	α-helix	trans	-72.9	-46.7	171.7	-168.8	-179.3	170.8	174.9	0	110.4	G550 Y1620 K1621 T1622 F1627 H1628 D1629	G550-K1625 PolarHBondContact O-NZ 3.28Å; Y1620-K1625 PolarHBondContact O-N 3.09Å; K1621-K1625 HydrophobicContact CG-CB 4.3Å; K1621-K1625 VanDerWaalsContact O-CB 3.22Å; K1621-K1625 WeakPolarHBondContact O-CB 3.33Å; T1622-K1625 PolarHBondContact O-N 2.85Å; K1625-F1627 PolarHBondContact O-N 3.43Å; K1625-H1628 PolarHBondContact O-N 3.44Å; K1625-D1629 VanDerWaalsContact O-CB 3.29Å; K1625-D1629 WeakPolarHBondContact O-CB 3.4Å; K1625-D1629 VanDerWaalsContact O-CG 3.25Å; K1625-D1629 PolarHBondContact O-N 3.13Å
1626	T	80.1	Confident	76.4	Confident	31 Å²	31	24.5 Å²	24.5	19%	0.19	12%	0.122	C	C	.	.	H	α-helix	trans	-63.9	-30.4	175.2	-54.2	0	0	0	0	111.3	T1622 G1630 T1703 L1705	T1622-T1626 WeakPolarHBondContact O-CA 3.07Å; T1622-T1626 WeakPolarHBondContact O-CB 3.32Å; T1622-T1626 PolarHBondContact O-N 2.67Å; T1622-T1626 PolarHBondContact O-OG1 2.77Å; T1626-G1630 VanDerWaalsContact O-CA 3.26Å; T1626-G1630 WeakPolarHBondContact O-CA 3.44Å; T1626-G1630 PolarHBondContact O-N 3.24Å; T1626-T1703 HydrophobicContact CG2-CG2 3.75Å; T1626-T1703 WeakPolarHBondContact O-CG2 3.26Å; T1626-L1705 HydrophobicContact CG2-CD1 3.85Å; T1626-L1705 HydrophobicContact CG2-CD2 4.49Å; T1626-L1705 HydrophobicContact CG2-CG 3.71Å
1627	F	87.9	Confident	77.5	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-79.3	-38	171	-179.2	-84.2	0	0	0	112	L1596 V1598 I1623 K1625 G1630 I1631 V1649 F1668 F1670 I1700 L1705	L1596-F1627 HydrophobicContact CB-CE2 3.91Å; L1596-F1627 HydrophobicContact CB-CZ 4.05Å; L1596-F1627 HydrophobicContact CD1-CE2 3.71Å; L1596-F1627 HydrophobicContact CD1-CZ 3.84Å; L1596-F1627 HydrophobicContact CG-CE2 4.45Å; L1596-F1627 HydrophobicContact CG-CZ 4.47Å; V1598-F1627 HydrophobicContact CG2-CD2 3.86Å; V1598-F1627 HydrophobicContact CG2-CE2 3.7Å; I1623-F1627 WeakPolarHBondContact O-CA 3.4Å; I1623-F1627 WeakPolarHBondContact O-CB 3.47Å; I1623-F1627 PolarHBondContact O-N 3.12Å; K1625-F1627 PolarHBondContact O-N 3.43Å; F1627-G1630 CarbonylContact O-C 3.56Å; F1627-G1630 PolarHBondContact O-N 3.2Å; F1627-I1631 HydrophobicContact CD1-CD1 4.43Å; F1627-I1631 HydrophobicContact CD1-CG1 3.61Å; F1627-I1631 HydrophobicContact CE1-CD1 4.19Å; F1627-I1631 HydrophobicContact CE1-CG1 3.73Å; F1627-I1631 HydrophobicContact CG-CG1 4.06Å; F1627-I1631 HydrophobicContact CZ-CD1 4.28Å; F1627-I1631 HydrophobicContact CZ-CG1 4.29Å; F1627-I1631 WeakPolarHBondContact O-CA 3.04Å; F1627-I1631 WeakPolarHBondContact O-CB 3.3Å; F1627-I1631 WeakPolarHBondContact O-CG1 3.05Å; F1627-I1631 PolarHBondContact O-N 2.96Å; F1627-V1649 HydrophobicContact CD1-CG2 3.99Å; F1627-V1649 HydrophobicContact CE1-CG2 3.98Å; F1627-F1668 HydrophobicContact CB-CD1 4.34Å; F1627-F1668 HydrophobicContact CB-CE1 3.55Å; F1627-F1668 HydrophobicContact CB-CZ 4.17Å; F1627-F1668 AromaticContact CD1-CD1 3.68Å; F1627-F1668 HydrophobicContact CD1-CD1 3.68Å; F1627-F1668 AromaticContact CD1-CE1 3.78Å; F1627-F1668 HydrophobicContact CD1-CE1 3.78Å; F1627-F1668 AromaticContact CD2-CD1 3.55Å; F1627-F1668 HydrophobicContact CD2-CD1 3.55Å; F1627-F1668 AromaticContact CD2-CE1 3.3Å; F1627-F1668 HydrophobicContact CD2-CE1 3.3Å; F1627-F1668 HydrophobicContact CD2-CE2 4.38Å; F1627-F1668 HydrophobicContact CD2-CG 4.13Å; F1627-F1668 AromaticContact CD2-CZ 3.72Å; F1627-F1668 HydrophobicContact CD2-CZ 3.72Å; F1627-F1668 HydrophobicContact CE1-CB 4.32Å; F1627-F1668 AromaticContact CE1-CD1 3.55Å; F1627-F1668 HydrophobicContact CE1-CD1 3.55Å; F1627-F1668 HydrophobicContact CE1-CE1 4.12Å; F1627-F1668 HydrophobicContact CE1-CG 4.28Å; F1627-F1668 HydrophobicContact CE2-CB 3.98Å; F1627-F1668 AromaticContact CE2-CD1 3.41Å; F1627-F1668 HydrophobicContact CE2-CD1 3.41Å; F1627-F1668 VanDerWaalsContact CE2-CD1 3.41Å; F1627-F1668 HydrophobicContact CE2-CD2 4.16Å; F1627-F1668 AromaticContact CE2-CE1 3.69Å; F1627-F1668 HydrophobicContact CE2-CE1 3.69Å; F1627-F1668 HydrophobicContact CE2-CE2 4.43Å; F1627-F1668 AromaticContact CE2-CG 3.62Å; F1627-F1668 HydrophobicContact CE2-CG 3.62Å; F1627-F1668 HydrophobicContact CE2-CZ 4.16Å; F1627-F1668 AromaticContact CG-CD1 3.67Å; F1627-F1668 HydrophobicContact CG-CD1 3.67Å; F1627-F1668 AromaticContact CG-CE1 3.34Å; F1627-F1668 HydrophobicContact CG-CE1 3.34Å; F1627-F1668 HydrophobicContact CG-CZ 4.12Å; F1627-F1668 HydrophobicContact CZ-CB 3.63Å; F1627-F1668 AromaticContact CZ-CD1 3.39Å; F1627-F1668 HydrophobicContact CZ-CD1 3.39Å; F1627-F1668 HydrophobicContact CZ-CE1 4.06Å; F1627-F1668 AromaticContact CZ-CG 3.69Å; F1627-F1668 HydrophobicContact CZ-CG 3.69Å; F1627-F1670 HydrophobicContact CE1-CB 4.16Å; F1627-F1670 AromaticContact CE1-CD1 3.43Å; F1627-F1670 HydrophobicContact CE1-CD1 3.43Å; F1627-F1670 VanDerWaalsContact CE1-CD1 3.43Å; F1627-F1670 AromaticContact CE1-CD2 3.97Å; F1627-F1670 HydrophobicContact CE1-CD2 3.97Å; F1627-F1670 AromaticContact CE1-CE1 3.57Å; F1627-F1670 HydrophobicContact CE1-CE1 3.57Å; F1627-F1670 HydrophobicContact CE1-CE2 4.13Å; F1627-F1670 AromaticContact CE1-CG 3.61Å; F1627-F1670 HydrophobicContact CE1-CG 3.61Å; F1627-F1670 AromaticContact CE1-CZ 3.94Å; F1627-F1670 HydrophobicContact CE1-CZ 3.94Å; F1627-F1670 HydrophobicContact CE2-CE1 4.46Å; F1627-F1670 AromaticContact CZ-CD1 3.35Å; F1627-F1670 HydrophobicContact CZ-CD1 3.35Å; F1627-F1670 AromaticContact CZ-CE1 3.29Å; F1627-F1670 HydrophobicContact CZ-CE1 3.29Å; F1627-F1670 HydrophobicContact CZ-CG 4.04Å; F1627-F1670 AromaticContact CZ-CZ 4Å; F1627-F1670 HydrophobicContact CZ-CZ 4Å; F1627-I1700 HydrophobicContact CD2-CD1 3.49Å; F1627-I1700 VanDerWaalsContact CD2-CD1 3.49Å; F1627-I1700 HydrophobicContact CE2-CD1 3.97Å; F1627-I1700 HydrophobicContact CG-CD1 4.49Å; F1627-L1705 HydrophobicContact CB-CD1 3.86Å
1628	H	83	Confident	78.5	Confident	70 Å²	70	31 Å²	31	32%	0.324	15%	0.148	S	C	.	.	H	α-helix	trans	-64.6	-48.2	174.2	178.3	-73.6	0	0	0	110.6	V1624 K1625 G1630 I1631 G1632 N1647	V1624-H1628 WeakPolarHBondContact O-CA 3.23Å; V1624-H1628 WeakPolarHBondContact O-CB 3.06Å; V1624-H1628 PolarHBondContact O-N 2.74Å; K1625-H1628 PolarHBondContact O-N 3.44Å; H1628-G1630 VanDerWaalsContact C-N 3.28Å; H1628-G1630 PolarHBondContact O-N 2.93Å; H1628-I1631 PolarHBondContact O-N 2.78Å; H1628-G1632 PolarHBondContact O-N 3.42Å; H1628-N1647 WeakPolarHBondContact CA-OD1 3.19Å; H1628-N1647 VanDerWaalsContact CD2-CG 3.49Å; H1628-N1647 PolarHBondContact CD2-ND2 2.82Å; H1628-N1647 PolarHBondContact CD2-O 3.29Å; H1628-N1647 PolarHBondContact CD2-OD1 2.8Å; H1628-N1647 PolarHBondContact NE2-O 2.89Å
1629	D	78	Confident	79.3	Confident	64 Å²	64	35 Å²	35	34%	0.342	17%	0.169	S	C	.	.	H	α-helix	trans	-64.6	-33.6	173.2	-64.6	-8.1	0	0	0	111.3	K1625 K1633	K1625-D1629 VanDerWaalsContact O-CB 3.29Å; K1625-D1629 WeakPolarHBondContact O-CB 3.4Å; K1625-D1629 VanDerWaalsContact O-CG 3.25Å; K1625-D1629 PolarHBondContact O-N 3.13Å; D1629-K1633 VanDerWaalsContact O-CB 3.25Å; D1629-K1633 WeakPolarHBondContact O-CB 3.23Å; D1629-K1633 WeakPolarHBondContact O-CD 3.4Å; D1629-K1633 WeakPolarHBondContact O-CG 3.39Å; D1629-K1633 PolarHBondContact O-N 2.92Å
1630	G	83.2	Confident	79.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-75.5	-36.7	177.1	0	0	0	0	0	113.6	T1626 F1627 H1628 A1634 G1701	T1626-G1630 VanDerWaalsContact O-CA 3.26Å; T1626-G1630 WeakPolarHBondContact O-CA 3.44Å; T1626-G1630 PolarHBondContact O-N 3.24Å; F1627-G1630 CarbonylContact O-C 3.56Å; F1627-G1630 PolarHBondContact O-N 3.2Å; H1628-G1630 VanDerWaalsContact C-N 3.28Å; H1628-G1630 PolarHBondContact O-N 2.93Å; G1630-A1634 WeakPolarHBondContact O-CB 3.22Å; G1630-A1634 PolarHBondContact O-N 3.46Å; G1630-G1701 VanDerWaalsContact O-CA 3.29Å; G1630-G1701 WeakPolarHBondContact O-CA 3.39Å; G1630-G1701 PolarHBondContact O-N 3.24Å
1631	I	86.6	Confident	79.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-69.6	-43.9	173.7	-73	-62.8	0	0	0	108	L1596 F1627 H1628 A1634 F1635 Y1644 N1647 F1670 L1689 I1700	L1596-I1631 HydrophobicContact CD1-CD1 4.01Å; F1627-I1631 HydrophobicContact CD1-CD1 4.43Å; F1627-I1631 HydrophobicContact CD1-CG1 3.61Å; F1627-I1631 HydrophobicContact CE1-CD1 4.19Å; F1627-I1631 HydrophobicContact CE1-CG1 3.73Å; F1627-I1631 HydrophobicContact CG-CG1 4.06Å; F1627-I1631 HydrophobicContact CZ-CD1 4.28Å; F1627-I1631 HydrophobicContact CZ-CG1 4.29Å; F1627-I1631 WeakPolarHBondContact O-CA 3.04Å; F1627-I1631 WeakPolarHBondContact O-CB 3.3Å; F1627-I1631 WeakPolarHBondContact O-CG1 3.05Å; F1627-I1631 PolarHBondContact O-N 2.96Å; H1628-I1631 PolarHBondContact O-N 2.78Å; I1631-A1634 PolarHBondContact O-N 2.7Å; I1631-F1635 HydrophobicContact CG2-CD2 3.58Å; I1631-F1635 HydrophobicContact CG2-CE2 3.51Å; I1631-F1635 VanDerWaalsContact O-CD2 3.22Å; I1631-F1635 WeakPolarHBondContact O-CD2 3.48Å; I1631-F1635 PolarHBondContact O-N 3.12Å; I1631-Y1644 HydrophobicContact CG2-CE2 4.4Å; I1631-N1647 HydrophobicContact CG2-CB 4.34Å; I1631-N1647 WeakPolarHBondContact CG2-OD1 3.2Å; I1631-F1670 HydrophobicContact CD1-CE1 4.3Å; I1631-F1670 HydrophobicContact CD1-CE2 4.09Å; I1631-F1670 HydrophobicContact CD1-CZ 3.56Å; I1631-F1670 HydrophobicContact CG1-CE2 4.12Å; I1631-F1670 HydrophobicContact CG1-CZ 4.06Å; I1631-F1670 HydrophobicContact CG2-CE2 4.13Å; I1631-L1689 HydrophobicContact CD1-CD1 3.64Å; I1631-L1689 HydrophobicContact CD1-CD2 3.73Å; I1631-L1689 HydrophobicContact CD1-CG 4.21Å; I1631-I1700 HydrophobicContact CD1-CG2 4.19Å; I1631-I1700 HydrophobicContact CG1-CG2 4.43Å
1632	G	80.5	Confident	79.8	Confident	6 Å²	6	40.5 Å²	40.5	6%	0.062	20%	0.197	C	C	.	.	H	α-helix	trans	-54.5	-58.4	168.9	0	0	0	0	0	111.7	H1628 A1634 F1635 E1636	H1628-G1632 PolarHBondContact O-N 3.42Å; G1632-A1634 PolarHBondContact O-N 2.95Å; G1632-F1635 CarbonylContact O-C 3.57Å; G1632-F1635 PolarHBondContact O-N 3.13Å; G1632-E1636 WeakPolarHBondContact O-CG 3.4Å; G1632-E1636 PolarHBondContact O-N 2.71Å
1633	K	78.9	Confident	80	Confident	90 Å²	90	41.6 Å²	41.6	39%	0.391	20%	0.202	S	C	.	.	H	α-helix	trans	-63.8	-18.2	176.2	-73.5	167.1	-176.9	166.1	0	115.1	D1629 R1637	D1629-K1633 VanDerWaalsContact O-CB 3.25Å; D1629-K1633 WeakPolarHBondContact O-CB 3.23Å; D1629-K1633 WeakPolarHBondContact O-CD 3.4Å; D1629-K1633 WeakPolarHBondContact O-CG 3.39Å; D1629-K1633 PolarHBondContact O-N 2.92Å; K1633-R1637 WeakPolarHBondContact O-CG 3.42Å; K1633-R1637 PolarHBondContact O-NE 2.82Å
1634	A	84.6	Confident	79.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-78.9	-49.8	169.7	0	0	0	0	0	109.2	G1630 I1631 G1632 E1636 R1637 T1638 L1689 S1692 I1693	G1630-A1634 WeakPolarHBondContact O-CB 3.22Å; G1630-A1634 PolarHBondContact O-N 3.46Å; I1631-A1634 PolarHBondContact O-N 2.7Å; G1632-A1634 PolarHBondContact O-N 2.95Å; A1634-E1636 VanDerWaalsContact C-N 3.32Å; A1634-E1636 PolarHBondContact O-N 3.05Å; A1634-R1637 WeakPolarHBondContact O-CB 2.91Å; A1634-R1637 PolarHBondContact O-N 3.19Å; A1634-T1638 WeakPolarHBondContact O-CG2 3.3Å; A1634-L1689 HydrophobicContact CB-CD1 3.64Å; A1634-S1692 VanDerWaalsContact CA-OG 3.28Å; A1634-S1692 WeakPolarHBondContact CA-OG 3.39Å; A1634-S1692 WeakPolarHBondContact O-CB 3.38Å; A1634-S1692 PolarHBondContact O-OG 2.72Å; A1634-S1692 VanDerWaalsContact O-OG 3.11Å; A1634-I1693 HydrophobicContact CB-CG1 4.36Å
1635	F	84.5	Confident	79.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-33.3	175.6	-77.8	-60.9	0	0	0	113.1	L1594 I1631 G1632 R1637 T1638 L1640 W1641 Y1644 T1672 F1674 L1689	L1594-F1635 HydrophobicContact CD1-CZ 4.3Å; I1631-F1635 HydrophobicContact CG2-CD2 3.58Å; I1631-F1635 HydrophobicContact CG2-CE2 3.51Å; I1631-F1635 VanDerWaalsContact O-CD2 3.22Å; I1631-F1635 WeakPolarHBondContact O-CD2 3.48Å; I1631-F1635 PolarHBondContact O-N 3.12Å; G1632-F1635 CarbonylContact O-C 3.57Å; G1632-F1635 PolarHBondContact O-N 3.13Å; F1635-R1637 PolarHBondContact O-N 2.97Å; F1635-R1637 VanDerWaalsContact O-N 3.12Å; F1635-T1638 WeakPolarHBondContact CA-OG1 3.2Å; F1635-T1638 HydrophobicContact CD1-CG2 4.42Å; F1635-T1638 WeakPolarHBondContact O-CA 3.22Å; F1635-T1638 WeakPolarHBondContact O-CB 3.3Å; F1635-T1638 PolarHBondContact O-N 3.4Å; F1635-T1638 VanDerWaalsContact O-O 3.11Å; F1635-T1638 PolarHBondContact O-OG1 2.78Å; F1635-L1640 HydrophobicContact CD1-CB 4.21Å; F1635-L1640 HydrophobicContact CD1-CD1 4.5Å; F1635-L1640 HydrophobicContact CE1-CD1 4.1Å; F1635-W1641 HydrophobicContact CB-CE3 4.18Å; F1635-W1641 WeakPolarHBondContact O-CB 3.32Å; F1635-Y1644 HydrophobicContact CB-CD2 4.34Å; F1635-Y1644 AromaticContact CD2-CD2 3.65Å; F1635-Y1644 HydrophobicContact CD2-CD2 3.65Å; F1635-Y1644 AromaticContact CD2-CE2 3.69Å; F1635-Y1644 HydrophobicContact CD2-CE2 3.69Å; F1635-Y1644 HydrophobicContact CE2-CD2 4.21Å; F1635-Y1644 HydrophobicContact CE2-CE2 4.19Å; F1635-Y1644 HydrophobicContact CG-CD2 4.12Å; F1635-T1672 HydrophobicContact CD2-CG2 4.38Å; F1635-T1672 HydrophobicContact CE2-CG2 3.66Å; F1635-T1672 HydrophobicContact CZ-CG2 3.99Å; F1635-F1674 HydrophobicContact CE1-CE1 4.41Å; F1635-F1674 AromaticContact CE1-CZ 3.99Å; F1635-F1674 HydrophobicContact CE1-CZ 3.99Å; F1635-F1674 AromaticContact CZ-CZ 3.97Å; F1635-F1674 HydrophobicContact CZ-CZ 3.97Å; F1635-L1689 HydrophobicContact CE1-CB 4.37Å; F1635-L1689 HydrophobicContact CE2-CD1 4.18Å; F1635-L1689 HydrophobicContact CZ-CB 4.26Å; F1635-L1689 HydrophobicContact CZ-CD1 4.26Å; F1635-L1689 HydrophobicContact CZ-CD2 4.42Å
1636	E	77.5	Confident	80.2	Confident	104 Å²	104	39.7 Å²	39.7	49%	0.486	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-29.2	169.7	-78.9	176	-179.9	0	0	113	G1632 A1634 W1641	G1632-E1636 WeakPolarHBondContact O-CG 3.4Å; G1632-E1636 PolarHBondContact O-N 2.71Å; A1634-E1636 VanDerWaalsContact C-N 3.32Å; A1634-E1636 PolarHBondContact O-N 3.05Å; E1636-W1641 HydrophobicContact CB-CD2 4.34Å; E1636-W1641 HydrophobicContact CB-CE3 4.36Å; E1636-W1641 HydrophobicContact CG-CD2 3.73Å; E1636-W1641 HydrophobicContact CG-CE3 3.71Å; E1636-W1641 HydrophobicContact CG-CG 4.47Å; E1636-W1641 HydrophobicContact CG-CH2 3.78Å; E1636-W1641 HydrophobicContact CG-CZ2 3.81Å; E1636-W1641 HydrophobicContact CG-CZ3 3.74Å
1637	R	76.2	Confident	80.3	Confident	123 Å²	123	38.9 Å²	38.9	46%	0.464	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	9.2	177.8	-52.7	175.1	-162.8	-139.5	6.5	112.9	K1633 A1634 F1635 G1701	K1633-R1637 WeakPolarHBondContact O-CG 3.42Å; K1633-R1637 PolarHBondContact O-NE 2.82Å; A1634-R1637 WeakPolarHBondContact O-CB 2.91Å; A1634-R1637 PolarHBondContact O-N 3.19Å; F1635-R1637 PolarHBondContact O-N 2.97Å; F1635-R1637 VanDerWaalsContact O-N 3.12Å; R1637-G1701 PolarHBondContact NH2-O 3.32Å
1638	T	81.2	Confident	79.6	Confident	14 Å²	14	41.8 Å²	41.8	9%	0.086	21%	0.208	C	C	.	.	S	Bend	trans	-118.3	163	177.1	73.4	0	0	0	0	110.7	A1634 F1635 L1640 W1641 Q1688	A1634-T1638 WeakPolarHBondContact O-CG2 3.3Å; F1635-T1638 WeakPolarHBondContact CA-OG1 3.2Å; F1635-T1638 HydrophobicContact CD1-CG2 4.42Å; F1635-T1638 WeakPolarHBondContact O-CA 3.22Å; F1635-T1638 WeakPolarHBondContact O-CB 3.3Å; F1635-T1638 PolarHBondContact O-N 3.4Å; F1635-T1638 VanDerWaalsContact O-O 3.11Å; F1635-T1638 PolarHBondContact O-OG1 2.78Å; T1638-L1640 PolarHBondContact O-N 2.68Å; T1638-L1640 VanDerWaalsContact O-N 3.17Å; T1638-L1640 PolarHBondContact OG1-N 2.88Å; T1638-W1641 PolarHBondContact O-N 2.88Å; T1638-Q1688 HydrophobicContact CG2-CB 3.79Å; T1638-Q1688 WeakPolarHBondContact CG2-O 3.49Å
1639	N	74	Confident	79.4	Confident	84 Å²	84	39 Å²	39	45%	0.449	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-11.1	179.6	-59	-20.7	0	0	0	112.5	V234	V234-N1639 WeakPolarHBondContact CG1-ND2 3.39Å
1640	L	80.8	Confident	78.8	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.4	-179.4	-58.8	176.2	0	0	0	114.1	F1635 T1638 S1642 Q1643 Y1644 F1674 Y1678 P1680 A1685 Q1688	F1635-L1640 HydrophobicContact CD1-CB 4.21Å; F1635-L1640 HydrophobicContact CD1-CD1 4.5Å; F1635-L1640 HydrophobicContact CE1-CD1 4.1Å; T1638-L1640 PolarHBondContact O-N 2.68Å; T1638-L1640 VanDerWaalsContact O-N 3.17Å; T1638-L1640 PolarHBondContact OG1-N 2.88Å; L1640-S1642 VanDerWaalsContact C-N 3.32Å; L1640-S1642 PolarHBondContact O-N 2.82Å; L1640-Q1643 PolarHBondContact O-N 2.83Å; L1640-Y1644 PolarHBondContact O-N 3.04Å; L1640-Y1644 VanDerWaalsContact O-N 3.14Å; L1640-F1674 HydrophobicContact CB-CE1 3.96Å; L1640-F1674 HydrophobicContact CD1-CE1 4.23Å; L1640-F1674 HydrophobicContact CD1-CZ 4.21Å; L1640-Y1678 HydrophobicContact CD2-CE1 4.23Å; L1640-P1680 HydrophobicContact CD1-CB 3.93Å; L1640-P1680 HydrophobicContact CD1-CG 4.27Å; L1640-P1680 HydrophobicContact CD2-CB 3.82Å; L1640-P1680 HydrophobicContact CD2-CG 4.19Å; L1640-A1685 HydrophobicContact CD1-CB 4.46Å; L1640-Q1688 HydrophobicContact CD1-CB 4.5Å
1641	W	77.2	Confident	78.3	Confident	90 Å²	90	42 Å²	42	34%	0.341	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-50.3	-49	-177.5	179.7	-119.9	0	0	0	113.2	H1580 F1635 E1636 T1638 Q1643 Y1644	H1580-W1641 PolarHBondContact CE1-O 3.33Å; H1580-W1641 PolarHBondContact ND1-O 2.88Å; F1635-W1641 HydrophobicContact CB-CE3 4.18Å; F1635-W1641 WeakPolarHBondContact O-CB 3.32Å; E1636-W1641 HydrophobicContact CB-CD2 4.34Å; E1636-W1641 HydrophobicContact CB-CE3 4.36Å; E1636-W1641 HydrophobicContact CG-CD2 3.73Å; E1636-W1641 HydrophobicContact CG-CE3 3.71Å; E1636-W1641 HydrophobicContact CG-CG 4.47Å; E1636-W1641 HydrophobicContact CG-CH2 3.78Å; E1636-W1641 HydrophobicContact CG-CZ2 3.81Å; E1636-W1641 HydrophobicContact CG-CZ3 3.74Å; T1638-W1641 PolarHBondContact O-N 2.88Å; W1641-Q1643 PolarHBondContact O-N 3Å; W1641-Y1644 AromaticContact CE3-CD1 3.94Å; W1641-Y1644 HydrophobicContact CE3-CD1 3.94Å; W1641-Y1644 HydrophobicContact CE3-CG 4.34Å; W1641-Y1644 HydrophobicContact CH2-CD1 4.28Å; W1641-Y1644 HydrophobicContact CH2-CE1 4.45Å; W1641-Y1644 AromaticContact CZ3-CD1 3.5Å; W1641-Y1644 HydrophobicContact CZ3-CD1 3.5Å; W1641-Y1644 AromaticContact CZ3-CE1 3.8Å; W1641-Y1644 HydrophobicContact CZ3-CE1 3.8Å; W1641-Y1644 HydrophobicContact CZ3-CG 4.3Å; W1641-Y1644 WeakPolarHBondContact O-CB 3.15Å; W1641-Y1644 PolarHBondContact O-N 3.28Å; W1641-Y1644 VanDerWaalsContact O-N 3.09Å
1642	S	71.4	Confident	77.9	Confident	73 Å²	73	42 Å²	42	51%	0.51	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-63.4	-5.5	-177.7	65	0	0	0	0	115.8	L1640	L1640-S1642 VanDerWaalsContact C-N 3.32Å; L1640-S1642 PolarHBondContact O-N 2.82Å
1643	Q	75.8	Confident	77.7	Confident	28 Å²	28	45.8 Å²	45.8	13%	0.131	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-120.3	-14.1	-179.6	-62.2	152.9	-1.8	0	0	112.1	L1640 W1641 A1645 F1674 L1675 Y1678	L1640-Q1643 PolarHBondContact O-N 2.83Å; W1641-Q1643 PolarHBondContact O-N 3Å; Q1643-A1645 PolarHBondContact O-N 2.83Å; Q1643-F1674 HydrophobicContact CB-CD1 4.38Å; Q1643-F1674 CarbonylContact O-C 3.42Å; Q1643-F1674 VanDerWaalsContact O-CA 3.28Å; Q1643-F1674 WeakPolarHBondContact O-CA 3.45Å; Q1643-L1675 PolarHBondContact O-N 2.74Å; Q1643-Y1678 VanDerWaalsContact CD-CG 3.48Å; Q1643-Y1678 HydrophobicContact CG-CG 4.44Å; Q1643-Y1678 VanDerWaalsContact NE2-CD2 3.28Å
1644	Y	80.6	Confident	77.4	Confident	14 Å²	14	42.6 Å²	42.6	6%	0.055	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	119.5	178.5	170.9	-93.4	0	0	0	109.6	H1580 I1631 F1635 L1640 W1641 G1646 N1647 T1672	H1580-Y1644 PolarHBondContact ND1-O 3.22Å; I1631-Y1644 HydrophobicContact CG2-CE2 4.4Å; F1635-Y1644 HydrophobicContact CB-CD2 4.34Å; F1635-Y1644 AromaticContact CD2-CD2 3.65Å; F1635-Y1644 HydrophobicContact CD2-CD2 3.65Å; F1635-Y1644 AromaticContact CD2-CE2 3.69Å; F1635-Y1644 HydrophobicContact CD2-CE2 3.69Å; F1635-Y1644 HydrophobicContact CE2-CD2 4.21Å; F1635-Y1644 HydrophobicContact CE2-CE2 4.19Å; F1635-Y1644 HydrophobicContact CG-CD2 4.12Å; L1640-Y1644 PolarHBondContact O-N 3.04Å; L1640-Y1644 VanDerWaalsContact O-N 3.14Å; W1641-Y1644 AromaticContact CE3-CD1 3.94Å; W1641-Y1644 HydrophobicContact CE3-CD1 3.94Å; W1641-Y1644 HydrophobicContact CE3-CG 4.34Å; W1641-Y1644 HydrophobicContact CH2-CD1 4.28Å; W1641-Y1644 HydrophobicContact CH2-CE1 4.45Å; W1641-Y1644 AromaticContact CZ3-CD1 3.5Å; W1641-Y1644 HydrophobicContact CZ3-CD1 3.5Å; W1641-Y1644 AromaticContact CZ3-CE1 3.8Å; W1641-Y1644 HydrophobicContact CZ3-CE1 3.8Å; W1641-Y1644 HydrophobicContact CZ3-CG 4.3Å; W1641-Y1644 WeakPolarHBondContact O-CB 3.15Å; W1641-Y1644 PolarHBondContact O-N 3.28Å; W1641-Y1644 VanDerWaalsContact O-N 3.09Å; Y1644-G1646 WeakPolarHBondContact CE2-O 3.23Å; Y1644-G1646 VanDerWaalsContact CZ-C 3.46Å; Y1644-G1646 VanDerWaalsContact CZ-CA 3.46Å; Y1644-N1647 HydrophobicContact CE2-CB 4.32Å; Y1644-N1647 PolarHBondContact OH-N 3.41Å; Y1644-N1647 PolarHBondContact OH-OD1 2.85Å; Y1644-T1672 HydrophobicContact CD2-CG2 3.64Å; Y1644-T1672 HydrophobicContact CE2-CG2 3.79Å
1645	A	80.6	Confident	76.4	Confident	26 Å²	26	42.6 Å²	42.6	22%	0.215	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	2	179.5	0	0	0	0	0	112.8	I1589 Q1643 Y1673 L1675	I1589-A1645 HydrophobicContact CG2-CB 3.81Å; Q1643-A1645 PolarHBondContact O-N 2.83Å; A1645-Y1673 PolarHBondContact N-O 2.91Å; A1645-L1675 HydrophobicContact CB-CD2 4.14Å
1646	G	80.8	Confident	75.5	Confident	14 Å²	14	42.8 Å²	42.8	14%	0.144	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	131.1	-178.3	-179.9	0	0	0	0	0	113.4	Y1644 Y1673	Y1644-G1646 WeakPolarHBondContact CE2-O 3.23Å; Y1644-G1646 VanDerWaalsContact CZ-C 3.46Å; Y1644-G1646 VanDerWaalsContact CZ-CA 3.46Å; G1646-Y1673 PolarHBondContact O-N 3.46Å
1647	N	82.4	Confident	74.7	Confident	14 Å²	14	45 Å²	45	8%	0.075	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.4	168.2	78.5	-107.1	0	0	0	111.5	H1628 I1631 Y1644 F1670 T1671	H1628-N1647 WeakPolarHBondContact CA-OD1 3.19Å; H1628-N1647 VanDerWaalsContact CD2-CG 3.49Å; H1628-N1647 PolarHBondContact CD2-ND2 2.82Å; H1628-N1647 PolarHBondContact CD2-O 3.29Å; H1628-N1647 PolarHBondContact CD2-OD1 2.8Å; H1628-N1647 PolarHBondContact NE2-O 2.89Å; I1631-N1647 HydrophobicContact CG2-CB 4.34Å; I1631-N1647 WeakPolarHBondContact CG2-OD1 3.2Å; Y1644-N1647 HydrophobicContact CE2-CB 4.32Å; Y1644-N1647 PolarHBondContact OH-N 3.41Å; Y1644-N1647 PolarHBondContact OH-OD1 2.85Å; N1647-F1670 HydrophobicContact CB-CD2 4.28Å; N1647-F1670 HydrophobicContact CB-CE2 4.48Å; N1647-T1671 CarbonylContact C-O 3.56Å; N1647-T1671 WeakPolarHBondContact CA-O 3.23Å; N1647-T1671 VanDerWaalsContact CB-O 3.31Å; N1647-T1671 WeakPolarHBondContact CB-O 3.31Å
1648	E	74.6	Confident	73.7	Confident	61 Å²	61	42.1 Å²	42.1	29%	0.285	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.4	175.4	-179.9	179.4	-159.6	0	0	109.2	Y560 F1670 T1671 Y1673	Y560-E1648 PolarHBondContact OH-OE1 3.08Å; Y560-E1648 VanDerWaalsContact OH-OE1 3.13Å; E1648-F1670 CarbonylContact O-C 3.34Å; E1648-F1670 WeakPolarHBondContact O-CA 3.42Å; E1648-F1670 WeakPolarHBondContact O-CB 3.4Å; E1648-T1671 PolarHBondContact N-O 3.24Å; E1648-T1671 PolarHBondContact O-N 2.95Å; E1648-Y1673 HydrophobicContact CB-CE2 3.85Å; E1648-Y1673 PolarHBondContact OE2-OH 3.41Å
1649	V	77.9	Confident	72.5	Confident	12 Å²	12	43.1 Å²	43.1	7%	0.073	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.8	171.3	-172.1	0	0	0	0	108.2	Y1620 V1624 F1627 I1652 F1668 E1669 F1670	Y1620-V1649 PolarHBondContact OH-O 3.25Å; V1624-V1649 HydrophobicContact CB-CB 4.35Å; V1624-V1649 HydrophobicContact CB-CG2 4.12Å; V1624-V1649 HydrophobicContact CG1-CB 3.74Å; V1624-V1649 HydrophobicContact CG1-CG2 3.49Å; V1624-V1649 VanDerWaalsContact CG1-CG2 3.49Å; V1624-V1649 HydrophobicContact CG2-CB 3.66Å; V1624-V1649 HydrophobicContact CG2-CG1 3.62Å; V1624-V1649 HydrophobicContact CG2-CG2 3.66Å; F1627-V1649 HydrophobicContact CD1-CG2 3.99Å; F1627-V1649 HydrophobicContact CE1-CG2 3.98Å; V1649-I1652 HydrophobicContact CG1-CG1 4.41Å; V1649-F1668 HydrophobicContact CG1-CD1 4.06Å; V1649-F1668 HydrophobicContact CG2-CD1 4.37Å; V1649-E1669 WeakPolarHBondContact CG1-O 2.73Å; V1649-F1670 HydrophobicContact CB-CB 4.03Å; V1649-F1670 HydrophobicContact CG1-CB 4.1Å; V1649-F1670 HydrophobicContact CG2-CB 3.66Å; V1649-F1670 HydrophobicContact CG2-CG 4.49Å
1650	R	65.7	Low	71.5	Confident	101 Å²	101	41.5 Å²	41.5	38%	0.381	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-42.6	-175.5	-72.7	180	164.6	171.4	-0.6	112.9	T707 H1593 E1669	T707-R1650 PolarHBondContact OG1-O 3Å; T707-R1650 VanDerWaalsContact OG1-O 3.04Å; H1593-R1650 PolarHBondContact CE1-NH1 3.39Å; H1593-R1650 VanDerWaalsContact CE1-NH1 3.25Å; H1593-R1650 PolarHBondContact CE1-NH2 3.31Å; H1593-R1650 PolarHBondContact NE2-NH1 2.71Å; H1593-R1650 PolarHBondContact NE2-NH2 2.89Å; R1650-E1669 VanDerWaalsContact CD-OE1 3.29Å; R1650-E1669 WeakPolarHBondContact CD-OE1 3.13Å; R1650-E1669 PolarHBondContact N-O 2.91Å; R1650-E1669 IonicContact NH1-OE1 3.2Å; R1650-E1669 PolarHBondContact NH1-OE1 2.55Å
1651	D	71.8	Confident	70.1	Confident	25 Å²	25	43.2 Å²	43.2	13%	0.134	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	150.2	-164.6	-174.4	-3.2	0	0	0	108.9	R1653 E1669	D1651-R1653 WeakPolarHBondContact OD2-CG 3.48Å; D1651-R1653 IonicContact OD2-CZ 2.75Å; D1651-R1653 IonicContact OD2-NE 2.77Å; D1651-R1653 PolarHBondContact OD2-NE 3.41Å; D1651-R1653 IonicContact OD2-NH2 2.87Å; D1651-R1653 PolarHBondContact OD2-NH2 2.04Å; D1651-E1669 HydrophobicContact CB-CB 4.3Å; D1651-E1669 PolarHBondContact O-N 2.88Å
1652	I	79.2	Confident	69.7	Low	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	114.5	162.2	-68.9	-176.2	0	0	0	110	Y1612 Y1620 I1623 V1624 V1649 L1666 W1667 F1668	Y1612-I1652 VanDerWaalsContact O-CB 3.32Å; Y1612-I1652 WeakPolarHBondContact O-CB 3.03Å; Y1620-I1652 HydrophobicContact CD2-CB 4.15Å; Y1620-I1652 HydrophobicContact CD2-CD1 3.37Å; Y1620-I1652 HydrophobicContact CD2-CG1 3.74Å; Y1620-I1652 HydrophobicContact CE2-CB 4.07Å; Y1620-I1652 HydrophobicContact CE2-CD1 3.65Å; Y1620-I1652 HydrophobicContact CE2-CG1 3.54Å; Y1620-I1652 HydrophobicContact CG-CD1 4.09Å; I1623-I1652 HydrophobicContact CG2-CD1 3.37Å; V1624-I1652 HydrophobicContact CG2-CD1 3.97Å; V1649-I1652 HydrophobicContact CG1-CG1 4.41Å; I1652-L1666 HydrophobicContact CG2-CB 3.89Å; I1652-L1666 HydrophobicContact CG2-CD2 4.31Å; I1652-W1667 CarbonylContact C-O 3.45Å; I1652-W1667 WeakPolarHBondContact CA-O 3.26Å; I1652-F1668 HydrophobicContact CD1-CD1 3.75Å; I1652-F1668 HydrophobicContact CD1-CD2 3.73Å; I1652-F1668 HydrophobicContact CD1-CE1 3.69Å; I1652-F1668 HydrophobicContact CD1-CE2 3.62Å; I1652-F1668 HydrophobicContact CD1-CG 3.82Å; I1652-F1668 HydrophobicContact CD1-CZ 3.67Å; I1652-F1668 HydrophobicContact CG1-CD1 4.18Å; I1652-F1668 HydrophobicContact CG1-CD2 4.11Å; I1652-F1668 HydrophobicContact CG1-CE2 4.49Å; I1652-F1668 HydrophobicContact CG1-CG 3.97Å
1653	R	76	Confident	69	Low	86 Å²	86	37.9 Å²	37.9	33%	0.325	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	164.8	-175.9	-60.5	-166.2	-179.8	113.9	25.1	113.7	Y1608 D1651 P1655 W1667 E1669	Y1608-R1653 WeakPolarHBondContact CD2-O 3.49Å; D1651-R1653 WeakPolarHBondContact OD2-CG 3.48Å; D1651-R1653 IonicContact OD2-CZ 2.75Å; D1651-R1653 IonicContact OD2-NE 2.77Å; D1651-R1653 PolarHBondContact OD2-NE 3.41Å; D1651-R1653 IonicContact OD2-NH2 2.87Å; D1651-R1653 PolarHBondContact OD2-NH2 2.04Å; R1653-P1655 VanDerWaalsContact O-CD 3.3Å; R1653-P1655 WeakPolarHBondContact O-CD 3.4Å; R1653-W1667 HydrophobicContact CB-CB 4.2Å; R1653-W1667 HydrophobicContact CB-CG 4.43Å; R1653-W1667 PolarHBondContact N-O 2.81Å; R1653-W1667 WeakPolarHBondContact O-CB 3.38Å; R1653-W1667 PolarHBondContact O-N 3.32Å; R1653-E1669 IonicContact CZ-OE2 3.41Å; R1653-E1669 IonicContact NH1-OE2 3.92Å; R1653-E1669 PolarHBondContact NH1-OE2 2.92Å; R1653-E1669 IonicContact NH2-OE2 3.47Å; R1653-E1669 PolarHBondContact NH2-OE2 2.88Å
1654	D	72.9	Confident	68	Low	23 Å²	23	36.7 Å²	36.7	12%	0.123	18%	0.184	C	C	.	.			trans	-64.6	119.6	164.1	-158.7	-31.5	0	0	0	109.4	I184 Y1608 G1656 Q1657	I184-D1654 WeakPolarHBondContact CD1-OD1 3.24Å; Y1608-D1654 HydrophobicContact CD1-CB 3.46Å; Y1608-D1654 VanDerWaalsContact CD1-CB 3.46Å; Y1608-D1654 WeakPolarHBondContact CD1-OD2 2.99Å; Y1608-D1654 HydrophobicContact CD2-CB 4.29Å; Y1608-D1654 HydrophobicContact CE1-CB 3.29Å; Y1608-D1654 VanDerWaalsContact CE1-CG 3.46Å; Y1608-D1654 VanDerWaalsContact CE1-OD2 3.29Å; Y1608-D1654 WeakPolarHBondContact CE1-OD2 3.45Å; Y1608-D1654 HydrophobicContact CE2-CB 4.16Å; Y1608-D1654 HydrophobicContact CG-CB 3.91Å; Y1608-D1654 VanDerWaalsContact CZ-N 3.3Å; D1654-G1656 PolarHBondContact O-N 3.38Å; D1654-G1656 PolarHBondContact OD1-N 2.97Å; D1654-Q1657 HydrophobicContact CB-CB 4.07Å; D1654-Q1657 HydrophobicContact CB-CG 3.83Å; D1654-Q1657 PolarHBondContact O-N 2.92Å
1655	P	64.4	Low	68	Low	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-34.1	171.1	-24.3	36.8	0	0	0	112.2	L1597 R1653 Q1657 M1658 N1659 W1662 G1665 W1667	L1597-P1655 HydrophobicContact CD1-CB 3.99Å; L1597-P1655 HydrophobicContact CD1-CG 3.68Å; R1653-P1655 VanDerWaalsContact O-CD 3.3Å; R1653-P1655 WeakPolarHBondContact O-CD 3.4Å; P1655-Q1657 PolarHBondContact O-N 3.39Å; P1655-M1658 PolarHBondContact O-N 3.32Å; P1655-N1659 PolarHBondContact O-N 3.24Å; P1655-W1662 HydrophobicContact CB-CB 3.2Å; P1655-W1662 HydrophobicContact CB-CD2 4.49Å; P1655-W1662 HydrophobicContact CB-CE3 4.27Å; P1655-W1662 HydrophobicContact CB-CG 4.11Å; P1655-W1662 VanDerWaalsContact O-CE3 3.3Å; P1655-G1665 WeakPolarHBondContact CG-O 3.02Å; P1655-W1667 HydrophobicContact CG-CB 4.45Å
1656	G	65.2	Low	68.2	Low	3 Å²	3	34.8 Å²	34.8	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-63.6	-39.5	179.7	0	0	0	0	0	113.4	D1654 M1658 N1659 W1662	D1654-G1656 PolarHBondContact O-N 3.38Å; D1654-G1656 PolarHBondContact OD1-N 2.97Å; G1656-M1658 PolarHBondContact O-N 3.47Å; G1656-N1659 CarbonylContact O-C 3.11Å; G1656-N1659 PolarHBondContact O-N 2.85Å; G1656-N1659 VanDerWaalsContact O-O 3.14Å; G1656-W1662 WeakPolarHBondContact CA-O 3.17Å
1657	Q	61.1	Low	68.2	Low	151 Å²	151	34.3 Å²	34.3	71%	0.706	17%	0.165	S	C	*	.	H	α-helix	trans	-65.5	-22.9	178.2	-72	-174.9	1.5	0	0	113.7	D1654 P1655	D1654-Q1657 HydrophobicContact CB-CB 4.07Å; D1654-Q1657 HydrophobicContact CB-CG 3.83Å; D1654-Q1657 PolarHBondContact O-N 2.92Å; P1655-Q1657 PolarHBondContact O-N 3.39Å
1658	M	55.2	Low	68.3	Low	63 Å²	63	33.6 Å²	33.6	31%	0.31	16%	0.161	S	C	.	.	H	α-helix	trans	-90.6	-26	178.1	-69.2	-167.9	58.7	0	0	113.1	P1655 G1656 W1662 W1667	P1655-M1658 PolarHBondContact O-N 3.32Å; G1656-M1658 PolarHBondContact O-N 3.47Å; M1658-W1662 HydrophobicContact CB-CE3 4.38Å; M1658-W1662 HydrophobicContact CB-CZ3 3.96Å; M1658-W1667 HydrophobicContact CE-CD2 4.36Å; M1658-W1667 HydrophobicContact CE-CZ2 3.64Å; M1658-W1667 HydrophobicContact SD-CD2 3.88Å; M1658-W1667 VanDerWaalsContact SD-CE2 3.5Å; M1658-W1667 HydrophobicContact SD-CG 3.63Å; M1658-W1667 HydrophobicContact SD-CZ2 4.22Å; M1658-W1667 PolarHBondContact SD-NE1 3.47Å
1659	N	54.4	Low	68.3	Low	35 Å²	35	32.4 Å²	32.4	19%	0.187	16%	0.156	C	C	.	.			trans	-162.8	132.6	176.3	-171.3	-5	0	0	0	109.4	P1655 G1656 T1661 W1662	P1655-N1659 PolarHBondContact O-N 3.24Å; G1656-N1659 CarbonylContact O-C 3.11Å; G1656-N1659 PolarHBondContact O-N 2.85Å; G1656-N1659 VanDerWaalsContact O-O 3.14Å; N1659-T1661 PolarHBondContact ND2-OG1 2.8Å; N1659-T1661 PolarHBondContact O-N 3.35Å; N1659-T1661 PolarHBondContact OD1-N 2.02Å; N1659-T1661 PolarHBondContact OD1-OG1 3.25Å; N1659-W1662 HydrophobicContact CB-CD2 3.96Å; N1659-W1662 HydrophobicContact CB-CE3 3.59Å; N1659-W1662 HydrophobicContact CB-CH2 3.36Å; N1659-W1662 HydrophobicContact CB-CZ2 3.77Å; N1659-W1662 HydrophobicContact CB-CZ3 3.29Å; N1659-W1662 VanDerWaalsContact ND2-CH2 3.3Å; N1659-W1662 WeakPolarHBondContact ND2-CH2 3.27Å; N1659-W1662 WeakPolarHBondContact ND2-CZ2 3.11Å; N1659-W1662 PolarHBondContact O-N 2.79Å; N1659-W1662 VanDerWaalsContact O-N 3.15Å
1660	S	52.7	Low	68.3	Low	50 Å²	50	31.8 Å²	31.8	35%	0.35	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	47.7	162.9	69.6	0	0	0	0	111.3	N151 E185 S186	N151-S1660 VanDerWaalsContact ND2-CB 3.26Å; N151-S1660 WeakPolarHBondContact ND2-CB 3.5Å; E185-S1660 CarbonylContact O-C 3.59Å; E185-S1660 WeakPolarHBondContact O-CB 3.27Å; E185-S1660 VanDerWaalsContact O-O 3.08Å; S186-S1660 VanDerWaalsContact OG-CA 3.28Å; S186-S1660 WeakPolarHBondContact OG-CA 3.31Å
1661	T	52.5	Low	68.8	Low	39 Å²	39	27.1 Å²	27.1	24%	0.239	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.8	11	154.5	27.2	0	0	0	0	114.5	E183 S186 Y187 N1659	E183-T1661 WeakPolarHBondContact CB-O 3.44Å; E183-T1661 WeakPolarHBondContact CG-O 3.02Å; S186-T1661 VanDerWaalsContact OG-C 3.23Å; S186-T1661 VanDerWaalsContact OG-CA 3.24Å; S186-T1661 WeakPolarHBondContact OG-CA 3.13Å; S186-T1661 PolarHBondContact OG-N 3.45Å; Y187-T1661 CarbonylContact C-O 3.6Å; Y187-T1661 WeakPolarHBondContact CA-O 3.33Å; Y187-T1661 HydrophobicContact CD1-CG2 4.33Å; Y187-T1661 PolarHBondContact N-O 2.89Å; Y187-T1661 VanDerWaalsContact O-CB 3.27Å; Y187-T1661 WeakPolarHBondContact O-CB 3.25Å; Y187-T1661 WeakPolarHBondContact O-CG2 3.4Å; N1659-T1661 PolarHBondContact ND2-OG1 2.8Å; N1659-T1661 PolarHBondContact O-N 3.35Å; N1659-T1661 PolarHBondContact OD1-N 2.02Å; N1659-T1661 PolarHBondContact OD1-OG1 3.25Å
1662	W	68	Low	69.2	Low	13 Å²	13	25.9 Å²	25.9	5%	0.049	13%	0.128	C	C	.	.			trans	-126.2	148.8	174.2	-46	-46.2	0	0	0	120.1	E183 I184 S186 R188 L1597 P1655 G1656 M1658 N1659 P1712	E183-W1662 WeakPolarHBondContact OE2-CA 3.32Å; E183-W1662 WeakPolarHBondContact OE2-CB 2.97Å; I184-W1662 PolarHBondContact N-O 3.27Å; S186-W1662 PolarHBondContact OG-N 3.14Å; S186-W1662 PolarHBondContact OG-O 3.21Å; R188-W1662 VanDerWaalsContact CD-CD1 3.48Å; L1597-W1662 HydrophobicContact CD2-CD2 4.17Å; L1597-W1662 HydrophobicContact CD2-CG 3.94Å; P1655-W1662 HydrophobicContact CB-CB 3.2Å; P1655-W1662 HydrophobicContact CB-CD2 4.49Å; P1655-W1662 HydrophobicContact CB-CE3 4.27Å; P1655-W1662 HydrophobicContact CB-CG 4.11Å; P1655-W1662 VanDerWaalsContact O-CE3 3.3Å; G1656-W1662 WeakPolarHBondContact CA-O 3.17Å; M1658-W1662 HydrophobicContact CB-CE3 4.38Å; M1658-W1662 HydrophobicContact CB-CZ3 3.96Å; N1659-W1662 HydrophobicContact CB-CD2 3.96Å; N1659-W1662 HydrophobicContact CB-CE3 3.59Å; N1659-W1662 HydrophobicContact CB-CH2 3.36Å; N1659-W1662 HydrophobicContact CB-CZ2 3.77Å; N1659-W1662 HydrophobicContact CB-CZ3 3.29Å; N1659-W1662 VanDerWaalsContact ND2-CH2 3.3Å; N1659-W1662 WeakPolarHBondContact ND2-CH2 3.27Å; N1659-W1662 WeakPolarHBondContact ND2-CZ2 3.11Å; N1659-W1662 PolarHBondContact O-N 2.79Å; N1659-W1662 VanDerWaalsContact O-N 3.15Å; W1662-P1712 HydrophobicContact CE3-CB 4.49Å; W1662-P1712 HydrophobicContact CH2-CB 3.2Å; W1662-P1712 HydrophobicContact CH2-CG 4.2Å; W1662-P1712 HydrophobicContact CZ2-CB 3.24Å; W1662-P1712 HydrophobicContact CZ2-CG 4.39Å; W1662-P1712 HydrophobicContact CZ3-CB 3.85Å; W1662-P1712 HydrophobicContact CZ3-CG 4.41Å
1663	K	56.8	Low	69.3	Low	37 Å²	37	28.5 Å²	28.5	16%	0.161	14%	0.138	C	C	.	.			trans	-130.7	-64.8	164.5	-101.2	148.3	-157.3	137.8	0	106.8	D182 E183 I184 G1665	D182-K1663 IonicContact OD1-NZ 2.69Å; D182-K1663 PolarHBondContact OD1-NZ 3.48Å; D182-K1663 IonicContact OD2-NZ 3.38Å; D182-K1663 PolarHBondContact OD2-NZ 2.95Å; E183-K1663 VanDerWaalsContact C-CE 3.45Å; E183-K1663 VanDerWaalsContact CA-CB 3.45Å; E183-K1663 VanDerWaalsContact CA-CD 3.47Å; E183-K1663 HydrophobicContact CB-CB 4.27Å; E183-K1663 VanDerWaalsContact CB-N 3.27Å; E183-K1663 WeakPolarHBondContact O-CE 3.45Å; E183-K1663 PolarHBondContact O-NZ 2.93Å; E183-K1663 PolarHBondContact OE1-N 2.86Å; E183-K1663 PolarHBondContact OE2-N 2.81Å; I184-K1663 HydrophobicContact CB-CG 4.09Å; I184-K1663 HydrophobicContact CG1-CB 3.86Å; I184-K1663 HydrophobicContact CG1-CG 3.4Å; K1663-G1665 PolarHBondContact O-N 2.86Å
1664	S	55.9	Low	69.6	Low	3 Å²	3	24.5 Å²	24.5	2%	0.021	12%	0.123	C	C	.	.	S	Bend	trans	-103.4	69.1	-134.2	71.2	0	0	0	0	106.4	I181 E183 R188 R1599 I1605 L1606	I181-S1664 WeakPolarHBondContact CG2-OG 3.33Å; E183-S1664 WeakPolarHBondContact OE1-CA 2.98Å; E183-S1664 WeakPolarHBondContact OE1-CB 3.44Å; E183-S1664 PolarHBondContact OE1-N 2.85Å; E183-S1664 PolarHBondContact OE1-OG 3.36Å; E183-S1664 PolarHBondContact OE2-N 2.66Å; R188-S1664 PolarHBondContact NH1-O 2.97Å; R188-S1664 PolarHBondContact NH1-OG 2.85Å; R188-S1664 PolarHBondContact NH2-O 3.05Å; R1599-S1664 PolarHBondContact NH2-O 2.93Å; R1599-S1664 PolarHBondContact NH2-OG 3.37Å; I1605-S1664 VanDerWaalsContact CG2-CB 3.46Å; L1606-S1664 CarbonylContact O-C 3.57Å; L1606-S1664 WeakPolarHBondContact O-CA 3.25Å
1665	G	80.4	Confident	69.7	Low	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	174.5	-171.7	-174.3	0	0	0	0	0	108.7	V1598 L1606 Y1608 P1655 K1663	V1598-G1665 CarbonylContact O-C 3.47Å; V1598-G1665 WeakPolarHBondContact O-CA 3.43Å; L1606-G1665 PolarHBondContact O-N 3.41Å; Y1608-G1665 PolarHBondContact N-O 3.32Å; P1655-G1665 WeakPolarHBondContact CG-O 3.02Å; K1663-G1665 PolarHBondContact O-N 2.86Å
1666	L	83.6	Confident	69.6	Low	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129.2	-171.9	-63	167.1	0	0	0	107.4	L1597 V1598 L1606 Y1608 Y1612 I1623 I1652 F1668	L1597-L1666 WeakPolarHBondContact CA-O 3.32Å; V1598-L1666 PolarHBondContact N-O 3.2Å; V1598-L1666 PolarHBondContact O-N 2.68Å; L1606-L1666 HydrophobicContact CB-CD1 4.11Å; L1606-L1666 HydrophobicContact CB-CG 4.32Å; L1606-L1666 HydrophobicContact CD1-CD1 4.08Å; L1606-L1666 HydrophobicContact CD2-CD1 4.29Å; L1606-L1666 HydrophobicContact CG-CD1 4.4Å; Y1608-L1666 HydrophobicContact CD2-CD2 4.03Å; Y1612-L1666 HydrophobicContact CD1-CD1 3.51Å; Y1612-L1666 HydrophobicContact CD1-CD2 3.62Å; Y1612-L1666 HydrophobicContact CD1-CG 4.15Å; Y1612-L1666 HydrophobicContact CD2-CD1 4.49Å; Y1612-L1666 HydrophobicContact CD2-CD2 3.47Å; Y1612-L1666 VanDerWaalsContact CD2-CD2 3.47Å; Y1612-L1666 HydrophobicContact CE1-CD1 3.17Å; Y1612-L1666 HydrophobicContact CE1-CD2 3.95Å; Y1612-L1666 HydrophobicContact CE1-CG 4.18Å; Y1612-L1666 HydrophobicContact CE2-CD1 4.22Å; Y1612-L1666 HydrophobicContact CE2-CD2 3.8Å; Y1612-L1666 HydrophobicContact CG-CD1 4.18Å; Y1612-L1666 HydrophobicContact CG-CD2 3.38Å; Y1612-L1666 HydrophobicContact CG-CG 4.39Å; I1623-L1666 HydrophobicContact CD1-CD1 3.3Å; I1652-L1666 HydrophobicContact CG2-CB 3.89Å; I1652-L1666 HydrophobicContact CG2-CD2 4.31Å; L1666-F1668 HydrophobicContact CB-CD2 4.35Å; L1666-F1668 HydrophobicContact CB-CE2 4.1Å; L1666-F1668 PolarHBondContact O-N 2.96Å
1667	W	82.1	Confident	69	Low	4 Å²	4	33.7 Å²	33.7	2%	0.015	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	102.3	-178.3	178.4	-102.7	0	0	0	110.8	P1595 L1597 I1652 R1653 P1655 M1658 E1669 P1712	P1595-W1667 HydrophobicContact CB-CH2 3.53Å; P1595-W1667 HydrophobicContact CB-CZ2 3.32Å; P1595-W1667 HydrophobicContact CB-CZ3 4.15Å; P1595-W1667 HydrophobicContact CG-CH2 3.6Å; P1595-W1667 HydrophobicContact CG-CZ2 3.51Å; L1597-W1667 HydrophobicContact CB-CE3 4.2Å; L1597-W1667 HydrophobicContact CB-CZ3 4.42Å; I1652-W1667 CarbonylContact C-O 3.45Å; I1652-W1667 WeakPolarHBondContact CA-O 3.26Å; R1653-W1667 HydrophobicContact CB-CB 4.2Å; R1653-W1667 HydrophobicContact CB-CG 4.43Å; R1653-W1667 PolarHBondContact N-O 2.81Å; R1653-W1667 WeakPolarHBondContact O-CB 3.38Å; R1653-W1667 PolarHBondContact O-N 3.32Å; P1655-W1667 HydrophobicContact CG-CB 4.45Å; M1658-W1667 HydrophobicContact CE-CD2 4.36Å; M1658-W1667 HydrophobicContact CE-CZ2 3.64Å; M1658-W1667 HydrophobicContact SD-CD2 3.88Å; M1658-W1667 VanDerWaalsContact SD-CE2 3.5Å; M1658-W1667 HydrophobicContact SD-CG 3.63Å; M1658-W1667 HydrophobicContact SD-CZ2 4.22Å; M1658-W1667 PolarHBondContact SD-NE1 3.47Å; W1667-E1669 PolarHBondContact O-N 3.36Å; W1667-P1712 HydrophobicContact CE3-CG 3.85Å; W1667-P1712 HydrophobicContact CH2-CG 3.51Å; W1667-P1712 HydrophobicContact CZ3-CB 4.35Å; W1667-P1712 HydrophobicContact CZ3-CG 3.02Å
1668	F	83.5	Confident	68.4	Low	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	112.6	175.8	-74.6	-123.9	0	0	0	110.4	P1595 L1596 V1598 I1623 V1624 F1627 V1649 I1652 L1666	P1595-F1668 CarbonylContact C-O 3.53Å; P1595-F1668 WeakPolarHBondContact CA-O 3.04Å; P1595-F1668 VanDerWaalsContact CB-O 3.25Å; P1595-F1668 WeakPolarHBondContact CB-O 3.26Å; L1596-F1668 PolarHBondContact N-O 2.85Å; L1596-F1668 VanDerWaalsContact N-O 3.1Å; L1596-F1668 PolarHBondContact O-N 3.48Å; V1598-F1668 HydrophobicContact CB-CD2 4.09Å; V1598-F1668 HydrophobicContact CB-CE2 3.58Å; V1598-F1668 HydrophobicContact CB-CZ 4.33Å; V1598-F1668 HydrophobicContact CG1-CE2 4.36Å; V1598-F1668 HydrophobicContact CG2-CD2 3.51Å; V1598-F1668 HydrophobicContact CG2-CE2 3.24Å; V1598-F1668 HydrophobicContact CG2-CG 4.29Å; V1598-F1668 HydrophobicContact CG2-CZ 3.79Å; I1623-F1668 HydrophobicContact CB-CZ 3.79Å; I1623-F1668 HydrophobicContact CD1-CE2 4.06Å; I1623-F1668 HydrophobicContact CD1-CZ 3.94Å; I1623-F1668 HydrophobicContact CG1-CE2 4.34Å; I1623-F1668 HydrophobicContact CG1-CZ 3.72Å; I1623-F1668 HydrophobicContact CG2-CE1 3.8Å; I1623-F1668 HydrophobicContact CG2-CE2 3.82Å; I1623-F1668 HydrophobicContact CG2-CZ 3.17Å; V1624-F1668 HydrophobicContact CG2-CD1 3.94Å; V1624-F1668 HydrophobicContact CG2-CE1 3.65Å; F1627-F1668 HydrophobicContact CB-CD1 4.34Å; F1627-F1668 HydrophobicContact CB-CE1 3.55Å; F1627-F1668 HydrophobicContact CB-CZ 4.17Å; F1627-F1668 AromaticContact CD1-CD1 3.68Å; F1627-F1668 HydrophobicContact CD1-CD1 3.68Å; F1627-F1668 AromaticContact CD1-CE1 3.78Å; F1627-F1668 HydrophobicContact CD1-CE1 3.78Å; F1627-F1668 AromaticContact CD2-CD1 3.55Å; F1627-F1668 HydrophobicContact CD2-CD1 3.55Å; F1627-F1668 AromaticContact CD2-CE1 3.3Å; F1627-F1668 HydrophobicContact CD2-CE1 3.3Å; F1627-F1668 HydrophobicContact CD2-CE2 4.38Å; F1627-F1668 HydrophobicContact CD2-CG 4.13Å; F1627-F1668 AromaticContact CD2-CZ 3.72Å; F1627-F1668 HydrophobicContact CD2-CZ 3.72Å; F1627-F1668 HydrophobicContact CE1-CB 4.32Å; F1627-F1668 AromaticContact CE1-CD1 3.55Å; F1627-F1668 HydrophobicContact CE1-CD1 3.55Å; F1627-F1668 HydrophobicContact CE1-CE1 4.12Å; F1627-F1668 HydrophobicContact CE1-CG 4.28Å; F1627-F1668 HydrophobicContact CE2-CB 3.98Å; F1627-F1668 AromaticContact CE2-CD1 3.41Å; F1627-F1668 HydrophobicContact CE2-CD1 3.41Å; F1627-F1668 VanDerWaalsContact CE2-CD1 3.41Å; F1627-F1668 HydrophobicContact CE2-CD2 4.16Å; F1627-F1668 AromaticContact CE2-CE1 3.69Å; F1627-F1668 HydrophobicContact CE2-CE1 3.69Å; F1627-F1668 HydrophobicContact CE2-CE2 4.43Å; F1627-F1668 AromaticContact CE2-CG 3.62Å; F1627-F1668 HydrophobicContact CE2-CG 3.62Å; F1627-F1668 HydrophobicContact CE2-CZ 4.16Å; F1627-F1668 AromaticContact CG-CD1 3.67Å; F1627-F1668 HydrophobicContact CG-CD1 3.67Å; F1627-F1668 AromaticContact CG-CE1 3.34Å; F1627-F1668 HydrophobicContact CG-CE1 3.34Å; F1627-F1668 HydrophobicContact CG-CZ 4.12Å; F1627-F1668 HydrophobicContact CZ-CB 3.63Å; F1627-F1668 AromaticContact CZ-CD1 3.39Å; F1627-F1668 HydrophobicContact CZ-CD1 3.39Å; F1627-F1668 HydrophobicContact CZ-CE1 4.06Å; F1627-F1668 AromaticContact CZ-CG 3.69Å; F1627-F1668 HydrophobicContact CZ-CG 3.69Å; V1649-F1668 HydrophobicContact CG1-CD1 4.06Å; V1649-F1668 HydrophobicContact CG2-CD1 4.37Å; I1652-F1668 HydrophobicContact CD1-CD1 3.75Å; I1652-F1668 HydrophobicContact CD1-CD2 3.73Å; I1652-F1668 HydrophobicContact CD1-CE1 3.69Å; I1652-F1668 HydrophobicContact CD1-CE2 3.62Å; I1652-F1668 HydrophobicContact CD1-CG 3.82Å; I1652-F1668 HydrophobicContact CD1-CZ 3.67Å; I1652-F1668 HydrophobicContact CG1-CD1 4.18Å; I1652-F1668 HydrophobicContact CG1-CD2 4.11Å; I1652-F1668 HydrophobicContact CG1-CE2 4.49Å; I1652-F1668 HydrophobicContact CG1-CG 3.97Å; L1666-F1668 HydrophobicContact CB-CD2 4.35Å; L1666-F1668 HydrophobicContact CB-CE2 4.1Å; L1666-F1668 PolarHBondContact O-N 2.96Å
1669	E	75.3	Confident	68.4	Low	35 Å²	35	36.7 Å²	36.7	16%	0.164	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	107.8	163	-168.1	-175.8	131.3	0	0	108.8	V1649 R1650 D1651 R1653 W1667	V1649-E1669 WeakPolarHBondContact CG1-O 2.73Å; R1650-E1669 VanDerWaalsContact CD-OE1 3.29Å; R1650-E1669 WeakPolarHBondContact CD-OE1 3.13Å; R1650-E1669 PolarHBondContact N-O 2.91Å; R1650-E1669 IonicContact NH1-OE1 3.2Å; R1650-E1669 PolarHBondContact NH1-OE1 2.55Å; D1651-E1669 HydrophobicContact CB-CB 4.3Å; D1651-E1669 PolarHBondContact O-N 2.88Å; R1653-E1669 IonicContact CZ-OE2 3.41Å; R1653-E1669 IonicContact NH1-OE2 3.92Å; R1653-E1669 PolarHBondContact NH1-OE2 2.92Å; R1653-E1669 IonicContact NH2-OE2 3.47Å; R1653-E1669 PolarHBondContact NH2-OE2 2.88Å; W1667-E1669 PolarHBondContact O-N 3.36Å
1670	F	77.3	Confident	68.9	Low	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	162.3	-179.2	88.4	-84.6	0	0	0	114.2	H1593 L1594 L1596 F1627 I1631 N1647 E1648 V1649 T1672 L1689	H1593-F1670 CarbonylContact C-O 3.34Å; H1593-F1670 VanDerWaalsContact CA-O 3.25Å; H1593-F1670 WeakPolarHBondContact CA-O 3.19Å; L1594-F1670 HydrophobicContact CB-CE1 4Å; L1594-F1670 HydrophobicContact CB-CE2 4.35Å; L1594-F1670 HydrophobicContact CB-CZ 3.82Å; L1594-F1670 PolarHBondContact N-O 2.04Å; L1594-F1670 WeakPolarHBondContact O-CD1 3.08Å; L1594-F1670 WeakPolarHBondContact O-CE1 3.37Å; L1596-F1670 HydrophobicContact CB-CE1 4.44Å; L1596-F1670 HydrophobicContact CD1-CE1 3.9Å; L1596-F1670 HydrophobicContact CD1-CZ 4.34Å; L1596-F1670 HydrophobicContact CG-CE1 4.1Å; F1627-F1670 HydrophobicContact CE1-CB 4.16Å; F1627-F1670 AromaticContact CE1-CD1 3.43Å; F1627-F1670 HydrophobicContact CE1-CD1 3.43Å; F1627-F1670 VanDerWaalsContact CE1-CD1 3.43Å; F1627-F1670 AromaticContact CE1-CD2 3.97Å; F1627-F1670 HydrophobicContact CE1-CD2 3.97Å; F1627-F1670 AromaticContact CE1-CE1 3.57Å; F1627-F1670 HydrophobicContact CE1-CE1 3.57Å; F1627-F1670 HydrophobicContact CE1-CE2 4.13Å; F1627-F1670 AromaticContact CE1-CG 3.61Å; F1627-F1670 HydrophobicContact CE1-CG 3.61Å; F1627-F1670 AromaticContact CE1-CZ 3.94Å; F1627-F1670 HydrophobicContact CE1-CZ 3.94Å; F1627-F1670 HydrophobicContact CE2-CE1 4.46Å; F1627-F1670 AromaticContact CZ-CD1 3.35Å; F1627-F1670 HydrophobicContact CZ-CD1 3.35Å; F1627-F1670 AromaticContact CZ-CE1 3.29Å; F1627-F1670 HydrophobicContact CZ-CE1 3.29Å; F1627-F1670 HydrophobicContact CZ-CG 4.04Å; F1627-F1670 AromaticContact CZ-CZ 4Å; F1627-F1670 HydrophobicContact CZ-CZ 4Å; I1631-F1670 HydrophobicContact CD1-CE1 4.3Å; I1631-F1670 HydrophobicContact CD1-CE2 4.09Å; I1631-F1670 HydrophobicContact CD1-CZ 3.56Å; I1631-F1670 HydrophobicContact CG1-CE2 4.12Å; I1631-F1670 HydrophobicContact CG1-CZ 4.06Å; I1631-F1670 HydrophobicContact CG2-CE2 4.13Å; N1647-F1670 HydrophobicContact CB-CD2 4.28Å; N1647-F1670 HydrophobicContact CB-CE2 4.48Å; E1648-F1670 CarbonylContact O-C 3.34Å; E1648-F1670 WeakPolarHBondContact O-CA 3.42Å; E1648-F1670 WeakPolarHBondContact O-CB 3.4Å; V1649-F1670 HydrophobicContact CB-CB 4.03Å; V1649-F1670 HydrophobicContact CG1-CB 4.1Å; V1649-F1670 HydrophobicContact CG2-CB 3.66Å; V1649-F1670 HydrophobicContact CG2-CG 4.49Å; F1670-T1672 WeakPolarHBondContact CE2-OG1 3.45Å; F1670-L1689 HydrophobicContact CZ-CD2 4.02Å
1671	T	76.5	Confident	69.4	Low	2 Å²	2	35.1 Å²	35.1	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.9	-177.4	-40.6	0	0	0	0	109.2	I1592 H1593 N1647 E1648 Y1673	I1592-T1671 CarbonylContact O-C 3.48Å; I1592-T1671 VanDerWaalsContact O-CA 3.31Å; I1592-T1671 WeakPolarHBondContact O-CA 3.32Å; H1593-T1671 PolarHBondContact CE1-OG1 3.47Å; H1593-T1671 PolarHBondContact ND1-OG1 3.1Å; N1647-T1671 CarbonylContact C-O 3.56Å; N1647-T1671 WeakPolarHBondContact CA-O 3.23Å; N1647-T1671 VanDerWaalsContact CB-O 3.31Å; N1647-T1671 WeakPolarHBondContact CB-O 3.31Å; E1648-T1671 PolarHBondContact N-O 3.24Å; E1648-T1671 PolarHBondContact O-N 2.95Å; T1671-Y1673 HydrophobicContact CG2-CE1 4.08Å
1672	T	80.6	Confident	69.9	Low	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	138	165.9	-60.1	0	0	0	0	109.6	G1591 I1592 F1635 Y1644 F1670 F1674	G1591-T1672 CarbonylContact C-O 3.3Å; G1591-T1672 WeakPolarHBondContact CA-O 3.36Å; I1592-T1672 PolarHBondContact N-O 3.35Å; I1592-T1672 PolarHBondContact O-N 3.11Å; F1635-T1672 HydrophobicContact CD2-CG2 4.38Å; F1635-T1672 HydrophobicContact CE2-CG2 3.66Å; F1635-T1672 HydrophobicContact CZ-CG2 3.99Å; Y1644-T1672 HydrophobicContact CD2-CG2 3.64Å; Y1644-T1672 HydrophobicContact CE2-CG2 3.79Å; F1670-T1672 WeakPolarHBondContact CE2-OG1 3.45Å; T1672-F1674 HydrophobicContact CG2-CD2 4.19Å; T1672-F1674 HydrophobicContact CG2-CE1 3.97Å; T1672-F1674 HydrophobicContact CG2-CE2 3.5Å; T1672-F1674 HydrophobicContact CG2-CZ 3.38Å
1673	Y	80.4	Confident	69.4	Low	55 Å²	55	37.6 Å²	37.6	22%	0.216	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	133.6	176.2	-64.5	-71.5	0	0	0	111.4	I1589 I1590 A1645 G1646 E1648 T1671	I1589-Y1673 HydrophobicContact CD1-CD1 3.73Å; I1589-Y1673 HydrophobicContact CD1-CE1 4.33Å; I1589-Y1673 HydrophobicContact CD1-CG 3.98Å; I1589-Y1673 HydrophobicContact CG1-CD1 4.32Å; I1590-Y1673 WeakPolarHBondContact O-CA 3.34Å; A1645-Y1673 PolarHBondContact N-O 2.91Å; G1646-Y1673 PolarHBondContact O-N 3.46Å; E1648-Y1673 HydrophobicContact CB-CE2 3.85Å; E1648-Y1673 PolarHBondContact OE2-OH 3.41Å; T1671-Y1673 HydrophobicContact CG2-CE1 4.08Å
1674	F	82.9	Confident	69.9	Low	2 Å²	2	40.7 Å²	40.7	1%	0.009	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.4	174	-60.9	-78	0	0	0	110.6	I1589 I1590 I1592 F1635 L1640 Q1643 T1672 K1676 P1680 A1685	I1589-F1674 CarbonylContact C-O 3.19Å; I1589-F1674 VanDerWaalsContact CA-O 3.25Å; I1589-F1674 WeakPolarHBondContact CA-O 3.39Å; I1590-F1674 PolarHBondContact N-O 3.05Å; I1590-F1674 PolarHBondContact O-N 2.71Å; I1592-F1674 HydrophobicContact CD1-CD2 3.85Å; I1592-F1674 HydrophobicContact CD1-CE2 3.86Å; I1592-F1674 HydrophobicContact CG1-CD2 4.2Å; I1592-F1674 HydrophobicContact CG1-CE2 4.32Å; F1635-F1674 HydrophobicContact CE1-CE1 4.41Å; F1635-F1674 AromaticContact CE1-CZ 3.99Å; F1635-F1674 HydrophobicContact CE1-CZ 3.99Å; F1635-F1674 AromaticContact CZ-CZ 3.97Å; F1635-F1674 HydrophobicContact CZ-CZ 3.97Å; L1640-F1674 HydrophobicContact CB-CE1 3.96Å; L1640-F1674 HydrophobicContact CD1-CE1 4.23Å; L1640-F1674 HydrophobicContact CD1-CZ 4.21Å; Q1643-F1674 HydrophobicContact CB-CD1 4.38Å; Q1643-F1674 CarbonylContact O-C 3.42Å; Q1643-F1674 VanDerWaalsContact O-CA 3.28Å; Q1643-F1674 WeakPolarHBondContact O-CA 3.45Å; T1672-F1674 HydrophobicContact CG2-CD2 4.19Å; T1672-F1674 HydrophobicContact CG2-CE1 3.97Å; T1672-F1674 HydrophobicContact CG2-CE2 3.5Å; T1672-F1674 HydrophobicContact CG2-CZ 3.38Å; F1674-K1676 PolarHBondContact O-N 3.45Å; F1674-P1680 HydrophobicContact CD1-CG 4.16Å; F1674-P1680 HydrophobicContact CD2-CG 3.68Å; F1674-P1680 HydrophobicContact CE1-CG 4.23Å; F1674-P1680 HydrophobicContact CE2-CG 3.74Å; F1674-P1680 HydrophobicContact CG-CG 3.89Å; F1674-P1680 HydrophobicContact CZ-CG 4.01Å; F1674-A1685 HydrophobicContact CE2-CB 4.37Å; F1674-A1685 HydrophobicContact CZ-CB 4.41Å
1675	L	75	Confident	70.8	Confident	24 Å²	24	40.5 Å²	40.5	13%	0.126	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	128	175.3	-62.6	177.8	0	0	0	111.3	H1580 Q1587 I1589 Q1643 A1645 G1677 Y1678	H1580-L1675 HydrophobicContact CB-CD1 4.12Å; Q1587-L1675 HydrophobicContact CB-CD2 4.19Å; I1589-L1675 HydrophobicContact CG2-CD2 4.11Å; Q1643-L1675 PolarHBondContact O-N 2.74Å; A1645-L1675 HydrophobicContact CB-CD2 4.14Å; L1675-G1677 PolarHBondContact O-N 2.81Å; L1675-Y1678 PolarHBondContact O-N 3.32Å
1676	K	61.2	Low	70.8	Confident	119 Å²	119	41.4 Å²	41.4	52%	0.517	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	133.8	178.7	-175.1	178.6	-179.3	-178.6	0	110.4	D1588 I1590 F1674	D1588-K1676 HydrophobicContact CB-CB 3.66Å; D1588-K1676 HydrophobicContact CB-CD 3.3Å; D1588-K1676 HydrophobicContact CB-CG 4.15Å; D1588-K1676 WeakPolarHBondContact O-CB 3.08Å; D1588-K1676 PolarHBondContact O-N 2.65Å; D1588-K1676 WeakPolarHBondContact OD2-CD 3.37Å; D1588-K1676 IonicContact OD2-NZ 3.88Å; D1588-K1676 PolarHBondContact OD2-NZ 3.37Å; I1590-K1676 HydrophobicContact CD1-CB 4.32Å; I1590-K1676 HydrophobicContact CD1-CG 4.06Å; I1590-K1676 HydrophobicContact CG1-CB 4.27Å; I1590-K1676 HydrophobicContact CG1-CG 4.34Å; F1674-K1676 PolarHBondContact O-N 3.45Å
1677	G	53.4	Low	70.2	Confident	76 Å²	76	45.8 Å²	45.8	78%	0.784	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	111.5	-10.6	-168.8	0	0	0	0	0	113.4	L1675	L1675-G1677 PolarHBondContact O-N 2.81Å
1678	Y	48.3	Very low	70	Confident	129 Å²	129	47.6 Å²	47.6	51%	0.506	25%	0.253	S	S	.	.			trans	-139.3	108.3	161.6	-158	-81.5	0	0	0	109.7	L1640 Q1643 L1675 P1680	L1640-Y1678 HydrophobicContact CD2-CE1 4.23Å; Q1643-Y1678 VanDerWaalsContact CD-CG 3.48Å; Q1643-Y1678 HydrophobicContact CG-CG 4.44Å; Q1643-Y1678 VanDerWaalsContact NE2-CD2 3.28Å; L1675-Y1678 PolarHBondContact O-N 3.32Å; Y1678-P1680 WeakPolarHBondContact O-CD 3.07Å
1679	E	54.7	Low	70	Confident	148 Å²	148	47.6 Å²	47.6	69%	0.692	25%	0.253	S	S	*	.			trans	-101.4	97.2	-178.8	-75.7	173.6	-152.9	0	0	109.8	I1590 S1681	I1590-E1679 HydrophobicContact CD1-CG 3.45Å; I1590-E1679 VanDerWaalsContact CD1-CG 3.45Å; I1590-E1679 VanDerWaalsContact CD1-OE1 3.31Å; I1590-E1679 WeakPolarHBondContact CD1-OE1 3.27Å; E1679-S1681 PolarHBondContact O-N 2.81Å
1680	P	65.6	Low	70.3	Confident	8 Å²	8	46.5 Å²	46.5	5%	0.052	25%	0.248	C	C	.	.			trans	-64.9	133.5	163	28	-31.4	0	0	0	108.3	I1592 L1640 F1674 Y1678 A1685	I1592-P1680 HydrophobicContact CD1-CG 4.02Å; I1592-P1680 WeakPolarHBondContact CD1-O 3.42Å; L1640-P1680 HydrophobicContact CD1-CB 3.93Å; L1640-P1680 HydrophobicContact CD1-CG 4.27Å; L1640-P1680 HydrophobicContact CD2-CB 3.82Å; L1640-P1680 HydrophobicContact CD2-CG 4.19Å; F1674-P1680 HydrophobicContact CD1-CG 4.16Å; F1674-P1680 HydrophobicContact CD2-CG 3.68Å; F1674-P1680 HydrophobicContact CE1-CG 4.23Å; F1674-P1680 HydrophobicContact CE2-CG 3.74Å; F1674-P1680 HydrophobicContact CG-CG 3.89Å; F1674-P1680 HydrophobicContact CZ-CG 4.01Å; Y1678-P1680 WeakPolarHBondContact O-CD 3.07Å; P1680-A1685 HydrophobicContact CB-CB 4.45Å
1681	S	64.6	Low	70.1	Confident	44 Å²	44	49 Å²	49	31%	0.308	26%	0.26	S	S	.	.			trans	-62.8	152.3	171.6	67.8	0	0	0	0	110	E1679 A1683 E1684 A1685	E1679-S1681 PolarHBondContact O-N 2.81Å; S1681-A1683 PolarHBondContact O-N 2.95Å; S1681-A1683 VanDerWaalsContact O-N 3.11Å; S1681-E1684 WeakPolarHBondContact CB-OE2 3.46Å; S1681-E1684 PolarHBondContact N-OE2 3.48Å; S1681-E1684 PolarHBondContact O-N 2.77Å; S1681-E1684 VanDerWaalsContact OG-CD 3.28Å; S1681-E1684 VanDerWaalsContact OG-CG 3.28Å; S1681-E1684 WeakPolarHBondContact OG-CG 3.35Å; S1681-E1684 PolarHBondContact OG-N 3.36Å; S1681-E1684 PolarHBondContact OG-OE2 3.19Å; S1681-A1685 PolarHBondContact O-N 3.4Å
1682	P	61.3	Low	70.2	Confident	56 Å²	56	49 Å²	49	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-56.1	-31.8	177.1	-25.7	34.2	0	0	0	112.9	I1592 W1686 F1714	I1592-P1682 HydrophobicContact CG2-CB 3.82Å; I1592-P1682 HydrophobicContact CG2-CG 3.98Å; P1682-W1686 WeakPolarHBondContact O-CB 3.05Å; P1682-W1686 PolarHBondContact O-N 2.77Å; P1682-F1714 HydrophobicContact CB-CD1 4.35Å; P1682-F1714 HydrophobicContact CB-CE1 3.37Å; P1682-F1714 HydrophobicContact CB-CE2 4.48Å; P1682-F1714 HydrophobicContact CB-CZ 3.46Å; P1682-F1714 VanDerWaalsContact CB-CZ 3.46Å; P1682-F1714 HydrophobicContact CG-CE1 4.43Å
1683	A	58.3	Low	70.3	Confident	48 Å²	48	49 Å²	49	40%	0.397	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-36.6	173.9	0	0	0	0	0	113.4	S1681 Q1687	S1681-A1683 PolarHBondContact O-N 2.95Å; S1681-A1683 VanDerWaalsContact O-N 3.11Å; A1683-Q1687 VanDerWaalsContact O-CB 3.22Å; A1683-Q1687 WeakPolarHBondContact O-CB 3.05Å; A1683-Q1687 WeakPolarHBondContact O-CG 3.19Å; A1683-Q1687 PolarHBondContact O-N 2.98Å; A1683-Q1687 PolarHBondContact O-NE2 3.48Å
1684	E	66.6	Low	70.1	Confident	101 Å²	101	48.2 Å²	48.2	47%	0.472	26%	0.257	S	S	.	.	H	α-helix	trans	-74	-42	175.3	-73.8	161.5	127.6	0	0	111.9	S1681 Q1687 Q1688	S1681-E1684 WeakPolarHBondContact CB-OE2 3.46Å; S1681-E1684 PolarHBondContact N-OE2 3.48Å; S1681-E1684 PolarHBondContact O-N 2.77Å; S1681-E1684 VanDerWaalsContact OG-CD 3.28Å; S1681-E1684 VanDerWaalsContact OG-CG 3.28Å; S1681-E1684 WeakPolarHBondContact OG-CG 3.35Å; S1681-E1684 PolarHBondContact OG-N 3.36Å; S1681-E1684 PolarHBondContact OG-OE2 3.19Å; E1684-Q1687 PolarHBondContact O-N 2.64Å; E1684-Q1688 WeakPolarHBondContact O-CB 3.41Å; E1684-Q1688 WeakPolarHBondContact O-CG 3.36Å; E1684-Q1688 PolarHBondContact O-N 2.91Å
1685	A	75.6	Confident	69.5	Low	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.8	-46.7	174.9	0	0	0	0	0	110.8	L1594 L1640 F1674 P1680 S1681 L1689	L1594-A1685 HydrophobicContact CD1-CB 4.01Å; L1594-A1685 HydrophobicContact CD2-CB 4.18Å; L1640-A1685 HydrophobicContact CD1-CB 4.46Å; F1674-A1685 HydrophobicContact CE2-CB 4.37Å; F1674-A1685 HydrophobicContact CZ-CB 4.41Å; P1680-A1685 HydrophobicContact CB-CB 4.45Å; S1681-A1685 PolarHBondContact O-N 3.4Å; A1685-L1689 WeakPolarHBondContact O-CB 3.35Å; A1685-L1689 PolarHBondContact O-N 3.41Å
1686	W	79.2	Confident	69.8	Low	19 Å²	19	55.2 Å²	55.2	7%	0.072	29%	0.291	C	S	.	.	H	α-helix	trans	-59.7	-46.2	172.5	-178.3	-102.3	0	0	0	112.5	L1594 P1595 L1596 P1682 F1690 Q1711 F1714	L1594-W1686 HydrophobicContact CB-CE3 4.46Å; L1594-W1686 HydrophobicContact CD2-CB 4.17Å; L1594-W1686 HydrophobicContact CD2-CE3 4.45Å; P1595-W1686 VanDerWaalsContact O-CH2 3.29Å; P1595-W1686 WeakPolarHBondContact O-CH2 3.46Å; P1595-W1686 WeakPolarHBondContact O-CZ3 3.25Å; L1596-W1686 HydrophobicContact CD2-CH2 3.58Å; L1596-W1686 HydrophobicContact CD2-CZ2 4.49Å; L1596-W1686 HydrophobicContact CD2-CZ3 3.67Å; L1596-W1686 HydrophobicContact CG-CH2 4.31Å; L1596-W1686 HydrophobicContact CG-CZ3 4Å; P1682-W1686 WeakPolarHBondContact O-CB 3.05Å; P1682-W1686 PolarHBondContact O-N 2.77Å; W1686-F1690 VanDerWaalsContact O-CB 3.23Å; W1686-F1690 WeakPolarHBondContact O-CB 3.28Å; W1686-F1690 PolarHBondContact O-N 3.24Å; W1686-Q1711 HydrophobicContact CH2-CB 4.41Å; W1686-Q1711 HydrophobicContact CH2-CG 4.26Å; W1686-Q1711 HydrophobicContact CZ2-CB 4.03Å; W1686-Q1711 HydrophobicContact CZ2-CG 4.04Å; W1686-F1714 HydrophobicContact CD2-CD2 4.38Å; W1686-F1714 HydrophobicContact CE3-CD2 4.21Å
1687	Q	71.3	Confident	70.3	Confident	91 Å²	91	51.2 Å²	51.2	43%	0.425	28%	0.284	S	S	.	.	H	α-helix	trans	-64.6	-48.1	-178.8	-82.7	-178.9	64.9	0	0	112.6	A1683 E1684 Q1691	A1683-Q1687 VanDerWaalsContact O-CB 3.22Å; A1683-Q1687 WeakPolarHBondContact O-CB 3.05Å; A1683-Q1687 WeakPolarHBondContact O-CG 3.19Å; A1683-Q1687 PolarHBondContact O-N 2.98Å; A1683-Q1687 PolarHBondContact O-NE2 3.48Å; E1684-Q1687 PolarHBondContact O-N 2.64Å; Q1687-Q1691 WeakPolarHBondContact O-CB 3.46Å; Q1687-Q1691 WeakPolarHBondContact O-CG 3.44Å; Q1687-Q1691 PolarHBondContact O-N 2.89Å; Q1687-Q1691 PolarHBondContact O-NE2 3.42Å
1688	Q	78.4	Confident	71.7	Confident	42 Å²	42	47.8 Å²	47.8	20%	0.196	25%	0.248	C	C	.	.	H	α-helix	trans	-64.3	-42.7	178.8	-72.6	-170.8	65.6	0	0	111.2	T1638 L1640 E1684 Q1691 S1692	T1638-Q1688 HydrophobicContact CG2-CB 3.79Å; T1638-Q1688 WeakPolarHBondContact CG2-O 3.49Å; L1640-Q1688 HydrophobicContact CD1-CB 4.5Å; E1684-Q1688 WeakPolarHBondContact O-CB 3.41Å; E1684-Q1688 WeakPolarHBondContact O-CG 3.36Å; E1684-Q1688 PolarHBondContact O-N 2.91Å; Q1688-Q1691 PolarHBondContact O-N 2.75Å; Q1688-S1692 PolarHBondContact O-N 2.03Å
1689	L	84	Confident	73.2	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-54.7	176.3	-179.9	62.6	0	0	0	111.8	L1594 L1596 I1631 A1634 F1635 F1670 A1685 Q1691 S1692 I1693	L1594-L1689 HydrophobicContact CD1-CD2 4.34Å; L1596-L1689 HydrophobicContact CD1-CD2 4.26Å; I1631-L1689 HydrophobicContact CD1-CD1 3.64Å; I1631-L1689 HydrophobicContact CD1-CD2 3.73Å; I1631-L1689 HydrophobicContact CD1-CG 4.21Å; A1634-L1689 HydrophobicContact CB-CD1 3.64Å; F1635-L1689 HydrophobicContact CE1-CB 4.37Å; F1635-L1689 HydrophobicContact CE2-CD1 4.18Å; F1635-L1689 HydrophobicContact CZ-CB 4.26Å; F1635-L1689 HydrophobicContact CZ-CD1 4.26Å; F1635-L1689 HydrophobicContact CZ-CD2 4.42Å; F1670-L1689 HydrophobicContact CZ-CD2 4.02Å; A1685-L1689 WeakPolarHBondContact O-CB 3.35Å; A1685-L1689 PolarHBondContact O-N 3.41Å; L1689-Q1691 VanDerWaalsContact C-N 3.25Å; L1689-Q1691 PolarHBondContact O-N 3.01Å; L1689-S1692 PolarHBondContact O-N 2.9Å; L1689-S1692 VanDerWaalsContact O-N 3.14Å; L1689-I1693 HydrophobicContact CD1-CD1 4.02Å; L1689-I1693 HydrophobicContact CD1-CG1 4.42Å; L1689-I1693 HydrophobicContact CG-CD1 3.85Å; L1689-I1693 VanDerWaalsContact O-CG1 3.27Å; L1689-I1693 WeakPolarHBondContact O-CG1 3.47Å; L1689-I1693 PolarHBondContact O-N 2.75Å
1690	F	80.4	Confident	74.5	Confident	12 Å²	12	34.8 Å²	34.8	5%	0.053	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-29.7	-179	-170.7	-95.7	0	0	0	112.9	W1686 K1694 I1707 Q1711	W1686-F1690 VanDerWaalsContact O-CB 3.23Å; W1686-F1690 WeakPolarHBondContact O-CB 3.28Å; W1686-F1690 PolarHBondContact O-N 3.24Å; F1690-K1694 WeakPolarHBondContact O-CB 3.09Å; F1690-K1694 PolarHBondContact O-N 3.45Å; F1690-I1707 HydrophobicContact CD2-CD1 3.52Å; F1690-I1707 HydrophobicContact CE2-CD1 3.37Å; F1690-I1707 HydrophobicContact CZ-CD1 4.37Å; F1690-Q1711 HydrophobicContact CD2-CG 4.33Å; F1690-Q1711 HydrophobicContact CE2-CG 3.74Å
1691	Q	73.8	Confident	75	Confident	53 Å²	53	34.5 Å²	34.5	25%	0.248	19%	0.19	C	C	.	.	H	α-helix	trans	-66.8	-47.6	172.1	-73.6	158.5	27.1	0	0	111.8	P237 Q1687 Q1688 L1689 I1693 K1694 Q1695	P237-Q1691 HydrophobicContact CG-CG 4.06Å; Q1687-Q1691 WeakPolarHBondContact O-CB 3.46Å; Q1687-Q1691 WeakPolarHBondContact O-CG 3.44Å; Q1687-Q1691 PolarHBondContact O-N 2.89Å; Q1687-Q1691 PolarHBondContact O-NE2 3.42Å; Q1688-Q1691 PolarHBondContact O-N 2.75Å; L1689-Q1691 VanDerWaalsContact C-N 3.25Å; L1689-Q1691 PolarHBondContact O-N 3.01Å; Q1691-I1693 VanDerWaalsContact C-N 3.32Å; Q1691-I1693 PolarHBondContact O-N 2.79Å; Q1691-K1694 PolarHBondContact O-N 3.26Å; Q1691-Q1695 PolarHBondContact O-N 2.69Å; Q1691-Q1695 VanDerWaalsContact O-N 3.14Å
1692	S	79.1	Confident	75.1	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.014	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-42.5	176.4	-180	0	0	0	0	111.7	A1634 Q1688 L1689 K1694 Q1695 T1696	A1634-S1692 VanDerWaalsContact CA-OG 3.28Å; A1634-S1692 WeakPolarHBondContact CA-OG 3.39Å; A1634-S1692 WeakPolarHBondContact O-CB 3.38Å; A1634-S1692 PolarHBondContact O-OG 2.72Å; A1634-S1692 VanDerWaalsContact O-OG 3.11Å; Q1688-S1692 PolarHBondContact O-N 2.03Å; L1689-S1692 PolarHBondContact O-N 2.9Å; L1689-S1692 VanDerWaalsContact O-N 3.14Å; S1692-K1694 VanDerWaalsContact C-N 3.31Å; S1692-K1694 PolarHBondContact O-N 3.16Å; S1692-Q1695 PolarHBondContact O-N 3.18Å; S1692-T1696 PolarHBondContact O-OG1 2.9Å
1693	I	83.1	Confident	76.2	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-37.8	178.3	-61.9	169.8	0	0	0	111	L1596 A1634 L1689 Q1691 T1696 Y1698 S1699 I1700 I1707	L1596-I1693 HydrophobicContact CD1-CD1 4.21Å; A1634-I1693 HydrophobicContact CB-CG1 4.36Å; L1689-I1693 HydrophobicContact CD1-CD1 4.02Å; L1689-I1693 HydrophobicContact CD1-CG1 4.42Å; L1689-I1693 HydrophobicContact CG-CD1 3.85Å; L1689-I1693 VanDerWaalsContact O-CG1 3.27Å; L1689-I1693 WeakPolarHBondContact O-CG1 3.47Å; L1689-I1693 PolarHBondContact O-N 2.75Å; Q1691-I1693 VanDerWaalsContact C-N 3.32Å; Q1691-I1693 PolarHBondContact O-N 2.79Å; I1693-T1696 PolarHBondContact O-N 3.18Å; I1693-T1696 PolarHBondContact O-OG1 2.95Å; I1693-T1696 VanDerWaalsContact O-OG1 3.12Å; I1693-Y1698 VanDerWaalsContact CG2-O 3.3Å; I1693-Y1698 WeakPolarHBondContact CG2-O 3.29Å; I1693-Y1698 CarbonylContact O-C 3.21Å; I1693-Y1698 WeakPolarHBondContact O-CA 3.46Å; I1693-Y1698 PolarHBondContact O-N 3.42Å; I1693-S1699 PolarHBondContact O-N 3.32Å; I1693-I1700 HydrophobicContact CD1-CG1 4.33Å; I1693-I1700 HydrophobicContact CD1-CG2 4.26Å; I1693-I1700 HydrophobicContact CG1-CG2 4.29Å; I1693-I1700 HydrophobicContact CG2-CG1 4.25Å; I1693-I1707 HydrophobicContact CB-CD1 4.28Å; I1693-I1707 HydrophobicContact CD1-CD1 4.46Å; I1693-I1707 HydrophobicContact CD1-CG2 4.37Å; I1693-I1707 HydrophobicContact CG2-CB 4.43Å; I1693-I1707 HydrophobicContact CG2-CD1 3.55Å; I1693-I1707 HydrophobicContact CG2-CG1 3.6Å; I1693-I1707 HydrophobicContact CG2-CG2 4.08Å
1694	K	74.9	Confident	76.9	Confident	37 Å²	37	32.6 Å²	32.6	16%	0.161	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-40	175.4	177.7	178.9	-74.7	152.4	0	113	T196 F1690 Q1691 S1692 T1696 G1697 Y1698	T196-K1694 WeakPolarHBondContact OG1-CD 3.14Å; T196-K1694 WeakPolarHBondContact OG1-CE 3.42Å; T196-K1694 PolarHBondContact OG1-NZ 3Å; F1690-K1694 WeakPolarHBondContact O-CB 3.09Å; F1690-K1694 PolarHBondContact O-N 3.45Å; Q1691-K1694 PolarHBondContact O-N 3.26Å; S1692-K1694 VanDerWaalsContact C-N 3.31Å; S1692-K1694 PolarHBondContact O-N 3.16Å; K1694-T1696 PolarHBondContact O-N 2.87Å; K1694-G1697 PolarHBondContact O-N 3.35Å; K1694-Y1698 HydrophobicContact CB-CD1 4.31Å; K1694-Y1698 HydrophobicContact CB-CE1 3.95Å; K1694-Y1698 HydrophobicContact CD-CE1 4.33Å; K1694-Y1698 WeakPolarHBondContact CE-OH 3.07Å; K1694-Y1698 HydrophobicContact CG-CE1 3.83Å
1695	Q	71.6	Confident	77.7	Confident	140 Å²	140	27.8 Å²	27.8	65%	0.654	16%	0.156	S	C	*	.	H	α-helix	trans	-57.8	-33.5	-179.3	-71.4	177.4	4.7	0	0	112.5	Q1691 S1692 G1697	Q1691-Q1695 PolarHBondContact O-N 2.69Å; Q1691-Q1695 VanDerWaalsContact O-N 3.14Å; S1692-Q1695 PolarHBondContact O-N 3.18Å; Q1695-G1697 PolarHBondContact O-N 2.8Å
1696	T	80.1	Confident	77.8	Confident	33 Å²	33	31.3 Å²	31.3	20%	0.202	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	16.1	176.3	29.8	0	0	0	0	113.8	S1692 I1693 K1694 S1699	S1692-T1696 PolarHBondContact O-OG1 2.9Å; I1693-T1696 PolarHBondContact O-N 3.18Å; I1693-T1696 PolarHBondContact O-OG1 2.95Å; I1693-T1696 VanDerWaalsContact O-OG1 3.12Å; K1694-T1696 PolarHBondContact O-N 2.87Å; T1696-S1699 WeakPolarHBondContact CB-O 3.07Å; T1696-S1699 WeakPolarHBondContact O-CB 3.29Å; T1696-S1699 PolarHBondContact OG1-O 3.43Å
1697	G	72.4	Confident	78	Confident	35 Å²	35	30.4 Å²	30.4	36%	0.361	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	38.3	-179.3	0	0	0	0	0	112.6	K1694 Q1695 S1699 Y1706	K1694-G1697 PolarHBondContact O-N 3.35Å; Q1695-G1697 PolarHBondContact O-N 2.8Å; G1697-S1699 PolarHBondContact O-N 3.18Å; G1697-Y1706 VanDerWaalsContact O-CD1 3.25Å; G1697-Y1706 WeakPolarHBondContact O-CD1 3.47Å; G1697-Y1706 VanDerWaalsContact O-CE1 3.32Å; G1697-Y1706 WeakPolarHBondContact O-CE1 3.41Å
1698	Y	83.5	Confident	77.8	Confident	5 Å²	5	26 Å²	26	2%	0.02	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	5.1	-173.5	-54.7	-80.1	0	0	0	115.6	C191 F195 I1693 K1694 Y1706 I1707 E1709	C191-Y1698 PolarHBondContact O-OH 3.45Å; C191-Y1698 VanDerWaalsContact O-OH 3.12Å; F195-Y1698 PolarHBondContact O-OH 3.08Å; I1693-Y1698 VanDerWaalsContact CG2-O 3.3Å; I1693-Y1698 WeakPolarHBondContact CG2-O 3.29Å; I1693-Y1698 CarbonylContact O-C 3.21Å; I1693-Y1698 WeakPolarHBondContact O-CA 3.46Å; I1693-Y1698 PolarHBondContact O-N 3.42Å; K1694-Y1698 HydrophobicContact CB-CD1 4.31Å; K1694-Y1698 HydrophobicContact CB-CE1 3.95Å; K1694-Y1698 HydrophobicContact CD-CE1 4.33Å; K1694-Y1698 WeakPolarHBondContact CE-OH 3.07Å; K1694-Y1698 HydrophobicContact CG-CE1 3.83Å; Y1698-Y1706 CarbonylContact O-C 3.38Å; Y1698-Y1706 VanDerWaalsContact O-CA 3.27Å; Y1698-Y1706 WeakPolarHBondContact O-CA 3.33Å; Y1698-I1707 HydrophobicContact CD1-CG1 4.42Å; Y1698-I1707 PolarHBondContact O-N 3.36Å; Y1698-E1709 HydrophobicContact CD1-CG 3.66Å; Y1698-E1709 HydrophobicContact CD2-CG 3.36Å; Y1698-E1709 WeakPolarHBondContact CD2-OE1 2.94Å; Y1698-E1709 HydrophobicContact CE1-CB 4.36Å; Y1698-E1709 HydrophobicContact CE1-CG 3.65Å; Y1698-E1709 VanDerWaalsContact CE2-CD 3.5Å; Y1698-E1709 HydrophobicContact CE2-CG 3.35Å; Y1698-E1709 WeakPolarHBondContact CE2-OE1 3.43Å; Y1698-E1709 HydrophobicContact CG-CG 3.51Å; Y1698-E1709 VanDerWaalsContact CZ-CG 3.47Å
1699	S	78.9	Confident	76.8	Confident	4 Å²	4	24.6 Å²	24.6	3%	0.028	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-73.8	137.2	168.4	137	0	0	0	0	111.6	I1693 T1696 G1697 G1701 G1702 T1703 L1705	I1693-S1699 PolarHBondContact O-N 3.32Å; T1696-S1699 WeakPolarHBondContact CB-O 3.07Å; T1696-S1699 WeakPolarHBondContact O-CB 3.29Å; T1696-S1699 PolarHBondContact OG1-O 3.43Å; G1697-S1699 PolarHBondContact O-N 3.18Å; S1699-G1701 PolarHBondContact O-N 3Å; S1699-G1701 VanDerWaalsContact O-N 3.16Å; S1699-G1702 VanDerWaalsContact OG-C 3.27Å; S1699-G1702 WeakPolarHBondContact OG-CA 3.44Å; S1699-G1702 PolarHBondContact OG-N 2.83Å; S1699-T1703 VanDerWaalsContact CB-O 3.23Å; S1699-T1703 WeakPolarHBondContact CB-O 3.21Å; S1699-T1703 PolarHBondContact OG-N 3.42Å; S1699-T1703 PolarHBondContact OG-O 3.38Å; S1699-L1705 CarbonylContact C-O 3.54Å; S1699-L1705 WeakPolarHBondContact CA-O 3.24Å
1700	I	81.6	Confident	75.3	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-75.3	106.7	-177.1	-54.2	175.5	0	0	0	109.5	V1598 F1627 I1631 I1693 G1702 T1703 L1705 I1707	V1598-I1700 HydrophobicContact CG1-CD1 4.47Å; V1598-I1700 HydrophobicContact CG2-CD1 3.89Å; F1627-I1700 HydrophobicContact CD2-CD1 3.49Å; F1627-I1700 VanDerWaalsContact CD2-CD1 3.49Å; F1627-I1700 HydrophobicContact CE2-CD1 3.97Å; F1627-I1700 HydrophobicContact CG-CD1 4.49Å; I1631-I1700 HydrophobicContact CD1-CG2 4.19Å; I1631-I1700 HydrophobicContact CG1-CG2 4.43Å; I1693-I1700 HydrophobicContact CD1-CG1 4.33Å; I1693-I1700 HydrophobicContact CD1-CG2 4.26Å; I1693-I1700 HydrophobicContact CG1-CG2 4.29Å; I1693-I1700 HydrophobicContact CG2-CG1 4.25Å; I1700-G1702 PolarHBondContact O-N 2.94Å; I1700-G1702 VanDerWaalsContact O-N 3.09Å; I1700-T1703 WeakPolarHBondContact O-CB 3.31Å; I1700-T1703 WeakPolarHBondContact O-CG2 3.5Å; I1700-T1703 PolarHBondContact O-N 2.89Å; I1700-T1703 PolarHBondContact O-OG1 2.86Å; I1700-L1705 HydrophobicContact CB-CB 4.47Å; I1700-L1705 HydrophobicContact CD1-CB 3.98Å; I1700-L1705 HydrophobicContact CD1-CD1 4.48Å; I1700-L1705 HydrophobicContact CG1-CB 4.26Å; I1700-L1705 WeakPolarHBondContact CG1-O 3.1Å; I1700-L1705 PolarHBondContact N-O 3.38Å; I1700-I1707 HydrophobicContact CD1-CG2 3.66Å; I1700-I1707 HydrophobicContact CG1-CG2 3.6Å
1701	G	75.9	Confident	74.5	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.01	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	8	178.3	0	0	0	0	0	115.8	G1630 R1637 S1699	G1630-G1701 VanDerWaalsContact O-CA 3.29Å; G1630-G1701 WeakPolarHBondContact O-CA 3.39Å; G1630-G1701 PolarHBondContact O-N 3.24Å; R1637-G1701 PolarHBondContact NH2-O 3.32Å; S1699-G1701 PolarHBondContact O-N 3Å; S1699-G1701 VanDerWaalsContact O-N 3.16Å
1702	G	67.4	Low	73.7	Confident	45 Å²	45	21.9 Å²	21.9	46%	0.464	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	16.1	-170.9	0	0	0	0	0	114.1	S1699 I1700	S1699-G1702 VanDerWaalsContact OG-C 3.27Å; S1699-G1702 WeakPolarHBondContact OG-CA 3.44Å; S1699-G1702 PolarHBondContact OG-N 2.83Å; I1700-G1702 PolarHBondContact O-N 2.94Å; I1700-G1702 VanDerWaalsContact O-N 3.09Å
1703	T	84	Confident	72.3	Confident	23 Å²	23	22 Å²	22	14%	0.141	13%	0.127	C	C	.	.	S	Bend	trans	-80.1	-176.9	168.3	64.8	0	0	0	0	111.7	T1626 S1699 I1700 L1705	T1626-T1703 HydrophobicContact CG2-CG2 3.75Å; T1626-T1703 WeakPolarHBondContact O-CG2 3.26Å; S1699-T1703 VanDerWaalsContact CB-O 3.23Å; S1699-T1703 WeakPolarHBondContact CB-O 3.21Å; S1699-T1703 PolarHBondContact OG-N 3.42Å; S1699-T1703 PolarHBondContact OG-O 3.38Å; I1700-T1703 WeakPolarHBondContact O-CB 3.31Å; I1700-T1703 WeakPolarHBondContact O-CG2 3.5Å; I1700-T1703 PolarHBondContact O-N 2.89Å; I1700-T1703 PolarHBondContact O-OG1 2.86Å; T1703-L1705 VanDerWaalsContact C-N 3.33Å; T1703-L1705 PolarHBondContact OG1-N 2.88Å
1704	D	73.4	Confident	70.8	Confident	41 Å²	41	24.1 Å²	24.1	22%	0.219	14%	0.136	C	C	.	.	S	Bend	trans	-85.6	-0.1	173.6	68.7	-15.9	0	0	0	114.4	K1601 N1602 Y1706	K1601-D1704 CarbonylContact C-O 3.41Å; K1601-D1704 VanDerWaalsContact CA-O 3.27Å; K1601-D1704 WeakPolarHBondContact CA-O 3.34Å; K1601-D1704 WeakPolarHBondContact CE-OD2 3.36Å; K1601-D1704 HydrophobicContact CG-CB 4.43Å; K1601-D1704 WeakPolarHBondContact CG-OD2 3.38Å; K1601-D1704 IonicContact NZ-OD2 3.23Å; N1602-D1704 PolarHBondContact N-O 2.87Å; N1602-D1704 WeakPolarHBondContact ND2-CB 3.28Å; N1602-D1704 PolarHBondContact ND2-OD2 3.34Å; N1602-D1704 WeakPolarHBondContact OD1-CB 3.36Å; D1704-Y1706 WeakPolarHBondContact O-CD2 3.44Å; D1704-Y1706 WeakPolarHBondContact O-CE2 3.47Å
1705	L	83	Confident	69.8	Low	0 Å²	0	24 Å²	24	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.8	174.8	-58.4	-177.1	0	0	0	110.5	V1598 K1601 I1623 T1626 F1627 S1699 I1700 T1703	V1598-L1705 HydrophobicContact CG1-CB 4.16Å; K1601-L1705 HydrophobicContact CB-CD2 4.47Å; K1601-L1705 HydrophobicContact CD-CD2 4.35Å; K1601-L1705 HydrophobicContact CG-CD2 4.15Å; I1623-L1705 HydrophobicContact CD1-CD2 3.99Å; I1623-L1705 HydrophobicContact CG1-CD1 3.78Å; I1623-L1705 HydrophobicContact CG1-CD2 3.4Å; I1623-L1705 HydrophobicContact CG1-CG 4.23Å; I1623-L1705 VanDerWaalsContact O-CD1 3.27Å; I1623-L1705 WeakPolarHBondContact O-CD1 3.37Å; T1626-L1705 HydrophobicContact CG2-CD1 3.85Å; T1626-L1705 HydrophobicContact CG2-CD2 4.49Å; T1626-L1705 HydrophobicContact CG2-CG 3.71Å; F1627-L1705 HydrophobicContact CB-CD1 3.86Å; S1699-L1705 CarbonylContact C-O 3.54Å; S1699-L1705 WeakPolarHBondContact CA-O 3.24Å; I1700-L1705 HydrophobicContact CB-CB 4.47Å; I1700-L1705 HydrophobicContact CD1-CB 3.98Å; I1700-L1705 HydrophobicContact CD1-CD1 4.48Å; I1700-L1705 HydrophobicContact CG1-CB 4.26Å; I1700-L1705 WeakPolarHBondContact CG1-O 3.1Å; I1700-L1705 PolarHBondContact N-O 3.38Å; T1703-L1705 VanDerWaalsContact C-N 3.33Å; T1703-L1705 PolarHBondContact OG1-N 2.88Å
1706	Y	78.3	Confident	68.6	Low	73 Å²	73	17.4 Å²	17.4	29%	0.286	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126	174.3	-64.3	-101.5	0	0	0	109.5	R1599 R1600 N1602 G1697 Y1698 D1704	R1599-Y1706 WeakPolarHBondContact CA-O 3.16Å; R1599-Y1706 WeakPolarHBondContact CB-O 3.34Å; R1599-Y1706 PolarHBondContact N-O 2.79Å; R1600-Y1706 PolarHBondContact N-O 3.22Å; R1600-Y1706 PolarHBondContact O-N 3.46Å; N1602-Y1706 WeakPolarHBondContact O-CD2 3.16Å; G1697-Y1706 VanDerWaalsContact O-CD1 3.25Å; G1697-Y1706 WeakPolarHBondContact O-CD1 3.47Å; G1697-Y1706 VanDerWaalsContact O-CE1 3.32Å; G1697-Y1706 WeakPolarHBondContact O-CE1 3.41Å; Y1698-Y1706 CarbonylContact O-C 3.38Å; Y1698-Y1706 VanDerWaalsContact O-CA 3.27Å; Y1698-Y1706 WeakPolarHBondContact O-CA 3.33Å; D1704-Y1706 WeakPolarHBondContact O-CD2 3.44Å; D1704-Y1706 WeakPolarHBondContact O-CE2 3.47Å
1707	I	82.1	Confident	67.3	Low	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	164.3	168.1	66.7	169.9	0	0	0	109.9	L1596 F1690 I1693 Y1698 I1700	L1596-I1707 HydrophobicContact CD2-CG2 4.31Å; F1690-I1707 HydrophobicContact CD2-CD1 3.52Å; F1690-I1707 HydrophobicContact CE2-CD1 3.37Å; F1690-I1707 HydrophobicContact CZ-CD1 4.37Å; I1693-I1707 HydrophobicContact CB-CD1 4.28Å; I1693-I1707 HydrophobicContact CD1-CD1 4.46Å; I1693-I1707 HydrophobicContact CD1-CG2 4.37Å; I1693-I1707 HydrophobicContact CG2-CB 4.43Å; I1693-I1707 HydrophobicContact CG2-CD1 3.55Å; I1693-I1707 HydrophobicContact CG2-CG1 3.6Å; I1693-I1707 HydrophobicContact CG2-CG2 4.08Å; Y1698-I1707 HydrophobicContact CD1-CG1 4.42Å; Y1698-I1707 PolarHBondContact O-N 3.36Å; I1700-I1707 HydrophobicContact CD1-CG2 3.66Å; I1700-I1707 HydrophobicContact CG1-CG2 3.6Å
1708	D	68	Low	66	Low	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-71.4	136.8	164.7	-159.6	46.5	0	0	0	110.7	R188 Q190 L1597 R1599 Q1710 Q1711	R188-D1708 VanDerWaalsContact CD-OD2 3.28Å; R188-D1708 WeakPolarHBondContact CD-OD2 3.19Å; R188-D1708 WeakPolarHBondContact CG-OD2 3.01Å; R188-D1708 IonicContact CZ-OD1 3.18Å; R188-D1708 IonicContact CZ-OD2 2.64Å; R188-D1708 IonicContact NE-OD1 2.8Å; R188-D1708 IonicContact NE-OD2 3.92Å; R188-D1708 PolarHBondContact NE-OD2 3.09Å; R188-D1708 IonicContact NH2-OD1 3.21Å; Q190-D1708 WeakPolarHBondContact CG-OD1 3.25Å; L1597-D1708 PolarHBondContact O-N 2.84Å; L1597-D1708 VanDerWaalsContact O-N 3.15Å; R1599-D1708 HydrophobicContact CB-CB 4.02Å; R1599-D1708 WeakPolarHBondContact CD-OD1 3.05Å; R1599-D1708 HydrophobicContact CG-CB 4.44Å; R1599-D1708 IonicContact CZ-OD1 3.32Å; R1599-D1708 IonicContact NE-OD1 2.7Å; R1599-D1708 IonicContact NH1-OD1 2.69Å; R1599-D1708 PolarHBondContact NH1-OD1 3.38Å; R1599-D1708 IonicContact NH1-OD2 2.98Å; D1708-Q1710 VanDerWaalsContact CG-N 3.29Å; D1708-Q1710 PolarHBondContact O-N 2.87Å; D1708-Q1710 VanDerWaalsContact O-N 3.15Å; D1708-Q1710 WeakPolarHBondContact OD2-CA 3.36Å; D1708-Q1710 WeakPolarHBondContact OD2-CB 3.25Å; D1708-Q1710 PolarHBondContact OD2-N 2.86Å; D1708-Q1711 PolarHBondContact O-NE2 2.81Å
1709	E	57.4	Low	64.4	Low	12 Å²	12	29 Å²	29	6%	0.056	15%	0.152	C	C	.	.	S	Bend	trans	-66.3	-4.3	165.2	-64.4	156.8	-171.7	0	0	111.3	Q190 C191 Y1698	Q190-E1709 HydrophobicContact CB-CB 3.78Å; Q190-E1709 HydrophobicContact CB-CG 4.42Å; Q190-E1709 WeakPolarHBondContact CB-OE2 3.38Å; Q190-E1709 HydrophobicContact CG-CB 3.65Å; Q190-E1709 HydrophobicContact CG-CG 4.26Å; Q190-E1709 VanDerWaalsContact NE2-N 3.19Å; Q190-E1709 PolarHBondContact NE2-OE1 3.03Å; Q190-E1709 PolarHBondContact NE2-OE2 3.35Å; Q190-E1709 VanDerWaalsContact O-OE2 3.13Å; C191-E1709 VanDerWaalsContact C-CD 3.48Å; C191-E1709 PolarHBondContact N-OE2 3.41Å; C191-E1709 VanDerWaalsContact N-OE2 3.1Å; Y1698-E1709 HydrophobicContact CD1-CG 3.66Å; Y1698-E1709 HydrophobicContact CD2-CG 3.36Å; Y1698-E1709 WeakPolarHBondContact CD2-OE1 2.94Å; Y1698-E1709 HydrophobicContact CE1-CB 4.36Å; Y1698-E1709 HydrophobicContact CE1-CG 3.65Å; Y1698-E1709 VanDerWaalsContact CE2-CD 3.5Å; Y1698-E1709 HydrophobicContact CE2-CG 3.35Å; Y1698-E1709 WeakPolarHBondContact CE2-OE1 3.43Å; Y1698-E1709 HydrophobicContact CG-CG 3.51Å; Y1698-E1709 VanDerWaalsContact CZ-CG 3.47Å
1710	Q	52.7	Low	62.9	Low	4 Å²	4	37.3 Å²	37.3	2%	0.019	19%	0.19	C	C	.	.	S	Bend	trans	-125.6	94.2	160.6	-63.5	-173.5	11.3	0	0	115.2	C189 P206 G207 D1708	C189-Q1710 VanDerWaalsContact C-NE2 3.31Å; C189-Q1710 VanDerWaalsContact CA-CD 3.49Å; C189-Q1710 VanDerWaalsContact CB-CD 3.41Å; C189-Q1710 VanDerWaalsContact CB-OE1 3.27Å; C189-Q1710 VanDerWaalsContact N-OE1 3.08Å; C189-Q1710 WeakPolarHBondContact O-CB 3.3Å; C189-Q1710 WeakPolarHBondContact O-CG 3.04Å; P206-Q1710 VanDerWaalsContact C-CD 3.49Å; P206-Q1710 VanDerWaalsContact C-CG 3.5Å; P206-Q1710 HydrophobicContact CB-CB 4.18Å; P206-Q1710 HydrophobicContact CB-CG 3.93Å; P206-Q1710 VanDerWaalsContact CG-CA 3.42Å; P206-Q1710 HydrophobicContact CG-CB 3.73Å; P206-Q1710 HydrophobicContact CG-CG 4.03Å; P206-Q1710 WeakPolarHBondContact O-CG 3.32Å; P206-Q1710 PolarHBondContact O-NE2 2.86Å; P206-Q1710 PolarHBondContact O-OE1 3.47Å; G207-Q1710 PolarHBondContact O-NE2 3.3Å; D1708-Q1710 VanDerWaalsContact CG-N 3.29Å; D1708-Q1710 PolarHBondContact O-N 2.87Å; D1708-Q1710 VanDerWaalsContact O-N 3.15Å; D1708-Q1710 WeakPolarHBondContact OD2-CA 3.36Å; D1708-Q1710 WeakPolarHBondContact OD2-CB 3.25Å; D1708-Q1710 PolarHBondContact OD2-N 2.86Å
1711	Q	63.8	Low	61.3	Low	3 Å²	3	39.2 Å²	39.2	1%	0.014	20%	0.203	C	C	.	.			trans	-65.5	176.3	169.6	-66.2	-56.1	-61.1	0	0	113.5	S203 P206 L1597 W1686 F1690 D1708	S203-Q1711 CarbonylContact O-C 3.52Å; P206-Q1711 WeakPolarHBondContact CD-O 3.27Å; P206-Q1711 HydrophobicContact CG-CB 4.42Å; P206-Q1711 VanDerWaalsContact CG-N 3.27Å; P206-Q1711 VanDerWaalsContact CG-O 3.25Å; P206-Q1711 WeakPolarHBondContact CG-O 3.23Å; L1597-Q1711 PolarHBondContact O-NE2 2.81Å; W1686-Q1711 HydrophobicContact CH2-CB 4.41Å; W1686-Q1711 HydrophobicContact CH2-CG 4.26Å; W1686-Q1711 HydrophobicContact CZ2-CB 4.03Å; W1686-Q1711 HydrophobicContact CZ2-CG 4.04Å; F1690-Q1711 HydrophobicContact CD2-CG 4.33Å; F1690-Q1711 HydrophobicContact CE2-CG 3.74Å; D1708-Q1711 PolarHBondContact O-NE2 2.81Å
1712	P	55.8	Low	60.5	Low	1 Å²	1	40.4 Å²	40.4	1%	0.006	21%	0.209	C	C	.	.			trans	-108	180	164.8	44.8	-38.1	0	0	0	111.2	S203 L1597 W1662 W1667	S203-P1712 CarbonylContact C-O 3.55Å; S203-P1712 VanDerWaalsContact C-O 3.31Å; S203-P1712 WeakPolarHBondContact CA-O 3.48Å; S203-P1712 WeakPolarHBondContact CB-O 3.48Å; S203-P1712 CarbonylContact O-C 3.57Å; S203-P1712 WeakPolarHBondContact O-CA 3.39Å; L1597-P1712 HydrophobicContact CB-CG 4.27Å; W1662-P1712 HydrophobicContact CE3-CB 4.49Å; W1662-P1712 HydrophobicContact CH2-CB 3.2Å; W1662-P1712 HydrophobicContact CH2-CG 4.2Å; W1662-P1712 HydrophobicContact CZ2-CB 3.24Å; W1662-P1712 HydrophobicContact CZ2-CG 4.39Å; W1662-P1712 HydrophobicContact CZ3-CB 3.85Å; W1662-P1712 HydrophobicContact CZ3-CG 4.41Å; W1667-P1712 HydrophobicContact CE3-CG 3.85Å; W1667-P1712 HydrophobicContact CH2-CG 3.51Å; W1667-P1712 HydrophobicContact CZ3-CB 4.35Å; W1667-P1712 HydrophobicContact CZ3-CG 3.02Å
1713	P	50.5	Low	59.8	Low	4 Å²	4	48.1 Å²	48.1	3%	0.026	23%	0.23	C	C	.	.			trans	-74.7	140.5	-157	15.3	-16.1	0	0	0	116.7	S203 R204 C1716 Y1717	S203-P1713 VanDerWaalsContact OG-CA 3.3Å; S203-P1713 WeakPolarHBondContact OG-CA 3.28Å; R204-P1713 HydrophobicContact CB-CB 3.88Å; R204-P1713 HydrophobicContact CB-CG 3.85Å; R204-P1713 HydrophobicContact CG-CB 4.41Å; R204-P1713 HydrophobicContact CG-CG 3.82Å; P1713-C1716 HydrophobicContact CB-CB 4.01Å; P1713-C1716 HydrophobicContact CG-CB 4.47Å; P1713-Y1717 WeakPolarHBondContact O-CD1 3.33Å
1714	F	51.5	Low	58.4	Low	45 Å²	45	51.1 Å²	51.1	20%	0.197	24%	0.241	C	C	.	.	S	Bend	trans	-80.2	-55.2	166.6	-168.5	-89.3	0	0	0	111.6	S203 H1593 L1594 P1682 W1686 C1716 Y1717	S203-F1714 VanDerWaalsContact CB-N 3.25Å; S203-F1714 PolarHBondContact OG-N 2.78Å; H1593-F1714 WeakPolarHBondContact O-CE2 3.11Å; H1593-F1714 WeakPolarHBondContact O-CZ 3.28Å; L1594-F1714 HydrophobicContact CD2-CD2 4.5Å; L1594-F1714 HydrophobicContact CD2-CE2 3.94Å; L1594-F1714 HydrophobicContact CD2-CZ 4.48Å; P1682-F1714 HydrophobicContact CB-CD1 4.35Å; P1682-F1714 HydrophobicContact CB-CE1 3.37Å; P1682-F1714 HydrophobicContact CB-CE2 4.48Å; P1682-F1714 HydrophobicContact CB-CZ 3.46Å; P1682-F1714 VanDerWaalsContact CB-CZ 3.46Å; P1682-F1714 HydrophobicContact CG-CE1 4.43Å; W1686-F1714 HydrophobicContact CD2-CD2 4.38Å; W1686-F1714 HydrophobicContact CE3-CD2 4.21Å; F1714-C1716 PolarHBondContact O-N 2.89Å; F1714-Y1717 WeakPolarHBondContact O-CD1 3.33Å
1715	A	53.9	Low	57.6	Low	36 Å²	36	50 Å²	50	30%	0.298	24%	0.237	S	C	.	.	S	Bend	trans	-72.1	-28.4	-177	0	0	0	0	0	113.7	C1735	A1715-C1735 PolarHBondContact O-SG 3.17Å
1716	C	47.1	Very low	56.2	Low	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	-123.6	21.8	-158.2	-66.7	0	0	0	0	117.2	R204 P1713 F1714 L1727 C1735	R204-C1716 PolarHBondContact NH1-O 3.38Å; P1713-C1716 HydrophobicContact CB-CB 4.01Å; P1713-C1716 HydrophobicContact CG-CB 4.47Å; F1714-C1716 PolarHBondContact O-N 2.89Å; C1716-L1727 HydrophobicContact CB-CD2 3.89Å; C1716-C1735 WeakPolarHBondContact CA-SG 3.38Å; C1716-C1735 HydrophobicContact CB-CB 3.96Å; C1716-C1735 WeakPolarHBondContact CB-SG 2.97Å; C1716-C1735 WeakPolarHBondContact SG-CB 3.49Å; C1716-C1735 CovalentContact SG-SG 2.03Å; C1716-C1735 PolarHBondContact SG-SG 2.7Å
1717	Y	51.3	Low	54.8	Low	77 Å²	77	52.8 Å²	52.8	30%	0.302	26%	0.256	S	S	.	.	S	Bend	trans	-80.6	-11.6	178	73.6	-87.6	0	0	0	114.6	P1713 F1714	P1713-Y1717 WeakPolarHBondContact O-CD1 3.33Å; F1714-Y1717 WeakPolarHBondContact O-CD1 3.33Å
1718	Q	45.9	Very low	53.2	Low	157 Å²	157	56.5 Å²	56.5	73%	0.734	28%	0.275	S	S	*	.	S	Bend	trans	-102.3	-1.8	-176.7	-62.1	-172	-13.4	0	0	115.2
1719	H	49.1	Very low	52	Low	84 Å²	84	58.5 Å²	58.5	39%	0.389	29%	0.285	S	S	.	.			trans	-90	136.1	-172.8	-143.3	-73	0	0	0	112.5	L1727 C1735	H1719-L1727 HydrophobicContact CB-CD1 4.26Å; H1719-L1727 HydrophobicContact CB-CD2 4.38Å; H1719-L1727 WeakPolarHBondContact O-CD1 3.15Å; H1719-C1735 HydrophobicContact CB-CB 4.13Å
1720	Q	47.2	Very low	51.3	Low	178 Å²	178	65 Å²	65	83%	0.832	31%	0.309	S	S	*	.			trans	-93.5	150.1	173.4	-68.2	176.1	-29.7	0	0	111.4	C1737	Q1720-C1737 PolarHBondContact O-SG 3.4Å
1721	C	49.8	Very low	51.2	Low	40 Å²	40	68.2 Å²	68.2	27%	0.27	34%	0.344	S	S	.	.			trans	-156.2	171	178.7	-65.6	0	0	0	0	110.5	A1725 C1737	C1721-A1725 HydrophobicContact CB-CB 4.19Å; C1721-C1737 WeakPolarHBondContact CA-SG 3.3Å; C1721-C1737 HydrophobicContact CB-CB 3.77Å; C1721-C1737 WeakPolarHBondContact CB-SG 3.1Å; C1721-C1737 VanDerWaalsContact SG-CA 3.57Å; C1721-C1737 WeakPolarHBondContact SG-CB 3.41Å; C1721-C1737 CovalentContact SG-SG 2.03Å; C1721-C1737 PolarHBondContact SG-SG 3.38Å
1722	D	58.5	Low	50.1	Low	25 Å²	25	71.7 Å²	71.7	13%	0.134	36%	0.363	C	S	.	.			trans	-58.8	144	164.3	-169.8	-49.9	0	0	0	110	K1724 A1725 G1752 T1753 C1755	D1722-K1724 PolarHBondContact O-N 3.17Å; D1722-K1724 VanDerWaalsContact O-N 3.1Å; D1722-K1724 VanDerWaalsContact OD1-CD 3.32Å; D1722-K1724 WeakPolarHBondContact OD1-CD 2.78Å; D1722-K1724 PolarHBondContact OD1-N 2.72Å; D1722-K1724 IonicContact OD1-NZ 2.68Å; D1722-K1724 IonicContact OD2-NZ 3.13Å; D1722-K1724 PolarHBondContact OD2-NZ 3.1Å; D1722-A1725 HydrophobicContact CB-CB 4.04Å; D1722-A1725 WeakPolarHBondContact O-CB 3.1Å; D1722-A1725 PolarHBondContact O-N 3.47Å; D1722-G1752 PolarHBondContact N-O 3.22Å; D1722-G1752 VanDerWaalsContact N-O 3.17Å; D1722-T1753 WeakPolarHBondContact CB-O 2.98Å; D1722-C1755 PolarHBondContact OD2-N 3.42Å
1723	K	53.5	Low	49.3	Very low	207 Å²	207	74.1 Å²	74.1	90%	0.9	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-22	173.3	-62.9	-173.8	178.5	-175.2	0	114.2
1724	K	53	Low	49	Very low	87 Å²	87	76 Å²	76	38%	0.378	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-15.5	175.5	-51.6	139.4	-169.5	150	0	112.9	D1722 P1740 Y1743 C1755	D1722-K1724 PolarHBondContact O-N 3.17Å; D1722-K1724 VanDerWaalsContact O-N 3.1Å; D1722-K1724 VanDerWaalsContact OD1-CD 3.32Å; D1722-K1724 WeakPolarHBondContact OD1-CD 2.78Å; D1722-K1724 PolarHBondContact OD1-N 2.72Å; D1722-K1724 IonicContact OD1-NZ 2.68Å; D1722-K1724 IonicContact OD2-NZ 3.13Å; D1722-K1724 PolarHBondContact OD2-NZ 3.1Å; K1724-P1740 WeakPolarHBondContact O-CD 3.43Å; K1724-P1740 WeakPolarHBondContact O-CG 3.11Å; K1724-Y1743 HydrophobicContact CB-CD1 4.48Å; K1724-Y1743 HydrophobicContact CB-CE1 4.34Å; K1724-Y1743 HydrophobicContact CD-CD1 3.84Å; K1724-Y1743 HydrophobicContact CD-CE1 3.54Å; K1724-Y1743 HydrophobicContact CG-CD1 4.42Å; K1724-Y1743 HydrophobicContact CG-CE1 3.91Å; K1724-C1755 HydrophobicContact CB-CB 4.14Å; K1724-C1755 HydrophobicContact CD-CB 4.01Å; K1724-C1755 WeakPolarHBondContact CD-O 3.22Å; K1724-C1755 WeakPolarHBondContact CE-O 3.44Å; K1724-C1755 PolarHBondContact NZ-O 3.41Å
1725	A	56.5	Low	48.9	Very low	16 Å²	16	74.2 Å²	74.2	13%	0.132	39%	0.392	C	S	.	.	S	Bend	trans	-80.1	144.6	-177.2	0	0	0	0	0	111.3	C1721 D1722 C1737 K1738 G1752	C1721-A1725 HydrophobicContact CB-CB 4.19Å; D1722-A1725 HydrophobicContact CB-CB 4.04Å; D1722-A1725 WeakPolarHBondContact O-CB 3.1Å; D1722-A1725 PolarHBondContact O-N 3.47Å; A1725-C1737 HydrophobicContact CB-CB 4.28Å; A1725-K1738 CarbonylContact C-O 3.49Å; A1725-K1738 VanDerWaalsContact CA-O 3.3Å; A1725-K1738 WeakPolarHBondContact CA-O 3.48Å; A1725-G1752 VanDerWaalsContact CB-O 3.23Å; A1725-G1752 WeakPolarHBondContact CB-O 3.49Å
1726	I	54.3	Low	49	Very low	104 Å²	104	73.3 Å²	73.3	53%	0.533	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-86.7	128.8	174.6	-58.7	176.8	0	0	0	108.7	I1728 C1737 K1738	I1726-I1728 HydrophobicContact CG2-CG1 4.37Å; I1726-C1737 CarbonylContact O-C 3.56Å; I1726-K1738 PolarHBondContact N-O 3.1Å; I1726-K1738 PolarHBondContact O-N 2.82Å
1727	L	49.9	Very low	49.8	Very low	29 Å²	29	74.3 Å²	74.3	15%	0.152	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-93.7	121.4	179	-152.8	167.9	0	0	0	109.6	C1716 H1719 C1735 A1736	C1716-L1727 HydrophobicContact CB-CD2 3.89Å; H1719-L1727 HydrophobicContact CB-CD1 4.26Å; H1719-L1727 HydrophobicContact CB-CD2 4.38Å; H1719-L1727 WeakPolarHBondContact O-CD1 3.15Å; L1727-C1735 HydrophobicContact CD2-CB 3.88Å; L1727-A1736 WeakPolarHBondContact CA-O 3.23Å
1728	I	47.4	Very low	50	Low	77 Å²	77	76.8 Å²	76.8	40%	0.395	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132	-170.7	-39.6	177.5	0	0	0	110	I1726 C1735 A1736 K1738	I1726-I1728 HydrophobicContact CG2-CG1 4.37Å; I1728-C1735 CarbonylContact O-C 3.39Å; I1728-C1735 VanDerWaalsContact O-CA 3.24Å; I1728-C1735 WeakPolarHBondContact O-CA 3.33Å; I1728-A1736 PolarHBondContact N-O 3.45Å; I1728-A1736 PolarHBondContact O-N 2.87Å; I1728-K1738 HydrophobicContact CD1-CB 4.17Å; I1728-K1738 HydrophobicContact CD1-CD 4.42Å
1729	D	42.9	Very low	50.8	Low	42 Å²	42	70.2 Å²	70.2	23%	0.225	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	126.2	161.7	-174.2	-10.9	0	0	0	109.3	G1731	D1729-G1731 VanDerWaalsContact C-N 3.28Å; D1729-G1731 PolarHBondContact OD1-N 3.46Å
1730	R	43.5	Very low	51.1	Low	148 Å²	148	68.1 Å²	68.1	56%	0.558	37%	0.368	S	S	*	.			trans	-79.7	-8.4	178.6	-69	175.3	163	161.5	-1	113.4	D1732 V1734	R1730-D1732 WeakPolarHBondContact CB-OD1 3.3Å; R1730-V1734 VanDerWaalsContact CB-O 3.24Å; R1730-V1734 WeakPolarHBondContact CB-O 3.13Å; R1730-V1734 WeakPolarHBondContact CG-O 3.29Å; R1730-V1734 PolarHBondContact N-O 3.02Å
1731	G	50.1	Low	51.3	Low	72 Å²	72	65.7 Å²	65.7	74%	0.742	37%	0.371	S	S	*	.	S	Bend	trans	85.8	1.3	-179.8	0	0	0	0	0	114.8	D1729	D1729-G1731 VanDerWaalsContact C-N 3.28Å; D1729-G1731 PolarHBondContact OD1-N 3.46Å
1732	D	39.8	Very low	51.1	Low	77 Å²	77	65.5 Å²	65.5	41%	0.412	38%	0.376	S	S	.	.	S	Bend	trans	-113	8.3	173.9	68.3	-40.1	0	0	0	113.5	R1730 R2365	R1730-D1732 WeakPolarHBondContact CB-OD1 3.3Å; D1732-R2365 IonicContact OD1-NH2 2.79Å; D1732-R2365 IonicContact OD2-CZ 3.43Å; D1732-R2365 IonicContact OD2-NE 2.74Å; D1732-R2365 PolarHBondContact OD2-NE 3.08Å; D1732-R2365 IonicContact OD2-NH2 3.15Å; D1732-R2365 PolarHBondContact OD2-NH2 2.84Å
1733	G	38.8	Very low	51.2	Low	51 Å²	51	68.3 Å²	68.3	53%	0.526	39%	0.385	S	S	.	.	S	Bend	trans	86.9	11.9	-176.9	0	0	0	0	0	114.6
1734	V	45.6	Very low	51.6	Low	43 Å²	43	62.1 Å²	62.1	26%	0.261	36%	0.364	S	S	.	.			trans	-118.9	144.5	174.2	-175.7	0	0	0	0	109.3	R1730	R1730-V1734 VanDerWaalsContact CB-O 3.24Å; R1730-V1734 WeakPolarHBondContact CB-O 3.13Å; R1730-V1734 WeakPolarHBondContact CG-O 3.29Å; R1730-V1734 PolarHBondContact N-O 3.02Å
1735	C	48.3	Very low	52	Low	9 Å²	9	60.6 Å²	60.6	6%	0.061	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	169.4	-174.9	-41.5	0	0	0	0	111.5	A1715 C1716 H1719 L1727 I1728	A1715-C1735 PolarHBondContact O-SG 3.17Å; C1716-C1735 WeakPolarHBondContact CA-SG 3.38Å; C1716-C1735 HydrophobicContact CB-CB 3.96Å; C1716-C1735 WeakPolarHBondContact CB-SG 2.97Å; C1716-C1735 WeakPolarHBondContact SG-CB 3.49Å; C1716-C1735 CovalentContact SG-SG 2.03Å; C1716-C1735 PolarHBondContact SG-SG 2.7Å; H1719-C1735 HydrophobicContact CB-CB 4.13Å; L1727-C1735 HydrophobicContact CD2-CB 3.88Å; I1728-C1735 CarbonylContact O-C 3.39Å; I1728-C1735 VanDerWaalsContact O-CA 3.24Å; I1728-C1735 WeakPolarHBondContact O-CA 3.33Å
1736	A	56.3	Low	52.1	Low	17 Å²	17	67.1 Å²	67.1	14%	0.14	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	154.7	174.2	0	0	0	0	0	112.3	L1727 I1728	L1727-A1736 WeakPolarHBondContact CA-O 3.23Å; I1728-A1736 PolarHBondContact N-O 3.45Å; I1728-A1736 PolarHBondContact O-N 2.87Å
1737	C	64.9	Low	51.7	Low	20 Å²	20	64.8 Å²	64.8	14%	0.135	37%	0.374	C	S	.	.			trans	-94.3	157.7	170.9	-47.7	0	0	0	0	110.4	Q1720 C1721 A1725 I1726 G1752	Q1720-C1737 PolarHBondContact O-SG 3.4Å; C1721-C1737 WeakPolarHBondContact CA-SG 3.3Å; C1721-C1737 HydrophobicContact CB-CB 3.77Å; C1721-C1737 WeakPolarHBondContact CB-SG 3.1Å; C1721-C1737 VanDerWaalsContact SG-CA 3.57Å; C1721-C1737 WeakPolarHBondContact SG-CB 3.41Å; C1721-C1737 CovalentContact SG-SG 2.03Å; C1721-C1737 PolarHBondContact SG-SG 3.38Å; A1725-C1737 HydrophobicContact CB-CB 4.28Å; I1726-C1737 CarbonylContact O-C 3.56Å; C1737-G1752 WeakPolarHBondContact CB-O 3.48Å
1738	K	54.4	Low	51.6	Low	130 Å²	130	70.3 Å²	70.3	57%	0.565	41%	0.409	S	S	*	.			trans	-156.3	128.8	171.7	176	176	176.3	-179.8	0	111.9	A1725 I1726 I1728	A1725-K1738 CarbonylContact C-O 3.49Å; A1725-K1738 VanDerWaalsContact CA-O 3.3Å; A1725-K1738 WeakPolarHBondContact CA-O 3.48Å; I1726-K1738 PolarHBondContact N-O 3.1Å; I1726-K1738 PolarHBondContact O-N 2.82Å; I1728-K1738 HydrophobicContact CD1-CB 4.17Å; I1728-K1738 HydrophobicContact CD1-CD 4.42Å
1739	C	61.9	Low	51.4	Low	19 Å²	19	70.9 Å²	70.9	13%	0.128	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-68.4	140.5	171.3	-60.1	0	0	0	0	112.7	C1755	C1739-C1755 WeakPolarHBondContact CA-SG 3.4Å; C1739-C1755 HydrophobicContact CB-CB 3.87Å; C1739-C1755 WeakPolarHBondContact CB-SG 3.44Å; C1739-C1755 WeakPolarHBondContact SG-CA 3.5Å; C1739-C1755 WeakPolarHBondContact SG-CB 3.45Å; C1739-C1755 CovalentContact SG-SG 2.04Å; C1739-C1755 PolarHBondContact SG-SG 2.86Å
1740	P	56.9	Low	51.7	Low	39 Å²	39	72.1 Å²	72.1	25%	0.253	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-80.9	159.5	177.5	32.7	-35	0	0	0	112.3	K1724 Y1743	K1724-P1740 WeakPolarHBondContact O-CD 3.43Å; K1724-P1740 WeakPolarHBondContact O-CG 3.11Å; P1740-Y1743 HydrophobicContact CG-CD2 3.8Å; P1740-Y1743 HydrophobicContact CG-CE2 4.41Å; P1740-Y1743 HydrophobicContact CG-CG 4.29Å; P1740-Y1743 WeakPolarHBondContact O-CB 3.16Å; P1740-Y1743 PolarHBondContact O-N 2.8Å
1741	S	50.5	Low	51.9	Low	128 Å²	128	69.2 Å²	69.2	90%	0.895	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	138.2	174.8	-57.5	0	0	0	0	111.8	Y1743	S1741-Y1743 VanDerWaalsContact C-N 3.32Å
1742	G	45.7	Very low	52.3	Low	35 Å²	35	65.8 Å²	65.8	36%	0.361	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-9	-168.2	0	0	0	0	0	113.6	P1757 M1758	G1742-P1757 WeakPolarHBondContact O-CA 3.42Å; G1742-M1758 PolarHBondContact O-N 3.04Å
1743	Y	61.3	Low	53.5	Low	85 Å²	85	64.8 Å²	64.8	33%	0.333	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	151.2	167.2	-65.2	-109.3	0	0	0	109.5	K1724 P1740 S1741 C1755 V1756 P1757	K1724-Y1743 HydrophobicContact CB-CD1 4.48Å; K1724-Y1743 HydrophobicContact CB-CE1 4.34Å; K1724-Y1743 HydrophobicContact CD-CD1 3.84Å; K1724-Y1743 HydrophobicContact CD-CE1 3.54Å; K1724-Y1743 HydrophobicContact CG-CD1 4.42Å; K1724-Y1743 HydrophobicContact CG-CE1 3.91Å; P1740-Y1743 HydrophobicContact CG-CD2 3.8Å; P1740-Y1743 HydrophobicContact CG-CE2 4.41Å; P1740-Y1743 HydrophobicContact CG-CG 4.29Å; P1740-Y1743 WeakPolarHBondContact O-CB 3.16Å; P1740-Y1743 PolarHBondContact O-N 2.8Å; S1741-Y1743 VanDerWaalsContact C-N 3.32Å; Y1743-C1755 HydrophobicContact CD1-CB 4.2Å; Y1743-V1756 CarbonylContact C-O 3.42Å; Y1743-V1756 WeakPolarHBondContact CA-O 3.22Å; Y1743-V1756 VanDerWaalsContact CD1-C 3.46Å; Y1743-P1757 HydrophobicContact CD1-CB 3.86Å; Y1743-P1757 HydrophobicContact CD1-CG 4.41Å; Y1743-P1757 VanDerWaalsContact CD1-N 3.3Å; Y1743-P1757 HydrophobicContact CE1-CB 3.56Å; Y1743-P1757 HydrophobicContact CE1-CG 3.97Å; Y1743-P1757 HydrophobicContact CE2-CB 4.47Å; Y1743-P1757 HydrophobicContact CG-CB 4.42Å
1744	V	61.4	Low	54.7	Low	76 Å²	76	67.8 Å²	67.8	46%	0.461	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	155.3	167.6	-72	0	0	0	0	110	V1756 M1758	V1744-V1756 HydrophobicContact CG2-CG2 4.17Å; V1744-V1756 PolarHBondContact N-O 3.38Å; V1744-V1756 PolarHBondContact O-N 3.31Å; V1744-M1758 HydrophobicContact CG1-CE 3.95Å
1745	D	60.9	Low	55.1	Low	56 Å²	56	65.8 Å²	65.8	30%	0.299	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	147.9	173.2	-128.4	-51.3	0	0	0	110.6	D1747 P1751 G1752 Y1754	D1745-D1747 PolarHBondContact OD1-N 2.74Å; D1745-P1751 VanDerWaalsContact OD2-CA 3.28Å; D1745-P1751 WeakPolarHBondContact OD2-CA 3.39Å; D1745-G1752 PolarHBondContact OD2-N 3.24Å; D1745-Y1754 VanDerWaalsContact OD1-O 3.11Å
1746	K	58.4	Low	55.3	Low	153 Å²	153	67.3 Å²	67.3	67%	0.665	37%	0.371	S	S	*	.	S	Bend	trans	-115.5	-2.5	168.4	-145	-175.7	177.8	-172	0	112.6	Y1754 V1756	K1746-Y1754 HydrophobicContact CB-CD1 3.4Å; K1746-Y1754 HydrophobicContact CB-CE1 3.78Å; K1746-Y1754 HydrophobicContact CB-CG 4.44Å; K1746-Y1754 HydrophobicContact CD-CD1 4.26Å; K1746-Y1754 HydrophobicContact CD-CE1 3.74Å; K1746-Y1754 HydrophobicContact CG-CD1 4.45Å; K1746-Y1754 HydrophobicContact CG-CE1 4.41Å; K1746-Y1754 PolarHBondContact N-O 3.46Å; K1746-V1756 HydrophobicContact CB-CG2 4.29Å
1747	D	45.8	Very low	54.8	Low	54 Å²	54	68.9 Å²	68.9	29%	0.289	38%	0.38	S	S	.	.			trans	-109.8	119.4	171.2	-177.7	-9.4	0	0	0	108.5	D1745 L1749 H1750 T1753	D1745-D1747 PolarHBondContact OD1-N 2.74Å; D1747-L1749 VanDerWaalsContact C-N 3.34Å; D1747-L1749 WeakPolarHBondContact OD1-CA 3.08Å; D1747-L1749 PolarHBondContact OD1-N 2.94Å; D1747-H1750 PolarHBondContact OD1-N 2.85Å; D1747-T1753 WeakPolarHBondContact CB-OG1 3.37Å; D1747-T1753 PolarHBondContact OD2-OG1 3.22Å
1748	V	49.7	Very low	53.4	Low	145 Å²	145	73.7 Å²	73.7	88%	0.879	40%	0.402	S	S	*	.	S	Bend	trans	-82.9	-19.2	-179.5	-178.8	0	0	0	0	111.3
1749	L	42.1	Very low	52.4	Low	89 Å²	89	72.8 Å²	72.8	47%	0.466	40%	0.402	S	S	.	.	S	Bend	trans	-102.1	-30	-164.7	-150.6	43.7	0	0	0	111.6	D1747 F2361	D1747-L1749 VanDerWaalsContact C-N 3.34Å; D1747-L1749 WeakPolarHBondContact OD1-CA 3.08Å; D1747-L1749 PolarHBondContact OD1-N 2.94Å; L1749-F2361 HydrophobicContact CD1-CD2 4.35Å; L1749-F2361 HydrophobicContact CD2-CD2 3.8Å; L1749-F2361 HydrophobicContact CD2-CE2 3.19Å; L1749-F2361 HydrophobicContact CD2-CZ 3.75Å; L1749-F2361 HydrophobicContact CG-CD2 3.85Å; L1749-F2361 HydrophobicContact CG-CE2 3.61Å; L1749-F2361 HydrophobicContact CG-CZ 3.98Å
1750	H	48.7	Very low	50.9	Low	69 Å²	69	77.3 Å²	77.3	32%	0.319	43%	0.431	S	S	.	.	S	Bend	trans	-129.1	83.4	170.2	-85.3	46.7	0	0	0	112.8	D1747 G1752 T1753 F2361	D1747-H1750 PolarHBondContact OD1-N 2.85Å; H1750-G1752 PolarHBondContact O-N 3Å; H1750-T1753 HydrophobicContact CB-CG2 3.58Å; H1750-T1753 WeakPolarHBondContact O-CG2 3.36Å; H1750-T1753 PolarHBondContact O-N 2.96Å; H1750-T1753 PolarHBondContact O-OG1 3.36Å; H1750-F2361 AromaticContact CE1-CD1 3.21Å; H1750-F2361 WeakPolarHBondContact CE1-CD1 3.42Å; H1750-F2361 AromaticContact CE1-CE1 3.63Å; H1750-F2361 AromaticContact ND1-CD1 3.71Å; H1750-F2361 AromaticContact ND1-CE1 3.71Å
1751	P	49.3	Very low	49.4	Very low	86 Å²	86	82.5 Å²	82.5	56%	0.558	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	128.9	-176.2	-28.1	36	0	0	0	114.3	D1745	D1745-P1751 VanDerWaalsContact OD2-CA 3.28Å; D1745-P1751 WeakPolarHBondContact OD2-CA 3.39Å
1752	G	57.6	Low	48.2	Very low	0 Å²	0	80.8 Å²	80.8	0%	0	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	7	-178.5	0	0	0	0	0	115.8	D1722 A1725 C1737 D1745 H1750	D1722-G1752 PolarHBondContact N-O 3.22Å; D1722-G1752 VanDerWaalsContact N-O 3.17Å; A1725-G1752 VanDerWaalsContact CB-O 3.23Å; A1725-G1752 WeakPolarHBondContact CB-O 3.49Å; C1737-G1752 WeakPolarHBondContact CB-O 3.48Å; D1745-G1752 PolarHBondContact OD2-N 3.24Å; H1750-G1752 PolarHBondContact O-N 3Å
1753	T	64.9	Low	47.5	Very low	56 Å²	56	83.2 Å²	83.2	34%	0.344	47%	0.465	S	S	.	.	S	Bend	trans	-75.6	-27	167.6	53.8	0	0	0	0	112.6	D1722 D1747 H1750	D1722-T1753 WeakPolarHBondContact CB-O 2.98Å; D1747-T1753 WeakPolarHBondContact CB-OG1 3.37Å; D1747-T1753 PolarHBondContact OD2-OG1 3.22Å; H1750-T1753 HydrophobicContact CB-CG2 3.58Å; H1750-T1753 WeakPolarHBondContact O-CG2 3.36Å; H1750-T1753 PolarHBondContact O-N 2.96Å; H1750-T1753 PolarHBondContact O-OG1 3.36Å
1754	Y	64.1	Low	45.8	Very low	115 Å²	115	84.2 Å²	84.2	45%	0.451	48%	0.482	S	S	.	.	S	Bend	trans	-148.8	103.6	-176.7	-167	-83.4	0	0	0	112.9	D1745 K1746 V1756	D1745-Y1754 VanDerWaalsContact OD1-O 3.11Å; K1746-Y1754 HydrophobicContact CB-CD1 3.4Å; K1746-Y1754 HydrophobicContact CB-CE1 3.78Å; K1746-Y1754 HydrophobicContact CB-CG 4.44Å; K1746-Y1754 HydrophobicContact CD-CD1 4.26Å; K1746-Y1754 HydrophobicContact CD-CE1 3.74Å; K1746-Y1754 HydrophobicContact CG-CD1 4.45Å; K1746-Y1754 HydrophobicContact CG-CE1 4.41Å; K1746-Y1754 PolarHBondContact N-O 3.46Å; Y1754-V1756 HydrophobicContact CD1-CG1 4.17Å; Y1754-V1756 HydrophobicContact CE1-CG1 3.48Å; Y1754-V1756 VanDerWaalsContact CE1-CG1 3.48Å
1755	C	53.1	Low	44	Very low	0 Å²	0	85.2 Å²	85.2	0%	0	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123	-177	-55.8	0	0	0	0	111.6	D1722 K1724 C1739 Y1743	D1722-C1755 PolarHBondContact OD2-N 3.42Å; K1724-C1755 HydrophobicContact CB-CB 4.14Å; K1724-C1755 HydrophobicContact CD-CB 4.01Å; K1724-C1755 WeakPolarHBondContact CD-O 3.22Å; K1724-C1755 WeakPolarHBondContact CE-O 3.44Å; K1724-C1755 PolarHBondContact NZ-O 3.41Å; C1739-C1755 WeakPolarHBondContact CA-SG 3.4Å; C1739-C1755 HydrophobicContact CB-CB 3.87Å; C1739-C1755 WeakPolarHBondContact CB-SG 3.44Å; C1739-C1755 WeakPolarHBondContact SG-CA 3.5Å; C1739-C1755 WeakPolarHBondContact SG-CB 3.45Å; C1739-C1755 CovalentContact SG-SG 2.04Å; C1739-C1755 PolarHBondContact SG-SG 2.86Å; Y1743-C1755 HydrophobicContact CD1-CB 4.2Å
1756	V	52.9	Low	42.2	Very low	42 Å²	42	86.7 Å²	86.7	26%	0.255	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.7	175.3	-80.6	0	0	0	0	112.2	Y1743 V1744 K1746 Y1754	Y1743-V1756 CarbonylContact C-O 3.42Å; Y1743-V1756 WeakPolarHBondContact CA-O 3.22Å; Y1743-V1756 VanDerWaalsContact CD1-C 3.46Å; V1744-V1756 HydrophobicContact CG2-CG2 4.17Å; V1744-V1756 PolarHBondContact N-O 3.38Å; V1744-V1756 PolarHBondContact O-N 3.31Å; K1746-V1756 HydrophobicContact CB-CG2 4.29Å; Y1754-V1756 HydrophobicContact CD1-CG1 4.17Å; Y1754-V1756 HydrophobicContact CE1-CG1 3.48Å; Y1754-V1756 VanDerWaalsContact CE1-CG1 3.48Å
1757	P	46.1	Very low	40.8	Very low	50 Å²	50	85 Å²	85	33%	0.325	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	149.6	-178.1	28.7	-32.7	0	0	0	111.7	G1742 Y1743 I1759	G1742-P1757 WeakPolarHBondContact O-CA 3.42Å; Y1743-P1757 HydrophobicContact CD1-CB 3.86Å; Y1743-P1757 HydrophobicContact CD1-CG 4.41Å; Y1743-P1757 VanDerWaalsContact CD1-N 3.3Å; Y1743-P1757 HydrophobicContact CE1-CB 3.56Å; Y1743-P1757 HydrophobicContact CE1-CG 3.97Å; Y1743-P1757 HydrophobicContact CE2-CB 4.47Å; Y1743-P1757 HydrophobicContact CG-CB 4.42Å; P1757-I1759 HydrophobicContact CG-CD1 4.43Å; P1757-I1759 HydrophobicContact CG-CG1 4.21Å
1758	M	36.3	Very low	40	Very low	121 Å²	121	89 Å²	89	60%	0.596	52%	0.519	S	S	*	.			trans	-70	124	160.9	-57.4	172.6	-167.1	0	0	108.5	G1742 V1744 P1760	G1742-M1758 PolarHBondContact O-N 3.04Å; V1744-M1758 HydrophobicContact CG1-CE 3.95Å; M1758-P1760 VanDerWaalsContact O-CD 3.31Å; M1758-P1760 WeakPolarHBondContact O-CD 3.29Å
1759	I	32.7	Very low	39.1	Very low	110 Å²	110	84.7 Å²	84.7	56%	0.564	49%	0.494	S	S	*	.			trans	-111.2	101.9	-178.2	-59.4	178.3	0	0	0	110.4	S141 P1757	S141-I1759 WeakPolarHBondContact OG-CD1 3.44Å; P1757-I1759 HydrophobicContact CG-CD1 4.43Å; P1757-I1759 HydrophobicContact CG-CG1 4.21Å
1760	P	29.9	Very low	38.8	Very low	114 Å²	114	82.9 Å²	82.9	74%	0.74	49%	0.487	S	S	*	.			trans	-78.9	163.1	161.2	32.7	-33	0	0	0	111.8	M1758	M1758-P1760 VanDerWaalsContact O-CD 3.31Å; M1758-P1760 WeakPolarHBondContact O-CD 3.29Å
1761	T	25.3	Very low	38	Very low	148 Å²	148	81.7 Å²	81.7	91%	0.908	48%	0.484	S	S	*	.			trans	-92.5	-177.5	-168	44.1	0	0	0	0	115
1762	A	26.6	Very low	37.7	Very low	92 Å²	92	80.1 Å²	80.1	76%	0.76	47%	0.474	S	S	*	.			trans	-83.7	160.1	-161.1	0	0	0	0	0	116.5
1763	P	30	Very low	36.7	Very low	86 Å²	86	81.8 Å²	81.8	56%	0.558	49%	0.491	S	S	*	.			trans	-94.8	141.1	-164.4	34.7	-36.4	0	0	0	117.8	M1	M1-P1763 PolarHBondContact N-O 3.31Å
1764	P	25.8	Very low	35.5	Very low	106 Å²	106	88.2 Å²	88.2	69%	0.688	52%	0.517	S	S	*	.			trans	-84.8	-177.1	169.7	-20.4	36.9	0	0	0	118.8	M1	M1-P1764 CarbonylContact O-C 2.65Å; M1-P1764 VanDerWaalsContact O-C 3.29Å
1765	L	23.3	Very low	34.7	Very low	98 Å²	98	91.6 Å²	91.6	51%	0.513	53%	0.534	S	S	.	.			trans	-92.5	166.8	-157.4	-117	174.5	0	0	0	116	M1 G2	M1-L1765 HydrophobicContact CB-CB 3.84Å; M1-L1765 HydrophobicContact CB-CD1 4.32Å; M1-L1765 HydrophobicContact CB-CG 3.63Å; M1-L1765 HydrophobicContact CE-CD1 4.38Å; M1-L1765 HydrophobicContact CG-CB 4.05Å; M1-L1765 HydrophobicContact CG-CD1 3.72Å; M1-L1765 HydrophobicContact CG-CG 3.62Å; M1-L1765 HydrophobicContact SD-CB 3.86Å; M1-L1765 HydrophobicContact SD-CD1 3.82Å; M1-L1765 HydrophobicContact SD-CG 3.97Å; G2-L1765 CarbonylContact O-C 2.9Å; G2-L1765 WeakPolarHBondContact O-CA 3.15Å
1766	T	24.5	Very low	34.7	Very low	87 Å²	87	98.1 Å²	98.1	53%	0.534	57%	0.565	S	S	.	*	S	Bend	trans	-33.2	146.7	168.6	53.8	0	0	0	0	117.9	G2	G2-T1766 PolarHBondContact O-N 2.77Å
1767	T	27.7	Very low	34.4	Very low	117 Å²	117	96.5 Å²	96.5	72%	0.718	56%	0.555	S	S	*	*			trans	55.2	87.8	148.4	55.6	0	0	0	0	115.7	P1769	T1767-P1769 VanDerWaalsContact O-CD 3.27Å; T1767-P1769 WeakPolarHBondContact O-CD 3.16Å
1768	L	29.1	Very low	34.9	Very low	138 Å²	138	101.1 Å²	101.1	72%	0.723	57%	0.567	S	S	*	*				-23.5	124.9	126.5	-89.9	63	0	0	0	111.3	P1770	L1768-P1770 HydrophobicContact CD2-CB 4Å
1769	P	31.5	Very low	35.8	Very low	54 Å²	54	96 Å²	96	35%	0.351	54%	0.543	S	S	.	.				-67.8	135.9	109.6	14	6.8	0	0	0	107.6	S100 S102 T1767	S100-P1769 WeakPolarHBondContact O-CB 3.06Å; S102-P1769 WeakPolarHBondContact CA-O 3.31Å; S102-P1769 VanDerWaalsContact CB-C 3.43Å; S102-P1769 WeakPolarHBondContact CB-O 3.33Å; S102-P1769 PolarHBondContact N-O 3.23Å; T1767-P1769 VanDerWaalsContact O-CD 3.27Å; T1767-P1769 WeakPolarHBondContact O-CD 3.16Å
1770	P	35.8	Very low	36.1	Very low	51 Å²	51	95.1 Å²	95.1	33%	0.331	55%	0.547	S	S	.	.	S	Bend	trans	-88	150.2	-164.5	26.6	-34.5	0	0	0	119.1	Y101 S102 Q103 L1768	Y101-P1770 VanDerWaalsContact CB-CD 3.47Å; Y101-P1770 WeakPolarHBondContact CB-O 3.28Å; Y101-P1770 HydrophobicContact CD1-CG 4.06Å; Y101-P1770 WeakPolarHBondContact CD1-O 3.47Å; Y101-P1770 HydrophobicContact CG-CG 4.24Å; S102-P1770 CarbonylContact C-O 3.44Å; S102-P1770 VanDerWaalsContact N-N 3.16Å; S102-P1770 PolarHBondContact N-O 2.69Å; S102-P1770 CarbonylContact O-C 3.55Å; Q103-P1770 PolarHBondContact N-O 3.37Å; L1768-P1770 HydrophobicContact CD2-CB 4Å
1771	N	31	Very low	37	Very low	45 Å²	45	93.4 Å²	93.4	24%	0.241	53%	0.531	C	S	.	.			trans	79.8	77.9	165.1	-167.1	5.2	0	0	0	121.8	S102 Q103 T104 S105 G1773 D2401	S102-N1771 CarbonylContact C-O 3.54Å; S102-N1771 CarbonylContact O-C 3.59Å; S102-N1771 VanDerWaalsContact O-CA 3.27Å; S102-N1771 WeakPolarHBondContact O-CA 3.27Å; S102-N1771 PolarHBondContact O-N 2.95Å; S102-N1771 VanDerWaalsContact O-O 3.12Å; Q103-N1771 PolarHBondContact N-O 2.03Å; T104-N1771 PolarHBondContact N-O 2.74Å; T104-N1771 VanDerWaalsContact N-O 3.12Å; S105-N1771 PolarHBondContact N-O 3.4Å; S105-N1771 PolarHBondContact OG-OD1 2.83Å; N1771-G1773 VanDerWaalsContact OD1-CA 3.31Å; N1771-G1773 WeakPolarHBondContact OD1-CA 3.33Å; N1771-G1773 PolarHBondContact OD1-N 2.84Å; N1771-D2401 PolarHBondContact ND2-OD1 2.96Å
1772	C	43.7	Very low	38	Very low	52 Å²	52	91 Å²	91	35%	0.351	52%	0.52	S	S	.	.			trans	-84.4	110.9	140.2	161.2	0	0	0	0	106.3	S102 T104 E1774 C1777	S102-C1772 PolarHBondContact O-N 2.85Å; T104-C1772 VanDerWaalsContact C-CA 3.44Å; C1772-E1774 PolarHBondContact O-N 2.81Å; C1772-C1777 WeakPolarHBondContact CB-SG 3.07Å; C1772-C1777 WeakPolarHBondContact SG-CB 3.32Å; C1772-C1777 CovalentContact SG-SG 2.1Å; C1772-C1777 PolarHBondContact SG-SG 2.03Å
1773	G	35.9	Very low	39.3	Very low	36 Å²	36	86.7 Å²	86.7	37%	0.371	48%	0.484	S	S	.	.			trans	-70.3	67.1	-174.6	0	0	0	0	0	113.3	S105 N1771 K1775	S105-G1773 VanDerWaalsContact OG-CA 3.31Å; S105-G1773 WeakPolarHBondContact OG-CA 2.97Å; S105-G1773 PolarHBondContact OG-N 2.61Å; N1771-G1773 VanDerWaalsContact OD1-CA 3.31Å; N1771-G1773 WeakPolarHBondContact OD1-CA 3.33Å; N1771-G1773 PolarHBondContact OD1-N 2.84Å; G1773-K1775 PolarHBondContact O-N 2.71Å
1774	E	40.9	Very low	40.5	Very low	190 Å²	190	84.9 Å²	84.9	89%	0.888	47%	0.472	S	S	*	.	S	Bend	trans	53.4	-4.4	161.8	-56.2	-162.4	140.7	0	0	119.9	C1772	C1772-E1774 PolarHBondContact O-N 2.81Å
1775	K	46.4	Very low	41.8	Very low	186 Å²	186	80 Å²	80	81%	0.809	44%	0.44	S	S	*	.	S	Bend	trans	-131.9	105.2	174.7	-70.4	-171.8	178.6	175.9	0	113.9	G1773	G1773-K1775 PolarHBondContact O-N 2.71Å
1776	H	53.4	Low	42.9	Very low	138 Å²	138	79.5 Å²	79.5	64%	0.639	44%	0.441	S	S	*	.			trans	38	129.6	166.3	-66.5	-45.5	0	0	0	120.4
1777	C	46.1	Very low	43.7	Very low	7 Å²	7	79.7 Å²	79.7	5%	0.047	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	97.1	-145.6	-108.3	0	0	0	0	106.9	T104 G108 C1772 C1785	T104-C1777 PolarHBondContact O-SG 2.72Å; G108-C1777 WeakPolarHBondContact CA-O 3.31Å; G108-C1777 PolarHBondContact N-SG 3.09Å; C1772-C1777 WeakPolarHBondContact CB-SG 3.07Å; C1772-C1777 WeakPolarHBondContact SG-CB 3.32Å; C1772-C1777 CovalentContact SG-SG 2.1Å; C1772-C1777 PolarHBondContact SG-SG 2.03Å; C1777-C1785 WeakPolarHBondContact O-CA 3.05Å; C1777-C1785 WeakPolarHBondContact O-CB 3.49Å; C1777-C1785 PolarHBondContact O-N 3.46Å; C1777-C1785 PolarHBondContact O-SG 2.87Å
1778	Y	56.8	Low	44.7	Very low	148 Å²	148	77 Å²	77	58%	0.58	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	147.5	-170.4	-79.3	-92.2	0	0	0	115.4	S107 K109 V1784	S107-Y1778 CarbonylContact C-O 3.42Å; S107-Y1778 WeakPolarHBondContact CB-O 3.44Å; K109-Y1778 VanDerWaalsContact CE-O 3.29Å; K109-Y1778 WeakPolarHBondContact CE-O 3.33Å; Y1778-V1784 HydrophobicContact CD1-CG2 4.29Å; Y1778-V1784 HydrophobicContact CE1-CG2 3.82Å
1779	S	56.3	Low	45.5	Very low	13 Å²	13	77.1 Å²	77.1	9%	0.091	45%	0.453	C	S	.	.			trans	-86.2	166.5	-179	111	0	0	0	0	115.5	L1781 S1782 E1783	S1779-L1781 VanDerWaalsContact C-N 3.35Å; S1779-L1781 WeakPolarHBondContact OG-CA 3.28Å; S1779-L1781 PolarHBondContact OG-N 3.24Å; S1779-S1782 PolarHBondContact O-N 3.42Å; S1779-S1782 PolarHBondContact OG-N 2.78Å; S1779-E1783 WeakPolarHBondContact CB-OE2 2.99Å; S1779-E1783 PolarHBondContact N-O 2.85Å; S1779-E1783 WeakPolarHBondContact OG-CB 3.18Å; S1779-E1783 PolarHBondContact OG-N 2.04Å; S1779-E1783 PolarHBondContact OG-OE2 2.86Å
1780	S	38.9	Very low	46.5	Very low	91 Å²	91	74.8 Å²	74.8	64%	0.636	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-5.6	171.5	35.1	0	0	0	0	113.6	K109 S1782	K109-S1780 WeakPolarHBondContact CD-OG 3.31Å; S1780-S1782 VanDerWaalsContact C-N 3.3Å
1781	L	48.5	Very low	47.6	Very low	79 Å²	79	76.8 Å²	76.8	41%	0.414	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	18.4	163.5	-42.2	173.4	0	0	0	109.9	S1779 E1783 P1804	S1779-L1781 VanDerWaalsContact C-N 3.35Å; S1779-L1781 WeakPolarHBondContact OG-CA 3.28Å; S1779-L1781 PolarHBondContact OG-N 3.24Å; L1781-E1783 VanDerWaalsContact C-N 3.34Å; L1781-E1783 HydrophobicContact CB-CG 4.42Å; L1781-E1783 WeakPolarHBondContact CB-OE2 3.02Å; L1781-E1783 PolarHBondContact O-N 3Å; L1781-P1804 HydrophobicContact CB-CB 4.26Å; L1781-P1804 HydrophobicContact CD1-CB 4.34Å; L1781-P1804 HydrophobicContact CD2-CB 4.39Å
1782	S	46.8	Very low	48.7	Very low	98 Å²	98	75.9 Å²	75.9	69%	0.685	45%	0.445	S	S	*	.	S	Bend	trans	62.3	25.6	179.9	-57	0	0	0	0	116.4	S1779 S1780	S1779-S1782 PolarHBondContact O-N 3.42Å; S1779-S1782 PolarHBondContact OG-N 2.78Å; S1780-S1782 VanDerWaalsContact C-N 3.3Å
1783	E	52.2	Low	49.3	Very low	1 Å²	1	75.6 Å²	75.6	1%	0.005	44%	0.443	C	S	.	.			trans	-87.2	157.3	179.5	-55.2	139	137.1	0	0	112.4	N110 S1779 L1781 C1790 C1805	N110-E1783 WeakPolarHBondContact CB-OE2 3.27Å; N110-E1783 PolarHBondContact ND2-OE1 3.01Å; N110-E1783 PolarHBondContact ND2-OE2 2.55Å; S1779-E1783 WeakPolarHBondContact CB-OE2 2.99Å; S1779-E1783 PolarHBondContact N-O 2.85Å; S1779-E1783 WeakPolarHBondContact OG-CB 3.18Å; S1779-E1783 PolarHBondContact OG-N 2.04Å; S1779-E1783 PolarHBondContact OG-OE2 2.86Å; L1781-E1783 VanDerWaalsContact C-N 3.34Å; L1781-E1783 HydrophobicContact CB-CG 4.42Å; L1781-E1783 WeakPolarHBondContact CB-OE2 3.02Å; L1781-E1783 PolarHBondContact O-N 3Å; E1783-C1790 HydrophobicContact CB-CB 3.91Å; E1783-C1805 PolarHBondContact OE1-SG 2.04Å
1784	V	56.9	Low	49.9	Very low	48 Å²	48	84.5 Å²	84.5	29%	0.291	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.3	179.5	-177.2	0	0	0	0	109.5	Y1778 C1790 V1791	Y1778-V1784 HydrophobicContact CD1-CG2 4.29Å; Y1778-V1784 HydrophobicContact CE1-CG2 3.82Å; V1784-C1790 VanDerWaalsContact O-CA 3.32Å; V1784-C1790 WeakPolarHBondContact O-CA 3.37Å; V1784-C1790 WeakPolarHBondContact O-CB 3.31Å; V1784-V1791 PolarHBondContact O-N 3.09Å
1785	C	52.4	Low	50.1	Low	3 Å²	3	77.6 Å²	77.6	2%	0.02	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	136.1	-176.7	-43.3	0	0	0	0	112.8	K109 C1777 E1789 C1790	K109-C1785 WeakPolarHBondContact CA-SG 3.5Å; K109-C1785 PolarHBondContact N-SG 2.68Å; C1777-C1785 WeakPolarHBondContact O-CA 3.05Å; C1777-C1785 WeakPolarHBondContact O-CB 3.49Å; C1777-C1785 PolarHBondContact O-N 3.46Å; C1777-C1785 PolarHBondContact O-SG 2.87Å; C1785-E1789 WeakPolarHBondContact CA-O 3.18Å; C1785-C1790 VanDerWaalsContact CA-SG 3.59Å; C1785-C1790 HydrophobicContact CB-CB 3.72Å; C1785-C1790 WeakPolarHBondContact CB-SG 3.49Å; C1785-C1790 WeakPolarHBondContact SG-CB 3.34Å; C1785-C1790 CovalentContact SG-SG 2.01Å; C1785-C1790 PolarHBondContact SG-SG 3.22Å
1786	V	45.7	Very low	50.4	Low	87 Å²	87	72.4 Å²	72.4	53%	0.527	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	119.8	178.4	-169.5	0	0	0	0	107.3	G1788 E1789	V1786-G1788 PolarHBondContact O-N 3.39Å; V1786-G1788 VanDerWaalsContact O-N 3.15Å; V1786-E1789 PolarHBondContact N-O 2.87Å; V1786-E1789 PolarHBondContact O-N 3.42Å; V1786-E1789 VanDerWaalsContact O-O 3.06Å
1787	G	41.6	Very low	50.5	Low	92 Å²	92	68.8 Å²	68.8	95%	0.948	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	15.2	179.3	0	0	0	0	0	116.2
1788	G	49.5	Very low	50.5	Low	60 Å²	60	70.4 Å²	70.4	62%	0.619	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.9	-11.6	-178.1	0	0	0	0	0	114.7	V1786	V1786-G1788 PolarHBondContact O-N 3.39Å; V1786-G1788 VanDerWaalsContact O-N 3.15Å
1789	E	45.1	Very low	50	Low	141 Å²	141	71.3 Å²	71.3	66%	0.659	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	131.5	164.2	-169.4	165.1	-128.1	0	0	108.7	C1785 V1786	C1785-E1789 WeakPolarHBondContact CA-O 3.18Å; V1786-E1789 PolarHBondContact N-O 2.87Å; V1786-E1789 PolarHBondContact O-N 3.42Å; V1786-E1789 VanDerWaalsContact O-O 3.06Å
1790	C	52.5	Low	49.6	Very low	4 Å²	4	75.4 Å²	75.4	3%	0.027	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	121	166.3	-21.7	0	0	0	0	110.9	K109 N110 E1783 V1784 C1785	K109-C1790 PolarHBondContact O-SG 3.03Å; K109-C1790 VanDerWaalsContact O-SG 3.35Å; N110-C1790 WeakPolarHBondContact CA-SG 3.33Å; N110-C1790 HydrophobicContact CB-CB 3.84Å; N110-C1790 WeakPolarHBondContact CB-SG 3.3Å; N110-C1790 PolarHBondContact N-SG 3.33Å; N110-C1790 VanDerWaalsContact N-SG 3.38Å; N110-C1790 PolarHBondContact ND2-O 2.92Å; N110-C1790 VanDerWaalsContact ND2-O 3.09Å; N110-C1790 VanDerWaalsContact OD1-CA 3.3Å; N110-C1790 WeakPolarHBondContact OD1-CA 3.26Å; N110-C1790 WeakPolarHBondContact OD1-CB 3.42Å; N110-C1790 PolarHBondContact OD1-N 2.93Å; N110-C1790 VanDerWaalsContact OD1-N 3.09Å; N110-C1790 PolarHBondContact OD1-O 3.01Å; N110-C1790 PolarHBondContact OD1-SG 2.04Å; E1783-C1790 HydrophobicContact CB-CB 3.91Å; V1784-C1790 VanDerWaalsContact O-CA 3.32Å; V1784-C1790 WeakPolarHBondContact O-CA 3.37Å; V1784-C1790 WeakPolarHBondContact O-CB 3.31Å; C1785-C1790 VanDerWaalsContact CA-SG 3.59Å; C1785-C1790 HydrophobicContact CB-CB 3.72Å; C1785-C1790 WeakPolarHBondContact CB-SG 3.49Å; C1785-C1790 WeakPolarHBondContact SG-CB 3.34Å; C1785-C1790 CovalentContact SG-SG 2.01Å; C1785-C1790 PolarHBondContact SG-SG 3.22Å
1791	V	58.4	Low	50	Low	94 Å²	94	73.7 Å²	73.7	57%	0.57	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	143.2	168.1	-77.1	0	0	0	0	109.5	V1784	V1784-V1791 PolarHBondContact O-N 3.09Å
1792	C	54.9	Low	49.8	Very low	25 Å²	25	72.3 Å²	72.3	17%	0.169	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-59	132.7	160.4	-60.2	0	0	0	0	107.8	M1796 S1797 C1805	C1792-M1796 HydrophobicContact CB-CB 3.84Å; C1792-M1796 WeakPolarHBondContact CB-O 3.49Å; C1792-S1797 VanDerWaalsContact SG-C 3.52Å; C1792-S1797 VanDerWaalsContact SG-CA 3.6Å; C1792-C1805 WeakPolarHBondContact CA-SG 3.4Å; C1792-C1805 HydrophobicContact CB-CB 3.71Å; C1792-C1805 WeakPolarHBondContact CB-SG 3.37Å; C1792-C1805 WeakPolarHBondContact SG-CB 3.45Å; C1792-C1805 CovalentContact SG-SG 2.03Å; C1792-C1805 PolarHBondContact SG-SG 3.13Å
1793	P	57.4	Low	49.8	Very low	46 Å²	46	71.8 Å²	71.8	30%	0.299	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-62.2	157.1	178.3	25.8	-33.4	0	0	0	111.1	G1795 M1796	P1793-G1795 PolarHBondContact O-N 2.89Å; P1793-M1796 HydrophobicContact CG-SD 3.89Å; P1793-M1796 PolarHBondContact O-N 3.08Å
1794	K	47.5	Very low	49.5	Very low	224 Å²	224	75 Å²	75	97%	0.974	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.3	124.4	-178	-91.2	-166.8	171.7	-170.8	0	111.3
1795	G	44.8	Very low	49.2	Very low	44 Å²	44	73.5 Å²	73.5	45%	0.454	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	100	0.9	-175.2	0	0	0	0	0	114.9	P1793 Q1807 V1808	P1793-G1795 PolarHBondContact O-N 2.89Å; G1795-Q1807 WeakPolarHBondContact O-CA 3.44Å; G1795-V1808 PolarHBondContact O-N 2.95Å
1796	M	53.6	Low	49.2	Very low	77 Å²	77	77 Å²	77	38%	0.379	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	155.2	177.6	-67.1	176.1	170.4	0	0	113.1	C1792 P1793 C1805 I1806 Q1807	C1792-M1796 HydrophobicContact CB-CB 3.84Å; C1792-M1796 WeakPolarHBondContact CB-O 3.49Å; P1793-M1796 HydrophobicContact CG-SD 3.89Å; P1793-M1796 PolarHBondContact O-N 3.08Å; M1796-C1805 HydrophobicContact CB-CB 4.04Å; M1796-C1805 HydrophobicContact SD-CB 4.33Å; M1796-I1806 CarbonylContact C-O 2.91Å; M1796-I1806 WeakPolarHBondContact CA-O 3.45Å; M1796-I1806 VanDerWaalsContact CB-O 3.23Å; M1796-I1806 WeakPolarHBondContact CB-O 3.45Å; M1796-Q1807 HydrophobicContact CE-CG 3.81Å; M1796-Q1807 HydrophobicContact CG-CB 4.43Å; M1796-Q1807 HydrophobicContact CG-CG 3.69Å
1797	S	53.9	Low	49.6	Very low	63 Å²	63	78.5 Å²	78.5	44%	0.441	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	170.9	172.6	-173.1	0	0	0	0	109.3	C1792 C1805 I1806	C1792-S1797 VanDerWaalsContact SG-C 3.52Å; C1792-S1797 VanDerWaalsContact SG-CA 3.6Å; S1797-C1805 CarbonylContact O-C 3.51Å; S1797-C1805 VanDerWaalsContact O-CA 3.29Å; S1797-C1805 WeakPolarHBondContact O-CA 3.19Å; S1797-I1806 PolarHBondContact N-O 3.47Å; S1797-I1806 VanDerWaalsContact O-CG1 3.3Å; S1797-I1806 WeakPolarHBondContact O-CG1 3.41Å; S1797-I1806 PolarHBondContact O-N 2.04Å
1798	R	46.7	Very low	50.2	Low	40 Å²	40	76 Å²	76	15%	0.151	42%	0.421	C	S	.	.			trans	-124.3	137.1	174.8	76.2	174	-162.3	-91.3	-7.9	112.4	L1800 Q1803	R1798-L1800 VanDerWaalsContact CD-O 3.26Å; R1798-L1800 WeakPolarHBondContact CD-O 3.07Å; R1798-L1800 PolarHBondContact NE-O 3.12Å; R1798-L1800 PolarHBondContact O-N 3.29Å; R1798-Q1803 WeakPolarHBondContact CD-O 3.41Å
1799	R	47	Very low	50.6	Low	167 Å²	167	76.3 Å²	76.3	63%	0.63	41%	0.406	S	S	*	.	S	Bend	trans	-66.2	-36	-175.9	-172	178.7	-170	173	4.7	113.1
1800	L	46.9	Very low	51.3	Low	100 Å²	100	75 Å²	75	52%	0.524	40%	0.398	S	S	.	.	S	Bend	trans	-146.1	164.9	-180	-93.4	171.8	0	0	0	112.7	R1798 G1802 Q1803	R1798-L1800 VanDerWaalsContact CD-O 3.26Å; R1798-L1800 WeakPolarHBondContact CD-O 3.07Å; R1798-L1800 PolarHBondContact NE-O 3.12Å; R1798-L1800 PolarHBondContact O-N 3.29Å; L1800-G1802 PolarHBondContact O-N 3.02Å; L1800-G1802 VanDerWaalsContact O-N 3.14Å; L1800-Q1803 PolarHBondContact O-N 2.91Å
1801	L	47.1	Very low	52.1	Low	54 Å²	54	76 Å²	76	28%	0.283	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	108.6	164.3	-84.8	59.9	0	0	0	108.7	F112 L113 R114	F112-L1801 HydrophobicContact CB-CD2 4.11Å; F112-L1801 HydrophobicContact CB-CG 4.15Å; F112-L1801 HydrophobicContact CD1-CB 3.91Å; F112-L1801 HydrophobicContact CD1-CD2 3.63Å; F112-L1801 HydrophobicContact CD1-CG 3.89Å; F112-L1801 HydrophobicContact CD2-CB 3.79Å; F112-L1801 HydrophobicContact CD2-CD2 4.48Å; F112-L1801 HydrophobicContact CD2-CG 3.86Å; F112-L1801 HydrophobicContact CE1-CB 3.76Å; F112-L1801 HydrophobicContact CE1-CD2 4.19Å; F112-L1801 HydrophobicContact CE1-CG 4.27Å; F112-L1801 HydrophobicContact CE2-CB 3.71Å; F112-L1801 HydrophobicContact CE2-CG 4.31Å; F112-L1801 HydrophobicContact CG-CB 3.94Å; F112-L1801 HydrophobicContact CG-CD2 3.81Å; F112-L1801 HydrophobicContact CG-CG 3.67Å; F112-L1801 HydrophobicContact CZ-CB 3.69Å; F112-L1801 HydrophobicContact CZ-CG 4.49Å; L113-L1801 HydrophobicContact CB-CD1 4.19Å; L113-L1801 HydrophobicContact CD1-CD1 4.05Å; R114-L1801 HydrophobicContact CG-CD2 4.41Å
1802	G	44.7	Very low	52.6	Low	50 Å²	50	77 Å²	77	52%	0.515	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	116.6	-9	174.1	0	0	0	0	0	115.3	L1800	L1800-G1802 PolarHBondContact O-N 3.02Å; L1800-G1802 VanDerWaalsContact O-N 3.14Å
1803	Q	46.1	Very low	53.6	Low	88 Å²	88	76 Å²	76	41%	0.411	39%	0.394	S	S	.	.	S	Bend	trans	-96.6	151.6	175.4	-73.1	-179.3	-26.2	0	0	111.5	R1798 L1800	R1798-Q1803 WeakPolarHBondContact CD-O 3.41Å; L1800-Q1803 PolarHBondContact O-N 2.91Å
1804	P	45.9	Very low	54.6	Low	67 Å²	67	74.9 Å²	74.9	44%	0.435	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-60.8	156.3	173	27.4	-35.7	0	0	0	111.7	L1781 I1806	L1781-P1804 HydrophobicContact CB-CB 4.26Å; L1781-P1804 HydrophobicContact CD1-CB 4.34Å; L1781-P1804 HydrophobicContact CD2-CB 4.39Å; P1804-I1806 PolarHBondContact O-N 3.24Å
1805	C	51.5	Low	56.4	Low	17 Å²	17	64.2 Å²	64.2	12%	0.115	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-62.8	117.5	168.7	-63.7	0	0	0	0	110.5	E1783 C1792 M1796 S1797	E1783-C1805 PolarHBondContact OE1-SG 2.04Å; C1792-C1805 WeakPolarHBondContact CA-SG 3.4Å; C1792-C1805 HydrophobicContact CB-CB 3.71Å; C1792-C1805 WeakPolarHBondContact CB-SG 3.37Å; C1792-C1805 WeakPolarHBondContact SG-CB 3.45Å; C1792-C1805 CovalentContact SG-SG 2.03Å; C1792-C1805 PolarHBondContact SG-SG 3.13Å; M1796-C1805 HydrophobicContact CB-CB 4.04Å; M1796-C1805 HydrophobicContact SD-CB 4.33Å; S1797-C1805 CarbonylContact O-C 3.51Å; S1797-C1805 VanDerWaalsContact O-CA 3.29Å; S1797-C1805 WeakPolarHBondContact O-CA 3.19Å
1806	I	52.1	Low	58.2	Low	77 Å²	77	62.1 Å²	62.1	40%	0.395	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	155.5	165.9	56.2	171.8	0	0	0	108.8	M1796 S1797 P1804	M1796-I1806 CarbonylContact C-O 2.91Å; M1796-I1806 WeakPolarHBondContact CA-O 3.45Å; M1796-I1806 VanDerWaalsContact CB-O 3.23Å; M1796-I1806 WeakPolarHBondContact CB-O 3.45Å; S1797-I1806 PolarHBondContact N-O 3.47Å; S1797-I1806 VanDerWaalsContact O-CG1 3.3Å; S1797-I1806 WeakPolarHBondContact O-CG1 3.41Å; S1797-I1806 PolarHBondContact O-N 2.04Å; P1804-I1806 PolarHBondContact O-N 3.24Å
1807	Q	54.4	Low	59.8	Low	119 Å²	119	58.4 Å²	58.4	56%	0.556	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	161.3	164.3	-82.5	-171.9	-39.2	0	0	110.6	G1795 M1796 P1896	G1795-Q1807 WeakPolarHBondContact O-CA 3.44Å; M1796-Q1807 HydrophobicContact CE-CG 3.81Å; M1796-Q1807 HydrophobicContact CG-CB 4.43Å; M1796-Q1807 HydrophobicContact CG-CG 3.69Å; Q1807-P1896 HydrophobicContact CB-CG 3.63Å; Q1807-P1896 WeakPolarHBondContact O-CD 3.28Å; Q1807-P1896 WeakPolarHBondContact O-CG 3.43Å
1808	V	55.1	Low	60.9	Low	39 Å²	39	56.6 Å²	56.6	24%	0.236	29%	0.286	C	S	.	.			trans	-130.2	130.4	172.2	-170.6	0	0	0	0	107.5	G1795 N1893 T1894	G1795-V1808 PolarHBondContact O-N 2.95Å; V1808-N1893 HydrophobicContact CG1-CB 4.02Å; V1808-T1894 WeakPolarHBondContact CA-O 3.42Å; V1808-T1894 VanDerWaalsContact CG1-O 3.26Å; V1808-T1894 WeakPolarHBondContact CG1-O 3.43Å
1809	E	58.1	Low	62.1	Low	66 Å²	66	58.9 Å²	58.9	31%	0.308	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	119.3	168.9	-73.5	-166.7	-114.3	0	0	109.5	N1893 T1894 P1896 G1897 K1901	E1809-N1893 WeakPolarHBondContact O-CA 3.46Å; E1809-T1894 PolarHBondContact N-O 3.14Å; E1809-T1894 PolarHBondContact O-N 3.19Å; E1809-P1896 HydrophobicContact CG-CB 4.01Å; E1809-P1896 HydrophobicContact CG-CG 4.15Å; E1809-P1896 VanDerWaalsContact OE1-CA 3.24Å; E1809-P1896 WeakPolarHBondContact OE1-CA 3.45Å; E1809-G1897 PolarHBondContact OE1-N 2.94Å; E1809-G1897 VanDerWaalsContact OE1-N 3.14Å; E1809-K1901 WeakPolarHBondContact OE2-CE 2.99Å; E1809-K1901 IonicContact OE2-NZ 3.54Å; E1809-K1901 PolarHBondContact OE2-NZ 3.29Å
1810	K	59.3	Low	63.5	Low	113 Å²	113	55.9 Å²	55.9	49%	0.491	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	143.7	165.2	-62.6	-134.1	170.7	-166.1	0	109.5	E1868 T1891 V1892 N1893	K1810-E1868 IonicContact NZ-OE1 2.66Å; K1810-E1868 PolarHBondContact NZ-OE1 3.39Å; K1810-E1868 IonicContact NZ-OE2 3.58Å; K1810-T1891 HydrophobicContact CB-CG2 4.22Å; K1810-T1891 HydrophobicContact CD-CG2 3.66Å; K1810-T1891 HydrophobicContact CG-CG2 4.5Å; K1810-V1892 CarbonylContact C-O 2.83Å; K1810-V1892 WeakPolarHBondContact CA-O 3.43Å; K1810-N1893 WeakPolarHBondContact CD-OD1 3.1Å; K1810-N1893 WeakPolarHBondContact CE-OD1 2.98Å; K1810-N1893 WeakPolarHBondContact CG-OD1 3.47Å
1811	F	67.9	Low	64.6	Low	25 Å²	25	53.7 Å²	53.7	11%	0.11	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	137.8	163.9	60.9	-79.4	0	0	0	111.4	V1813 V1892 T1894 K1901 F1904	F1811-V1813 HydrophobicContact CD2-CG2 3.99Å; F1811-V1813 HydrophobicContact CE2-CG2 3.92Å; F1811-V1892 HydrophobicContact CD1-CB 4.35Å; F1811-V1892 HydrophobicContact CD2-CB 4.39Å; F1811-V1892 HydrophobicContact CE1-CB 3.98Å; F1811-V1892 HydrophobicContact CE1-CG1 3.91Å; F1811-V1892 HydrophobicContact CE2-CB 4.03Å; F1811-V1892 HydrophobicContact CE2-CG1 4.37Å; F1811-V1892 HydrophobicContact CE2-CG2 4.47Å; F1811-V1892 HydrophobicContact CZ-CB 3.82Å; F1811-V1892 HydrophobicContact CZ-CG1 3.72Å; F1811-V1892 PolarHBondContact N-O 3.26Å; F1811-V1892 PolarHBondContact O-N 2.84Å; F1811-T1894 HydrophobicContact CE1-CG2 3.94Å; F1811-K1901 HydrophobicContact CB-CD 3.83Å; F1811-K1901 HydrophobicContact CD1-CD 3.85Å; F1811-K1901 HydrophobicContact CD1-CG 3.78Å; F1811-K1901 HydrophobicContact CD2-CB 4.19Å; F1811-K1901 HydrophobicContact CD2-CD 4.39Å; F1811-K1901 HydrophobicContact CD2-CG 4.2Å; F1811-K1901 HydrophobicContact CE1-CD 4.48Å; F1811-K1901 HydrophobicContact CE1-CG 3.91Å; F1811-K1901 HydrophobicContact CE2-CB 4.2Å; F1811-K1901 HydrophobicContact CE2-CG 4.31Å; F1811-K1901 HydrophobicContact CG-CB 4.39Å; F1811-K1901 HydrophobicContact CG-CD 3.79Å; F1811-K1901 HydrophobicContact CG-CG 3.92Å; F1811-K1901 HydrophobicContact CZ-CB 4.41Å; F1811-K1901 HydrophobicContact CZ-CG 4.17Å; F1811-F1904 AromaticContact CE2-CD1 3.92Å; F1811-F1904 HydrophobicContact CE2-CD1 3.92Å; F1811-F1904 HydrophobicContact CE2-CE1 4.39Å; F1811-F1904 AromaticContact CZ-CD1 3.84Å; F1811-F1904 HydrophobicContact CZ-CD1 3.84Å; F1811-F1904 HydrophobicContact CZ-CE1 4.29Å; F1811-F1904 HydrophobicContact CZ-CG 4.43Å
1812	E	69.4	Low	65.2	Low	116 Å²	116	56.5 Å²	56.5	54%	0.542	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	133.1	176.7	-71.3	175.9	-108.4	0	0	110.8	N1889	E1812-N1889 PolarHBondContact OE2-ND2 2.89Å
1813	V	76.4	Confident	65.8	Low	3 Å²	3	59.9 Å²	59.9	2%	0.018	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	109.6	164.9	-176.9	0	0	0	0	107	F1811 I1815 T1890 V1892 F1909	F1811-V1813 HydrophobicContact CD2-CG2 3.99Å; F1811-V1813 HydrophobicContact CE2-CG2 3.92Å; V1813-I1815 HydrophobicContact CG1-CD1 4.5Å; V1813-I1815 HydrophobicContact CG1-CG1 4.12Å; V1813-T1890 PolarHBondContact N-O 3.03Å; V1813-T1890 WeakPolarHBondContact O-CB 3.35Å; V1813-T1890 PolarHBondContact O-N 2.82Å; V1813-V1892 HydrophobicContact CG2-CG2 4.11Å; V1813-F1909 HydrophobicContact CG1-CE2 4.29Å
1814	P	77.8	Confident	66.4	Low	23 Å²	23	59.4 Å²	59.4	15%	0.149	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	137.8	168.8	28.2	-30.8	0	0	0	109	L1887 F1888 S1932	P1814-L1887 HydrophobicContact CB-CD1 3.63Å; P1814-F1888 WeakPolarHBondContact CA-O 3.06Å; P1814-S1932 WeakPolarHBondContact CD-O 3.31Å; P1814-S1932 VanDerWaalsContact CG-O 3.28Å; P1814-S1932 WeakPolarHBondContact CG-O 3.32Å; P1814-S1932 VanDerWaalsContact O-CB 3.27Å; P1814-S1932 WeakPolarHBondContact O-CB 3.26Å
1815	I	84.6	Confident	67.8	Low	0 Å²	0	57 Å²	57	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.4	168.9	-66.6	-163.4	0	0	0	109.2	V1813 V1817 Y1846 F1850 F1888 F1909 V1926	V1813-I1815 HydrophobicContact CG1-CD1 4.5Å; V1813-I1815 HydrophobicContact CG1-CG1 4.12Å; I1815-V1817 HydrophobicContact CG2-CG2 4.37Å; I1815-Y1846 HydrophobicContact CB-CE2 4.31Å; I1815-Y1846 WeakPolarHBondContact CB-OH 3.29Å; I1815-Y1846 HydrophobicContact CG2-CE2 4.07Å; I1815-F1850 HydrophobicContact CD1-CD2 3.88Å; I1815-F1850 HydrophobicContact CD1-CE2 3.67Å; I1815-F1888 PolarHBondContact N-O 3.29Å; I1815-F1888 PolarHBondContact O-N 2.79Å; I1815-F1909 HydrophobicContact CD1-CZ 4.44Å; I1815-F1909 HydrophobicContact CG1-CZ 4.19Å; I1815-V1926 HydrophobicContact CG2-CG1 3.89Å; I1815-V1926 HydrophobicContact CG2-CG2 3.85Å
1816	I	84.1	Confident	68.6	Low	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.9	174.2	-58.5	175.8	0	0	0	108.2	P1875 Y1879 V1882 L1886 L1887 V1926 D1927 V1930	I1816-P1875 HydrophobicContact CD1-CB 4.06Å; I1816-P1875 HydrophobicContact CG1-CB 4.28Å; I1816-P1875 HydrophobicContact CG2-CB 4.18Å; I1816-P1875 HydrophobicContact CG2-CG 4.48Å; I1816-Y1879 HydrophobicContact CD1-CD2 3.76Å; I1816-Y1879 HydrophobicContact CD1-CE2 3.91Å; I1816-Y1879 HydrophobicContact CD1-CG 4.43Å; I1816-V1882 HydrophobicContact CD1-CG1 4.48Å; I1816-V1882 HydrophobicContact CD1-CG2 4.03Å; I1816-V1882 HydrophobicContact CG2-CG1 4.31Å; I1816-L1886 WeakPolarHBondContact CA-O 3.19Å; I1816-L1887 HydrophobicContact CG1-CD1 3.95Å; I1816-V1926 WeakPolarHBondContact O-CA 3.5Å; I1816-D1927 HydrophobicContact CB-CB 4.17Å; I1816-D1927 HydrophobicContact CG2-CB 4.05Å; I1816-D1927 PolarHBondContact O-N 3.34Å; I1816-V1930 HydrophobicContact CD1-CB 4.27Å; I1816-V1930 HydrophobicContact CD1-CG1 4.15Å; I1816-V1930 HydrophobicContact CD1-CG2 4.05Å
1817	V	86.2	Confident	69.3	Low	0 Å²	0	62 Å²	62	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	108.3	168.9	-174.9	0	0	0	0	107.1	I1815 L1825 Y1846 G1885 L1886 F1888 L1924 H1925	I1815-V1817 HydrophobicContact CG2-CG2 4.37Å; V1817-L1825 HydrophobicContact CB-CD1 4.14Å; V1817-L1825 HydrophobicContact CG1-CD1 3.53Å; V1817-Y1846 HydrophobicContact CG2-CD2 4.1Å; V1817-Y1846 HydrophobicContact CG2-CE2 4.2Å; V1817-G1885 CarbonylContact O-C 3.55Å; V1817-G1885 WeakPolarHBondContact O-CA 3.43Å; V1817-L1886 PolarHBondContact N-O 3.47Å; V1817-L1886 PolarHBondContact O-N 2.84Å; V1817-F1888 HydrophobicContact CB-CE2 3.97Å; V1817-F1888 HydrophobicContact CG2-CD2 3.77Å; V1817-F1888 HydrophobicContact CG2-CE2 3.48Å; V1817-F1888 VanDerWaalsContact CG2-CE2 3.48Å; V1817-F1888 HydrophobicContact CG2-CZ 4.47Å; V1817-L1924 HydrophobicContact CG1-CB 4.12Å; V1817-L1924 HydrophobicContact CG1-CD2 4.17Å; V1817-H1925 WeakPolarHBondContact CA-O 3.42Å; V1817-H1925 WeakPolarHBondContact CG1-O 3.49Å
1818	D	77.6	Confident	70	Confident	24 Å²	24	58.7 Å²	58.7	13%	0.128	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-34.2	-178.5	69.8	-38.5	0	0	0	112	P1824 L1825 H1925 D1927	D1818-P1824 CarbonylContact O-C 3.36Å; D1818-P1824 WeakPolarHBondContact O-CA 3.03Å; D1818-L1825 PolarHBondContact O-N 2.78Å; D1818-H1925 PolarHBondContact N-O 3.37Å; D1818-H1925 IonicContact OD1-CD2 3.81Å; D1818-H1925 PolarHBondContact OD1-CD2 3.46Å; D1818-H1925 VanDerWaalsContact OD1-CD2 3.23Å; D1818-H1925 IonicContact OD1-CG 3.26Å; D1818-H1925 VanDerWaalsContact OD1-O 3.12Å; D1818-H1925 IonicContact OD2-CD2 2.7Å; D1818-D1927 HydrophobicContact CB-CB 4.26Å
1819	R	72	Confident	70.3	Confident	89 Å²	89	60.9 Å²	60.9	34%	0.336	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	146	-174	-81.3	170.4	-76.5	150.6	6.4	113.5	M1823 P1824 H1925	R1819-M1823 CarbonylContact C-O 3.24Å; R1819-M1823 WeakPolarHBondContact CA-O 3.22Å; R1819-M1823 WeakPolarHBondContact CB-O 3.49Å; R1819-P1824 HydrophobicContact CG-CB 4.4Å; R1819-H1925 HydrophobicContact CB-CB 4.03Å; R1819-H1925 PolarHBondContact NH2-CD2 3.14Å; R1819-H1925 PolarHBondContact NH2-NE2 3.32Å; R1819-H1925 PolarHBondContact O-N 2.82Å
1820	W	75.9	Confident	70.6	Confident	104 Å²	104	58.9 Å²	58.9	39%	0.394	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	109.8	160.3	-167	2.8	0	0	0	108.5	S1822 M1823 L1825 M1842 L1924	W1820-S1822 PolarHBondContact O-N 2.98Å; W1820-S1822 VanDerWaalsContact O-N 3.12Å; W1820-M1823 PolarHBondContact N-O 2.77Å; W1820-M1823 PolarHBondContact O-N 2.96Å; W1820-L1825 HydrophobicContact CB-CD2 4.13Å; W1820-L1825 HydrophobicContact CB-CG 4.49Å; W1820-M1842 HydrophobicContact CE3-CE 4.4Å; W1820-M1842 HydrophobicContact CZ3-CE 4.49Å; W1820-L1924 HydrophobicContact CB-CD2 4.4Å; W1820-L1924 HydrophobicContact CG-CD2 4.05Å
1821	A	70.7	Confident	71.1	Confident	54 Å²	54	55.1 Å²	55.1	45%	0.446	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	-109.6	-164.9	0	0	0	0	0	111.5	K1923	A1821-K1923 WeakPolarHBondContact CA-O 3.04Å; A1821-K1923 HydrophobicContact CB-CB 4.34Å; A1821-K1923 HydrophobicContact CB-CD 4.5Å; A1821-K1923 PolarHBondContact N-O 3.24Å
1822	S	60.2	Low	70.9	Confident	113 Å²	113	58.1 Å²	58.1	79%	0.79	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-11.5	179.3	-42.3	0	0	0	0	113.5	W1820	W1820-S1822 PolarHBondContact O-N 2.98Å; W1820-S1822 VanDerWaalsContact O-N 3.12Å
1823	M	56.8	Low	70.4	Confident	120 Å²	120	58.1 Å²	58.1	59%	0.591	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	125	-167	179.9	176.4	172.8	0	0	111.3	R1819 W1820	R1819-M1823 CarbonylContact C-O 3.24Å; R1819-M1823 WeakPolarHBondContact CA-O 3.22Å; R1819-M1823 WeakPolarHBondContact CB-O 3.49Å; W1820-M1823 PolarHBondContact N-O 2.77Å; W1820-M1823 PolarHBondContact O-N 2.96Å
1824	P	59.2	Low	69.3	Low	79 Å²	79	64.3 Å²	64.3	51%	0.513	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	139	177	28.6	-34.2	0	0	0	111.2	D1818 R1819	D1818-P1824 CarbonylContact O-C 3.36Å; D1818-P1824 WeakPolarHBondContact O-CA 3.03Å; R1819-P1824 HydrophobicContact CG-CB 4.4Å
1825	L	74.2	Confident	67.9	Low	16 Å²	16	70.4 Å²	70.4	8%	0.084	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-89.6	139.4	171.9	-62.9	175.7	0	0	0	109.4	V1817 D1818 W1820 M1842 G1885 L1886	V1817-L1825 HydrophobicContact CB-CD1 4.14Å; V1817-L1825 HydrophobicContact CG1-CD1 3.53Å; D1818-L1825 PolarHBondContact O-N 2.78Å; W1820-L1825 HydrophobicContact CB-CD2 4.13Å; W1820-L1825 HydrophobicContact CB-CG 4.49Å; L1825-M1842 HydrophobicContact CD2-CE 4.43Å; L1825-G1885 VanDerWaalsContact O-CA 3.27Å; L1825-G1885 WeakPolarHBondContact O-CA 3.05Å; L1825-G1885 PolarHBondContact O-N 2.92Å; L1825-L1886 HydrophobicContact CB-CG 4.2Å; L1825-L1886 HydrophobicContact CD1-CD1 4.08Å; L1825-L1886 HydrophobicContact CD1-CG 4.31Å
1826	Q	67.6	Low	66.5	Low	149 Å²	149	71.7 Å²	71.7	70%	0.696	38%	0.376	S	S	*	.			trans	-119.8	143.6	170.4	-71.6	-175.6	-18.4	0	0	109.4
1827	W	68.9	Low	64.8	Low	51 Å²	51	76.3 Å²	76.3	19%	0.193	41%	0.406	C	S	.	.			trans	-71.4	152.4	175.3	-178.2	82.2	0	0	0	111.4	T1829 D1832 K1873 D1874 G1885 L1886	W1827-T1829 HydrophobicContact CH2-CG2 3.69Å; W1827-T1829 HydrophobicContact CZ3-CG2 4.2Å; W1827-D1832 WeakPolarHBondContact CH2-OD2 3.26Å; W1827-D1832 WeakPolarHBondContact CZ2-OD1 3.47Å; W1827-D1832 WeakPolarHBondContact CZ2-OD2 3.27Å; W1827-K1873 VanDerWaalsContact CD1-O 3.28Å; W1827-D1874 HydrophobicContact CB-CB 4.06Å; W1827-D1874 VanDerWaalsContact CD1-N 3.27Å; W1827-D1874 HydrophobicContact CD2-CB 3.48Å; W1827-D1874 VanDerWaalsContact CD2-CB 3.48Å; W1827-D1874 HydrophobicContact CE3-CB 3.89Å; W1827-D1874 VanDerWaalsContact CE3-OD2 3.24Å; W1827-D1874 VanDerWaalsContact CG-CA 3.44Å; W1827-D1874 HydrophobicContact CG-CB 3.54Å; W1827-G1885 PolarHBondContact N-O 2.84Å; W1827-L1886 HydrophobicContact CB-CD2 4.26Å
1828	S	68.1	Low	63.5	Low	48 Å²	48	82.7 Å²	82.7	34%	0.336	43%	0.43	S	S	.	.			trans	-152	150.3	-180	-175.8	0	0	0	0	109.4	V1830 Y1831	S1828-V1830 PolarHBondContact O-N 3.45Å; S1828-Y1831 WeakPolarHBondContact O-CD2 3.34Å; S1828-Y1831 PolarHBondContact O-N 2.03Å
1829	T	61.9	Low	63.2	Low	86 Å²	86	82.2 Å²	82.2	53%	0.528	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-58.3	-17.1	174.7	48.2	0	0	0	0	113.5	W1827 Y1831 D1832	W1827-T1829 HydrophobicContact CH2-CG2 3.69Å; W1827-T1829 HydrophobicContact CZ3-CG2 4.2Å; T1829-Y1831 PolarHBondContact O-N 3.33Å; T1829-D1832 WeakPolarHBondContact O-CB 3.08Å; T1829-D1832 PolarHBondContact O-N 2.98Å
1830	V	63.5	Low	62.8	Low	24 Å²	24	81.8 Å²	81.8	15%	0.145	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-49	-36.2	166.4	172.7	0	0	0	0	112.3	S1828 H1833 R1838	S1828-V1830 PolarHBondContact O-N 3.45Å; V1830-H1833 PolarHBondContact O-N 3.44Å; V1830-R1838 HydrophobicContact CG1-CB 3.96Å; V1830-R1838 VanDerWaalsContact CG1-CZ 3.48Å
1831	Y	69.8	Low	62.4	Low	33 Å²	33	82.5 Å²	82.5	13%	0.129	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-83.5	-7.7	-178.9	-60.6	-70.1	0	0	0	114	S1828 T1829 H1833 F1839 M1842 I1872 L1886	S1828-Y1831 WeakPolarHBondContact O-CD2 3.34Å; S1828-Y1831 PolarHBondContact O-N 2.03Å; T1829-Y1831 PolarHBondContact O-N 3.33Å; Y1831-H1833 PolarHBondContact O-N 2.87Å; Y1831-F1839 VanDerWaalsContact O-CD2 3.31Å; Y1831-F1839 WeakPolarHBondContact O-CD2 3.21Å; Y1831-M1842 HydrophobicContact CE1-CB 4.07Å; Y1831-M1842 HydrophobicContact CE1-CG 4.08Å; Y1831-I1872 HydrophobicContact CD1-CB 4.5Å; Y1831-I1872 HydrophobicContact CD1-CD1 4.34Å; Y1831-I1872 HydrophobicContact CD1-CG2 4.01Å; Y1831-I1872 HydrophobicContact CG-CG2 3.99Å; Y1831-L1886 HydrophobicContact CD2-CD2 3.65Å; Y1831-L1886 HydrophobicContact CE1-CD1 4.07Å; Y1831-L1886 HydrophobicContact CE2-CD1 4.05Å; Y1831-L1886 HydrophobicContact CE2-CD2 3.44Å; Y1831-L1886 VanDerWaalsContact CE2-CD2 3.44Å; Y1831-L1886 HydrophobicContact CE2-CG 4.41Å; Y1831-L1886 HydrophobicContact CG-CD2 4.35Å
1832	D	64.6	Low	62.7	Low	89 Å²	89	80.6 Å²	80.6	48%	0.476	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-78.3	-1.5	168.9	-64.2	-43.2	0	0	0	112.2	W1827 T1829	W1827-D1832 WeakPolarHBondContact CH2-OD2 3.26Å; W1827-D1832 WeakPolarHBondContact CZ2-OD1 3.47Å; W1827-D1832 WeakPolarHBondContact CZ2-OD2 3.27Å; T1829-D1832 WeakPolarHBondContact O-CB 3.08Å; T1829-D1832 PolarHBondContact O-N 2.98Å
1833	H	57.6	Low	63.5	Low	116 Å²	116	77 Å²	77	54%	0.537	39%	0.391	S	S	.	.			trans	-117.6	95.8	-175.1	-64.9	-24.6	0	0	0	111.5	V1830 Y1831 N1835 D1836 F1839	V1830-H1833 PolarHBondContact O-N 3.44Å; Y1831-H1833 PolarHBondContact O-N 2.87Å; H1833-N1835 PolarHBondContact O-N 3.2Å; H1833-D1836 HydrophobicContact CB-CB 4.16Å; H1833-D1836 WeakPolarHBondContact O-CB 3.29Å; H1833-D1836 PolarHBondContact O-N 2.94Å; H1833-F1839 WeakPolarHBondContact O-CB 3.34Å
1834	E	53.7	Low	64.2	Low	132 Å²	132	75.7 Å²	75.7	62%	0.617	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-24.8	177.8	-64.6	176.6	-179.9	0	0	114.3	F1839	E1834-F1839 HydrophobicContact CB-CD1 4.5Å; E1834-F1839 HydrophobicContact CB-CE1 4.2Å; E1834-F1839 HydrophobicContact CG-CE1 4.23Å; E1834-F1839 HydrophobicContact CG-CZ 4.13Å
1835	N	48.7	Very low	65	Low	152 Å²	152	74 Å²	74	81%	0.813	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-1	-179.6	-69.1	-82.2	0	0	0	114	H1833	H1833-N1835 PolarHBondContact O-N 3.2Å
1836	D	55.2	Low	65.6	Low	27 Å²	27	73.2 Å²	73.2	14%	0.144	37%	0.37	C	S	.	.	S	Bend	trans	-77.6	132.7	175.9	-167.9	-70.2	0	0	0	110.5	H1833 R1838 F1839 I1840	H1833-D1836 HydrophobicContact CB-CB 4.16Å; H1833-D1836 WeakPolarHBondContact O-CB 3.29Å; H1833-D1836 PolarHBondContact O-N 2.94Å; D1836-R1838 PolarHBondContact O-N 2.97Å; D1836-R1838 VanDerWaalsContact O-N 3.09Å; D1836-R1838 VanDerWaalsContact OD1-CB 3.26Å; D1836-R1838 WeakPolarHBondContact OD1-CB 3.49Å; D1836-R1838 IonicContact OD1-CZ 2.8Å; D1836-R1838 PolarHBondContact OD1-N 2.96Å; D1836-R1838 IonicContact OD1-NE 2.7Å; D1836-R1838 PolarHBondContact OD1-NE 3.17Å; D1836-R1838 IonicContact OD1-NH2 2.87Å; D1836-R1838 IonicContact OD2-CZ 3.02Å; D1836-R1838 IonicContact OD2-NE 3.15Å; D1836-R1838 IonicContact OD2-NH2 3.82Å; D1836-R1838 PolarHBondContact OD2-NH2 3.25Å; D1836-F1839 HydrophobicContact CB-CB 4.35Å; D1836-F1839 WeakPolarHBondContact O-CB 3.44Å; D1836-F1839 PolarHBondContact O-N 2.69Å; D1836-F1839 VanDerWaalsContact O-N 3.07Å; D1836-I1840 PolarHBondContact O-N 3.1Å; D1836-I1840 VanDerWaalsContact O-N 3.11Å
1837	P	47.8	Very low	66.1	Low	97 Å²	97	68.1 Å²	68.1	63%	0.63	35%	0.347	S	S	*	.	H	α-helix	trans	-53.3	-32.4	177.6	-28.1	35.8	0	0	0	114.2	I1840 E1841	P1837-I1840 PolarHBondContact O-N 2.97Å; P1837-E1841 WeakPolarHBondContact O-CB 3.04Å; P1837-E1841 PolarHBondContact O-N 2.87Å
1838	R	59.1	Low	66.3	Low	134 Å²	134	68.8 Å²	68.8	51%	0.506	36%	0.36	S	S	.	.	H	α-helix	trans	-75.8	-32.4	-179.2	-61.6	164.2	-71.6	-176.2	-1.3	112.4	V1830 D1836 M1842	V1830-R1838 HydrophobicContact CG1-CB 3.96Å; V1830-R1838 VanDerWaalsContact CG1-CZ 3.48Å; D1836-R1838 PolarHBondContact O-N 2.97Å; D1836-R1838 VanDerWaalsContact O-N 3.09Å; D1836-R1838 VanDerWaalsContact OD1-CB 3.26Å; D1836-R1838 WeakPolarHBondContact OD1-CB 3.49Å; D1836-R1838 IonicContact OD1-CZ 2.8Å; D1836-R1838 PolarHBondContact OD1-N 2.96Å; D1836-R1838 IonicContact OD1-NE 2.7Å; D1836-R1838 PolarHBondContact OD1-NE 3.17Å; D1836-R1838 IonicContact OD1-NH2 2.87Å; D1836-R1838 IonicContact OD2-CZ 3.02Å; D1836-R1838 IonicContact OD2-NE 3.15Å; D1836-R1838 IonicContact OD2-NH2 3.82Å; D1836-R1838 PolarHBondContact OD2-NH2 3.25Å; R1838-M1842 VanDerWaalsContact O-CB 3.22Å; R1838-M1842 WeakPolarHBondContact O-CB 3.38Å; R1838-M1842 PolarHBondContact O-N 2.7Å; R1838-M1842 VanDerWaalsContact O-N 3.09Å
1839	F	71.7	Confident	66.8	Low	14 Å²	14	66.5 Å²	66.5	6%	0.061	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-51.3	167.9	177.2	-85.6	0	0	0	109.4	Y1831 H1833 E1834 D1836 E1841 M1842 H1843 I1872	Y1831-F1839 VanDerWaalsContact O-CD2 3.31Å; Y1831-F1839 WeakPolarHBondContact O-CD2 3.21Å; H1833-F1839 WeakPolarHBondContact O-CB 3.34Å; E1834-F1839 HydrophobicContact CB-CD1 4.5Å; E1834-F1839 HydrophobicContact CB-CE1 4.2Å; E1834-F1839 HydrophobicContact CG-CE1 4.23Å; E1834-F1839 HydrophobicContact CG-CZ 4.13Å; D1836-F1839 HydrophobicContact CB-CB 4.35Å; D1836-F1839 WeakPolarHBondContact O-CB 3.44Å; D1836-F1839 PolarHBondContact O-N 2.69Å; D1836-F1839 VanDerWaalsContact O-N 3.07Å; F1839-E1841 PolarHBondContact O-N 3.48Å; F1839-M1842 PolarHBondContact O-N 2.78Å; F1839-H1843 HydrophobicContact CE1-CB 4.42Å; F1839-H1843 AromaticContact CE1-ND1 3.78Å; F1839-H1843 AromaticContact CZ-ND1 3.95Å; F1839-H1843 WeakPolarHBondContact O-CB 3.44Å; F1839-H1843 PolarHBondContact O-N 2.79Å; F1839-I1872 HydrophobicContact CD2-CB 4.34Å; F1839-I1872 HydrophobicContact CD2-CD1 3.88Å; F1839-I1872 HydrophobicContact CD2-CG1 4.22Å; F1839-I1872 HydrophobicContact CE2-CB 4.02Å; F1839-I1872 HydrophobicContact CE2-CD1 3.86Å; F1839-I1872 HydrophobicContact CE2-CG1 3.77Å; F1839-I1872 HydrophobicContact CZ-CD1 4.47Å; F1839-I1872 HydrophobicContact CZ-CG1 4.42Å
1840	I	64.5	Low	67.9	Low	79 Å²	79	62.4 Å²	62.4	41%	0.405	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-42.8	-177.8	-62.7	168.4	0	0	0	111.5	D1836 P1837 N1844	D1836-I1840 PolarHBondContact O-N 3.1Å; D1836-I1840 VanDerWaalsContact O-N 3.11Å; P1837-I1840 PolarHBondContact O-N 2.97Å; I1840-N1844 WeakPolarHBondContact CG2-ND2 3.39Å; I1840-N1844 WeakPolarHBondContact O-CB 3.33Å; I1840-N1844 VanDerWaalsContact O-CG 3.28Å; I1840-N1844 PolarHBondContact O-N 2.84Å; I1840-N1844 PolarHBondContact O-ND2 2.81Å
1841	E	66.2	Low	68.5	Low	119 Å²	119	62 Å²	62	56%	0.556	32%	0.319	S	S	*	.	H	α-helix	trans	-63.5	-52.7	177.1	-174.5	176.8	-174.2	0	0	111.6	P1837 F1839 H1843 N1844 V1845	P1837-E1841 WeakPolarHBondContact O-CB 3.04Å; P1837-E1841 PolarHBondContact O-N 2.87Å; F1839-E1841 PolarHBondContact O-N 3.48Å; E1841-H1843 VanDerWaalsContact C-N 3.34Å; E1841-H1843 PolarHBondContact O-N 3.04Å; E1841-N1844 PolarHBondContact O-N 3.44Å; E1841-V1845 WeakPolarHBondContact O-CG2 3.06Å; E1841-V1845 PolarHBondContact O-N 2.69Å
1842	M	77.6	Confident	68.6	Low	14 Å²	14	64.3 Å²	64.3	7%	0.069	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-41.7	179.3	-177.8	59	69.3	0	0	112	W1820 L1825 Y1831 R1838 F1839 V1845 Y1846 I1872 L1886 F1888	W1820-M1842 HydrophobicContact CE3-CE 4.4Å; W1820-M1842 HydrophobicContact CZ3-CE 4.49Å; L1825-M1842 HydrophobicContact CD2-CE 4.43Å; Y1831-M1842 HydrophobicContact CE1-CB 4.07Å; Y1831-M1842 HydrophobicContact CE1-CG 4.08Å; R1838-M1842 VanDerWaalsContact O-CB 3.22Å; R1838-M1842 WeakPolarHBondContact O-CB 3.38Å; R1838-M1842 PolarHBondContact O-N 2.7Å; R1838-M1842 VanDerWaalsContact O-N 3.09Å; F1839-M1842 PolarHBondContact O-N 2.78Å; M1842-V1845 PolarHBondContact O-N 3.17Å; M1842-Y1846 VanDerWaalsContact O-CB 3.31Å; M1842-Y1846 WeakPolarHBondContact O-CB 3.45Å; M1842-Y1846 PolarHBondContact O-N 2.71Å; M1842-I1872 HydrophobicContact CG-CD1 4.29Å; M1842-L1886 HydrophobicContact CE-CD1 4.02Å; M1842-L1886 HydrophobicContact CG-CD1 3.93Å; M1842-L1886 HydrophobicContact SD-CD1 4.09Å; M1842-F1888 HydrophobicContact CG-CE1 4.22Å; M1842-F1888 HydrophobicContact CG-CZ 3.75Å; M1842-F1888 HydrophobicContact SD-CZ 4.05Å
1843	H	76.5	Confident	69.1	Low	39 Å²	39	60.3 Å²	60.3	18%	0.181	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-46.6	175.7	-176.2	113.1	0	0	0	111.7	F1839 E1841 Y1846 L1847 V1869 I1872	F1839-H1843 HydrophobicContact CE1-CB 4.42Å; F1839-H1843 AromaticContact CE1-ND1 3.78Å; F1839-H1843 AromaticContact CZ-ND1 3.95Å; F1839-H1843 WeakPolarHBondContact O-CB 3.44Å; F1839-H1843 PolarHBondContact O-N 2.79Å; E1841-H1843 VanDerWaalsContact C-N 3.34Å; E1841-H1843 PolarHBondContact O-N 3.04Å; H1843-Y1846 PolarHBondContact O-N 2.88Å; H1843-L1847 WeakPolarHBondContact O-CG 3.49Å; H1843-L1847 PolarHBondContact O-N 2.64Å; H1843-V1869 PolarHBondContact CE1-O 2.79Å; H1843-I1872 HydrophobicContact CB-CD1 4.34Å
1844	N	71.4	Confident	70	Confident	92 Å²	92	55.3 Å²	55.3	49%	0.492	29%	0.288	S	S	.	.	H	α-helix	trans	-66.2	-42.6	177.8	-77.2	-43.7	0	0	0	112.7	I1840 E1841 L1847 S1848	I1840-N1844 WeakPolarHBondContact CG2-ND2 3.39Å; I1840-N1844 WeakPolarHBondContact O-CB 3.33Å; I1840-N1844 VanDerWaalsContact O-CG 3.28Å; I1840-N1844 PolarHBondContact O-N 2.84Å; I1840-N1844 PolarHBondContact O-ND2 2.81Å; E1841-N1844 PolarHBondContact O-N 3.44Å; N1844-L1847 PolarHBondContact O-N 3.2Å; N1844-S1848 PolarHBondContact O-N 3.1Å; N1844-S1848 VanDerWaalsContact O-N 3.09Å
1845	V	77.3	Confident	70.7	Confident	43 Å²	43	56.9 Å²	56.9	26%	0.261	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-46.1	176	174.7	0	0	0	0	110.2	E1841 M1842 S1848 A1849 L1924	E1841-V1845 WeakPolarHBondContact O-CG2 3.06Å; E1841-V1845 PolarHBondContact O-N 2.69Å; M1842-V1845 PolarHBondContact O-N 3.17Å; V1845-S1848 PolarHBondContact O-N 2.84Å; V1845-S1848 PolarHBondContact O-OG 2.83Å; V1845-A1849 PolarHBondContact O-N 3.16Å; V1845-A1849 VanDerWaalsContact O-N 3.1Å; V1845-L1924 HydrophobicContact CG1-CD1 4.23Å; V1845-L1924 HydrophobicContact CG1-CD2 4.49Å; V1845-L1924 HydrophobicContact CG1-CG 4.42Å
1846	Y	85.9	Confident	71.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.6	-49.6	176.5	176.6	-92.7	0	0	0	112.9	I1815 V1817 M1842 H1843 S1848 A1849 F1850 V1869 F1888 T1890 L1919 L1924	I1815-Y1846 HydrophobicContact CB-CE2 4.31Å; I1815-Y1846 WeakPolarHBondContact CB-OH 3.29Å; I1815-Y1846 HydrophobicContact CG2-CE2 4.07Å; V1817-Y1846 HydrophobicContact CG2-CD2 4.1Å; V1817-Y1846 HydrophobicContact CG2-CE2 4.2Å; M1842-Y1846 VanDerWaalsContact O-CB 3.31Å; M1842-Y1846 WeakPolarHBondContact O-CB 3.45Å; M1842-Y1846 PolarHBondContact O-N 2.71Å; H1843-Y1846 PolarHBondContact O-N 2.88Å; Y1846-S1848 VanDerWaalsContact C-N 3.26Å; Y1846-S1848 PolarHBondContact O-N 3.05Å; Y1846-A1849 PolarHBondContact O-N 2.95Å; Y1846-A1849 VanDerWaalsContact O-N 3.12Å; Y1846-F1850 HydrophobicContact CE1-CB 4.27Å; Y1846-F1850 WeakPolarHBondContact O-CB 3.28Å; Y1846-F1850 PolarHBondContact O-N 3.15Å; Y1846-V1869 HydrophobicContact CD1-CG2 3.78Å; Y1846-V1869 HydrophobicContact CE1-CG2 3.59Å; Y1846-F1888 VanDerWaalsContact CB-CE1 3.41Å; Y1846-F1888 HydrophobicContact CD1-CB 4.42Å; Y1846-F1888 AromaticContact CD1-CD1 3.56Å; Y1846-F1888 HydrophobicContact CD1-CD1 3.56Å; Y1846-F1888 HydrophobicContact CD1-CE1 4.01Å; Y1846-F1888 HydrophobicContact CD1-CG 4.1Å; Y1846-F1888 HydrophobicContact CD2-CB 4.4Å; Y1846-F1888 AromaticContact CD2-CD1 3.7Å; Y1846-F1888 HydrophobicContact CD2-CD1 3.7Å; Y1846-F1888 AromaticContact CD2-CD2 3.8Å; Y1846-F1888 HydrophobicContact CD2-CD2 3.8Å; Y1846-F1888 AromaticContact CD2-CE1 3.79Å; Y1846-F1888 HydrophobicContact CD2-CE1 3.79Å; Y1846-F1888 AromaticContact CD2-CE2 3.89Å; Y1846-F1888 HydrophobicContact CD2-CE2 3.89Å; Y1846-F1888 AromaticContact CD2-CG 3.71Å; Y1846-F1888 HydrophobicContact CD2-CG 3.71Å; Y1846-F1888 AromaticContact CD2-CZ 3.88Å; Y1846-F1888 HydrophobicContact CD2-CZ 3.88Å; Y1846-F1888 HydrophobicContact CE1-CB 3.95Å; Y1846-F1888 AromaticContact CE1-CD1 3.98Å; Y1846-F1888 HydrophobicContact CE1-CD1 3.98Å; Y1846-F1888 HydrophobicContact CE1-CG 4.1Å; Y1846-F1888 HydrophobicContact CE2-CB 3.94Å; Y1846-F1888 HydrophobicContact CE2-CD1 4.1Å; Y1846-F1888 AromaticContact CE2-CD2 3.87Å; Y1846-F1888 HydrophobicContact CE2-CD2 3.87Å; Y1846-F1888 HydrophobicContact CE2-CE2 4.39Å; Y1846-F1888 AromaticContact CE2-CG 3.71Å; Y1846-F1888 HydrophobicContact CE2-CG 3.71Å; Y1846-F1888 AromaticContact CG-CD1 3.41Å; Y1846-F1888 HydrophobicContact CG-CD1 3.41Å; Y1846-F1888 VanDerWaalsContact CG-CD1 3.41Å; Y1846-F1888 HydrophobicContact CG-CD2 4.37Å; Y1846-F1888 AromaticContact CG-CE1 3.44Å; Y1846-F1888 HydrophobicContact CG-CE1 3.44Å; Y1846-F1888 VanDerWaalsContact CG-CE1 3.44Å; Y1846-F1888 HydrophobicContact CG-CE2 4.4Å; Y1846-F1888 AromaticContact CG-CG 3.91Å; Y1846-F1888 HydrophobicContact CG-CG 3.91Å; Y1846-F1888 AromaticContact CG-CZ 3.96Å; Y1846-F1888 HydrophobicContact CG-CZ 3.96Å; Y1846-F1888 AromaticContact CZ-CG 3.92Å; Y1846-T1890 HydrophobicContact CE1-CG2 4.38Å; Y1846-T1890 WeakPolarHBondContact CE1-OG1 3.26Å; Y1846-T1890 PolarHBondContact OH-OG1 3.19Å; Y1846-L1919 HydrophobicContact CD2-CD2 4.01Å; Y1846-L1919 HydrophobicContact CE2-CD2 3.81Å; Y1846-L1924 HydrophobicContact CD2-CD1 4.44Å
1847	L	78.9	Confident	72.4	Confident	41 Å²	41	51.9 Å²	51.9	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-58	-38.8	178	-75.4	176.9	0	0	0	112.2	H1843 N1844 G1851 F1867 V1869	H1843-L1847 WeakPolarHBondContact O-CG 3.49Å; H1843-L1847 PolarHBondContact O-N 2.64Å; N1844-L1847 PolarHBondContact O-N 3.2Å; L1847-G1851 PolarHBondContact O-N 3.44Å; L1847-F1867 HydrophobicContact CD2-CD2 3.83Å; L1847-F1867 HydrophobicContact CD2-CE2 3.97Å; L1847-V1869 HydrophobicContact CD2-CG2 3.97Å
1848	S	72.4	Confident	73.1	Confident	66 Å²	66	51.5 Å²	51.5	46%	0.462	27%	0.271	S	S	.	.	H	α-helix	trans	-65.6	-40.6	177.1	80.4	0	0	0	0	112.5	N1844 V1845 Y1846 Q1852	N1844-S1848 PolarHBondContact O-N 3.1Å; N1844-S1848 VanDerWaalsContact O-N 3.09Å; V1845-S1848 PolarHBondContact O-N 2.84Å; V1845-S1848 PolarHBondContact O-OG 2.83Å; Y1846-S1848 VanDerWaalsContact C-N 3.26Å; Y1846-S1848 PolarHBondContact O-N 3.05Å; S1848-Q1852 WeakPolarHBondContact O-CG 3.44Å; S1848-Q1852 PolarHBondContact O-N 3.01Å
1849	A	79.4	Confident	73.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-70.8	-45.9	179.3	0	0	0	0	0	112	V1845 Y1846 G1851 Q1852 A1853 L1919 S1922 L1924	V1845-A1849 PolarHBondContact O-N 3.16Å; V1845-A1849 VanDerWaalsContact O-N 3.1Å; Y1846-A1849 PolarHBondContact O-N 2.95Å; Y1846-A1849 VanDerWaalsContact O-N 3.12Å; A1849-G1851 PolarHBondContact O-N 3.33Å; A1849-Q1852 PolarHBondContact O-N 2.03Å; A1849-A1853 PolarHBondContact O-N 3.12Å; A1849-L1919 HydrophobicContact CB-CB 4.2Å; A1849-L1919 HydrophobicContact CB-CD2 3.76Å; A1849-L1919 HydrophobicContact CB-CG 3.86Å; A1849-S1922 WeakPolarHBondContact CB-OG 3.34Å; A1849-L1924 HydrophobicContact CB-CD1 4.17Å
1850	F	84	Confident	72.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-43.4	175.8	-171.6	-91.7	0	0	0	111.2	I1815 Y1846 Q1852 A1853 V1854 F1867 T1890 V1892 L1908 L1919	I1815-F1850 HydrophobicContact CD1-CD2 3.88Å; I1815-F1850 HydrophobicContact CD1-CE2 3.67Å; Y1846-F1850 HydrophobicContact CE1-CB 4.27Å; Y1846-F1850 WeakPolarHBondContact O-CB 3.28Å; Y1846-F1850 PolarHBondContact O-N 3.15Å; F1850-Q1852 VanDerWaalsContact C-N 3.29Å; F1850-Q1852 PolarHBondContact O-N 3.1Å; F1850-A1853 PolarHBondContact O-N 3.27Å; F1850-A1853 VanDerWaalsContact O-N 3.11Å; F1850-V1854 HydrophobicContact CD1-CG2 3.9Å; F1850-V1854 HydrophobicContact CE1-CG2 3.57Å; F1850-V1854 HydrophobicContact CZ-CG2 4.06Å; F1850-V1854 WeakPolarHBondContact O-CG2 3.19Å; F1850-V1854 PolarHBondContact O-N 2.78Å; F1850-F1867 HydrophobicContact CD1-CB 4.32Å; F1850-F1867 AromaticContact CD1-CD1 3.98Å; F1850-F1867 HydrophobicContact CD1-CD1 3.98Å; F1850-F1867 AromaticContact CD1-CD2 3.64Å; F1850-F1867 HydrophobicContact CD1-CD2 3.64Å; F1850-F1867 HydrophobicContact CD1-CE1 4.22Å; F1850-F1867 AromaticContact CD1-CE2 3.9Å; F1850-F1867 HydrophobicContact CD1-CE2 3.9Å; F1850-F1867 AromaticContact CD1-CG 3.7Å; F1850-F1867 HydrophobicContact CD1-CG 3.7Å; F1850-F1867 HydrophobicContact CD1-CZ 4.19Å; F1850-F1867 HydrophobicContact CE1-CB 3.87Å; F1850-F1867 AromaticContact CE1-CD1 3.9Å; F1850-F1867 HydrophobicContact CE1-CD1 3.9Å; F1850-F1867 HydrophobicContact CE1-CD2 4.09Å; F1850-F1867 AromaticContact CE1-CG 3.68Å; F1850-F1867 HydrophobicContact CE1-CG 3.68Å; F1850-T1890 HydrophobicContact CD1-CG2 4.35Å; F1850-T1890 HydrophobicContact CD2-CG2 4.46Å; F1850-T1890 HydrophobicContact CE1-CG2 3.98Å; F1850-T1890 HydrophobicContact CE2-CG2 4.1Å; F1850-T1890 HydrophobicContact CZ-CG2 3.85Å; F1850-V1892 HydrophobicContact CE1-CG2 4.49Å; F1850-V1892 HydrophobicContact CZ-CG2 4.15Å; F1850-L1908 HydrophobicContact CE2-CD2 3.78Å; F1850-L1908 HydrophobicContact CZ-CD2 4.04Å; F1850-L1919 HydrophobicContact CB-CD2 4.35Å
1851	G	75.4	Confident	72.1	Confident	15 Å²	15	54.8 Å²	54.8	16%	0.155	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-30.9	175.5	0	0	0	0	0	114.5	L1847 A1849 K1855 F1867	L1847-G1851 PolarHBondContact O-N 3.44Å; A1849-G1851 PolarHBondContact O-N 3.33Å; G1851-K1855 WeakPolarHBondContact O-CB 3.46Å; G1851-K1855 WeakPolarHBondContact O-CG 3.47Å; G1851-K1855 PolarHBondContact O-N 3.22Å; G1851-F1867 VanDerWaalsContact CA-CZ 3.44Å
1852	Q	72.2	Confident	71.1	Confident	82 Å²	82	53 Å²	53	38%	0.383	30%	0.301	S	S	.	.	H	α-helix	trans	-72	-42.5	170.5	-73.7	176.2	-0.3	0	0	111.9	S1848 A1849 F1850 K1855 A1856 S1921	S1848-Q1852 WeakPolarHBondContact O-CG 3.44Å; S1848-Q1852 PolarHBondContact O-N 3.01Å; A1849-Q1852 PolarHBondContact O-N 2.03Å; F1850-Q1852 VanDerWaalsContact C-N 3.29Å; F1850-Q1852 PolarHBondContact O-N 3.1Å; Q1852-K1855 PolarHBondContact O-N 2.9Å; Q1852-A1856 PolarHBondContact O-N 2.92Å; Q1852-A1856 VanDerWaalsContact O-N 3.14Å; Q1852-S1921 VanDerWaalsContact OE1-CB 3.26Å
1853	A	75.7	Confident	69.6	Low	5 Å²	5	56.4 Å²	56.4	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-42.6	177.8	0	0	0	0	0	112.1	A1849 F1850 A1856 L1908 L1919	A1849-A1853 PolarHBondContact O-N 3.12Å; F1850-A1853 PolarHBondContact O-N 3.27Å; F1850-A1853 VanDerWaalsContact O-N 3.11Å; A1853-A1856 WeakPolarHBondContact O-CB 3.49Å; A1853-A1856 PolarHBondContact O-N 3.1Å; A1853-L1908 HydrophobicContact CB-CD1 3.94Å; A1853-L1919 HydrophobicContact CB-CD1 3.81Å
1854	V	76.1	Confident	68.4	Low	10 Å²	10	56.3 Å²	56.3	6%	0.061	33%	0.329	C	S	.	.	H	α-helix	trans	-65.1	-38.6	175.1	175.7	0	0	0	0	111.7	F1850 A1856 I1857 L1860 V1865 F1904 L1908	F1850-V1854 HydrophobicContact CD1-CG2 3.9Å; F1850-V1854 HydrophobicContact CE1-CG2 3.57Å; F1850-V1854 HydrophobicContact CZ-CG2 4.06Å; F1850-V1854 WeakPolarHBondContact O-CG2 3.19Å; F1850-V1854 PolarHBondContact O-N 2.78Å; V1854-A1856 PolarHBondContact O-N 2.77Å; V1854-I1857 PolarHBondContact O-N 2.72Å; V1854-L1860 HydrophobicContact CG1-CD2 3.7Å; V1854-V1865 HydrophobicContact CG1-CG1 4.49Å; V1854-F1904 HydrophobicContact CG2-CZ 4.21Å; V1854-L1908 HydrophobicContact CG2-CD1 4.5Å
1855	K	68	Low	68	Low	165 Å²	165	52.8 Å²	52.8	72%	0.717	31%	0.31	S	S	*	.	H	α-helix	trans	-67.2	-16.9	174.4	-82.3	-178.6	175.9	-178.1	0	114.6	G1851 Q1852	G1851-K1855 WeakPolarHBondContact O-CB 3.46Å; G1851-K1855 WeakPolarHBondContact O-CG 3.47Å; G1851-K1855 PolarHBondContact O-N 3.22Å; Q1852-K1855 PolarHBondContact O-N 2.9Å
1856	A	70.5	Confident	67.2	Low	57 Å²	57	53.9 Å²	53.9	47%	0.471	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.2	178	0	0	0	0	0	113.4	Q1852 A1853 V1854 P1858	Q1852-A1856 PolarHBondContact O-N 2.92Å; Q1852-A1856 VanDerWaalsContact O-N 3.14Å; A1853-A1856 WeakPolarHBondContact O-CB 3.49Å; A1853-A1856 PolarHBondContact O-N 3.1Å; V1854-A1856 PolarHBondContact O-N 2.77Å; A1856-P1858 WeakPolarHBondContact O-CD 3.36Å
1857	I	70.8	Confident	66.8	Low	18 Å²	18	56.8 Å²	56.8	9%	0.092	33%	0.332	C	S	.	.	S	Bend	trans	-77.2	118.6	179.3	-59.7	175.4	0	0	0	109.4	V1854 L1860 F1904 T1907 L1908	V1854-I1857 PolarHBondContact O-N 2.72Å; I1857-L1860 HydrophobicContact CB-CB 4.13Å; I1857-L1860 HydrophobicContact CB-CD2 4.06Å; I1857-L1860 HydrophobicContact CD1-CD2 4.1Å; I1857-L1860 HydrophobicContact CG2-CB 3.94Å; I1857-L1860 HydrophobicContact CG2-CD2 4.29Å; I1857-F1904 HydrophobicContact CD1-CD2 4.41Å; I1857-F1904 HydrophobicContact CD1-CE2 3.99Å; I1857-T1907 HydrophobicContact CG2-CG2 3.92Å; I1857-L1908 HydrophobicContact CD1-CB 4.31Å; I1857-L1908 HydrophobicContact CD1-CD1 4.25Å
1858	P	60.7	Low	66.3	Low	88 Å²	88	58.5 Å²	58.5	57%	0.571	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	156.1	173.9	-21.1	34.4	0	0	0	112.2	A1856 L1860	A1856-P1858 WeakPolarHBondContact O-CD 3.36Å; P1858-L1860 PolarHBondContact O-N 2.78Å
1859	D	60.3	Low	66.5	Low	177 Å²	177	56 Å²	56	95%	0.947	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	-0.4	-179.5	-54.8	-40.8	0	0	0	116.5	D1861	D1859-D1861 PolarHBondContact O-N 2.89Å
1860	L	61.6	Low	65.5	Low	37 Å²	37	60.8 Å²	60.8	19%	0.194	34%	0.344	C	S	.	.			trans	-88.2	106.5	176.4	-168.4	71.7	0	0	0	111.4	V1854 I1857 P1858 S1862 V1865 I1899 F1904	V1854-L1860 HydrophobicContact CG1-CD2 3.7Å; I1857-L1860 HydrophobicContact CB-CB 4.13Å; I1857-L1860 HydrophobicContact CB-CD2 4.06Å; I1857-L1860 HydrophobicContact CD1-CD2 4.1Å; I1857-L1860 HydrophobicContact CG2-CB 3.94Å; I1857-L1860 HydrophobicContact CG2-CD2 4.29Å; P1858-L1860 PolarHBondContact O-N 2.78Å; L1860-S1862 PolarHBondContact O-N 2.95Å; L1860-V1865 HydrophobicContact CD1-CG2 4Å; L1860-V1865 HydrophobicContact CD2-CG2 4.26Å; L1860-V1865 HydrophobicContact CG-CG2 4.29Å; L1860-I1899 HydrophobicContact CD1-CD1 3.64Å; L1860-I1899 HydrophobicContact CD1-CG1 4.11Å; L1860-F1904 HydrophobicContact CD2-CE2 3.98Å
1861	D	52.4	Low	64.7	Low	83 Å²	83	62.1 Å²	62.1	44%	0.444	35%	0.353	S	S	.	.			trans	-65	104.8	171.1	179.2	-7.9	0	0	0	110	D1859 S1863 T1864	D1859-D1861 PolarHBondContact O-N 2.89Å; D1861-S1863 PolarHBondContact O-N 2.82Å; D1861-S1863 VanDerWaalsContact OD1-CB 3.28Å; D1861-S1863 WeakPolarHBondContact OD1-CB 3.29Å; D1861-S1863 PolarHBondContact OD1-N 3.26Å; D1861-S1863 PolarHBondContact OD1-OG 2.84Å; D1861-S1863 PolarHBondContact OD2-OG 3.35Å; D1861-S1863 VanDerWaalsContact OD2-OG 3.07Å; D1861-T1864 HydrophobicContact CB-CG2 3.98Å; D1861-T1864 WeakPolarHBondContact O-CB 3.45Å; D1861-T1864 PolarHBondContact O-N 2.91Å; D1861-T1864 PolarHBondContact O-OG1 3.11Å
1862	S	46.6	Very low	65	Low	80 Å²	80	61.5 Å²	61.5	56%	0.559	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-8.7	179.7	66.1	0	0	0	0	115.4	L1860	L1860-S1862 PolarHBondContact O-N 2.95Å
1863	S	46.2	Very low	65.2	Low	86 Å²	86	61.7 Å²	61.7	60%	0.601	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-6.3	170.6	76.1	0	0	0	0	114.5	D1861	D1861-S1863 PolarHBondContact O-N 2.82Å; D1861-S1863 VanDerWaalsContact OD1-CB 3.28Å; D1861-S1863 WeakPolarHBondContact OD1-CB 3.29Å; D1861-S1863 PolarHBondContact OD1-N 3.26Å; D1861-S1863 PolarHBondContact OD1-OG 2.84Å; D1861-S1863 PolarHBondContact OD2-OG 3.35Å; D1861-S1863 VanDerWaalsContact OD2-OG 3.07Å
1864	T	50.8	Low	65.3	Low	38 Å²	38	62.4 Å²	62.4	23%	0.233	35%	0.349	C	S	.	.	S	Bend	trans	-103.6	-10.2	-174.4	65.3	0	0	0	0	115	D1861	D1861-T1864 HydrophobicContact CB-CG2 3.98Å; D1861-T1864 WeakPolarHBondContact O-CB 3.45Å; D1861-T1864 PolarHBondContact O-N 2.91Å; D1861-T1864 PolarHBondContact O-OG1 3.11Å
1865	V	63.2	Low	65	Low	18 Å²	18	62 Å²	62	11%	0.109	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.9	-177.3	-173.2	0	0	0	0	110.2	V1854 L1860 V1892 T1894 I1899	V1854-V1865 HydrophobicContact CG1-CG1 4.49Å; L1860-V1865 HydrophobicContact CD1-CG2 4Å; L1860-V1865 HydrophobicContact CD2-CG2 4.26Å; L1860-V1865 HydrophobicContact CG-CG2 4.29Å; V1865-V1892 HydrophobicContact CG1-CG1 3.77Å; V1865-T1894 HydrophobicContact CG1-CG2 4.36Å; V1865-T1894 HydrophobicContact CG2-CG2 4.27Å; V1865-I1899 HydrophobicContact CG2-CD1 3.41Å; V1865-I1899 VanDerWaalsContact CG2-CD1 3.41Å
1866	S	61	Low	65	Low	65 Å²	65	56.8 Å²	56.8	46%	0.455	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	156.2	167.2	51.9	0	0	0	0	109.8	N1893	S1866-N1893 PolarHBondContact N-O 3.17Å; S1866-N1893 PolarHBondContact O-N 2.68Å; S1866-N1893 WeakPolarHBondContact OG-CB 3.25Å
1867	F	75.9	Confident	64.7	Low	62 Å²	62	60 Å²	60	27%	0.272	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	147.2	-175	50.7	-93.5	0	0	0	111	L1847 F1850 G1851 T1890 T1891	L1847-F1867 HydrophobicContact CD2-CD2 3.83Å; L1847-F1867 HydrophobicContact CD2-CE2 3.97Å; F1850-F1867 HydrophobicContact CD1-CB 4.32Å; F1850-F1867 AromaticContact CD1-CD1 3.98Å; F1850-F1867 HydrophobicContact CD1-CD1 3.98Å; F1850-F1867 AromaticContact CD1-CD2 3.64Å; F1850-F1867 HydrophobicContact CD1-CD2 3.64Å; F1850-F1867 HydrophobicContact CD1-CE1 4.22Å; F1850-F1867 AromaticContact CD1-CE2 3.9Å; F1850-F1867 HydrophobicContact CD1-CE2 3.9Å; F1850-F1867 AromaticContact CD1-CG 3.7Å; F1850-F1867 HydrophobicContact CD1-CG 3.7Å; F1850-F1867 HydrophobicContact CD1-CZ 4.19Å; F1850-F1867 HydrophobicContact CE1-CB 3.87Å; F1850-F1867 AromaticContact CE1-CD1 3.9Å; F1850-F1867 HydrophobicContact CE1-CD1 3.9Å; F1850-F1867 HydrophobicContact CE1-CD2 4.09Å; F1850-F1867 AromaticContact CE1-CG 3.68Å; F1850-F1867 HydrophobicContact CE1-CG 3.68Å; G1851-F1867 VanDerWaalsContact CA-CZ 3.44Å; F1867-T1890 HydrophobicContact CB-CG2 4.34Å; F1867-T1891 WeakPolarHBondContact CA-O 2.91Å
1868	E	68.5	Low	64.4	Low	76 Å²	76	60.6 Å²	60.6	36%	0.355	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	158.3	178.5	65.7	-154.6	132.9	0	0	109.5	K1810 T1890 T1891 N1893	K1810-E1868 IonicContact NZ-OE1 2.66Å; K1810-E1868 PolarHBondContact NZ-OE1 3.39Å; K1810-E1868 IonicContact NZ-OE2 3.58Å; E1868-T1890 CarbonylContact O-C 2.76Å; E1868-T1890 WeakPolarHBondContact O-CA 3.35Å; E1868-T1891 HydrophobicContact CG-CG2 4.47Å; E1868-T1891 PolarHBondContact N-O 3.1Å; E1868-T1891 PolarHBondContact O-N 2.93Å; E1868-N1893 PolarHBondContact OE1-ND2 3.29Å
1869	V	76.3	Confident	64.8	Low	14 Å²	14	57.2 Å²	57.2	9%	0.085	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	119.6	178.9	171.9	0	0	0	0	109	H1843 Y1846 L1847 F1888 N1889 T1890	H1843-V1869 PolarHBondContact CE1-O 2.79Å; Y1846-V1869 HydrophobicContact CD1-CG2 3.78Å; Y1846-V1869 HydrophobicContact CE1-CG2 3.59Å; L1847-V1869 HydrophobicContact CD2-CG2 3.97Å; V1869-F1888 HydrophobicContact CG1-CB 4.49Å; V1869-F1888 HydrophobicContact CG1-CD1 4.2Å; V1869-N1889 WeakPolarHBondContact CA-O 3.14Å; V1869-T1890 HydrophobicContact CG2-CG2 4.22Å
1870	E	60	Low	64.7	Low	101 Å²	101	54 Å²	54	47%	0.472	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-21.7	-173.8	-67	-175.6	-154	0	0	113.4	N1889 T1891	E1870-N1889 PolarHBondContact N-O 3.16Å; E1870-N1889 VanDerWaalsContact N-O 3.12Å; E1870-T1891 PolarHBondContact OE1-OG1 2.76Å
1871	S	66.9	Low	64.4	Low	28 Å²	28	58 Å²	58	20%	0.196	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	156.1	175.8	37.5	0	0	0	0	112.5	K1873 N1889	S1871-K1873 VanDerWaalsContact OG-CE 3.27Å; S1871-K1873 WeakPolarHBondContact OG-CE 3.08Å; S1871-K1873 PolarHBondContact OG-NZ 2.76Å; S1871-N1889 PolarHBondContact O-N 3.37Å
1872	I	80.4	Confident	64.9	Low	2 Å²	2	54.5 Å²	54.5	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	107.7	171.7	-57.9	177.1	0	0	0	108.3	Y1831 F1839 M1842 H1843 L1886 L1887 F1888	Y1831-I1872 HydrophobicContact CD1-CB 4.5Å; Y1831-I1872 HydrophobicContact CD1-CD1 4.34Å; Y1831-I1872 HydrophobicContact CD1-CG2 4.01Å; Y1831-I1872 HydrophobicContact CG-CG2 3.99Å; F1839-I1872 HydrophobicContact CD2-CB 4.34Å; F1839-I1872 HydrophobicContact CD2-CD1 3.88Å; F1839-I1872 HydrophobicContact CD2-CG1 4.22Å; F1839-I1872 HydrophobicContact CE2-CB 4.02Å; F1839-I1872 HydrophobicContact CE2-CD1 3.86Å; F1839-I1872 HydrophobicContact CE2-CG1 3.77Å; F1839-I1872 HydrophobicContact CZ-CD1 4.47Å; F1839-I1872 HydrophobicContact CZ-CG1 4.42Å; M1842-I1872 HydrophobicContact CG-CD1 4.29Å; H1843-I1872 HydrophobicContact CB-CD1 4.34Å; I1872-L1886 HydrophobicContact CG2-CB 4.14Å; I1872-L1886 HydrophobicContact CG2-CD1 4.47Å; I1872-L1886 HydrophobicContact CG2-CD2 4.32Å; I1872-L1887 CarbonylContact C-O 3.54Å; I1872-L1887 WeakPolarHBondContact CA-O 3.31Å; I1872-F1888 HydrophobicContact CD1-CD1 4.1Å; I1872-F1888 HydrophobicContact CD1-CE1 3.57Å; I1872-F1888 HydrophobicContact CD1-CZ 4.24Å; I1872-F1888 HydrophobicContact CG1-CD1 3.83Å; I1872-F1888 HydrophobicContact CG1-CE1 3.81Å
1873	K	78.2	Confident	65.3	Low	85 Å²	85	54.3 Å²	54.3	37%	0.37	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	169.9	-169.8	-76.1	167.6	176.5	138.7	0	112.7	W1827 S1871 L1887	W1827-K1873 VanDerWaalsContact CD1-O 3.28Å; S1871-K1873 VanDerWaalsContact OG-CE 3.27Å; S1871-K1873 WeakPolarHBondContact OG-CE 3.08Å; S1871-K1873 PolarHBondContact OG-NZ 2.76Å; K1873-L1887 HydrophobicContact CB-CB 4.28Å; K1873-L1887 HydrophobicContact CB-CD2 4.2Å; K1873-L1887 HydrophobicContact CB-CG 4.39Å; K1873-L1887 PolarHBondContact N-O 3.16Å; K1873-L1887 WeakPolarHBondContact O-CB 3.42Å; K1873-L1887 PolarHBondContact O-N 2.78Å
1874	D	76.4	Confident	66.1	Low	21 Å²	21	52.4 Å²	52.4	11%	0.112	31%	0.311	C	S	.	.			trans	-77.7	118.8	173.2	-165.5	-26.4	0	0	0	110.3	W1827 S1876 K1877 T1878	W1827-D1874 HydrophobicContact CB-CB 4.06Å; W1827-D1874 VanDerWaalsContact CD1-N 3.27Å; W1827-D1874 HydrophobicContact CD2-CB 3.48Å; W1827-D1874 VanDerWaalsContact CD2-CB 3.48Å; W1827-D1874 HydrophobicContact CE3-CB 3.89Å; W1827-D1874 VanDerWaalsContact CE3-OD2 3.24Å; W1827-D1874 VanDerWaalsContact CG-CA 3.44Å; W1827-D1874 HydrophobicContact CG-CB 3.54Å; D1874-S1876 VanDerWaalsContact C-N 3.25Å; D1874-S1876 VanDerWaalsContact CG-OG 3.24Å; D1874-S1876 PolarHBondContact O-N 3Å; D1874-S1876 WeakPolarHBondContact OD1-CB 3.47Å; D1874-S1876 PolarHBondContact OD1-N 3.48Å; D1874-S1876 PolarHBondContact OD1-OG 2.84Å; D1874-S1876 PolarHBondContact OD2-OG 2.83Å; D1874-K1877 HydrophobicContact CB-CB 4.12Å; D1874-K1877 HydrophobicContact CB-CD 3.65Å; D1874-K1877 HydrophobicContact CB-CG 3.77Å; D1874-K1877 VanDerWaalsContact OD2-CE 3.23Å; D1874-K1877 WeakPolarHBondContact OD2-CE 3.46Å; D1874-K1877 IonicContact OD2-NZ 2.8Å; D1874-T1878 PolarHBondContact O-OG1 3.43Å
1875	P	70.2	Confident	67.3	Low	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	-65.4	-30.5	174.8	28.2	-33.4	0	0	0	111.6	I1816 K1877 T1878 Y1879 V1882 G1885 L1887	I1816-P1875 HydrophobicContact CD1-CB 4.06Å; I1816-P1875 HydrophobicContact CG1-CB 4.28Å; I1816-P1875 HydrophobicContact CG2-CB 4.18Å; I1816-P1875 HydrophobicContact CG2-CG 4.48Å; P1875-K1877 PolarHBondContact O-N 3.18Å; P1875-T1878 CarbonylContact O-C 3.17Å; P1875-T1878 WeakPolarHBondContact O-CA 3.31Å; P1875-T1878 PolarHBondContact O-N 3.09Å; P1875-Y1879 PolarHBondContact O-N 2.72Å; P1875-V1882 HydrophobicContact CB-CB 4.23Å; P1875-V1882 HydrophobicContact CB-CG1 3.81Å; P1875-V1882 HydrophobicContact CG-CG1 4.06Å; P1875-G1885 VanDerWaalsContact CD-O 3.23Å; P1875-G1885 WeakPolarHBondContact CD-O 3.44Å; P1875-G1885 WeakPolarHBondContact CG-O 3.18Å; P1875-L1887 HydrophobicContact CB-CB 4.33Å
1876	S	67.2	Low	68.4	Low	57 Å²	57	49.8 Å²	49.8	40%	0.399	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-31	-176.3	73.9	0	0	0	0	113.2	D1874 T1878 V1882	D1874-S1876 VanDerWaalsContact C-N 3.25Å; D1874-S1876 VanDerWaalsContact CG-OG 3.24Å; D1874-S1876 PolarHBondContact O-N 3Å; D1874-S1876 WeakPolarHBondContact OD1-CB 3.47Å; D1874-S1876 PolarHBondContact OD1-N 3.48Å; D1874-S1876 PolarHBondContact OD1-OG 2.84Å; D1874-S1876 PolarHBondContact OD2-OG 2.83Å; S1876-T1878 PolarHBondContact O-N 3.45Å; S1876-V1882 WeakPolarHBondContact CA-O 3.46Å; S1876-V1882 WeakPolarHBondContact CB-O 3.47Å
1877	K	65.8	Low	69.5	Low	125 Å²	125	46.8 Å²	46.8	54%	0.543	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-16.2	169.9	-63.4	175.6	-164	156.2	0	113.3	D1874 P1875	D1874-K1877 HydrophobicContact CB-CB 4.12Å; D1874-K1877 HydrophobicContact CB-CD 3.65Å; D1874-K1877 HydrophobicContact CB-CG 3.77Å; D1874-K1877 VanDerWaalsContact OD2-CE 3.23Å; D1874-K1877 WeakPolarHBondContact OD2-CE 3.46Å; D1874-K1877 IonicContact OD2-NZ 2.8Å; P1875-K1877 PolarHBondContact O-N 3.18Å
1878	T	63.8	Low	69.9	Low	30 Å²	30	43.9 Å²	43.9	18%	0.184	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-36.3	-164.9	-48.2	0	0	0	0	112.5	D1874 P1875 S1876 L1887 L1936 P1937	D1874-T1878 PolarHBondContact O-OG1 3.43Å; P1875-T1878 CarbonylContact O-C 3.17Å; P1875-T1878 WeakPolarHBondContact O-CA 3.31Å; P1875-T1878 PolarHBondContact O-N 3.09Å; S1876-T1878 PolarHBondContact O-N 3.45Å; T1878-L1887 HydrophobicContact CG2-CD2 3.63Å; T1878-L1936 HydrophobicContact CG2-CD1 3.72Å; T1878-L1936 HydrophobicContact CG2-CD2 3.76Å; T1878-L1936 HydrophobicContact CG2-CG 4.29Å; T1878-P1937 WeakPolarHBondContact O-CD 3.06Å
1879	Y	68.8	Low	70.3	Confident	17 Å²	17	41.4 Å²	41.4	7%	0.067	25%	0.25	C	C	.	.			trans	-132.1	106.2	176.7	-63.5	-90.6	0	0	0	108.5	I1816 P1875 T1881 V1882 L1887 V1930 L1936	I1816-Y1879 HydrophobicContact CD1-CD2 3.76Å; I1816-Y1879 HydrophobicContact CD1-CE2 3.91Å; I1816-Y1879 HydrophobicContact CD1-CG 4.43Å; P1875-Y1879 PolarHBondContact O-N 2.72Å; Y1879-T1881 PolarHBondContact O-N 3.21Å; Y1879-V1882 PolarHBondContact O-N 3.3Å; Y1879-L1887 HydrophobicContact CE2-CD1 4.48Å; Y1879-V1930 HydrophobicContact CD1-CG1 3.78Å; Y1879-V1930 HydrophobicContact CE1-CG1 3.54Å; Y1879-V1930 HydrophobicContact CE2-CG1 4.45Å; Y1879-V1930 HydrophobicContact CG-CG1 4.31Å; Y1879-L1936 HydrophobicContact CD1-CD2 4.34Å; Y1879-L1936 HydrophobicContact CD2-CD2 4.38Å; Y1879-L1936 HydrophobicContact CE1-CD2 3.64Å; Y1879-L1936 HydrophobicContact CE2-CD2 3.68Å; Y1879-L1936 WeakPolarHBondContact OH-CD2 3.35Å
1880	S	59.5	Low	70.5	Confident	110 Å²	110	40.7 Å²	40.7	77%	0.769	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-1.7	-176	60.5	0	0	0	0	115.2
1881	T	54.8	Low	71.2	Confident	121 Å²	121	36.1 Å²	36.1	74%	0.742	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-10.2	175.1	51.5	0	0	0	0	113.3	Y1879	Y1879-T1881 PolarHBondContact O-N 3.21Å
1882	V	63.2	Low	71.6	Confident	9 Å²	9	34.8 Å²	34.8	6%	0.055	22%	0.215	C	C	.	.			trans	-106.9	105.8	-174.2	-173.5	0	0	0	0	109.8	I1816 P1875 S1876 Y1879 S1884 V1930	I1816-V1882 HydrophobicContact CD1-CG1 4.48Å; I1816-V1882 HydrophobicContact CD1-CG2 4.03Å; I1816-V1882 HydrophobicContact CG2-CG1 4.31Å; P1875-V1882 HydrophobicContact CB-CB 4.23Å; P1875-V1882 HydrophobicContact CB-CG1 3.81Å; P1875-V1882 HydrophobicContact CG-CG1 4.06Å; S1876-V1882 WeakPolarHBondContact CA-O 3.46Å; S1876-V1882 WeakPolarHBondContact CB-O 3.47Å; Y1879-V1882 PolarHBondContact O-N 3.3Å; V1882-S1884 PolarHBondContact O-N 3.42Å; V1882-V1930 HydrophobicContact CG2-CG2 3.45Å; V1882-V1930 VanDerWaalsContact CG2-CG2 3.45Å
1883	G	54.9	Low	71	Confident	75 Å²	75	35.5 Å²	35.5	77%	0.773	22%	0.219	S	C	*	.			trans	-73.9	-20.4	-177.8	0	0	0	0	0	115.1
1884	S	62.1	Low	70.2	Confident	47 Å²	47	31.6 Å²	31.6	33%	0.329	20%	0.203	S	C	.	.	S	Bend	trans	-165.5	143.8	-174.4	53.9	0	0	0	0	112.5	V1882	V1882-S1884 PolarHBondContact O-N 3.42Å
1885	G	77.1	Confident	69.3	Low	0 Å²	0	32.3 Å²	32.3	0%	0	21%	0.209	C	C	.	.			trans	158.9	-168.8	172.4	0	0	0	0	0	110.8	V1817 L1825 W1827 P1875	V1817-G1885 CarbonylContact O-C 3.55Å; V1817-G1885 WeakPolarHBondContact O-CA 3.43Å; L1825-G1885 VanDerWaalsContact O-CA 3.27Å; L1825-G1885 WeakPolarHBondContact O-CA 3.05Å; L1825-G1885 PolarHBondContact O-N 2.92Å; W1827-G1885 PolarHBondContact N-O 2.84Å; P1875-G1885 VanDerWaalsContact CD-O 3.23Å; P1875-G1885 WeakPolarHBondContact CD-O 3.44Å; P1875-G1885 WeakPolarHBondContact CG-O 3.18Å
1886	L	86.4	Confident	68.5	Low	0 Å²	0	35 Å²	35	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.1	166.4	-61.5	179.8	0	0	0	110	I1816 V1817 L1825 W1827 Y1831 M1842 I1872 F1888	I1816-L1886 WeakPolarHBondContact CA-O 3.19Å; V1817-L1886 PolarHBondContact N-O 3.47Å; V1817-L1886 PolarHBondContact O-N 2.84Å; L1825-L1886 HydrophobicContact CB-CG 4.2Å; L1825-L1886 HydrophobicContact CD1-CD1 4.08Å; L1825-L1886 HydrophobicContact CD1-CG 4.31Å; W1827-L1886 HydrophobicContact CB-CD2 4.26Å; Y1831-L1886 HydrophobicContact CD2-CD2 3.65Å; Y1831-L1886 HydrophobicContact CE1-CD1 4.07Å; Y1831-L1886 HydrophobicContact CE2-CD1 4.05Å; Y1831-L1886 HydrophobicContact CE2-CD2 3.44Å; Y1831-L1886 VanDerWaalsContact CE2-CD2 3.44Å; Y1831-L1886 HydrophobicContact CE2-CG 4.41Å; Y1831-L1886 HydrophobicContact CG-CD2 4.35Å; M1842-L1886 HydrophobicContact CE-CD1 4.02Å; M1842-L1886 HydrophobicContact CG-CD1 3.93Å; M1842-L1886 HydrophobicContact SD-CD1 4.09Å; I1872-L1886 HydrophobicContact CG2-CB 4.14Å; I1872-L1886 HydrophobicContact CG2-CD1 4.47Å; I1872-L1886 HydrophobicContact CG2-CD2 4.32Å; L1886-F1888 HydrophobicContact CB-CD2 4.4Å; L1886-F1888 HydrophobicContact CB-CE2 3.76Å; L1886-F1888 HydrophobicContact CB-CZ 4.43Å; L1886-F1888 HydrophobicContact CD1-CZ 4.49Å
1887	L	83.2	Confident	68	Low	3 Å²	3	35.6 Å²	35.6	2%	0.016	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.2	177.4	171.5	62.6	0	0	0	110.6	P1814 I1816 I1872 K1873 P1875 T1878 Y1879	P1814-L1887 HydrophobicContact CB-CD1 3.63Å; I1816-L1887 HydrophobicContact CG1-CD1 3.95Å; I1872-L1887 CarbonylContact C-O 3.54Å; I1872-L1887 WeakPolarHBondContact CA-O 3.31Å; K1873-L1887 HydrophobicContact CB-CB 4.28Å; K1873-L1887 HydrophobicContact CB-CD2 4.2Å; K1873-L1887 HydrophobicContact CB-CG 4.39Å; K1873-L1887 PolarHBondContact N-O 3.16Å; K1873-L1887 WeakPolarHBondContact O-CB 3.42Å; K1873-L1887 PolarHBondContact O-N 2.78Å; P1875-L1887 HydrophobicContact CB-CB 4.33Å; T1878-L1887 HydrophobicContact CG2-CD2 3.63Å; Y1879-L1887 HydrophobicContact CE2-CD1 4.48Å
1888	F	85.3	Confident	67.4	Low	0 Å²	0	32.6 Å²	32.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	112.9	174.4	-63.9	-103.8	0	0	0	109.8	P1814 I1815 V1817 M1842 Y1846 V1869 I1872 L1886 T1890	P1814-F1888 WeakPolarHBondContact CA-O 3.06Å; I1815-F1888 PolarHBondContact N-O 3.29Å; I1815-F1888 PolarHBondContact O-N 2.79Å; V1817-F1888 HydrophobicContact CB-CE2 3.97Å; V1817-F1888 HydrophobicContact CG2-CD2 3.77Å; V1817-F1888 HydrophobicContact CG2-CE2 3.48Å; V1817-F1888 VanDerWaalsContact CG2-CE2 3.48Å; V1817-F1888 HydrophobicContact CG2-CZ 4.47Å; M1842-F1888 HydrophobicContact CG-CE1 4.22Å; M1842-F1888 HydrophobicContact CG-CZ 3.75Å; M1842-F1888 HydrophobicContact SD-CZ 4.05Å; Y1846-F1888 VanDerWaalsContact CB-CE1 3.41Å; Y1846-F1888 HydrophobicContact CD1-CB 4.42Å; Y1846-F1888 AromaticContact CD1-CD1 3.56Å; Y1846-F1888 HydrophobicContact CD1-CD1 3.56Å; Y1846-F1888 HydrophobicContact CD1-CE1 4.01Å; Y1846-F1888 HydrophobicContact CD1-CG 4.1Å; Y1846-F1888 HydrophobicContact CD2-CB 4.4Å; Y1846-F1888 AromaticContact CD2-CD1 3.7Å; Y1846-F1888 HydrophobicContact CD2-CD1 3.7Å; Y1846-F1888 AromaticContact CD2-CD2 3.8Å; Y1846-F1888 HydrophobicContact CD2-CD2 3.8Å; Y1846-F1888 AromaticContact CD2-CE1 3.79Å; Y1846-F1888 HydrophobicContact CD2-CE1 3.79Å; Y1846-F1888 AromaticContact CD2-CE2 3.89Å; Y1846-F1888 HydrophobicContact CD2-CE2 3.89Å; Y1846-F1888 AromaticContact CD2-CG 3.71Å; Y1846-F1888 HydrophobicContact CD2-CG 3.71Å; Y1846-F1888 AromaticContact CD2-CZ 3.88Å; Y1846-F1888 HydrophobicContact CD2-CZ 3.88Å; Y1846-F1888 HydrophobicContact CE1-CB 3.95Å; Y1846-F1888 AromaticContact CE1-CD1 3.98Å; Y1846-F1888 HydrophobicContact CE1-CD1 3.98Å; Y1846-F1888 HydrophobicContact CE1-CG 4.1Å; Y1846-F1888 HydrophobicContact CE2-CB 3.94Å; Y1846-F1888 HydrophobicContact CE2-CD1 4.1Å; Y1846-F1888 AromaticContact CE2-CD2 3.87Å; Y1846-F1888 HydrophobicContact CE2-CD2 3.87Å; Y1846-F1888 HydrophobicContact CE2-CE2 4.39Å; Y1846-F1888 AromaticContact CE2-CG 3.71Å; Y1846-F1888 HydrophobicContact CE2-CG 3.71Å; Y1846-F1888 AromaticContact CG-CD1 3.41Å; Y1846-F1888 HydrophobicContact CG-CD1 3.41Å; Y1846-F1888 VanDerWaalsContact CG-CD1 3.41Å; Y1846-F1888 HydrophobicContact CG-CD2 4.37Å; Y1846-F1888 AromaticContact CG-CE1 3.44Å; Y1846-F1888 HydrophobicContact CG-CE1 3.44Å; Y1846-F1888 VanDerWaalsContact CG-CE1 3.44Å; Y1846-F1888 HydrophobicContact CG-CE2 4.4Å; Y1846-F1888 AromaticContact CG-CG 3.91Å; Y1846-F1888 HydrophobicContact CG-CG 3.91Å; Y1846-F1888 AromaticContact CG-CZ 3.96Å; Y1846-F1888 HydrophobicContact CG-CZ 3.96Å; Y1846-F1888 AromaticContact CZ-CG 3.92Å; V1869-F1888 HydrophobicContact CG1-CB 4.49Å; V1869-F1888 HydrophobicContact CG1-CD1 4.2Å; I1872-F1888 HydrophobicContact CD1-CD1 4.1Å; I1872-F1888 HydrophobicContact CD1-CE1 3.57Å; I1872-F1888 HydrophobicContact CD1-CZ 4.24Å; I1872-F1888 HydrophobicContact CG1-CD1 3.83Å; I1872-F1888 HydrophobicContact CG1-CE1 3.81Å; L1886-F1888 HydrophobicContact CB-CD2 4.4Å; L1886-F1888 HydrophobicContact CB-CE2 3.76Å; L1886-F1888 HydrophobicContact CB-CZ 4.43Å; L1886-F1888 HydrophobicContact CD1-CZ 4.49Å; F1888-T1890 PolarHBondContact O-N 2.91Å
1889	N	77	Confident	67.5	Low	24 Å²	24	32.5 Å²	32.5	13%	0.128	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	101.1	167.5	-81.4	53.5	0	0	0	108.4	E1812 V1869 E1870 S1871	E1812-N1889 PolarHBondContact OE2-ND2 2.89Å; V1869-N1889 WeakPolarHBondContact CA-O 3.14Å; E1870-N1889 PolarHBondContact N-O 3.16Å; E1870-N1889 VanDerWaalsContact N-O 3.12Å; S1871-N1889 PolarHBondContact O-N 3.37Å
1890	T	80.5	Confident	67.4	Low	0 Å²	0	36.6 Å²	36.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	107	-176.3	-50.1	0	0	0	0	110.2	V1813 Y1846 F1850 F1867 E1868 V1869 F1888 V1892	V1813-T1890 PolarHBondContact N-O 3.03Å; V1813-T1890 WeakPolarHBondContact O-CB 3.35Å; V1813-T1890 PolarHBondContact O-N 2.82Å; Y1846-T1890 HydrophobicContact CE1-CG2 4.38Å; Y1846-T1890 WeakPolarHBondContact CE1-OG1 3.26Å; Y1846-T1890 PolarHBondContact OH-OG1 3.19Å; F1850-T1890 HydrophobicContact CD1-CG2 4.35Å; F1850-T1890 HydrophobicContact CD2-CG2 4.46Å; F1850-T1890 HydrophobicContact CE1-CG2 3.98Å; F1850-T1890 HydrophobicContact CE2-CG2 4.1Å; F1850-T1890 HydrophobicContact CZ-CG2 3.85Å; F1867-T1890 HydrophobicContact CB-CG2 4.34Å; E1868-T1890 CarbonylContact O-C 2.76Å; E1868-T1890 WeakPolarHBondContact O-CA 3.35Å; V1869-T1890 HydrophobicContact CG2-CG2 4.22Å; F1888-T1890 PolarHBondContact O-N 2.91Å; T1890-V1892 PolarHBondContact O-N 2.6Å
1891	T	73.8	Confident	67.6	Low	4 Å²	4	35 Å²	35	3%	0.025	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.1	178.1	-58.9	0	0	0	0	109.4	K1810 F1867 E1868 E1870	K1810-T1891 HydrophobicContact CB-CG2 4.22Å; K1810-T1891 HydrophobicContact CD-CG2 3.66Å; K1810-T1891 HydrophobicContact CG-CG2 4.5Å; F1867-T1891 WeakPolarHBondContact CA-O 2.91Å; E1868-T1891 HydrophobicContact CG-CG2 4.47Å; E1868-T1891 PolarHBondContact N-O 3.1Å; E1868-T1891 PolarHBondContact O-N 2.93Å; E1870-T1891 PolarHBondContact OE1-OG1 2.76Å
1892	V	75.6	Confident	68.2	Low	0 Å²	0	34.9 Å²	34.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	132.4	177.3	-174.5	0	0	0	0	109.4	K1810 F1811 V1813 F1850 V1865 T1890 T1894 F1904	K1810-V1892 CarbonylContact C-O 2.83Å; K1810-V1892 WeakPolarHBondContact CA-O 3.43Å; F1811-V1892 HydrophobicContact CD1-CB 4.35Å; F1811-V1892 HydrophobicContact CD2-CB 4.39Å; F1811-V1892 HydrophobicContact CE1-CB 3.98Å; F1811-V1892 HydrophobicContact CE1-CG1 3.91Å; F1811-V1892 HydrophobicContact CE2-CB 4.03Å; F1811-V1892 HydrophobicContact CE2-CG1 4.37Å; F1811-V1892 HydrophobicContact CE2-CG2 4.47Å; F1811-V1892 HydrophobicContact CZ-CB 3.82Å; F1811-V1892 HydrophobicContact CZ-CG1 3.72Å; F1811-V1892 PolarHBondContact N-O 3.26Å; F1811-V1892 PolarHBondContact O-N 2.84Å; V1813-V1892 HydrophobicContact CG2-CG2 4.11Å; F1850-V1892 HydrophobicContact CE1-CG2 4.49Å; F1850-V1892 HydrophobicContact CZ-CG2 4.15Å; V1865-V1892 HydrophobicContact CG1-CG1 3.77Å; T1890-V1892 PolarHBondContact O-N 2.6Å; V1892-T1894 HydrophobicContact CG1-CG2 4.16Å; V1892-F1904 HydrophobicContact CG1-CE1 4.19Å; V1892-F1904 HydrophobicContact CG1-CZ 4.36Å; V1892-F1904 HydrophobicContact CG2-CE1 4.31Å
1893	N	66.5	Low	68.5	Low	17 Å²	17	40.2 Å²	40.2	9%	0.091	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	115.1	-174.1	-64.1	-45.5	0	0	0	109.7	V1808 E1809 K1810 S1866 E1868	V1808-N1893 HydrophobicContact CG1-CB 4.02Å; E1809-N1893 WeakPolarHBondContact O-CA 3.46Å; K1810-N1893 WeakPolarHBondContact CD-OD1 3.1Å; K1810-N1893 WeakPolarHBondContact CE-OD1 2.98Å; K1810-N1893 WeakPolarHBondContact CG-OD1 3.47Å; S1866-N1893 PolarHBondContact N-O 3.17Å; S1866-N1893 PolarHBondContact O-N 2.68Å; S1866-N1893 WeakPolarHBondContact OG-CB 3.25Å; E1868-N1893 PolarHBondContact OE1-ND2 3.29Å
1894	T	62.4	Low	69.7	Low	4 Å²	4	37 Å²	37	3%	0.025	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	162.3	-177.4	60.7	0	0	0	0	112.3	V1808 E1809 F1811 V1865 V1892 I1899	V1808-T1894 WeakPolarHBondContact CA-O 3.42Å; V1808-T1894 VanDerWaalsContact CG1-O 3.26Å; V1808-T1894 WeakPolarHBondContact CG1-O 3.43Å; E1809-T1894 PolarHBondContact N-O 3.14Å; E1809-T1894 PolarHBondContact O-N 3.19Å; F1811-T1894 HydrophobicContact CE1-CG2 3.94Å; V1865-T1894 HydrophobicContact CG1-CG2 4.36Å; V1865-T1894 HydrophobicContact CG2-CG2 4.27Å; V1892-T1894 HydrophobicContact CG1-CG2 4.16Å; T1894-I1899 HydrophobicContact CG2-CB 4.47Å; T1894-I1899 HydrophobicContact CG2-CD1 3.75Å
1895	S	57.1	Low	70.4	Confident	35 Å²	35	35.1 Å²	35.1	25%	0.245	20%	0.204	C	C	.	.			trans	-66	137.7	167	25.9	0	0	0	0	111.2	G1897 S1898	S1895-G1897 PolarHBondContact O-N 2.87Å; S1895-S1898 PolarHBondContact O-N 3.42Å; S1895-S1898 VanDerWaalsContact O-N 3.07Å; S1895-S1898 PolarHBondContact O-OG 3.47Å; S1895-S1898 VanDerWaalsContact OG-CB 3.27Å; S1895-S1898 WeakPolarHBondContact OG-CB 3.37Å; S1895-S1898 PolarHBondContact OG-OG 2.84Å
1896	P	54.3	Low	70.4	Confident	56 Å²	56	39.6 Å²	39.6	36%	0.364	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	131.4	-178.3	-25.1	30.1	0	0	0	112.6	Q1807 E1809 S1898	Q1807-P1896 HydrophobicContact CB-CG 3.63Å; Q1807-P1896 WeakPolarHBondContact O-CD 3.28Å; Q1807-P1896 WeakPolarHBondContact O-CG 3.43Å; E1809-P1896 HydrophobicContact CG-CB 4.01Å; E1809-P1896 HydrophobicContact CG-CG 4.15Å; E1809-P1896 VanDerWaalsContact OE1-CA 3.24Å; E1809-P1896 WeakPolarHBondContact OE1-CA 3.45Å; P1896-S1898 PolarHBondContact O-N 3.08Å; P1896-S1898 VanDerWaalsContact O-N 3.07Å
1897	G	55.8	Low	70	Confident	71 Å²	71	41.3 Å²	41.3	73%	0.732	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	6.5	-177.7	0	0	0	0	0	116.8	E1809 S1895	E1809-G1897 PolarHBondContact OE1-N 2.94Å; E1809-G1897 VanDerWaalsContact OE1-N 3.14Å; S1895-G1897 PolarHBondContact O-N 2.87Å
1898	S	54.5	Low	70	Confident	61 Å²	61	41.2 Å²	41.2	43%	0.427	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-23	178.7	74.5	0	0	0	0	113.6	S1895 P1896	S1895-S1898 PolarHBondContact O-N 3.42Å; S1895-S1898 VanDerWaalsContact O-N 3.07Å; S1895-S1898 PolarHBondContact O-OG 3.47Å; S1895-S1898 VanDerWaalsContact OG-CB 3.27Å; S1895-S1898 WeakPolarHBondContact OG-CB 3.37Å; S1895-S1898 PolarHBondContact OG-OG 2.84Å; P1896-S1898 PolarHBondContact O-N 3.08Å; P1896-S1898 VanDerWaalsContact O-N 3.07Å
1899	I	64.5	Low	69.8	Low	28 Å²	28	42 Å²	42	14%	0.144	24%	0.237	C	C	.	.	S	Bend	trans	-141.8	127.1	-178.3	-67	161	0	0	0	107.1	L1860 V1865 T1894 F1904	L1860-I1899 HydrophobicContact CD1-CD1 3.64Å; L1860-I1899 HydrophobicContact CD1-CG1 4.11Å; V1865-I1899 HydrophobicContact CG2-CD1 3.41Å; V1865-I1899 VanDerWaalsContact CG2-CD1 3.41Å; T1894-I1899 HydrophobicContact CG2-CB 4.47Å; T1894-I1899 HydrophobicContact CG2-CD1 3.75Å; I1899-F1904 HydrophobicContact CG2-CB 3.69Å; I1899-F1904 HydrophobicContact CG2-CD2 4.04Å; I1899-F1904 HydrophobicContact CG2-CG 4.12Å
1900	D	67.4	Low	69.8	Low	104 Å²	104	47.1 Å²	47.1	56%	0.556	26%	0.26	S	S	*	.			trans	-72.8	128.5	170.3	-179.8	-56.7	0	0	0	109.6	E1902 Q1903 F1904	D1900-E1902 PolarHBondContact OD1-N 3.42Å; D1900-Q1903 HydrophobicContact CB-CB 3.7Å; D1900-Q1903 PolarHBondContact OD1-N 3.03Å; D1900-F1904 WeakPolarHBondContact O-CB 3.32Å; D1900-F1904 PolarHBondContact O-N 2.86Å
1901	K	64.1	Low	69.5	Low	75 Å²	75	50.6 Å²	50.6	33%	0.326	28%	0.276	S	S	.	.	H	α-helix	trans	-68.4	-39	-173.3	-61.1	178.4	-179.2	173.8	0	112.7	E1809 F1811 C1905	E1809-K1901 WeakPolarHBondContact OE2-CE 2.99Å; E1809-K1901 IonicContact OE2-NZ 3.54Å; E1809-K1901 PolarHBondContact OE2-NZ 3.29Å; F1811-K1901 HydrophobicContact CB-CD 3.83Å; F1811-K1901 HydrophobicContact CD1-CD 3.85Å; F1811-K1901 HydrophobicContact CD1-CG 3.78Å; F1811-K1901 HydrophobicContact CD2-CB 4.19Å; F1811-K1901 HydrophobicContact CD2-CD 4.39Å; F1811-K1901 HydrophobicContact CD2-CG 4.2Å; F1811-K1901 HydrophobicContact CE1-CD 4.48Å; F1811-K1901 HydrophobicContact CE1-CG 3.91Å; F1811-K1901 HydrophobicContact CE2-CB 4.2Å; F1811-K1901 HydrophobicContact CE2-CG 4.31Å; F1811-K1901 HydrophobicContact CG-CB 4.39Å; F1811-K1901 HydrophobicContact CG-CD 3.79Å; F1811-K1901 HydrophobicContact CG-CG 3.92Å; F1811-K1901 HydrophobicContact CZ-CB 4.41Å; F1811-K1901 HydrophobicContact CZ-CG 4.17Å; K1901-C1905 WeakPolarHBondContact O-CB 3.47Å; K1901-C1905 PolarHBondContact O-N 3.31Å
1902	E	67.2	Low	69.8	Low	119 Å²	119	50.5 Å²	50.5	56%	0.556	28%	0.276	S	S	*	.	H	α-helix	trans	-77.8	-39.9	-177.9	-164	-178.1	151	0	0	109.9	D1900 C1905 K1906	D1900-E1902 PolarHBondContact OD1-N 3.42Å; E1902-C1905 PolarHBondContact O-N 2.88Å; E1902-K1906 HydrophobicContact CG-CD 4.33Å; E1902-K1906 WeakPolarHBondContact O-CB 3.04Å; E1902-K1906 VanDerWaalsContact O-CG 3.25Å; E1902-K1906 WeakPolarHBondContact O-CG 3.27Å; E1902-K1906 PolarHBondContact O-N 3.38Å; E1902-K1906 VanDerWaalsContact OE1-CE 3.27Å; E1902-K1906 WeakPolarHBondContact OE1-CE 3.04Å; E1902-K1906 IonicContact OE1-NZ 3.54Å; E1902-K1906 PolarHBondContact OE1-NZ 2.89Å
1903	Q	69.8	Low	69.9	Low	121 Å²	121	56.2 Å²	56.2	57%	0.565	30%	0.301	S	S	*	.	H	α-helix	trans	-58.9	-47.9	170.4	-164.7	76.6	-4.2	0	0	111	D1900 K1906 T1907	D1900-Q1903 HydrophobicContact CB-CB 3.7Å; D1900-Q1903 PolarHBondContact OD1-N 3.03Å; Q1903-K1906 PolarHBondContact O-N 3.37Å; Q1903-T1907 WeakPolarHBondContact O-CB 3.02Å; Q1903-T1907 PolarHBondContact O-N 2.95Å; Q1903-T1907 PolarHBondContact O-OG1 3.49Å; Q1903-T1907 VanDerWaalsContact O-OG1 3.08Å
1904	F	79.5	Confident	70.2	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.035	33%	0.327	C	S	.	.	H	α-helix	trans	-61.4	-46.9	177.6	177.3	-93.7	0	0	0	112.3	F1811 V1854 I1857 L1860 V1892 I1899 D1900 K1906 T1907 L1908	F1811-F1904 AromaticContact CE2-CD1 3.92Å; F1811-F1904 HydrophobicContact CE2-CD1 3.92Å; F1811-F1904 HydrophobicContact CE2-CE1 4.39Å; F1811-F1904 AromaticContact CZ-CD1 3.84Å; F1811-F1904 HydrophobicContact CZ-CD1 3.84Å; F1811-F1904 HydrophobicContact CZ-CE1 4.29Å; F1811-F1904 HydrophobicContact CZ-CG 4.43Å; V1854-F1904 HydrophobicContact CG2-CZ 4.21Å; I1857-F1904 HydrophobicContact CD1-CD2 4.41Å; I1857-F1904 HydrophobicContact CD1-CE2 3.99Å; L1860-F1904 HydrophobicContact CD2-CE2 3.98Å; V1892-F1904 HydrophobicContact CG1-CE1 4.19Å; V1892-F1904 HydrophobicContact CG1-CZ 4.36Å; V1892-F1904 HydrophobicContact CG2-CE1 4.31Å; I1899-F1904 HydrophobicContact CG2-CB 3.69Å; I1899-F1904 HydrophobicContact CG2-CD2 4.04Å; I1899-F1904 HydrophobicContact CG2-CG 4.12Å; D1900-F1904 WeakPolarHBondContact O-CB 3.32Å; D1900-F1904 PolarHBondContact O-N 2.86Å; F1904-K1906 VanDerWaalsContact C-N 3.35Å; F1904-K1906 PolarHBondContact O-N 3.49Å; F1904-T1907 PolarHBondContact O-N 2.93Å; F1904-L1908 HydrophobicContact CE1-CD2 4.3Å; F1904-L1908 VanDerWaalsContact O-CB 3.3Å; F1904-L1908 WeakPolarHBondContact O-CB 3.02Å; F1904-L1908 PolarHBondContact O-N 3.24Å
1905	C	76.4	Confident	70.9	Confident	8 Å²	8	60.8 Å²	60.8	5%	0.054	34%	0.341	C	S	.	.	H	α-helix	trans	-57.7	-47.9	176.3	-165	0	0	0	0	110.8	K1901 E1902 L1908 F1909 C1933	K1901-C1905 WeakPolarHBondContact O-CB 3.47Å; K1901-C1905 PolarHBondContact O-N 3.31Å; E1902-C1905 PolarHBondContact O-N 2.88Å; C1905-L1908 PolarHBondContact O-N 2.8Å; C1905-F1909 WeakPolarHBondContact O-CD2 3.15Å; C1905-F1909 PolarHBondContact O-N 2.85Å; C1905-C1933 HydrophobicContact CB-CB 4.14Å; C1905-C1933 WeakPolarHBondContact CB-SG 3.24Å; C1905-C1933 WeakPolarHBondContact SG-CB 3.07Å; C1905-C1933 CovalentContact SG-SG 2.05Å; C1905-C1933 PolarHBondContact SG-SG 3.44Å
1906	K	77	Confident	71.7	Confident	94 Å²	94	63.5 Å²	63.5	41%	0.409	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-46.5	177.6	-73	169.5	-177.2	169.8	0	113	E1902 Q1903 F1904 F1909 Q1910	E1902-K1906 HydrophobicContact CG-CD 4.33Å; E1902-K1906 WeakPolarHBondContact O-CB 3.04Å; E1902-K1906 VanDerWaalsContact O-CG 3.25Å; E1902-K1906 WeakPolarHBondContact O-CG 3.27Å; E1902-K1906 PolarHBondContact O-N 3.38Å; E1902-K1906 VanDerWaalsContact OE1-CE 3.27Å; E1902-K1906 WeakPolarHBondContact OE1-CE 3.04Å; E1902-K1906 IonicContact OE1-NZ 3.54Å; E1902-K1906 PolarHBondContact OE1-NZ 2.89Å; Q1903-K1906 PolarHBondContact O-N 3.37Å; F1904-K1906 VanDerWaalsContact C-N 3.35Å; F1904-K1906 PolarHBondContact O-N 3.49Å; K1906-F1909 PolarHBondContact O-N 2.92Å; K1906-Q1910 WeakPolarHBondContact O-CB 3.47Å; K1906-Q1910 VanDerWaalsContact O-CG 3.26Å; K1906-Q1910 WeakPolarHBondContact O-CG 3.08Å; K1906-Q1910 PolarHBondContact O-N 2.83Å
1907	T	78.7	Confident	72.9	Confident	36 Å²	36	60.9 Å²	60.9	22%	0.221	34%	0.343	C	S	.	.	H	α-helix	trans	-66.4	-39.9	180	-61	0	0	0	0	111.9	I1857 Q1903 F1904 Q1910 Q1911	I1857-T1907 HydrophobicContact CG2-CG2 3.92Å; Q1903-T1907 WeakPolarHBondContact O-CB 3.02Å; Q1903-T1907 PolarHBondContact O-N 2.95Å; Q1903-T1907 PolarHBondContact O-OG1 3.49Å; Q1903-T1907 VanDerWaalsContact O-OG1 3.08Å; F1904-T1907 PolarHBondContact O-N 2.93Å; T1907-Q1910 PolarHBondContact O-N 3.17Å; T1907-Q1911 WeakPolarHBondContact O-CG 3.32Å; T1907-Q1911 PolarHBondContact O-N 2.85Å
1908	L	82.7	Confident	73.9	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.2	-48.4	174.4	179.6	63.6	0	0	0	111.3	F1850 A1853 V1854 I1857 F1904 C1905 Q1910 Q1911 I1912	F1850-L1908 HydrophobicContact CE2-CD2 3.78Å; F1850-L1908 HydrophobicContact CZ-CD2 4.04Å; A1853-L1908 HydrophobicContact CB-CD1 3.94Å; V1854-L1908 HydrophobicContact CG2-CD1 4.5Å; I1857-L1908 HydrophobicContact CD1-CB 4.31Å; I1857-L1908 HydrophobicContact CD1-CD1 4.25Å; F1904-L1908 HydrophobicContact CE1-CD2 4.3Å; F1904-L1908 VanDerWaalsContact O-CB 3.3Å; F1904-L1908 WeakPolarHBondContact O-CB 3.02Å; F1904-L1908 PolarHBondContact O-N 3.24Å; C1905-L1908 PolarHBondContact O-N 2.8Å; L1908-Q1910 VanDerWaalsContact C-N 3.32Å; L1908-Q1910 PolarHBondContact O-N 3.07Å; L1908-Q1911 PolarHBondContact O-N 3.16Å; L1908-I1912 HydrophobicContact CD1-CD1 4.27Å; L1908-I1912 HydrophobicContact CG-CD1 4.06Å; L1908-I1912 WeakPolarHBondContact O-CG1 3.2Å; L1908-I1912 PolarHBondContact O-N 3.27Å
1909	F	80.4	Confident	75	Confident	17 Å²	17	60.1 Å²	60.1	8%	0.075	31%	0.312	C	S	.	.	H	α-helix	trans	-69.2	-26.2	177.1	-87.8	-81.5	0	0	0	113.6	V1813 I1815 C1905 K1906 K1913 V1926 S1932	V1813-F1909 HydrophobicContact CG1-CE2 4.29Å; I1815-F1909 HydrophobicContact CD1-CZ 4.44Å; I1815-F1909 HydrophobicContact CG1-CZ 4.19Å; C1905-F1909 WeakPolarHBondContact O-CD2 3.15Å; C1905-F1909 PolarHBondContact O-N 2.85Å; K1906-F1909 PolarHBondContact O-N 2.92Å; F1909-K1913 VanDerWaalsContact O-CB 3.3Å; F1909-K1913 WeakPolarHBondContact O-CB 3.06Å; F1909-K1913 VanDerWaalsContact O-CG 3.3Å; F1909-K1913 WeakPolarHBondContact O-CG 3.11Å; F1909-K1913 PolarHBondContact O-N 2.75Å; F1909-V1926 HydrophobicContact CE1-CG1 3.84Å; F1909-V1926 HydrophobicContact CZ-CG1 4.47Å; F1909-S1932 VanDerWaalsContact CZ-CB 3.43Å
1910	Q	77	Confident	75.2	Confident	131 Å²	131	60 Å²	60	61%	0.612	32%	0.318	S	S	*	.	H	α-helix	trans	-66.2	-43.5	168.7	-80.1	173.9	-9.5	0	0	111.8	K1906 T1907 L1908 K1913 A1914	K1906-Q1910 WeakPolarHBondContact O-CB 3.47Å; K1906-Q1910 VanDerWaalsContact O-CG 3.26Å; K1906-Q1910 WeakPolarHBondContact O-CG 3.08Å; K1906-Q1910 PolarHBondContact O-N 2.83Å; T1907-Q1910 PolarHBondContact O-N 3.17Å; L1908-Q1910 VanDerWaalsContact C-N 3.32Å; L1908-Q1910 PolarHBondContact O-N 3.07Å; Q1910-K1913 PolarHBondContact O-N 2.83Å; Q1910-A1914 WeakPolarHBondContact O-CB 3.08Å; Q1910-A1914 PolarHBondContact O-N 2.96Å
1911	Q	75.7	Confident	75.2	Confident	73 Å²	73	60.3 Å²	60.3	34%	0.341	33%	0.328	S	S	.	.	H	α-helix	trans	-64	-42.7	174.8	-69.6	-65.2	-15.3	0	0	111.7	T1907 L1908 K1913 A1914 A1915	T1907-Q1911 WeakPolarHBondContact O-CG 3.32Å; T1907-Q1911 PolarHBondContact O-N 2.85Å; L1908-Q1911 PolarHBondContact O-N 3.16Å; Q1911-K1913 PolarHBondContact O-N 3.1Å; Q1911-A1914 PolarHBondContact O-N 2.9Å; Q1911-A1915 WeakPolarHBondContact O-CB 3.12Å; Q1911-A1915 PolarHBondContact O-N 3.21Å
1912	I	80.2	Confident	75.6	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-42.2	175.3	-67.1	166	0	0	0	111.1	L1908 A1915 S1916 G1917 L1919 V1926 T1928	L1908-I1912 HydrophobicContact CD1-CD1 4.27Å; L1908-I1912 HydrophobicContact CG-CD1 4.06Å; L1908-I1912 WeakPolarHBondContact O-CG1 3.2Å; L1908-I1912 PolarHBondContact O-N 3.27Å; I1912-A1915 CarbonylContact O-C 3.1Å; I1912-A1915 PolarHBondContact O-N 3.5Å; I1912-S1916 PolarHBondContact O-N 2.88Å; I1912-G1917 WeakPolarHBondContact O-CA 3.3Å; I1912-G1917 PolarHBondContact O-N 3.49Å; I1912-L1919 HydrophobicContact CD1-CD1 3.78Å; I1912-L1919 HydrophobicContact CG1-CD1 4.19Å; I1912-V1926 HydrophobicContact CG2-CB 3.93Å; I1912-V1926 HydrophobicContact CG2-CG1 4.36Å; I1912-V1926 HydrophobicContact CG2-CG2 4.3Å; I1912-T1928 HydrophobicContact CG2-CG2 4.28Å
1913	K	76.2	Confident	75.9	Confident	121 Å²	121	59.3 Å²	59.3	53%	0.526	33%	0.325	S	S	.	.	H	α-helix	trans	-64.8	-40.9	174.8	-79	173.6	172.4	175.6	0	112.1	F1909 Q1910 Q1911 A1915 S1916 T1928	F1909-K1913 VanDerWaalsContact O-CB 3.3Å; F1909-K1913 WeakPolarHBondContact O-CB 3.06Å; F1909-K1913 VanDerWaalsContact O-CG 3.3Å; F1909-K1913 WeakPolarHBondContact O-CG 3.11Å; F1909-K1913 PolarHBondContact O-N 2.75Å; Q1910-K1913 PolarHBondContact O-N 2.83Å; Q1911-K1913 PolarHBondContact O-N 3.1Å; K1913-A1915 VanDerWaalsContact C-N 3.32Å; K1913-A1915 PolarHBondContact O-N 2.7Å; K1913-S1916 PolarHBondContact O-N 2.9Å; K1913-S1916 VanDerWaalsContact O-N 3.14Å; K1913-T1928 WeakPolarHBondContact CE-O 3.46Å; K1913-T1928 HydrophobicContact CG-CG2 3.81Å; K1913-T1928 PolarHBondContact NZ-O 3.36Å
1914	A	73.2	Confident	76.6	Confident	78 Å²	78	53.6 Å²	53.6	65%	0.645	30%	0.298	S	S	*	.	H	α-helix	trans	-64.9	-33.6	174	0	0	0	0	0	112.8	Q1910 Q1911 S1916	Q1910-A1914 WeakPolarHBondContact O-CB 3.08Å; Q1910-A1914 PolarHBondContact O-N 2.96Å; Q1911-A1914 PolarHBondContact O-N 2.9Å; A1914-S1916 PolarHBondContact O-N 3.35Å
1915	A	77.6	Confident	76.6	Confident	39 Å²	39	54.9 Å²	54.9	32%	0.322	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	15	172.8	0	0	0	0	0	114	Q1911 I1912 K1913 G1917 K1918	Q1911-A1915 WeakPolarHBondContact O-CB 3.12Å; Q1911-A1915 PolarHBondContact O-N 3.21Å; I1912-A1915 CarbonylContact O-C 3.1Å; I1912-A1915 PolarHBondContact O-N 3.5Å; K1913-A1915 VanDerWaalsContact C-N 3.32Å; K1913-A1915 PolarHBondContact O-N 2.7Å; A1915-G1917 VanDerWaalsContact C-N 3.35Å; A1915-G1917 PolarHBondContact O-N 3.24Å; A1915-K1918 HydrophobicContact CB-CB 4.26Å; A1915-K1918 WeakPolarHBondContact O-CB 2.95Å; A1915-K1918 WeakPolarHBondContact O-CG 3.28Å; A1915-K1918 PolarHBondContact O-N 2.87Å
1916	S	74.6	Confident	76.9	Confident	91 Å²	91	54.5 Å²	54.5	64%	0.636	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	48.2	-175.6	-55.3	0	0	0	0	112.9	I1912 K1913 A1914 K1918 H1925	I1912-S1916 PolarHBondContact O-N 2.88Å; K1913-S1916 PolarHBondContact O-N 2.9Å; K1913-S1916 VanDerWaalsContact O-N 3.14Å; A1914-S1916 PolarHBondContact O-N 3.35Å; S1916-K1918 VanDerWaalsContact C-N 3.28Å; S1916-K1918 PolarHBondContact O-N 3.22Å; S1916-H1925 PolarHBondContact O-CE1 2.78Å; S1916-H1925 PolarHBondContact O-ND1 3.16Å
1917	G	78.1	Confident	77	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.021	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	-3.4	179.3	0	0	0	0	0	115.1	I1912 A1915 H1925 V1926	I1912-G1917 WeakPolarHBondContact O-CA 3.3Å; I1912-G1917 PolarHBondContact O-N 3.49Å; A1915-G1917 VanDerWaalsContact C-N 3.35Å; A1915-G1917 PolarHBondContact O-N 3.24Å; G1917-H1925 CarbonylContact O-C 3.51Å; G1917-H1925 WeakPolarHBondContact O-CA 3.37Å; G1917-V1926 PolarHBondContact O-N 3.3Å
1918	K	76.5	Confident	76.9	Confident	115 Å²	115	51.8 Å²	51.8	50%	0.5	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-75	135.7	-178.2	-64.6	175.8	-177.5	173.3	0	112.2	A1915 S1916 G1920 L1924	A1915-K1918 HydrophobicContact CB-CB 4.26Å; A1915-K1918 WeakPolarHBondContact O-CB 2.95Å; A1915-K1918 WeakPolarHBondContact O-CG 3.28Å; A1915-K1918 PolarHBondContact O-N 2.87Å; S1916-K1918 VanDerWaalsContact C-N 3.28Å; S1916-K1918 PolarHBondContact O-N 3.22Å; K1918-G1920 PolarHBondContact O-N 2.8Å; K1918-L1924 WeakPolarHBondContact CA-O 3.36Å
1919	L	78.4	Confident	76	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.325	C	S	.	.			trans	-87.1	98.9	172.9	-167.6	64.8	0	0	0	110	Y1846 A1849 F1850 A1853 I1912 S1922 L1924 V1926	Y1846-L1919 HydrophobicContact CD2-CD2 4.01Å; Y1846-L1919 HydrophobicContact CE2-CD2 3.81Å; A1849-L1919 HydrophobicContact CB-CB 4.2Å; A1849-L1919 HydrophobicContact CB-CD2 3.76Å; A1849-L1919 HydrophobicContact CB-CG 3.86Å; F1850-L1919 HydrophobicContact CB-CD2 4.35Å; A1853-L1919 HydrophobicContact CB-CD1 3.81Å; I1912-L1919 HydrophobicContact CD1-CD1 3.78Å; I1912-L1919 HydrophobicContact CG1-CD1 4.19Å; L1919-S1922 VanDerWaalsContact O-CB 3.3Å; L1919-S1922 WeakPolarHBondContact O-CB 3.42Å; L1919-S1922 PolarHBondContact O-N 2.77Å; L1919-S1922 PolarHBondContact O-OG 3.03Å; L1919-L1924 HydrophobicContact CB-CB 4.37Å; L1919-L1924 PolarHBondContact N-O 3.49Å; L1919-V1926 HydrophobicContact CB-CG2 4.09Å; L1919-V1926 HydrophobicContact CD1-CG2 4.35Å
1920	G	68.2	Low	75.4	Confident	26 Å²	26	56.4 Å²	56.4	27%	0.268	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	-145.5	-177.2	0	0	0	0	0	112.9	K1918 S1922	K1918-G1920 PolarHBondContact O-N 2.8Å; G1920-S1922 PolarHBondContact O-N 2.82Å
1921	S	67.5	Low	74.8	Confident	110 Å²	110	55.3 Å²	55.3	77%	0.769	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	6.3	173.9	-47.2	0	0	0	0	113.1	Q1852	Q1852-S1921 VanDerWaalsContact OE1-CB 3.26Å
1922	S	72.1	Confident	74.2	Confident	23 Å²	23	52 Å²	52	16%	0.161	31%	0.309	C	S	.	.	S	Bend	trans	-78.7	173.4	-173.7	84.4	0	0	0	0	113	A1849 L1919 G1920 L1924	A1849-S1922 WeakPolarHBondContact CB-OG 3.34Å; L1919-S1922 VanDerWaalsContact O-CB 3.3Å; L1919-S1922 WeakPolarHBondContact O-CB 3.42Å; L1919-S1922 PolarHBondContact O-N 2.77Å; L1919-S1922 PolarHBondContact O-OG 3.03Å; G1920-S1922 PolarHBondContact O-N 2.82Å; S1922-L1924 VanDerWaalsContact C-N 3.33Å; S1922-L1924 WeakPolarHBondContact OG-CB 3.01Å; S1922-L1924 PolarHBondContact OG-N 3.38Å
1923	K	74.4	Confident	73.5	Confident	150 Å²	150	54.3 Å²	54.3	65%	0.652	33%	0.325	S	S	*	.	S	Bend	trans	-84.9	0	169.5	-69.6	-178	179.2	179.5	0	113.2	A1821	A1821-K1923 WeakPolarHBondContact CA-O 3.04Å; A1821-K1923 HydrophobicContact CB-CB 4.34Å; A1821-K1923 HydrophobicContact CB-CD 4.5Å; A1821-K1923 PolarHBondContact N-O 3.24Å
1924	L	84.6	Confident	72.6	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	133.2	-179.7	-58.8	-175.3	0	0	0	110.8	V1817 W1820 V1845 Y1846 A1849 K1918 L1919 S1922	V1817-L1924 HydrophobicContact CG1-CB 4.12Å; V1817-L1924 HydrophobicContact CG1-CD2 4.17Å; W1820-L1924 HydrophobicContact CB-CD2 4.4Å; W1820-L1924 HydrophobicContact CG-CD2 4.05Å; V1845-L1924 HydrophobicContact CG1-CD1 4.23Å; V1845-L1924 HydrophobicContact CG1-CD2 4.49Å; V1845-L1924 HydrophobicContact CG1-CG 4.42Å; Y1846-L1924 HydrophobicContact CD2-CD1 4.44Å; A1849-L1924 HydrophobicContact CB-CD1 4.17Å; K1918-L1924 WeakPolarHBondContact CA-O 3.36Å; L1919-L1924 HydrophobicContact CB-CB 4.37Å; L1919-L1924 PolarHBondContact N-O 3.49Å; S1922-L1924 VanDerWaalsContact C-N 3.33Å; S1922-L1924 WeakPolarHBondContact OG-CB 3.01Å; S1922-L1924 PolarHBondContact OG-N 3.38Å
1925	H	80	Confident	71.6	Confident	36 Å²	36	53 Å²	53	17%	0.167	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	142.7	169.7	-160	96.2	0	0	0	109.4	V1817 D1818 R1819 S1916 G1917	V1817-H1925 WeakPolarHBondContact CA-O 3.42Å; V1817-H1925 WeakPolarHBondContact CG1-O 3.49Å; D1818-H1925 PolarHBondContact N-O 3.37Å; D1818-H1925 IonicContact OD1-CD2 3.81Å; D1818-H1925 PolarHBondContact OD1-CD2 3.46Å; D1818-H1925 VanDerWaalsContact OD1-CD2 3.23Å; D1818-H1925 IonicContact OD1-CG 3.26Å; D1818-H1925 VanDerWaalsContact OD1-O 3.12Å; D1818-H1925 IonicContact OD2-CD2 2.7Å; R1819-H1925 HydrophobicContact CB-CB 4.03Å; R1819-H1925 PolarHBondContact NH2-CD2 3.14Å; R1819-H1925 PolarHBondContact NH2-NE2 3.32Å; R1819-H1925 PolarHBondContact O-N 2.82Å; S1916-H1925 PolarHBondContact O-CE1 2.78Å; S1916-H1925 PolarHBondContact O-ND1 3.16Å; G1917-H1925 CarbonylContact O-C 3.51Å; G1917-H1925 WeakPolarHBondContact O-CA 3.37Å
1926	V	82.5	Confident	70.2	Confident	0 Å²	0	56 Å²	56	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.3	178.5	173.7	0	0	0	0	108.6	I1815 I1816 F1909 I1912 G1917 L1919 T1928	I1815-V1926 HydrophobicContact CG2-CG1 3.89Å; I1815-V1926 HydrophobicContact CG2-CG2 3.85Å; I1816-V1926 WeakPolarHBondContact O-CA 3.5Å; F1909-V1926 HydrophobicContact CE1-CG1 3.84Å; F1909-V1926 HydrophobicContact CZ-CG1 4.47Å; I1912-V1926 HydrophobicContact CG2-CB 3.93Å; I1912-V1926 HydrophobicContact CG2-CG1 4.36Å; I1912-V1926 HydrophobicContact CG2-CG2 4.3Å; G1917-V1926 PolarHBondContact O-N 3.3Å; L1919-V1926 HydrophobicContact CB-CG2 4.09Å; L1919-V1926 HydrophobicContact CD1-CG2 4.35Å; V1926-T1928 PolarHBondContact O-N 3.26Å; V1926-T1928 VanDerWaalsContact O-N 3.13Å
1927	D	78.9	Confident	68.7	Low	24 Å²	24	55.2 Å²	55.2	13%	0.128	33%	0.329	C	S	.	.			trans	-64.7	114.9	171.1	-169.9	-13.7	0	0	0	109.3	I1816 D1818 S1929	I1816-D1927 HydrophobicContact CB-CB 4.17Å; I1816-D1927 HydrophobicContact CG2-CB 4.05Å; I1816-D1927 PolarHBondContact O-N 3.34Å; D1818-D1927 HydrophobicContact CB-CB 4.26Å; D1927-S1929 WeakPolarHBondContact OD1-CA 3.04Å; D1927-S1929 VanDerWaalsContact OD1-CB 3.24Å; D1927-S1929 WeakPolarHBondContact OD1-CB 3.29Å; D1927-S1929 PolarHBondContact OD1-N 3Å; D1927-S1929 PolarHBondContact OD1-OG 3.16Å; D1927-S1929 PolarHBondContact OD2-OG 3.33Å
1928	T	75.1	Confident	66.6	Low	49 Å²	49	64.6 Å²	64.6	30%	0.301	37%	0.369	S	S	.	.	S	Bend	trans	-97.9	-0.4	-179.2	56	0	0	0	0	113.2	I1912 K1913 V1926	I1912-T1928 HydrophobicContact CG2-CG2 4.28Å; K1913-T1928 WeakPolarHBondContact CE-O 3.46Å; K1913-T1928 HydrophobicContact CG-CG2 3.81Å; K1913-T1928 PolarHBondContact NZ-O 3.36Å; V1926-T1928 PolarHBondContact O-N 3.26Å; V1926-T1928 VanDerWaalsContact O-N 3.13Å
1929	S	65.6	Low	64.5	Low	99 Å²	99	64.8 Å²	64.8	69%	0.692	38%	0.382	S	S	*	.	S	Bend	trans	-82.3	-29.5	175.8	76.8	0	0	0	0	112.9	D1927	D1927-S1929 WeakPolarHBondContact OD1-CA 3.04Å; D1927-S1929 VanDerWaalsContact OD1-CB 3.24Å; D1927-S1929 WeakPolarHBondContact OD1-CB 3.29Å; D1927-S1929 PolarHBondContact OD1-N 3Å; D1927-S1929 PolarHBondContact OD1-OG 3.16Å; D1927-S1929 PolarHBondContact OD2-OG 3.33Å
1930	V	67.3	Low	62.5	Low	15 Å²	15	71.6 Å²	71.6	9%	0.091	42%	0.423	C	S	.	.	S	Bend	trans	-84.8	121	173.4	-179.2	0	0	0	0	109.7	I1816 Y1879 V1882 S1932	I1816-V1930 HydrophobicContact CD1-CB 4.27Å; I1816-V1930 HydrophobicContact CD1-CG1 4.15Å; I1816-V1930 HydrophobicContact CD1-CG2 4.05Å; Y1879-V1930 HydrophobicContact CD1-CG1 3.78Å; Y1879-V1930 HydrophobicContact CE1-CG1 3.54Å; Y1879-V1930 HydrophobicContact CE2-CG1 4.45Å; Y1879-V1930 HydrophobicContact CG-CG1 4.31Å; V1882-V1930 HydrophobicContact CG2-CG2 3.45Å; V1882-V1930 VanDerWaalsContact CG2-CG2 3.45Å; V1930-S1932 VanDerWaalsContact C-N 3.32Å; V1930-S1932 PolarHBondContact O-N 3.12Å
1931	D	64.3	Low	60.9	Low	107 Å²	107	75.1 Å²	75.1	57%	0.572	44%	0.44	S	S	*	.			trans	-70.9	92.9	166.9	-169.3	-7.3	0	0	0	109.5	C1933 A1934	D1931-C1933 PolarHBondContact O-N 3.05Å; D1931-C1933 WeakPolarHBondContact OD1-CB 3.48Å; D1931-C1933 PolarHBondContact OD1-N 3Å; D1931-A1934 HydrophobicContact CB-CB 4.16Å; D1931-A1934 WeakPolarHBondContact O-CB 3.07Å; D1931-A1934 PolarHBondContact O-N 2.57Å
1932	S	63.1	Low	59.8	Low	4 Å²	4	77.2 Å²	77.2	3%	0.028	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-8.9	179.5	-60.7	0	0	0	0	113	P1814 F1909 V1930 A1934	P1814-S1932 WeakPolarHBondContact CD-O 3.31Å; P1814-S1932 VanDerWaalsContact CG-O 3.28Å; P1814-S1932 WeakPolarHBondContact CG-O 3.32Å; P1814-S1932 VanDerWaalsContact O-CB 3.27Å; P1814-S1932 WeakPolarHBondContact O-CB 3.26Å; F1909-S1932 VanDerWaalsContact CZ-CB 3.43Å; V1930-S1932 VanDerWaalsContact C-N 3.32Å; V1930-S1932 PolarHBondContact O-N 3.12Å; S1932-A1934 VanDerWaalsContact C-N 3.27Å
1933	C	65.2	Low	59.1	Low	51 Å²	51	80.1 Å²	80.1	35%	0.345	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1.9	170	-48.7	0	0	0	0	112	C1905 D1931	C1905-C1933 HydrophobicContact CB-CB 4.14Å; C1905-C1933 WeakPolarHBondContact CB-SG 3.24Å; C1905-C1933 WeakPolarHBondContact SG-CB 3.07Å; C1905-C1933 CovalentContact SG-SG 2.05Å; C1905-C1933 PolarHBondContact SG-SG 3.44Å; D1931-C1933 PolarHBondContact O-N 3.05Å; D1931-C1933 WeakPolarHBondContact OD1-CB 3.48Å; D1931-C1933 PolarHBondContact OD1-N 3Å
1934	A	58.4	Low	58.5	Low	41 Å²	41	77.4 Å²	77.4	34%	0.339	45%	0.449	S	S	.	.	S	Bend	trans	-109.5	150.2	-178.5	0	0	0	0	0	114.2	D1931 S1932	D1931-A1934 HydrophobicContact CB-CB 4.16Å; D1931-A1934 WeakPolarHBondContact O-CB 3.07Å; D1931-A1934 PolarHBondContact O-N 2.57Å; S1932-A1934 VanDerWaalsContact C-N 3.27Å
1935	P	51	Low	57.7	Low	129 Å²	129	77.5 Å²	77.5	84%	0.838	45%	0.449	S	S	*	.			trans	-79.7	161.6	-172.8	31.4	-36.5	0	0	0	115.8
1936	L	48.7	Very low	57.2	Low	102 Å²	102	78.8 Å²	78.8	53%	0.534	47%	0.472	S	S	.	.			trans	-86.3	143.1	-161.2	-56.6	178.1	0	0	0	116.8	T1878 Y1879	T1878-L1936 HydrophobicContact CG2-CD1 3.72Å; T1878-L1936 HydrophobicContact CG2-CD2 3.76Å; T1878-L1936 HydrophobicContact CG2-CG 4.29Å; Y1879-L1936 HydrophobicContact CD1-CD2 4.34Å; Y1879-L1936 HydrophobicContact CD2-CD2 4.38Å; Y1879-L1936 HydrophobicContact CE1-CD2 3.64Å; Y1879-L1936 HydrophobicContact CE2-CD2 3.68Å; Y1879-L1936 WeakPolarHBondContact OH-CD2 3.35Å
1937	P	42.6	Very low	56.3	Low	76 Å²	76	86 Å²	86	49%	0.494	52%	0.517	S	S	.	.			trans	-84.4	-173.7	174.1	35.4	-37	0	0	0	114.8	T1878	T1878-P1937 WeakPolarHBondContact O-CD 3.06Å
1938	K	33.5	Very low	55.3	Low	199 Å²	199	86.9 Å²	86.9	87%	0.865	53%	0.525	S	S	*	.			trans	-134	155.9	-172.4	-64.3	-177.2	-179.7	179.5	0	114.5
1939	P	33.6	Very low	55	Low	119 Å²	119	91.3 Å²	91.3	77%	0.773	54%	0.542	S	S	*	.			trans	-103	178.1	-165.1	4.7	19.2	0	0	0	116
1940	T	35	Very low	55.2	Low	142 Å²	142	86.8 Å²	86.8	87%	0.871	51%	0.51	S	S	*	.			trans	-132.2	166.6	-172.8	48.7	0	0	0	0	114.2
1941	T	35.3	Very low	55.3	Low	100 Å²	100	92 Å²	92	61%	0.613	53%	0.531	S	S	*	.			trans	-132.9	133.3	-164.1	46	0	0	0	0	115.9
1942	E	45	Very low	55.2	Low	154 Å²	154	88.6 Å²	88.6	72%	0.72	52%	0.518	S	S	*	.			trans	161.6	153.4	146.9	-93.9	-176.7	-167	0	0	110.3
1943	L	57.2	Low	55	Low	84 Å²	84	92.9 Å²	92.9	44%	0.44	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	130.7	-169.5	-139.5	84.2	0	0	0	115.2	H1949 C1950	L1943-H1949 CarbonylContact O-C 3.19Å; L1943-C1950 PolarHBondContact O-N 2.73Å
1944	P	60.7	Low	55.3	Low	93 Å²	93	91.6 Å²	91.6	60%	0.604	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	152.5	177.8	33.1	-35.4	0	0	0	113.9
1945	C	68.5	Low	55.7	Low	3 Å²	3	91.1 Å²	91.1	2%	0.02	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	90.5	179	-170.9	0	0	0	0	114.2	T1947 S1948 C1950 C1958	C1945-T1947 PolarHBondContact O-N 3.18Å; C1945-S1948 CarbonylContact C-O 3.23Å; C1945-S1948 WeakPolarHBondContact CA-O 3.43Å; C1945-S1948 PolarHBondContact N-O 3.43Å; C1945-S1948 CarbonylContact O-C 3.12Å; C1945-S1948 WeakPolarHBondContact O-CA 3.44Å; C1945-S1948 PolarHBondContact O-N 3.22Å; C1945-S1948 PolarHBondContact O-OG 2.8Å; C1945-C1950 WeakPolarHBondContact CB-SG 3.49Å; C1945-C1950 VanDerWaalsContact SG-SG 3.64Å; C1945-C1958 WeakPolarHBondContact CA-SG 3.14Å; C1945-C1958 HydrophobicContact CB-CB 3.52Å; C1945-C1958 WeakPolarHBondContact CB-SG 3.4Å; C1945-C1958 WeakPolarHBondContact SG-CA 3.06Å; C1945-C1958 WeakPolarHBondContact SG-CB 3.46Å; C1945-C1958 CovalentContact SG-SG 2.03Å; C1945-C1958 PolarHBondContact SG-SG 2.99Å
1946	G	69.5	Low	56.8	Low	63 Å²	63	86 Å²	86	65%	0.649	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	-124.9	-178.2	0	0	0	0	0	111.2	G1961	G1946-G1961 WeakPolarHBondContact CA-O 3.49Å; G1946-G1961 PolarHBondContact N-O 2.04Å
1947	T	63.4	Low	58	Low	152 Å²	152	83.9 Å²	83.9	93%	0.933	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-9.7	170.7	49.9	0	0	0	0	113.5	C1945	C1945-T1947 PolarHBondContact O-N 3.18Å
1948	S	58.9	Low	59.4	Low	42 Å²	42	82.2 Å²	82.2	29%	0.294	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	164.2	173.9	36.8	0	0	0	0	111.9	C1945	C1945-S1948 CarbonylContact C-O 3.23Å; C1945-S1948 WeakPolarHBondContact CA-O 3.43Å; C1945-S1948 PolarHBondContact N-O 3.43Å; C1945-S1948 CarbonylContact O-C 3.12Å; C1945-S1948 WeakPolarHBondContact O-CA 3.44Å; C1945-S1948 PolarHBondContact O-N 3.22Å; C1945-S1948 PolarHBondContact O-OG 2.8Å
1949	H	68.6	Low	60.7	Low	143 Å²	143	76.6 Å²	76.6	66%	0.662	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.5	167.4	-65.8	61.6	0	0	0	106.5	L1943	L1943-H1949 CarbonylContact O-C 3.19Å
1950	C	69.8	Low	62.1	Low	3 Å²	3	74.4 Å²	74.4	2%	0.02	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	136.6	179.8	-61.1	0	0	0	0	109.4	L1943 C1945 A1952 E1956 C1964	L1943-C1950 PolarHBondContact O-N 2.73Å; C1945-C1950 WeakPolarHBondContact CB-SG 3.49Å; C1945-C1950 VanDerWaalsContact SG-SG 3.64Å; C1950-A1952 PolarHBondContact O-N 3.46Å; C1950-E1956 HydrophobicContact CB-CB 3.88Å; C1950-C1964 WeakPolarHBondContact CA-SG 3.25Å; C1950-C1964 HydrophobicContact CB-CB 3.85Å; C1950-C1964 WeakPolarHBondContact CB-SG 3.37Å; C1950-C1964 PolarHBondContact N-SG 2.89Å; C1950-C1964 WeakPolarHBondContact SG-CA 3.41Å; C1950-C1964 WeakPolarHBondContact SG-CB 3.04Å; C1950-C1964 CovalentContact SG-SG 2.04Å; C1950-C1964 PolarHBondContact SG-SG 3Å
1951	K	68.3	Low	63.7	Low	126 Å²	126	69.8 Å²	69.8	55%	0.548	43%	0.433	S	S	.	.			trans	-78.4	96.1	178.1	-67.6	167.6	-178	170.1	0	108.7	D1953 L1954 G1955 E1956	K1951-D1953 PolarHBondContact O-N 3.4Å; K1951-L1954 HydrophobicContact CB-CB 3.9Å; K1951-L1954 HydrophobicContact CB-CD1 4.12Å; K1951-L1954 HydrophobicContact CB-CG 3.78Å; K1951-L1954 HydrophobicContact CD-CD1 3.58Å; K1951-L1954 HydrophobicContact CD-CG 3.93Å; K1951-L1954 CarbonylContact O-C 3.42Å; K1951-L1954 WeakPolarHBondContact O-CA 3.47Å; K1951-L1954 PolarHBondContact O-N 3.06Å; K1951-G1955 PolarHBondContact O-N 3.2Å; K1951-E1956 WeakPolarHBondContact CB-OE2 3.38Å; K1951-E1956 PolarHBondContact N-OE2 3.42Å; K1951-E1956 PolarHBondContact O-N 2.84Å; K1951-E1956 VanDerWaalsContact O-N 3.09Å
1952	A	63.5	Low	65.2	Low	35 Å²	35	75 Å²	75	29%	0.289	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-51.9	-35.9	167.8	0	0	0	0	0	111	C1950 L1954 G1955	C1950-A1952 PolarHBondContact O-N 3.46Å; A1952-L1954 VanDerWaalsContact C-N 3.27Å; A1952-L1954 PolarHBondContact O-N 3.26Å; A1952-G1955 WeakPolarHBondContact O-CA 3.34Å; A1952-G1955 PolarHBondContact O-N 2.73Å
1953	D	58.2	Low	66.2	Low	94 Å²	94	72.7 Å²	72.7	50%	0.503	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-57.1	-32	171.3	-72.7	14.2	0	0	0	114.3	K1951 Q1978	K1951-D1953 PolarHBondContact O-N 3.4Å; D1953-Q1978 WeakPolarHBondContact O-CG 2.99Å; D1953-Q1978 PolarHBondContact O-NE2 3.5Å
1954	L	70.8	Confident	67	Low	24 Å²	24	70.1 Å²	70.1	13%	0.126	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-87.9	-2.4	173	-65.9	-171.8	0	0	0	112.8	K1951 A1952 E1956 Q1978 C1979	K1951-L1954 HydrophobicContact CB-CB 3.9Å; K1951-L1954 HydrophobicContact CB-CD1 4.12Å; K1951-L1954 HydrophobicContact CB-CG 3.78Å; K1951-L1954 HydrophobicContact CD-CD1 3.58Å; K1951-L1954 HydrophobicContact CD-CG 3.93Å; K1951-L1954 CarbonylContact O-C 3.42Å; K1951-L1954 WeakPolarHBondContact O-CA 3.47Å; K1951-L1954 PolarHBondContact O-N 3.06Å; A1952-L1954 VanDerWaalsContact C-N 3.27Å; A1952-L1954 PolarHBondContact O-N 3.26Å; L1954-E1956 VanDerWaalsContact C-N 3.29Å; L1954-E1956 HydrophobicContact CB-CG 4.04Å; L1954-Q1978 HydrophobicContact CD2-CG 4.26Å; L1954-C1979 WeakPolarHBondContact O-CB 3.34Å; L1954-C1979 PolarHBondContact O-N 2.86Å; L1954-C1979 PolarHBondContact O-SG 2.73Å; L1954-C1979 VanDerWaalsContact O-SG 3.33Å
1955	G	67.8	Low	67.8	Low	31 Å²	31	68 Å²	68	32%	0.32	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	20.1	-170.3	0	0	0	0	0	113.7	K1951 A1952 P1967	K1951-G1955 PolarHBondContact O-N 3.2Å; A1952-G1955 WeakPolarHBondContact O-CA 3.34Å; A1952-G1955 PolarHBondContact O-N 2.73Å; G1955-P1967 VanDerWaalsContact O-CD 3.23Å; G1955-P1967 WeakPolarHBondContact O-CD 3.46Å
1956	E	73.9	Confident	68.2	Low	22 Å²	22	68.4 Å²	68.4	10%	0.103	41%	0.412	C	S	.	.			trans	-75.1	132.1	177.3	-69.1	178.4	151.1	0	0	111.7	C1950 K1951 L1954 C1964 S1965 R1972	C1950-E1956 HydrophobicContact CB-CB 3.88Å; K1951-E1956 WeakPolarHBondContact CB-OE2 3.38Å; K1951-E1956 PolarHBondContact N-OE2 3.42Å; K1951-E1956 PolarHBondContact O-N 2.84Å; K1951-E1956 VanDerWaalsContact O-N 3.09Å; L1954-E1956 VanDerWaalsContact C-N 3.29Å; L1954-E1956 HydrophobicContact CB-CG 4.04Å; E1956-C1964 HydrophobicContact CB-CB 4.36Å; E1956-S1965 CarbonylContact C-O 3.32Å; E1956-S1965 WeakPolarHBondContact CA-O 3.4Å; E1956-R1972 IonicContact OE1-CZ 2.62Å; E1956-R1972 IonicContact OE1-NH1 3.41Å; E1956-R1972 PolarHBondContact OE1-NH1 3.23Å; E1956-R1972 IonicContact OE1-NH2 3.8Å; E1956-R1972 PolarHBondContact OE1-NH2 2.85Å
1957	V	73.3	Confident	68.2	Low	56 Å²	56	67.2 Å²	67.2	34%	0.339	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	153.7	171.8	-62.8	0	0	0	0	110.8	I1959 S1965 P1967	V1957-I1959 HydrophobicContact CG2-CG1 4.17Å; V1957-I1959 PolarHBondContact O-N 2.84Å; V1957-S1965 PolarHBondContact N-O 2.87Å; V1957-S1965 PolarHBondContact O-N 2.8Å; V1957-P1967 HydrophobicContact CG1-CB 4.31Å; V1957-P1967 HydrophobicContact CG1-CG 4.46Å; V1957-P1967 HydrophobicContact CG2-CB 3.92Å
1958	C	72.6	Confident	68.4	Low	42 Å²	42	70.3 Å²	70.3	28%	0.284	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	98.2	179.3	-172	0	0	0	0	111.4	C1945 G1961	C1945-C1958 WeakPolarHBondContact CA-SG 3.14Å; C1945-C1958 HydrophobicContact CB-CB 3.52Å; C1945-C1958 WeakPolarHBondContact CB-SG 3.4Å; C1945-C1958 WeakPolarHBondContact SG-CA 3.06Å; C1945-C1958 WeakPolarHBondContact SG-CB 3.46Å; C1945-C1958 CovalentContact SG-SG 2.03Å; C1945-C1958 PolarHBondContact SG-SG 2.99Å; C1958-G1961 VanDerWaalsContact SG-C 3.57Å; C1958-G1961 WeakPolarHBondContact SG-CA 3.33Å
1959	I	61.9	Low	68.7	Low	80 Å²	80	70.3 Å²	70.3	41%	0.41	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	130.9	174.7	-53.2	-175.5	0	0	0	109	V1957 G1961 R1962 I1963	V1957-I1959 HydrophobicContact CG2-CG1 4.17Å; V1957-I1959 PolarHBondContact O-N 2.84Å; I1959-G1961 PolarHBondContact O-N 2.81Å; I1959-G1961 VanDerWaalsContact O-N 3.08Å; I1959-R1962 PolarHBondContact O-N 3.37Å; I1959-I1963 PolarHBondContact N-O 2.67Å; I1959-I1963 PolarHBondContact O-N 3.48Å
1960	G	62.6	Low	68.9	Low	74 Å²	74	68 Å²	68	76%	0.763	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	18.6	176.5	0	0	0	0	0	115.7	R1962	G1960-R1962 PolarHBondContact O-N 3.19Å
1961	G	67.2	Low	69	Low	44 Å²	44	68.6 Å²	68.6	45%	0.454	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	8.5	-176.9	0	0	0	0	0	115	G1946 C1958 I1959	G1946-G1961 WeakPolarHBondContact CA-O 3.49Å; G1946-G1961 PolarHBondContact N-O 2.04Å; C1958-G1961 VanDerWaalsContact SG-C 3.57Å; C1958-G1961 WeakPolarHBondContact SG-CA 3.33Å; I1959-G1961 PolarHBondContact O-N 2.81Å; I1959-G1961 VanDerWaalsContact O-N 3.08Å
1962	R	67.4	Low	68.9	Low	210 Å²	210	65 Å²	65	79%	0.792	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.6	-19.7	-170.1	-65	-177	-176.9	172.5	2.3	115.7	I1959 G1960	I1959-R1962 PolarHBondContact O-N 3.37Å; G1960-R1962 PolarHBondContact O-N 3.19Å
1963	I	67.3	Low	68.9	Low	106 Å²	106	67.1 Å²	67.1	54%	0.544	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	118.4	-171.4	-57.2	176.9	0	0	0	109.4	I1959	I1959-I1963 PolarHBondContact N-O 2.67Å; I1959-I1963 PolarHBondContact O-N 3.48Å
1964	C	73.3	Confident	69.1	Low	30 Å²	30	67.9 Å²	67.9	20%	0.203	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	112.2	168.2	-64.1	0	0	0	0	109.8	C1950 E1956	C1950-C1964 WeakPolarHBondContact CA-SG 3.25Å; C1950-C1964 HydrophobicContact CB-CB 3.85Å; C1950-C1964 WeakPolarHBondContact CB-SG 3.37Å; C1950-C1964 PolarHBondContact N-SG 2.89Å; C1950-C1964 WeakPolarHBondContact SG-CA 3.41Å; C1950-C1964 WeakPolarHBondContact SG-CB 3.04Å; C1950-C1964 CovalentContact SG-SG 2.04Å; C1950-C1964 PolarHBondContact SG-SG 3Å; E1956-C1964 HydrophobicContact CB-CB 4.36Å
1965	S	78.1	Confident	68.7	Low	47 Å²	47	72 Å²	72	33%	0.329	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	173.9	178.7	-162.1	0	0	0	0	110.9	E1956 V1957	E1956-S1965 CarbonylContact C-O 3.32Å; E1956-S1965 WeakPolarHBondContact CA-O 3.4Å; V1957-S1965 PolarHBondContact N-O 2.87Å; V1957-S1965 PolarHBondContact O-N 2.8Å
1966	C	75.6	Confident	68.4	Low	12 Å²	12	73.2 Å²	73.2	8%	0.081	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-69.2	145.7	172.4	-59.6	0	0	0	0	110.9	F1970 C1979	C1966-F1970 HydrophobicContact CB-CB 4.02Å; C1966-F1970 VanDerWaalsContact CB-O 3.3Å; C1966-F1970 WeakPolarHBondContact CB-O 3.23Å; C1966-C1979 WeakPolarHBondContact CA-SG 3.4Å; C1966-C1979 HydrophobicContact CB-CB 3.68Å; C1966-C1979 WeakPolarHBondContact CB-SG 3.38Å; C1966-C1979 VanDerWaalsContact SG-CA 3.58Å; C1966-C1979 WeakPolarHBondContact SG-CB 3.3Å; C1966-C1979 CovalentContact SG-SG 2.04Å; C1966-C1979 PolarHBondContact SG-SG 2.96Å
1967	P	69.1	Low	68.4	Low	39 Å²	39	75.3 Å²	75.3	25%	0.253	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-64.9	159.4	172.3	26.7	-33.8	0	0	0	111.4	G1955 V1957 G1969 F1970	G1955-P1967 VanDerWaalsContact O-CD 3.23Å; G1955-P1967 WeakPolarHBondContact O-CD 3.46Å; V1957-P1967 HydrophobicContact CG1-CB 4.31Å; V1957-P1967 HydrophobicContact CG1-CG 4.46Å; V1957-P1967 HydrophobicContact CG2-CB 3.92Å; P1967-G1969 PolarHBondContact O-N 2.82Å; P1967-F1970 HydrophobicContact CG-CB 4.11Å; P1967-F1970 HydrophobicContact CG-CD2 3.83Å; P1967-F1970 HydrophobicContact CG-CG 4.03Å; P1967-F1970 WeakPolarHBondContact O-CB 3.41Å; P1967-F1970 PolarHBondContact O-N 2.87Å
1968	F	69.6	Low	68.2	Low	217 Å²	217	78.7 Å²	78.7	95%	0.952	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	131	-178.7	-123.8	-90.1	0	0	0	111.6
1969	G	64.1	Low	68.3	Low	42 Å²	42	77.5 Å²	77.5	43%	0.433	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	-18.4	-172.9	0	0	0	0	0	114.9	P1967 T1982	P1967-G1969 PolarHBondContact O-N 2.82Å; G1969-T1982 PolarHBondContact O-N 3.03Å; G1969-T1982 PolarHBondContact O-OG1 3.24Å
1970	F	73.4	Confident	68.8	Low	95 Å²	95	76.6 Å²	76.6	42%	0.417	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	149.4	178.8	-65.8	-108.1	0	0	0	111.5	C1966 P1967 C1979 V1980 E1981	C1966-F1970 HydrophobicContact CB-CB 4.02Å; C1966-F1970 VanDerWaalsContact CB-O 3.3Å; C1966-F1970 WeakPolarHBondContact CB-O 3.23Å; P1967-F1970 HydrophobicContact CG-CB 4.11Å; P1967-F1970 HydrophobicContact CG-CD2 3.83Å; P1967-F1970 HydrophobicContact CG-CG 4.03Å; P1967-F1970 WeakPolarHBondContact O-CB 3.41Å; P1967-F1970 PolarHBondContact O-N 2.87Å; F1970-C1979 HydrophobicContact CB-CB 4.17Å; F1970-V1980 CarbonylContact C-O 3.12Å; F1970-V1980 VanDerWaalsContact CA-O 3.24Å; F1970-V1980 WeakPolarHBondContact CA-O 3.37Å; F1970-V1980 VanDerWaalsContact CD1-C 3.49Å; F1970-E1981 HydrophobicContact CD1-CB 4.3Å; F1970-E1981 HydrophobicContact CE1-CB 4Å; F1970-E1981 HydrophobicContact CZ-CB 4.4Å
1971	G	71.9	Confident	69.1	Low	15 Å²	15	79 Å²	79	16%	0.155	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	173.4	-178.5	0	0	0	0	0	112.1	C1979 V1980	G1971-C1979 WeakPolarHBondContact O-CA 3.4Å; G1971-V1980 PolarHBondContact N-O 2.97Å; G1971-V1980 VanDerWaalsContact O-CG2 3.29Å; G1971-V1980 WeakPolarHBondContact O-CG2 3.45Å; G1971-V1980 PolarHBondContact O-N 3.4Å
1972	R	66.5	Low	69.5	Low	49 Å²	49	77.5 Å²	77.5	19%	0.185	41%	0.409	C	S	.	.			trans	-151.1	146.5	-177.1	57.3	-177.6	169.6	-175.6	-4.6	111.4	E1956 P1975 D1977 V2038	E1956-R1972 IonicContact OE1-CZ 2.62Å; E1956-R1972 IonicContact OE1-NH1 3.41Å; E1956-R1972 PolarHBondContact OE1-NH1 3.23Å; E1956-R1972 IonicContact OE1-NH2 3.8Å; E1956-R1972 PolarHBondContact OE1-NH2 2.85Å; R1972-P1975 PolarHBondContact NH1-O 2.94Å; R1972-D1977 HydrophobicContact CB-CB 4.19Å; R1972-D1977 VanDerWaalsContact CD-O 3.28Å; R1972-D1977 WeakPolarHBondContact CD-O 3.35Å; R1972-V2038 VanDerWaalsContact C-CG1 3.45Å
1973	K	62.3	Low	69.7	Low	81 Å²	81	71.1 Å²	71.1	35%	0.352	39%	0.39	S	S	.	.	S	Bend	trans	-79.3	-31.1	-173.2	-167.5	165.9	-172.8	146.4	0	112.6	N2034 F2037	K1973-N2034 PolarHBondContact NZ-O 2.96Å; K1973-N2034 PolarHBondContact NZ-OD1 3.37Å; K1973-N2034 VanDerWaalsContact NZ-OD1 3.09Å; K1973-F2037 WeakPolarHBondContact CD-O 3.24Å; K1973-F2037 WeakPolarHBondContact CE-O 3.1Å; K1973-F2037 PolarHBondContact NZ-O 3.43Å
1974	H	63.6	Low	70	Confident	110 Å²	110	69.7 Å²	69.7	51%	0.509	39%	0.388	S	S	.	.	S	Bend	trans	-134	157.1	168.9	-45.1	85.3	0	0	0	110	G1976 D1977	H1974-G1976 PolarHBondContact O-N 3.05Å; H1974-D1977 WeakPolarHBondContact CB-OD2 3.4Å; H1974-D1977 IonicContact CE1-OD2 2.72Å; H1974-D1977 IonicContact CG-OD2 3.11Å; H1974-D1977 PolarHBondContact N-OD2 3.19Å; H1974-D1977 IonicContact ND1-OD1 3.94Å; H1974-D1977 IonicContact ND1-OD2 3.93Å; H1974-D1977 PolarHBondContact ND1-OD2 3.05Å; H1974-D1977 PolarHBondContact O-N 3.48Å
1975	P	60.6	Low	70	Confident	110 Å²	110	68.9 Å²	68.9	71%	0.714	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-10.6	178.3	-25.3	35.4	0	0	0	115.9	R1972	R1972-P1975 PolarHBondContact NH1-O 2.94Å
1976	G	62.4	Low	69.7	Low	56 Å²	56	69.2 Å²	69.2	58%	0.577	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-8.1	174.5	0	0	0	0	0	114.7	H1974	H1974-G1976 PolarHBondContact O-N 3.05Å
1977	D	73.9	Confident	69.8	Low	67 Å²	67	68.8 Å²	68.8	36%	0.358	38%	0.381	S	S	.	.	S	Bend	trans	-83.7	155	179.8	-58.7	-33.9	0	0	0	110.9	R1972 H1974	R1972-D1977 HydrophobicContact CB-CB 4.19Å; R1972-D1977 VanDerWaalsContact CD-O 3.28Å; R1972-D1977 WeakPolarHBondContact CD-O 3.35Å; H1974-D1977 WeakPolarHBondContact CB-OD2 3.4Å; H1974-D1977 IonicContact CE1-OD2 2.72Å; H1974-D1977 IonicContact CG-OD2 3.11Å; H1974-D1977 PolarHBondContact N-OD2 3.19Å; H1974-D1977 IonicContact ND1-OD1 3.94Å; H1974-D1977 IonicContact ND1-OD2 3.93Å; H1974-D1977 PolarHBondContact ND1-OD2 3.05Å; H1974-D1977 PolarHBondContact O-N 3.48Å
1978	Q	69.4	Low	70.4	Confident	127 Å²	127	67.1 Å²	67.1	59%	0.593	37%	0.37	S	S	*	.			trans	-62.9	143	170.8	-104.5	176.3	-17.9	0	0	110.9	D1953 L1954 V1980	D1953-Q1978 WeakPolarHBondContact O-CG 2.99Å; D1953-Q1978 PolarHBondContact O-NE2 3.5Å; L1954-Q1978 HydrophobicContact CD2-CG 4.26Å; Q1978-V1980 PolarHBondContact O-N 3.42Å; Q1978-V1980 VanDerWaalsContact O-N 3.12Å
1979	C	74.3	Confident	71.2	Confident	17 Å²	17	56.8 Å²	56.8	12%	0.115	33%	0.325	C	S	.	.			trans	-65.5	104.8	168.6	-65.5	0	0	0	0	109.6	L1954 C1966 F1970 G1971	L1954-C1979 WeakPolarHBondContact O-CB 3.34Å; L1954-C1979 PolarHBondContact O-N 2.86Å; L1954-C1979 PolarHBondContact O-SG 2.73Å; L1954-C1979 VanDerWaalsContact O-SG 3.33Å; C1966-C1979 WeakPolarHBondContact CA-SG 3.4Å; C1966-C1979 HydrophobicContact CB-CB 3.68Å; C1966-C1979 WeakPolarHBondContact CB-SG 3.38Å; C1966-C1979 VanDerWaalsContact SG-CA 3.58Å; C1966-C1979 WeakPolarHBondContact SG-CB 3.3Å; C1966-C1979 CovalentContact SG-SG 2.04Å; C1966-C1979 PolarHBondContact SG-SG 2.96Å; F1970-C1979 HydrophobicContact CB-CB 4.17Å; G1971-C1979 WeakPolarHBondContact O-CA 3.4Å
1980	V	73	Confident	72.2	Confident	60 Å²	60	55.5 Å²	55.5	36%	0.364	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	150.2	175	-69.5	0	0	0	0	110	F1970 G1971 Q1978 T1982 V2038 T2068	F1970-V1980 CarbonylContact C-O 3.12Å; F1970-V1980 VanDerWaalsContact CA-O 3.24Å; F1970-V1980 WeakPolarHBondContact CA-O 3.37Å; F1970-V1980 VanDerWaalsContact CD1-C 3.49Å; G1971-V1980 PolarHBondContact N-O 2.97Å; G1971-V1980 VanDerWaalsContact O-CG2 3.29Å; G1971-V1980 WeakPolarHBondContact O-CG2 3.45Å; G1971-V1980 PolarHBondContact O-N 3.4Å; Q1978-V1980 PolarHBondContact O-N 3.42Å; Q1978-V1980 VanDerWaalsContact O-N 3.12Å; V1980-T1982 PolarHBondContact O-N 2.95Å; V1980-V2038 HydrophobicContact CG2-CG2 4.47Å; V1980-T2068 HydrophobicContact CB-CG2 4.35Å; V1980-T2068 HydrophobicContact CG2-CG2 3.79Å
1981	E	68.3	Low	72.9	Confident	124 Å²	124	51 Å²	51	58%	0.579	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.3	135.8	172	-172.6	-179.9	-170	0	0	109.7	F1970 P2069	F1970-E1981 HydrophobicContact CD1-CB 4.3Å; F1970-E1981 HydrophobicContact CE1-CB 4Å; F1970-E1981 HydrophobicContact CZ-CB 4.4Å; E1981-P2069 HydrophobicContact CB-CG 4.26Å; E1981-P2069 HydrophobicContact CG-CG 4.18Å; E1981-P2069 WeakPolarHBondContact O-CD 3.49Å
1982	T	75.3	Confident	73.6	Confident	13 Å²	13	52.2 Å²	52.2	8%	0.08	29%	0.29	C	S	.	.			trans	-123.7	132.2	179.5	63.8	0	0	0	0	112.3	G1969 V1980 P1984 V2038 H2066 F2067	G1969-T1982 PolarHBondContact O-N 3.03Å; G1969-T1982 PolarHBondContact O-OG1 3.24Å; V1980-T1982 PolarHBondContact O-N 2.95Å; T1982-P1984 VanDerWaalsContact O-CD 3.27Å; T1982-P1984 WeakPolarHBondContact O-CD 3.37Å; T1982-V2038 HydrophobicContact CG2-CB 4.3Å; T1982-V2038 HydrophobicContact CG2-CG1 4.26Å; T1982-V2038 HydrophobicContact CG2-CG2 4Å; T1982-H2066 HydrophobicContact CG2-CB 4.31Å; T1982-H2066 PolarHBondContact OG1-ND1 2.82Å; T1982-F2067 CarbonylContact C-O 3.52Å; T1982-F2067 WeakPolarHBondContact CA-O 3.24Å
1983	L	72.2	Confident	74.2	Confident	77 Å²	77	53.9 Å²	53.9	40%	0.403	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	108.6	167.6	-178.1	64.4	0	0	0	108.7	V1985 F2067 F2073	L1983-V1985 HydrophobicContact CG-CG2 4.45Å; L1983-V1985 PolarHBondContact O-N 3.15Å; L1983-F2067 PolarHBondContact N-O 3.35Å; L1983-F2067 PolarHBondContact O-N 2.79Å; L1983-F2073 HydrophobicContact CD2-CD1 3.74Å; L1983-F2073 HydrophobicContact CD2-CE1 3.77Å
1984	P	72.4	Confident	75.2	Confident	76 Å²	76	53.7 Å²	53.7	49%	0.494	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	123.7	174.8	29.7	-33.4	0	0	0	110.4	T1982 I2064	T1982-P1984 VanDerWaalsContact O-CD 3.27Å; T1982-P1984 WeakPolarHBondContact O-CD 3.37Å; P1984-I2064 HydrophobicContact CB-CG2 3.6Å
1985	V	74	Confident	76	Confident	13 Å²	13	51.3 Å²	51.3	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	111.6	173.3	-178.1	0	0	0	0	109.8	L1983 M1987 I2064 V2065 F2067 F2073 A2075	L1983-V1985 HydrophobicContact CG-CG2 4.45Å; L1983-V1985 PolarHBondContact O-N 3.15Å; V1985-M1987 HydrophobicContact CB-CE 4.18Å; V1985-M1987 HydrophobicContact CG1-CE 3.9Å; V1985-M1987 HydrophobicContact CG1-CG 4.07Å; V1985-M1987 HydrophobicContact CG1-SD 4.35Å; V1985-I2064 WeakPolarHBondContact O-CA 3.28Å; V1985-V2065 PolarHBondContact N-O 2.84Å; V1985-V2065 PolarHBondContact O-N 3.06Å; V1985-F2067 HydrophobicContact CB-CD2 4.32Å; V1985-F2067 HydrophobicContact CB-CE2 4.27Å; V1985-F2067 HydrophobicContact CG2-CD2 4.05Å; V1985-F2067 HydrophobicContact CG2-CE2 4.38Å; V1985-F2073 HydrophobicContact CG2-CE1 3.56Å; V1985-F2073 HydrophobicContact CG2-CZ 3.71Å; V1985-A2075 HydrophobicContact CG1-CB 3.54Å
1986	S	71	Confident	76.7	Confident	53 Å²	53	54.5 Å²	54.5	37%	0.371	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.1	169.2	-171.7	0	0	0	0	110.3	F2063	S1986-F2063 CarbonylContact C-O 3.25Å; S1986-F2063 VanDerWaalsContact CA-O 3.32Å; S1986-F2063 WeakPolarHBondContact CA-O 3.12Å
1987	M	79	Confident	77.1	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.015	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	165.4	179.5	-87.9	176.6	-69.5	0	0	112.2	V1985 Y2028 F2063 V2065 F2067 A2078 H2079	V1985-M1987 HydrophobicContact CB-CE 4.18Å; V1985-M1987 HydrophobicContact CG1-CE 3.9Å; V1985-M1987 HydrophobicContact CG1-CG 4.07Å; V1985-M1987 HydrophobicContact CG1-SD 4.35Å; M1987-Y2028 VanDerWaalsContact CE-OH 3.26Å; M1987-Y2028 WeakPolarHBondContact CE-OH 3.46Å; M1987-Y2028 PolarHBondContact SD-OH 3.19Å; M1987-F2063 VanDerWaalsContact C-CE1 3.47Å; M1987-F2063 HydrophobicContact CB-CE1 4.11Å; M1987-F2063 HydrophobicContact CB-CE2 3.89Å; M1987-F2063 HydrophobicContact CB-CZ 3.66Å; M1987-F2063 PolarHBondContact N-O 2.9Å; M1987-F2063 WeakPolarHBondContact O-CD1 3.43Å; M1987-F2063 VanDerWaalsContact O-CE1 3.31Å; M1987-F2063 WeakPolarHBondContact O-CE1 3.23Å; M1987-F2063 PolarHBondContact O-N 3.47Å; M1987-F2063 VanDerWaalsContact O-O 3.12Å; M1987-V2065 HydrophobicContact CE-CB 3.68Å; M1987-V2065 HydrophobicContact CE-CG2 3.58Å; M1987-F2067 HydrophobicContact CE-CE2 3.84Å; M1987-F2067 HydrophobicContact CE-CZ 4.25Å; M1987-A2078 HydrophobicContact CE-CB 4.19Å; M1987-A2078 HydrophobicContact SD-CB 4.04Å; M1987-H2079 HydrophobicContact CG-CB 4.37Å; M1987-H2079 HydrophobicContact SD-CB 3.86Å
1988	P	80.6	Confident	77.3	Confident	4 Å²	4	57 Å²	57	3%	0.026	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	156.4	-171.2	42.7	-27.4	0	0	0	115.2	W2060 F2061 L2107 N2378	P1988-W2060 HydrophobicContact CB-CH2 4.24Å; P1988-W2060 HydrophobicContact CB-CZ2 4Å; P1988-F2061 CarbonylContact C-O 3.45Å; P1988-F2061 VanDerWaalsContact CA-O 3.32Å; P1988-F2061 WeakPolarHBondContact CA-O 3.46Å; P1988-L2107 HydrophobicContact CG-CD1 4.24Å; P1988-N2378 WeakPolarHBondContact CB-ND2 3.36Å; P1988-N2378 WeakPolarHBondContact CB-OD1 3.05Å; P1988-N2378 WeakPolarHBondContact CG-ND2 3.37Å
1989	L	86.3	Confident	77.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	135.2	177.3	-140	74	0	0	0	114.4	F2020 I2024 W2060 F2061 F2063 L2083 I2086 I2093 I2100	L1989-F2020 HydrophobicContact CB-CE2 3.89Å; L1989-F2020 HydrophobicContact CB-CZ 3.89Å; L1989-F2020 HydrophobicContact CD2-CE2 3.66Å; L1989-F2020 HydrophobicContact CD2-CZ 3.99Å; L1989-F2020 HydrophobicContact CG-CE2 4.45Å; L1989-I2024 HydrophobicContact CD2-CD1 4.31Å; L1989-W2060 WeakPolarHBondContact O-CA 3.3Å; L1989-W2060 VanDerWaalsContact O-CE3 3.27Å; L1989-F2061 PolarHBondContact N-O 2.81Å; L1989-F2061 PolarHBondContact O-N 2.85Å; L1989-F2063 HydrophobicContact CB-CE1 4.06Å; L1989-L2083 HydrophobicContact CD1-CD2 3.81Å; L1989-I2086 HydrophobicContact CD1-CD1 4.35Å; L1989-I2086 HydrophobicContact CD2-CD1 3.97Å; L1989-I2093 HydrophobicContact CD2-CD1 3.67Å; L1989-I2093 HydrophobicContact CD2-CG1 4.03Å; L1989-I2100 HydrophobicContact CD2-CG2 3.51Å; L1989-I2100 HydrophobicContact CG-CG2 3.76Å
1990	W	86.3	Confident	78.2	Confident	16 Å²	16	56.1 Å²	56.1	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	103.5	174.9	-172.6	24.3	0	0	0	111.5	I1992 F2055 K2057 W2060 I2100 N2101 Q2104	W1990-I1992 HydrophobicContact CD2-CG2 3.81Å; W1990-I1992 VanDerWaalsContact CE2-CG2 3.43Å; W1990-I1992 HydrophobicContact CE3-CG2 4.48Å; W1990-I1992 HydrophobicContact CG-CG2 4.11Å; W1990-I1992 HydrophobicContact CH2-CG2 4.4Å; W1990-I1992 HydrophobicContact CZ2-CG2 3.74Å; W1990-F2055 HydrophobicContact CE3-CG 4.41Å; W1990-F2055 HydrophobicContact CH2-CB 3.69Å; W1990-F2055 AromaticContact CH2-CD1 3.2Å; W1990-F2055 HydrophobicContact CH2-CD1 3.2Å; W1990-F2055 HydrophobicContact CH2-CD2 4.38Å; W1990-F2055 AromaticContact CH2-CE1 3.88Å; W1990-F2055 HydrophobicContact CH2-CE1 3.88Å; W1990-F2055 AromaticContact CH2-CG 3.5Å; W1990-F2055 HydrophobicContact CH2-CG 3.5Å; W1990-F2055 HydrophobicContact CZ2-CB 3.59Å; W1990-F2055 HydrophobicContact CZ2-CD1 4.05Å; W1990-F2055 AromaticContact CZ2-CG 3.94Å; W1990-F2055 HydrophobicContact CZ2-CG 3.94Å; W1990-F2055 HydrophobicContact CZ3-CB 4.31Å; W1990-F2055 AromaticContact CZ3-CD1 3.46Å; W1990-F2055 HydrophobicContact CZ3-CD1 3.46Å; W1990-F2055 VanDerWaalsContact CZ3-CD1 3.46Å; W1990-F2055 HydrophobicContact CZ3-CD2 4.18Å; W1990-F2055 AromaticContact CZ3-CE1 3.69Å; W1990-F2055 HydrophobicContact CZ3-CE1 3.69Å; W1990-F2055 HydrophobicContact CZ3-CE2 4.36Å; W1990-F2055 AromaticContact CZ3-CG 3.72Å; W1990-F2055 HydrophobicContact CZ3-CG 3.72Å; W1990-F2055 HydrophobicContact CZ3-CZ 4.14Å; W1990-K2057 PolarHBondContact NE1-O 2.77Å; W1990-W2060 HydrophobicContact CB-CE3 3.55Å; W1990-W2060 HydrophobicContact CB-CZ3 3.62Å; W1990-W2060 HydrophobicContact CG-CE3 4.38Å; W1990-W2060 VanDerWaalsContact N-CE3 3.29Å; W1990-I2100 VanDerWaalsContact O-CA 3.28Å; W1990-I2100 WeakPolarHBondContact O-CA 3.44Å; W1990-I2100 WeakPolarHBondContact O-CB 3.07Å; W1990-N2101 HydrophobicContact CD2-CB 4.42Å; W1990-N2101 HydrophobicContact CE3-CB 3.88Å; W1990-N2101 HydrophobicContact CZ3-CB 4.11Å; W1990-N2101 WeakPolarHBondContact CZ3-ND2 3.46Å; W1990-N2101 PolarHBondContact O-N 3.01Å; W1990-Q2104 PolarHBondContact O-NE2 3.3Å
1991	V	87.6	Confident	78.5	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	107.6	180	-167.1	0	0	0	0	108.5	L1999 F2020 G2058 L2059 F2061 I2093 L2098	V1991-L1999 HydrophobicContact CB-CD1 4.43Å; V1991-L1999 HydrophobicContact CG1-CD1 3.85Å; V1991-F2020 HydrophobicContact CG2-CD2 4.03Å; V1991-F2020 HydrophobicContact CG2-CE2 3.86Å; V1991-G2058 CarbonylContact O-C 3.47Å; V1991-G2058 WeakPolarHBondContact O-CA 3.31Å; V1991-L2059 PolarHBondContact N-O 2.63Å; V1991-L2059 PolarHBondContact O-N 3.03Å; V1991-F2061 HydrophobicContact CB-CD2 4.3Å; V1991-F2061 HydrophobicContact CB-CE2 4.03Å; V1991-F2061 HydrophobicContact CG2-CD2 3.55Å; V1991-F2061 HydrophobicContact CG2-CE2 3.63Å; V1991-I2093 HydrophobicContact CG1-CD1 4.24Å; V1991-I2093 HydrophobicContact CG2-CD1 3.74Å; V1991-L2098 HydrophobicContact CG1-CB 3.86Å; V1991-L2098 HydrophobicContact CG1-CD2 4.32Å; V1991-L2098 HydrophobicContact CG1-CG 4.48Å
1992	I	85.9	Confident	78.9	Confident	41 Å²	41	51.6 Å²	51.6	21%	0.21	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-26.6	-170.2	53.3	167.5	0	0	0	113.9	W1990 L1999 Y2099 N2101	W1990-I1992 HydrophobicContact CD2-CG2 3.81Å; W1990-I1992 VanDerWaalsContact CE2-CG2 3.43Å; W1990-I1992 HydrophobicContact CE3-CG2 4.48Å; W1990-I1992 HydrophobicContact CG-CG2 4.11Å; W1990-I1992 HydrophobicContact CH2-CG2 4.4Å; W1990-I1992 HydrophobicContact CZ2-CG2 3.74Å; I1992-L1999 PolarHBondContact O-N 3.34Å; I1992-Y2099 WeakPolarHBondContact CG1-O 3.14Å; I1992-Y2099 PolarHBondContact N-O 2.82Å; I1992-N2101 HydrophobicContact CD1-CB 4.01Å; I1992-N2101 HydrophobicContact CG1-CB 4.43Å; I1992-N2101 HydrophobicContact CG2-CB 3.94Å
1993	R	79.1	Confident	78.4	Confident	83 Å²	83	59.4 Å²	59.4	31%	0.313	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	153.4	-177.5	64.7	-174	168.5	90.8	2	112.4	N1995 D1997 Y2099	R1993-N1995 WeakPolarHBondContact CD-O 3.47Å; R1993-N1995 PolarHBondContact NH1-O 3.46Å; R1993-D1997 CarbonylContact C-O 3.57Å; R1993-D1997 WeakPolarHBondContact CA-O 3.38Å; R1993-D1997 VanDerWaalsContact CB-O 3.25Å; R1993-D1997 WeakPolarHBondContact CB-O 3.45Å; R1993-Y2099 HydrophobicContact CG-CD2 4.28Å; R1993-Y2099 HydrophobicContact CG-CG 4.3Å; R1993-Y2099 VanDerWaalsContact CZ-CG 3.49Å; R1993-Y2099 PolarHBondContact N-O 3.39Å; R1993-Y2099 VanDerWaalsContact NH2-CD1 3.3Å; R1993-Y2099 PolarHBondContact O-N 3.05Å
1994	R	85.1	Confident	78.4	Confident	78 Å²	78	60.2 Å²	60.2	29%	0.294	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	120.1	164.5	179.5	-176.5	176.7	-179.2	0.4	107.3	Q1996 D1997 L1999 E2097 L2098	R1994-Q1996 PolarHBondContact O-N 2.63Å; R1994-D1997 PolarHBondContact N-O 3.18Å; R1994-D1997 WeakPolarHBondContact O-CA 3.44Å; R1994-D1997 WeakPolarHBondContact O-CB 3.37Å; R1994-D1997 PolarHBondContact O-N 3.26Å; R1994-L1999 HydrophobicContact CB-CD1 4.5Å; R1994-L1999 HydrophobicContact CB-CD2 4.06Å; R1994-L1999 HydrophobicContact CB-CG 4.33Å; R1994-E2097 CarbonylContact C-O 3.51Å; R1994-E2097 VanDerWaalsContact CA-O 3.27Å; R1994-E2097 WeakPolarHBondContact CA-O 3.38Å; R1994-E2097 HydrophobicContact CG-CB 3.92Å; R1994-E2097 IonicContact CZ-OE2 3.92Å; R1994-E2097 IonicContact NE-OE2 2.67Å; R1994-E2097 PolarHBondContact NE-OE2 3.1Å; R1994-E2097 IonicContact NH2-OE2 2.6Å; R1994-E2097 PolarHBondContact NH2-OE2 3.42Å; R1994-L2098 HydrophobicContact CB-CD2 4.06Å; R1994-L2098 HydrophobicContact CG-CD2 4.11Å
1995	N	80.3	Confident	78.6	Confident	59 Å²	59	57.9 Å²	57.9	32%	0.316	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	-111.9	-167.9	-67.3	-28	0	0	0	111.4	R1993 E2097	R1993-N1995 WeakPolarHBondContact CD-O 3.47Å; R1993-N1995 PolarHBondContact NH1-O 3.46Å; N1995-E2097 PolarHBondContact N-O 3.04Å; N1995-E2097 PolarHBondContact ND2-OE1 3.19Å; N1995-E2097 WeakPolarHBondContact OD1-CB 3.28Å; N1995-E2097 WeakPolarHBondContact OD1-CG 3.41Å
1996	Q	75	Confident	78.4	Confident	178 Å²	178	60 Å²	60	83%	0.832	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-13.6	176	-61.8	-176.8	1.3	0	0	112.7	R1994 P1998	R1994-Q1996 PolarHBondContact O-N 2.63Å; Q1996-P1998 VanDerWaalsContact O-CD 3.25Å; Q1996-P1998 WeakPolarHBondContact O-CD 3.23Å
1997	D	71.2	Confident	78.1	Confident	113 Å²	113	61.3 Å²	61.3	60%	0.604	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	113	-177.6	-61.7	-48.1	0	0	0	110.6	R1993 R1994 L1999	R1993-D1997 CarbonylContact C-O 3.57Å; R1993-D1997 WeakPolarHBondContact CA-O 3.38Å; R1993-D1997 VanDerWaalsContact CB-O 3.25Å; R1993-D1997 WeakPolarHBondContact CB-O 3.45Å; R1994-D1997 PolarHBondContact N-O 3.18Å; R1994-D1997 WeakPolarHBondContact O-CA 3.44Å; R1994-D1997 WeakPolarHBondContact O-CB 3.37Å; R1994-D1997 PolarHBondContact O-N 3.26Å; D1997-L1999 PolarHBondContact O-N 3.47Å
1998	P	76.1	Confident	77.3	Confident	61 Å²	61	64.3 Å²	64.3	40%	0.396	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	125.3	172	25.6	-31.6	0	0	0	109.1	Q1996 Y2000	Q1996-P1998 VanDerWaalsContact O-CD 3.25Å; Q1996-P1998 WeakPolarHBondContact O-CD 3.23Å; P1998-Y2000 HydrophobicContact CB-CE2 4.07Å; P1998-Y2000 HydrophobicContact CG-CE2 3.82Å; P1998-Y2000 WeakPolarHBondContact O-CD2 3.45Å; P1998-Y2000 VanDerWaalsContact O-CE2 3.28Å; P1998-Y2000 WeakPolarHBondContact O-CE2 3.11Å
1999	L	83.8	Confident	76.7	Confident	7 Å²	7	68.9 Å²	68.9	4%	0.037	35%	0.351	C	S	.	.			trans	-72.6	144.1	177.6	-69.1	165.5	0	0	0	108.9	V1991 I1992 R1994 D1997 Y2005 I2016 G2058 L2059	V1991-L1999 HydrophobicContact CB-CD1 4.43Å; V1991-L1999 HydrophobicContact CG1-CD1 3.85Å; I1992-L1999 PolarHBondContact O-N 3.34Å; R1994-L1999 HydrophobicContact CB-CD1 4.5Å; R1994-L1999 HydrophobicContact CB-CD2 4.06Å; R1994-L1999 HydrophobicContact CB-CG 4.33Å; D1997-L1999 PolarHBondContact O-N 3.47Å; L1999-Y2005 HydrophobicContact CD2-CE2 4.46Å; L1999-Y2005 VanDerWaalsContact CD2-OH 3.29Å; L1999-Y2005 WeakPolarHBondContact CD2-OH 3.28Å; L1999-I2016 HydrophobicContact CD1-CD1 3.99Å; L1999-I2016 HydrophobicContact CD2-CD1 3.74Å; L1999-G2058 WeakPolarHBondContact O-CA 3.36Å; L1999-G2058 PolarHBondContact O-N 3Å; L1999-L2059 HydrophobicContact CB-CG 4.22Å; L1999-L2059 HydrophobicContact CD1-CD1 4.23Å; L1999-L2059 HydrophobicContact CD1-CG 4.4Å; L1999-L2059 HydrophobicContact CD2-CD1 4.44Å
2000	Y	79.4	Confident	75.9	Confident	120 Å²	120	69.6 Å²	69.6	47%	0.471	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-133.8	125	171.1	-60.3	-88.1	0	0	0	108.1	P1998 G2002 Y2005 K2057	P1998-Y2000 HydrophobicContact CB-CE2 4.07Å; P1998-Y2000 HydrophobicContact CG-CE2 3.82Å; P1998-Y2000 WeakPolarHBondContact O-CD2 3.45Å; P1998-Y2000 VanDerWaalsContact O-CE2 3.28Å; P1998-Y2000 WeakPolarHBondContact O-CE2 3.11Å; Y2000-G2002 PolarHBondContact O-N 3.47Å; Y2000-Y2005 WeakPolarHBondContact O-CD2 3.46Å; Y2000-Y2005 WeakPolarHBondContact O-CE2 3.45Å; Y2000-K2057 HydrophobicContact CD1-CB 4.42Å; Y2000-K2057 HydrophobicContact CD1-CG 4.21Å; Y2000-K2057 HydrophobicContact CE1-CB 4.26Å; Y2000-K2057 HydrophobicContact CE1-CD 3.58Å; Y2000-K2057 HydrophobicContact CE1-CG 3.68Å; Y2000-K2057 PolarHBondContact OH-NZ 2.93Å
2001	Y	80.5	Confident	75.2	Confident	57 Å²	57	73.9 Å²	73.9	22%	0.224	39%	0.386	C	S	.	.			trans	-63.9	128.3	173.1	-173.4	-77.8	0	0	0	111.1	S2006 I2045 Q2046 N2047 G2058 L2059	Y2001-S2006 VanDerWaalsContact OH-CB 3.29Å; Y2001-S2006 WeakPolarHBondContact OH-CB 3.29Å; Y2001-I2045 HydrophobicContact CD2-CG2 4.49Å; Y2001-I2045 HydrophobicContact CE2-CG2 4.47Å; Y2001-I2045 WeakPolarHBondContact CE2-O 3.44Å; Y2001-Q2046 VanDerWaalsContact CD2-C 3.43Å; Y2001-Q2046 WeakPolarHBondContact CD2-O 3.06Å; Y2001-N2047 WeakPolarHBondContact CB-ND2 3.16Å; Y2001-N2047 HydrophobicContact CD1-CB 3.46Å; Y2001-N2047 VanDerWaalsContact CD1-CB 3.46Å; Y2001-N2047 VanDerWaalsContact CD1-CG 3.45Å; Y2001-N2047 WeakPolarHBondContact CD1-ND2 3.13Å; Y2001-N2047 HydrophobicContact CD2-CB 3.65Å; Y2001-N2047 VanDerWaalsContact CD2-N 3.34Å; Y2001-N2047 HydrophobicContact CE1-CB 3.79Å; Y2001-N2047 HydrophobicContact CE2-CB 3.98Å; Y2001-N2047 VanDerWaalsContact CE2-N 3.29Å; Y2001-N2047 HydrophobicContact CG-CB 3.34Å; Y2001-G2058 PolarHBondContact N-O 3.42Å; Y2001-L2059 HydrophobicContact CD2-CD2 3.79Å; Y2001-L2059 HydrophobicContact CG-CD2 4.22Å
2002	G	76.4	Confident	74.7	Confident	32 Å²	32	76.8 Å²	76.8	33%	0.33	40%	0.401	S	S	.	.	S	Bend	trans	-162.3	-169	177.2	0	0	0	0	0	109.6	Y2000 N2004 Y2005 S2006	Y2000-G2002 PolarHBondContact O-N 3.47Å; G2002-N2004 VanDerWaalsContact C-N 3.25Å; G2002-N2004 PolarHBondContact O-N 3.45Å; G2002-N2004 VanDerWaalsContact O-N 3.1Å; G2002-Y2005 PolarHBondContact O-N 2.04Å; G2002-S2006 PolarHBondContact O-N 3.18Å; G2002-S2006 VanDerWaalsContact O-N 3.14Å
2003	K	63.8	Low	74.7	Confident	177 Å²	177	76.3 Å²	76.3	77%	0.77	40%	0.397	S	S	*	.	H	α-helix	trans	-50.6	-42.2	-172.1	-71.3	-164.7	173	-166.5	0	113.7	Y2005 S2006 D2007	K2003-Y2005 PolarHBondContact O-N 3.47Å; K2003-S2006 WeakPolarHBondContact CA-OG 3.43Å; K2003-S2006 PolarHBondContact O-N 3.21Å; K2003-S2006 PolarHBondContact O-OG 3.1Å; K2003-D2007 VanDerWaalsContact O-CB 3.22Å; K2003-D2007 WeakPolarHBondContact O-CB 3.29Å; K2003-D2007 PolarHBondContact O-N 2.02Å
2004	N	73.5	Confident	74.7	Confident	93 Å²	93	74.9 Å²	74.9	50%	0.497	39%	0.393	S	S	.	.	H	α-helix	trans	-64.3	-8.6	-179.5	-54.9	9.8	0	0	0	115.2	G2002 S2010 L2012 R2013	G2002-N2004 VanDerWaalsContact C-N 3.25Å; G2002-N2004 PolarHBondContact O-N 3.45Å; G2002-N2004 VanDerWaalsContact O-N 3.1Å; N2004-S2010 WeakPolarHBondContact O-CB 3.25Å; N2004-S2010 PolarHBondContact O-OG 2.88Å; N2004-L2012 HydrophobicContact CB-CB 4.17Å; N2004-L2012 HydrophobicContact CB-CD2 3.68Å; N2004-R2013 PolarHBondContact O-N 3.38Å
2005	Y	75.4	Confident	74.5	Confident	28 Å²	28	73.2 Å²	73.2	11%	0.11	40%	0.396	C	S	.	.	H	α-helix	trans	-120.1	-20.4	176.2	-60	-63.3	0	0	0	113.3	L1999 Y2000 G2002 K2003 L2012 R2013 I2016 L2059	L1999-Y2005 HydrophobicContact CD2-CE2 4.46Å; L1999-Y2005 VanDerWaalsContact CD2-OH 3.29Å; L1999-Y2005 WeakPolarHBondContact CD2-OH 3.28Å; Y2000-Y2005 WeakPolarHBondContact O-CD2 3.46Å; Y2000-Y2005 WeakPolarHBondContact O-CE2 3.45Å; G2002-Y2005 PolarHBondContact O-N 2.04Å; K2003-Y2005 PolarHBondContact O-N 3.47Å; Y2005-L2012 HydrophobicContact CE1-CD2 3.79Å; Y2005-L2012 HydrophobicContact CE1-CG 3.87Å; Y2005-L2012 HydrophobicContact CE2-CD2 4.18Å; Y2005-L2012 WeakPolarHBondContact OH-CD2 3.4Å; Y2005-R2013 WeakPolarHBondContact O-CD 3.27Å; Y2005-R2013 PolarHBondContact O-NH1 2.62Å; Y2005-I2016 HydrophobicContact CD1-CG2 3.93Å; Y2005-I2016 HydrophobicContact CE1-CB 4.33Å; Y2005-I2016 HydrophobicContact CE1-CD1 3.79Å; Y2005-I2016 HydrophobicContact CE1-CG2 3.94Å; Y2005-L2059 HydrophobicContact CD1-CD1 3.62Å; Y2005-L2059 HydrophobicContact CD1-CD2 4.43Å; Y2005-L2059 HydrophobicContact CD2-CD1 4.1Å; Y2005-L2059 HydrophobicContact CD2-CD2 3.67Å; Y2005-L2059 HydrophobicContact CD2-CG 4.43Å; Y2005-L2059 HydrophobicContact CE1-CD1 3.79Å; Y2005-L2059 HydrophobicContact CE2-CD1 4.24Å; Y2005-L2059 HydrophobicContact CE2-CD2 4.32Å; Y2005-L2059 HydrophobicContact CG-CD1 3.77Å; Y2005-L2059 HydrophobicContact CG-CD2 3.72Å; Y2005-L2059 HydrophobicContact CG-CG 4.4Å
2006	S	70.4	Confident	74.9	Confident	56 Å²	56	70.6 Å²	70.6	39%	0.392	38%	0.382	S	S	.	.	H	α-helix	trans	-82.8	-25	171.7	63.2	0	0	0	0	113.4	Y2001 G2002 K2003	Y2001-S2006 VanDerWaalsContact OH-CB 3.29Å; Y2001-S2006 WeakPolarHBondContact OH-CB 3.29Å; G2002-S2006 PolarHBondContact O-N 3.18Å; G2002-S2006 VanDerWaalsContact O-N 3.14Å; K2003-S2006 WeakPolarHBondContact CA-OG 3.43Å; K2003-S2006 PolarHBondContact O-N 3.21Å; K2003-S2006 PolarHBondContact O-OG 3.1Å
2007	D	64.7	Low	75.6	Confident	81 Å²	81	63.4 Å²	63.4	43%	0.433	35%	0.35	S	S	.	.			trans	-81.7	118.9	177.4	176.3	2.6	0	0	0	110.3	K2003 D2009 S2010 R2013	K2003-D2007 VanDerWaalsContact O-CB 3.22Å; K2003-D2007 WeakPolarHBondContact O-CB 3.29Å; K2003-D2007 PolarHBondContact O-N 2.02Å; D2007-D2009 VanDerWaalsContact C-N 3.27Å; D2007-D2009 PolarHBondContact O-N 2.87Å; D2007-D2009 PolarHBondContact OD1-N 3.28Å; D2007-S2010 WeakPolarHBondContact O-CB 3.43Å; D2007-S2010 PolarHBondContact O-N 2.95Å; D2007-R2013 WeakPolarHBondContact O-CB 3.23Å; D2007-R2013 WeakPolarHBondContact O-CD 3.22Å
2008	A	63.2	Low	76.3	Confident	66 Å²	66	63.2 Å²	63.2	55%	0.545	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-36.7	179.4	0	0	0	0	0	112.7	K2014	A2008-K2014 WeakPolarHBondContact O-CE 3.31Å
2009	D	67	Low	76.7	Confident	100 Å²	100	62 Å²	62	54%	0.535	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-11.7	-175.8	-97.4	-49.5	0	0	0	113.8	D2007 P2011 K2014	D2007-D2009 VanDerWaalsContact C-N 3.27Å; D2007-D2009 PolarHBondContact O-N 2.87Å; D2007-D2009 PolarHBondContact OD1-N 3.28Å; D2009-P2011 WeakPolarHBondContact O-CD 3.22Å; D2009-K2014 IonicContact OD1-NZ 2.83Å; D2009-K2014 PolarHBondContact OD1-NZ 3.41Å
2010	S	70.5	Confident	77.1	Confident	15 Å²	15	61.6 Å²	61.6	11%	0.105	33%	0.333	C	S	.	.			trans	-58.3	126.8	-176.5	-165.6	0	0	0	0	111.6	N2004 D2007 L2012 R2013 K2014	N2004-S2010 WeakPolarHBondContact O-CB 3.25Å; N2004-S2010 PolarHBondContact O-OG 2.88Å; D2007-S2010 WeakPolarHBondContact O-CB 3.43Å; D2007-S2010 PolarHBondContact O-N 2.95Å; S2010-L2012 PolarHBondContact O-N 3.48Å; S2010-L2012 VanDerWaalsContact O-N 3.07Å; S2010-R2013 PolarHBondContact O-N 2.97Å; S2010-K2014 PolarHBondContact O-N 3.49Å
2011	P	70.9	Confident	77.7	Confident	107 Å²	107	57.7 Å²	57.7	70%	0.695	32%	0.319	S	S	*	.	H	α-helix	trans	-55.9	-28.5	174.7	-27.1	35.2	0	0	0	112.9	D2009 A2015	D2009-P2011 WeakPolarHBondContact O-CD 3.22Å; P2011-A2015 VanDerWaalsContact O-CB 3.24Å; P2011-A2015 WeakPolarHBondContact O-CB 3.24Å; P2011-A2015 PolarHBondContact O-N 3.15Å
2012	L	77	Confident	77.9	Confident	61 Å²	61	58 Å²	58	32%	0.319	32%	0.324	S	S	.	.	H	α-helix	trans	-73.3	-35.2	177	-154	74.6	0	0	0	112.3	N2004 Y2005 S2010 I2016	N2004-L2012 HydrophobicContact CB-CB 4.17Å; N2004-L2012 HydrophobicContact CB-CD2 3.68Å; Y2005-L2012 HydrophobicContact CE1-CD2 3.79Å; Y2005-L2012 HydrophobicContact CE1-CG 3.87Å; Y2005-L2012 HydrophobicContact CE2-CD2 4.18Å; Y2005-L2012 WeakPolarHBondContact OH-CD2 3.4Å; S2010-L2012 PolarHBondContact O-N 3.48Å; S2010-L2012 VanDerWaalsContact O-N 3.07Å; L2012-I2016 WeakPolarHBondContact O-CB 3.43Å; L2012-I2016 WeakPolarHBondContact O-CG2 3.11Å; L2012-I2016 PolarHBondContact O-N 3.35Å; L2012-I2016 VanDerWaalsContact O-N 3.13Å
2013	R	84.8	Confident	78.4	Confident	31 Å²	31	56.4 Å²	56.4	12%	0.117	31%	0.308	C	S	.	.	H	α-helix	trans	-68.6	-49.3	171.2	-171.7	-177.8	166	120.2	-13.5	110.5	N2004 Y2005 D2007 S2010 A2015 I2016 V2017 D2044 I2045	N2004-R2013 PolarHBondContact O-N 3.38Å; Y2005-R2013 WeakPolarHBondContact O-CD 3.27Å; Y2005-R2013 PolarHBondContact O-NH1 2.62Å; D2007-R2013 WeakPolarHBondContact O-CB 3.23Å; D2007-R2013 WeakPolarHBondContact O-CD 3.22Å; S2010-R2013 PolarHBondContact O-N 2.97Å; R2013-A2015 PolarHBondContact O-N 3.26Å; R2013-I2016 WeakPolarHBondContact O-CG2 3.39Å; R2013-I2016 PolarHBondContact O-N 3.22Å; R2013-I2016 VanDerWaalsContact O-N 3.14Å; R2013-V2017 HydrophobicContact CG-CG2 4.32Å; R2013-V2017 WeakPolarHBondContact O-CG2 3.45Å; R2013-V2017 PolarHBondContact O-N 2.97Å; R2013-D2044 IonicContact CZ-OD1 2.83Å; R2013-D2044 IonicContact NH1-OD1 2.64Å; R2013-D2044 PolarHBondContact NH1-OD1 3.04Å; R2013-D2044 IonicContact NH2-OD1 3.28Å; R2013-D2044 PolarHBondContact NH2-OD1 2.79Å; R2013-I2045 HydrophobicContact CG-CD1 4.09Å
2014	K	79.3	Confident	79.7	Confident	52 Å²	52	48 Å²	48	23%	0.226	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-45.8	179.5	-68.8	177.5	178.2	169.4	0	111.5	A2008 D2009 S2010 I2016 E2018 G2352	A2008-K2014 WeakPolarHBondContact O-CE 3.31Å; D2009-K2014 IonicContact OD1-NZ 2.83Å; D2009-K2014 PolarHBondContact OD1-NZ 3.41Å; S2010-K2014 PolarHBondContact O-N 3.49Å; K2014-I2016 PolarHBondContact O-N 2.03Å; K2014-E2018 WeakPolarHBondContact O-CB 3.12Å; K2014-E2018 PolarHBondContact O-N 3.46Å; K2014-E2018 VanDerWaalsContact O-N 3.08Å; K2014-G2352 PolarHBondContact NZ-O 3.01Å
2015	A	82.4	Confident	80.2	Confident	43 Å²	43	47.3 Å²	47.3	36%	0.355	26%	0.264	S	S	.	.	H	α-helix	trans	-65.4	-34.9	175.8	0	0	0	0	0	114.1	P2011 R2013 M2019	P2011-A2015 VanDerWaalsContact O-CB 3.24Å; P2011-A2015 WeakPolarHBondContact O-CB 3.24Å; P2011-A2015 PolarHBondContact O-N 3.15Å; R2013-A2015 PolarHBondContact O-N 3.26Å; A2015-M2019 WeakPolarHBondContact O-CE 3.13Å; A2015-M2019 WeakPolarHBondContact O-CG 3.22Å; A2015-M2019 PolarHBondContact O-N 2.96Å; A2015-M2019 VanDerWaalsContact O-N 3.11Å
2016	I	88.4	Confident	80.6	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-80.6	-28.4	-179.8	-149.6	161.3	0	0	0	113.2	L1999 Y2005 L2012 R2013 K2014 M2019 F2020 I2045 L2059 F2061 L2098	L1999-I2016 HydrophobicContact CD1-CD1 3.99Å; L1999-I2016 HydrophobicContact CD2-CD1 3.74Å; Y2005-I2016 HydrophobicContact CD1-CG2 3.93Å; Y2005-I2016 HydrophobicContact CE1-CB 4.33Å; Y2005-I2016 HydrophobicContact CE1-CD1 3.79Å; Y2005-I2016 HydrophobicContact CE1-CG2 3.94Å; L2012-I2016 WeakPolarHBondContact O-CB 3.43Å; L2012-I2016 WeakPolarHBondContact O-CG2 3.11Å; L2012-I2016 PolarHBondContact O-N 3.35Å; L2012-I2016 VanDerWaalsContact O-N 3.13Å; R2013-I2016 WeakPolarHBondContact O-CG2 3.39Å; R2013-I2016 PolarHBondContact O-N 3.22Å; R2013-I2016 VanDerWaalsContact O-N 3.14Å; K2014-I2016 PolarHBondContact O-N 2.03Å; I2016-M2019 HydrophobicContact CB-CE 4.32Å; I2016-M2019 HydrophobicContact CG1-CE 4.1Å; I2016-F2020 VanDerWaalsContact O-CB 3.24Å; I2016-F2020 WeakPolarHBondContact O-CB 3.45Å; I2016-F2020 PolarHBondContact O-N 3.12Å; I2016-I2045 HydrophobicContact CG2-CD1 3.71Å; I2016-L2059 HydrophobicContact CD1-CD1 3.76Å; I2016-L2059 HydrophobicContact CG2-CD1 4.39Å; I2016-F2061 HydrophobicContact CG1-CZ 4.28Å; I2016-F2061 HydrophobicContact CG2-CZ 4.08Å; I2016-L2098 HydrophobicContact CD1-CD2 3.87Å; I2016-L2098 HydrophobicContact CG1-CD1 3.97Å; I2016-L2098 HydrophobicContact CG1-CD2 3.73Å; I2016-L2098 HydrophobicContact CG1-CG 4.5Å
2017	V	89.7	Confident	81.4	Confident	27 Å²	27	48 Å²	48	16%	0.164	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-48.3	167	168.7	0	0	0	0	110	R2013 M2019 F2020 E2021 V2042 I2045	R2013-V2017 HydrophobicContact CG-CG2 4.32Å; R2013-V2017 WeakPolarHBondContact O-CG2 3.45Å; R2013-V2017 PolarHBondContact O-N 2.97Å; V2017-M2019 PolarHBondContact O-N 3.4Å; V2017-F2020 WeakPolarHBondContact O-CA 3.31Å; V2017-F2020 WeakPolarHBondContact O-CB 3.2Å; V2017-F2020 PolarHBondContact O-N 2.82Å; V2017-E2021 HydrophobicContact CG1-CG 4.3Å; V2017-E2021 WeakPolarHBondContact CG1-OE1 3.36Å; V2017-E2021 WeakPolarHBondContact O-CG 3.31Å; V2017-E2021 PolarHBondContact O-N 2.97Å; V2017-V2042 HydrophobicContact CG1-CB 3.99Å; V2017-V2042 HydrophobicContact CG1-CG2 3.99Å; V2017-V2042 HydrophobicContact CG2-CB 4.37Å; V2017-V2042 HydrophobicContact CG2-CG1 4.29Å; V2017-I2045 HydrophobicContact CG2-CD1 3.94Å; V2017-I2045 HydrophobicContact CG2-CG1 4.45Å
2018	E	85.2	Confident	82.4	Confident	109 Å²	109	44.1 Å²	44.1	51%	0.509	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-42.9	-178.7	-167.6	162.7	161.3	0	0	112.5	K2014 F2020 D2022 R2353	K2014-E2018 WeakPolarHBondContact O-CB 3.12Å; K2014-E2018 PolarHBondContact O-N 3.46Å; K2014-E2018 VanDerWaalsContact O-N 3.08Å; E2018-F2020 VanDerWaalsContact C-N 3.28Å; E2018-F2020 PolarHBondContact O-N 3.31Å; E2018-D2022 VanDerWaalsContact O-CB 3.28Å; E2018-D2022 WeakPolarHBondContact O-CB 3.49Å; E2018-D2022 PolarHBondContact O-N 2.03Å; E2018-R2353 IonicContact OE2-NH2 2.79Å; E2018-R2353 PolarHBondContact OE2-NH2 3.35Å
2019	M	84.6	Confident	83.2	Confident	35 Å²	35	42.6 Å²	42.6	17%	0.172	23%	0.231	C	C	.	.	H	α-helix	trans	-66.1	-26.1	171.2	-73.3	-174.3	-65.6	0	0	114	A2015 I2016 V2017 G2023 T2096 E2097 L2098	A2015-M2019 WeakPolarHBondContact O-CE 3.13Å; A2015-M2019 WeakPolarHBondContact O-CG 3.22Å; A2015-M2019 PolarHBondContact O-N 2.96Å; A2015-M2019 VanDerWaalsContact O-N 3.11Å; I2016-M2019 HydrophobicContact CB-CE 4.32Å; I2016-M2019 HydrophobicContact CG1-CE 4.1Å; V2017-M2019 PolarHBondContact O-N 3.4Å; M2019-G2023 PolarHBondContact O-N 2.9Å; M2019-T2096 PolarHBondContact O-OG1 2.77Å; M2019-E2097 HydrophobicContact SD-CB 4.44Å; M2019-L2098 HydrophobicContact CB-CD1 3.87Å; M2019-L2098 HydrophobicContact CB-CG 4.2Å; M2019-L2098 HydrophobicContact CE-CD2 4.36Å
2020	F	93.5	Very high	83.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-76.1	-50.5	176.5	-176.7	-88	0	0	0	110.4	L1989 V1991 I2016 V2017 E2018 G2023 I2024 V2042 F2061 F2063 I2093 L2098	L1989-F2020 HydrophobicContact CB-CE2 3.89Å; L1989-F2020 HydrophobicContact CB-CZ 3.89Å; L1989-F2020 HydrophobicContact CD2-CE2 3.66Å; L1989-F2020 HydrophobicContact CD2-CZ 3.99Å; L1989-F2020 HydrophobicContact CG-CE2 4.45Å; V1991-F2020 HydrophobicContact CG2-CD2 4.03Å; V1991-F2020 HydrophobicContact CG2-CE2 3.86Å; I2016-F2020 VanDerWaalsContact O-CB 3.24Å; I2016-F2020 WeakPolarHBondContact O-CB 3.45Å; I2016-F2020 PolarHBondContact O-N 3.12Å; V2017-F2020 WeakPolarHBondContact O-CA 3.31Å; V2017-F2020 WeakPolarHBondContact O-CB 3.2Å; V2017-F2020 PolarHBondContact O-N 2.82Å; E2018-F2020 VanDerWaalsContact C-N 3.28Å; E2018-F2020 PolarHBondContact O-N 3.31Å; F2020-G2023 CarbonylContact O-C 3.55Å; F2020-G2023 WeakPolarHBondContact O-CA 3.26Å; F2020-G2023 PolarHBondContact O-N 3.27Å; F2020-G2023 VanDerWaalsContact O-N 3.09Å; F2020-I2024 HydrophobicContact CD1-CG1 3.9Å; F2020-I2024 HydrophobicContact CE1-CD1 4.09Å; F2020-I2024 HydrophobicContact CE1-CG1 3.56Å; F2020-I2024 HydrophobicContact CZ-CD1 3.99Å; F2020-I2024 HydrophobicContact CZ-CG1 3.98Å; F2020-I2024 WeakPolarHBondContact O-CG1 3.34Å; F2020-I2024 PolarHBondContact O-N 2.78Å; F2020-V2042 HydrophobicContact CD1-CG2 3.57Å; F2020-V2042 HydrophobicContact CE1-CG2 4.07Å; F2020-V2042 HydrophobicContact CG-CG2 4.4Å; F2020-F2061 HydrophobicContact CB-CD1 4.03Å; F2020-F2061 HydrophobicContact CB-CE1 3.58Å; F2020-F2061 HydrophobicContact CB-CZ 4.12Å; F2020-F2061 AromaticContact CD1-CD1 3.75Å; F2020-F2061 HydrophobicContact CD1-CD1 3.75Å; F2020-F2061 HydrophobicContact CD1-CE1 4.2Å; F2020-F2061 HydrophobicContact CD1-CG 4.34Å; F2020-F2061 HydrophobicContact CD2-CB 4.24Å; F2020-F2061 AromaticContact CD2-CD1 3.55Å; F2020-F2061 HydrophobicContact CD2-CD1 3.55Å; F2020-F2061 AromaticContact CD2-CD2 3.87Å; F2020-F2061 HydrophobicContact CD2-CD2 3.87Å; F2020-F2061 AromaticContact CD2-CE1 3.71Å; F2020-F2061 HydrophobicContact CD2-CE1 3.71Å; F2020-F2061 HydrophobicContact CD2-CE2 4.02Å; F2020-F2061 AromaticContact CD2-CG 3.63Å; F2020-F2061 HydrophobicContact CD2-CG 3.63Å; F2020-F2061 AromaticContact CD2-CZ 3.94Å; F2020-F2061 HydrophobicContact CD2-CZ 3.94Å; F2020-F2061 HydrophobicContact CE1-CB 4.03Å; F2020-F2061 HydrophobicContact CE1-CD1 4.04Å; F2020-F2061 HydrophobicContact CE1-CG 4.25Å; F2020-F2061 HydrophobicContact CE2-CB 3.63Å; F2020-F2061 AromaticContact CE2-CD1 3.85Å; F2020-F2061 HydrophobicContact CE2-CD1 3.85Å; F2020-F2061 AromaticContact CE2-CD2 3.84Å; F2020-F2061 HydrophobicContact CE2-CD2 3.84Å; F2020-F2061 HydrophobicContact CE2-CE1 4.44Å; F2020-F2061 HydrophobicContact CE2-CE2 4.44Å; F2020-F2061 AromaticContact CE2-CG 3.51Å; F2020-F2061 HydrophobicContact CE2-CG 3.51Å; F2020-F2061 AromaticContact CG-CD1 3.49Å; F2020-F2061 HydrophobicContact CG-CD1 3.49Å; F2020-F2061 VanDerWaalsContact CG-CD1 3.49Å; F2020-F2061 AromaticContact CG-CE1 3.57Å; F2020-F2061 HydrophobicContact CG-CE1 3.57Å; F2020-F2061 HydrophobicContact CG-CG 4.05Å; F2020-F2061 HydrophobicContact CG-CZ 4.19Å; F2020-F2061 HydrophobicContact CZ-CB 3.52Å; F2020-F2061 HydrophobicContact CZ-CD1 4.1Å; F2020-F2061 AromaticContact CZ-CG 3.85Å; F2020-F2061 HydrophobicContact CZ-CG 3.85Å; F2020-F2063 HydrophobicContact CE1-CB 4.09Å; F2020-F2063 AromaticContact CE1-CD1 3.61Å; F2020-F2063 HydrophobicContact CE1-CD1 3.61Å; F2020-F2063 HydrophobicContact CE1-CD2 4.21Å; F2020-F2063 HydrophobicContact CE1-CE1 4.05Å; F2020-F2063 AromaticContact CE1-CG 3.71Å; F2020-F2063 HydrophobicContact CE1-CG 3.71Å; F2020-F2063 AromaticContact CZ-CD1 3.58Å; F2020-F2063 HydrophobicContact CZ-CD1 3.58Å; F2020-F2063 AromaticContact CZ-CE1 3.67Å; F2020-F2063 HydrophobicContact CZ-CE1 3.67Å; F2020-F2063 HydrophobicContact CZ-CG 4.17Å; F2020-F2063 HydrophobicContact CZ-CZ 4.3Å; F2020-I2093 HydrophobicContact CD2-CD1 3.76Å; F2020-I2093 HydrophobicContact CE2-CD1 3.88Å; F2020-L2098 HydrophobicContact CB-CD1 3.99Å
2021	E	90.2	Very high	84.3	Confident	38 Å²	38	44.6 Å²	44.6	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-46	-179.6	-69.8	173.7	172.7	0	0	111.8	V2017 G2023 I2024 K2025 V2040 A2041 V2042	V2017-E2021 HydrophobicContact CG1-CG 4.3Å; V2017-E2021 WeakPolarHBondContact CG1-OE1 3.36Å; V2017-E2021 WeakPolarHBondContact O-CG 3.31Å; V2017-E2021 PolarHBondContact O-N 2.97Å; E2021-G2023 VanDerWaalsContact C-N 3.28Å; E2021-G2023 PolarHBondContact O-N 2.7Å; E2021-I2024 PolarHBondContact O-N 3.28Å; E2021-K2025 WeakPolarHBondContact O-CB 3.42Å; E2021-K2025 VanDerWaalsContact O-CG 3.24Å; E2021-K2025 WeakPolarHBondContact O-CG 3.5Å; E2021-K2025 PolarHBondContact O-N 2.9Å; E2021-V2040 HydrophobicContact CB-CG1 4.24Å; E2021-V2040 HydrophobicContact CG-CG1 4.46Å; E2021-A2041 WeakPolarHBondContact OE1-CA 3.06Å; E2021-V2042 HydrophobicContact CG-CG2 3.89Å; E2021-V2042 PolarHBondContact OE1-N 3.08Å
2022	D	85.4	Confident	84.3	Confident	62 Å²	62	44 Å²	44	33%	0.332	23%	0.229	S	C	.	.	H	α-helix	trans	-57.3	-41.6	170.2	170.7	64.1	0	0	0	111.9	E2018 K2025 K2026 T2096	E2018-D2022 VanDerWaalsContact O-CB 3.28Å; E2018-D2022 WeakPolarHBondContact O-CB 3.49Å; E2018-D2022 PolarHBondContact O-N 2.03Å; D2022-K2025 PolarHBondContact O-N 3.01Å; D2022-K2026 VanDerWaalsContact O-CB 3.31Å; D2022-K2026 WeakPolarHBondContact O-CB 3.25Å; D2022-K2026 WeakPolarHBondContact O-CG 3.31Å; D2022-K2026 PolarHBondContact O-N 3.28Å; D2022-K2026 WeakPolarHBondContact OD1-CD 3.35Å; D2022-K2026 WeakPolarHBondContact OD1-CE 3.44Å; D2022-K2026 IonicContact OD1-NZ 3.8Å; D2022-K2026 PolarHBondContact OD1-NZ 2.89Å; D2022-K2026 IonicContact OD2-NZ 2.74Å; D2022-K2026 PolarHBondContact OD2-NZ 3.49Å; D2022-T2096 WeakPolarHBondContact OD2-CG2 3.01Å
2023	G	86.2	Confident	84.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-44.2	174.1	0	0	0	0	0	113.1	M2019 F2020 E2021 A2027 I2093 G2094	M2019-G2023 PolarHBondContact O-N 2.9Å; F2020-G2023 CarbonylContact O-C 3.55Å; F2020-G2023 WeakPolarHBondContact O-CA 3.26Å; F2020-G2023 PolarHBondContact O-N 3.27Å; F2020-G2023 VanDerWaalsContact O-N 3.09Å; E2021-G2023 VanDerWaalsContact C-N 3.28Å; E2021-G2023 PolarHBondContact O-N 2.7Å; G2023-A2027 VanDerWaalsContact O-CB 3.26Å; G2023-A2027 WeakPolarHBondContact O-CB 3.41Å; G2023-A2027 PolarHBondContact O-N 3.17Å; G2023-I2093 WeakPolarHBondContact CA-O 2.99Å; G2023-G2094 VanDerWaalsContact O-CA 3.26Å; G2023-G2094 WeakPolarHBondContact O-CA 3.26Å; G2023-G2094 PolarHBondContact O-N 2.73Å
2024	I	91.2	Very high	84	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69.2	-42.4	178	-63.2	-63.3	0	0	0	110.9	L1989 F2020 E2021 K2026 A2027 Y2028 F2037 V2040 F2063 V2065 L2082 I2093	L1989-I2024 HydrophobicContact CD2-CD1 4.31Å; F2020-I2024 HydrophobicContact CD1-CG1 3.9Å; F2020-I2024 HydrophobicContact CE1-CD1 4.09Å; F2020-I2024 HydrophobicContact CE1-CG1 3.56Å; F2020-I2024 HydrophobicContact CZ-CD1 3.99Å; F2020-I2024 HydrophobicContact CZ-CG1 3.98Å; F2020-I2024 WeakPolarHBondContact O-CG1 3.34Å; F2020-I2024 PolarHBondContact O-N 2.78Å; E2021-I2024 PolarHBondContact O-N 3.28Å; I2024-K2026 PolarHBondContact O-N 3.31Å; I2024-A2027 PolarHBondContact O-N 2.61Å; I2024-A2027 VanDerWaalsContact O-N 3.15Å; I2024-Y2028 HydrophobicContact CG2-CD2 3.6Å; I2024-Y2028 HydrophobicContact CG2-CE2 3.7Å; I2024-Y2028 PolarHBondContact O-N 2.9Å; I2024-F2037 HydrophobicContact CG2-CE2 4.38Å; I2024-V2040 HydrophobicContact CB-CG1 4.09Å; I2024-V2040 HydrophobicContact CB-CG2 4.38Å; I2024-V2040 HydrophobicContact CG2-CB 4.13Å; I2024-V2040 HydrophobicContact CG2-CG1 3.98Å; I2024-V2040 HydrophobicContact CG2-CG2 3.97Å; I2024-F2063 HydrophobicContact CD1-CE2 4.19Å; I2024-F2063 HydrophobicContact CD1-CZ 4.12Å; I2024-F2063 HydrophobicContact CG1-CE2 4.36Å; I2024-F2063 HydrophobicContact CG2-CE2 4.27Å; I2024-V2065 HydrophobicContact CG2-CG2 4.37Å; I2024-L2082 HydrophobicContact CD1-CD1 3.86Å; I2024-L2082 HydrophobicContact CD1-CD2 3.95Å; I2024-L2082 HydrophobicContact CD1-CG 4.45Å; I2024-I2093 HydrophobicContact CD1-CG2 3.88Å; I2024-I2093 HydrophobicContact CG1-CG2 4.32Å
2025	K	84.9	Confident	83.7	Confident	78 Å²	78	44.4 Å²	44.4	34%	0.339	25%	0.252	S	S	.	.	H	α-helix	trans	-58.3	-46.3	174.1	-67.8	174.1	-155	-153.4	0	110.6	E2021 D2022 G2029 F2037 D2039 V2040	E2021-K2025 WeakPolarHBondContact O-CB 3.42Å; E2021-K2025 VanDerWaalsContact O-CG 3.24Å; E2021-K2025 WeakPolarHBondContact O-CG 3.5Å; E2021-K2025 PolarHBondContact O-N 2.9Å; D2022-K2025 PolarHBondContact O-N 3.01Å; K2025-G2029 PolarHBondContact O-N 2.93Å; K2025-F2037 HydrophobicContact CB-CE1 4.47Å; K2025-F2037 HydrophobicContact CB-CZ 4.41Å; K2025-F2037 HydrophobicContact CG-CE1 3.96Å; K2025-F2037 HydrophobicContact CG-CZ 3.76Å; K2025-D2039 WeakPolarHBondContact CE-OD1 3.26Å; K2025-D2039 IonicContact NZ-OD1 2.75Å; K2025-D2039 PolarHBondContact NZ-OD1 2.7Å; K2025-D2039 IonicContact NZ-OD2 3.13Å; K2025-V2040 HydrophobicContact CD-CG1 4.26Å; K2025-V2040 VanDerWaalsContact CE-CG1 3.49Å; K2025-V2040 HydrophobicContact CG-CG1 3.7Å
2026	K	84	Confident	83.5	Confident	99 Å²	99	44.3 Å²	44.3	43%	0.43	25%	0.246	S	C	.	.	H	α-helix	trans	-67	-31.8	174.3	-75.7	167.7	176	158.1	0	113.9	D2022 I2024	D2022-K2026 VanDerWaalsContact O-CB 3.31Å; D2022-K2026 WeakPolarHBondContact O-CB 3.25Å; D2022-K2026 WeakPolarHBondContact O-CG 3.31Å; D2022-K2026 PolarHBondContact O-N 3.28Å; D2022-K2026 WeakPolarHBondContact OD1-CD 3.35Å; D2022-K2026 WeakPolarHBondContact OD1-CE 3.44Å; D2022-K2026 IonicContact OD1-NZ 3.8Å; D2022-K2026 PolarHBondContact OD1-NZ 2.89Å; D2022-K2026 IonicContact OD2-NZ 2.74Å; D2022-K2026 PolarHBondContact OD2-NZ 3.49Å; I2024-K2026 PolarHBondContact O-N 3.31Å
2027	A	86	Confident	83.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.9	-53.1	176.7	0	0	0	0	0	111.1	G2023 I2024 G2029 R2030 L2082 S2085 I2086	G2023-A2027 VanDerWaalsContact O-CB 3.26Å; G2023-A2027 WeakPolarHBondContact O-CB 3.41Å; G2023-A2027 PolarHBondContact O-N 3.17Å; I2024-A2027 PolarHBondContact O-N 2.61Å; I2024-A2027 VanDerWaalsContact O-N 3.15Å; A2027-G2029 PolarHBondContact O-N 2.94Å; A2027-R2030 PolarHBondContact O-N 3.09Å; A2027-L2082 HydrophobicContact CB-CD1 3.62Å; A2027-S2085 WeakPolarHBondContact CA-OG 3.27Å; A2027-S2085 WeakPolarHBondContact O-CB 3.39Å; A2027-S2085 PolarHBondContact O-OG 2.83Å; A2027-I2086 HydrophobicContact CB-CG1 4.15Å
2028	Y	86.1	Confident	82.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-29.3	176	-81.3	-70.7	0	0	0	112.4	M1987 I2024 R2030 T2031 L2033 N2034 F2037 V2065 F2067 A2078 L2082	M1987-Y2028 VanDerWaalsContact CE-OH 3.26Å; M1987-Y2028 WeakPolarHBondContact CE-OH 3.46Å; M1987-Y2028 PolarHBondContact SD-OH 3.19Å; I2024-Y2028 HydrophobicContact CG2-CD2 3.6Å; I2024-Y2028 HydrophobicContact CG2-CE2 3.7Å; I2024-Y2028 PolarHBondContact O-N 2.9Å; Y2028-R2030 PolarHBondContact O-N 3.02Å; Y2028-T2031 WeakPolarHBondContact CA-OG1 3.22Å; Y2028-T2031 HydrophobicContact CD1-CG2 4.11Å; Y2028-T2031 WeakPolarHBondContact CD1-OG1 3.48Å; Y2028-T2031 PolarHBondContact O-N 2.81Å; Y2028-T2031 PolarHBondContact O-OG1 2.04Å; Y2028-L2033 HydrophobicContact CD1-CB 4.32Å; Y2028-L2033 HydrophobicContact CE1-CD1 4.31Å; Y2028-N2034 WeakPolarHBondContact O-CB 3.15Å; Y2028-F2037 HydrophobicContact CD1-CD2 4.23Å; Y2028-F2037 AromaticContact CD2-CD2 3.49Å; Y2028-F2037 HydrophobicContact CD2-CD2 3.49Å; Y2028-F2037 VanDerWaalsContact CD2-CD2 3.49Å; Y2028-F2037 AromaticContact CD2-CE2 3.44Å; Y2028-F2037 HydrophobicContact CD2-CE2 3.44Å; Y2028-F2037 VanDerWaalsContact CD2-CE2 3.44Å; Y2028-F2037 HydrophobicContact CE2-CD2 4.25Å; Y2028-F2037 HydrophobicContact CE2-CE2 4.19Å; Y2028-F2037 AromaticContact CG-CD2 3.47Å; Y2028-F2037 HydrophobicContact CG-CD2 3.47Å; Y2028-F2037 VanDerWaalsContact CG-CD2 3.47Å; Y2028-F2037 AromaticContact CG-CE2 3.89Å; Y2028-F2037 HydrophobicContact CG-CE2 3.89Å; Y2028-F2037 HydrophobicContact CG-CG 4.28Å; Y2028-V2065 HydrophobicContact CE2-CG1 4.18Å; Y2028-V2065 HydrophobicContact CE2-CG2 4.05Å; Y2028-F2067 HydrophobicContact CD1-CE1 4.26Å; Y2028-F2067 HydrophobicContact CD1-CZ 4.36Å; Y2028-F2067 HydrophobicContact CE1-CE1 4.01Å; Y2028-F2067 AromaticContact CE1-CZ 3.72Å; Y2028-F2067 HydrophobicContact CE1-CZ 3.72Å; Y2028-F2067 HydrophobicContact CE2-CZ 4.41Å; Y2028-F2067 AromaticContact CZ-CZ 3.74Å; Y2028-A2078 PolarHBondContact OH-O 2.85Å; Y2028-L2082 HydrophobicContact CD2-CD1 4.11Å; Y2028-L2082 HydrophobicContact CE1-CB 4.2Å; Y2028-L2082 HydrophobicContact CE2-CB 4.25Å; Y2028-L2082 HydrophobicContact CE2-CD1 3.8Å; Y2028-L2082 HydrophobicContact CE2-CD2 4.02Å; Y2028-L2082 HydrophobicContact CE2-CG 4.24Å
2029	G	79.3	Confident	82.5	Confident	34 Å²	34	41.9 Å²	41.9	35%	0.351	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-20.1	169.9	0	0	0	0	0	115.5	K2025 A2027 N2034	K2025-G2029 PolarHBondContact O-N 2.93Å; A2027-G2029 PolarHBondContact O-N 2.94Å; G2029-N2034 PolarHBondContact O-ND2 3.16Å
2030	R	79.4	Confident	82.5	Confident	138 Å²	138	40.4 Å²	40.4	52%	0.521	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	1.8	176.4	-52	-174.2	-169.1	108.1	6.3	114.5	A2027 Y2028 T2089 G2094	A2027-R2030 PolarHBondContact O-N 3.09Å; Y2028-R2030 PolarHBondContact O-N 3.02Å; R2030-T2089 VanDerWaalsContact NH1-CG2 3.3Å; R2030-G2094 PolarHBondContact NH1-O 2.04Å; R2030-G2094 PolarHBondContact NH2-O 3.26Å
2031	T	82.5	Confident	81.9	Confident	18 Å²	18	42.7 Å²	42.7	11%	0.11	25%	0.247	C	C	.	.	S	Bend	trans	-95.8	165.8	-178.8	66.9	0	0	0	0	111.3	Y2028 L2033 N2034 E2081	Y2028-T2031 WeakPolarHBondContact CA-OG1 3.22Å; Y2028-T2031 HydrophobicContact CD1-CG2 4.11Å; Y2028-T2031 WeakPolarHBondContact CD1-OG1 3.48Å; Y2028-T2031 PolarHBondContact O-N 2.81Å; Y2028-T2031 PolarHBondContact O-OG1 2.04Å; T2031-L2033 PolarHBondContact O-N 3.24Å; T2031-L2033 PolarHBondContact OG1-N 3.48Å; T2031-N2034 PolarHBondContact O-N 2.98Å; T2031-E2081 VanDerWaalsContact CB-OE2 3.29Å; T2031-E2081 WeakPolarHBondContact CB-OE2 3.08Å; T2031-E2081 HydrophobicContact CG2-CB 3.88Å
2032	S	71.5	Confident	81.6	Confident	95 Å²	95	42 Å²	42	66%	0.664	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-66.8	-29.5	173	72.8	0	0	0	0	111	N2034 E2081	S2032-N2034 PolarHBondContact O-N 2.65Å; S2032-N2034 VanDerWaalsContact O-N 3.15Å; S2032-E2081 WeakPolarHBondContact CB-OE1 3.32Å; S2032-E2081 PolarHBondContact N-OE2 2.8Å; S2032-E2081 PolarHBondContact OG-OE1 2.76Å; S2032-E2081 PolarHBondContact OG-OE2 3.28Å
2033	L	79.5	Confident	81.1	Confident	21 Å²	21	46.6 Å²	46.6	11%	0.11	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-69.5	0.2	176.8	-65.6	171	0	0	0	115.6	Y2028 T2031 G2035 N2036 F2037 F2067 F2073 A2078 E2081	Y2028-L2033 HydrophobicContact CD1-CB 4.32Å; Y2028-L2033 HydrophobicContact CE1-CD1 4.31Å; T2031-L2033 PolarHBondContact O-N 3.24Å; T2031-L2033 PolarHBondContact OG1-N 3.48Å; L2033-G2035 PolarHBondContact O-N 2.85Å; L2033-G2035 VanDerWaalsContact O-N 3.16Å; L2033-N2036 PolarHBondContact O-N 2.82Å; L2033-F2037 WeakPolarHBondContact O-CB 3.13Å; L2033-F2037 PolarHBondContact O-N 3.05Å; L2033-F2067 HydrophobicContact CB-CE1 4.11Å; L2033-F2067 HydrophobicContact CD1-CE1 4.22Å; L2033-F2073 HydrophobicContact CD1-CE2 4.29Å; L2033-F2073 HydrophobicContact CD2-CD2 3.83Å; L2033-F2073 HydrophobicContact CD2-CE2 4.14Å; L2033-A2078 HydrophobicContact CD1-CB 3.97Å; L2033-E2081 PolarHBondContact N-OE2 2.71Å
2034	N	75.7	Confident	80.8	Confident	65 Å²	65	48.4 Å²	48.4	35%	0.348	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-56.1	-32.1	175.1	-171.2	7.9	0	0	0	112.5	K1973 Y2028 G2029 T2031 S2032 N2036	K1973-N2034 PolarHBondContact NZ-O 2.96Å; K1973-N2034 PolarHBondContact NZ-OD1 3.37Å; K1973-N2034 VanDerWaalsContact NZ-OD1 3.09Å; Y2028-N2034 WeakPolarHBondContact O-CB 3.15Å; G2029-N2034 PolarHBondContact O-ND2 3.16Å; T2031-N2034 PolarHBondContact O-N 2.98Å; S2032-N2034 PolarHBondContact O-N 2.65Å; S2032-N2034 VanDerWaalsContact O-N 3.15Å; N2034-N2036 VanDerWaalsContact C-N 3.29Å; N2034-N2036 PolarHBondContact O-N 2.89Å
2035	G	71.9	Confident	80.5	Confident	67 Å²	67	48.4 Å²	48.4	69%	0.691	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-64.7	-32	174.9	0	0	0	0	0	113.8	L2033	L2033-G2035 PolarHBondContact O-N 2.85Å; L2033-G2035 VanDerWaalsContact O-N 3.16Å
2036	N	79.5	Confident	80.4	Confident	41 Å²	41	46.4 Å²	46.4	22%	0.219	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-23.3	-174.7	-60	17.6	0	0	0	112.4	L2033 N2034 V2038 F2067 T2068 T2070	L2033-N2036 PolarHBondContact O-N 2.82Å; N2034-N2036 VanDerWaalsContact C-N 3.29Å; N2034-N2036 PolarHBondContact O-N 2.89Å; N2036-V2038 PolarHBondContact O-N 3.26Å; N2036-F2067 HydrophobicContact CB-CD1 4.3Å; N2036-F2067 CarbonylContact O-C 3.48Å; N2036-F2067 VanDerWaalsContact O-CA 3.24Å; N2036-F2067 WeakPolarHBondContact O-CA 3.2Å; N2036-T2068 WeakPolarHBondContact CA-OG1 3.41Å; N2036-T2068 WeakPolarHBondContact CB-OG1 3.44Å; N2036-T2068 PolarHBondContact O-N 3.4Å; N2036-T2070 PolarHBondContact ND2-OG1 3.09Å
2037	F	80.9	Confident	80	Confident	9 Å²	9	42.3 Å²	42.3	4%	0.039	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	117.8	176.7	178.4	-82.3	0	0	0	110.3	K1973 I2024 K2025 Y2028 L2033 V2040 V2065 F2067	K1973-F2037 WeakPolarHBondContact CD-O 3.24Å; K1973-F2037 WeakPolarHBondContact CE-O 3.1Å; K1973-F2037 PolarHBondContact NZ-O 3.43Å; I2024-F2037 HydrophobicContact CG2-CE2 4.38Å; K2025-F2037 HydrophobicContact CB-CE1 4.47Å; K2025-F2037 HydrophobicContact CB-CZ 4.41Å; K2025-F2037 HydrophobicContact CG-CE1 3.96Å; K2025-F2037 HydrophobicContact CG-CZ 3.76Å; Y2028-F2037 HydrophobicContact CD1-CD2 4.23Å; Y2028-F2037 AromaticContact CD2-CD2 3.49Å; Y2028-F2037 HydrophobicContact CD2-CD2 3.49Å; Y2028-F2037 VanDerWaalsContact CD2-CD2 3.49Å; Y2028-F2037 AromaticContact CD2-CE2 3.44Å; Y2028-F2037 HydrophobicContact CD2-CE2 3.44Å; Y2028-F2037 VanDerWaalsContact CD2-CE2 3.44Å; Y2028-F2037 HydrophobicContact CE2-CD2 4.25Å; Y2028-F2037 HydrophobicContact CE2-CE2 4.19Å; Y2028-F2037 AromaticContact CG-CD2 3.47Å; Y2028-F2037 HydrophobicContact CG-CD2 3.47Å; Y2028-F2037 VanDerWaalsContact CG-CD2 3.47Å; Y2028-F2037 AromaticContact CG-CE2 3.89Å; Y2028-F2037 HydrophobicContact CG-CE2 3.89Å; Y2028-F2037 HydrophobicContact CG-CG 4.28Å; L2033-F2037 WeakPolarHBondContact O-CB 3.13Å; L2033-F2037 PolarHBondContact O-N 3.05Å; F2037-V2040 HydrophobicContact CE2-CB 4.31Å; F2037-V2040 HydrophobicContact CE2-CG1 4.47Å; F2037-V2040 HydrophobicContact CZ-CB 4.13Å; F2037-V2040 HydrophobicContact CZ-CG1 3.93Å; F2037-V2065 HydrophobicContact CD2-CG1 3.48Å; F2037-V2065 VanDerWaalsContact CD2-CG1 3.48Å; F2037-V2065 HydrophobicContact CE2-CG1 3.42Å; F2037-V2065 VanDerWaalsContact CE2-CG1 3.42Å; F2037-F2067 HydrophobicContact CB-CD1 4.43Å; F2037-F2067 HydrophobicContact CB-CE1 4.3Å; F2037-F2067 HydrophobicContact CD2-CE1 4.35Å
2038	V	79.7	Confident	79.4	Confident	11 Å²	11	42.3 Å²	42.3	7%	0.067	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-62.8	177.1	-174.3	0	0	0	0	109.8	R1972 V1980 T1982 N2036 H2066 T2068	R1972-V2038 VanDerWaalsContact C-CG1 3.45Å; V1980-V2038 HydrophobicContact CG2-CG2 4.47Å; T1982-V2038 HydrophobicContact CG2-CB 4.3Å; T1982-V2038 HydrophobicContact CG2-CG1 4.26Å; T1982-V2038 HydrophobicContact CG2-CG2 4Å; N2036-V2038 PolarHBondContact O-N 3.26Å; V2038-H2066 HydrophobicContact CB-CB 4.26Å; V2038-H2066 WeakPolarHBondContact CB-O 3.45Å; V2038-H2066 PolarHBondContact N-O 3.23Å; V2038-T2068 HydrophobicContact CG2-CG2 3.91Å
2039	D	81.1	Confident	78.6	Confident	69 Å²	69	42.3 Å²	42.3	37%	0.369	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	175.7	176	-153.8	9.1	0	0	0	113.8	K2025 V2065 H2066	K2025-D2039 WeakPolarHBondContact CE-OD1 3.26Å; K2025-D2039 IonicContact NZ-OD1 2.75Å; K2025-D2039 PolarHBondContact NZ-OD1 2.7Å; K2025-D2039 IonicContact NZ-OD2 3.13Å; D2039-V2065 WeakPolarHBondContact O-CA 3.34Å; D2039-H2066 PolarHBondContact O-N 2.88Å
2040	V	84.5	Confident	78.3	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.018	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	139.7	174	56.7	0	0	0	0	111.9	E2021 I2024 K2025 F2037 F2063 I2064 V2065	E2021-V2040 HydrophobicContact CB-CG1 4.24Å; E2021-V2040 HydrophobicContact CG-CG1 4.46Å; I2024-V2040 HydrophobicContact CB-CG1 4.09Å; I2024-V2040 HydrophobicContact CB-CG2 4.38Å; I2024-V2040 HydrophobicContact CG2-CB 4.13Å; I2024-V2040 HydrophobicContact CG2-CG1 3.98Å; I2024-V2040 HydrophobicContact CG2-CG2 3.97Å; K2025-V2040 HydrophobicContact CD-CG1 4.26Å; K2025-V2040 VanDerWaalsContact CE-CG1 3.49Å; K2025-V2040 HydrophobicContact CG-CG1 3.7Å; F2037-V2040 HydrophobicContact CE2-CB 4.31Å; F2037-V2040 HydrophobicContact CE2-CG1 4.47Å; F2037-V2040 HydrophobicContact CZ-CB 4.13Å; F2037-V2040 HydrophobicContact CZ-CG1 3.93Å; V2040-F2063 HydrophobicContact CG2-CB 4.4Å; V2040-F2063 HydrophobicContact CG2-CD2 3.67Å; V2040-F2063 HydrophobicContact CG2-CE2 4.45Å; V2040-F2063 HydrophobicContact CG2-CG 4.45Å; V2040-I2064 WeakPolarHBondContact CA-O 3.5Å; V2040-V2065 HydrophobicContact CB-CG2 4.13Å; V2040-V2065 HydrophobicContact CG2-CG2 3.89Å
2041	A	80.4	Confident	77.6	Confident	48 Å²	48	44.4 Å²	44.4	40%	0.397	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137	172	0	0	0	0	0	111.4	E2021 F2063 I2064	E2021-A2041 WeakPolarHBondContact OE1-CA 3.06Å; A2041-F2063 CarbonylContact O-C 3.36Å; A2041-F2063 WeakPolarHBondContact O-CA 3.48Å; A2041-F2063 WeakPolarHBondContact O-CB 3.46Å; A2041-I2064 PolarHBondContact N-O 3.43Å; A2041-I2064 PolarHBondContact O-N 3.19Å
2042	V	85	Confident	76.5	Confident	25 Å²	25	46.1 Å²	46.1	15%	0.152	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.9	173.3	176.2	0	0	0	0	110.3	V2017 F2020 E2021 I2045 F2061 F2063	V2017-V2042 HydrophobicContact CG1-CB 3.99Å; V2017-V2042 HydrophobicContact CG1-CG2 3.99Å; V2017-V2042 HydrophobicContact CG2-CB 4.37Å; V2017-V2042 HydrophobicContact CG2-CG1 4.29Å; F2020-V2042 HydrophobicContact CD1-CG2 3.57Å; F2020-V2042 HydrophobicContact CE1-CG2 4.07Å; F2020-V2042 HydrophobicContact CG-CG2 4.4Å; E2021-V2042 HydrophobicContact CG-CG2 3.89Å; E2021-V2042 PolarHBondContact OE1-N 3.08Å; V2042-I2045 HydrophobicContact CG1-CG1 4.24Å; V2042-F2061 HydrophobicContact CG1-CD1 3.94Å; V2042-F2061 HydrophobicContact CG2-CD1 3.92Å; V2042-F2061 HydrophobicContact CG2-CE1 4.44Å; V2042-F2063 HydrophobicContact CG2-CB 4.26Å
2043	R	74.3	Confident	75.7	Confident	157 Å²	157	46.3 Å²	46.3	59%	0.592	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	-48.9	176.1	-170.4	172.4	85.8	154.8	2.3	111	E2062	R2043-E2062 WeakPolarHBondContact CA-O 3.47Å; R2043-E2062 WeakPolarHBondContact CB-O 3.29Å; R2043-E2062 IonicContact CZ-OE2 2.66Å; R2043-E2062 PolarHBondContact N-O 2.82Å; R2043-E2062 IonicContact NE-OE2 3.54Å; R2043-E2062 PolarHBondContact NE-OE2 3.48Å; R2043-E2062 IonicContact NH2-OE1 3.41Å; R2043-E2062 PolarHBondContact NH2-OE1 2.86Å; R2043-E2062 IonicContact NH2-OE2 2.75Å; R2043-E2062 PolarHBondContact NH2-OE2 2.87Å
2044	D	80	Confident	74.7	Confident	38 Å²	38	49.8 Å²	49.8	20%	0.203	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	157.5	172.8	-168.4	25.6	0	0	0	112.8	R2013 Q2046 E2062	R2013-D2044 IonicContact CZ-OD1 2.83Å; R2013-D2044 IonicContact NH1-OD1 2.64Å; R2013-D2044 PolarHBondContact NH1-OD1 3.04Å; R2013-D2044 IonicContact NH2-OD1 3.28Å; R2013-D2044 PolarHBondContact NH2-OD1 2.79Å; D2044-Q2046 PolarHBondContact OD2-NE2 2.67Å; D2044-E2062 PolarHBondContact N-O 3.29Å; D2044-E2062 VanDerWaalsContact N-O 3.09Å; D2044-E2062 PolarHBondContact O-N 2.82Å
2045	I	84	Confident	74.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117.9	163.4	-53.1	-176.4	0	0	0	107.9	Y2001 R2013 I2016 V2017 V2042 L2059 W2060 F2061	Y2001-I2045 HydrophobicContact CD2-CG2 4.49Å; Y2001-I2045 HydrophobicContact CE2-CG2 4.47Å; Y2001-I2045 WeakPolarHBondContact CE2-O 3.44Å; R2013-I2045 HydrophobicContact CG-CD1 4.09Å; I2016-I2045 HydrophobicContact CG2-CD1 3.71Å; V2017-I2045 HydrophobicContact CG2-CD1 3.94Å; V2017-I2045 HydrophobicContact CG2-CG1 4.45Å; V2042-I2045 HydrophobicContact CG1-CG1 4.24Å; I2045-L2059 HydrophobicContact CG2-CB 3.84Å; I2045-L2059 HydrophobicContact CG2-CD1 4.29Å; I2045-L2059 HydrophobicContact CG2-CD2 4.13Å; I2045-L2059 HydrophobicContact CG2-CG 4.3Å; I2045-W2060 CarbonylContact C-O 3.45Å; I2045-W2060 WeakPolarHBondContact CA-O 3.23Å; I2045-F2061 HydrophobicContact CD1-CD1 4.08Å; I2045-F2061 HydrophobicContact CD1-CE1 3.42Å; I2045-F2061 VanDerWaalsContact CD1-CE1 3.42Å; I2045-F2061 HydrophobicContact CD1-CE2 4.29Å; I2045-F2061 HydrophobicContact CD1-CZ 3.55Å; I2045-F2061 HydrophobicContact CG1-CD1 3.83Å; I2045-F2061 HydrophobicContact CG1-CE1 3.71Å; I2045-F2061 HydrophobicContact CG1-CG 4.33Å; I2045-F2061 HydrophobicContact CG1-CZ 4.12Å
2046	Q	82.7	Confident	74.1	Confident	37 Å²	37	48.5 Å²	48.5	17%	0.173	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	165.9	172.3	-72.6	-76.1	-32.1	0	0	111.8	Y2001 D2044 W2060 G2375 Y2376 T2377	Y2001-Q2046 VanDerWaalsContact CD2-C 3.43Å; Y2001-Q2046 WeakPolarHBondContact CD2-O 3.06Å; D2044-Q2046 PolarHBondContact OD2-NE2 2.67Å; Q2046-W2060 PolarHBondContact N-O 2.83Å; Q2046-W2060 PolarHBondContact O-N 3.31Å; Q2046-G2375 PolarHBondContact OE1-O 2.83Å; Q2046-Y2376 VanDerWaalsContact CB-N 3.33Å; Q2046-T2377 HydrophobicContact CG-CG2 3.86Å; Q2046-T2377 WeakPolarHBondContact CG-OG1 3.36Å
2047	N	76.4	Confident	73.7	Confident	13 Å²	13	51 Å²	51	7%	0.07	26%	0.255	C	S	.	.			trans	-81.2	139.9	179.5	-165.7	-32	0	0	0	110.8	Y2001 S2049 K2374 G2375 Y2376	Y2001-N2047 WeakPolarHBondContact CB-ND2 3.16Å; Y2001-N2047 HydrophobicContact CD1-CB 3.46Å; Y2001-N2047 VanDerWaalsContact CD1-CB 3.46Å; Y2001-N2047 VanDerWaalsContact CD1-CG 3.45Å; Y2001-N2047 WeakPolarHBondContact CD1-ND2 3.13Å; Y2001-N2047 HydrophobicContact CD2-CB 3.65Å; Y2001-N2047 VanDerWaalsContact CD2-N 3.34Å; Y2001-N2047 HydrophobicContact CE1-CB 3.79Å; Y2001-N2047 HydrophobicContact CE2-CB 3.98Å; Y2001-N2047 VanDerWaalsContact CE2-N 3.29Å; Y2001-N2047 HydrophobicContact CG-CB 3.34Å; N2047-S2049 PolarHBondContact O-N 2.89Å; N2047-K2374 HydrophobicContact CB-CB 4Å; N2047-K2374 WeakPolarHBondContact ND2-CB 3.15Å; N2047-K2374 VanDerWaalsContact ND2-CG 3.3Å; N2047-K2374 WeakPolarHBondContact ND2-CG 3.35Å; N2047-K2374 WeakPolarHBondContact OD1-CB 3.06Å; N2047-K2374 WeakPolarHBondContact OD1-CE 3.1Å; N2047-G2375 CarbonylContact O-C 3.4Å; N2047-G2375 WeakPolarHBondContact O-CA 3.37Å; N2047-G2375 PolarHBondContact O-N 2.82Å; N2047-Y2376 PolarHBondContact O-N 3.12Å
2048	P	72.8	Confident	73.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	58.9	-176.9	-19.2	35.2	0	0	0	116.9	F2055 G2058 W2060 Y2376	P2048-F2055 HydrophobicContact CB-CB 4.43Å; P2048-F2055 CarbonylContact O-C 3.53Å; P2048-F2055 VanDerWaalsContact O-C 3.3Å; P2048-F2055 WeakPolarHBondContact O-CB 3.47Å; P2048-G2058 VanDerWaalsContact CD-O 3.23Å; P2048-G2058 WeakPolarHBondContact CD-O 3.41Å; P2048-G2058 VanDerWaalsContact CG-C 3.44Å; P2048-G2058 WeakPolarHBondContact CG-O 3.26Å; P2048-W2060 HydrophobicContact CG-CB 4.23Å; P2048-Y2376 VanDerWaalsContact CA-CD2 3.43Å; P2048-Y2376 HydrophobicContact CB-CD2 4.31Å; P2048-Y2376 HydrophobicContact CB-CE1 4.09Å; P2048-Y2376 HydrophobicContact CB-CE2 3.71Å; P2048-Y2376 WeakPolarHBondContact O-CE2 3.45Å
2049	S	69.7	Low	74.2	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.9	-9.9	168.3	-37.9	0	0	0	0	122.1	N2047 I2051 N2052 D2053 M2373 K2374 Y2376	N2047-S2049 PolarHBondContact O-N 2.89Å; S2049-I2051 PolarHBondContact O-N 2.89Å; S2049-N2052 WeakPolarHBondContact CA-O 3.4Å; S2049-N2052 CarbonylContact O-C 3.19Å; S2049-N2052 PolarHBondContact O-N 3.03Å; S2049-D2053 PolarHBondContact O-N 2.87Å; S2049-M2373 WeakPolarHBondContact CB-SD 3.24Å; S2049-K2374 CarbonylContact C-O 3.55Å; S2049-K2374 WeakPolarHBondContact CA-O 3.37Å; S2049-K2374 VanDerWaalsContact CB-O 3.29Å; S2049-K2374 WeakPolarHBondContact CB-O 3.42Å; S2049-K2374 PolarHBondContact N-O 2.75Å; S2049-K2374 WeakPolarHBondContact OG-CE 3.21Å; S2049-K2374 PolarHBondContact OG-NZ 2.77Å; S2049-Y2376 VanDerWaalsContact CA-CD2 3.48Å
2050	R	72.1	Confident	74.5	Confident	162 Å²	162	46.8 Å²	46.8	61%	0.611	23%	0.233	S	C	*	.	S	Bend	trans	-79	-11.5	176.1	-62.4	160.5	-155.8	141.4	-13.5	114.1	M2373 K2374 G2375	R2050-M2373 WeakPolarHBondContact CG-O 3.31Å; R2050-M2373 PolarHBondContact NE-O 2.95Å; R2050-K2374 PolarHBondContact N-O 2.88Å; R2050-G2375 WeakPolarHBondContact CD-O 3.2Å; R2050-G2375 VanDerWaalsContact CG-CA 3.44Å; R2050-G2375 PolarHBondContact NH1-O 2.6Å
2051	I	65.2	Low	74.8	Confident	53 Å²	53	46.7 Å²	46.7	27%	0.272	23%	0.232	S	C	.	.	S	Bend	trans	-78.9	-42.1	162.4	-80.5	156.9	0	0	0	110.3	S2049 W2060 Y2110 Y2376 T2377	S2049-I2051 PolarHBondContact O-N 2.89Å; I2051-W2060 HydrophobicContact CD1-CH2 4.37Å; I2051-W2060 HydrophobicContact CD1-CZ2 3.5Å; I2051-W2060 VanDerWaalsContact CD1-CZ2 3.5Å; I2051-Y2110 HydrophobicContact CB-CE2 4.36Å; I2051-Y2110 HydrophobicContact CD1-CD2 4.34Å; I2051-Y2110 HydrophobicContact CD1-CE2 3.25Å; I2051-Y2110 WeakPolarHBondContact CD1-OH 3.01Å; I2051-Y2110 HydrophobicContact CG1-CE2 3.45Å; I2051-Y2110 VanDerWaalsContact CG1-CE2 3.45Å; I2051-Y2110 WeakPolarHBondContact CG1-OH 3.45Å; I2051-Y2110 HydrophobicContact CG2-CE2 3.94Å; I2051-Y2376 HydrophobicContact CB-CD1 4.07Å; I2051-Y2376 HydrophobicContact CB-CD2 3.44Å; I2051-Y2376 VanDerWaalsContact CB-CD2 3.44Å; I2051-Y2376 HydrophobicContact CB-CE1 4.46Å; I2051-Y2376 HydrophobicContact CB-CE2 3.89Å; I2051-Y2376 HydrophobicContact CB-CG 3.56Å; I2051-Y2376 VanDerWaalsContact CD1-CB 3.49Å; I2051-Y2376 HydrophobicContact CD1-CD1 3.16Å; I2051-Y2376 HydrophobicContact CD1-CD2 4.16Å; I2051-Y2376 HydrophobicContact CD1-CE1 3.82Å; I2051-Y2376 HydrophobicContact CD1-CG 3.38Å; I2051-Y2376 HydrophobicContact CG1-CD1 4.03Å; I2051-Y2376 HydrophobicContact CG1-CD2 4.14Å; I2051-Y2376 HydrophobicContact CG1-CG 3.71Å; I2051-Y2376 HydrophobicContact CG2-CD2 4.44Å; I2051-Y2376 HydrophobicContact CG2-CE2 4.43Å; I2051-Y2376 VanDerWaalsContact N-CD2 3.34Å; I2051-T2377 WeakPolarHBondContact CD1-O 3.06Å
2052	N	59	Low	74.9	Confident	55 Å²	55	44.9 Å²	44.9	29%	0.294	22%	0.215	S	C	.	.			trans	-161.7	121	-176.3	-179.5	3.1	0	0	0	110.5	S2049 T2054 F2055	S2049-N2052 WeakPolarHBondContact CA-O 3.4Å; S2049-N2052 CarbonylContact O-C 3.19Å; S2049-N2052 PolarHBondContact O-N 3.03Å; N2052-T2054 PolarHBondContact ND2-OG1 2.77Å; N2052-T2054 PolarHBondContact O-N 2.79Å; N2052-T2054 VanDerWaalsContact O-N 3.12Å; N2052-T2054 PolarHBondContact OD1-N 2.82Å; N2052-T2054 VanDerWaalsContact OD1-N 3.13Å; N2052-T2054 PolarHBondContact OD1-OG1 3.48Å; N2052-T2054 VanDerWaalsContact OD1-OG1 3.11Å; N2052-F2055 HydrophobicContact CB-CD2 3.62Å; N2052-F2055 HydrophobicContact CB-CE2 3.71Å; N2052-F2055 HydrophobicContact CB-CG 4.32Å; N2052-F2055 HydrophobicContact CB-CZ 4.44Å; N2052-F2055 WeakPolarHBondContact ND2-CE2 3.38Å; N2052-F2055 VanDerWaalsContact ND2-CZ 3.27Å; N2052-F2055 WeakPolarHBondContact ND2-CZ 3.38Å; N2052-F2055 PolarHBondContact O-N 2.61Å
2053	D	54.9	Low	75	Confident	98 Å²	98	43.7 Å²	43.7	52%	0.524	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-25	-178.3	-57.4	-62	0	0	0	113.3	S2049 F2055 T2056 M2373	S2049-D2053 PolarHBondContact O-N 2.87Å; D2053-F2055 PolarHBondContact O-N 3.1Å; D2053-T2056 WeakPolarHBondContact O-CG2 3.23Å; D2053-M2373 HydrophobicContact CB-CE 4.13Å; D2053-M2373 WeakPolarHBondContact OD1-CG 3.44Å
2054	T	58.7	Low	75.3	Confident	95 Å²	95	38.4 Å²	38.4	58%	0.583	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-23.3	-179	64.3	0	0	0	0	113.5	N2052 T2056	N2052-T2054 PolarHBondContact ND2-OG1 2.77Å; N2052-T2054 PolarHBondContact O-N 2.79Å; N2052-T2054 VanDerWaalsContact O-N 3.12Å; N2052-T2054 PolarHBondContact OD1-N 2.82Å; N2052-T2054 VanDerWaalsContact OD1-N 3.13Å; N2052-T2054 PolarHBondContact OD1-OG1 3.48Å; N2052-T2054 VanDerWaalsContact OD1-OG1 3.11Å; T2054-T2056 PolarHBondContact O-N 2.72Å
2055	F	72.3	Confident	75.5	Confident	29 Å²	29	36.6 Å²	36.6	13%	0.127	18%	0.181	C	C	.	.			trans	-82.7	46.5	-170.5	-62.3	-26	0	0	0	112.4	W1990 P2048 N2052 D2053 K2057 W2103 Y2376	W1990-F2055 HydrophobicContact CE3-CG 4.41Å; W1990-F2055 HydrophobicContact CH2-CB 3.69Å; W1990-F2055 AromaticContact CH2-CD1 3.2Å; W1990-F2055 HydrophobicContact CH2-CD1 3.2Å; W1990-F2055 HydrophobicContact CH2-CD2 4.38Å; W1990-F2055 AromaticContact CH2-CE1 3.88Å; W1990-F2055 HydrophobicContact CH2-CE1 3.88Å; W1990-F2055 AromaticContact CH2-CG 3.5Å; W1990-F2055 HydrophobicContact CH2-CG 3.5Å; W1990-F2055 HydrophobicContact CZ2-CB 3.59Å; W1990-F2055 HydrophobicContact CZ2-CD1 4.05Å; W1990-F2055 AromaticContact CZ2-CG 3.94Å; W1990-F2055 HydrophobicContact CZ2-CG 3.94Å; W1990-F2055 HydrophobicContact CZ3-CB 4.31Å; W1990-F2055 AromaticContact CZ3-CD1 3.46Å; W1990-F2055 HydrophobicContact CZ3-CD1 3.46Å; W1990-F2055 VanDerWaalsContact CZ3-CD1 3.46Å; W1990-F2055 HydrophobicContact CZ3-CD2 4.18Å; W1990-F2055 AromaticContact CZ3-CE1 3.69Å; W1990-F2055 HydrophobicContact CZ3-CE1 3.69Å; W1990-F2055 HydrophobicContact CZ3-CE2 4.36Å; W1990-F2055 AromaticContact CZ3-CG 3.72Å; W1990-F2055 HydrophobicContact CZ3-CG 3.72Å; W1990-F2055 HydrophobicContact CZ3-CZ 4.14Å; P2048-F2055 HydrophobicContact CB-CB 4.43Å; P2048-F2055 CarbonylContact O-C 3.53Å; P2048-F2055 VanDerWaalsContact O-C 3.3Å; P2048-F2055 WeakPolarHBondContact O-CB 3.47Å; N2052-F2055 HydrophobicContact CB-CD2 3.62Å; N2052-F2055 HydrophobicContact CB-CE2 3.71Å; N2052-F2055 HydrophobicContact CB-CG 4.32Å; N2052-F2055 HydrophobicContact CB-CZ 4.44Å; N2052-F2055 WeakPolarHBondContact ND2-CE2 3.38Å; N2052-F2055 VanDerWaalsContact ND2-CZ 3.27Å; N2052-F2055 WeakPolarHBondContact ND2-CZ 3.38Å; N2052-F2055 PolarHBondContact O-N 2.61Å; D2053-F2055 PolarHBondContact O-N 3.1Å; F2055-K2057 PolarHBondContact O-N 3.24Å; F2055-W2103 AromaticContact CE2-CZ3 3.95Å; F2055-W2103 HydrophobicContact CE2-CZ3 3.95Å; F2055-W2103 HydrophobicContact CZ-CE3 4.05Å; F2055-W2103 HydrophobicContact CZ-CH2 4.24Å; F2055-W2103 AromaticContact CZ-CZ3 3.49Å; F2055-W2103 HydrophobicContact CZ-CZ3 3.49Å; F2055-W2103 VanDerWaalsContact CZ-CZ3 3.49Å; F2055-Y2376 HydrophobicContact CB-CE2 3.89Å; F2055-Y2376 WeakPolarHBondContact CB-OH 3.06Å; F2055-Y2376 AromaticContact CD2-CE2 3.75Å; F2055-Y2376 HydrophobicContact CD2-CE2 3.75Å; F2055-Y2376 AromaticContact CD2-CZ 3.72Å; F2055-Y2376 WeakPolarHBondContact CD2-OH 3.32Å; F2055-Y2376 HydrophobicContact CG-CE2 4.33Å
2056	T	63.6	Low	75.4	Confident	75 Å²	75	39.2 Å²	39.2	46%	0.46	19%	0.194	S	C	.	.			trans	-56.3	-12.9	-166	56	0	0	0	0	117.3	D2053 T2054 K2374	D2053-T2056 WeakPolarHBondContact O-CG2 3.23Å; T2054-T2056 PolarHBondContact O-N 2.72Å; T2056-K2374 PolarHBondContact O-NZ 3.48Å
2057	K	70.1	Confident	75.3	Confident	94 Å²	94	37.5 Å²	37.5	41%	0.409	19%	0.185	S	C	.	.	S	Bend	trans	-126.6	164.4	-175.1	-48.8	-165.8	-179.8	-162.1	0	112.3	W1990 Y2000 F2055	W1990-K2057 PolarHBondContact NE1-O 2.77Å; Y2000-K2057 HydrophobicContact CD1-CB 4.42Å; Y2000-K2057 HydrophobicContact CD1-CG 4.21Å; Y2000-K2057 HydrophobicContact CE1-CB 4.26Å; Y2000-K2057 HydrophobicContact CE1-CD 3.58Å; Y2000-K2057 HydrophobicContact CE1-CG 3.68Å; Y2000-K2057 PolarHBondContact OH-NZ 2.93Å; F2055-K2057 PolarHBondContact O-N 3.24Å
2058	G	82.9	Confident	75.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	97.9	-169.3	179.4	0	0	0	0	0	114.3	V1991 L1999 Y2001 P2048	V1991-G2058 CarbonylContact O-C 3.47Å; V1991-G2058 WeakPolarHBondContact O-CA 3.31Å; L1999-G2058 WeakPolarHBondContact O-CA 3.36Å; L1999-G2058 PolarHBondContact O-N 3Å; Y2001-G2058 PolarHBondContact N-O 3.42Å; P2048-G2058 VanDerWaalsContact CD-O 3.23Å; P2048-G2058 WeakPolarHBondContact CD-O 3.41Å; P2048-G2058 VanDerWaalsContact CG-C 3.44Å; P2048-G2058 WeakPolarHBondContact CG-O 3.26Å
2059	L	89	Confident	75	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.4	168.5	-60.8	177.1	0	0	0	108.8	V1991 L1999 Y2001 Y2005 I2016 I2045 F2061	V1991-L2059 PolarHBondContact N-O 2.63Å; V1991-L2059 PolarHBondContact O-N 3.03Å; L1999-L2059 HydrophobicContact CB-CG 4.22Å; L1999-L2059 HydrophobicContact CD1-CD1 4.23Å; L1999-L2059 HydrophobicContact CD1-CG 4.4Å; L1999-L2059 HydrophobicContact CD2-CD1 4.44Å; Y2001-L2059 HydrophobicContact CD2-CD2 3.79Å; Y2001-L2059 HydrophobicContact CG-CD2 4.22Å; Y2005-L2059 HydrophobicContact CD1-CD1 3.62Å; Y2005-L2059 HydrophobicContact CD1-CD2 4.43Å; Y2005-L2059 HydrophobicContact CD2-CD1 4.1Å; Y2005-L2059 HydrophobicContact CD2-CD2 3.67Å; Y2005-L2059 HydrophobicContact CD2-CG 4.43Å; Y2005-L2059 HydrophobicContact CE1-CD1 3.79Å; Y2005-L2059 HydrophobicContact CE2-CD1 4.24Å; Y2005-L2059 HydrophobicContact CE2-CD2 4.32Å; Y2005-L2059 HydrophobicContact CG-CD1 3.77Å; Y2005-L2059 HydrophobicContact CG-CD2 3.72Å; Y2005-L2059 HydrophobicContact CG-CG 4.4Å; I2016-L2059 HydrophobicContact CD1-CD1 3.76Å; I2016-L2059 HydrophobicContact CG2-CD1 4.39Å; I2045-L2059 HydrophobicContact CG2-CB 3.84Å; I2045-L2059 HydrophobicContact CG2-CD1 4.29Å; I2045-L2059 HydrophobicContact CG2-CD2 4.13Å; I2045-L2059 HydrophobicContact CG2-CG 4.3Å; L2059-F2061 HydrophobicContact CB-CD2 4.32Å; L2059-F2061 HydrophobicContact CB-CE2 3.84Å; L2059-F2061 HydrophobicContact CD1-CE2 4.29Å
2060	W	87.4	Confident	74.6	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	116.9	176.1	179.2	-106.5	0	0	0	109.8	P1988 L1989 W1990 I2045 Q2046 P2048 I2051 P2105 Y2376 N2378	P1988-W2060 HydrophobicContact CB-CH2 4.24Å; P1988-W2060 HydrophobicContact CB-CZ2 4Å; L1989-W2060 WeakPolarHBondContact O-CA 3.3Å; L1989-W2060 VanDerWaalsContact O-CE3 3.27Å; W1990-W2060 HydrophobicContact CB-CE3 3.55Å; W1990-W2060 HydrophobicContact CB-CZ3 3.62Å; W1990-W2060 HydrophobicContact CG-CE3 4.38Å; W1990-W2060 VanDerWaalsContact N-CE3 3.29Å; I2045-W2060 CarbonylContact C-O 3.45Å; I2045-W2060 WeakPolarHBondContact CA-O 3.23Å; Q2046-W2060 PolarHBondContact N-O 2.83Å; Q2046-W2060 PolarHBondContact O-N 3.31Å; P2048-W2060 HydrophobicContact CG-CB 4.23Å; I2051-W2060 HydrophobicContact CD1-CH2 4.37Å; I2051-W2060 HydrophobicContact CD1-CZ2 3.5Å; I2051-W2060 VanDerWaalsContact CD1-CZ2 3.5Å; W2060-P2105 HydrophobicContact CH2-CG 3.87Å; W2060-P2105 HydrophobicContact CZ3-CG 4.46Å; W2060-Y2376 HydrophobicContact CB-CD1 3.78Å; W2060-Y2376 HydrophobicContact CB-CE1 3.89Å; W2060-Y2376 AromaticContact CD1-CD1 3.6Å; W2060-Y2376 AromaticContact CD2-CD1 3.4Å; W2060-Y2376 HydrophobicContact CD2-CD1 3.4Å; W2060-Y2376 AromaticContact CD2-CE1 3.27Å; W2060-Y2376 HydrophobicContact CD2-CE1 3.27Å; W2060-Y2376 AromaticContact CE2-CD1 3.37Å; W2060-Y2376 AromaticContact CE2-CE1 3.56Å; W2060-Y2376 HydrophobicContact CE3-CD1 4.07Å; W2060-Y2376 AromaticContact CE3-CE1 3.44Å; W2060-Y2376 HydrophobicContact CE3-CE1 3.44Å; W2060-Y2376 VanDerWaalsContact CE3-CE1 3.44Å; W2060-Y2376 AromaticContact CG-CD1 3.33Å; W2060-Y2376 HydrophobicContact CG-CD1 3.33Å; W2060-Y2376 AromaticContact CG-CE1 3.58Å; W2060-Y2376 HydrophobicContact CG-CE1 3.58Å; W2060-Y2376 HydrophobicContact CG-CG 4.49Å; W2060-Y2376 HydrophobicContact CH2-CD1 4.42Å; W2060-Y2376 AromaticContact CH2-CE1 3.92Å; W2060-Y2376 HydrophobicContact CH2-CE1 3.92Å; W2060-Y2376 AromaticContact CZ2-CD1 3.8Å; W2060-Y2376 HydrophobicContact CZ2-CD1 3.8Å; W2060-Y2376 AromaticContact CZ2-CE1 3.77Å; W2060-Y2376 HydrophobicContact CZ2-CE1 3.77Å; W2060-Y2376 AromaticContact CZ3-CE1 3.82Å; W2060-Y2376 HydrophobicContact CZ3-CE1 3.82Å; W2060-Y2376 AromaticContact NE1-CD1 3.62Å; W2060-N2378 HydrophobicContact CZ2-CB 4.45Å; W2060-N2378 WeakPolarHBondContact CZ2-ND2 3.08Å; W2060-N2378 WeakPolarHBondContact CZ2-OD1 3.22Å; W2060-N2378 PolarHBondContact NE1-OD1 3.13Å
2061	F	90.5	Very high	73.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.9	-179.8	-72	-111	0	0	0	108.9	P1988 L1989 V1991 I2016 F2020 V2042 I2045 L2059 F2063	P1988-F2061 CarbonylContact C-O 3.45Å; P1988-F2061 VanDerWaalsContact CA-O 3.32Å; P1988-F2061 WeakPolarHBondContact CA-O 3.46Å; L1989-F2061 PolarHBondContact N-O 2.81Å; L1989-F2061 PolarHBondContact O-N 2.85Å; V1991-F2061 HydrophobicContact CB-CD2 4.3Å; V1991-F2061 HydrophobicContact CB-CE2 4.03Å; V1991-F2061 HydrophobicContact CG2-CD2 3.55Å; V1991-F2061 HydrophobicContact CG2-CE2 3.63Å; I2016-F2061 HydrophobicContact CG1-CZ 4.28Å; I2016-F2061 HydrophobicContact CG2-CZ 4.08Å; F2020-F2061 HydrophobicContact CB-CD1 4.03Å; F2020-F2061 HydrophobicContact CB-CE1 3.58Å; F2020-F2061 HydrophobicContact CB-CZ 4.12Å; F2020-F2061 AromaticContact CD1-CD1 3.75Å; F2020-F2061 HydrophobicContact CD1-CD1 3.75Å; F2020-F2061 HydrophobicContact CD1-CE1 4.2Å; F2020-F2061 HydrophobicContact CD1-CG 4.34Å; F2020-F2061 HydrophobicContact CD2-CB 4.24Å; F2020-F2061 AromaticContact CD2-CD1 3.55Å; F2020-F2061 HydrophobicContact CD2-CD1 3.55Å; F2020-F2061 AromaticContact CD2-CD2 3.87Å; F2020-F2061 HydrophobicContact CD2-CD2 3.87Å; F2020-F2061 AromaticContact CD2-CE1 3.71Å; F2020-F2061 HydrophobicContact CD2-CE1 3.71Å; F2020-F2061 HydrophobicContact CD2-CE2 4.02Å; F2020-F2061 AromaticContact CD2-CG 3.63Å; F2020-F2061 HydrophobicContact CD2-CG 3.63Å; F2020-F2061 AromaticContact CD2-CZ 3.94Å; F2020-F2061 HydrophobicContact CD2-CZ 3.94Å; F2020-F2061 HydrophobicContact CE1-CB 4.03Å; F2020-F2061 HydrophobicContact CE1-CD1 4.04Å; F2020-F2061 HydrophobicContact CE1-CG 4.25Å; F2020-F2061 HydrophobicContact CE2-CB 3.63Å; F2020-F2061 AromaticContact CE2-CD1 3.85Å; F2020-F2061 HydrophobicContact CE2-CD1 3.85Å; F2020-F2061 AromaticContact CE2-CD2 3.84Å; F2020-F2061 HydrophobicContact CE2-CD2 3.84Å; F2020-F2061 HydrophobicContact CE2-CE1 4.44Å; F2020-F2061 HydrophobicContact CE2-CE2 4.44Å; F2020-F2061 AromaticContact CE2-CG 3.51Å; F2020-F2061 HydrophobicContact CE2-CG 3.51Å; F2020-F2061 AromaticContact CG-CD1 3.49Å; F2020-F2061 HydrophobicContact CG-CD1 3.49Å; F2020-F2061 VanDerWaalsContact CG-CD1 3.49Å; F2020-F2061 AromaticContact CG-CE1 3.57Å; F2020-F2061 HydrophobicContact CG-CE1 3.57Å; F2020-F2061 HydrophobicContact CG-CG 4.05Å; F2020-F2061 HydrophobicContact CG-CZ 4.19Å; F2020-F2061 HydrophobicContact CZ-CB 3.52Å; F2020-F2061 HydrophobicContact CZ-CD1 4.1Å; F2020-F2061 AromaticContact CZ-CG 3.85Å; F2020-F2061 HydrophobicContact CZ-CG 3.85Å; V2042-F2061 HydrophobicContact CG1-CD1 3.94Å; V2042-F2061 HydrophobicContact CG2-CD1 3.92Å; V2042-F2061 HydrophobicContact CG2-CE1 4.44Å; I2045-F2061 HydrophobicContact CD1-CD1 4.08Å; I2045-F2061 HydrophobicContact CD1-CE1 3.42Å; I2045-F2061 VanDerWaalsContact CD1-CE1 3.42Å; I2045-F2061 HydrophobicContact CD1-CE2 4.29Å; I2045-F2061 HydrophobicContact CD1-CZ 3.55Å; I2045-F2061 HydrophobicContact CG1-CD1 3.83Å; I2045-F2061 HydrophobicContact CG1-CE1 3.71Å; I2045-F2061 HydrophobicContact CG1-CG 4.33Å; I2045-F2061 HydrophobicContact CG1-CZ 4.12Å; L2059-F2061 HydrophobicContact CB-CD2 4.32Å; L2059-F2061 HydrophobicContact CB-CE2 3.84Å; L2059-F2061 HydrophobicContact CD1-CE2 4.29Å; F2061-F2063 HydrophobicContact CB-CD1 4.4Å
2062	E	83.1	Confident	73.3	Confident	10 Å²	10	44.8 Å²	44.8	5%	0.047	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.6	161.4	-173.5	-178.6	-117.3	0	0	107.3	R2043 D2044 T2377 N2378	R2043-E2062 WeakPolarHBondContact CA-O 3.47Å; R2043-E2062 WeakPolarHBondContact CB-O 3.29Å; R2043-E2062 IonicContact CZ-OE2 2.66Å; R2043-E2062 PolarHBondContact N-O 2.82Å; R2043-E2062 IonicContact NE-OE2 3.54Å; R2043-E2062 PolarHBondContact NE-OE2 3.48Å; R2043-E2062 IonicContact NH2-OE1 3.41Å; R2043-E2062 PolarHBondContact NH2-OE1 2.86Å; R2043-E2062 IonicContact NH2-OE2 2.75Å; R2043-E2062 PolarHBondContact NH2-OE2 2.87Å; D2044-E2062 PolarHBondContact N-O 3.29Å; D2044-E2062 VanDerWaalsContact N-O 3.09Å; D2044-E2062 PolarHBondContact O-N 2.82Å; E2062-T2377 HydrophobicContact CB-CG2 4.32Å; E2062-T2377 VanDerWaalsContact CD-CB 3.42Å; E2062-T2377 VanDerWaalsContact CD-CG2 3.44Å; E2062-T2377 HydrophobicContact CG-CG2 4.5Å; E2062-T2377 VanDerWaalsContact OE1-CB 3.23Å; E2062-T2377 WeakPolarHBondContact OE1-CB 3.4Å; E2062-T2377 WeakPolarHBondContact OE1-CG2 3.37Å; E2062-T2377 WeakPolarHBondContact OE2-CG2 3.26Å; E2062-N2378 PolarHBondContact OE1-N 3.43Å; E2062-N2378 VanDerWaalsContact OE1-N 3.17Å
2063	F	86.5	Confident	73.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	158.3	-171.4	62.5	-80.1	0	0	0	110.3	S1986 M1987 L1989 F2020 I2024 V2040 A2041 V2042 F2061 V2065 L2082	S1986-F2063 CarbonylContact C-O 3.25Å; S1986-F2063 VanDerWaalsContact CA-O 3.32Å; S1986-F2063 WeakPolarHBondContact CA-O 3.12Å; M1987-F2063 VanDerWaalsContact C-CE1 3.47Å; M1987-F2063 HydrophobicContact CB-CE1 4.11Å; M1987-F2063 HydrophobicContact CB-CE2 3.89Å; M1987-F2063 HydrophobicContact CB-CZ 3.66Å; M1987-F2063 PolarHBondContact N-O 2.9Å; M1987-F2063 WeakPolarHBondContact O-CD1 3.43Å; M1987-F2063 VanDerWaalsContact O-CE1 3.31Å; M1987-F2063 WeakPolarHBondContact O-CE1 3.23Å; M1987-F2063 PolarHBondContact O-N 3.47Å; M1987-F2063 VanDerWaalsContact O-O 3.12Å; L1989-F2063 HydrophobicContact CB-CE1 4.06Å; F2020-F2063 HydrophobicContact CE1-CB 4.09Å; F2020-F2063 AromaticContact CE1-CD1 3.61Å; F2020-F2063 HydrophobicContact CE1-CD1 3.61Å; F2020-F2063 HydrophobicContact CE1-CD2 4.21Å; F2020-F2063 HydrophobicContact CE1-CE1 4.05Å; F2020-F2063 AromaticContact CE1-CG 3.71Å; F2020-F2063 HydrophobicContact CE1-CG 3.71Å; F2020-F2063 AromaticContact CZ-CD1 3.58Å; F2020-F2063 HydrophobicContact CZ-CD1 3.58Å; F2020-F2063 AromaticContact CZ-CE1 3.67Å; F2020-F2063 HydrophobicContact CZ-CE1 3.67Å; F2020-F2063 HydrophobicContact CZ-CG 4.17Å; F2020-F2063 HydrophobicContact CZ-CZ 4.3Å; I2024-F2063 HydrophobicContact CD1-CE2 4.19Å; I2024-F2063 HydrophobicContact CD1-CZ 4.12Å; I2024-F2063 HydrophobicContact CG1-CE2 4.36Å; I2024-F2063 HydrophobicContact CG2-CE2 4.27Å; V2040-F2063 HydrophobicContact CG2-CB 4.4Å; V2040-F2063 HydrophobicContact CG2-CD2 3.67Å; V2040-F2063 HydrophobicContact CG2-CE2 4.45Å; V2040-F2063 HydrophobicContact CG2-CG 4.45Å; A2041-F2063 CarbonylContact O-C 3.36Å; A2041-F2063 WeakPolarHBondContact O-CA 3.48Å; A2041-F2063 WeakPolarHBondContact O-CB 3.46Å; V2042-F2063 HydrophobicContact CG2-CB 4.26Å; F2061-F2063 HydrophobicContact CB-CD1 4.4Å; F2063-V2065 HydrophobicContact CD2-CG2 3.65Å; F2063-V2065 HydrophobicContact CE2-CG2 3.53Å; F2063-L2082 HydrophobicContact CE2-CD2 4.25Å; F2063-L2082 HydrophobicContact CZ-CD2 3.81Å
2064	I	80	Confident	74.1	Confident	46 Å²	46	41.7 Å²	41.7	24%	0.236	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.7	177.5	-58.7	176.9	0	0	0	107.6	P1984 V1985 V2040 A2041	P1984-I2064 HydrophobicContact CB-CG2 3.6Å; V1985-I2064 WeakPolarHBondContact O-CA 3.28Å; V2040-I2064 WeakPolarHBondContact CA-O 3.5Å; A2041-I2064 PolarHBondContact N-O 3.43Å; A2041-I2064 PolarHBondContact O-N 3.19Å
2065	V	84.5	Confident	74.5	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.3	171.9	-175.9	0	0	0	0	108.6	V1985 M1987 I2024 Y2028 F2037 D2039 V2040 F2063 F2067	V1985-V2065 PolarHBondContact N-O 2.84Å; V1985-V2065 PolarHBondContact O-N 3.06Å; M1987-V2065 HydrophobicContact CE-CB 3.68Å; M1987-V2065 HydrophobicContact CE-CG2 3.58Å; I2024-V2065 HydrophobicContact CG2-CG2 4.37Å; Y2028-V2065 HydrophobicContact CE2-CG1 4.18Å; Y2028-V2065 HydrophobicContact CE2-CG2 4.05Å; F2037-V2065 HydrophobicContact CD2-CG1 3.48Å; F2037-V2065 VanDerWaalsContact CD2-CG1 3.48Å; F2037-V2065 HydrophobicContact CE2-CG1 3.42Å; F2037-V2065 VanDerWaalsContact CE2-CG1 3.42Å; D2039-V2065 WeakPolarHBondContact O-CA 3.34Å; V2040-V2065 HydrophobicContact CB-CG2 4.13Å; V2040-V2065 HydrophobicContact CG2-CG2 3.89Å; F2063-V2065 HydrophobicContact CD2-CG2 3.65Å; F2063-V2065 HydrophobicContact CE2-CG2 3.53Å; V2065-F2067 HydrophobicContact CB-CD2 4.29Å; V2065-F2067 HydrophobicContact CB-CE2 3.62Å; V2065-F2067 HydrophobicContact CB-CZ 4.09Å; V2065-F2067 HydrophobicContact CG1-CD2 3.94Å; V2065-F2067 HydrophobicContact CG1-CE1 4.06Å; V2065-F2067 HydrophobicContact CG1-CE2 3.34Å; V2065-F2067 HydrophobicContact CG1-CZ 3.42Å; V2065-F2067 VanDerWaalsContact CG1-CZ 3.42Å
2066	H	81.2	Confident	74.2	Confident	56 Å²	56	39.3 Å²	39.3	26%	0.259	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	121.6	179.2	-67.4	-102.3	0	0	0	109.2	T1982 V2038 D2039	T1982-H2066 HydrophobicContact CG2-CB 4.31Å; T1982-H2066 PolarHBondContact OG1-ND1 2.82Å; V2038-H2066 HydrophobicContact CB-CB 4.26Å; V2038-H2066 WeakPolarHBondContact CB-O 3.45Å; V2038-H2066 PolarHBondContact N-O 3.23Å; D2039-H2066 PolarHBondContact O-N 2.88Å
2067	F	82.2	Confident	74.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	153.2	175.6	-63.6	-87.8	0	0	0	111	T1982 L1983 V1985 M1987 Y2028 L2033 N2036 F2037 V2065 F2073 A2078	T1982-F2067 CarbonylContact C-O 3.52Å; T1982-F2067 WeakPolarHBondContact CA-O 3.24Å; L1983-F2067 PolarHBondContact N-O 3.35Å; L1983-F2067 PolarHBondContact O-N 2.79Å; V1985-F2067 HydrophobicContact CB-CD2 4.32Å; V1985-F2067 HydrophobicContact CB-CE2 4.27Å; V1985-F2067 HydrophobicContact CG2-CD2 4.05Å; V1985-F2067 HydrophobicContact CG2-CE2 4.38Å; M1987-F2067 HydrophobicContact CE-CE2 3.84Å; M1987-F2067 HydrophobicContact CE-CZ 4.25Å; Y2028-F2067 HydrophobicContact CD1-CE1 4.26Å; Y2028-F2067 HydrophobicContact CD1-CZ 4.36Å; Y2028-F2067 HydrophobicContact CE1-CE1 4.01Å; Y2028-F2067 AromaticContact CE1-CZ 3.72Å; Y2028-F2067 HydrophobicContact CE1-CZ 3.72Å; Y2028-F2067 HydrophobicContact CE2-CZ 4.41Å; Y2028-F2067 AromaticContact CZ-CZ 3.74Å; L2033-F2067 HydrophobicContact CB-CE1 4.11Å; L2033-F2067 HydrophobicContact CD1-CE1 4.22Å; N2036-F2067 HydrophobicContact CB-CD1 4.3Å; N2036-F2067 CarbonylContact O-C 3.48Å; N2036-F2067 VanDerWaalsContact O-CA 3.24Å; N2036-F2067 WeakPolarHBondContact O-CA 3.2Å; F2037-F2067 HydrophobicContact CB-CD1 4.43Å; F2037-F2067 HydrophobicContact CB-CE1 4.3Å; F2037-F2067 HydrophobicContact CD2-CE1 4.35Å; V2065-F2067 HydrophobicContact CB-CD2 4.29Å; V2065-F2067 HydrophobicContact CB-CE2 3.62Å; V2065-F2067 HydrophobicContact CB-CZ 4.09Å; V2065-F2067 HydrophobicContact CG1-CD2 3.94Å; V2065-F2067 HydrophobicContact CG1-CE1 4.06Å; V2065-F2067 HydrophobicContact CG1-CE2 3.34Å; V2065-F2067 HydrophobicContact CG1-CZ 3.42Å; V2065-F2067 VanDerWaalsContact CG1-CZ 3.42Å; F2067-F2073 HydrophobicContact CB-CE1 4.47Å; F2067-F2073 HydrophobicContact CB-CE2 4Å; F2067-F2073 HydrophobicContact CB-CZ 3.96Å; F2067-F2073 AromaticContact CD1-CE2 3.72Å; F2067-F2073 HydrophobicContact CD1-CE2 3.72Å; F2067-F2073 HydrophobicContact CD1-CZ 4.2Å; F2067-F2073 HydrophobicContact CD2-CE1 4.23Å; F2067-F2073 AromaticContact CD2-CE2 3.68Å; F2067-F2073 HydrophobicContact CD2-CE2 3.68Å; F2067-F2073 AromaticContact CD2-CZ 3.27Å; F2067-F2073 HydrophobicContact CD2-CZ 3.27Å; F2067-F2073 HydrophobicContact CE1-CE2 4.01Å; F2067-F2073 AromaticContact CE2-CE2 3.94Å; F2067-F2073 HydrophobicContact CE2-CE2 3.94Å; F2067-F2073 AromaticContact CE2-CZ 3.63Å; F2067-F2073 HydrophobicContact CE2-CZ 3.63Å; F2067-F2073 HydrophobicContact CG-CD2 4.47Å; F2067-F2073 HydrophobicContact CG-CE1 4.49Å; F2067-F2073 AromaticContact CG-CE2 3.53Å; F2067-F2073 HydrophobicContact CG-CE2 3.53Å; F2067-F2073 AromaticContact CG-CZ 3.56Å; F2067-F2073 HydrophobicContact CG-CZ 3.56Å; F2067-F2073 HydrophobicContact CZ-CE2 4.09Å; F2067-F2073 HydrophobicContact CZ-CZ 4.24Å; F2067-A2078 HydrophobicContact CE2-CB 3.98Å; F2067-A2078 HydrophobicContact CZ-CB 3.81Å
2068	T	76.1	Confident	74.9	Confident	34 Å²	34	34.9 Å²	34.9	21%	0.209	23%	0.227	C	C	.	.			trans	-71.1	135.5	167	51.3	0	0	0	0	111.2	V1980 N2036 V2038 T2070	V1980-T2068 HydrophobicContact CB-CG2 4.35Å; V1980-T2068 HydrophobicContact CG2-CG2 3.79Å; N2036-T2068 WeakPolarHBondContact CA-OG1 3.41Å; N2036-T2068 WeakPolarHBondContact CB-OG1 3.44Å; N2036-T2068 PolarHBondContact O-N 3.4Å; V2038-T2068 HydrophobicContact CG2-CG2 3.91Å; T2068-T2070 PolarHBondContact O-N 2.88Å; T2068-T2070 PolarHBondContact O-OG1 3.28Å
2069	P	66.5	Low	74.9	Confident	61 Å²	61	35.2 Å²	35.2	40%	0.396	23%	0.229	S	C	.	.			trans	-64.6	126.8	-178.4	25.8	-33.5	0	0	0	110.8	E1981	E1981-P2069 HydrophobicContact CB-CG 4.26Å; E1981-P2069 HydrophobicContact CG-CG 4.18Å; E1981-P2069 WeakPolarHBondContact O-CD 3.49Å
2070	T	61.8	Low	74.3	Confident	58 Å²	58	41.5 Å²	41.5	36%	0.356	26%	0.256	S	S	.	.			trans	-145.7	137	-177.7	33.8	0	0	0	0	109.9	N2036 T2068 S2072 F2073	N2036-T2070 PolarHBondContact ND2-OG1 3.09Å; T2068-T2070 PolarHBondContact O-N 2.88Å; T2068-T2070 PolarHBondContact O-OG1 3.28Å; T2070-S2072 PolarHBondContact O-N 3.49Å; T2070-F2073 WeakPolarHBondContact O-CB 3.36Å; T2070-F2073 PolarHBondContact O-N 2.79Å; T2070-F2073 WeakPolarHBondContact OG1-CB 3.15Å
2071	A	55.8	Low	74	Confident	122 Å²	122	44.1 Å²	44.1	100%	1.008	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-12.6	-167.8	0	0	0	0	0	115.7
2072	S	53.1	Low	73.9	Confident	106 Å²	106	44.1 Å²	44.1	74%	0.741	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	4.6	176.8	60.6	0	0	0	0	113.9	T2070	T2070-S2072 PolarHBondContact O-N 3.49Å
2073	F	65.6	Low	73.9	Confident	28 Å²	28	44.5 Å²	44.5	12%	0.123	27%	0.271	C	S	.	.			trans	-89.6	131.4	-174.7	175.8	-88.7	0	0	0	111.9	L1983 V1985 L2033 F2067 T2070 A2078	L1983-F2073 HydrophobicContact CD2-CD1 3.74Å; L1983-F2073 HydrophobicContact CD2-CE1 3.77Å; V1985-F2073 HydrophobicContact CG2-CE1 3.56Å; V1985-F2073 HydrophobicContact CG2-CZ 3.71Å; L2033-F2073 HydrophobicContact CD1-CE2 4.29Å; L2033-F2073 HydrophobicContact CD2-CD2 3.83Å; L2033-F2073 HydrophobicContact CD2-CE2 4.14Å; F2067-F2073 HydrophobicContact CB-CE1 4.47Å; F2067-F2073 HydrophobicContact CB-CE2 4Å; F2067-F2073 HydrophobicContact CB-CZ 3.96Å; F2067-F2073 AromaticContact CD1-CE2 3.72Å; F2067-F2073 HydrophobicContact CD1-CE2 3.72Å; F2067-F2073 HydrophobicContact CD1-CZ 4.2Å; F2067-F2073 HydrophobicContact CD2-CE1 4.23Å; F2067-F2073 AromaticContact CD2-CE2 3.68Å; F2067-F2073 HydrophobicContact CD2-CE2 3.68Å; F2067-F2073 AromaticContact CD2-CZ 3.27Å; F2067-F2073 HydrophobicContact CD2-CZ 3.27Å; F2067-F2073 HydrophobicContact CE1-CE2 4.01Å; F2067-F2073 AromaticContact CE2-CE2 3.94Å; F2067-F2073 HydrophobicContact CE2-CE2 3.94Å; F2067-F2073 AromaticContact CE2-CZ 3.63Å; F2067-F2073 HydrophobicContact CE2-CZ 3.63Å; F2067-F2073 HydrophobicContact CG-CD2 4.47Å; F2067-F2073 HydrophobicContact CG-CE1 4.49Å; F2067-F2073 AromaticContact CG-CE2 3.53Å; F2067-F2073 HydrophobicContact CG-CE2 3.53Å; F2067-F2073 AromaticContact CG-CZ 3.56Å; F2067-F2073 HydrophobicContact CG-CZ 3.56Å; F2067-F2073 HydrophobicContact CZ-CE2 4.09Å; F2067-F2073 HydrophobicContact CZ-CZ 4.24Å; T2070-F2073 WeakPolarHBondContact O-CB 3.36Å; T2070-F2073 PolarHBondContact O-N 2.79Å; T2070-F2073 WeakPolarHBondContact OG1-CB 3.15Å; F2073-A2078 HydrophobicContact CE2-CB 3.85Å; F2073-A2078 HydrophobicContact CZ-CB 3.9Å
2074	T	66.3	Low	73.7	Confident	61 Å²	61	50.9 Å²	50.9	37%	0.374	30%	0.3	S	S	.	.			trans	-135.4	149	172.3	71.6	0	0	0	0	110.3	A2076 N2077 A2078	T2074-A2076 PolarHBondContact O-N 2.9Å; T2074-N2077 PolarHBondContact O-N 2.92Å; T2074-N2077 VanDerWaalsContact O-N 3.1Å; T2074-N2077 WeakPolarHBondContact OG1-CB 3.46Å; T2074-N2077 PolarHBondContact OG1-N 2.83Å; T2074-N2077 PolarHBondContact OG1-ND2 3Å; T2074-A2078 PolarHBondContact O-N 3.45Å; T2074-A2078 VanDerWaalsContact O-N 3.08Å
2075	A	67	Low	73.9	Confident	38 Å²	38	49.3 Å²	49.3	31%	0.314	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-35.1	177.9	0	0	0	0	0	112.7	V1985 A2078 H2079 L2107	V1985-A2075 HydrophobicContact CG1-CB 3.54Å; A2075-A2078 PolarHBondContact O-N 3.33Å; A2075-H2079 WeakPolarHBondContact O-CB 3.43Å; A2075-H2079 PolarHBondContact O-N 3.37Å; A2075-L2107 HydrophobicContact CB-CD2 3.93Å
2076	A	64.2	Low	73.9	Confident	36 Å²	36	49.3 Å²	49.3	30%	0.298	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-42	175.5	0	0	0	0	0	112.3	T2074 K2080	T2074-A2076 PolarHBondContact O-N 2.9Å; A2076-K2080 VanDerWaalsContact O-CB 3.27Å; A2076-K2080 WeakPolarHBondContact O-CB 3.32Å; A2076-K2080 PolarHBondContact O-N 2.78Å
2077	N	70.9	Confident	73.9	Confident	76 Å²	76	53.1 Å²	53.1	41%	0.406	31%	0.305	S	S	.	.	H	α-helix	trans	-67.1	-41.2	176	-76	-23.8	0	0	0	111.9	T2074 K2080 E2081	T2074-N2077 PolarHBondContact O-N 2.92Å; T2074-N2077 VanDerWaalsContact O-N 3.1Å; T2074-N2077 WeakPolarHBondContact OG1-CB 3.46Å; T2074-N2077 PolarHBondContact OG1-N 2.83Å; T2074-N2077 PolarHBondContact OG1-ND2 3Å; N2077-K2080 PolarHBondContact O-N 2.86Å; N2077-E2081 PolarHBondContact O-N 2.68Å
2078	A	79.1	Confident	73.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-58.8	-49.3	175.4	0	0	0	0	0	112.5	M1987 Y2028 L2033 F2067 F2073 T2074 A2075 K2080 E2081 L2082	M1987-A2078 HydrophobicContact CE-CB 4.19Å; M1987-A2078 HydrophobicContact SD-CB 4.04Å; Y2028-A2078 PolarHBondContact OH-O 2.85Å; L2033-A2078 HydrophobicContact CD1-CB 3.97Å; F2067-A2078 HydrophobicContact CE2-CB 3.98Å; F2067-A2078 HydrophobicContact CZ-CB 3.81Å; F2073-A2078 HydrophobicContact CE2-CB 3.85Å; F2073-A2078 HydrophobicContact CZ-CB 3.9Å; T2074-A2078 PolarHBondContact O-N 3.45Å; T2074-A2078 VanDerWaalsContact O-N 3.08Å; A2075-A2078 PolarHBondContact O-N 3.33Å; A2078-K2080 VanDerWaalsContact C-N 3.32Å; A2078-K2080 PolarHBondContact O-N 2.99Å; A2078-E2081 PolarHBondContact O-N 3.35Å; A2078-L2082 WeakPolarHBondContact O-CB 3.26Å; A2078-L2082 PolarHBondContact O-N 3.32Å; A2078-L2082 VanDerWaalsContact O-N 3.11Å
2079	H	82.1	Confident	73.9	Confident	7 Å²	7	56.8 Å²	56.8	3%	0.032	34%	0.342	C	S	.	.	H	α-helix	trans	-62.8	-37.6	177.1	-174.4	-105.7	0	0	0	112.6	M1987 A2075 L2083 L2107	M1987-H2079 HydrophobicContact CG-CB 4.37Å; M1987-H2079 HydrophobicContact SD-CB 3.86Å; A2075-H2079 WeakPolarHBondContact O-CB 3.43Å; A2075-H2079 PolarHBondContact O-N 3.37Å; H2079-L2083 VanDerWaalsContact CE1-CD1 3.43Å; H2079-L2083 WeakPolarHBondContact CE1-CD1 3.23Å; H2079-L2083 WeakPolarHBondContact O-CG 3.47Å; H2079-L2083 PolarHBondContact O-N 2.94Å; H2079-L2107 HydrophobicContact CB-CB 4.01Å; H2079-L2107 HydrophobicContact CB-CD2 4.15Å; H2079-L2107 PolarHBondContact CE1-N 3.25Å; H2079-L2107 VanDerWaalsContact CE1-N 3.31Å; H2079-L2107 PolarHBondContact ND1-N 3.16Å
2080	K	75.9	Confident	74.5	Confident	132 Å²	132	56 Å²	56	57%	0.574	35%	0.345	S	S	*	.	H	α-helix	trans	-64.9	-48	178.4	-176.8	179	177.5	-178.2	0	112.2	A2076 N2077 A2078 Q2084	A2076-K2080 VanDerWaalsContact O-CB 3.27Å; A2076-K2080 WeakPolarHBondContact O-CB 3.32Å; A2076-K2080 PolarHBondContact O-N 2.78Å; N2077-K2080 PolarHBondContact O-N 2.86Å; A2078-K2080 VanDerWaalsContact C-N 3.32Å; A2078-K2080 PolarHBondContact O-N 2.99Å; K2080-Q2084 WeakPolarHBondContact O-CB 3.14Å; K2080-Q2084 PolarHBondContact O-N 3.35Å; K2080-Q2084 VanDerWaalsContact O-N 3.08Å
2081	E	82.3	Confident	75.7	Confident	55 Å²	55	56.1 Å²	56.1	26%	0.257	34%	0.339	S	S	.	.	H	α-helix	trans	-65.7	-38.2	177.2	-70	-149.4	148.1	0	0	112.2	T2031 S2032 L2033 N2077 A2078 Q2084 S2085	T2031-E2081 VanDerWaalsContact CB-OE2 3.29Å; T2031-E2081 WeakPolarHBondContact CB-OE2 3.08Å; T2031-E2081 HydrophobicContact CG2-CB 3.88Å; S2032-E2081 WeakPolarHBondContact CB-OE1 3.32Å; S2032-E2081 PolarHBondContact N-OE2 2.8Å; S2032-E2081 PolarHBondContact OG-OE1 2.76Å; S2032-E2081 PolarHBondContact OG-OE2 3.28Å; L2033-E2081 PolarHBondContact N-OE2 2.71Å; N2077-E2081 PolarHBondContact O-N 2.68Å; A2078-E2081 PolarHBondContact O-N 3.35Å; E2081-Q2084 PolarHBondContact O-N 2.99Å; E2081-S2085 PolarHBondContact O-N 3.47Å
2082	L	86.9	Confident	77	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.1	-53.4	175.1	177.4	60.8	0	0	0	111.9	I2024 A2027 Y2028 F2063 A2078 Q2084 S2085 I2086	I2024-L2082 HydrophobicContact CD1-CD1 3.86Å; I2024-L2082 HydrophobicContact CD1-CD2 3.95Å; I2024-L2082 HydrophobicContact CD1-CG 4.45Å; A2027-L2082 HydrophobicContact CB-CD1 3.62Å; Y2028-L2082 HydrophobicContact CD2-CD1 4.11Å; Y2028-L2082 HydrophobicContact CE1-CB 4.2Å; Y2028-L2082 HydrophobicContact CE2-CB 4.25Å; Y2028-L2082 HydrophobicContact CE2-CD1 3.8Å; Y2028-L2082 HydrophobicContact CE2-CD2 4.02Å; Y2028-L2082 HydrophobicContact CE2-CG 4.24Å; F2063-L2082 HydrophobicContact CE2-CD2 4.25Å; F2063-L2082 HydrophobicContact CZ-CD2 3.81Å; A2078-L2082 WeakPolarHBondContact O-CB 3.26Å; A2078-L2082 PolarHBondContact O-N 3.32Å; A2078-L2082 VanDerWaalsContact O-N 3.11Å; L2082-Q2084 PolarHBondContact O-N 2.91Å; L2082-S2085 PolarHBondContact O-N 2.73Å; L2082-S2085 VanDerWaalsContact O-N 3.16Å; L2082-I2086 HydrophobicContact CD1-CD1 3.8Å; L2082-I2086 HydrophobicContact CD1-CG1 4.25Å; L2082-I2086 HydrophobicContact CG-CD1 3.9Å; L2082-I2086 WeakPolarHBondContact O-CG1 3.43Å; L2082-I2086 PolarHBondContact O-N 3.24Å
2083	L	84.7	Confident	78.6	Confident	19 Å²	19	45.5 Å²	45.5	10%	0.099	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-33.5	178.2	-70.4	-174.5	0	0	0	112.5	L1989 H2079 R2087 I2100 Q2104	L1989-L2083 HydrophobicContact CD1-CD2 3.81Å; H2079-L2083 VanDerWaalsContact CE1-CD1 3.43Å; H2079-L2083 WeakPolarHBondContact CE1-CD1 3.23Å; H2079-L2083 WeakPolarHBondContact O-CG 3.47Å; H2079-L2083 PolarHBondContact O-N 2.94Å; L2083-R2087 WeakPolarHBondContact O-CB 3.48Å; L2083-R2087 WeakPolarHBondContact O-CG 3.43Å; L2083-R2087 PolarHBondContact O-N 2.74Å; L2083-I2100 HydrophobicContact CD2-CD1 4.13Å; L2083-Q2104 HydrophobicContact CD1-CB 4.04Å; L2083-Q2104 HydrophobicContact CD2-CB 4.18Å; L2083-Q2104 HydrophobicContact CD2-CG 3.79Å
2084	Q	80.5	Confident	79.3	Confident	133 Å²	133	44.2 Å²	44.2	62%	0.621	25%	0.252	S	S	*	.	H	α-helix	trans	-68.8	-39.1	175.6	-172.9	167.5	-16.3	0	0	112.2	K2080 E2081 L2082 G2088	K2080-Q2084 WeakPolarHBondContact O-CB 3.14Å; K2080-Q2084 PolarHBondContact O-N 3.35Å; K2080-Q2084 VanDerWaalsContact O-N 3.08Å; E2081-Q2084 PolarHBondContact O-N 2.99Å; L2082-Q2084 PolarHBondContact O-N 2.91Å; Q2084-G2088 PolarHBondContact O-N 2.97Å
2085	S	84.5	Confident	79.8	Confident	13 Å²	13	43.7 Å²	43.7	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-64.3	-43.6	173.2	-175.2	0	0	0	0	112.1	A2027 E2081 L2082 G2088 T2089	A2027-S2085 WeakPolarHBondContact CA-OG 3.27Å; A2027-S2085 WeakPolarHBondContact O-CB 3.39Å; A2027-S2085 PolarHBondContact O-OG 2.83Å; E2081-S2085 PolarHBondContact O-N 3.47Å; L2082-S2085 PolarHBondContact O-N 2.73Å; L2082-S2085 VanDerWaalsContact O-N 3.16Å; S2085-G2088 WeakPolarHBondContact O-CA 3.28Å; S2085-G2088 PolarHBondContact O-N 2.99Å; S2085-G2088 VanDerWaalsContact O-N 3.07Å; S2085-T2089 PolarHBondContact O-N 3.18Å; S2085-T2089 PolarHBondContact O-OG1 2.86Å
2086	I	85.9	Confident	80.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-68.2	-37.1	179.6	-63.2	172.1	0	0	0	111.5	L1989 A2027 L2082 G2088 T2089 Y2091 I2093 I2100	L1989-I2086 HydrophobicContact CD1-CD1 4.35Å; L1989-I2086 HydrophobicContact CD2-CD1 3.97Å; A2027-I2086 HydrophobicContact CB-CG1 4.15Å; L2082-I2086 HydrophobicContact CD1-CD1 3.8Å; L2082-I2086 HydrophobicContact CD1-CG1 4.25Å; L2082-I2086 HydrophobicContact CG-CD1 3.9Å; L2082-I2086 WeakPolarHBondContact O-CG1 3.43Å; L2082-I2086 PolarHBondContact O-N 3.24Å; I2086-G2088 VanDerWaalsContact C-N 3.29Å; I2086-G2088 PolarHBondContact O-N 3.2Å; I2086-T2089 PolarHBondContact O-N 2.79Å; I2086-T2089 PolarHBondContact O-OG1 2.95Å; I2086-Y2091 WeakPolarHBondContact O-CA 3.01Å; I2086-Y2091 PolarHBondContact O-N 3.38Å; I2086-I2093 HydrophobicContact CD1-CG1 4.5Å; I2086-I2093 HydrophobicContact CD1-CG2 4.11Å; I2086-I2093 HydrophobicContact CG1-CG2 4.47Å; I2086-I2100 HydrophobicContact CB-CD1 4.24Å; I2086-I2100 HydrophobicContact CG2-CD1 3.43Å; I2086-I2100 VanDerWaalsContact CG2-CD1 3.43Å; I2086-I2100 HydrophobicContact CG2-CG1 3.61Å; I2086-I2100 HydrophobicContact CG2-CG2 4.38Å
2087	R	80.2	Confident	81.6	Confident	136 Å²	136	44.2 Å²	44.2	51%	0.513	25%	0.25	S	S	.	.	H	α-helix	trans	-58.1	-41.9	167.8	-83	169.6	174.8	175.7	0.4	111.6	L2083 T2089 G2090 Y2091 E2102	L2083-R2087 WeakPolarHBondContact O-CB 3.48Å; L2083-R2087 WeakPolarHBondContact O-CG 3.43Å; L2083-R2087 PolarHBondContact O-N 2.74Å; R2087-T2089 PolarHBondContact O-N 2.69Å; R2087-G2090 PolarHBondContact O-N 3.09Å; R2087-Y2091 HydrophobicContact CG-CD1 4.15Å; R2087-Y2091 HydrophobicContact CG-CE1 3.55Å; R2087-E2102 PolarHBondContact NH2-O 2.97Å
2088	G	76.1	Confident	82.5	Confident	70 Å²	70	40.6 Å²	40.6	72%	0.722	23%	0.231	S	C	*	.	H	α-helix	trans	-58.7	-28.5	175.6	0	0	0	0	0	114.6	Q2084 S2085 I2086	Q2084-G2088 PolarHBondContact O-N 2.97Å; S2085-G2088 WeakPolarHBondContact O-CA 3.28Å; S2085-G2088 PolarHBondContact O-N 2.99Å; S2085-G2088 VanDerWaalsContact O-N 3.07Å; I2086-G2088 VanDerWaalsContact C-N 3.29Å; I2086-G2088 PolarHBondContact O-N 3.2Å
2089	T	81.5	Confident	82.7	Confident	42 Å²	42	43.3 Å²	43.3	26%	0.258	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	27.7	172.4	32.2	0	0	0	0	114.1	R2030 S2085 I2086 R2087 Y2091 S2092	R2030-T2089 VanDerWaalsContact NH1-CG2 3.3Å; S2085-T2089 PolarHBondContact O-N 3.18Å; S2085-T2089 PolarHBondContact O-OG1 2.86Å; I2086-T2089 PolarHBondContact O-N 2.79Å; I2086-T2089 PolarHBondContact O-OG1 2.95Å; R2087-T2089 PolarHBondContact O-N 2.69Å; T2089-Y2091 VanDerWaalsContact C-N 3.32Å; T2089-Y2091 PolarHBondContact O-N 3.19Å; T2089-S2092 WeakPolarHBondContact CB-O 2.95Å; T2089-S2092 WeakPolarHBondContact O-CB 3.32Å; T2089-S2092 PolarHBondContact O-N 2.9Å; T2089-S2092 VanDerWaalsContact O-N 3.12Å; T2089-S2092 PolarHBondContact OG1-O 3.43Å
2090	G	79.7	Confident	83	Confident	44 Å²	44	43.2 Å²	43.2	45%	0.454	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	38.8	174.8	0	0	0	0	0	112.9	R2087 S2092	R2087-G2090 PolarHBondContact O-N 3.09Å; G2090-S2092 PolarHBondContact O-N 3.46Å
2091	Y	86.4	Confident	82.8	Confident	60 Å²	60	39 Å²	39	24%	0.235	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	2.5	-174.2	-52	-69.8	0	0	0	115.9	I2086 R2087 T2089 Y2099 I2100 E2102	I2086-Y2091 WeakPolarHBondContact O-CA 3.01Å; I2086-Y2091 PolarHBondContact O-N 3.38Å; R2087-Y2091 HydrophobicContact CG-CD1 4.15Å; R2087-Y2091 HydrophobicContact CG-CE1 3.55Å; T2089-Y2091 VanDerWaalsContact C-N 3.32Å; T2089-Y2091 PolarHBondContact O-N 3.19Å; Y2091-Y2099 CarbonylContact O-C 3.36Å; Y2091-Y2099 VanDerWaalsContact O-CA 3.26Å; Y2091-Y2099 WeakPolarHBondContact O-CA 3.32Å; Y2091-I2100 HydrophobicContact CD1-CD1 4.37Å; Y2091-I2100 HydrophobicContact CD1-CG1 4.18Å; Y2091-I2100 PolarHBondContact O-N 2.65Å; Y2091-E2102 HydrophobicContact CD1-CB 4.4Å; Y2091-E2102 HydrophobicContact CE1-CB 3.89Å; Y2091-E2102 HydrophobicContact CE1-CG 4.12Å; Y2091-E2102 HydrophobicContact CE2-CB 3.99Å; Y2091-E2102 HydrophobicContact CE2-CG 4.23Å; Y2091-E2102 VanDerWaalsContact OH-CG 3.29Å; Y2091-E2102 WeakPolarHBondContact OH-CG 3.38Å; Y2091-E2102 PolarHBondContact OH-OE1 2.93Å
2092	S	84.1	Confident	81.9	Confident	5 Å²	5	42.2 Å²	42.2	4%	0.035	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-72.9	133.7	166.4	163.3	0	0	0	0	110.7	T2089 G2090 G2094 G2095 T2096 L2098	T2089-S2092 WeakPolarHBondContact CB-O 2.95Å; T2089-S2092 WeakPolarHBondContact O-CB 3.32Å; T2089-S2092 PolarHBondContact O-N 2.9Å; T2089-S2092 VanDerWaalsContact O-N 3.12Å; T2089-S2092 PolarHBondContact OG1-O 3.43Å; G2090-S2092 PolarHBondContact O-N 3.46Å; S2092-G2094 PolarHBondContact O-N 3.22Å; S2092-G2094 VanDerWaalsContact O-N 3.1Å; S2092-G2095 WeakPolarHBondContact OG-CA 3.48Å; S2092-G2095 PolarHBondContact OG-N 3.03Å; S2092-T2096 PolarHBondContact OG-N 2.58Å; S2092-T2096 PolarHBondContact OG-O 2.84Å; S2092-L2098 CarbonylContact C-O 3.5Å; S2092-L2098 WeakPolarHBondContact CA-O 3.42Å
2093	I	87.3	Confident	80.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	-71.1	104.9	177.5	-51.2	173.3	0	0	0	108.7	L1989 V1991 F2020 G2023 I2024 I2086 G2095 T2096 L2098 I2100	L1989-I2093 HydrophobicContact CD2-CD1 3.67Å; L1989-I2093 HydrophobicContact CD2-CG1 4.03Å; V1991-I2093 HydrophobicContact CG1-CD1 4.24Å; V1991-I2093 HydrophobicContact CG2-CD1 3.74Å; F2020-I2093 HydrophobicContact CD2-CD1 3.76Å; F2020-I2093 HydrophobicContact CE2-CD1 3.88Å; G2023-I2093 WeakPolarHBondContact CA-O 2.99Å; I2024-I2093 HydrophobicContact CD1-CG2 3.88Å; I2024-I2093 HydrophobicContact CG1-CG2 4.32Å; I2086-I2093 HydrophobicContact CD1-CG1 4.5Å; I2086-I2093 HydrophobicContact CD1-CG2 4.11Å; I2086-I2093 HydrophobicContact CG1-CG2 4.47Å; I2093-G2095 PolarHBondContact O-N 3.29Å; I2093-T2096 WeakPolarHBondContact O-CG2 3.35Å; I2093-T2096 PolarHBondContact O-N 2.86Å; I2093-T2096 PolarHBondContact O-OG1 3.14Å; I2093-T2096 VanDerWaalsContact O-OG1 3.07Å; I2093-L2098 HydrophobicContact CD1-CB 3.8Å; I2093-L2098 HydrophobicContact CG1-CB 4.27Å; I2093-L2098 PolarHBondContact N-O 2.85Å; I2093-I2100 HydrophobicContact CD1-CG2 4.03Å; I2093-I2100 HydrophobicContact CG1-CG2 3.79Å
2094	G	79.8	Confident	80.2	Confident	1 Å²	1	49 Å²	49	1%	0.01	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	-3.6	178.8	0	0	0	0	0	115.7	G2023 R2030 S2092	G2023-G2094 VanDerWaalsContact O-CA 3.26Å; G2023-G2094 WeakPolarHBondContact O-CA 3.26Å; G2023-G2094 PolarHBondContact O-N 2.73Å; R2030-G2094 PolarHBondContact NH1-O 2.04Å; R2030-G2094 PolarHBondContact NH2-O 3.26Å; S2092-G2094 PolarHBondContact O-N 3.22Å; S2092-G2094 VanDerWaalsContact O-N 3.1Å
2095	G	77.4	Confident	79.2	Confident	51 Å²	51	43.5 Å²	43.5	53%	0.526	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.3	13.3	-169.2	0	0	0	0	0	114.2	S2092 I2093	S2092-G2095 WeakPolarHBondContact OG-CA 3.48Å; S2092-G2095 PolarHBondContact OG-N 3.03Å; I2093-G2095 PolarHBondContact O-N 3.29Å
2096	T	86.9	Confident	77.9	Confident	18 Å²	18	44.8 Å²	44.8	11%	0.11	25%	0.25	C	S	.	.	S	Bend	trans	-83.9	177.8	172.6	72.2	0	0	0	0	112.2	M2019 D2022 S2092 I2093 L2098	M2019-T2096 PolarHBondContact O-OG1 2.77Å; D2022-T2096 WeakPolarHBondContact OD2-CG2 3.01Å; S2092-T2096 PolarHBondContact OG-N 2.58Å; S2092-T2096 PolarHBondContact OG-O 2.84Å; I2093-T2096 WeakPolarHBondContact O-CG2 3.35Å; I2093-T2096 PolarHBondContact O-N 2.86Å; I2093-T2096 PolarHBondContact O-OG1 3.14Å; I2093-T2096 VanDerWaalsContact O-OG1 3.07Å; T2096-L2098 PolarHBondContact O-N 2.78Å; T2096-L2098 VanDerWaalsContact O-N 3.15Å; T2096-L2098 PolarHBondContact OG1-N 3.32Å
2097	E	81	Confident	76.5	Confident	67 Å²	67	45.5 Å²	45.5	31%	0.313	25%	0.254	S	S	.	.	S	Bend	trans	-65.8	-9	175.8	-57.8	-164.7	133.3	0	0	113.9	R1994 N1995 M2019 Y2099	R1994-E2097 CarbonylContact C-O 3.51Å; R1994-E2097 VanDerWaalsContact CA-O 3.27Å; R1994-E2097 WeakPolarHBondContact CA-O 3.38Å; R1994-E2097 HydrophobicContact CG-CB 3.92Å; R1994-E2097 IonicContact CZ-OE2 3.92Å; R1994-E2097 IonicContact NE-OE2 2.67Å; R1994-E2097 PolarHBondContact NE-OE2 3.1Å; R1994-E2097 IonicContact NH2-OE2 2.6Å; R1994-E2097 PolarHBondContact NH2-OE2 3.42Å; N1995-E2097 PolarHBondContact N-O 3.04Å; N1995-E2097 PolarHBondContact ND2-OE1 3.19Å; N1995-E2097 WeakPolarHBondContact OD1-CB 3.28Å; N1995-E2097 WeakPolarHBondContact OD1-CG 3.41Å; M2019-E2097 HydrophobicContact SD-CB 4.44Å; E2097-Y2099 WeakPolarHBondContact O-CD2 3.49Å; E2097-Y2099 VanDerWaalsContact O-CE2 3.26Å; E2097-Y2099 WeakPolarHBondContact O-CE2 3.28Å
2098	L	89.3	Confident	75.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	127.7	-175.4	-60.3	-175.6	0	0	0	111.3	V1991 R1994 I2016 M2019 F2020 S2092 I2093 T2096	V1991-L2098 HydrophobicContact CG1-CB 3.86Å; V1991-L2098 HydrophobicContact CG1-CD2 4.32Å; V1991-L2098 HydrophobicContact CG1-CG 4.48Å; R1994-L2098 HydrophobicContact CB-CD2 4.06Å; R1994-L2098 HydrophobicContact CG-CD2 4.11Å; I2016-L2098 HydrophobicContact CD1-CD2 3.87Å; I2016-L2098 HydrophobicContact CG1-CD1 3.97Å; I2016-L2098 HydrophobicContact CG1-CD2 3.73Å; I2016-L2098 HydrophobicContact CG1-CG 4.5Å; M2019-L2098 HydrophobicContact CB-CD1 3.87Å; M2019-L2098 HydrophobicContact CB-CG 4.2Å; M2019-L2098 HydrophobicContact CE-CD2 4.36Å; F2020-L2098 HydrophobicContact CB-CD1 3.99Å; S2092-L2098 CarbonylContact C-O 3.5Å; S2092-L2098 WeakPolarHBondContact CA-O 3.42Å; I2093-L2098 HydrophobicContact CD1-CB 3.8Å; I2093-L2098 HydrophobicContact CG1-CB 4.27Å; I2093-L2098 PolarHBondContact N-O 2.85Å; T2096-L2098 PolarHBondContact O-N 2.78Å; T2096-L2098 VanDerWaalsContact O-N 3.15Å; T2096-L2098 PolarHBondContact OG1-N 3.32Å
2099	Y	84.4	Confident	74.5	Confident	56 Å²	56	37.9 Å²	37.9	22%	0.22	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.3	-179.7	-60.9	-103.7	0	0	0	111.8	I1992 R1993 Y2091 E2097	I1992-Y2099 WeakPolarHBondContact CG1-O 3.14Å; I1992-Y2099 PolarHBondContact N-O 2.82Å; R1993-Y2099 HydrophobicContact CG-CD2 4.28Å; R1993-Y2099 HydrophobicContact CG-CG 4.3Å; R1993-Y2099 VanDerWaalsContact CZ-CG 3.49Å; R1993-Y2099 PolarHBondContact N-O 3.39Å; R1993-Y2099 VanDerWaalsContact NH2-CD1 3.3Å; R1993-Y2099 PolarHBondContact O-N 3.05Å; Y2091-Y2099 CarbonylContact O-C 3.36Å; Y2091-Y2099 VanDerWaalsContact O-CA 3.26Å; Y2091-Y2099 WeakPolarHBondContact O-CA 3.32Å; E2097-Y2099 WeakPolarHBondContact O-CD2 3.49Å; E2097-Y2099 VanDerWaalsContact O-CE2 3.26Å; E2097-Y2099 WeakPolarHBondContact O-CE2 3.28Å
2100	I	87.8	Confident	73.3	Confident	6 Å²	6	36.1 Å²	36.1	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	165.8	173.1	66.6	164.5	0	0	0	111.6	L1989 W1990 L2083 I2086 Y2091 I2093 Q2104	L1989-I2100 HydrophobicContact CD2-CG2 3.51Å; L1989-I2100 HydrophobicContact CG-CG2 3.76Å; W1990-I2100 VanDerWaalsContact O-CA 3.28Å; W1990-I2100 WeakPolarHBondContact O-CA 3.44Å; W1990-I2100 WeakPolarHBondContact O-CB 3.07Å; L2083-I2100 HydrophobicContact CD2-CD1 4.13Å; I2086-I2100 HydrophobicContact CB-CD1 4.24Å; I2086-I2100 HydrophobicContact CG2-CD1 3.43Å; I2086-I2100 VanDerWaalsContact CG2-CD1 3.43Å; I2086-I2100 HydrophobicContact CG2-CG1 3.61Å; I2086-I2100 HydrophobicContact CG2-CG2 4.38Å; Y2091-I2100 HydrophobicContact CD1-CD1 4.37Å; Y2091-I2100 HydrophobicContact CD1-CG1 4.18Å; Y2091-I2100 PolarHBondContact O-N 2.65Å; I2093-I2100 HydrophobicContact CD1-CG2 4.03Å; I2093-I2100 HydrophobicContact CG1-CG2 3.79Å; I2100-Q2104 HydrophobicContact CD1-CG 3.83Å
2101	N	72	Confident	72.1	Confident	44 Å²	44	40.4 Å²	40.4	24%	0.235	21%	0.206	C	C	.	.			trans	-72.3	143.8	163.8	-169.2	5.2	0	0	0	110.4	W1990 I1992 W2103 Q2104	W1990-N2101 HydrophobicContact CD2-CB 4.42Å; W1990-N2101 HydrophobicContact CE3-CB 3.88Å; W1990-N2101 HydrophobicContact CZ3-CB 4.11Å; W1990-N2101 WeakPolarHBondContact CZ3-ND2 3.46Å; W1990-N2101 PolarHBondContact O-N 3.01Å; I1992-N2101 HydrophobicContact CD1-CB 4.01Å; I1992-N2101 HydrophobicContact CG1-CB 4.43Å; I1992-N2101 HydrophobicContact CG2-CB 3.94Å; N2101-W2103 WeakPolarHBondContact CB-O 3.32Å; N2101-W2103 PolarHBondContact ND2-O 3.01Å; N2101-W2103 PolarHBondContact O-N 2.88Å; N2101-Q2104 VanDerWaalsContact N-NE2 3.19Å; N2101-Q2104 PolarHBondContact O-NE2 3.25Å
2102	E	62.8	Low	70.9	Confident	121 Å²	121	42 Å²	42	57%	0.565	22%	0.218	S	C	*	.	S	Bend	trans	-56.7	-38.2	175	165.2	159.8	-110.4	0	0	112.3	R2087 Y2091	R2087-E2102 PolarHBondContact NH2-O 2.97Å; Y2091-E2102 HydrophobicContact CD1-CB 4.4Å; Y2091-E2102 HydrophobicContact CE1-CB 3.89Å; Y2091-E2102 HydrophobicContact CE1-CG 4.12Å; Y2091-E2102 HydrophobicContact CE2-CB 3.99Å; Y2091-E2102 HydrophobicContact CE2-CG 4.23Å; Y2091-E2102 VanDerWaalsContact OH-CG 3.29Å; Y2091-E2102 WeakPolarHBondContact OH-CG 3.38Å; Y2091-E2102 PolarHBondContact OH-OE1 2.93Å
2103	W	63.1	Low	69.8	Low	145 Å²	145	45.1 Å²	45.1	55%	0.549	24%	0.235	S	C	.	.			trans	-89.6	111.1	165.6	-166.5	92	0	0	0	110	F2055 N2101 P2105	F2055-W2103 AromaticContact CE2-CZ3 3.95Å; F2055-W2103 HydrophobicContact CE2-CZ3 3.95Å; F2055-W2103 HydrophobicContact CZ-CE3 4.05Å; F2055-W2103 HydrophobicContact CZ-CH2 4.24Å; F2055-W2103 AromaticContact CZ-CZ3 3.49Å; F2055-W2103 HydrophobicContact CZ-CZ3 3.49Å; F2055-W2103 VanDerWaalsContact CZ-CZ3 3.49Å; N2101-W2103 WeakPolarHBondContact CB-O 3.32Å; N2101-W2103 PolarHBondContact ND2-O 3.01Å; N2101-W2103 PolarHBondContact O-N 2.88Å; W2103-P2105 HydrophobicContact CH2-CB 3.95Å; W2103-P2105 HydrophobicContact CZ3-CB 4.09Å; W2103-P2105 HydrophobicContact CZ3-CG 4.34Å
2104	Q	73.3	Confident	68.9	Low	17 Å²	17	46 Å²	46	8%	0.079	24%	0.24	C	C	.	.			trans	-106.9	142.2	159.8	-62.4	-64	-60.9	0	0	107.6	W1990 L2083 I2100 N2101 S2106	W1990-Q2104 PolarHBondContact O-NE2 3.3Å; L2083-Q2104 HydrophobicContact CD1-CB 4.04Å; L2083-Q2104 HydrophobicContact CD2-CB 4.18Å; L2083-Q2104 HydrophobicContact CD2-CG 3.79Å; I2100-Q2104 HydrophobicContact CD1-CG 3.83Å; N2101-Q2104 VanDerWaalsContact N-NE2 3.19Å; N2101-Q2104 PolarHBondContact O-NE2 3.25Å; Q2104-S2106 PolarHBondContact O-N 2.94Å
2105	P	60.5	Low	68.3	Low	18 Å²	18	49.3 Å²	49.3	12%	0.117	26%	0.255	C	S	.	.			trans	-60.3	137.7	165.1	28.8	-32.9	0	0	0	108.2	W2060 W2103	W2060-P2105 HydrophobicContact CH2-CG 3.87Å; W2060-P2105 HydrophobicContact CZ3-CG 4.46Å; W2103-P2105 HydrophobicContact CH2-CB 3.95Å; W2103-P2105 HydrophobicContact CZ3-CB 4.09Å; W2103-P2105 HydrophobicContact CZ3-CG 4.34Å
2106	S	56.5	Low	67.1	Low	40 Å²	40	56.7 Å²	56.7	28%	0.28	27%	0.272	S	S	.	.			trans	-62.7	142.2	168.7	41.5	0	0	0	0	108.7	Q2104 A2108 C2109	Q2104-S2106 PolarHBondContact O-N 2.94Å; S2106-A2108 CarbonylContact O-C 3.49Å; S2106-A2108 PolarHBondContact O-N 3.28Å; S2106-A2108 VanDerWaalsContact O-N 3.09Å; S2106-C2109 PolarHBondContact O-N 3.19Å; S2106-C2109 VanDerWaalsContact O-N 3.15Å; S2106-C2109 VanDerWaalsContact OG-CB 3.25Å; S2106-C2109 WeakPolarHBondContact OG-CB 3.28Å; S2106-C2109 PolarHBondContact OG-N 3.39Å; S2106-C2109 PolarHBondContact OG-SG 3.09Å; S2106-C2109 VanDerWaalsContact OG-SG 3.34Å
2107	L	56.5	Low	65.5	Low	14 Å²	14	58.6 Å²	58.6	7%	0.073	30%	0.295	C	S	.	.	S	Bend	trans	-49.1	-36.4	168	-178.4	73.8	0	0	0	109.5	P1988 A2075 H2079 A2379 A2380 A2381	P1988-L2107 HydrophobicContact CG-CD1 4.24Å; A2075-L2107 HydrophobicContact CB-CD2 3.93Å; H2079-L2107 HydrophobicContact CB-CB 4.01Å; H2079-L2107 HydrophobicContact CB-CD2 4.15Å; H2079-L2107 PolarHBondContact CE1-N 3.25Å; H2079-L2107 VanDerWaalsContact CE1-N 3.31Å; H2079-L2107 PolarHBondContact ND1-N 3.16Å; L2107-A2379 HydrophobicContact CD1-CB 4.43Å; L2107-A2380 WeakPolarHBondContact CD1-O 2.91Å; L2107-A2380 CarbonylContact O-C 3.57Å; L2107-A2380 VanDerWaalsContact O-O 3.08Å; L2107-A2381 PolarHBondContact O-N 3.48Å
2108	A	55.6	Low	64.9	Low	16 Å²	16	56.7 Å²	56.7	13%	0.132	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-86	163.1	0	0	0	0	0	112.6	S2106 Y2110 P2122 A2381 D2382	S2106-A2108 CarbonylContact O-C 3.49Å; S2106-A2108 PolarHBondContact O-N 3.28Å; S2106-A2108 VanDerWaalsContact O-N 3.09Å; A2108-Y2110 PolarHBondContact O-N 3.1Å; A2108-P2122 HydrophobicContact CB-CB 3.43Å; A2108-P2122 VanDerWaalsContact CB-CB 3.43Å; A2108-P2122 HydrophobicContact CB-CG 4.36Å; A2108-A2381 CarbonylContact O-C 3.52Å; A2108-D2382 VanDerWaalsContact C-CB 3.41Å; A2108-D2382 WeakPolarHBondContact CA-OD1 3.12Å; A2108-D2382 WeakPolarHBondContact CA-OD2 3.34Å; A2108-D2382 WeakPolarHBondContact CB-OD1 3.37Å; A2108-D2382 WeakPolarHBondContact CB-OD2 3.4Å; A2108-D2382 CarbonylContact O-C 3.56Å; A2108-D2382 VanDerWaalsContact O-C 3.24Å; A2108-D2382 WeakPolarHBondContact O-CA 3.35Å; A2108-D2382 WeakPolarHBondContact O-CB 3.23Å; A2108-D2382 PolarHBondContact O-N 2.92Å
2109	C	58.2	Low	63.5	Low	30 Å²	30	61.3 Å²	61.3	20%	0.203	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	26.9	-170.1	-67.2	0	0	0	0	118.7	S2106 N2112 C2120 D2382 A2383	S2106-C2109 PolarHBondContact O-N 3.19Å; S2106-C2109 VanDerWaalsContact O-N 3.15Å; S2106-C2109 VanDerWaalsContact OG-CB 3.25Å; S2106-C2109 WeakPolarHBondContact OG-CB 3.28Å; S2106-C2109 PolarHBondContact OG-N 3.39Å; S2106-C2109 PolarHBondContact OG-SG 3.09Å; S2106-C2109 VanDerWaalsContact OG-SG 3.34Å; C2109-N2112 PolarHBondContact O-ND2 2.94Å; C2109-C2120 WeakPolarHBondContact CA-SG 3.34Å; C2109-C2120 HydrophobicContact CB-CB 3.88Å; C2109-C2120 WeakPolarHBondContact CB-SG 3.36Å; C2109-C2120 WeakPolarHBondContact SG-CB 3.45Å; C2109-C2120 CovalentContact SG-SG 2.03Å; C2109-C2120 PolarHBondContact SG-SG 2.9Å; C2109-D2382 CarbonylContact C-O 3.45Å; C2109-D2382 PolarHBondContact N-OD2 3.39Å; C2109-A2383 CarbonylContact C-O 2.78Å
2110	Y	57.6	Low	62.8	Low	6 Å²	6	60 Å²	60	2%	0.024	32%	0.316	C	S	.	.	S	Bend	trans	-107.5	109.6	-166.2	-179.7	-92.8	0	0	0	115.4	I2051 A2108 T2377 N2378 A2379 D2382	I2051-Y2110 HydrophobicContact CB-CE2 4.36Å; I2051-Y2110 HydrophobicContact CD1-CD2 4.34Å; I2051-Y2110 HydrophobicContact CD1-CE2 3.25Å; I2051-Y2110 WeakPolarHBondContact CD1-OH 3.01Å; I2051-Y2110 HydrophobicContact CG1-CE2 3.45Å; I2051-Y2110 VanDerWaalsContact CG1-CE2 3.45Å; I2051-Y2110 WeakPolarHBondContact CG1-OH 3.45Å; I2051-Y2110 HydrophobicContact CG2-CE2 3.94Å; A2108-Y2110 PolarHBondContact O-N 3.1Å; Y2110-T2377 PolarHBondContact OH-O 3.13Å; Y2110-T2377 VanDerWaalsContact OH-O 3.05Å; Y2110-N2378 HydrophobicContact CD1-CB 3.45Å; Y2110-N2378 VanDerWaalsContact CD1-CB 3.45Å; Y2110-N2378 HydrophobicContact CD2-CB 4.48Å; Y2110-N2378 HydrophobicContact CE1-CB 3Å; Y2110-N2378 HydrophobicContact CE2-CB 4.15Å; Y2110-N2378 HydrophobicContact CG-CB 4.19Å; Y2110-N2378 VanDerWaalsContact CZ-CB 3.4Å; Y2110-A2379 HydrophobicContact CD1-CB 4.17Å; Y2110-A2379 HydrophobicContact CE1-CB 4.44Å; Y2110-A2379 WeakPolarHBondContact CE1-O 3.33Å; Y2110-D2382 CarbonylContact C-O 3.48Å; Y2110-D2382 VanDerWaalsContact CA-O 3.28Å; Y2110-D2382 WeakPolarHBondContact CA-O 3.45Å; Y2110-D2382 PolarHBondContact N-O 3.32Å
2111	K	53	Low	61.6	Low	134 Å²	134	62.3 Å²	62.3	58%	0.583	33%	0.329	S	S	*	.	S	Bend	trans	72.1	94.3	-171.5	-87.5	172.3	-180	158.8	0	113.7	N2378 A2383	K2111-N2378 PolarHBondContact NZ-O 3.43Å; K2111-A2383 PolarHBondContact O-N 2.79Å
2112	N	62.3	Low	61	Low	94 Å²	94	63.1 Å²	63.1	50%	0.503	34%	0.336	S	S	.	.			trans	-132.5	164.2	-160.1	70.4	18.4	0	0	0	120.2	C2109 A2383 G2384	C2109-N2112 PolarHBondContact O-ND2 2.94Å; N2112-A2383 WeakPolarHBondContact CB-O 3Å; N2112-A2383 PolarHBondContact ND2-O 3.13Å; N2112-G2384 WeakPolarHBondContact CB-O 3.41Å; N2112-G2384 VanDerWaalsContact CG-O 3.26Å; N2112-G2384 PolarHBondContact ND2-O 2.87Å
2113	D	60.7	Low	60.8	Low	70 Å²	70	60.9 Å²	60.9	37%	0.374	33%	0.328	S	S	.	.			trans	-128.8	6.5	-156.8	93.1	-40.6	0	0	0	116.8	R2146	D2113-R2146 IonicContact OD1-CZ 2.59Å; D2113-R2146 IonicContact OD1-NE 3.87Å; D2113-R2146 PolarHBondContact OD1-NE 3.01Å; D2113-R2146 IonicContact OD1-NH1 3.07Å; D2113-R2146 IonicContact OD1-NH2 3.9Å; D2113-R2146 IonicContact OD2-CZ 2.64Å; D2113-R2146 IonicContact OD2-NE 3.45Å; D2113-R2146 PolarHBondContact OD2-NE 2.82Å; D2113-R2146 IonicContact OD2-NH1 3.98Å; D2113-R2146 PolarHBondContact OD2-NH1 2.7Å; D2113-R2146 IonicContact OD2-NH2 2.6Å
2114	C	68.3	Low	59.8	Low	18 Å²	18	63.5 Å²	63.5	12%	0.122	35%	0.346	C	S	.	.	S	Bend	trans	-94.1	-173	170.6	-128.9	0	0	0	0	110.7	C2130 G2145 R2146 A2385 D2386	C2114-C2130 VanDerWaalsContact CB-SG 3.53Å; C2114-C2130 WeakPolarHBondContact SG-CB 3.07Å; C2114-C2130 CovalentContact SG-SG 2.14Å; C2114-C2130 PolarHBondContact SG-SG 3.34Å; C2114-G2145 PolarHBondContact SG-O 2.83Å; C2114-R2146 HydrophobicContact CB-CG 4.14Å; C2114-R2146 WeakPolarHBondContact SG-CA 3.27Å; C2114-R2146 WeakPolarHBondContact SG-CG 3.39Å; C2114-R2146 PolarHBondContact SG-N 3.21Å; C2114-A2385 VanDerWaalsContact CB-C 3.49Å; C2114-A2385 VanDerWaalsContact SG-CA 3.59Å; C2114-D2386 VanDerWaalsContact SG-CA 3.58Å; C2114-D2386 PolarHBondContact SG-N 3.45Å; C2114-D2386 PolarHBondContact SG-O 3.5Å
2115	F	66.7	Low	58.4	Low	70 Å²	70	68.3 Å²	68.3	31%	0.307	37%	0.372	S	S	.	.			trans	-54.8	140.2	-175.6	-170.5	-106.9	0	0	0	114.2	G2117 G2118 Y2136 G2145 C2148	F2115-G2117 PolarHBondContact O-N 2.62Å; F2115-G2118 PolarHBondContact O-N 2.87Å; F2115-Y2136 HydrophobicContact CE1-CE1 4.26Å; F2115-Y2136 HydrophobicContact CZ-CE1 4.38Å; F2115-G2145 WeakPolarHBondContact CB-O 3.46Å; F2115-G2145 PolarHBondContact N-O 3.03Å; F2115-C2148 HydrophobicContact CB-CB 4.18Å; F2115-C2148 HydrophobicContact CD1-CB 3.66Å; F2115-C2148 HydrophobicContact CD2-CB 3.81Å; F2115-C2148 HydrophobicContact CE1-CB 3.88Å; F2115-C2148 HydrophobicContact CE2-CB 4.02Å; F2115-C2148 HydrophobicContact CG-CB 3.61Å; F2115-C2148 HydrophobicContact CZ-CB 4.05Å
2116	K	52.4	Low	57.9	Low	206 Å²	206	69 Å²	69	90%	0.896	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	95.1	-179.8	-169.4	173	-176	174.9	0	110.2
2117	G	52.8	Low	57.9	Low	58 Å²	58	69 Å²	69	60%	0.598	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.7	-2.3	-168	0	0	0	0	0	113.9	F2115 P2133	F2115-G2117 PolarHBondContact O-N 2.62Å; G2117-P2133 WeakPolarHBondContact O-CD 3.33Å
2118	G	69	Low	58.4	Low	27 Å²	27	72 Å²	72	28%	0.278	39%	0.393	S	S	.	.			trans	-63.9	151.3	166.8	0	0	0	0	0	112.7	F2115 C2120	F2115-G2118 PolarHBondContact O-N 2.87Å; G2118-C2120 PolarHBondContact O-N 2.92Å
2119	L	61.1	Low	58.9	Low	98 Å²	98	72.6 Å²	72.6	51%	0.513	40%	0.396	S	S	.	.			trans	-92.2	27.2	-165.2	-114.1	167.3	0	0	0	116.7	D2386	L2119-D2386 WeakPolarHBondContact CA-OD2 3.29Å; L2119-D2386 HydrophobicContact CB-CB 4.24Å; L2119-D2386 WeakPolarHBondContact CB-OD2 3.42Å; L2119-D2386 PolarHBondContact N-OD2 2.91Å
2120	C	68.8	Low	59.7	Low	27 Å²	27	71.5 Å²	71.5	18%	0.182	39%	0.388	C	S	.	.			trans	3.9	113.7	-167.7	177.6	0	0	0	0	118.3	C2109 G2118 G2384 A2385	C2109-C2120 WeakPolarHBondContact CA-SG 3.34Å; C2109-C2120 HydrophobicContact CB-CB 3.88Å; C2109-C2120 WeakPolarHBondContact CB-SG 3.36Å; C2109-C2120 WeakPolarHBondContact SG-CB 3.45Å; C2109-C2120 CovalentContact SG-SG 2.03Å; C2109-C2120 PolarHBondContact SG-SG 2.9Å; G2118-C2120 PolarHBondContact O-N 2.92Å; C2120-G2384 WeakPolarHBondContact SG-CA 3.38Å; C2120-A2385 WeakPolarHBondContact CA-O 3.46Å
2121	I	63.7	Low	60.2	Low	56 Å²	56	75.4 Å²	75.4	29%	0.287	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.2	169.6	-59.7	173.2	0	0	0	112	T2129 R2131 D2386	I2121-T2129 HydrophobicContact CB-CG2 3.7Å; I2121-T2129 HydrophobicContact CG2-CG2 3.44Å; I2121-T2129 VanDerWaalsContact CG2-CG2 3.44Å; I2121-T2129 PolarHBondContact O-N 3.06Å; I2121-R2131 HydrophobicContact CD1-CB 3.75Å; I2121-R2131 HydrophobicContact CD1-CG 3.94Å; I2121-D2386 WeakPolarHBondContact CG1-OD1 3.34Å; I2121-D2386 PolarHBondContact N-OD1 3.44Å
2122	P	57.9	Low	61.2	Low	60 Å²	60	69 Å²	69	39%	0.39	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	148.4	169.5	33.8	-36.6	0	0	0	111.5	A2108 D2382	A2108-P2122 HydrophobicContact CB-CB 3.43Å; A2108-P2122 VanDerWaalsContact CB-CB 3.43Å; A2108-P2122 HydrophobicContact CB-CG 4.36Å; P2122-D2382 WeakPolarHBondContact CA-OD2 3.25Å; P2122-D2382 VanDerWaalsContact CB-OD2 3.32Å; P2122-D2382 WeakPolarHBondContact CB-OD2 3.14Å
2123	L	59.4	Low	61.5	Low	75 Å²	75	66 Å²	66	39%	0.393	36%	0.361	S	S	.	.			trans	-105.4	162.7	173.5	-66.8	176.2	0	0	0	111.8	D2125 G2126 S2127 T2129	L2123-D2125 VanDerWaalsContact C-N 3.31Å; L2123-D2125 WeakPolarHBondContact CB-OD1 3.4Å; L2123-D2125 PolarHBondContact O-N 2.96Å; L2123-G2126 PolarHBondContact O-N 3.29Å; L2123-S2127 WeakPolarHBondContact CB-O 3.07Å; L2123-S2127 PolarHBondContact N-O 2.7Å; L2123-T2129 HydrophobicContact CD1-CG2 4.4Å; L2123-T2129 HydrophobicContact CD2-CG2 3.45Å; L2123-T2129 VanDerWaalsContact CD2-CG2 3.45Å; L2123-T2129 HydrophobicContact CG-CG2 3.84Å
2124	E	42.3	Very low	61.7	Low	200 Å²	200	66 Å²	66	94%	0.935	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-19	-173.8	-59	-166.5	134.2	0	0	114.1	G2126	E2124-G2126 PolarHBondContact O-N 3.43Å
2125	D	44	Very low	60.6	Low	118 Å²	118	68.8 Å²	68.8	63%	0.631	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-2.8	173.7	64	-18.7	0	0	0	113.3	L2123 S2127	L2123-D2125 VanDerWaalsContact C-N 3.31Å; L2123-D2125 WeakPolarHBondContact CB-OD1 3.4Å; L2123-D2125 PolarHBondContact O-N 2.96Å; D2125-S2127 WeakPolarHBondContact OD1-CA 3.43Å; D2125-S2127 WeakPolarHBondContact OD1-CB 3.02Å; D2125-S2127 PolarHBondContact OD1-N 3.36Å; D2125-S2127 PolarHBondContact OD1-OG 3.43Å; D2125-S2127 WeakPolarHBondContact OD2-CB 3.38Å; D2125-S2127 PolarHBondContact OD2-OG 2.58Å
2126	G	48.4	Very low	60.6	Low	32 Å²	32	68 Å²	68	33%	0.33	37%	0.37	S	S	.	.	S	Bend	trans	75.5	12	-170.2	0	0	0	0	0	113.4	L2123 E2124	L2123-G2126 PolarHBondContact O-N 3.29Å; E2124-G2126 PolarHBondContact O-N 3.43Å
2127	S	57.6	Low	61	Low	40 Å²	40	61.1 Å²	61.1	28%	0.28	34%	0.341	S	S	.	.			trans	-97.4	-162.6	160.6	90.8	0	0	0	0	109.8	L2123 D2125	L2123-S2127 WeakPolarHBondContact CB-O 3.07Å; L2123-S2127 PolarHBondContact N-O 2.7Å; D2125-S2127 WeakPolarHBondContact OD1-CA 3.43Å; D2125-S2127 WeakPolarHBondContact OD1-CB 3.02Å; D2125-S2127 PolarHBondContact OD1-N 3.36Å; D2125-S2127 PolarHBondContact OD1-OG 3.43Å; D2125-S2127 WeakPolarHBondContact OD2-CB 3.38Å; D2125-S2127 PolarHBondContact OD2-OG 2.58Å
2128	Y	67.4	Low	61.4	Low	77 Å²	77	59.6 Å²	59.6	30%	0.302	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	130	-154.4	63.9	-88.6	0	0	0	112.5	R2146 D2382 A2383 G2384 A2385	Y2128-R2146 PolarHBondContact OH-NH2 2.56Å; Y2128-R2146 VanDerWaalsContact OH-NH2 3.14Å; Y2128-D2382 VanDerWaalsContact CB-CB 3.46Å; Y2128-D2382 VanDerWaalsContact CB-CG 3.49Å; Y2128-D2382 HydrophobicContact CD1-CB 4.33Å; Y2128-D2382 HydrophobicContact CG-CB 3.95Å; Y2128-A2383 HydrophobicContact CD1-CB 3.69Å; Y2128-A2383 HydrophobicContact CD2-CB 3.19Å; Y2128-A2383 HydrophobicContact CE1-CB 3.54Å; Y2128-A2383 HydrophobicContact CE2-CB 3.05Å; Y2128-A2383 HydrophobicContact CG-CB 3.55Å; Y2128-G2384 VanDerWaalsContact CD2-N 3.32Å; Y2128-A2385 HydrophobicContact CD2-CB 3.33Å; Y2128-A2385 HydrophobicContact CE2-CB 3.85Å; Y2128-A2385 HydrophobicContact CG-CB 4.43Å
2129	T	65.1	Low	61	Low	29 Å²	29	64.8 Å²	64.8	18%	0.178	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	147.8	-175.3	176.9	0	0	0	0	111.4	I2121 L2123 A2385 R2387	I2121-T2129 HydrophobicContact CB-CG2 3.7Å; I2121-T2129 HydrophobicContact CG2-CG2 3.44Å; I2121-T2129 VanDerWaalsContact CG2-CG2 3.44Å; I2121-T2129 PolarHBondContact O-N 3.06Å; L2123-T2129 HydrophobicContact CD1-CG2 4.4Å; L2123-T2129 HydrophobicContact CD2-CG2 3.45Å; L2123-T2129 VanDerWaalsContact CD2-CG2 3.45Å; L2123-T2129 HydrophobicContact CG-CG2 3.84Å; T2129-A2385 VanDerWaalsContact C-CB 3.42Å; T2129-A2385 WeakPolarHBondContact O-CB 3.18Å; T2129-R2387 PolarHBondContact OG1-NH1 3.19Å
2130	C	75.8	Confident	60.9	Low	7 Å²	7	66.1 Å²	66.1	5%	0.047	33%	0.332	C	S	.	.			trans	-87.1	137.6	-177.8	-93.9	0	0	0	0	109.4	C2114 P2144 A2385 D2386 R2387	C2114-C2130 VanDerWaalsContact CB-SG 3.53Å; C2114-C2130 WeakPolarHBondContact SG-CB 3.07Å; C2114-C2130 CovalentContact SG-SG 2.14Å; C2114-C2130 PolarHBondContact SG-SG 3.34Å; C2130-P2144 WeakPolarHBondContact CB-O 3.33Å; C2130-P2144 PolarHBondContact SG-O 2.9Å; C2130-A2385 HydrophobicContact CB-CB 3.74Å; C2130-A2385 VanDerWaalsContact SG-C 3.59Å; C2130-A2385 WeakPolarHBondContact SG-CA 3.26Å; C2130-A2385 WeakPolarHBondContact SG-CB 3.48Å; C2130-D2386 PolarHBondContact SG-N 3.05Å; C2130-R2387 VanDerWaalsContact CB-CA 3.5Å; C2130-R2387 HydrophobicContact CB-CB 3.66Å; C2130-R2387 HydrophobicContact CB-CG 3.27Å; C2130-R2387 WeakPolarHBondContact O-CB 3.42Å; C2130-R2387 VanDerWaalsContact O-CD 3.3Å; C2130-R2387 WeakPolarHBondContact O-CD 3.38Å; C2130-R2387 WeakPolarHBondContact O-CG 3.1Å; C2130-R2387 PolarHBondContact O-NH1 2.99Å
2131	R	67.4	Low	60.2	Low	88 Å²	88	70.5 Å²	70.5	33%	0.332	36%	0.36	S	S	.	.			trans	-144.1	87	141.4	-72.6	-162.5	75.4	-165.7	9	125	I2121 D2386 R2387 R2388	I2121-R2131 HydrophobicContact CD1-CB 3.75Å; I2121-R2131 HydrophobicContact CD1-CG 3.94Å; R2131-D2386 VanDerWaalsContact CA-C 3.5Å; R2131-D2386 VanDerWaalsContact CA-OD2 3.27Å; R2131-D2386 WeakPolarHBondContact CA-OD2 3.33Å; R2131-D2386 WeakPolarHBondContact CB-OD2 3.49Å; R2131-D2386 PolarHBondContact N-OD1 3.39Å; R2131-D2386 PolarHBondContact N-OD2 3.28Å; R2131-R2387 VanDerWaalsContact C-N 3.29Å; R2131-R2387 VanDerWaalsContact CA-CA 3.41Å; R2131-R2387 HydrophobicContact CG-CB 4.48Å; R2131-R2388 HydrophobicContact CB-CB 3.48Å; R2131-R2388 VanDerWaalsContact CB-CB 3.48Å; R2131-R2388 HydrophobicContact CB-CG 4.36Å; R2131-R2388 HydrophobicContact CG-CB 3.89Å; R2131-R2388 PolarHBondContact O-NE 3.2Å; R2131-R2388 PolarHBondContact O-NH2 3.23Å
2132	C	74.2	Confident	59.7	Low	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.382	C	S	.	.			trans	1.3	156.8	156.6	-84.2	0	0	0	0	118.7	Y2136 C2148 D2386 R2387 R2388	C2132-Y2136 VanDerWaalsContact SG-CB 3.58Å; C2132-C2148 WeakPolarHBondContact CB-SG 3.3Å; C2132-C2148 WeakPolarHBondContact SG-CB 3.35Å; C2132-C2148 CovalentContact SG-SG 2.05Å; C2132-C2148 PolarHBondContact SG-SG 2.88Å; C2132-D2386 PolarHBondContact N-O 3.02Å; C2132-R2387 WeakPolarHBondContact CA-O 3.23Å; C2132-R2387 WeakPolarHBondContact CB-O 3.42Å; C2132-R2387 PolarHBondContact N-O 3.48Å; C2132-R2387 PolarHBondContact SG-O 3.47Å; C2132-R2388 HydrophobicContact CB-CB 3.73Å; C2132-R2388 HydrophobicContact CB-CG 4.31Å; C2132-R2388 VanDerWaalsContact N-CB 3.3Å; C2132-R2388 VanDerWaalsContact O-CD 3.23Å; C2132-R2388 WeakPolarHBondContact O-CD 3.2Å; C2132-R2388 PolarHBondContact O-NE 2.88Å; C2132-R2388 PolarHBondContact SG-N 3.04Å
2133	P	68.7	Low	59.9	Low	31 Å²	31	74.2 Å²	74.2	20%	0.201	38%	0.383	C	S	.	.			trans	-55.1	141.2	152.3	28.2	-34.9	0	0	0	112.9	G2117 Y2136	G2117-P2133 WeakPolarHBondContact O-CD 3.33Å; P2133-Y2136 HydrophobicContact CB-CD2 4.15Å; P2133-Y2136 HydrophobicContact CB-CE2 4.38Å; P2133-Y2136 HydrophobicContact CG-CD2 3.61Å; P2133-Y2136 HydrophobicContact CG-CE2 3.87Å; P2133-Y2136 HydrophobicContact CG-CG 4.02Å; P2133-Y2136 PolarHBondContact O-N 2.81Å
2134	P	64.9	Low	60.1	Low	69 Å²	69	71.6 Å²	71.6	45%	0.448	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	155.6	169.8	-25.3	34.9	0	0	0	113	Y2136 M2389	P2134-Y2136 PolarHBondContact O-N 2.89Å; P2134-M2389 HydrophobicContact CB-CE 4.14Å
2135	K	44.8	Very low	61.4	Low	77 Å²	77	62 Å²	62	34%	0.335	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	3	-174.5	-46	172.2	-178.6	-178.5	0	114.7	V2151 D2157 S2159 L2160	K2135-V2151 PolarHBondContact O-N 2.8Å; K2135-D2157 IonicContact NZ-OD2 2.73Å; K2135-D2157 PolarHBondContact NZ-OD2 3.12Å; K2135-S2159 PolarHBondContact NZ-OG 3.45Å; K2135-L2160 HydrophobicContact CB-CD2 4.45Å; K2135-L2160 HydrophobicContact CD-CD1 3.88Å; K2135-L2160 HydrophobicContact CD-CD2 3.52Å; K2135-L2160 HydrophobicContact CD-CG 3.79Å
2136	Y	67.4	Low	63.1	Low	54 Å²	54	60.6 Å²	60.6	21%	0.212	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	157.5	164.5	-65.8	-116.6	0	0	0	110.2	F2115 C2132 P2133 P2134 C2148 T2149 M2150	F2115-Y2136 HydrophobicContact CE1-CE1 4.26Å; F2115-Y2136 HydrophobicContact CZ-CE1 4.38Å; C2132-Y2136 VanDerWaalsContact SG-CB 3.58Å; P2133-Y2136 HydrophobicContact CB-CD2 4.15Å; P2133-Y2136 HydrophobicContact CB-CE2 4.38Å; P2133-Y2136 HydrophobicContact CG-CD2 3.61Å; P2133-Y2136 HydrophobicContact CG-CE2 3.87Å; P2133-Y2136 HydrophobicContact CG-CG 4.02Å; P2133-Y2136 PolarHBondContact O-N 2.81Å; P2134-Y2136 PolarHBondContact O-N 2.89Å; Y2136-C2148 HydrophobicContact CD1-CB 3.9Å; Y2136-C2148 HydrophobicContact CG-CB 4.43Å; Y2136-T2149 CarbonylContact C-O 3.45Å; Y2136-T2149 VanDerWaalsContact CA-O 3.24Å; Y2136-T2149 WeakPolarHBondContact CA-O 3.34Å; Y2136-M2150 HydrophobicContact CD1-CG 3.79Å; Y2136-M2150 HydrophobicContact CD2-CG 3.74Å; Y2136-M2150 HydrophobicContact CE1-CE 3.85Å; Y2136-M2150 HydrophobicContact CE1-CG 3.68Å; Y2136-M2150 HydrophobicContact CE1-SD 4.2Å; Y2136-M2150 HydrophobicContact CE2-CE 4.42Å; Y2136-M2150 HydrophobicContact CE2-CG 3.61Å; Y2136-M2150 HydrophobicContact CE2-SD 3.81Å; Y2136-M2150 HydrophobicContact CG-CG 3.82Å; Y2136-M2150 VanDerWaalsContact OH-CE 3.31Å; Y2136-M2150 WeakPolarHBondContact OH-CE 3.29Å
2137	E	60.6	Low	63.8	Low	61 Å²	61	63 Å²	63	29%	0.285	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	165.2	176	-59.6	-170.2	178.4	0	0	112.5	C2148 T2149 V2151 M2389 M2390	E2137-C2148 CarbonylContact O-C 3.23Å; E2137-C2148 WeakPolarHBondContact O-CA 3.42Å; E2137-T2149 PolarHBondContact N-O 3.2Å; E2137-T2149 PolarHBondContact O-N 2.84Å; E2137-T2149 PolarHBondContact O-OG1 3.04Å; E2137-T2149 VanDerWaalsContact O-OG1 3.07Å; E2137-V2151 HydrophobicContact CB-CG2 3.96Å; E2137-V2151 HydrophobicContact CG-CB 4.45Å; E2137-V2151 HydrophobicContact CG-CG2 3.67Å; E2137-M2389 CarbonylContact C-O 3.34Å; E2137-M2389 WeakPolarHBondContact CA-O 3.38Å; E2137-M2389 HydrophobicContact CG-CB 4.13Å; E2137-M2390 VanDerWaalsContact CD-CG 3.49Å; E2137-M2390 HydrophobicContact CG-CG 4.21Å; E2137-M2390 VanDerWaalsContact OE1-CG 3.23Å; E2137-M2390 WeakPolarHBondContact OE1-CG 3.24Å
2138	D	61.5	Low	64.2	Low	26 Å²	26	61.7 Å²	61.7	14%	0.139	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.9	-162.4	-70.1	-35.6	0	0	0	112.7	R2140 P2144 G2145 R2387 R2388 M2389	D2138-R2140 PolarHBondContact O-N 3.16Å; D2138-R2140 VanDerWaalsContact O-N 3.09Å; D2138-P2144 HydrophobicContact CB-CB 3.81Å; D2138-P2144 VanDerWaalsContact OD2-CB 3.26Å; D2138-P2144 WeakPolarHBondContact OD2-CB 3.4Å; D2138-G2145 WeakPolarHBondContact OD1-CA 3.36Å; D2138-G2145 PolarHBondContact OD1-N 2.95Å; D2138-R2387 WeakPolarHBondContact OD1-CA 3.49Å; D2138-R2387 WeakPolarHBondContact OD2-CB 3.31Å; D2138-R2388 PolarHBondContact OD1-N 3.46Å; D2138-M2389 WeakPolarHBondContact CA-O 3.12Å; D2138-M2389 WeakPolarHBondContact CB-O 3.37Å; D2138-M2389 PolarHBondContact N-O 2.9Å; D2138-M2389 PolarHBondContact OD2-N 2.81Å
2139	K	60.2	Low	63.8	Low	135 Å²	135	60.3 Å²	60.3	59%	0.587	31%	0.305	S	S	*	.	S	Bend	trans	-69.8	-5.2	178.4	-122.9	171.6	-175	166.9	0	115.1	M2147 T2149	K2139-M2147 HydrophobicContact CB-CB 3.66Å; K2139-M2147 WeakPolarHBondContact CB-O 3.41Å; K2139-M2147 HydrophobicContact CD-CE 4.42Å; K2139-M2147 PolarHBondContact N-O 2.94Å; K2139-T2149 HydrophobicContact CD-CG2 3.91Å; K2139-T2149 HydrophobicContact CG-CG2 4.42Å
2140	R	59.5	Low	63.5	Low	126 Å²	126	61.1 Å²	61.1	48%	0.475	31%	0.307	S	S	.	.			trans	-154.9	99.5	-178.9	-75.5	-170.1	171.1	-178.2	-2.5	113.4	D2138 S2142 Q2143 P2144 M2147	D2138-R2140 PolarHBondContact O-N 3.16Å; D2138-R2140 VanDerWaalsContact O-N 3.09Å; R2140-S2142 PolarHBondContact O-N 3.06Å; R2140-Q2143 VanDerWaalsContact NH1-OE1 3.09Å; R2140-Q2143 CarbonylContact O-C 2.96Å; R2140-Q2143 PolarHBondContact O-N 3.47Å; R2140-P2144 WeakPolarHBondContact O-CA 3.49Å; R2140-P2144 VanDerWaalsContact O-CB 3.29Å; R2140-P2144 WeakPolarHBondContact O-CB 3.43Å; R2140-M2147 HydrophobicContact CG-SD 4.19Å
2141	P	53.1	Low	62.6	Low	119 Å²	119	65 Å²	65	77%	0.773	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-6.1	177.4	-27.3	36.7	0	0	0	117.4	P2144	P2141-P2144 WeakPolarHBondContact O-CG 3.13Å
2142	S	53.6	Low	61.8	Low	107 Å²	107	63 Å²	63	75%	0.748	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-18.2	172.8	55.1	0	0	0	0	114.9	R2140	R2140-S2142 PolarHBondContact O-N 3.06Å
2143	Q	61.3	Low	60.6	Low	88 Å²	88	65.5 Å²	65.5	41%	0.411	34%	0.344	S	S	.	.	S	Bend	trans	-140.8	55.1	178.6	-66.4	-179	-43.2	0	0	108.8	R2140 G2145 R2146	R2140-Q2143 VanDerWaalsContact NH1-OE1 3.09Å; R2140-Q2143 CarbonylContact O-C 2.96Å; R2140-Q2143 PolarHBondContact O-N 3.47Å; Q2143-G2145 PolarHBondContact O-N 3.2Å; Q2143-R2146 PolarHBondContact O-N 2.86Å
2144	P	63.4	Low	60.4	Low	19 Å²	19	64 Å²	64	12%	0.123	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	140	-145.2	-2.3	19	0	0	0	109.6	C2130 D2138 R2140 P2141 R2146 R2387	C2130-P2144 WeakPolarHBondContact CB-O 3.33Å; C2130-P2144 PolarHBondContact SG-O 2.9Å; D2138-P2144 HydrophobicContact CB-CB 3.81Å; D2138-P2144 VanDerWaalsContact OD2-CB 3.26Å; D2138-P2144 WeakPolarHBondContact OD2-CB 3.4Å; R2140-P2144 WeakPolarHBondContact O-CA 3.49Å; R2140-P2144 VanDerWaalsContact O-CB 3.29Å; R2140-P2144 WeakPolarHBondContact O-CB 3.43Å; P2141-P2144 WeakPolarHBondContact O-CG 3.13Å; P2144-R2146 PolarHBondContact O-N 3.12Å; P2144-R2387 HydrophobicContact CB-CB 4.19Å; P2144-R2387 HydrophobicContact CB-CG 3.47Å; P2144-R2387 VanDerWaalsContact CB-CG 3.47Å; P2144-R2387 HydrophobicContact CG-CG 3.82Å; P2144-R2387 VanDerWaalsContact O-CA 3.25Å; P2144-R2387 WeakPolarHBondContact O-CA 3.49Å; P2144-R2387 VanDerWaalsContact O-CG 3.25Å; P2144-R2387 WeakPolarHBondContact O-CG 3.22Å
2145	G	70.4	Confident	60.5	Low	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	50	21	-179.2	0	0	0	0	0	119	C2114 F2115 D2138 Q2143 M2147 R2387	C2114-G2145 PolarHBondContact SG-O 2.83Å; F2115-G2145 WeakPolarHBondContact CB-O 3.46Å; F2115-G2145 PolarHBondContact N-O 3.03Å; D2138-G2145 WeakPolarHBondContact OD1-CA 3.36Å; D2138-G2145 PolarHBondContact OD1-N 2.95Å; Q2143-G2145 PolarHBondContact O-N 3.2Å; G2145-M2147 VanDerWaalsContact CA-N 3.34Å; G2145-M2147 PolarHBondContact O-N 2.68Å; G2145-M2147 VanDerWaalsContact O-N 3.1Å; G2145-R2387 WeakPolarHBondContact CA-O 3.46Å
2146	R	78.8	Confident	61	Low	88 Å²	88	63.5 Å²	63.5	33%	0.332	34%	0.341	S	S	.	.	S	Bend	trans	-57.1	-14.4	142.1	-59.2	-171.7	-173.4	-175.3	2.5	109.8	D2113 C2114 Y2128 Q2143 P2144	D2113-R2146 IonicContact OD1-CZ 2.59Å; D2113-R2146 IonicContact OD1-NE 3.87Å; D2113-R2146 PolarHBondContact OD1-NE 3.01Å; D2113-R2146 IonicContact OD1-NH1 3.07Å; D2113-R2146 IonicContact OD1-NH2 3.9Å; D2113-R2146 IonicContact OD2-CZ 2.64Å; D2113-R2146 IonicContact OD2-NE 3.45Å; D2113-R2146 PolarHBondContact OD2-NE 2.82Å; D2113-R2146 IonicContact OD2-NH1 3.98Å; D2113-R2146 PolarHBondContact OD2-NH1 2.7Å; D2113-R2146 IonicContact OD2-NH2 2.6Å; C2114-R2146 HydrophobicContact CB-CG 4.14Å; C2114-R2146 WeakPolarHBondContact SG-CA 3.27Å; C2114-R2146 WeakPolarHBondContact SG-CG 3.39Å; C2114-R2146 PolarHBondContact SG-N 3.21Å; Y2128-R2146 PolarHBondContact OH-NH2 2.56Å; Y2128-R2146 VanDerWaalsContact OH-NH2 3.14Å; Q2143-R2146 PolarHBondContact O-N 2.86Å; P2144-R2146 PolarHBondContact O-N 3.12Å
2147	M	64.3	Low	60.5	Low	83 Å²	83	63.6 Å²	63.6	41%	0.409	35%	0.346	S	S	.	.	S	Bend	trans	-132.5	99.8	170	-50.7	177.6	75.2	0	0	111	K2139 R2140 G2145	K2139-M2147 HydrophobicContact CB-CB 3.66Å; K2139-M2147 WeakPolarHBondContact CB-O 3.41Å; K2139-M2147 HydrophobicContact CD-CE 4.42Å; K2139-M2147 PolarHBondContact N-O 2.94Å; R2140-M2147 HydrophobicContact CG-SD 4.19Å; G2145-M2147 VanDerWaalsContact CA-N 3.34Å; G2145-M2147 PolarHBondContact O-N 2.68Å; G2145-M2147 VanDerWaalsContact O-N 3.1Å
2148	C	64.9	Low	60.4	Low	12 Å²	12	70.3 Å²	70.3	8%	0.081	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	153.7	173.9	-70.9	0	0	0	0	112.5	F2115 C2132 Y2136 E2137 R2387	F2115-C2148 HydrophobicContact CB-CB 4.18Å; F2115-C2148 HydrophobicContact CD1-CB 3.66Å; F2115-C2148 HydrophobicContact CD2-CB 3.81Å; F2115-C2148 HydrophobicContact CE1-CB 3.88Å; F2115-C2148 HydrophobicContact CE2-CB 4.02Å; F2115-C2148 HydrophobicContact CG-CB 3.61Å; F2115-C2148 HydrophobicContact CZ-CB 4.05Å; C2132-C2148 WeakPolarHBondContact CB-SG 3.3Å; C2132-C2148 WeakPolarHBondContact SG-CB 3.35Å; C2132-C2148 CovalentContact SG-SG 2.05Å; C2132-C2148 PolarHBondContact SG-SG 2.88Å; Y2136-C2148 HydrophobicContact CD1-CB 3.9Å; Y2136-C2148 HydrophobicContact CG-CB 4.43Å; E2137-C2148 CarbonylContact O-C 3.23Å; E2137-C2148 WeakPolarHBondContact O-CA 3.42Å; C2148-R2387 PolarHBondContact SG-O 2.82Å
2149	T	60	Low	59.9	Low	47 Å²	47	73.4 Å²	73.4	29%	0.288	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	137.7	175	23.2	0	0	0	0	112.1	Y2136 E2137 K2139	Y2136-T2149 CarbonylContact C-O 3.45Å; Y2136-T2149 VanDerWaalsContact CA-O 3.24Å; Y2136-T2149 WeakPolarHBondContact CA-O 3.34Å; E2137-T2149 PolarHBondContact N-O 3.2Å; E2137-T2149 PolarHBondContact O-N 2.84Å; E2137-T2149 PolarHBondContact O-OG1 3.04Å; E2137-T2149 VanDerWaalsContact O-OG1 3.07Å; K2139-T2149 HydrophobicContact CD-CG2 3.91Å; K2139-T2149 HydrophobicContact CG-CG2 4.42Å
2150	M	58.6	Low	59.4	Low	46 Å²	46	68 Å²	68	23%	0.227	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	150.3	179	-93.9	175.6	-66.9	0	0	113.7	Y2136 Y2177	Y2136-M2150 HydrophobicContact CD1-CG 3.79Å; Y2136-M2150 HydrophobicContact CD2-CG 3.74Å; Y2136-M2150 HydrophobicContact CE1-CE 3.85Å; Y2136-M2150 HydrophobicContact CE1-CG 3.68Å; Y2136-M2150 HydrophobicContact CE1-SD 4.2Å; Y2136-M2150 HydrophobicContact CE2-CE 4.42Å; Y2136-M2150 HydrophobicContact CE2-CG 3.61Å; Y2136-M2150 HydrophobicContact CE2-SD 3.81Å; Y2136-M2150 HydrophobicContact CG-CG 3.82Å; Y2136-M2150 VanDerWaalsContact OH-CE 3.31Å; Y2136-M2150 WeakPolarHBondContact OH-CE 3.29Å; M2150-Y2177 HydrophobicContact CE-CE1 3.81Å; M2150-Y2177 HydrophobicContact SD-CE1 4.36Å
2151	V	57.2	Low	59.5	Low	90 Å²	90	64.9 Å²	64.9	55%	0.545	37%	0.368	S	S	.	.			trans	-127.9	-11.8	-174.6	-178.3	0	0	0	0	114.1	K2135 E2137	K2135-V2151 PolarHBondContact O-N 2.8Å; E2137-V2151 HydrophobicContact CB-CG2 3.96Å; E2137-V2151 HydrophobicContact CG-CB 4.45Å; E2137-V2151 HydrophobicContact CG-CG2 3.67Å
2152	S	49.8	Very low	60.2	Low	45 Å²	45	63.3 Å²	63.3	32%	0.315	36%	0.356	S	S	.	.	S	Bend	trans	-118.9	142.7	-177.9	61.5	0	0	0	0	113.5	P2154	S2152-P2154 VanDerWaalsContact O-CD 3.25Å; S2152-P2154 WeakPolarHBondContact O-CD 3.48Å
2153	N	50.6	Low	61.3	Low	53 Å²	53	59 Å²	59	28%	0.283	33%	0.325	S	S	.	.			trans	-58	114.2	179.1	-179.4	-15.5	0	0	0	112.5	C2155 S2156 F2171	N2153-C2155 PolarHBondContact OD1-N 2.9Å; N2153-S2156 VanDerWaalsContact CG-OG 3.31Å; N2153-S2156 PolarHBondContact ND2-OG 3.16Å; N2153-S2156 VanDerWaalsContact ND2-OG 3.09Å; N2153-S2156 PolarHBondContact OD1-N 3.47Å; N2153-F2171 HydrophobicContact CB-CD1 4.2Å; N2153-F2171 HydrophobicContact CB-CD2 4.17Å; N2153-F2171 HydrophobicContact CB-CE1 3.97Å; N2153-F2171 HydrophobicContact CB-CE2 3.95Å; N2153-F2171 HydrophobicContact CB-CG 4.28Å; N2153-F2171 HydrophobicContact CB-CZ 3.83Å; N2153-F2171 VanDerWaalsContact CG-CG 3.41Å; N2153-F2171 WeakPolarHBondContact ND2-CD1 3.45Å; N2153-F2171 WeakPolarHBondContact ND2-CG 3.47Å; N2153-F2171 WeakPolarHBondContact OD1-CD2 3.16Å; N2153-F2171 VanDerWaalsContact OD1-CG 3.3Å; N2153-F2171 WeakPolarHBondContact OD1-CG 3.42Å
2154	P	62.6	Low	62	Low	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.312	C	S	.	.	S	Bend	trans	-83.6	-17.6	-175.9	32.1	-32.2	0	0	0	115.1	S2152 D2157 L2160 N2161 Y2177	S2152-P2154 VanDerWaalsContact O-CD 3.25Å; S2152-P2154 WeakPolarHBondContact O-CD 3.48Å; P2154-D2157 VanDerWaalsContact O-O 3.09Å; P2154-L2160 HydrophobicContact CB-CB 3.56Å; P2154-L2160 HydrophobicContact CB-CD1 3.93Å; P2154-L2160 HydrophobicContact CB-CG 4.27Å; P2154-L2160 WeakPolarHBondContact O-CB 3.4Å; P2154-N2161 PolarHBondContact O-N 2.99Å; P2154-Y2177 HydrophobicContact CB-CD1 4.19Å; P2154-Y2177 HydrophobicContact CB-CD2 4.34Å; P2154-Y2177 HydrophobicContact CB-CE1 4.11Å; P2154-Y2177 HydrophobicContact CB-CE2 4.28Å; P2154-Y2177 HydrophobicContact CB-CG 4.28Å; P2154-Y2177 HydrophobicContact CG-CD1 3.23Å; P2154-Y2177 HydrophobicContact CG-CD2 3.79Å; P2154-Y2177 HydrophobicContact CG-CE1 3.62Å; P2154-Y2177 HydrophobicContact CG-CE2 4.14Å; P2154-Y2177 HydrophobicContact CG-CG 3.3Å
2155	C	67.2	Low	62.4	Low	37 Å²	37	60.1 Å²	60.1	25%	0.25	34%	0.339	C	S	.	.	S	Bend	trans	-81.5	-17.8	175.1	-56.8	0	0	0	0	112.5	N2153 C2169 V2170 F2171	N2153-C2155 PolarHBondContact OD1-N 2.9Å; C2155-C2169 WeakPolarHBondContact CA-SG 3.45Å; C2155-C2169 HydrophobicContact CB-CB 3.78Å; C2155-C2169 WeakPolarHBondContact CB-SG 3.21Å; C2155-C2169 WeakPolarHBondContact SG-CB 3.47Å; C2155-C2169 PolarHBondContact SG-O 2.7Å; C2155-C2169 VanDerWaalsContact SG-O 3.35Å; C2155-C2169 CovalentContact SG-SG 2.05Å; C2155-C2169 PolarHBondContact SG-SG 2.88Å; C2155-V2170 VanDerWaalsContact SG-C 3.54Å; C2155-F2171 HydrophobicContact CB-CB 4.23Å; C2155-F2171 PolarHBondContact SG-N 3.27Å
2156	S	56.7	Low	62.7	Low	98 Å²	98	62.5 Å²	62.5	69%	0.685	35%	0.352	S	S	*	.	S	Bend	trans	-76.1	-20.8	173.1	-62.5	0	0	0	0	114.1	N2153	N2153-S2156 VanDerWaalsContact CG-OG 3.31Å; N2153-S2156 PolarHBondContact ND2-OG 3.16Å; N2153-S2156 VanDerWaalsContact ND2-OG 3.09Å; N2153-S2156 PolarHBondContact OD1-N 3.47Å
2157	D	57	Low	62.8	Low	56 Å²	56	58.6 Å²	58.6	30%	0.299	34%	0.339	S	S	.	.			trans	-120.7	115	-173.7	176.4	-4	0	0	0	110	K2135 P2154 S2159 L2160 N2161	K2135-D2157 IonicContact NZ-OD2 2.73Å; K2135-D2157 PolarHBondContact NZ-OD2 3.12Å; P2154-D2157 VanDerWaalsContact O-O 3.09Å; D2157-S2159 PolarHBondContact O-N 3.04Å; D2157-S2159 WeakPolarHBondContact OD1-CB 3.43Å; D2157-S2159 PolarHBondContact OD1-N 3.18Å; D2157-S2159 PolarHBondContact OD1-OG 3.44Å; D2157-S2159 PolarHBondContact OD2-OG 2.99Å; D2157-L2160 HydrophobicContact CB-CB 4.28Å; D2157-L2160 HydrophobicContact CB-CD1 4.17Å; D2157-L2160 HydrophobicContact CB-CG 4.32Å; D2157-L2160 PolarHBondContact O-N 3.42Å; D2157-N2161 PolarHBondContact O-N 2.72Å
2158	K	57.5	Low	63.3	Low	202 Å²	202	61 Å²	61	88%	0.878	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.5	179.9	-72	-174.2	176.2	-178.4	0	114
2159	S	52.2	Low	63.9	Low	90 Å²	90	61.5 Å²	61.5	63%	0.629	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-9	173.7	71.9	0	0	0	0	114.2	K2135 D2157	K2135-S2159 PolarHBondContact NZ-OG 3.45Å; D2157-S2159 PolarHBondContact O-N 3.04Å; D2157-S2159 WeakPolarHBondContact OD1-CB 3.43Å; D2157-S2159 PolarHBondContact OD1-N 3.18Å; D2157-S2159 PolarHBondContact OD1-OG 3.44Å; D2157-S2159 PolarHBondContact OD2-OG 2.99Å
2160	L	49.8	Very low	64.5	Low	21 Å²	21	62.3 Å²	62.3	11%	0.11	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-19.7	176	-80.4	179.6	0	0	0	113.7	K2135 P2154 D2157 T2162	K2135-L2160 HydrophobicContact CB-CD2 4.45Å; K2135-L2160 HydrophobicContact CD-CD1 3.88Å; K2135-L2160 HydrophobicContact CD-CD2 3.52Å; K2135-L2160 HydrophobicContact CD-CG 3.79Å; P2154-L2160 HydrophobicContact CB-CB 3.56Å; P2154-L2160 HydrophobicContact CB-CD1 3.93Å; P2154-L2160 HydrophobicContact CB-CG 4.27Å; P2154-L2160 WeakPolarHBondContact O-CB 3.4Å; D2157-L2160 HydrophobicContact CB-CB 4.28Å; D2157-L2160 HydrophobicContact CB-CD1 4.17Å; D2157-L2160 HydrophobicContact CB-CG 4.32Å; D2157-L2160 PolarHBondContact O-N 3.42Å; L2160-T2162 PolarHBondContact O-N 3.38Å
2161	N	61.6	Low	64.7	Low	62 Å²	62	63.8 Å²	63.8	33%	0.332	36%	0.362	S	S	.	.			trans	-72.7	98.8	-178.1	-177.4	-0.8	0	0	0	111.3	P2154 D2157 C2163	P2154-N2161 PolarHBondContact O-N 2.99Å; D2157-N2161 PolarHBondContact O-N 2.72Å; N2161-C2163 VanDerWaalsContact C-N 3.3Å; N2161-C2163 WeakPolarHBondContact OD1-CB 3.46Å; N2161-C2163 PolarHBondContact OD1-N 3.34Å; N2161-C2163 PolarHBondContact OD1-SG 2.87Å
2162	T	66.4	Low	65	Low	85 Å²	85	62.9 Å²	62.9	52%	0.521	35%	0.353	S	S	.	.			trans	-88.3	13.7	177.1	64.7	0	0	0	0	114.2	L2160 Y2177	L2160-T2162 PolarHBondContact O-N 3.38Å; T2162-Y2177 PolarHBondContact OG1-OH 2.94Å
2163	C	76.6	Confident	64.5	Low	16 Å²	16	66.3 Å²	66.3	11%	0.108	38%	0.378	C	S	.	.	S	Bend	trans	-71.1	154.2	174.4	-53.2	0	0	0	0	111.1	N2161 A2167 C2179	N2161-C2163 VanDerWaalsContact C-N 3.3Å; N2161-C2163 WeakPolarHBondContact OD1-CB 3.46Å; N2161-C2163 PolarHBondContact OD1-N 3.34Å; N2161-C2163 PolarHBondContact OD1-SG 2.87Å; C2163-A2167 HydrophobicContact CB-CB 3.95Å; C2163-C2179 WeakPolarHBondContact CA-SG 3.18Å; C2163-C2179 HydrophobicContact CB-CB 3.57Å; C2163-C2179 WeakPolarHBondContact CB-SG 3.36Å; C2163-C2179 VanDerWaalsContact SG-CA 3.53Å; C2163-C2179 WeakPolarHBondContact SG-CB 3.42Å; C2163-C2179 CovalentContact SG-SG 2.02Å; C2163-C2179 PolarHBondContact SG-SG 3.01Å
2164	D	76	Confident	64.3	Low	24 Å²	24	67.8 Å²	67.8	13%	0.128	41%	0.406	C	S	.	.			trans	-55	146.3	169.6	-167.8	-72.2	0	0	0	109.9	N2166 A2167 G2196 K2198 C2199	D2164-N2166 PolarHBondContact O-N 3.39Å; D2164-N2166 WeakPolarHBondContact OD1-CA 3.46Å; D2164-N2166 VanDerWaalsContact OD1-CB 3.29Å; D2164-N2166 WeakPolarHBondContact OD1-CB 3.45Å; D2164-N2166 PolarHBondContact OD1-N 3Å; D2164-N2166 PolarHBondContact OD1-ND2 3.13Å; D2164-A2167 HydrophobicContact CB-CB 3.97Å; D2164-A2167 WeakPolarHBondContact O-CA 2.87Å; D2164-A2167 WeakPolarHBondContact O-CB 3.33Å; D2164-A2167 PolarHBondContact O-N 3.38Å; D2164-G2196 PolarHBondContact N-O 3.37Å; D2164-K2198 VanDerWaalsContact OD2-CA 3.3Å; D2164-K2198 WeakPolarHBondContact OD2-CA 3.36Å; D2164-C2199 HydrophobicContact CB-CB 4.13Å; D2164-C2199 PolarHBondContact OD2-N 3.04Å
2165	P	73.2	Confident	63.6	Low	108 Å²	108	68.6 Å²	68.6	70%	0.701	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-25.5	171.1	-28	36.6	0	0	0	113.6	A2167 K2182	P2165-A2167 VanDerWaalsContact C-N 3.32Å; P2165-K2182 PolarHBondContact O-NZ 2.8Å
2166	N	75.7	Confident	62.9	Low	49 Å²	49	73.3 Å²	73.3	26%	0.262	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	25.7	172.7	-45.7	-72	0	0	0	112.6	D2164 K2182 Y2185 C2199	D2164-N2166 PolarHBondContact O-N 3.39Å; D2164-N2166 WeakPolarHBondContact OD1-CA 3.46Å; D2164-N2166 VanDerWaalsContact OD1-CB 3.29Å; D2164-N2166 WeakPolarHBondContact OD1-CB 3.45Å; D2164-N2166 PolarHBondContact OD1-N 3Å; D2164-N2166 PolarHBondContact OD1-ND2 3.13Å; N2166-K2182 WeakPolarHBondContact O-CB 3.26Å; N2166-K2182 WeakPolarHBondContact O-CG 3.17Å; N2166-K2182 PolarHBondContact O-N 3.23Å; N2166-Y2185 HydrophobicContact CB-CD1 3.74Å; N2166-Y2185 HydrophobicContact CB-CD2 4.04Å; N2166-Y2185 HydrophobicContact CB-CE1 3.97Å; N2166-Y2185 HydrophobicContact CB-CE2 4.27Å; N2166-Y2185 HydrophobicContact CB-CG 3.78Å; N2166-C2199 HydrophobicContact CB-CB 4.09Å
2167	A	80.3	Confident	63.5	Low	7 Å²	7	71.2 Å²	71.2	6%	0.058	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	163	173.3	0	0	0	0	0	112.4	C2163 D2164 P2165 E2180 K2182 G2196	C2163-A2167 HydrophobicContact CB-CB 3.95Å; D2164-A2167 HydrophobicContact CB-CB 3.97Å; D2164-A2167 WeakPolarHBondContact O-CA 2.87Å; D2164-A2167 WeakPolarHBondContact O-CB 3.33Å; D2164-A2167 PolarHBondContact O-N 3.38Å; P2165-A2167 VanDerWaalsContact C-N 3.32Å; A2167-E2180 CarbonylContact C-O 3Å; A2167-E2180 WeakPolarHBondContact CA-O 3.31Å; A2167-E2180 VanDerWaalsContact CB-O 3.22Å; A2167-E2180 WeakPolarHBondContact CB-O 3.38Å; A2167-K2182 WeakPolarHBondContact O-CE 3.4Å; A2167-G2196 WeakPolarHBondContact CB-O 3.49Å
2168	E	75.4	Confident	64.1	Low	132 Å²	132	73.9 Å²	73.9	62%	0.617	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	145.1	176	-174.3	164.1	174.4	0	0	110.5	C2179 E2180	E2168-C2179 VanDerWaalsContact O-CA 3.29Å; E2168-C2179 WeakPolarHBondContact O-CA 3.49Å; E2168-E2180 PolarHBondContact N-O 2.93Å; E2168-E2180 PolarHBondContact O-N 3.33Å
2169	C	77.9	Confident	65.1	Low	23 Å²	23	64.5 Å²	64.5	16%	0.155	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.1	-178.1	-172.3	0	0	0	0	110	C2155	C2155-C2169 WeakPolarHBondContact CA-SG 3.45Å; C2155-C2169 HydrophobicContact CB-CB 3.78Å; C2155-C2169 WeakPolarHBondContact CB-SG 3.21Å; C2155-C2169 WeakPolarHBondContact SG-CB 3.47Å; C2155-C2169 PolarHBondContact SG-O 2.7Å; C2155-C2169 VanDerWaalsContact SG-O 3.35Å; C2155-C2169 CovalentContact SG-SG 2.05Å; C2155-C2169 PolarHBondContact SG-SG 2.88Å
2170	V	71.6	Confident	66	Low	64 Å²	64	64.4 Å²	64.4	39%	0.388	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	117.5	178.1	-175.3	0	0	0	0	109.3	C2155 Y2177 R2178	C2155-V2170 VanDerWaalsContact SG-C 3.54Å; V2170-Y2177 CarbonylContact O-C 3.34Å; V2170-Y2177 VanDerWaalsContact O-CA 3.22Å; V2170-Y2177 WeakPolarHBondContact O-CA 3.29Å; V2170-Y2177 WeakPolarHBondContact O-CB 3.15Å; V2170-R2178 PolarHBondContact N-O 2.62Å; V2170-R2178 PolarHBondContact O-N 3.49Å
2171	F	64.7	Low	67.5	Low	77 Å²	77	65 Å²	65	34%	0.338	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	138	175.6	-179.1	-121	0	0	0	111.4	N2153 C2155 E2176	N2153-F2171 HydrophobicContact CB-CD1 4.2Å; N2153-F2171 HydrophobicContact CB-CD2 4.17Å; N2153-F2171 HydrophobicContact CB-CE1 3.97Å; N2153-F2171 HydrophobicContact CB-CE2 3.95Å; N2153-F2171 HydrophobicContact CB-CG 4.28Å; N2153-F2171 HydrophobicContact CB-CZ 3.83Å; N2153-F2171 VanDerWaalsContact CG-CG 3.41Å; N2153-F2171 WeakPolarHBondContact ND2-CD1 3.45Å; N2153-F2171 WeakPolarHBondContact ND2-CG 3.47Å; N2153-F2171 WeakPolarHBondContact OD1-CD2 3.16Å; N2153-F2171 VanDerWaalsContact OD1-CG 3.3Å; N2153-F2171 WeakPolarHBondContact OD1-CG 3.42Å; C2155-F2171 HydrophobicContact CB-CB 4.23Å; C2155-F2171 PolarHBondContact SG-N 3.27Å; F2171-E2176 WeakPolarHBondContact CD2-O 3.14Å; F2171-E2176 WeakPolarHBondContact CE2-O 3.36Å
2172	I	61.5	Low	67.9	Low	71 Å²	71	66.3 Å²	66.3	36%	0.364	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.9	-178.4	-57.9	172.6	0	0	0	108.5	G2174 G2175 E2176 R2178	I2172-G2174 PolarHBondContact O-N 3.03Å; I2172-G2175 PolarHBondContact O-N 3.09Å; I2172-E2176 WeakPolarHBondContact CA-O 3.46Å; I2172-E2176 HydrophobicContact CB-CB 3.94Å; I2172-E2176 HydrophobicContact CD1-CB 4.47Å; I2172-E2176 HydrophobicContact CG2-CB 4.27Å; I2172-E2176 PolarHBondContact N-O 2.04Å; I2172-E2176 PolarHBondContact O-N 3.06Å; I2172-E2176 VanDerWaalsContact O-O 3.09Å; I2172-R2178 HydrophobicContact CD1-CB 4.44Å
2173	S	41.1	Very low	68	Low	118 Å²	118	68.5 Å²	68.5	83%	0.825	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	125.9	-177.7	-67.3	0	0	0	0	111
2174	G	45.5	Very low	67.5	Low	84 Å²	84	69.7 Å²	69.7	87%	0.866	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.1	-2.1	-174.1	0	0	0	0	0	115	I2172	I2172-G2174 PolarHBondContact O-N 3.03Å
2175	G	48.3	Very low	67.5	Low	16 Å²	16	72.3 Å²	72.3	17%	0.165	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.3	1	175.5	0	0	0	0	0	114.6	I2172	I2172-G2175 PolarHBondContact O-N 3.09Å
2176	E	51.8	Low	67.6	Low	137 Å²	137	69.2 Å²	69.2	64%	0.64	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	161.7	170.9	-71.8	-169.2	137.6	0	0	111.9	F2171 I2172	F2171-E2176 WeakPolarHBondContact CD2-O 3.14Å; F2171-E2176 WeakPolarHBondContact CE2-O 3.36Å; I2172-E2176 WeakPolarHBondContact CA-O 3.46Å; I2172-E2176 HydrophobicContact CB-CB 3.94Å; I2172-E2176 HydrophobicContact CD1-CB 4.47Å; I2172-E2176 HydrophobicContact CG2-CB 4.27Å; I2172-E2176 PolarHBondContact N-O 2.04Å; I2172-E2176 PolarHBondContact O-N 3.06Å; I2172-E2176 VanDerWaalsContact O-O 3.09Å
2177	Y	69	Low	67.6	Low	54 Å²	54	70.1 Å²	70.1	21%	0.212	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	161.9	172	70.3	-68.5	0	0	0	109.9	M2150 P2154 T2162 V2170	M2150-Y2177 HydrophobicContact CE-CE1 3.81Å; M2150-Y2177 HydrophobicContact SD-CE1 4.36Å; P2154-Y2177 HydrophobicContact CB-CD1 4.19Å; P2154-Y2177 HydrophobicContact CB-CD2 4.34Å; P2154-Y2177 HydrophobicContact CB-CE1 4.11Å; P2154-Y2177 HydrophobicContact CB-CE2 4.28Å; P2154-Y2177 HydrophobicContact CB-CG 4.28Å; P2154-Y2177 HydrophobicContact CG-CD1 3.23Å; P2154-Y2177 HydrophobicContact CG-CD2 3.79Å; P2154-Y2177 HydrophobicContact CG-CE1 3.62Å; P2154-Y2177 HydrophobicContact CG-CE2 4.14Å; P2154-Y2177 HydrophobicContact CG-CG 3.3Å; T2162-Y2177 PolarHBondContact OG1-OH 2.94Å; V2170-Y2177 CarbonylContact O-C 3.34Å; V2170-Y2177 VanDerWaalsContact O-CA 3.22Å; V2170-Y2177 WeakPolarHBondContact O-CA 3.29Å; V2170-Y2177 WeakPolarHBondContact O-CB 3.15Å
2178	R	71.1	Confident	66.9	Low	111 Å²	111	70.3 Å²	70.3	42%	0.419	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	151.9	179.4	176.1	169.7	165.7	-114.6	-20.1	111	V2170 I2172 E2180	V2170-R2178 PolarHBondContact N-O 2.62Å; V2170-R2178 PolarHBondContact O-N 3.49Å; I2172-R2178 HydrophobicContact CD1-CB 4.44Å; R2178-E2180 IonicContact CZ-OE1 3.45Å; R2178-E2180 IonicContact NH1-OE1 3.45Å; R2178-E2180 PolarHBondContact NH1-OE1 3.04Å; R2178-E2180 IonicContact NH2-OE1 3.35Å; R2178-E2180 PolarHBondContact NH2-OE1 3.44Å
2179	C	78.6	Confident	66.4	Low	6 Å²	6	66.2 Å²	66.2	4%	0.041	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	144.4	173.5	-53.5	0	0	0	0	111.5	C2163 E2168 R2195 G2196	C2163-C2179 WeakPolarHBondContact CA-SG 3.18Å; C2163-C2179 HydrophobicContact CB-CB 3.57Å; C2163-C2179 WeakPolarHBondContact CB-SG 3.36Å; C2163-C2179 VanDerWaalsContact SG-CA 3.53Å; C2163-C2179 WeakPolarHBondContact SG-CB 3.42Å; C2163-C2179 CovalentContact SG-SG 2.02Å; C2163-C2179 PolarHBondContact SG-SG 3.01Å; E2168-C2179 VanDerWaalsContact O-CA 3.29Å; E2168-C2179 WeakPolarHBondContact O-CA 3.49Å; C2179-R2195 WeakPolarHBondContact CB-O 3.1Å; C2179-G2196 WeakPolarHBondContact CB-O 3.34Å
2180	E	70.7	Confident	65.6	Low	87 Å²	87	68.3 Å²	68.3	41%	0.407	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.6	174	-55.2	-159.2	128.6	0	0	110.2	A2167 E2168 R2178	A2167-E2180 CarbonylContact C-O 3Å; A2167-E2180 WeakPolarHBondContact CA-O 3.31Å; A2167-E2180 VanDerWaalsContact CB-O 3.22Å; A2167-E2180 WeakPolarHBondContact CB-O 3.38Å; E2168-E2180 PolarHBondContact N-O 2.93Å; E2168-E2180 PolarHBondContact O-N 3.33Å; R2178-E2180 IonicContact CZ-OE1 3.45Å; R2178-E2180 IonicContact NH1-OE1 3.45Å; R2178-E2180 PolarHBondContact NH1-OE1 3.04Å; R2178-E2180 IonicContact NH2-OE1 3.35Å; R2178-E2180 PolarHBondContact NH2-OE1 3.44Å
2181	C	80.2	Confident	65	Low	34 Å²	34	69 Å²	69	23%	0.23	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	141.6	178.8	-63	0	0	0	0	111.5	Y2185 C2199	C2181-Y2185 VanDerWaalsContact CB-O 3.28Å; C2181-Y2185 WeakPolarHBondContact CB-O 3.39Å; C2181-C2199 VanDerWaalsContact CA-SG 3.56Å; C2181-C2199 HydrophobicContact CB-CB 3.88Å; C2181-C2199 WeakPolarHBondContact CB-SG 3.13Å; C2181-C2199 WeakPolarHBondContact SG-CB 3.29Å; C2181-C2199 CovalentContact SG-SG 2.04Å; C2181-C2199 PolarHBondContact SG-SG 2.91Å
2182	K	71	Confident	63.9	Low	89 Å²	89	70.4 Å²	70.4	39%	0.387	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-70.8	153.3	178.4	-69.5	173.2	-173.4	161.4	0	110.9	P2165 N2166 A2167 G2184 Y2185	P2165-K2182 PolarHBondContact O-NZ 2.8Å; N2166-K2182 WeakPolarHBondContact O-CB 3.26Å; N2166-K2182 WeakPolarHBondContact O-CG 3.17Å; N2166-K2182 PolarHBondContact O-N 3.23Å; A2167-K2182 WeakPolarHBondContact O-CE 3.4Å; K2182-G2184 PolarHBondContact O-N 2.89Å; K2182-Y2185 PolarHBondContact O-N 2.98Å
2183	P	67.3	Low	63.4	Low	132 Å²	132	68.9 Å²	68.9	86%	0.857	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	135.5	176.2	-27.9	35.5	0	0	0	113	Y2185	P2183-Y2185 VanDerWaalsContact C-N 3.35Å
2184	G	66.4	Low	64.3	Low	40 Å²	40	67.8 Å²	67.8	41%	0.412	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	-11.4	-171.4	0	0	0	0	0	114.5	K2182 D2202	K2182-G2184 PolarHBondContact O-N 2.89Å; G2184-D2202 PolarHBondContact O-N 3.37Å; G2184-D2202 VanDerWaalsContact O-N 3.13Å
2185	Y	76	Confident	65.1	Low	79 Å²	79	69.9 Å²	69.9	31%	0.31	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	141.3	179	-57	-102.4	0	0	0	112.5	N2166 C2181 K2182 P2183 V2200 Y2201	N2166-Y2185 HydrophobicContact CB-CD1 3.74Å; N2166-Y2185 HydrophobicContact CB-CD2 4.04Å; N2166-Y2185 HydrophobicContact CB-CE1 3.97Å; N2166-Y2185 HydrophobicContact CB-CE2 4.27Å; N2166-Y2185 HydrophobicContact CB-CG 3.78Å; C2181-Y2185 VanDerWaalsContact CB-O 3.28Å; C2181-Y2185 WeakPolarHBondContact CB-O 3.39Å; K2182-Y2185 PolarHBondContact O-N 2.98Å; P2183-Y2185 VanDerWaalsContact C-N 3.35Å; Y2185-V2200 CarbonylContact C-O 2.7Å; Y2185-V2200 WeakPolarHBondContact CA-O 3.27Å; Y2185-V2200 WeakPolarHBondContact CB-O 3.44Å; Y2185-Y2201 HydrophobicContact CE1-CD2 4.19Å
2186	V	76.5	Confident	66.1	Low	43 Å²	43	69.1 Å²	69.1	26%	0.261	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	163.3	-179.3	-66.8	0	0	0	0	110.9	C2199 V2200 D2202	V2186-C2199 CarbonylContact O-C 3.32Å; V2186-C2199 WeakPolarHBondContact O-CA 3.28Å; V2186-V2200 PolarHBondContact N-O 2.9Å; V2186-V2200 PolarHBondContact O-N 2.7Å; V2186-D2202 HydrophobicContact CG1-CB 4.07Å; V2186-D2202 WeakPolarHBondContact CG1-OD2 2.76Å; V2186-D2202 HydrophobicContact CG2-CB 3.91Å
2187	E	75.6	Confident	67	Low	69 Å²	69	64.4 Å²	64.4	32%	0.322	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-68.8	131.9	174	-75.4	163.1	-163.6	0	0	110.2	R2195 G2196	E2187-R2195 WeakPolarHBondContact OE1-CA 3.42Å; E2187-R2195 VanDerWaalsContact OE1-CB 3.24Å; E2187-R2195 WeakPolarHBondContact OE1-CB 3.48Å; E2187-R2195 WeakPolarHBondContact OE1-CG 3.2Å; E2187-R2195 IonicContact OE2-NE 3.51Å; E2187-G2196 PolarHBondContact OE1-N 2.93Å
2188	P	65.9	Low	67.1	Low	11 Å²	11	66.7 Å²	66.7	7%	0.071	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-66.6	141	-180	23.1	-28.8	0	0	0	110.8	G2190 F2191 K2198 V2200	P2188-G2190 PolarHBondContact O-N 2.66Å; P2188-F2191 HydrophobicContact CG-CB 4.16Å; P2188-F2191 WeakPolarHBondContact O-CB 3.45Å; P2188-F2191 PolarHBondContact O-N 3.24Å; P2188-K2198 VanDerWaalsContact CD-O 3.24Å; P2188-K2198 WeakPolarHBondContact CD-O 3.43Å; P2188-K2198 HydrophobicContact CG-CD 3.82Å; P2188-K2198 HydrophobicContact CG-CG 4.03Å; P2188-V2200 HydrophobicContact CB-CB 4.39Å; P2188-V2200 HydrophobicContact CB-CG1 3.8Å; P2188-V2200 HydrophobicContact CB-CG2 3.66Å; P2188-V2200 HydrophobicContact CG-CG1 3.88Å; P2188-V2200 HydrophobicContact CG-CG2 4.31Å
2189	F	63.5	Low	67.5	Low	45 Å²	45	61.8 Å²	61.8	20%	0.197	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	125.9	-175.4	-162.6	-69.3	0	0	0	112.2	G224 D226 F240 V2218 N2219 F2220	G224-F2189 WeakPolarHBondContact O-CE2 3.25Å; G224-F2189 WeakPolarHBondContact O-CZ 3.1Å; D226-F2189 HydrophobicContact CB-CD1 4.03Å; D226-F2189 HydrophobicContact CB-CD2 4.29Å; D226-F2189 HydrophobicContact CB-CE1 3.44Å; D226-F2189 VanDerWaalsContact CB-CE1 3.44Å; D226-F2189 HydrophobicContact CB-CE2 3.62Å; D226-F2189 HydrophobicContact CB-CG 4.49Å; D226-F2189 HydrophobicContact CB-CZ 3.2Å; D226-F2189 WeakPolarHBondContact OD1-CE1 3.44Å; D226-F2189 VanDerWaalsContact OD1-CZ 3.31Å; D226-F2189 WeakPolarHBondContact OD1-CZ 3.35Å; D226-F2189 WeakPolarHBondContact OD2-CE1 3.36Å; F240-F2189 HydrophobicContact CZ-CZ 4.22Å; F2189-V2218 HydrophobicContact CD2-CB 4.02Å; F2189-V2218 HydrophobicContact CD2-CG1 4.11Å; F2189-V2218 HydrophobicContact CD2-CG2 4.49Å; F2189-V2218 HydrophobicContact CE2-CB 4.5Å; F2189-V2218 HydrophobicContact CE2-CG1 4.14Å; F2189-N2219 WeakPolarHBondContact CB-O 3.44Å; F2189-N2219 PolarHBondContact N-O 2.99Å; F2189-F2220 HydrophobicContact CD1-CE1 4.22Å; F2189-F2220 HydrophobicContact CD1-CE2 4.35Å; F2189-F2220 AromaticContact CD1-CZ 3.9Å; F2189-F2220 HydrophobicContact CD1-CZ 3.9Å; F2189-F2220 HydrophobicContact CG-CE2 4.31Å; F2189-F2220 HydrophobicContact CG-CZ 4.28Å
2190	G	61.5	Low	67.3	Low	67 Å²	67	62.9 Å²	62.9	69%	0.691	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	10.9	175.2	0	0	0	0	0	115.7	P2188 A2192	P2188-G2190 PolarHBondContact O-N 2.66Å; G2190-A2192 PolarHBondContact O-N 3.19Å
2191	F	58.7	Low	67.4	Low	79 Å²	79	64.5 Å²	64.5	35%	0.346	37%	0.374	S	S	.	.			trans	-68.5	122.8	174.6	179	-108.5	0	0	0	112.7	P2188 T2197 K2198	P2188-F2191 HydrophobicContact CG-CB 4.16Å; P2188-F2191 WeakPolarHBondContact O-CB 3.45Å; P2188-F2191 PolarHBondContact O-N 3.24Å; F2191-T2197 WeakPolarHBondContact CE1-OG1 3.47Å; F2191-T2197 WeakPolarHBondContact CZ-OG1 3.49Å; F2191-K2198 HydrophobicContact CD1-CB 4.37Å; F2191-K2198 HydrophobicContact CD2-CB 4.21Å; F2191-K2198 HydrophobicContact CD2-CD 3.91Å; F2191-K2198 HydrophobicContact CE1-CB 4.04Å; F2191-K2198 HydrophobicContact CE2-CB 3.87Å; F2191-K2198 HydrophobicContact CE2-CD 3.96Å; F2191-K2198 HydrophobicContact CG-CB 4.44Å; F2191-K2198 HydrophobicContact CZ-CB 3.77Å
2192	A	42.2	Very low	67.1	Low	106 Å²	106	64.5 Å²	64.5	88%	0.876	37%	0.372	S	S	*	.			trans	-104.3	78.5	178	0	0	0	0	0	111.3	G2190	G2190-A2192 PolarHBondContact O-N 3.19Å
2193	G	49.8	Very low	67.1	Low	40 Å²	40	62.8 Å²	62.8	41%	0.412	37%	0.367	S	S	.	.	S	Bend	trans	-154.4	-177	177.2	0	0	0	0	0	112.2
2194	P	59.9	Low	67.1	Low	94 Å²	94	58.1 Å²	58.1	61%	0.61	34%	0.336	S	S	*	.	S	Bend	trans	-64.1	141.3	174.9	-14.7	28.7	0	0	0	110.6	T2197	P2194-T2197 HydrophobicContact CB-CG2 3.85Å; P2194-T2197 HydrophobicContact CG-CG2 4.17Å; P2194-T2197 WeakPolarHBondContact O-CB 3.46Å; P2194-T2197 WeakPolarHBondContact O-CG2 3.21Å; P2194-T2197 PolarHBondContact O-N 3.3Å; P2194-T2197 PolarHBondContact O-OG1 2.91Å
2195	R	63.6	Low	67.1	Low	128 Å²	128	59.6 Å²	59.6	48%	0.483	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	141.9	177.6	-79.1	-167.6	150.2	157.2	-5.3	111.8	C2179 E2187 T2197	C2179-R2195 WeakPolarHBondContact CB-O 3.1Å; E2187-R2195 WeakPolarHBondContact OE1-CA 3.42Å; E2187-R2195 VanDerWaalsContact OE1-CB 3.24Å; E2187-R2195 WeakPolarHBondContact OE1-CB 3.48Å; E2187-R2195 WeakPolarHBondContact OE1-CG 3.2Å; E2187-R2195 IonicContact OE2-NE 3.51Å; R2195-T2197 VanDerWaalsContact C-N 3.31Å; R2195-T2197 PolarHBondContact O-N 3.47Å
2196	G	68.5	Low	66.1	Low	0 Å²	0	61 Å²	61	0%	0	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	12	-179.4	0	0	0	0	0	116.4	D2164 A2167 C2179 E2187	D2164-G2196 PolarHBondContact N-O 3.37Å; A2167-G2196 WeakPolarHBondContact CB-O 3.49Å; C2179-G2196 WeakPolarHBondContact CB-O 3.34Å; E2187-G2196 PolarHBondContact OE1-N 2.93Å
2197	T	71.8	Confident	64.9	Low	39 Å²	39	64 Å²	64	24%	0.239	37%	0.372	C	S	.	.	S	Bend	trans	-93.4	-8.3	176	61.1	0	0	0	0	114.2	F2191 P2194 R2195	F2191-T2197 WeakPolarHBondContact CE1-OG1 3.47Å; F2191-T2197 WeakPolarHBondContact CZ-OG1 3.49Å; P2194-T2197 HydrophobicContact CB-CG2 3.85Å; P2194-T2197 HydrophobicContact CG-CG2 4.17Å; P2194-T2197 WeakPolarHBondContact O-CB 3.46Å; P2194-T2197 WeakPolarHBondContact O-CG2 3.21Å; P2194-T2197 PolarHBondContact O-N 3.3Å; P2194-T2197 PolarHBondContact O-OG1 2.91Å; R2195-T2197 VanDerWaalsContact C-N 3.31Å; R2195-T2197 PolarHBondContact O-N 3.47Å
2198	K	70	Confident	64	Low	101 Å²	101	66.8 Å²	66.8	44%	0.439	40%	0.396	S	S	.	.	S	Bend	trans	-149.1	116.5	169.4	-172.9	178.8	-179.1	-175.9	0	110.2	D2164 P2188 F2191	D2164-K2198 VanDerWaalsContact OD2-CA 3.3Å; D2164-K2198 WeakPolarHBondContact OD2-CA 3.36Å; P2188-K2198 VanDerWaalsContact CD-O 3.24Å; P2188-K2198 WeakPolarHBondContact CD-O 3.43Å; P2188-K2198 HydrophobicContact CG-CD 3.82Å; P2188-K2198 HydrophobicContact CG-CG 4.03Å; F2191-K2198 HydrophobicContact CD1-CB 4.37Å; F2191-K2198 HydrophobicContact CD2-CB 4.21Å; F2191-K2198 HydrophobicContact CD2-CD 3.91Å; F2191-K2198 HydrophobicContact CE1-CB 4.04Å; F2191-K2198 HydrophobicContact CE2-CB 3.87Å; F2191-K2198 HydrophobicContact CE2-CD 3.96Å; F2191-K2198 HydrophobicContact CG-CB 4.44Å; F2191-K2198 HydrophobicContact CZ-CB 3.77Å
2199	C	78.8	Confident	63.7	Low	9 Å²	9	71.2 Å²	71.2	6%	0.061	41%	0.414	C	S	.	.			trans	-123.3	122.5	-176	-58.2	0	0	0	0	110.2	D2164 N2166 C2181 V2186	D2164-C2199 HydrophobicContact CB-CB 4.13Å; D2164-C2199 PolarHBondContact OD2-N 3.04Å; N2166-C2199 HydrophobicContact CB-CB 4.09Å; C2181-C2199 VanDerWaalsContact CA-SG 3.56Å; C2181-C2199 HydrophobicContact CB-CB 3.88Å; C2181-C2199 WeakPolarHBondContact CB-SG 3.13Å; C2181-C2199 WeakPolarHBondContact SG-CB 3.29Å; C2181-C2199 CovalentContact SG-SG 2.04Å; C2181-C2199 PolarHBondContact SG-SG 2.91Å; V2186-C2199 CarbonylContact O-C 3.32Å; V2186-C2199 WeakPolarHBondContact O-CA 3.28Å
2200	V	75.7	Confident	63.5	Low	28 Å²	28	70.9 Å²	70.9	17%	0.17	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	165.5	175.2	-59.9	0	0	0	0	110.4	Y2185 V2186 P2188	Y2185-V2200 CarbonylContact C-O 2.7Å; Y2185-V2200 WeakPolarHBondContact CA-O 3.27Å; Y2185-V2200 WeakPolarHBondContact CB-O 3.44Å; V2186-V2200 PolarHBondContact N-O 2.9Å; V2186-V2200 PolarHBondContact O-N 2.7Å; P2188-V2200 HydrophobicContact CB-CB 4.39Å; P2188-V2200 HydrophobicContact CB-CG1 3.8Å; P2188-V2200 HydrophobicContact CB-CG2 3.66Å; P2188-V2200 HydrophobicContact CG-CG1 3.88Å; P2188-V2200 HydrophobicContact CG-CG2 4.31Å
2201	Y	72	Confident	63.2	Low	121 Å²	121	77.7 Å²	77.7	48%	0.475	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	143.4	-178.8	-153	-86.5	0	0	0	111.9	Y2185 L2203 D2206	Y2185-Y2201 HydrophobicContact CE1-CD2 4.19Å; Y2201-L2203 PolarHBondContact O-N 3.37Å; Y2201-D2206 WeakPolarHBondContact CE1-OD2 3.32Å
2202	D	74.3	Confident	63.1	Low	34 Å²	34	77.9 Å²	77.9	18%	0.182	43%	0.43	C	S	.	.			trans	-88.1	98.7	-178.3	-166.9	-17.6	0	0	0	112.8	G2184 V2186 C2204 A2205 N2219	G2184-D2202 PolarHBondContact O-N 3.37Å; G2184-D2202 VanDerWaalsContact O-N 3.13Å; V2186-D2202 HydrophobicContact CG1-CB 4.07Å; V2186-D2202 WeakPolarHBondContact CG1-OD2 2.76Å; V2186-D2202 HydrophobicContact CG2-CB 3.91Å; D2202-C2204 PolarHBondContact OD1-N 3.14Å; D2202-C2204 VanDerWaalsContact OD1-N 3.09Å; D2202-A2205 HydrophobicContact CB-CB 4.04Å; D2202-A2205 PolarHBondContact OD1-N 3.29Å; D2202-N2219 PolarHBondContact OD1-ND2 3.45Å
2203	L	71	Confident	63.8	Low	54 Å²	54	82.5 Å²	82.5	28%	0.283	43%	0.43	S	S	.	.	H	α-helix	trans	-78.2	-25.4	178.7	-63.9	166.3	0	0	0	113.2	Y2201 L2207 N2219 A2224	Y2201-L2203 PolarHBondContact O-N 3.37Å; L2203-L2207 PolarHBondContact O-N 2.7Å; L2203-N2219 WeakPolarHBondContact CA-OD1 3.38Å; L2203-N2219 WeakPolarHBondContact CB-OD1 3.27Å; L2203-N2219 PolarHBondContact N-OD1 3.19Å; L2203-A2224 HydrophobicContact CB-CB 4.37Å
2204	C	67.3	Low	64.6	Low	33 Å²	33	83 Å²	83	22%	0.223	42%	0.423	C	S	.	.	H	α-helix	trans	-76.5	-22.7	176.4	-76.3	0	0	0	0	113.1	D2202 C2217 V2218 N2219	D2202-C2204 PolarHBondContact OD1-N 3.14Å; D2202-C2204 VanDerWaalsContact OD1-N 3.09Å; C2204-C2217 HydrophobicContact CB-CB 3.92Å; C2204-C2217 WeakPolarHBondContact CB-SG 3.46Å; C2204-C2217 WeakPolarHBondContact SG-CB 3.23Å; C2204-C2217 CovalentContact SG-SG 2.05Å; C2204-C2217 PolarHBondContact SG-SG 2.71Å; C2204-V2218 VanDerWaalsContact SG-CA 3.51Å; C2204-V2218 PolarHBondContact SG-N 3.3Å; C2204-N2219 PolarHBondContact N-OD1 3.33Å
2205	A	66.4	Low	64.9	Low	71 Å²	71	79.6 Å²	79.6	59%	0.587	40%	0.403	S	S	*	.	H	α-helix	trans	-72.4	-39.9	172.3	0	0	0	0	0	112.6	D2202	D2202-A2205 HydrophobicContact CB-CB 4.04Å; D2202-A2205 PolarHBondContact OD1-N 3.29Å
2206	D	54.4	Low	65.1	Low	108 Å²	108	75.9 Å²	75.9	58%	0.578	39%	0.394	S	S	*	.	H	α-helix	trans	-84.3	-18.8	-172.7	-80.4	-6.9	0	0	0	114.3	Y2201	Y2201-D2206 WeakPolarHBondContact CE1-OD2 3.32Å
2207	L	52.5	Low	65.3	Low	107 Å²	107	77.5 Å²	77.5	56%	0.56	41%	0.405	S	S	*	.	S	Bend	trans	-131.8	128	-173.9	-69.1	173.3	0	0	0	113.5	L2203 F2209	L2203-L2207 PolarHBondContact O-N 2.7Å; L2207-F2209 PolarHBondContact O-N 3.07Å
2208	P	55	Low	65.3	Low	128 Å²	128	76.4 Å²	76.4	83%	0.831	40%	0.399	S	S	*	.			trans	-75.6	74.5	176	32.2	-35.4	0	0	0	111
2209	F	59.7	Low	65	Low	104 Å²	104	72.5 Å²	72.5	46%	0.456	38%	0.383	S	S	.	.			trans	-74	-31.1	-165.7	-163.8	-108.2	0	0	0	114	L2207 A2224 C2226	L2207-F2209 PolarHBondContact O-N 3.07Å; F2209-A2224 HydrophobicContact CD1-CB 4.43Å; F2209-C2226 WeakPolarHBondContact CD1-SG 3.36Å; F2209-C2226 PolarHBondContact O-SG 2.91Å
2210	C	59.4	Low	64	Low	38 Å²	38	75 Å²	75	26%	0.257	39%	0.393	S	S	.	.			trans	-110.9	127.7	-177	-48.4	0	0	0	0	112	T2216 C2226	C2210-T2216 VanDerWaalsContact SG-C 3.57Å; C2210-C2226 WeakPolarHBondContact CA-SG 3.36Å; C2210-C2226 HydrophobicContact CB-CB 4.13Å; C2210-C2226 WeakPolarHBondContact CB-SG 3.35Å; C2210-C2226 VanDerWaalsContact SG-CA 3.57Å; C2210-C2226 WeakPolarHBondContact SG-CB 3.45Å; C2210-C2226 CovalentContact SG-SG 2.04Å; C2210-C2226 PolarHBondContact SG-SG 3.09Å
2211	K	55.3	Low	63.4	Low	210 Å²	210	75.7 Å²	75.7	91%	0.913	41%	0.405	S	S	*	.			trans	-98.7	-11.3	-175.1	-84.2	-173.2	174.4	179.6	0	116.2
2212	E	57.7	Low	62.8	Low	83 Å²	83	77.1 Å²	77.1	39%	0.388	42%	0.421	S	S	.	.	S	Bend	trans	-113	145	-167.3	-80.9	177.5	-137.8	0	0	114.3	N2214 A2215 F2252	E2212-N2214 PolarHBondContact O-N 2.78Å; E2212-A2215 PolarHBondContact O-N 2.89Å; E2212-A2215 VanDerWaalsContact O-N 3.13Å; E2212-F2252 VanDerWaalsContact CD-CD2 3.42Å; E2212-F2252 VanDerWaalsContact OE1-CD2 3.28Å; E2212-F2252 WeakPolarHBondContact OE1-CD2 3.49Å; E2212-F2252 WeakPolarHBondContact OE1-CE2 3.34Å; E2212-F2252 WeakPolarHBondContact OE2-CD2 3.17Å
2213	K	56.7	Low	61.9	Low	202 Å²	202	82.7 Å²	82.7	88%	0.878	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.2	-169.6	-66.7	-176.7	177.1	179.2	0	115
2214	N	65.9	Low	61.5	Low	50 Å²	50	81.3 Å²	81.3	27%	0.267	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	21.6	-177.1	-62.1	4.6	0	0	0	112.1	E2212 C2228 L2229 C2253	E2212-N2214 PolarHBondContact O-N 2.78Å; N2214-C2228 CarbonylContact O-C 3.29Å; N2214-C2228 VanDerWaalsContact O-CA 3.24Å; N2214-C2228 WeakPolarHBondContact O-CA 3.35Å; N2214-L2229 HydrophobicContact CB-CD1 4.39Å; N2214-L2229 PolarHBondContact O-N 2.77Å; N2214-C2253 HydrophobicContact CB-CB 4.01Å; N2214-C2253 WeakPolarHBondContact CB-SG 3.33Å; N2214-C2253 PolarHBondContact O-SG 2.05Å
2215	A	67.5	Low	61.4	Low	23 Å²	23	82.9 Å²	82.9	19%	0.19	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156.2	-179.5	0	0	0	0	0	116.9	E2212 Q2227	E2212-A2215 PolarHBondContact O-N 2.89Å; E2212-A2215 VanDerWaalsContact O-N 3.13Å; A2215-Q2227 CarbonylContact C-O 3.58Å; A2215-Q2227 WeakPolarHBondContact CA-O 3.39Å; A2215-Q2227 WeakPolarHBondContact CB-O 3.46Å
2216	T	68.2	Low	61.5	Low	50 Å²	50	80.3 Å²	80.3	31%	0.307	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	152.9	-166	-33.3	0	0	0	0	113.4	C2210 C2226 Q2227	C2210-T2216 VanDerWaalsContact SG-C 3.57Å; T2216-C2226 CarbonylContact O-C 3.51Å; T2216-C2226 VanDerWaalsContact O-CA 3.27Å; T2216-C2226 WeakPolarHBondContact O-CA 3.28Å; T2216-Q2227 PolarHBondContact N-O 2.04Å; T2216-Q2227 PolarHBondContact O-N 3.02Å
2217	C	70.9	Confident	61.6	Low	34 Å²	34	75.5 Å²	75.5	23%	0.23	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	145.4	-176.8	-170.2	0	0	0	0	114.3	C2204 D2225	C2204-C2217 HydrophobicContact CB-CB 3.92Å; C2204-C2217 WeakPolarHBondContact CB-SG 3.46Å; C2204-C2217 WeakPolarHBondContact SG-CB 3.23Å; C2204-C2217 CovalentContact SG-SG 2.05Å; C2204-C2217 PolarHBondContact SG-SG 2.71Å; C2217-D2225 CarbonylContact C-O 3.58Å; C2217-D2225 VanDerWaalsContact CA-O 3.31Å; C2217-D2225 WeakPolarHBondContact CA-O 3.2Å
2218	V	72.1	Confident	62.2	Low	17 Å²	17	70.7 Å²	70.7	10%	0.103	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	151.5	167.2	-70.6	0	0	0	0	116.3	V225 F2189 C2204 F2220 A2224 D2225 Q2227	V225-V2218 WeakPolarHBondContact O-CG1 3.38Å; F2189-V2218 HydrophobicContact CD2-CB 4.02Å; F2189-V2218 HydrophobicContact CD2-CG1 4.11Å; F2189-V2218 HydrophobicContact CD2-CG2 4.49Å; F2189-V2218 HydrophobicContact CE2-CB 4.5Å; F2189-V2218 HydrophobicContact CE2-CG1 4.14Å; C2204-V2218 VanDerWaalsContact SG-CA 3.51Å; C2204-V2218 PolarHBondContact SG-N 3.3Å; V2218-F2220 HydrophobicContact CG2-CD2 4.19Å; V2218-F2220 HydrophobicContact CG2-CE2 4.17Å; V2218-A2224 CarbonylContact O-C 3.34Å; V2218-A2224 WeakPolarHBondContact O-CA 3.46Å; V2218-D2225 PolarHBondContact N-O 3.37Å; V2218-D2225 PolarHBondContact O-N 3.09Å; V2218-Q2227 HydrophobicContact CG2-CG 4.48Å
2219	N	63.9	Low	62.5	Low	19 Å²	19	67.9 Å²	67.9	10%	0.102	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	97.5	-177.2	-66.8	-50.4	0	0	0	114.4	F2189 D2202 L2203 C2204 G2221 R2223	F2189-N2219 WeakPolarHBondContact CB-O 3.44Å; F2189-N2219 PolarHBondContact N-O 2.99Å; D2202-N2219 PolarHBondContact OD1-ND2 3.45Å; L2203-N2219 WeakPolarHBondContact CA-OD1 3.38Å; L2203-N2219 WeakPolarHBondContact CB-OD1 3.27Å; L2203-N2219 PolarHBondContact N-OD1 3.19Å; C2204-N2219 PolarHBondContact N-OD1 3.33Å; N2219-G2221 PolarHBondContact O-N 2.98Å; N2219-R2223 CarbonylContact C-O 3.55Å
2220	F	58.1	Low	62	Low	62 Å²	62	65.9 Å²	65.9	27%	0.272	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	84.5	172.5	-94.6	-83.5	0	0	0	112.1	D226 F2189 V2218 D2222 R2223	D226-F2220 HydrophobicContact CB-CE2 4.17Å; D226-F2220 HydrophobicContact CB-CZ 4.18Å; F2189-F2220 HydrophobicContact CD1-CE1 4.22Å; F2189-F2220 HydrophobicContact CD1-CE2 4.35Å; F2189-F2220 AromaticContact CD1-CZ 3.9Å; F2189-F2220 HydrophobicContact CD1-CZ 3.9Å; F2189-F2220 HydrophobicContact CG-CE2 4.31Å; F2189-F2220 HydrophobicContact CG-CZ 4.28Å; V2218-F2220 HydrophobicContact CG2-CD2 4.19Å; V2218-F2220 HydrophobicContact CG2-CE2 4.17Å; F2220-D2222 PolarHBondContact O-N 3.09Å; F2220-R2223 CarbonylContact C-O 3.46Å; F2220-R2223 WeakPolarHBondContact CA-O 3.45Å; F2220-R2223 HydrophobicContact CB-CG 4.01Å; F2220-R2223 PolarHBondContact N-O 2.96Å; F2220-R2223 VanDerWaalsContact O-CG 3.24Å; F2220-R2223 WeakPolarHBondContact O-CG 3.48Å; F2220-R2223 PolarHBondContact O-N 3.23Å; F2220-R2223 VanDerWaalsContact O-N 3.13Å
2221	G	63.8	Low	61.3	Low	41 Å²	41	65.8 Å²	65.8	42%	0.423	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	-88.5	171.9	0	0	0	0	0	113.3	N2219	N2219-G2221 PolarHBondContact O-N 2.98Å
2222	D	57.8	Low	61.5	Low	151 Å²	151	60.8 Å²	60.8	81%	0.807	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	12.7	179.4	58.9	-23.5	0	0	0	113.5	F2220	F2220-D2222 PolarHBondContact O-N 3.09Å
2223	R	55.5	Low	61.6	Low	152 Å²	152	57.2 Å²	57.2	57%	0.574	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.8	168.8	178.5	61.7	172.4	-165.6	-169.3	5.4	113.4	N2219 F2220	N2219-R2223 CarbonylContact C-O 3.55Å; F2220-R2223 CarbonylContact C-O 3.46Å; F2220-R2223 WeakPolarHBondContact CA-O 3.45Å; F2220-R2223 HydrophobicContact CB-CG 4.01Å; F2220-R2223 PolarHBondContact N-O 2.96Å; F2220-R2223 VanDerWaalsContact O-CG 3.24Å; F2220-R2223 WeakPolarHBondContact O-CG 3.48Å; F2220-R2223 PolarHBondContact O-N 3.23Å; F2220-R2223 VanDerWaalsContact O-N 3.13Å
2224	A	63.5	Low	61.7	Low	24 Å²	24	47.6 Å²	47.6	20%	0.198	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	158.5	175.9	0	0	0	0	0	113.5	L2203 F2209 V2218	L2203-A2224 HydrophobicContact CB-CB 4.37Å; F2209-A2224 HydrophobicContact CD1-CB 4.43Å; V2218-A2224 CarbonylContact O-C 3.34Å; V2218-A2224 WeakPolarHBondContact O-CA 3.46Å
2225	D	64.7	Low	61.3	Low	66 Å²	66	45.5 Å²	45.5	35%	0.353	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	161.4	-179.8	-157.4	-0.5	0	0	0	113.6	C2217 V2218	C2217-D2225 CarbonylContact C-O 3.58Å; C2217-D2225 VanDerWaalsContact CA-O 3.31Å; C2217-D2225 WeakPolarHBondContact CA-O 3.2Å; V2218-D2225 PolarHBondContact N-O 3.37Å; V2218-D2225 PolarHBondContact O-N 3.09Å
2226	C	69.7	Low	60.9	Low	17 Å²	17	47.4 Å²	47.4	12%	0.115	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.9	-175.2	-74.1	0	0	0	0	115.2	P229 F2209 C2210 T2216	P229-C2226 VanDerWaalsContact CA-O 3.23Å; P229-C2226 WeakPolarHBondContact CA-O 3.46Å; P229-C2226 WeakPolarHBondContact CB-O 3.43Å; P229-C2226 WeakPolarHBondContact CD-O 3.49Å; P229-C2226 VanDerWaalsContact CG-O 3.24Å; P229-C2226 WeakPolarHBondContact CG-O 3.32Å; F2209-C2226 WeakPolarHBondContact CD1-SG 3.36Å; F2209-C2226 PolarHBondContact O-SG 2.91Å; C2210-C2226 WeakPolarHBondContact CA-SG 3.36Å; C2210-C2226 HydrophobicContact CB-CB 4.13Å; C2210-C2226 WeakPolarHBondContact CB-SG 3.35Å; C2210-C2226 VanDerWaalsContact SG-CA 3.57Å; C2210-C2226 WeakPolarHBondContact SG-CB 3.45Å; C2210-C2226 CovalentContact SG-SG 2.04Å; C2210-C2226 PolarHBondContact SG-SG 3.09Å; T2216-C2226 CarbonylContact O-C 3.51Å; T2216-C2226 VanDerWaalsContact O-CA 3.27Å; T2216-C2226 WeakPolarHBondContact O-CA 3.28Å
2227	Q	55.1	Low	60.2	Low	8 Å²	8	46.4 Å²	46.4	4%	0.037	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.5	-160.6	-56.2	-168.6	-15.7	0	0	114.6	V225 D226 C227 A2215 T2216 V2218	V225-Q2227 PolarHBondContact O-OE1 2.78Å; D226-Q2227 VanDerWaalsContact CA-OE1 3.22Å; C227-Q2227 WeakPolarHBondContact O-CB 3.24Å; C227-Q2227 WeakPolarHBondContact O-CG 3.23Å; C227-Q2227 PolarHBondContact O-NE2 2.93Å; C227-Q2227 VanDerWaalsContact O-NE2 3.14Å; C227-Q2227 PolarHBondContact O-OE1 3.46Å; C227-Q2227 VanDerWaalsContact O-OE1 3.09Å; A2215-Q2227 CarbonylContact C-O 3.58Å; A2215-Q2227 WeakPolarHBondContact CA-O 3.39Å; A2215-Q2227 WeakPolarHBondContact CB-O 3.46Å; T2216-Q2227 PolarHBondContact N-O 2.04Å; T2216-Q2227 PolarHBondContact O-N 3.02Å; V2218-Q2227 HydrophobicContact CG2-CG 4.48Å
2228	C	65.4	Low	59	Low	5 Å²	5	45.4 Å²	45.4	3%	0.034	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	158.9	-178.5	-88.4	0	0	0	0	113.9	P229 N2214 D2234 C2253	P229-C2228 WeakPolarHBondContact O-CB 3.41Å; P229-C2228 PolarHBondContact O-N 3.3Å; P229-C2228 PolarHBondContact O-SG 2.7Å; N2214-C2228 CarbonylContact O-C 3.29Å; N2214-C2228 VanDerWaalsContact O-CA 3.24Å; N2214-C2228 WeakPolarHBondContact O-CA 3.35Å; C2228-D2234 VanDerWaalsContact SG-CB 3.6Å; C2228-C2253 HydrophobicContact CB-CB 4.11Å; C2228-C2253 WeakPolarHBondContact CB-SG 3.48Å; C2228-C2253 WeakPolarHBondContact SG-CB 3.42Å; C2228-C2253 CovalentContact SG-SG 2.05Å; C2228-C2253 PolarHBondContact SG-SG 2.97Å
2229	L	62	Low	58	Low	69 Å²	69	44.8 Å²	44.8	36%	0.361	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-72.5	153.6	171.4	-71.6	179.1	0	0	0	113.1	N2214 Y2232	N2214-L2229 HydrophobicContact CB-CD1 4.39Å; N2214-L2229 PolarHBondContact O-N 2.77Å; L2229-Y2232 PolarHBondContact O-N 3.1Å
2230	D	49.4	Very low	57.2	Low	63 Å²	63	47.6 Å²	47.6	34%	0.337	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	156.5	169.8	-157.7	38.6	0	0	0	113.1	Q232 C233 Y2232	Q232-D2230 WeakPolarHBondContact CB-OD1 3.19Å; Q232-D2230 WeakPolarHBondContact CG-OD1 3.48Å; Q232-D2230 PolarHBondContact NE2-OD1 3.33Å; C233-D2230 HydrophobicContact CB-CB 4.4Å; C233-D2230 PolarHBondContact N-OD1 3.03Å; C233-D2230 WeakPolarHBondContact O-CB 3.4Å; D2230-Y2232 PolarHBondContact O-N 3.25Å
2231	G	44.6	Very low	56.6	Low	36 Å²	36	46.8 Å²	46.8	37%	0.371	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-13.4	-168.4	0	0	0	0	0	114.8
2232	Y	59.6	Low	55.6	Low	105 Å²	105	47.5 Å²	47.5	41%	0.412	25%	0.251	S	S	.	.			trans	-122.6	124.3	-177.3	-67.5	-98.2	0	0	0	114.9	L2229 D2230 D2234 C2253 L2254	L2229-Y2232 PolarHBondContact O-N 3.1Å; D2230-Y2232 PolarHBondContact O-N 3.25Å; Y2232-D2234 PolarHBondContact O-N 3.17Å; Y2232-C2253 HydrophobicContact CD1-CB 4.31Å; Y2232-C2253 HydrophobicContact CG-CB 4.08Å; Y2232-L2254 CarbonylContact C-O 3.45Å; Y2232-L2254 WeakPolarHBondContact CA-O 3.48Å; Y2232-L2254 WeakPolarHBondContact CB-O 3.48Å
2233	L	59.3	Low	55	Low	8 Å²	8	41 Å²	41	4%	0.042	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	94.4	171.4	-76	77.4	0	0	0	109.9	Q232 N245 A246 L2254 P2256	Q232-L2233 HydrophobicContact CG-CD1 4.32Å; N245-L2233 HydrophobicContact CB-CB 3.62Å; N245-L2233 HydrophobicContact CB-CD2 4.47Å; N245-L2233 HydrophobicContact CB-CG 4.01Å; N245-L2233 WeakPolarHBondContact ND2-CA 3.36Å; N245-L2233 WeakPolarHBondContact OD1-CA 3.38Å; N245-L2233 WeakPolarHBondContact OD1-CG 3.48Å; A246-L2233 HydrophobicContact CB-CB 4.34Å; A246-L2233 HydrophobicContact CB-CD2 3.75Å; L2233-L2254 PolarHBondContact N-O 2.96Å; L2233-L2254 CarbonylContact O-C 2.84Å; L2233-L2254 VanDerWaalsContact O-CA 3.31Å; L2233-L2254 WeakPolarHBondContact O-CA 3.19Å; L2233-L2254 WeakPolarHBondContact O-CB 3.33Å; L2233-L2254 PolarHBondContact O-N 2.78Å; L2233-P2256 HydrophobicContact CD1-CB 3.87Å; L2233-P2256 HydrophobicContact CD1-CG 3.69Å; L2233-P2256 HydrophobicContact CD2-CB 3.85Å
2234	D	58.9	Low	54.9	Low	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-32	151.7	160.5	-159.5	-12.9	0	0	0	113.9	N230 N245 F248 C2228 Y2232 R2236 F2252	N230-D2234 WeakPolarHBondContact CA-OD2 2.98Å; N230-D2234 HydrophobicContact CB-CB 3.65Å; N230-D2234 PolarHBondContact N-OD2 3.01Å; N230-D2234 PolarHBondContact ND2-OD2 2.87Å; N230-D2234 PolarHBondContact OD1-OD1 2.99Å; N230-D2234 PolarHBondContact OD1-OD2 3.27Å; N245-D2234 HydrophobicContact CB-CB 4.36Å; N245-D2234 WeakPolarHBondContact CB-O 3.48Å; N245-D2234 WeakPolarHBondContact ND2-CA 3.27Å; N245-D2234 WeakPolarHBondContact ND2-CB 3.48Å; N245-D2234 PolarHBondContact ND2-N 3.34Å; F248-D2234 WeakPolarHBondContact CE2-O 3.38Å; F248-D2234 WeakPolarHBondContact CZ-O 3.25Å; C2228-D2234 VanDerWaalsContact SG-CB 3.6Å; Y2232-D2234 PolarHBondContact O-N 3.17Å; D2234-R2236 PolarHBondContact OD1-N 3.28Å; D2234-R2236 IonicContact OD1-NE 3.39Å; D2234-R2236 PolarHBondContact OD1-NE 3.11Å; D2234-R2236 IonicContact OD2-CZ 3.72Å; D2234-R2236 IonicContact OD2-NE 2.8Å; D2234-R2236 PolarHBondContact OD2-NE 2.04Å; D2234-R2236 IonicContact OD2-NH2 2.84Å; D2234-R2236 PolarHBondContact OD2-NH2 2.87Å; D2234-F2252 CarbonylContact C-O 3.17Å; D2234-F2252 WeakPolarHBondContact CA-O 3.43Å; D2234-F2252 VanDerWaalsContact OD1-C 3.23Å; D2234-F2252 WeakPolarHBondContact OD1-CA 3.13Å; D2234-F2252 VanDerWaalsContact OD1-CB 3.31Å; D2234-F2252 WeakPolarHBondContact OD1-CB 3.4Å
2235	I	57.7	Low	53.9	Low	5 Å²	5	42.7 Å²	42.7	3%	0.026	24%	0.235	C	C	.	.			trans	-124.6	9.5	173.1	44.5	154.2	0	0	0	114.2	F248 K2237 S2238 R2243 L2248 V2251 F2252 L2254	F248-I2235 HydrophobicContact CE2-CB 4.47Å; F248-I2235 HydrophobicContact CE2-CG2 4.2Å; I2235-K2237 VanDerWaalsContact C-N 3.28Å; I2235-K2237 PolarHBondContact O-N 3.07Å; I2235-S2238 WeakPolarHBondContact O-CB 3.29Å; I2235-S2238 PolarHBondContact O-N 2.91Å; I2235-R2243 HydrophobicContact CD1-CG 4.1Å; I2235-R2243 VanDerWaalsContact O-CD 3.28Å; I2235-R2243 WeakPolarHBondContact O-CD 3.13Å; I2235-R2243 PolarHBondContact O-NH1 3.21Å; I2235-L2248 HydrophobicContact CD1-CB 3.55Å; I2235-L2248 HydrophobicContact CD1-CD1 4.24Å; I2235-L2248 HydrophobicContact CD1-CG 4.38Å; I2235-V2251 HydrophobicContact CD1-CB 4Å; I2235-V2251 HydrophobicContact CD1-CG1 4.03Å; I2235-V2251 HydrophobicContact CG1-CB 4.46Å; I2235-V2251 HydrophobicContact CG1-CG1 4.12Å; I2235-V2251 WeakPolarHBondContact CG1-O 3.26Å; I2235-F2252 WeakPolarHBondContact CG1-O 3.47Å; I2235-F2252 PolarHBondContact N-O 2.87Å; I2235-L2254 HydrophobicContact CD1-CD1 3.98Å; I2235-L2254 HydrophobicContact CG1-CB 4.3Å; I2235-L2254 HydrophobicContact CG1-CD1 4.48Å; I2235-L2254 HydrophobicContact CG2-CB 4.14Å; I2235-L2254 HydrophobicContact CG2-CD2 4.46Å
2236	R	58.6	Low	53.3	Low	64 Å²	64	45.3 Å²	45.3	24%	0.242	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-40.5	179.9	-76.6	173.4	-83.8	-149.5	-8.5	113.9	P229 N230 K265 D2234 F2252	P229-R2236 VanDerWaalsContact CB-CZ 3.47Å; P229-R2236 PolarHBondContact O-NH2 2.95Å; N230-R2236 VanDerWaalsContact OD1-CB 3.28Å; N230-R2236 WeakPolarHBondContact OD1-CB 3.25Å; N230-R2236 PolarHBondContact OD1-N 2.92Å; N230-R2236 VanDerWaalsContact OD1-N 3.16Å; K265-R2236 VanDerWaalsContact CE-O 3.26Å; K265-R2236 WeakPolarHBondContact CE-O 3.42Å; K265-R2236 PolarHBondContact NZ-O 3.12Å; D2234-R2236 PolarHBondContact OD1-N 3.28Å; D2234-R2236 IonicContact OD1-NE 3.39Å; D2234-R2236 PolarHBondContact OD1-NE 3.11Å; D2234-R2236 IonicContact OD2-CZ 3.72Å; D2234-R2236 IonicContact OD2-NE 2.8Å; D2234-R2236 PolarHBondContact OD2-NE 2.04Å; D2234-R2236 IonicContact OD2-NH2 2.84Å; D2234-R2236 PolarHBondContact OD2-NH2 2.87Å; R2236-F2252 HydrophobicContact CG-CB 4.24Å; R2236-F2252 HydrophobicContact CG-CD1 3.12Å; R2236-F2252 HydrophobicContact CG-CD2 4.09Å; R2236-F2252 HydrophobicContact CG-CE1 3.38Å; R2236-F2252 HydrophobicContact CG-CE2 4.3Å; R2236-F2252 HydrophobicContact CG-CG 3.54Å; R2236-F2252 HydrophobicContact CG-CZ 3.99Å; R2236-F2252 VanDerWaalsContact CZ-CD2 3.49Å; R2236-F2252 VanDerWaalsContact NH1-CD2 3.33Å
2237	K	53.8	Low	52.3	Low	29 Å²	29	47.5 Å²	47.5	13%	0.126	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	27.5	170.1	-4.8	107.6	153.1	172	0	114.6	D228 N230 F248 C263 S264 K265 I2235	D228-K2237 WeakPolarHBondContact OD1-CE 3.09Å; D228-K2237 IonicContact OD1-NZ 3.21Å; D228-K2237 PolarHBondContact OD1-NZ 2.88Å; D228-K2237 IonicContact OD2-NZ 3.61Å; D228-K2237 PolarHBondContact OD2-NZ 3.33Å; N230-K2237 HydrophobicContact CB-CD 3.81Å; N230-K2237 VanDerWaalsContact CG-CD 3.44Å; N230-K2237 WeakPolarHBondContact ND2-CD 3.34Å; N230-K2237 WeakPolarHBondContact ND2-CE 3.09Å; N230-K2237 PolarHBondContact OD1-N 3.16Å; F248-K2237 HydrophobicContact CD1-CB 3.48Å; F248-K2237 VanDerWaalsContact CD1-CB 3.48Å; F248-K2237 HydrophobicContact CD1-CD 3.56Å; F248-K2237 HydrophobicContact CD1-CG 4.06Å; F248-K2237 WeakPolarHBondContact CD1-O 3.08Å; F248-K2237 HydrophobicContact CE1-CB 3.41Å; F248-K2237 VanDerWaalsContact CE1-CB 3.41Å; F248-K2237 HydrophobicContact CE1-CD 3.4Å; F248-K2237 HydrophobicContact CE1-CG 3.76Å; F248-K2237 WeakPolarHBondContact CE1-O 3.41Å; F248-K2237 WeakPolarHBondContact CG-O 3.12Å; C263-K2237 VanDerWaalsContact C-CD 3.47Å; C263-K2237 HydrophobicContact CB-CD 3.97Å; C263-K2237 WeakPolarHBondContact O-CD 3.05Å; C263-K2237 WeakPolarHBondContact O-CE 3.4Å; C263-K2237 PolarHBondContact SG-NZ 3.5Å; S264-K2237 CarbonylContact C-O 3.19Å; K265-K2237 WeakPolarHBondContact CA-O 3.19Å; K265-K2237 HydrophobicContact CG-CB 4.09Å; K265-K2237 WeakPolarHBondContact CG-O 3.44Å; K265-K2237 PolarHBondContact N-O 3.37Å; K265-K2237 VanDerWaalsContact N-O 3.12Å; I2235-K2237 VanDerWaalsContact C-N 3.28Å; I2235-K2237 PolarHBondContact O-N 3.07Å
2238	S	45.4	Very low	52.2	Low	12 Å²	12	49.3 Å²	49.3	8%	0.084	28%	0.284	C	S	.	.	S	Bend	trans	-94.2	126.9	163.6	-164.5	0	0	0	0	109.6	A246 G247 K265 I2235 R2243	A246-S2238 VanDerWaalsContact O-CB 3.3Å; A246-S2238 WeakPolarHBondContact O-CB 3.5Å; A246-S2238 PolarHBondContact O-OG 3.43Å; G247-S2238 WeakPolarHBondContact CA-OG 3.18Å; G247-S2238 WeakPolarHBondContact O-CA 3.31Å; K265-S2238 WeakPolarHBondContact CE-O 3.25Å; I2235-S2238 WeakPolarHBondContact O-CB 3.29Å; I2235-S2238 PolarHBondContact O-N 2.91Å; S2238-R2243 WeakPolarHBondContact O-CD 3.43Å
2239	P	50.6	Low	51.6	Low	4 Å²	4	53 Å²	53	3%	0.026	30%	0.303	C	S	.	.			trans	-44.9	137.9	-158.6	17	-33.8	0	0	0	115.5	G247 K265 E266 I267 S2241 T2242 R2243	G247-P2239 WeakPolarHBondContact O-CD 3.08Å; K265-P2239 HydrophobicContact CB-CB 4.41Å; E266-P2239 HydrophobicContact CB-CG 4.39Å; E266-P2239 WeakPolarHBondContact O-CB 3.48Å; E266-P2239 VanDerWaalsContact O-CG 3.22Å; E266-P2239 WeakPolarHBondContact O-CG 3.39Å; I267-P2239 HydrophobicContact CG1-CB 3.91Å; P2239-S2241 VanDerWaalsContact C-N 3.32Å; P2239-S2241 PolarHBondContact O-N 3.23Å; P2239-T2242 VanDerWaalsContact CG-OG1 3.3Å; P2239-T2242 WeakPolarHBondContact CG-OG1 3.29Å; P2239-T2242 PolarHBondContact O-N 3.01Å; P2239-T2242 VanDerWaalsContact O-N 3.16Å; P2239-R2243 PolarHBondContact O-N 2.95Å
2240	V	48.6	Very low	51	Low	79 Å²	79	57.2 Å²	57.2	48%	0.479	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-41.7	-173	-175.5	0	0	0	0	110.8	K265 R2243 A2244	K265-V2240 HydrophobicContact CD-CG2 3.86Å; K265-V2240 VanDerWaalsContact NZ-CG2 3.33Å; V2240-R2243 PolarHBondContact O-N 2.92Å; V2240-A2244 VanDerWaalsContact O-CB 3.3Å; V2240-A2244 WeakPolarHBondContact O-CB 3.5Å; V2240-A2244 PolarHBondContact O-N 3.35Å
2241	S	44.5	Very low	51.4	Low	45 Å²	45	56.8 Å²	56.8	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-54.3	-52.3	173	41	0	0	0	0	111.5	P2239 A2244 Q2245	P2239-S2241 VanDerWaalsContact C-N 3.32Å; P2239-S2241 PolarHBondContact O-N 3.23Å; S2241-A2244 PolarHBondContact O-N 3.02Å; S2241-Q2245 VanDerWaalsContact O-CB 3.31Å; S2241-Q2245 WeakPolarHBondContact O-CB 3.34Å; S2241-Q2245 WeakPolarHBondContact O-CG 3.47Å; S2241-Q2245 PolarHBondContact O-N 3.12Å
2242	T	43.7	Very low	52.3	Low	55 Å²	55	57.8 Å²	57.8	34%	0.337	32%	0.32	S	S	.	.	H	α-helix	trans	-71.5	-34.9	-177.6	-38.4	0	0	0	0	112.5	P2239 Q2245 L2246	P2239-T2242 VanDerWaalsContact CG-OG1 3.3Å; P2239-T2242 WeakPolarHBondContact CG-OG1 3.29Å; P2239-T2242 PolarHBondContact O-N 3.01Å; P2239-T2242 VanDerWaalsContact O-N 3.16Å; T2242-Q2245 PolarHBondContact O-N 2.9Å; T2242-L2246 HydrophobicContact CG2-CD1 4.1Å; T2242-L2246 WeakPolarHBondContact O-CB 3.44Å; T2242-L2246 VanDerWaalsContact O-CG 3.27Å; T2242-L2246 WeakPolarHBondContact O-CG 3.46Å; T2242-L2246 PolarHBondContact O-N 3.25Å
2243	R	45.4	Very low	52.4	Low	16 Å²	16	53.4 Å²	53.4	6%	0.06	30%	0.304	C	S	.	.	H	α-helix	trans	-60.8	-47.1	170.4	-92.1	174.2	69.9	119	0.9	112.3	I2235 S2238 P2239 V2240 L2246 G2247 L2248 D2249 V2251	I2235-R2243 HydrophobicContact CD1-CG 4.1Å; I2235-R2243 VanDerWaalsContact O-CD 3.28Å; I2235-R2243 WeakPolarHBondContact O-CD 3.13Å; I2235-R2243 PolarHBondContact O-NH1 3.21Å; S2238-R2243 WeakPolarHBondContact O-CD 3.43Å; P2239-R2243 PolarHBondContact O-N 2.95Å; V2240-R2243 PolarHBondContact O-N 2.92Å; R2243-L2246 CarbonylContact O-C 3.57Å; R2243-L2246 PolarHBondContact O-N 2.98Å; R2243-G2247 PolarHBondContact O-N 3.49Å; R2243-L2248 HydrophobicContact CG-CB 4.47Å; R2243-L2248 PolarHBondContact NE-O 3.49Å; R2243-L2248 PolarHBondContact NH2-O 2.99Å; R2243-L2248 VanDerWaalsContact NH2-O 3.14Å; R2243-L2248 PolarHBondContact O-N 3.38Å; R2243-D2249 PolarHBondContact NH2-O 3.48Å; R2243-V2251 VanDerWaalsContact CZ-O 3.27Å; R2243-V2251 PolarHBondContact NH1-O 3.13Å; R2243-V2251 PolarHBondContact NH2-O 3.03Å
2244	A	51.8	Low	52.4	Low	55 Å²	55	54.8 Å²	54.8	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-68.6	-38	178.7	0	0	0	0	0	111.8	V2240 S2241 L2246 G2247	V2240-A2244 VanDerWaalsContact O-CB 3.3Å; V2240-A2244 WeakPolarHBondContact O-CB 3.5Å; V2240-A2244 PolarHBondContact O-N 3.35Å; S2241-A2244 PolarHBondContact O-N 3.02Å; A2244-L2246 PolarHBondContact O-N 2.64Å; A2244-G2247 PolarHBondContact O-N 3.07Å
2245	Q	43.8	Very low	52.1	Low	156 Å²	156	60.8 Å²	60.8	73%	0.729	34%	0.338	S	S	*	.	H	α-helix	trans	-65	-26.5	173	-75.2	170.3	-0.4	0	0	113	S2241 T2242	S2241-Q2245 VanDerWaalsContact O-CB 3.31Å; S2241-Q2245 WeakPolarHBondContact O-CB 3.34Å; S2241-Q2245 WeakPolarHBondContact O-CG 3.47Å; S2241-Q2245 PolarHBondContact O-N 3.12Å; T2242-Q2245 PolarHBondContact O-N 2.9Å
2246	L	52.1	Low	51.6	Low	120 Å²	120	63.8 Å²	63.8	63%	0.628	36%	0.357	S	S	*	.	H	α-helix	trans	-100.3	-1.7	176.7	-64.5	175.8	0	0	0	114.1	T2242 R2243 A2244 L2248	T2242-L2246 HydrophobicContact CG2-CD1 4.1Å; T2242-L2246 WeakPolarHBondContact O-CB 3.44Å; T2242-L2246 VanDerWaalsContact O-CG 3.27Å; T2242-L2246 WeakPolarHBondContact O-CG 3.46Å; T2242-L2246 PolarHBondContact O-N 3.25Å; R2243-L2246 CarbonylContact O-C 3.57Å; R2243-L2246 PolarHBondContact O-N 2.98Å; A2244-L2246 PolarHBondContact O-N 2.64Å; L2246-L2248 HydrophobicContact CB-CD1 3.8Å; L2246-L2248 HydrophobicContact CB-CG 4.18Å; L2246-L2248 HydrophobicContact CD1-CD1 4.39Å
2247	G	49.1	Very low	50.8	Low	63 Å²	63	64.8 Å²	64.8	65%	0.649	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	28.7	178.3	0	0	0	0	0	115.2	R2243 A2244	R2243-G2247 PolarHBondContact O-N 3.49Å; A2244-G2247 PolarHBondContact O-N 3.07Å
2248	L	52.7	Low	50.5	Low	47 Å²	47	68.5 Å²	68.5	25%	0.246	40%	0.395	C	S	.	.			trans	-107.8	33.9	-169.1	-67.7	168.5	0	0	0	113.6	I2235 R2243 L2246 L2254	I2235-L2248 HydrophobicContact CD1-CB 3.55Å; I2235-L2248 HydrophobicContact CD1-CD1 4.24Å; I2235-L2248 HydrophobicContact CD1-CG 4.38Å; R2243-L2248 HydrophobicContact CG-CB 4.47Å; R2243-L2248 PolarHBondContact NE-O 3.49Å; R2243-L2248 PolarHBondContact NH2-O 2.99Å; R2243-L2248 VanDerWaalsContact NH2-O 3.14Å; R2243-L2248 PolarHBondContact O-N 3.38Å; L2246-L2248 HydrophobicContact CB-CD1 3.8Å; L2246-L2248 HydrophobicContact CB-CG 4.18Å; L2246-L2248 HydrophobicContact CD1-CD1 4.39Å; L2248-L2254 HydrophobicContact CD1-CD1 3.72Å; L2248-L2254 HydrophobicContact CD2-CD1 3.7Å; L2248-L2254 HydrophobicContact CG-CD1 4.28Å
2249	D	52.3	Low	50.6	Low	82 Å²	82	73.7 Å²	73.7	44%	0.439	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-23.6	-166.1	-72.2	-41.9	0	0	0	116.1	R2243	R2243-D2249 PolarHBondContact NH2-O 3.48Å
2250	D	50.2	Low	49.9	Very low	157 Å²	157	79.2 Å²	79.2	84%	0.84	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-2.8	175.3	-72.9	-37	0	0	0	113.8
2251	V	57.5	Low	49.1	Very low	54 Å²	54	83.7 Å²	83.7	33%	0.327	46%	0.464	S	S	.	.			trans	-88.6	131.7	-177.9	173.7	0	0	0	0	110	I2235 R2243 L2254	I2235-V2251 HydrophobicContact CD1-CB 4Å; I2235-V2251 HydrophobicContact CD1-CG1 4.03Å; I2235-V2251 HydrophobicContact CG1-CB 4.46Å; I2235-V2251 HydrophobicContact CG1-CG1 4.12Å; I2235-V2251 WeakPolarHBondContact CG1-O 3.26Å; R2243-V2251 VanDerWaalsContact CZ-O 3.27Å; R2243-V2251 PolarHBondContact NH1-O 3.13Å; R2243-V2251 PolarHBondContact NH2-O 3.03Å; V2251-L2254 HydrophobicContact CG1-CB 4.45Å; V2251-L2254 HydrophobicContact CG1-CD1 4.21Å
2252	F	62.7	Low	48.7	Very low	57 Å²	57	87 Å²	87	25%	0.25	49%	0.486	C	S	.	.	S	Bend	trans	-91.1	-87.6	158.2	-61.6	-13.2	0	0	0	108.7	E2212 D2234 I2235 R2236 L2254	E2212-F2252 VanDerWaalsContact CD-CD2 3.42Å; E2212-F2252 VanDerWaalsContact OE1-CD2 3.28Å; E2212-F2252 WeakPolarHBondContact OE1-CD2 3.49Å; E2212-F2252 WeakPolarHBondContact OE1-CE2 3.34Å; E2212-F2252 WeakPolarHBondContact OE2-CD2 3.17Å; D2234-F2252 CarbonylContact C-O 3.17Å; D2234-F2252 WeakPolarHBondContact CA-O 3.43Å; D2234-F2252 VanDerWaalsContact OD1-C 3.23Å; D2234-F2252 WeakPolarHBondContact OD1-CA 3.13Å; D2234-F2252 VanDerWaalsContact OD1-CB 3.31Å; D2234-F2252 WeakPolarHBondContact OD1-CB 3.4Å; I2235-F2252 WeakPolarHBondContact CG1-O 3.47Å; I2235-F2252 PolarHBondContact N-O 2.87Å; R2236-F2252 HydrophobicContact CG-CB 4.24Å; R2236-F2252 HydrophobicContact CG-CD1 3.12Å; R2236-F2252 HydrophobicContact CG-CD2 4.09Å; R2236-F2252 HydrophobicContact CG-CE1 3.38Å; R2236-F2252 HydrophobicContact CG-CE2 4.3Å; R2236-F2252 HydrophobicContact CG-CG 3.54Å; R2236-F2252 HydrophobicContact CG-CZ 3.99Å; R2236-F2252 VanDerWaalsContact CZ-CD2 3.49Å; R2236-F2252 VanDerWaalsContact NH1-CD2 3.33Å; F2252-L2254 PolarHBondContact O-N 3.47Å
2253	C	62	Low	48.3	Very low	13 Å²	13	88.9 Å²	88.9	9%	0.088	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.8	-172.5	-22.1	0	0	0	0	116.3	N2214 C2228 Y2232	N2214-C2253 HydrophobicContact CB-CB 4.01Å; N2214-C2253 WeakPolarHBondContact CB-SG 3.33Å; N2214-C2253 PolarHBondContact O-SG 2.05Å; C2228-C2253 HydrophobicContact CB-CB 4.11Å; C2228-C2253 WeakPolarHBondContact CB-SG 3.48Å; C2228-C2253 WeakPolarHBondContact SG-CB 3.42Å; C2228-C2253 CovalentContact SG-SG 2.05Å; C2228-C2253 PolarHBondContact SG-SG 2.97Å; Y2232-C2253 HydrophobicContact CD1-CB 4.31Å; Y2232-C2253 HydrophobicContact CG-CB 4.08Å
2254	L	58.8	Low	48	Very low	37 Å²	37	93.8 Å²	93.8	19%	0.194	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	-170.2	-175.5	-163.9	118.7	0	0	0	112.8	Y2232 L2233 I2235 L2248 V2251 F2252	Y2232-L2254 CarbonylContact C-O 3.45Å; Y2232-L2254 WeakPolarHBondContact CA-O 3.48Å; Y2232-L2254 WeakPolarHBondContact CB-O 3.48Å; L2233-L2254 PolarHBondContact N-O 2.96Å; L2233-L2254 CarbonylContact O-C 2.84Å; L2233-L2254 VanDerWaalsContact O-CA 3.31Å; L2233-L2254 WeakPolarHBondContact O-CA 3.19Å; L2233-L2254 WeakPolarHBondContact O-CB 3.33Å; L2233-L2254 PolarHBondContact O-N 2.78Å; I2235-L2254 HydrophobicContact CD1-CD1 3.98Å; I2235-L2254 HydrophobicContact CG1-CB 4.3Å; I2235-L2254 HydrophobicContact CG1-CD1 4.48Å; I2235-L2254 HydrophobicContact CG2-CB 4.14Å; I2235-L2254 HydrophobicContact CG2-CD2 4.46Å; L2248-L2254 HydrophobicContact CD1-CD1 3.72Å; L2248-L2254 HydrophobicContact CD2-CD1 3.7Å; L2248-L2254 HydrophobicContact CG-CD1 4.28Å; V2251-L2254 HydrophobicContact CG1-CB 4.45Å; V2251-L2254 HydrophobicContact CG1-CD1 4.21Å; F2252-L2254 PolarHBondContact O-N 3.47Å
2255	K	52.6	Low	47.1	Very low	127 Å²	127	94.2 Å²	94.2	55%	0.552	54%	0.544	S	S	*	.			trans	-129.3	147.9	-173.5	-168	172.7	-178.7	-172.9	0	113	S2257	K2255-S2257 PolarHBondContact O-N 3.38Å
2256	P	47.9	Very low	46.7	Very low	68 Å²	68	93.8 Å²	93.8	44%	0.442	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	17.1	-168.5	34.4	-30.6	0	0	0	115.3	L2233 D2258	L2233-P2256 HydrophobicContact CD1-CB 3.87Å; L2233-P2256 HydrophobicContact CD1-CG 3.69Å; L2233-P2256 HydrophobicContact CD2-CB 3.85Å; P2256-D2258 VanDerWaalsContact C-N 3.33Å
2257	S	41.4	Very low	45.7	Very low	84 Å²	84	94.8 Å²	94.8	59%	0.587	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-3.5	-178.2	39.2	0	0	0	0	114.3	K2255	K2255-S2257 PolarHBondContact O-N 3.38Å
2258	D	47.9	Very low	44.5	Very low	107 Å²	107	100.1 Å²	100.1	57%	0.572	56%	0.561	S	S	*	*			trans	-123.9	44.4	-150.4	-49.2	-18.5	0	0	0	112.4	P2256	P2256-D2258 VanDerWaalsContact C-N 3.33Å
2259	T	46.6	Very low	43.5	Very low	122 Å²	122	103.6 Å²	103.6	75%	0.748	59%	0.587	S	S	*	*			trans	-152.8	137.2	-176.3	-32.3	0	0	0	0	115.2
2260	D	35.8	Very low	42.5	Very low	120 Å²	120	105.6 Å²	105.6	64%	0.642	60%	0.597	S	S	*	*			trans	-96.6	160.3	180	-174.1	0.5	0	0	0	112.2	C2262	D2260-C2262 PolarHBondContact OD1-N 3.19Å; D2260-C2262 VanDerWaalsContact OD1-N 3.08Å
2261	R	32.8	Very low	41.8	Very low	172 Å²	172	103 Å²	103	65%	0.649	59%	0.589	S	S	*	*			trans	-123	-18.5	-176.8	-68.5	-178.3	173.2	-179.2	-2.1	115.4	A2263 L2264	R2261-A2263 VanDerWaalsContact C-N 3.27Å; R2261-A2263 PolarHBondContact O-N 3.2Å; R2261-L2264 WeakPolarHBondContact O-CB 3.28Å; R2261-L2264 PolarHBondContact O-N 3Å; R2261-L2264 VanDerWaalsContact O-N 3.12Å
2262	C	35.9	Very low	40.6	Very low	114 Å²	114	105.6 Å²	105.6	77%	0.77	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-68.8	-27.2	-172.6	-163.9	0	0	0	0	113	D2260 L2264	D2260-C2262 PolarHBondContact OD1-N 3.19Å; D2260-C2262 VanDerWaalsContact OD1-N 3.08Å; C2262-L2264 PolarHBondContact O-N 3.09Å
2263	A	35.1	Very low	39.7	Very low	96 Å²	96	104.2 Å²	104.2	79%	0.793	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-68.7	-10.8	174.9	0	0	0	0	0	114.3	R2261	R2261-A2263 VanDerWaalsContact C-N 3.27Å; R2261-A2263 PolarHBondContact O-N 3.2Å
2264	L	38.3	Very low	38.9	Very low	119 Å²	119	108.6 Å²	108.6	62%	0.623	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-95.6	8.4	-171.2	-59.8	175.7	0	0	0	114.5	R2261 C2262 L2266	R2261-L2264 WeakPolarHBondContact O-CB 3.28Å; R2261-L2264 PolarHBondContact O-N 3Å; R2261-L2264 VanDerWaalsContact O-N 3.12Å; C2262-L2264 PolarHBondContact O-N 3.09Å; L2264-L2266 VanDerWaalsContact C-N 3.28Å; L2264-L2266 PolarHBondContact O-N 3.48Å
2265	G	33.3	Very low	38.2	Very low	63 Å²	63	109.8 Å²	109.8	65%	0.649	64%	0.643	S	S	*	*			trans	65.2	13.4	159.3	0	0	0	0	0	118.1	H2267	G2265-H2267 PolarHBondContact O-N 3.03Å
2266	L	36.7	Very low	38	Very low	147 Å²	147	110.6 Å²	110.6	77%	0.77	65%	0.652	S	S	*	*			trans	-74.5	19.3	-173.3	-73.6	165.8	0	0	0	115.6	L2264	L2264-L2266 VanDerWaalsContact C-N 3.28Å; L2264-L2266 PolarHBondContact O-N 3.48Å
2267	H	29.2	Very low	37.5	Very low	142 Å²	142	109.8 Å²	109.8	66%	0.657	66%	0.656	S	S	*	*	S	Bend	trans	-128	132	171.1	-72.9	-20.5	0	0	0	110.2	G2265	G2265-H2267 PolarHBondContact O-N 3.03Å
2268	N	25.3	Very low	37.3	Very low	175 Å²	175	109 Å²	109	94%	0.936	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-89.3	122.9	-163.1	-145.3	5.1	0	0	0	111.7
2269	C	31.4	Very low	36.6	Very low	119 Å²	119	114.8 Å²	114.8	80%	0.804	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-93.9	153.8	-172.6	-69.5	0	0	0	0	113.7
2270	L	31.1	Very low	36.6	Very low	124 Å²	124	112.6 Å²	112.6	65%	0.649	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-80.3	147.2	-178.7	-74.7	159.9	0	0	0	113.1	L2298	L2270-L2298 HydrophobicContact CB-CD2 4.23Å; L2270-L2298 HydrophobicContact CD1-CD2 4.28Å
2271	P	35.3	Very low	36.5	Very low	103 Å²	103	115.5 Å²	115.5	67%	0.669	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-83.3	158.8	-177.7	33.5	-36	0	0	0	114.4
2272	P	32.5	Very low	36.6	Very low	109 Å²	109	111.9 Å²	111.9	71%	0.708	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-101.5	172.3	-171.7	6.7	16.7	0	0	0	114.6
2273	A	42.8	Very low	36.7	Very low	28 Å²	28	109.9 Å²	109.9	23%	0.231	69%	0.685	C	S	.	*	P	Polyproline II helix	trans	-71.3	160	170.8	0	0	0	0	0	112.6
2274	V	46.8	Very low	37.3	Very low	104 Å²	104	111.3 Å²	111.3	63%	0.63	68%	0.675	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.9	128.1	-178.8	-178.3	0	0	0	0	110.3	R2286	V2274-R2286 PolarHBondContact N-O 2.81Å; V2274-R2286 PolarHBondContact O-N 3.47Å
2275	C	44.5	Very low	37.7	Very low	63 Å²	63	106 Å²	106	43%	0.426	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.8	142.6	-179.1	-43.6	0	0	0	0	111.1	C2285	C2275-C2285 HydrophobicContact CB-CB 3.93Å; C2275-C2285 WeakPolarHBondContact CB-SG 3.3Å; C2275-C2285 WeakPolarHBondContact SG-CB 3.03Å; C2275-C2285 CovalentContact SG-SG 2.04Å; C2275-C2285 PolarHBondContact SG-SG 3.18Å
2276	I	47.5	Very low	38.4	Very low	143 Å²	143	109.8 Å²	109.8	73%	0.733	64%	0.643	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-131.1	117.4	178	-54.8	-180	0	0	0	109.3	Q2284	I2276-Q2284 PolarHBondContact N-O 3.22Å; I2276-Q2284 VanDerWaalsContact N-O 3.12Å
2277	G	37.8	Very low	39	Very low	51 Å²	51	103.3 Å²	103.3	53%	0.526	61%	0.61	S	S	.	*			trans	-172.5	145.5	172.6	0	0	0	0	0	111.3
2278	G	36.1	Very low	39.9	Very low	68 Å²	68	103.1 Å²	103.1	70%	0.701	62%	0.621	S	S	*	*			trans	-89	172.6	179.7	0	0	0	0	0	113.2	G2280	G2278-G2280 PolarHBondContact O-N 2.97Å; G2278-G2280 VanDerWaalsContact O-N 3.14Å
2279	K	34.2	Very low	40.7	Very low	229 Å²	229	100.7 Å²	100.7	100%	0.996	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	113	178.2	-66	-178.9	178.4	-178.8	0	111.7
2280	G	46.2	Very low	41.3	Very low	76 Å²	76	96.3 Å²	96.3	78%	0.784	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	158.1	-50.4	165	0	0	0	0	0	113.7	G2278	G2278-G2280 PolarHBondContact O-N 2.97Å; G2278-G2280 VanDerWaalsContact O-N 3.14Å
2281	E	33.8	Very low	42.1	Very low	181 Å²	181	92.6 Å²	92.6	85%	0.846	57%	0.567	S	S	*	*	S	Bend	trans	-135.7	167.6	-174	-63.2	-177.5	150.2	0	0	110.4
2282	A	33.9	Very low	42.2	Very low	95 Å²	95	93 Å²	93	79%	0.785	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-63.2	127.1	-164.9	0	0	0	0	0	113.6
2283	P	39.2	Very low	42.9	Very low	72 Å²	72	89.4 Å²	89.4	47%	0.468	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-71.7	143	178.2	30.4	-35.3	0	0	0	111.4
2284	Q	46.8	Very low	42.7	Very low	126 Å²	126	96.8 Å²	96.8	59%	0.589	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.5	119.9	171.1	-69.2	-176.1	-4.6	0	0	109.6	I2276 L2292	I2276-Q2284 PolarHBondContact N-O 3.22Å; I2276-Q2284 VanDerWaalsContact N-O 3.12Å; Q2284-L2292 HydrophobicContact CB-CD2 3.91Å; Q2284-L2292 HydrophobicContact CG-CD2 3.96Å
2285	C	47.2	Very low	42	Very low	9 Å²	9	100.3 Å²	100.3	6%	0.061	58%	0.576	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.8	137.9	170.1	-65.8	0	0	0	0	110.6	C2275 T2293	C2275-C2285 HydrophobicContact CB-CB 3.93Å; C2275-C2285 WeakPolarHBondContact CB-SG 3.3Å; C2275-C2285 WeakPolarHBondContact SG-CB 3.03Å; C2275-C2285 CovalentContact SG-SG 2.04Å; C2275-C2285 PolarHBondContact SG-SG 3.18Å; C2285-T2293 WeakPolarHBondContact CB-O 3.34Å; C2285-T2293 PolarHBondContact O-N 3.37Å; C2285-T2293 VanDerWaalsContact O-N 3.11Å
2286	R	49	Very low	41.8	Very low	141 Å²	141	101.6 Å²	101.6	53%	0.532	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.3	132.3	178.8	-98.4	178.9	159.7	170.1	-5.5	111.8	V2274 G2290 S2291	V2274-R2286 PolarHBondContact N-O 2.81Å; V2274-R2286 PolarHBondContact O-N 3.47Å; R2286-G2290 PolarHBondContact NE-O 2.04Å; R2286-G2290 PolarHBondContact NH2-O 2.86Å; R2286-S2291 WeakPolarHBondContact CA-O 3.33Å; R2286-S2291 WeakPolarHBondContact CG-O 3.08Å
2287	C	47.5	Very low	41.2	Very low	11 Å²	11	99.4 Å²	99.4	7%	0.074	59%	0.594	C	S	.	*			trans	-71.2	159.2	153.6	-63.2	0	0	0	0	109	D2289 G2290 S2291 C2299	C2287-D2289 WeakPolarHBondContact CB-OD1 3.44Å; C2287-D2289 PolarHBondContact O-N 3.28Å; C2287-G2290 PolarHBondContact O-N 3.44Å; C2287-S2291 PolarHBondContact N-O 2.79Å; C2287-C2299 HydrophobicContact CB-CB 4.06Å; C2287-C2299 WeakPolarHBondContact CB-SG 3.49Å; C2287-C2299 WeakPolarHBondContact SG-CB 3.05Å; C2287-C2299 CovalentContact SG-SG 2.04Å; C2287-C2299 PolarHBondContact SG-SG 3.14Å
2288	P	48.2	Very low	41.2	Very low	138 Å²	138	100.5 Å²	100.5	90%	0.896	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-12.9	-175.6	-26.7	36.5	0	0	0	116	G2290	P2288-G2290 VanDerWaalsContact C-N 3.29Å
2289	D	42.4	Very low	41.5	Very low	125 Å²	125	100.2 Å²	100.2	67%	0.668	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-3.8	173.5	68.9	-12.9	0	0	0	113.7	C2287 S2291	C2287-D2289 WeakPolarHBondContact CB-OD1 3.44Å; C2287-D2289 PolarHBondContact O-N 3.28Å; D2289-S2291 VanDerWaalsContact OD1-CB 3.31Å; D2289-S2291 WeakPolarHBondContact OD1-CB 3.3Å; D2289-S2291 PolarHBondContact OD1-N 2.93Å; D2289-S2291 PolarHBondContact OD1-OG 2.9Å; D2289-S2291 PolarHBondContact OD2-OG 3.28Å
2290	G	44.3	Very low	41.9	Very low	27 Å²	27	98.8 Å²	98.8	28%	0.278	56%	0.562	S	S	.	*			trans	86.1	2.9	179.5	0	0	0	0	0	115.1	R2286 C2287 P2288	R2286-G2290 PolarHBondContact NE-O 2.04Å; R2286-G2290 PolarHBondContact NH2-O 2.86Å; C2287-G2290 PolarHBondContact O-N 3.44Å; P2288-G2290 VanDerWaalsContact C-N 3.29Å
2291	S	49.1	Very low	41.1	Very low	45 Å²	45	104.4 Å²	104.4	32%	0.315	57%	0.567	S	S	.	*			trans	-64.6	143.5	173.3	60.9	0	0	0	0	112	R2286 C2287 D2289	R2286-S2291 WeakPolarHBondContact CA-O 3.33Å; R2286-S2291 WeakPolarHBondContact CG-O 3.08Å; C2287-S2291 PolarHBondContact N-O 2.79Å; D2289-S2291 VanDerWaalsContact OD1-CB 3.31Å; D2289-S2291 WeakPolarHBondContact OD1-CB 3.3Å; D2289-S2291 PolarHBondContact OD1-N 2.93Å; D2289-S2291 PolarHBondContact OD1-OG 2.9Å; D2289-S2291 PolarHBondContact OD2-OG 3.28Å
2292	L	36.5	Very low	41.1	Very low	113 Å²	113	101 Å²	101	59%	0.592	55%	0.55	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.2	123.9	174.9	-77.9	165.6	0	0	0	109.7	Q2284	Q2284-L2292 HydrophobicContact CB-CD2 3.91Å; Q2284-L2292 HydrophobicContact CG-CD2 3.96Å
2293	T	46.8	Very low	41.3	Very low	33 Å²	33	102.8 Å²	102.8	20%	0.202	55%	0.546	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	164.3	171.5	47.8	0	0	0	0	111	C2285	C2285-T2293 WeakPolarHBondContact CB-O 3.34Å; C2285-T2293 PolarHBondContact O-N 3.37Å; C2285-T2293 VanDerWaalsContact O-N 3.11Å
2294	F	39.9	Very low	41.2	Very low	182 Å²	182	106.4 Å²	106.4	80%	0.798	56%	0.561	S	S	*	*			trans	-106.6	168.4	173.9	-68.3	-85.5	0	0	0	110.4
2295	E	31.3	Very low	41	Very low	178 Å²	178	104 Å²	104	83%	0.832	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	143.3	-177.3	-70.7	-174.4	110.9	0	0	113.5	V2297	E2295-V2297 VanDerWaalsContact C-N 3.32Å; E2295-V2297 PolarHBondContact O-N 3.01Å
2296	G	39.7	Very low	40.6	Very low	90 Å²	90	104.6 Å²	104.6	93%	0.928	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.3	-4.5	168.3	0	0	0	0	0	117
2297	V	34.8	Very low	40.5	Very low	98 Å²	98	101 Å²	101	59%	0.594	56%	0.56	S	S	*	*			trans	-96.8	124	179.9	-174.5	0	0	0	0	111.8	E2295	E2295-V2297 VanDerWaalsContact C-N 3.32Å; E2295-V2297 PolarHBondContact O-N 3.01Å
2298	L	39.1	Very low	40.3	Very low	73 Å²	73	109.6 Å²	109.6	38%	0.382	60%	0.599	S	S	.	*			trans	-76.6	133.8	174.5	-157.7	77.9	0	0	0	110.4	L2270 R2300	L2270-L2298 HydrophobicContact CB-CD2 4.23Å; L2270-L2298 HydrophobicContact CD1-CD2 4.28Å; L2298-R2300 PolarHBondContact O-N 3.04Å
2299	C	41.4	Very low	40.1	Very low	62 Å²	62	103.5 Å²	103.5	42%	0.419	56%	0.559	S	S	.	*	S	Bend	trans	-64.3	96	178.9	-51.8	0	0	0	0	110.9	C2287	C2287-C2299 HydrophobicContact CB-CB 4.06Å; C2287-C2299 WeakPolarHBondContact CB-SG 3.49Å; C2287-C2299 WeakPolarHBondContact SG-CB 3.05Å; C2287-C2299 CovalentContact SG-SG 2.04Å; C2287-C2299 PolarHBondContact SG-SG 3.14Å
2300	R	43.1	Very low	40	Very low	200 Å²	200	103.5 Å²	103.5	76%	0.755	56%	0.559	S	S	*	*			trans	-127.2	-9.9	-166.5	-169.8	164.4	175.4	118.2	6	116.9	L2298 K2302	L2298-R2300 PolarHBondContact O-N 3.04Å; R2300-K2302 PolarHBondContact O-N 3.22Å
2301	E	30.3	Very low	40	Very low	193 Å²	193	112.6 Å²	112.6	90%	0.902	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	58	-162.6	-159.4	168.1	-119	0	0	115
2302	K	33	Very low	39.2	Very low	111 Å²	111	117.9 Å²	117.9	48%	0.483	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-160.3	13.3	167.1	-125.1	171.4	-172.9	173.8	0	118.2	R2300 F2317 N2320	R2300-K2302 PolarHBondContact O-N 3.22Å; K2302-F2317 HydrophobicContact CB-CE2 4.47Å; K2302-F2317 HydrophobicContact CD-CE1 4Å; K2302-F2317 HydrophobicContact CD-CE2 4.19Å; K2302-F2317 HydrophobicContact CD-CZ 3.64Å; K2302-F2317 HydrophobicContact CG-CE2 4.1Å; K2302-F2317 HydrophobicContact CG-CZ 3.74Å; K2302-N2320 PolarHBondContact NZ-OD1 2.04Å
2303	L	38.4	Very low	39.1	Very low	132 Å²	132	114 Å²	114	69%	0.691	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-75.5	-23.4	-174.9	-121.2	164.3	0	0	0	113.8	T2305 C2306	L2303-T2305 PolarHBondContact O-N 2.85Å; L2303-T2305 VanDerWaalsContact O-N 3.09Å; L2303-C2306 HydrophobicContact CD2-CB 4.45Å; L2303-C2306 PolarHBondContact O-N 3.3Å
2304	D	36.7	Very low	38.4	Very low	148 Å²	148	118.4 Å²	118.4	79%	0.791	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-68.8	-12.1	-171.1	-53.7	-45.9	0	0	0	114.9
2305	T	43.4	Very low	38.4	Very low	75 Å²	75	110.8 Å²	110.8	46%	0.46	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-96.6	0.8	172.6	56.9	0	0	0	0	113.8	L2303 F2317 T2322	L2303-T2305 PolarHBondContact O-N 2.85Å; L2303-T2305 VanDerWaalsContact O-N 3.09Å; T2305-F2317 VanDerWaalsContact OG1-CE2 3.27Å; T2305-F2317 WeakPolarHBondContact OG1-CE2 3.44Å; T2305-F2317 WeakPolarHBondContact OG1-CZ 3.43Å; T2305-T2322 WeakPolarHBondContact CB-OG1 3.32Å; T2305-T2322 VanDerWaalsContact O-CG2 3.29Å; T2305-T2322 WeakPolarHBondContact O-CG2 3.25Å; T2305-T2322 PolarHBondContact OG1-OG1 3.38Å
2306	C	37.4	Very low	38.9	Very low	22 Å²	22	106.4 Å²	106.4	15%	0.149	57%	0.566	C	S	.	*	S	Bend	trans	-105.4	-4.5	173.4	-72.7	0	0	0	0	113.9	L2303 E2308 C2309 C2315	L2303-C2306 HydrophobicContact CD2-CB 4.45Å; L2303-C2306 PolarHBondContact O-N 3.3Å; C2306-E2308 VanDerWaalsContact C-N 3.34Å; C2306-E2308 PolarHBondContact O-N 3.39Å; C2306-C2309 WeakPolarHBondContact O-CB 3.07Å; C2306-C2309 PolarHBondContact O-N 2.79Å; C2306-C2315 WeakPolarHBondContact CA-SG 3.42Å; C2306-C2315 HydrophobicContact CB-CB 3.33Å; C2306-C2315 WeakPolarHBondContact CB-SG 3.2Å; C2306-C2315 WeakPolarHBondContact SG-CB 3.25Å; C2306-C2315 CovalentContact SG-SG 2.03Å; C2306-C2315 PolarHBondContact SG-SG 2.69Å
2307	A	47.7	Very low	39.2	Very low	66 Å²	66	105.2 Å²	105.2	55%	0.545	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-63.9	-35.6	-177.9	0	0	0	0	0	113.3	C2309	A2307-C2309 PolarHBondContact O-N 3.15Å; A2307-C2309 VanDerWaalsContact O-N 3.15Å
2308	E	44	Very low	39.2	Very low	191 Å²	191	106.8 Å²	106.8	89%	0.893	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-71.8	-3.3	-178.7	-61	-169.3	139.4	0	0	114.4	C2306	C2306-E2308 VanDerWaalsContact C-N 3.34Å; C2306-E2308 PolarHBondContact O-N 3.39Å
2309	C	42.3	Very low	39.4	Very low	9 Å²	9	109.9 Å²	109.9	6%	0.061	55%	0.551	C	S	.	*	G	3₁₀ helix	trans	-87.8	-25.9	-178.3	-115.5	0	0	0	0	114.6	C2306 A2307 Y2311 H2312 G2313 C2315 C2324	C2306-C2309 WeakPolarHBondContact O-CB 3.07Å; C2306-C2309 PolarHBondContact O-N 2.79Å; A2307-C2309 PolarHBondContact O-N 3.15Å; A2307-C2309 VanDerWaalsContact O-N 3.15Å; C2309-Y2311 PolarHBondContact O-N 3.12Å; C2309-H2312 PolarHBondContact O-N 2.68Å; C2309-H2312 VanDerWaalsContact O-N 3.16Å; C2309-G2313 VanDerWaalsContact CB-O 3.26Å; C2309-G2313 WeakPolarHBondContact CB-O 3.2Å; C2309-G2313 PolarHBondContact O-N 2.88Å; C2309-G2313 VanDerWaalsContact O-O 3.11Å; C2309-G2313 PolarHBondContact SG-O 2.79Å; C2309-C2315 HydrophobicContact CB-CB 3.86Å; C2309-C2315 WeakPolarHBondContact SG-CA 3.46Å; C2309-C2315 PolarHBondContact SG-N 2.62Å; C2309-C2315 VanDerWaalsContact SG-N 3.4Å; C2309-C2324 WeakPolarHBondContact CA-SG 3.38Å; C2309-C2324 HydrophobicContact CB-CB 4.44Å; C2309-C2324 WeakPolarHBondContact CB-SG 3.04Å; C2309-C2324 WeakPolarHBondContact SG-CA 3.44Å; C2309-C2324 WeakPolarHBondContact SG-CB 3.45Å; C2309-C2324 CovalentContact SG-SG 2.03Å; C2309-C2324 PolarHBondContact SG-SG 2.53Å
2310	N	41.9	Very low	39.4	Very low	125 Å²	125	113.5 Å²	113.5	67%	0.668	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	31.2	-159.6	-86.6	-27.6	0	0	0	116.1
2311	Y	44.1	Very low	39	Very low	218 Å²	218	111.7 Å²	111.7	86%	0.855	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.1	-11.4	163.2	-100.8	-84.5	0	0	0	115.4	C2309	C2309-Y2311 PolarHBondContact O-N 3.12Å
2312	H	31.1	Very low	39.4	Very low	156 Å²	156	104.6 Å²	104.6	72%	0.722	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.2	-0.1	177.3	-82.1	-59.8	0	0	0	117.4	C2309	C2309-H2312 PolarHBondContact O-N 2.68Å; C2309-H2312 VanDerWaalsContact O-N 3.16Å
2313	G	34.6	Very low	39.8	Very low	31 Å²	31	102.5 Å²	102.5	32%	0.32	53%	0.531	S	S	.	.	S	Bend	trans	172.2	166.6	169.4	0	0	0	0	0	115.1	C2309	C2309-G2313 VanDerWaalsContact CB-O 3.26Å; C2309-G2313 WeakPolarHBondContact CB-O 3.2Å; C2309-G2313 PolarHBondContact O-N 2.88Å; C2309-G2313 VanDerWaalsContact O-O 3.11Å; C2309-G2313 PolarHBondContact SG-O 2.79Å
2314	D	33.4	Very low	39.6	Very low	126 Å²	126	99.7 Å²	99.7	67%	0.674	52%	0.521	S	S	*	.			trans	-67.3	136.6	179.3	-102.2	-35	0	0	0	112.7	I2316	D2314-I2316 PolarHBondContact O-N 3.12Å
2315	C	38.2	Very low	39.5	Very low	23 Å²	23	98 Å²	98	16%	0.155	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	117.1	169	175.5	0	0	0	0	109.9	C2306 C2309 T2322	C2306-C2315 WeakPolarHBondContact CA-SG 3.42Å; C2306-C2315 HydrophobicContact CB-CB 3.33Å; C2306-C2315 WeakPolarHBondContact CB-SG 3.2Å; C2306-C2315 WeakPolarHBondContact SG-CB 3.25Å; C2306-C2315 CovalentContact SG-SG 2.03Å; C2306-C2315 PolarHBondContact SG-SG 2.69Å; C2309-C2315 HydrophobicContact CB-CB 3.86Å; C2309-C2315 WeakPolarHBondContact SG-CA 3.46Å; C2309-C2315 PolarHBondContact SG-N 2.62Å; C2309-C2315 VanDerWaalsContact SG-N 3.4Å; C2315-T2322 WeakPolarHBondContact SG-CG2 3.45Å
2316	I	43.3	Very low	38.8	Very low	85 Å²	85	100.9 Å²	100.9	44%	0.436	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	108.9	174.7	-59.7	-176.3	0	0	0	109.5	D2314 T2323	D2314-I2316 PolarHBondContact O-N 3.12Å; I2316-T2323 PolarHBondContact N-O 2.98Å; I2316-T2323 PolarHBondContact O-N 3.41Å; I2316-T2323 VanDerWaalsContact O-O 3.13Å; I2316-T2323 PolarHBondContact O-OG1 2.75Å
2317	F	44.9	Very low	38.2	Very low	65 Å²	65	105.4 Å²	105.4	29%	0.285	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	134.6	161.4	-98.2	-82.2	0	0	0	110.4	K2302 T2305 K2321 T2322	K2302-F2317 HydrophobicContact CB-CE2 4.47Å; K2302-F2317 HydrophobicContact CD-CE1 4Å; K2302-F2317 HydrophobicContact CD-CE2 4.19Å; K2302-F2317 HydrophobicContact CD-CZ 3.64Å; K2302-F2317 HydrophobicContact CG-CE2 4.1Å; K2302-F2317 HydrophobicContact CG-CZ 3.74Å; T2305-F2317 VanDerWaalsContact OG1-CE2 3.27Å; T2305-F2317 WeakPolarHBondContact OG1-CE2 3.44Å; T2305-F2317 WeakPolarHBondContact OG1-CZ 3.43Å; F2317-K2321 WeakPolarHBondContact CA-O 3.25Å; F2317-K2321 VanDerWaalsContact CD1-C 3.5Å; F2317-K2321 WeakPolarHBondContact CD1-O 3.14Å; F2317-T2322 HydrophobicContact CD2-CG2 3.76Å; F2317-T2322 HydrophobicContact CE1-CG2 4.39Å; F2317-T2322 WeakPolarHBondContact CE1-OG1 3.14Å; F2317-T2322 HydrophobicContact CE2-CG2 3.63Å; F2317-T2322 HydrophobicContact CG-CG2 4.21Å; F2317-T2322 HydrophobicContact CZ-CG2 3.98Å; F2317-T2322 WeakPolarHBondContact CZ-OG1 3.17Å
2318	K	36	Very low	37	Very low	132 Å²	132	108.2 Å²	108.2	57%	0.574	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-145.6	143.9	160.9	-148.9	-169.2	172.1	-66.9	0	110.6	N2320 K2321	K2318-N2320 VanDerWaalsContact C-N 3.27Å; K2318-N2320 PolarHBondContact O-N 3.04Å; K2318-N2320 VanDerWaalsContact O-N 3.13Å; K2318-K2321 PolarHBondContact N-O 3.45Å; K2318-K2321 PolarHBondContact O-N 2.73Å
2319	D	41.8	Very low	36.1	Very low	137 Å²	137	108.7 Å²	108.7	73%	0.733	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	45	170.3	-47.1	-28.5	0	0	0	113.7	K2321	D2319-K2321 VanDerWaalsContact C-N 3.34Å; D2319-K2321 PolarHBondContact O-N 2.94Å
2320	N	41.7	Very low	35.2	Very low	139 Å²	139	113.2 Å²	113.2	74%	0.743	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.7	16.1	-178.9	-99.4	-25.5	0	0	0	117.7	K2302 K2318	K2302-N2320 PolarHBondContact NZ-OD1 2.04Å; K2318-N2320 VanDerWaalsContact C-N 3.27Å; K2318-N2320 PolarHBondContact O-N 3.04Å; K2318-N2320 VanDerWaalsContact O-N 3.13Å
2321	K	34.4	Very low	34.2	Very low	162 Å²	162	117.6 Å²	117.6	70%	0.704	58%	0.575	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.8	148.2	158.9	-81.5	-169.7	175.7	-175.9	0	112.5	F2317 K2318 D2319	F2317-K2321 WeakPolarHBondContact CA-O 3.25Å; F2317-K2321 VanDerWaalsContact CD1-C 3.5Å; F2317-K2321 WeakPolarHBondContact CD1-O 3.14Å; K2318-K2321 PolarHBondContact N-O 3.45Å; K2318-K2321 PolarHBondContact O-N 2.73Å; D2319-K2321 VanDerWaalsContact C-N 3.34Å; D2319-K2321 PolarHBondContact O-N 2.94Å
2322	T	39.4	Very low	33.1	Very low	43 Å²	43	110.9 Å²	110.9	26%	0.264	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.5	136.5	167.2	-29.5	0	0	0	0	109.4	T2305 C2315 F2317	T2305-T2322 WeakPolarHBondContact CB-OG1 3.32Å; T2305-T2322 VanDerWaalsContact O-CG2 3.29Å; T2305-T2322 WeakPolarHBondContact O-CG2 3.25Å; T2305-T2322 PolarHBondContact OG1-OG1 3.38Å; C2315-T2322 WeakPolarHBondContact SG-CG2 3.45Å; F2317-T2322 HydrophobicContact CD2-CG2 3.76Å; F2317-T2322 HydrophobicContact CE1-CG2 4.39Å; F2317-T2322 WeakPolarHBondContact CE1-OG1 3.14Å; F2317-T2322 HydrophobicContact CE2-CG2 3.63Å; F2317-T2322 HydrophobicContact CG-CG2 4.21Å; F2317-T2322 HydrophobicContact CZ-CG2 3.98Å; F2317-T2322 WeakPolarHBondContact CZ-OG1 3.17Å
2323	T	41.2	Very low	32.5	Very low	68 Å²	68	109.5 Å²	109.5	42%	0.417	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-140.5	118.7	171.5	28.3	0	0	0	0	111.3	I2316 H2325	I2316-T2323 PolarHBondContact N-O 2.98Å; I2316-T2323 PolarHBondContact O-N 3.41Å; I2316-T2323 VanDerWaalsContact O-O 3.13Å; I2316-T2323 PolarHBondContact O-OG1 2.75Å; T2323-H2325 PolarHBondContact O-N 2.96Å
2324	C	34	Very low	31.8	Very low	73 Å²	73	113.7 Å²	113.7	49%	0.493	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.9	108.1	161.6	-79.5	0	0	0	0	108.7	C2309	C2309-C2324 WeakPolarHBondContact CA-SG 3.38Å; C2309-C2324 HydrophobicContact CB-CB 4.44Å; C2309-C2324 WeakPolarHBondContact CB-SG 3.04Å; C2309-C2324 WeakPolarHBondContact SG-CA 3.44Å; C2309-C2324 WeakPolarHBondContact SG-CB 3.45Å; C2309-C2324 CovalentContact SG-SG 2.03Å; C2309-C2324 PolarHBondContact SG-SG 2.53Å
2325	H	35.1	Very low	31.3	Very low	112 Å²	112	115.6 Å²	115.6	52%	0.519	58%	0.583	S	S	.	*			trans	-116.6	99.9	-172.3	-154.7	-48.3	0	0	0	110.3	T2323 C2327	T2323-H2325 PolarHBondContact O-N 2.96Å; H2325-C2327 PolarHBondContact O-N 3.43Å
2326	H	29.5	Very low	30.5	Very low	135 Å²	135	121.7 Å²	121.7	63%	0.625	60%	0.602	S	S	*	*			trans	-45.9	141.9	164.6	-92.1	-81.8	0	0	0	110.5	I2328	H2326-I2328 VanDerWaalsContact C-N 3.29Å; H2326-I2328 PolarHBondContact O-N 3.1Å
2327	C	24.4	Very low	29.4	Very low	117 Å²	117	123 Å²	123	79%	0.791	61%	0.607	S	S	*	*	S	Bend	trans	-74.6	79.4	-174.4	-161.9	0	0	0	0	112.6	H2325	H2325-C2327 PolarHBondContact O-N 3.43Å
2328	I	22.7	Very low	28.4	Very low	125 Å²	125	128 Å²	128	64%	0.641	63%	0.633	S	S	*	*			trans	-123.3	73.6	146.9	-51.5	-175.9	0	0	0	107.7	H2326 N2330	H2326-I2328 VanDerWaalsContact C-N 3.29Å; H2326-I2328 PolarHBondContact O-N 3.1Å; I2328-N2330 PolarHBondContact O-N 2.92Å
2329	R	24.1	Very low	27.7	Very low	201 Å²	201	125.4 Å²	125.4	76%	0.758	64%	0.644	S	S	*	*			trans	-69.5	111.9	142	-85.5	-170.5	173.4	179.8	1.3	105.8
2330	N	23.4	Very low	26.9	Very low	104 Å²	104	123.1 Å²	123.1	56%	0.556	64%	0.644	S	S	*	*				57	117.9	89.2	-93.3	-79.2	0	0	0	112.5	I2328 G2332	I2328-N2330 PolarHBondContact O-N 2.92Å; N2330-G2332 PolarHBondContact O-N 2.8Å; N2330-G2332 VanDerWaalsContact O-N 3.14Å
2331	R	21.4	Very low	26	Very low	217 Å²	217	121.6 Å²	121.6	82%	0.819	64%	0.644	S	S	*	*			trans	42.4	66.2	133.5	-65.1	173.6	164.4	141.9	-7.9	113.2	L2333	R2331-L2333 HydrophobicContact CB-CD2 4.11Å; R2331-L2333 VanDerWaalsContact O-CD2 3.26Å; R2331-L2333 WeakPolarHBondContact O-CD2 3.41Å; R2331-L2333 VanDerWaalsContact O-CG 3.25Å; R2331-L2333 WeakPolarHBondContact O-CG 3.33Å; R2331-L2333 PolarHBondContact O-N 3.36Å
2332	G	20	Very low	25.4	Very low	77 Å²	77	119.4 Å²	119.4	79%	0.794	65%	0.65	S	S	*	*			trans	-68.9	-11.1	174	0	0	0	0	0	114.5	N2330	N2330-G2332 PolarHBondContact O-N 2.8Å; N2330-G2332 VanDerWaalsContact O-N 3.14Å
2333	L	19.5	Very low	24.7	Very low	127 Å²	127	120.6 Å²	120.6	67%	0.665	67%	0.67	S	S	*	*			trans	74.9	152	171.5	-41.7	178.8	0	0	0	113.4	R2331	R2331-L2333 HydrophobicContact CB-CD2 4.11Å; R2331-L2333 VanDerWaalsContact O-CD2 3.26Å; R2331-L2333 WeakPolarHBondContact O-CD2 3.41Å; R2331-L2333 VanDerWaalsContact O-CG 3.25Å; R2331-L2333 WeakPolarHBondContact O-CG 3.33Å; R2331-L2333 PolarHBondContact O-N 3.36Å
2334	I	20.7	Very low	23.8	Very low	119 Å²	119	122.7 Å²	122.7	61%	0.61	69%	0.687	S	S	*	*				50.6	104.5	101.6	-57.7	177.8	0	0	0	109.3
2335	Y	20.9	Very low	23.1	Very low	167 Å²	167	128.5 Å²	128.5	66%	0.655	71%	0.707	S	S	*	*			cis	-175.9	171.9	40.1	-109.1	-15.7	0	0	0	107.8
2336	R	21.3	Very low	22.3	Very low	151 Å²	151	126.1 Å²	126.1	57%	0.57	71%	0.713	S	S	*	*			cis	-152.1	154.6	-6.5	-145.9	162.7	167.7	123.2	26.4	109.9
2337	E	21.8	Very low	21.9	Very low	113 Å²	113	127 Å²	127	53%	0.528	72%	0.722	S	S	.	*			trans	12.9	130.8	144.6	-63.1	151.5	-155.5	0	0	120.1
2338	M	22.5	Very low	21.7	Very low	168 Å²	168	127.3 Å²	127.3	83%	0.828	73%	0.725	S	S	*	*			trans	66	61	130.7	-56.8	164	-169.9	0	0	117.3	A2340	M2338-A2340 VanDerWaalsContact C-N 3.25Å; M2338-A2340 PolarHBondContact O-N 3.47Å
2339	G	22	Very low	21.6	Very low	78 Å²	78	124.5 Å²	124.5	80%	0.804	72%	0.72	S	S	*	*			trans	-63.7	-19.8	174.2	0	0	0	0	0	116.4
2340	A	24.2	Very low	21.4	Very low	90 Å²	90	118.7 Å²	118.7	74%	0.744	72%	0.724	S	S	*	*			trans	59	-178.2	176.5	0	0	0	0	0	116.2	M2338	M2338-A2340 VanDerWaalsContact C-N 3.25Å; M2338-A2340 PolarHBondContact O-N 3.47Å
2341	S	22.7	Very low	21.6	Very low	106 Å²	106	120.7 Å²	120.7	74%	0.741	72%	0.724	S	S	*	*			trans	54.9	110.9	178	40.5	0	0	0	0	116.9
2342	S	23.4	Very low	21.7	Very low	117 Å²	117	112.7 Å²	112.7	82%	0.818	71%	0.709	S	S	*	*			cis	75.5	127.3	34.7	92.2	0	0	0	0	116
2343	G	24.9	Very low	22.1	Very low	67 Å²	67	114.7 Å²	114.7	69%	0.691	69%	0.693	S	S	*	*			trans	83.7	165.7	163.3	0	0	0	0	0	115.5
2344	S	21.4	Very low	22.4	Very low	112 Å²	112	114.3 Å²	114.3	78%	0.783	69%	0.692	S	S	*	*			trans	58	112.2	-171.8	31.7	0	0	0	0	113.4
2345	E	18.6	Very low	22.6	Very low	195 Å²	195	112.8 Å²	112.8	91%	0.911	69%	0.691	S	S	*	*			cis	53.7	105.3	24.9	-51.1	-172.9	120.1	0	0	113.6
2346	G	19.8	Very low	22.8	Very low	63 Å²	63	111.3 Å²	111.3	65%	0.649	70%	0.695	S	S	*	*			trans	106.3	141.5	168.2	0	0	0	0	0	115.7
2347	L	21.2	Very low	22.9	Very low	154 Å²	154	112.8 Å²	112.8	81%	0.806	71%	0.706	S	S	*	*			trans	53.7	67.9	155.9	-56.2	165.5	0	0	0	114.2	A2349	L2347-A2349 HydrophobicContact CB-CB 4.42Å
2348	S	19.2	Very low	23.1	Very low	123 Å²	123	116 Å²	116	86%	0.86	71%	0.714	S	S	*	*			cis	46.8	40.7	34.3	89.9	0	0	0	0	113.4
2349	A	20.2	Very low	23.2	Very low	65 Å²	65	111.9 Å²	111.9	54%	0.537	70%	0.699	S	S	.	*			trans	-128.4	-0.1	-175.7	0	0	0	0	0	115.4	L2347 Y2351	L2347-A2349 HydrophobicContact CB-CB 4.42Å; A2349-Y2351 PolarHBondContact O-N 2.03Å
2350	G	20.9	Very low	23.2	Very low	80 Å²	80	112.1 Å²	112.1	83%	0.825	68%	0.682	S	S	*	*			trans	50.5	-129.1	165.8	0	0	0	0	0	116.5
2351	Y	27.2	Very low	23.7	Very low	145 Å²	145	112 Å²	112	57%	0.569	66%	0.664	S	S	*	*			trans	68.8	36.9	166.8	-80	-106.3	0	0	0	117.6	A2349 R2353	A2349-Y2351 PolarHBondContact O-N 2.03Å; Y2351-R2353 HydrophobicContact CD1-CG 3.77Å; Y2351-R2353 VanDerWaalsContact CE1-CD 3.49Å; Y2351-R2353 HydrophobicContact CE1-CG 4.03Å; Y2351-R2353 HydrophobicContact CG-CG 4.23Å
2352	G	22.7	Very low	24.6	Very low	49 Å²	49	110.4 Å²	110.4	51%	0.505	65%	0.653	S	S	.	*	S	Bend	trans	-75	-33.8	157.6	0	0	0	0	0	117.7	K2014	K2014-G2352 PolarHBondContact NZ-O 3.01Å
2353	R	29.3	Very low	24.4	Very low	120 Å²	120	111.9 Å²	111.9	45%	0.453	65%	0.651	S	S	.	*			cis	-113.1	-155.3	8	-55.4	-178.5	176.1	-176	-1.5	110.5	E2018 Y2351	E2018-R2353 IonicContact OE2-NH2 2.79Å; E2018-R2353 PolarHBondContact OE2-NH2 3.35Å; Y2351-R2353 HydrophobicContact CD1-CG 3.77Å; Y2351-R2353 VanDerWaalsContact CE1-CD 3.49Å; Y2351-R2353 HydrophobicContact CE1-CG 4.03Å; Y2351-R2353 HydrophobicContact CG-CG 4.23Å
2354	D	25.8	Very low	24.7	Very low	119 Å²	119	113.6 Å²	113.6	64%	0.636	65%	0.649	S	S	*	*			trans	-41.8	152	143	-37.9	-93.4	0	0	0	111.9
2355	S	25.5	Very low	24.7	Very low	86 Å²	86	115.9 Å²	115.9	60%	0.601	64%	0.641	S	S	*	*			cis	-166	168.3	-20.7	57.9	0	0	0	0	109.7
2356	D	23.9	Very low	25.2	Very low	136 Å²	136	110.7 Å²	110.7	73%	0.727	63%	0.631	S	S	*	*			trans	66.8	175.8	163	-49.1	-57.5	0	0	0	117.9
2357	F	23	Very low	25.5	Very low	183 Å²	183	116.8 Å²	116.8	80%	0.803	64%	0.64	S	S	*	*			trans	64.1	111.1	-162	-67.4	-91	0	0	0	114
2358	Y	26.7	Very low	25.6	Very low	179 Å²	179	116.4 Å²	116.4	70%	0.702	64%	0.638	S	S	*	*			cis	66.4	144.7	11.6	-97.4	-81.2	0	0	0	117
2359	T	25.5	Very low	25.7	Very low	82 Å²	82	118.2 Å²	118.2	50%	0.503	63%	0.63	S	S	.	*			trans	70.1	144.6	160	52.6	0	0	0	0	122.2
2360	D	22.2	Very low	25.8	Very low	84 Å²	84	121.2 Å²	121.2	45%	0.449	63%	0.633	S	S	.	*			trans	94	136.4	143.5	-72.2	-11	0	0	0	124.9	T460	T460-D2360 PolarHBondContact OG1-N 2.85Å; T460-D2360 VanDerWaalsContact OG1-N 3.1Å
2361	F	34.7	Very low	26.2	Very low	87 Å²	87	122.8 Å²	122.8	38%	0.382	63%	0.629	S	S	.	*			trans	4.4	123.2	163	-68	-99.3	0	0	0	118.7	T460 L1749 H1750	T460-F2361 HydrophobicContact CG2-CD2 4.26Å; T460-F2361 HydrophobicContact CG2-CE2 4.26Å; L1749-F2361 HydrophobicContact CD1-CD2 4.35Å; L1749-F2361 HydrophobicContact CD2-CD2 3.8Å; L1749-F2361 HydrophobicContact CD2-CE2 3.19Å; L1749-F2361 HydrophobicContact CD2-CZ 3.75Å; L1749-F2361 HydrophobicContact CG-CD2 3.85Å; L1749-F2361 HydrophobicContact CG-CE2 3.61Å; L1749-F2361 HydrophobicContact CG-CZ 3.98Å; H1750-F2361 AromaticContact CE1-CD1 3.21Å; H1750-F2361 WeakPolarHBondContact CE1-CD1 3.42Å; H1750-F2361 AromaticContact CE1-CE1 3.63Å; H1750-F2361 AromaticContact ND1-CD1 3.71Å; H1750-F2361 AromaticContact ND1-CE1 3.71Å
2362	S	40.8	Very low	26.2	Very low	73 Å²	73	120.8 Å²	120.8	51%	0.51	63%	0.634	S	S	.	*			cis	51.9	77.4	15.7	30.1	0	0	0	0	113.8
2363	I	19.3	Very low	26.2	Very low	148 Å²	148	122.3 Å²	122.3	76%	0.759	63%	0.629	S	S	*	*			cis	-108.7	133.7	31.7	-44.6	170.2	0	0	0	113.8
2364	P	30.3	Very low	26	Very low	102 Å²	102	119.4 Å²	119.4	66%	0.662	62%	0.619	S	S	*	*			trans	-120.2	158.6	163.7	12.1	11.7	0	0	0	114.6
2365	R	22.3	Very low	26.1	Very low	161 Å²	161	113.9 Å²	113.9	61%	0.608	59%	0.59	S	S	*	*			trans	-55.8	143.9	173.2	-69.4	-175.8	174.4	117.5	-10.7	111.4	D1732	D1732-R2365 IonicContact OD1-NH2 2.79Å; D1732-R2365 IonicContact OD2-CZ 3.43Å; D1732-R2365 IonicContact OD2-NE 2.74Å; D1732-R2365 PolarHBondContact OD2-NE 3.08Å; D1732-R2365 IonicContact OD2-NH2 3.15Å; D1732-R2365 PolarHBondContact OD2-NH2 2.84Å
2366	A	28.7	Very low	26.1	Very low	86 Å²	86	110.4 Å²	110.4	71%	0.711	56%	0.564	S	S	*	*			cis	72.8	152.4	38.5	0	0	0	0	0	115
2367	K	26.6	Very low	26	Very low	191 Å²	191	105.1 Å²	105.1	83%	0.83	54%	0.537	S	S	*	.			trans	-51.4	144.9	178.6	-73.1	-178.4	-179.7	177.3	0	110.2
2368	L	22.4	Very low	26.1	Very low	145 Å²	145	96.8 Å²	96.8	76%	0.759	50%	0.501	S	S	*	.			cis	-102.3	121.1	17.6	-71.1	162.9	0	0	0	112.7	E2370	L2368-E2370 VanDerWaalsContact C-N 3.34Å; L2368-E2370 PolarHBondContact O-N 3.11Å
2369	K	21.7	Very low	26.1	Very low	162 Å²	162	90.4 Å²	90.4	70%	0.704	49%	0.485	S	S	*	.				-27.4	95.2	100.6	-166.7	-175.2	178.8	-173.5	0	114.7
2370	E	21.5	Very low	25.9	Very low	128 Å²	128	89.6 Å²	89.6	60%	0.598	49%	0.486	S	S	*	.			trans	66.6	162.8	152.2	-64.3	150.1	-141.9	0	0	117.7	L2368	L2368-E2370 VanDerWaalsContact C-N 3.34Å; L2368-E2370 PolarHBondContact O-N 3.11Å
2371	P	29.4	Very low	25.8	Very low	113 Å²	113	88 Å²	88	73%	0.734	49%	0.485	S	S	*	.			cis	-124.6	-179.4	-15.1	17.2	7.7	0	0	0	112.6
2372	P	27.2	Very low	25.2	Very low	103 Å²	103	83.9 Å²	83.9	67%	0.669	47%	0.467	S	S	*	.			cis	-136.1	51.1	-36.8	38.9	-20.9	0	0	0	111.9	K2374	P2372-K2374 WeakPolarHBondContact O-CG 3.49Å
2373	M	22.6	Very low	24.3	Very low	81 Å²	81	80.9 Å²	80.9	40%	0.399	45%	0.446	S	S	.	.			trans	-111.3	97.7	168.8	-67.3	-70.7	-173.9	0	0	109.5	S2049 R2050 D2053	S2049-M2373 WeakPolarHBondContact CB-SD 3.24Å; R2050-M2373 WeakPolarHBondContact CG-O 3.31Å; R2050-M2373 PolarHBondContact NE-O 2.95Å; D2053-M2373 HydrophobicContact CB-CE 4.13Å; D2053-M2373 WeakPolarHBondContact OD1-CG 3.44Å
2374	K	26.6	Very low	24.4	Very low	58 Å²	58	74 Å²	74	25%	0.252	41%	0.412	S	S	.	.				53.6	100.1	76.6	-59.6	172.6	68.2	-148.6	0	111.6	N2047 S2049 R2050 T2056 P2372	N2047-K2374 HydrophobicContact CB-CB 4Å; N2047-K2374 WeakPolarHBondContact ND2-CB 3.15Å; N2047-K2374 VanDerWaalsContact ND2-CG 3.3Å; N2047-K2374 WeakPolarHBondContact ND2-CG 3.35Å; N2047-K2374 WeakPolarHBondContact OD1-CB 3.06Å; N2047-K2374 WeakPolarHBondContact OD1-CE 3.1Å; S2049-K2374 CarbonylContact C-O 3.55Å; S2049-K2374 WeakPolarHBondContact CA-O 3.37Å; S2049-K2374 VanDerWaalsContact CB-O 3.29Å; S2049-K2374 WeakPolarHBondContact CB-O 3.42Å; S2049-K2374 PolarHBondContact N-O 2.75Å; S2049-K2374 WeakPolarHBondContact OG-CE 3.21Å; S2049-K2374 PolarHBondContact OG-NZ 2.77Å; R2050-K2374 PolarHBondContact N-O 2.88Å; T2056-K2374 PolarHBondContact O-NZ 3.48Å; P2372-K2374 WeakPolarHBondContact O-CG 3.49Å
2375	G	26.5	Very low	23.9	Very low	3 Å²	3	69.2 Å²	69.2	3%	0.031	38%	0.381	C	S	.	.			trans	-178.3	118.6	175.5	0	0	0	0	0	125.5	Q2046 N2047 R2050	Q2046-G2375 PolarHBondContact OE1-O 2.83Å; N2047-G2375 CarbonylContact O-C 3.4Å; N2047-G2375 WeakPolarHBondContact O-CA 3.37Å; N2047-G2375 PolarHBondContact O-N 2.82Å; R2050-G2375 WeakPolarHBondContact CD-O 3.2Å; R2050-G2375 VanDerWaalsContact CG-CA 3.44Å; R2050-G2375 PolarHBondContact NH1-O 2.6Å
2376	Y	26.9	Very low	23.8	Very low	13 Å²	13	61.5 Å²	61.5	5%	0.051	35%	0.352	C	S	.	.				54.2	93.3	108.1	-92.8	-40.5	0	0	0	118.5	Q2046 N2047 P2048 S2049 I2051 F2055 W2060	Q2046-Y2376 VanDerWaalsContact CB-N 3.33Å; N2047-Y2376 PolarHBondContact O-N 3.12Å; P2048-Y2376 VanDerWaalsContact CA-CD2 3.43Å; P2048-Y2376 HydrophobicContact CB-CD2 4.31Å; P2048-Y2376 HydrophobicContact CB-CE1 4.09Å; P2048-Y2376 HydrophobicContact CB-CE2 3.71Å; P2048-Y2376 WeakPolarHBondContact O-CE2 3.45Å; S2049-Y2376 VanDerWaalsContact CA-CD2 3.48Å; I2051-Y2376 HydrophobicContact CB-CD1 4.07Å; I2051-Y2376 HydrophobicContact CB-CD2 3.44Å; I2051-Y2376 VanDerWaalsContact CB-CD2 3.44Å; I2051-Y2376 HydrophobicContact CB-CE1 4.46Å; I2051-Y2376 HydrophobicContact CB-CE2 3.89Å; I2051-Y2376 HydrophobicContact CB-CG 3.56Å; I2051-Y2376 VanDerWaalsContact CD1-CB 3.49Å; I2051-Y2376 HydrophobicContact CD1-CD1 3.16Å; I2051-Y2376 HydrophobicContact CD1-CD2 4.16Å; I2051-Y2376 HydrophobicContact CD1-CE1 3.82Å; I2051-Y2376 HydrophobicContact CD1-CG 3.38Å; I2051-Y2376 HydrophobicContact CG1-CD1 4.03Å; I2051-Y2376 HydrophobicContact CG1-CD2 4.14Å; I2051-Y2376 HydrophobicContact CG1-CG 3.71Å; I2051-Y2376 HydrophobicContact CG2-CD2 4.44Å; I2051-Y2376 HydrophobicContact CG2-CE2 4.43Å; I2051-Y2376 VanDerWaalsContact N-CD2 3.34Å; F2055-Y2376 HydrophobicContact CB-CE2 3.89Å; F2055-Y2376 WeakPolarHBondContact CB-OH 3.06Å; F2055-Y2376 AromaticContact CD2-CE2 3.75Å; F2055-Y2376 HydrophobicContact CD2-CE2 3.75Å; F2055-Y2376 AromaticContact CD2-CZ 3.72Å; F2055-Y2376 WeakPolarHBondContact CD2-OH 3.32Å; F2055-Y2376 HydrophobicContact CG-CE2 4.33Å; W2060-Y2376 HydrophobicContact CB-CD1 3.78Å; W2060-Y2376 HydrophobicContact CB-CE1 3.89Å; W2060-Y2376 AromaticContact CD1-CD1 3.6Å; W2060-Y2376 AromaticContact CD2-CD1 3.4Å; W2060-Y2376 HydrophobicContact CD2-CD1 3.4Å; W2060-Y2376 AromaticContact CD2-CE1 3.27Å; W2060-Y2376 HydrophobicContact CD2-CE1 3.27Å; W2060-Y2376 AromaticContact CE2-CD1 3.37Å; W2060-Y2376 AromaticContact CE2-CE1 3.56Å; W2060-Y2376 HydrophobicContact CE3-CD1 4.07Å; W2060-Y2376 AromaticContact CE3-CE1 3.44Å; W2060-Y2376 HydrophobicContact CE3-CE1 3.44Å; W2060-Y2376 VanDerWaalsContact CE3-CE1 3.44Å; W2060-Y2376 AromaticContact CG-CD1 3.33Å; W2060-Y2376 HydrophobicContact CG-CD1 3.33Å; W2060-Y2376 AromaticContact CG-CE1 3.58Å; W2060-Y2376 HydrophobicContact CG-CE1 3.58Å; W2060-Y2376 HydrophobicContact CG-CG 4.49Å; W2060-Y2376 HydrophobicContact CH2-CD1 4.42Å; W2060-Y2376 AromaticContact CH2-CE1 3.92Å; W2060-Y2376 HydrophobicContact CH2-CE1 3.92Å; W2060-Y2376 AromaticContact CZ2-CD1 3.8Å; W2060-Y2376 HydrophobicContact CZ2-CD1 3.8Å; W2060-Y2376 AromaticContact CZ2-CE1 3.77Å; W2060-Y2376 HydrophobicContact CZ2-CE1 3.77Å; W2060-Y2376 AromaticContact CZ3-CE1 3.82Å; W2060-Y2376 HydrophobicContact CZ3-CE1 3.82Å; W2060-Y2376 AromaticContact NE1-CD1 3.62Å
2377	T	21.5	Very low	23.5	Very low	26 Å²	26	61.8 Å²	61.8	16%	0.16	34%	0.335	C	S	.	.			trans	-73.7	-153.1	168	17.2	0	0	0	0	112.9	Q2046 I2051 E2062 Y2110	Q2046-T2377 HydrophobicContact CG-CG2 3.86Å; Q2046-T2377 WeakPolarHBondContact CG-OG1 3.36Å; I2051-T2377 WeakPolarHBondContact CD1-O 3.06Å; E2062-T2377 HydrophobicContact CB-CG2 4.32Å; E2062-T2377 VanDerWaalsContact CD-CB 3.42Å; E2062-T2377 VanDerWaalsContact CD-CG2 3.44Å; E2062-T2377 HydrophobicContact CG-CG2 4.5Å; E2062-T2377 VanDerWaalsContact OE1-CB 3.23Å; E2062-T2377 WeakPolarHBondContact OE1-CB 3.4Å; E2062-T2377 WeakPolarHBondContact OE1-CG2 3.37Å; E2062-T2377 WeakPolarHBondContact OE2-CG2 3.26Å; Y2110-T2377 PolarHBondContact OH-O 3.13Å; Y2110-T2377 VanDerWaalsContact OH-O 3.05Å
2378	N	25	Very low	23.3	Very low	8 Å²	8	54.3 Å²	54.3	4%	0.043	30%	0.301	C	S	.	.			trans	81.2	130.6	-170.6	-58.4	29.2	0	0	0	113.7	P1988 W2060 E2062 Y2110 K2111	P1988-N2378 WeakPolarHBondContact CB-ND2 3.36Å; P1988-N2378 WeakPolarHBondContact CB-OD1 3.05Å; P1988-N2378 WeakPolarHBondContact CG-ND2 3.37Å; W2060-N2378 HydrophobicContact CZ2-CB 4.45Å; W2060-N2378 WeakPolarHBondContact CZ2-ND2 3.08Å; W2060-N2378 WeakPolarHBondContact CZ2-OD1 3.22Å; W2060-N2378 PolarHBondContact NE1-OD1 3.13Å; E2062-N2378 PolarHBondContact OE1-N 3.43Å; E2062-N2378 VanDerWaalsContact OE1-N 3.17Å; Y2110-N2378 HydrophobicContact CD1-CB 3.45Å; Y2110-N2378 VanDerWaalsContact CD1-CB 3.45Å; Y2110-N2378 HydrophobicContact CD2-CB 4.48Å; Y2110-N2378 HydrophobicContact CE1-CB 3Å; Y2110-N2378 HydrophobicContact CE2-CB 4.15Å; Y2110-N2378 HydrophobicContact CG-CB 4.19Å; Y2110-N2378 VanDerWaalsContact CZ-CB 3.4Å; K2111-N2378 PolarHBondContact NZ-O 3.43Å
2379	A	25.8	Very low	23.4	Very low	44 Å²	44	49.4 Å²	49.4	36%	0.364	28%	0.275	S	S	.	.				74.8	161.2	73.3	0	0	0	0	0	111.7	L2107 Y2110	L2107-A2379 HydrophobicContact CD1-CB 4.43Å; Y2110-A2379 HydrophobicContact CD1-CB 4.17Å; Y2110-A2379 HydrophobicContact CE1-CB 4.44Å; Y2110-A2379 WeakPolarHBondContact CE1-O 3.33Å
2380	A	21.5	Very low	23.6	Very low	65 Å²	65	46.5 Å²	46.5	54%	0.537	27%	0.265	S	S	.	.			cis	73.5	124.6	19.8	0	0	0	0	0	113.7	L2107	L2107-A2380 WeakPolarHBondContact CD1-O 2.91Å; L2107-A2380 CarbonylContact O-C 3.57Å; L2107-A2380 VanDerWaalsContact O-O 3.08Å
2381	A	21.6	Very low	23.7	Very low	51 Å²	51	45.7 Å²	45.7	42%	0.421	26%	0.261	S	S	.	.	S	Bend	cis	-99.6	-95.2	8.5	0	0	0	0	0	111.9	L2107 A2108	L2107-A2381 PolarHBondContact O-N 3.48Å; A2108-A2381 CarbonylContact O-C 3.52Å
2382	D	21.5	Very low	23.4	Very low	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.			trans	-46.8	139	174.2	-18.7	-10.6	0	0	0	110.6	A2108 C2109 Y2110 P2122 Y2128 G2384	A2108-D2382 VanDerWaalsContact C-CB 3.41Å; A2108-D2382 WeakPolarHBondContact CA-OD1 3.12Å; A2108-D2382 WeakPolarHBondContact CA-OD2 3.34Å; A2108-D2382 WeakPolarHBondContact CB-OD1 3.37Å; A2108-D2382 WeakPolarHBondContact CB-OD2 3.4Å; A2108-D2382 CarbonylContact O-C 3.56Å; A2108-D2382 VanDerWaalsContact O-C 3.24Å; A2108-D2382 WeakPolarHBondContact O-CA 3.35Å; A2108-D2382 WeakPolarHBondContact O-CB 3.23Å; A2108-D2382 PolarHBondContact O-N 2.92Å; C2109-D2382 CarbonylContact C-O 3.45Å; C2109-D2382 PolarHBondContact N-OD2 3.39Å; Y2110-D2382 CarbonylContact C-O 3.48Å; Y2110-D2382 VanDerWaalsContact CA-O 3.28Å; Y2110-D2382 WeakPolarHBondContact CA-O 3.45Å; Y2110-D2382 PolarHBondContact N-O 3.32Å; P2122-D2382 WeakPolarHBondContact CA-OD2 3.25Å; P2122-D2382 VanDerWaalsContact CB-OD2 3.32Å; P2122-D2382 WeakPolarHBondContact CB-OD2 3.14Å; Y2128-D2382 VanDerWaalsContact CB-CB 3.46Å; Y2128-D2382 VanDerWaalsContact CB-CG 3.49Å; Y2128-D2382 HydrophobicContact CD1-CB 4.33Å; Y2128-D2382 HydrophobicContact CG-CB 3.95Å; D2382-G2384 VanDerWaalsContact CB-N 3.3Å
2383	A	20.5	Very low	23.4	Very low	10 Å²	10	51.3 Å²	51.3	8%	0.083	27%	0.266	C	S	.	.			cis	41	-149	47.4	0	0	0	0	0	111.8	C2109 K2111 N2112 Y2128	C2109-A2383 CarbonylContact C-O 2.78Å; K2111-A2383 PolarHBondContact O-N 2.79Å; N2112-A2383 WeakPolarHBondContact CB-O 3Å; N2112-A2383 PolarHBondContact ND2-O 3.13Å; Y2128-A2383 HydrophobicContact CD1-CB 3.69Å; Y2128-A2383 HydrophobicContact CD2-CB 3.19Å; Y2128-A2383 HydrophobicContact CE1-CB 3.54Å; Y2128-A2383 HydrophobicContact CE2-CB 3.05Å; Y2128-A2383 HydrophobicContact CG-CB 3.55Å
2384	G	22.2	Very low	23.5	Very low	4 Å²	4	56 Å²	56	4%	0.041	29%	0.287	C	S	.	.			trans	82	62.5	-144.9	0	0	0	0	0	105.1	N2112 C2120 Y2128 D2382	N2112-G2384 WeakPolarHBondContact CB-O 3.41Å; N2112-G2384 VanDerWaalsContact CG-O 3.26Å; N2112-G2384 PolarHBondContact ND2-O 2.87Å; C2120-G2384 WeakPolarHBondContact SG-CA 3.38Å; Y2128-G2384 VanDerWaalsContact CD2-N 3.32Å; D2382-G2384 VanDerWaalsContact CB-N 3.3Å
2385	A	20.4	Very low	23.5	Very low	1 Å²	1	56.6 Å²	56.6	1%	0.008	31%	0.309	C	S	.	.				24.8	99.4	75.8	0	0	0	0	0	115	C2114 C2120 Y2128 T2129 C2130	C2114-A2385 VanDerWaalsContact CB-C 3.49Å; C2114-A2385 VanDerWaalsContact SG-CA 3.59Å; C2120-A2385 WeakPolarHBondContact CA-O 3.46Å; Y2128-A2385 HydrophobicContact CD2-CB 3.33Å; Y2128-A2385 HydrophobicContact CE2-CB 3.85Å; Y2128-A2385 HydrophobicContact CG-CB 4.43Å; T2129-A2385 VanDerWaalsContact C-CB 3.42Å; T2129-A2385 WeakPolarHBondContact O-CB 3.18Å; C2130-A2385 HydrophobicContact CB-CB 3.74Å; C2130-A2385 VanDerWaalsContact SG-C 3.59Å; C2130-A2385 WeakPolarHBondContact SG-CA 3.26Å; C2130-A2385 WeakPolarHBondContact SG-CB 3.48Å
2386	D	20	Very low	23.2	Very low	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.352	C	S	.	.			trans	-138.3	109.3	139.7	-109.4	33.2	0	0	0	116.3	C2114 L2119 I2121 C2130 R2131 C2132 R2388	C2114-D2386 VanDerWaalsContact SG-CA 3.58Å; C2114-D2386 PolarHBondContact SG-N 3.45Å; C2114-D2386 PolarHBondContact SG-O 3.5Å; L2119-D2386 WeakPolarHBondContact CA-OD2 3.29Å; L2119-D2386 HydrophobicContact CB-CB 4.24Å; L2119-D2386 WeakPolarHBondContact CB-OD2 3.42Å; L2119-D2386 PolarHBondContact N-OD2 2.91Å; I2121-D2386 WeakPolarHBondContact CG1-OD1 3.34Å; I2121-D2386 PolarHBondContact N-OD1 3.44Å; C2130-D2386 PolarHBondContact SG-N 3.05Å; R2131-D2386 VanDerWaalsContact CA-C 3.5Å; R2131-D2386 VanDerWaalsContact CA-OD2 3.27Å; R2131-D2386 WeakPolarHBondContact CA-OD2 3.33Å; R2131-D2386 WeakPolarHBondContact CB-OD2 3.49Å; R2131-D2386 PolarHBondContact N-OD1 3.39Å; R2131-D2386 PolarHBondContact N-OD2 3.28Å; C2132-D2386 PolarHBondContact N-O 3.02Å; D2386-R2388 IonicContact OD2-NH2 2.8Å
2387	R	22.2	Very low	23.2	Very low	91 Å²	91	69 Å²	69	34%	0.343	39%	0.388	S	S	.	.			trans	-35.8	-118.4	173.5	-70.8	-175.5	-173.6	78.5	-3.4	112.4	T2129 C2130 R2131 C2132 D2138 P2144 G2145 C2148	T2129-R2387 PolarHBondContact OG1-NH1 3.19Å; C2130-R2387 VanDerWaalsContact CB-CA 3.5Å; C2130-R2387 HydrophobicContact CB-CB 3.66Å; C2130-R2387 HydrophobicContact CB-CG 3.27Å; C2130-R2387 WeakPolarHBondContact O-CB 3.42Å; C2130-R2387 VanDerWaalsContact O-CD 3.3Å; C2130-R2387 WeakPolarHBondContact O-CD 3.38Å; C2130-R2387 WeakPolarHBondContact O-CG 3.1Å; C2130-R2387 PolarHBondContact O-NH1 2.99Å; R2131-R2387 VanDerWaalsContact C-N 3.29Å; R2131-R2387 VanDerWaalsContact CA-CA 3.41Å; R2131-R2387 HydrophobicContact CG-CB 4.48Å; C2132-R2387 WeakPolarHBondContact CA-O 3.23Å; C2132-R2387 WeakPolarHBondContact CB-O 3.42Å; C2132-R2387 PolarHBondContact N-O 3.48Å; C2132-R2387 PolarHBondContact SG-O 3.47Å; D2138-R2387 WeakPolarHBondContact OD1-CA 3.49Å; D2138-R2387 WeakPolarHBondContact OD2-CB 3.31Å; P2144-R2387 HydrophobicContact CB-CB 4.19Å; P2144-R2387 HydrophobicContact CB-CG 3.47Å; P2144-R2387 VanDerWaalsContact CB-CG 3.47Å; P2144-R2387 HydrophobicContact CG-CG 3.82Å; P2144-R2387 VanDerWaalsContact O-CA 3.25Å; P2144-R2387 WeakPolarHBondContact O-CA 3.49Å; P2144-R2387 VanDerWaalsContact O-CG 3.25Å; P2144-R2387 WeakPolarHBondContact O-CG 3.22Å; G2145-R2387 WeakPolarHBondContact CA-O 3.46Å; C2148-R2387 PolarHBondContact SG-O 2.82Å
2388	R	22.8	Very low	23.3	Very low	34 Å²	34	75.8 Å²	75.8	13%	0.128	41%	0.411	C	S	.	.			cis	-145.7	142.8	10.6	124.8	-170.1	-9.5	-146.5	-0.4	105.9	R2131 C2132 D2138 D2386	R2131-R2388 HydrophobicContact CB-CB 3.48Å; R2131-R2388 VanDerWaalsContact CB-CB 3.48Å; R2131-R2388 HydrophobicContact CB-CG 4.36Å; R2131-R2388 HydrophobicContact CG-CB 3.89Å; R2131-R2388 PolarHBondContact O-NE 3.2Å; R2131-R2388 PolarHBondContact O-NH2 3.23Å; C2132-R2388 HydrophobicContact CB-CB 3.73Å; C2132-R2388 HydrophobicContact CB-CG 4.31Å; C2132-R2388 VanDerWaalsContact N-CB 3.3Å; C2132-R2388 VanDerWaalsContact O-CD 3.23Å; C2132-R2388 WeakPolarHBondContact O-CD 3.2Å; C2132-R2388 PolarHBondContact O-NE 2.88Å; C2132-R2388 PolarHBondContact SG-N 3.04Å; D2138-R2388 PolarHBondContact OD1-N 3.46Å; D2386-R2388 IonicContact OD2-NH2 2.8Å
2389	M	24.1	Very low	23.1	Very low	42 Å²	42	83.1 Å²	83.1	21%	0.207	45%	0.445	C	S	.	.			trans	70.4	152.5	178.9	-33.3	-148.1	-132.5	0	0	113	P2134 E2137 D2138	P2134-M2389 HydrophobicContact CB-CE 4.14Å; E2137-M2389 CarbonylContact C-O 3.34Å; E2137-M2389 WeakPolarHBondContact CA-O 3.38Å; E2137-M2389 HydrophobicContact CG-CB 4.13Å; D2138-M2389 WeakPolarHBondContact CA-O 3.12Å; D2138-M2389 WeakPolarHBondContact CB-O 3.37Å; D2138-M2389 PolarHBondContact N-O 2.9Å; D2138-M2389 PolarHBondContact OD2-N 2.81Å
2390	M	26.9	Very low	23	Very low	101 Å²	101	83.8 Å²	83.8	50%	0.498	46%	0.456	S	S	.	.			cis	-91.1	116.6	-12.9	-85.7	-64.4	172.7	0	0	111	E2137	E2137-M2390 VanDerWaalsContact CD-CG 3.49Å; E2137-M2390 HydrophobicContact CG-CG 4.21Å; E2137-M2390 VanDerWaalsContact OE1-CG 3.23Å; E2137-M2390 WeakPolarHBondContact OE1-CG 3.24Å
2391	Q	22.1	Very low	22.9	Very low	111 Å²	111	83.6 Å²	83.6	52%	0.519	45%	0.446	S	S	.	.			trans	-46.9	147.4	142.1	-57.6	151.6	-117.8	0	0	108.8
2392	Y	24.4	Very low	23	Very low	191 Å²	191	86.1 Å²	86.1	75%	0.749	45%	0.449	S	S	*	.				174.6	145.9	122.9	-96.9	-66.1	0	0	0	110.7
2393	L	26.8	Very low	22.9	Very low	143 Å²	143	88.7 Å²	88.7	75%	0.749	46%	0.461	S	S	*	.			trans	68.7	125.1	179	-45.3	179	0	0	0	114
2394	E	23.5	Very low	22.8	Very low	180 Å²	180	90.2 Å²	90.2	84%	0.841	47%	0.469	S	S	*	.			cis	92	139.2	24.3	-57	178.2	150.6	0	0	115.2
2395	G	26.4	Very low	22.7	Very low	70 Å²	70	91.2 Å²	91.2	72%	0.722	48%	0.479	S	S	*	.			trans	91.8	122.3	-166.5	0	0	0	0	0	111.5
2396	E	21.7	Very low	22.9	Very low	197 Å²	197	93.9 Å²	93.9	92%	0.921	50%	0.498	S	S	*	.			cis	61.7	114.6	17.9	-61.3	-163.2	158.1	0	0	115.7
2397	G	25.7	Very low	23.1	Very low	79 Å²	79	96.6 Å²	96.6	81%	0.814	51%	0.511	S	S	*	.			trans	-164	148.3	-179.2	0	0	0	0	0	113
2398	R	24.9	Very low	23.3	Very low	169 Å²	169	97.8 Å²	97.8	64%	0.638	53%	0.528	S	S	*	.			trans	-75.9	149.9	-176.9	-85.6	-177.1	-167.6	115.6	9.7	111.8	A2481 I2482	R2398-A2481 PolarHBondContact NH1-O 3.06Å; R2398-A2481 PolarHBondContact NH2-O 3.1Å; R2398-I2482 PolarHBondContact NH2-O 3.17Å
2399	Q	19.4	Very low	23.2	Very low	162 Å²	162	102.6 Å²	102.6	76%	0.757	56%	0.555	S	S	*	*				64.2	104.1	64.4	-158	-173.3	26.2	0	0	112.7
2400	G	23.5	Very low	23	Very low	58 Å²	58	103.4 Å²	103.4	60%	0.598	57%	0.569	S	S	*	*			trans	-175.3	135.9	177.8	0	0	0	0	0	108.4
2401	D	20.4	Very low	22.8	Very low	61 Å²	61	105.4 Å²	105.4	33%	0.326	57%	0.574	S	S	.	*			cis	51.4	118.7	22.5	-73.5	45.7	0	0	0	111.3	Y101 N1771	Y101-D2401 VanDerWaalsContact CE1-CG 3.48Å; Y101-D2401 WeakPolarHBondContact CE1-OD1 3.44Å; Y101-D2401 WeakPolarHBondContact CE1-OD2 3.46Å; Y101-D2401 VanDerWaalsContact CZ-OD2 3.31Å; Y101-D2401 PolarHBondContact OH-OD2 2.59Å; N1771-D2401 PolarHBondContact ND2-OD1 2.96Å
2402	E	22.6	Very low	22.8	Very low	104 Å²	104	105.1 Å²	105.1	49%	0.486	59%	0.585	S	S	.	*			trans	114.5	126.8	176.5	-52.6	-119.9	106.3	0	0	116	T2449 K2450	E2402-T2449 VanDerWaalsContact CA-CA 3.5Å; E2402-T2449 WeakPolarHBondContact OE1-CA 3.07Å; E2402-T2449 PolarHBondContact OE1-N 3Å; E2402-K2450 CarbonylContact C-O 3.43Å; E2402-K2450 WeakPolarHBondContact CA-O 3.03Å; E2402-K2450 HydrophobicContact CB-CB 3.81Å; E2402-K2450 WeakPolarHBondContact CB-O 3.05Å; E2402-K2450 HydrophobicContact CG-CB 4.05Å; E2402-K2450 WeakPolarHBondContact OE1-CB 3.05Å; E2402-K2450 PolarHBondContact OE1-N 2.84Å; E2402-K2450 WeakPolarHBondContact OE2-CB 3.19Å
2403	Q	19.7	Very low	22.8	Very low	55 Å²	55	102.4 Å²	102.4	26%	0.257	58%	0.583	S	S	.	*			cis	119.4	-118	-18.7	-141.6	169.2	-121.1	0	0	127.4	V97 S98 R2421 T2449 K2450 D2451	V97-Q2403 VanDerWaalsContact N-NE2 3.15Å; S98-Q2403 PolarHBondContact O-OE1 3.43Å; Q2403-R2421 PolarHBondContact O-NH2 2.9Å; Q2403-T2449 VanDerWaalsContact CB-C 3.49Å; Q2403-T2449 VanDerWaalsContact CB-CB 3.44Å; Q2403-T2449 PolarHBondContact NE2-OG1 2.79Å; Q2403-K2450 VanDerWaalsContact N-C 3.26Å; Q2403-K2450 PolarHBondContact N-O 2.99Å; Q2403-K2450 CarbonylContact O-C 3.42Å; Q2403-D2451 VanDerWaalsContact C-N 3.35Å; Q2403-D2451 PolarHBondContact O-N 3.39Å
2404	V	19.8	Very low	22.6	Very low	42 Å²	42	99.3 Å²	99.3	26%	0.255	57%	0.57	S	S	.	*	B	Isolated β-bridge	trans	-52.4	136.7	-174.1	167.5	0	0	0	0	119.8	F96 T2449 K2450 D2451	F96-V2404 HydrophobicContact CB-CG2 3.78Å; F96-V2404 HydrophobicContact CD1-CG2 3.7Å; F96-V2404 HydrophobicContact CD2-CB 4.47Å; F96-V2404 HydrophobicContact CD2-CG1 4.28Å; F96-V2404 HydrophobicContact CD2-CG2 3.31Å; F96-V2404 HydrophobicContact CE1-CG2 3.99Å; F96-V2404 HydrophobicContact CE2-CG1 4.25Å; F96-V2404 HydrophobicContact CE2-CG2 3.63Å; F96-V2404 HydrophobicContact CG-CG2 3.32Å; F96-V2404 HydrophobicContact CZ-CG2 3.94Å; V2404-T2449 WeakPolarHBondContact CB-O 3.44Å; V2404-T2449 WeakPolarHBondContact CG2-O 3.43Å; V2404-T2449 VanDerWaalsContact N-C 3.26Å; V2404-T2449 PolarHBondContact N-O 2.57Å; V2404-K2450 VanDerWaalsContact N-N 3.13Å; V2404-K2450 CarbonylContact O-C 3.37Å; V2404-K2450 VanDerWaalsContact O-CA 3.23Å; V2404-K2450 WeakPolarHBondContact O-CA 3.31Å; V2404-K2450 VanDerWaalsContact O-CG 3.27Å; V2404-K2450 WeakPolarHBondContact O-CG 3.4Å; V2404-D2451 PolarHBondContact O-N 2.95Å
2405	G	20	Very low	22.6	Very low	24 Å²	24	93 Å²	93	25%	0.247	55%	0.549	C	S	.	.			trans	63.7	-172.5	162.4	0	0	0	0	0	115.4	R2421 D2451 T2452	G2405-R2421 VanDerWaalsContact C-NE 3.27Å; G2405-R2421 VanDerWaalsContact N-CZ 3.33Å; G2405-R2421 VanDerWaalsContact N-NH2 3.18Å; G2405-R2421 PolarHBondContact O-NE 3.02Å; G2405-R2421 PolarHBondContact O-NH2 3.2Å; G2405-D2451 CarbonylContact O-C 3.13Å; G2405-D2451 WeakPolarHBondContact O-CA 3.22Å; G2405-T2452 PolarHBondContact O-N 2.66Å
2406	S	24.8	Very low	22.5	Very low	57 Å²	57	95.8 Å²	95.8	40%	0.399	54%	0.543	S	S	.	.			cis	-72.9	168.4	-50	65.8	0	0	0	0	110.9	R2421 A2422 D2451	S2406-R2421 WeakPolarHBondContact O-CD 3.48Å; S2406-R2421 VanDerWaalsContact O-CG 3.27Å; S2406-R2421 WeakPolarHBondContact O-CG 3.27Å; S2406-R2421 PolarHBondContact O-NE 2.61Å; S2406-A2422 PolarHBondContact O-N 2.77Å; S2406-D2451 PolarHBondContact N-OD1 2.89Å
2407	E	22.6	Very low	22.7	Very low	58 Å²	58	87.5 Å²	87.5	27%	0.271	51%	0.51	S	S	.	.			cis	-44.4	156.4	19.5	-91.1	174.2	22.7	0	0	118.2	G2420 R2421 A2422 R2454	E2407-G2420 VanDerWaalsContact CD-C 3.49Å; E2407-G2420 WeakPolarHBondContact OE1-CA 3.3Å; E2407-R2421 PolarHBondContact OE1-N 3.37Å; E2407-R2421 PolarHBondContact OE2-N 3.15Å; E2407-A2422 HydrophobicContact CG-CB 4.06Å; E2407-R2454 IonicContact OE2-CZ 2.67Å; E2407-R2454 IonicContact OE2-NE 3.24Å; E2407-R2454 IonicContact OE2-NH2 2.7Å; E2407-R2454 PolarHBondContact OE2-NH2 3.13Å
2408	T	26.7	Very low	23.5	Very low	115 Å²	115	86.8 Å²	86.8	71%	0.706	49%	0.487	S	S	*	.			cis	-130.3	122.1	31.1	-46	0	0	0	0	116.1
2409	I	20.4	Very low	23.7	Very low	135 Å²	135	82.6 Å²	82.6	69%	0.692	48%	0.482	S	S	*	.			trans	-127.9	101.1	146.3	-62.2	177.7	0	0	0	102.7
2410	A	20.4	Very low	24	Very low	60 Å²	60	76.4 Å²	76.4	50%	0.496	46%	0.461	S	S	.	.				74.2	132.4	80	0	0	0	0	0	112.9
2411	F	22.5	Very low	24.8	Very low	142 Å²	142	77.7 Å²	77.7	62%	0.623	45%	0.448	S	S	*	.			trans	65.3	138.1	-170.4	-55.5	-84.2	0	0	0	115.3	Y2435	F2411-Y2435 WeakPolarHBondContact CE1-O 3.09Å; F2411-Y2435 VanDerWaalsContact CZ-O 3.28Å; F2411-Y2435 WeakPolarHBondContact CZ-O 3.24Å
2412	S	23	Very low	25.3	Very low	105 Å²	105	75.5 Å²	75.5	73%	0.734	44%	0.439	S	S	*	.			cis	-156.2	168.5	-13.2	52.3	0	0	0	0	110.7
2413	D	23.3	Very low	25.4	Very low	135 Å²	135	74 Å²	74	72%	0.722	43%	0.434	S	S	*	.			trans	-56	152	-176.9	-68.6	-90.5	0	0	0	115.1	A2415	D2413-A2415 HydrophobicContact CB-CB 4.18Å; D2413-A2415 WeakPolarHBondContact OD1-CA 3.33Å; D2413-A2415 PolarHBondContact OD1-N 2.91Å
2414	V	23.4	Very low	25.9	Very low	78 Å²	78	75.7 Å²	75.7	47%	0.473	46%	0.457	S	S	.	.			cis	-1.9	83	-4.4	-171.8	0	0	0	0	115.6	Q2416	V2414-Q2416 WeakPolarHBondContact CG1-O 3.24Å
2415	A	23.9	Very low	26.1	Very low	47 Å²	47	80.3 Å²	80.3	39%	0.388	47%	0.471	S	S	.	.				50.5	74.7	65.8	0	0	0	0	0	110.5	D2413	D2413-A2415 HydrophobicContact CB-CB 4.18Å; D2413-A2415 WeakPolarHBondContact OD1-CA 3.33Å; D2413-A2415 PolarHBondContact OD1-N 2.91Å
2416	Q	24	Very low	26.3	Very low	129 Å²	129	87.2 Å²	87.2	60%	0.603	49%	0.489	S	S	*	.			trans	73.8	134	-177	-39	119.9	47.4	0	0	112.9	V2414	V2414-Q2416 WeakPolarHBondContact CG1-O 3.24Å
2417	G	26.5	Very low	26.4	Very low	22 Å²	22	90.3 Å²	90.3	23%	0.227	50%	0.501	C	S	.	.			cis	-174.2	139.4	-1.6	0	0	0	0	0	112.9	P14 R15	P14-G2417 VanDerWaalsContact C-C 3.44Å; P14-G2417 VanDerWaalsContact CD-O 3.26Å; P14-G2417 WeakPolarHBondContact CD-O 3.04Å; R15-G2417 VanDerWaalsContact CB-CA 3.45Å; R15-G2417 VanDerWaalsContact N-C 3.33Å
2418	I	41.9	Very low	26.5	Very low	65 Å²	65	89.3 Å²	89.3	33%	0.333	50%	0.498	S	S	.	.			trans	74.4	127.9	167.7	-53.2	117.3	0	0	0	117.3	P13 P14 R15	P13-I2418 CarbonylContact C-O 3.19Å; P13-I2418 WeakPolarHBondContact CA-O 3.38Å; P13-I2418 WeakPolarHBondContact CB-O 3.41Å; P14-I2418 VanDerWaalsContact C-C 3.44Å; P14-I2418 CarbonylContact C-O 3.48Å; P14-I2418 WeakPolarHBondContact CD-O 3.03Å; P14-I2418 CarbonylContact O-C 3.51Å; P14-I2418 WeakPolarHBondContact O-CA 3.31Å; P14-I2418 PolarHBondContact O-N 3.35Å; R15-I2418 PolarHBondContact O-N 2.62Å
2419	P	29.2	Very low	26.3	Very low	80 Å²	80	88.2 Å²	88.2	52%	0.519	49%	0.486	S	S	.	.				-116.9	166.2	-125.6	44.3	-38.2	0	0	0	124.9	P13 P14	P13-P2419 VanDerWaalsContact CB-C 3.46Å; P13-P2419 WeakPolarHBondContact CB-O 3.27Å; P13-P2419 WeakPolarHBondContact CG-O 3.49Å; P13-P2419 CarbonylContact O-C 3.52Å; P13-P2419 WeakPolarHBondContact O-CA 3.46Å; P14-P2419 WeakPolarHBondContact O-CA 3.33Å; P14-P2419 VanDerWaalsContact O-CB 3.23Å; P14-P2419 WeakPolarHBondContact O-CB 3.47Å; P14-P2419 VanDerWaalsContact O-N 3.08Å
2420	G	26.3	Very low	26.5	Very low	32 Å²	32	84.1 Å²	84.1	33%	0.33	47%	0.469	S	S	.	.			trans	-115.9	-150.7	-157.8	0	0	0	0	0	124.4	P13 E2407	P13-G2420 PolarHBondContact O-N 3.07Å; P13-G2420 VanDerWaalsContact O-N 3.13Å; E2407-G2420 VanDerWaalsContact CD-C 3.49Å; E2407-G2420 WeakPolarHBondContact OE1-CA 3.3Å
2421	R	40.6	Very low	26.8	Very low	86 Å²	86	87.4 Å²	87.4	33%	0.325	47%	0.474	S	S	.	.			trans	-155.8	164.1	-169.5	-156.5	74	177.8	-103.1	-20.1	112.3	Q2403 G2405 S2406 E2407 T2452 R2454	Q2403-R2421 PolarHBondContact O-NH2 2.9Å; G2405-R2421 VanDerWaalsContact C-NE 3.27Å; G2405-R2421 VanDerWaalsContact N-CZ 3.33Å; G2405-R2421 VanDerWaalsContact N-NH2 3.18Å; G2405-R2421 PolarHBondContact O-NE 3.02Å; G2405-R2421 PolarHBondContact O-NH2 3.2Å; S2406-R2421 WeakPolarHBondContact O-CD 3.48Å; S2406-R2421 VanDerWaalsContact O-CG 3.27Å; S2406-R2421 WeakPolarHBondContact O-CG 3.27Å; S2406-R2421 PolarHBondContact O-NE 2.61Å; E2407-R2421 PolarHBondContact OE1-N 3.37Å; E2407-R2421 PolarHBondContact OE2-N 3.15Å; R2421-T2452 PolarHBondContact NH2-O 2.82Å; R2421-R2454 WeakPolarHBondContact O-CD 3.35Å; R2421-R2454 WeakPolarHBondContact O-CG 3.03Å; R2421-R2454 PolarHBondContact O-NE 3.16Å
2422	A	30	Very low	27	Very low	15 Å²	15	86.8 Å²	86.8	12%	0.124	49%	0.487	C	S	.	.			trans	-111.6	163.1	-154.5	0	0	0	0	0	122.1	S2406 E2407 T2453	S2406-A2422 PolarHBondContact O-N 2.77Å; E2407-A2422 HydrophobicContact CG-CB 4.06Å; A2422-T2453 CarbonylContact O-C 3.6Å; A2422-T2453 VanDerWaalsContact O-C 3.25Å; A2422-T2453 WeakPolarHBondContact O-CA 3.14Å
2423	D	25.4	Very low	27.4	Very low	73 Å²	73	86.6 Å²	86.6	39%	0.39	49%	0.486	S	S	.	.			trans	-149.4	158.6	167.8	-88.4	-23.7	0	0	0	109.9	R2454 I2456	D2423-R2454 HydrophobicContact CB-CB 3.97Å; D2423-R2454 HydrophobicContact CB-CG 4.48Å; D2423-R2454 PolarHBondContact O-NH1 2.89Å; D2423-R2454 WeakPolarHBondContact OD2-CB 3.39Å; D2423-I2456 HydrophobicContact CB-CD1 3.66Å; D2423-I2456 HydrophobicContact CB-CG1 4.38Å; D2423-I2456 WeakPolarHBondContact OD2-CG1 3.37Å
2424	A	28.7	Very low	27.8	Very low	89 Å²	89	88.2 Å²	88.2	74%	0.736	49%	0.489	S	S	*	.			trans	-146.4	134.1	158.1	0	0	0	0	0	109.5
2425	Y	25.3	Very low	28.5	Very low	139 Å²	139	93.4 Å²	93.4	55%	0.545	50%	0.502	S	S	.	.				49.9	129.4	79.1	-86.6	-106.3	0	0	0	113.7	T2458	Y2425-T2458 HydrophobicContact CE2-CG2 4.49Å
2426	R	23.5	Very low	29	Very low	170 Å²	170	95.1 Å²	95.1	64%	0.642	51%	0.511	S	S	*	.			cis	54.6	78.3	3.9	-159.5	175.8	-166.2	-136.6	1.1	117.8	T2469 T2470	R2426-T2469 PolarHBondContact NH2-O 3.23Å; R2426-T2470 PolarHBondContact NH2-O 3.4Å
2427	D	27.2	Very low	29.6	Very low	121 Å²	121	93.9 Å²	93.9	65%	0.647	52%	0.517	S	S	*	.			trans	-52.8	151.9	142.6	-40.6	-78.2	0	0	0	109.6
2428	D	24.9	Very low	30	Very low	38 Å²	38	96 Å²	96	20%	0.203	53%	0.531	C	S	.	.			cis	35.8	94.4	-0.9	-86.8	-34	0	0	0	119.3	T2460 N2462 T2467	D2428-T2460 PolarHBondContact OD2-N 3.46Å; D2428-N2462 HydrophobicContact CB-CB 4.01Å; D2428-N2462 WeakPolarHBondContact OD1-CB 3.4Å; D2428-N2462 PolarHBondContact OD1-OD1 2.04Å; D2428-T2467 PolarHBondContact OD1-N 3.49Å
2429	M	23	Very low	29.4	Very low	92 Å²	92	96.2 Å²	96.2	45%	0.453	54%	0.539	S	S	.	.			trans	-53.3	154.1	169.4	-104.1	-165.1	-170.1	0	0	112.2	A2464 V2466 T2467	M2429-A2464 CarbonylContact C-O 3.2Å; M2429-A2464 VanDerWaalsContact CB-O 3.24Å; M2429-A2464 WeakPolarHBondContact CB-O 3.38Å; M2429-V2466 HydrophobicContact CB-CB 4.26Å; M2429-V2466 HydrophobicContact CB-CG1 4.2Å; M2429-V2466 HydrophobicContact CE-CG1 4Å; M2429-V2466 HydrophobicContact CG-CB 4.43Å; M2429-V2466 HydrophobicContact CG-CG1 3.95Å; M2429-V2466 HydrophobicContact SD-CB 3.77Å; M2429-V2466 HydrophobicContact SD-CG1 3.42Å; M2429-V2466 WeakPolarHBondContact SD-CG1 3.43Å; M2429-V2466 HydrophobicContact SD-CG2 4.19Å; M2429-T2467 WeakPolarHBondContact CA-OG1 3.5Å; M2429-T2467 WeakPolarHBondContact CB-OG1 3.38Å; M2429-T2467 VanDerWaalsContact CG-OG1 3.31Å; M2429-T2467 WeakPolarHBondContact CG-OG1 3.17Å; M2429-T2467 PolarHBondContact N-OG1 3.44Å
2430	S	23	Very low	29.8	Very low	48 Å²	48	97.2 Å²	97.2	34%	0.336	53%	0.533	S	S	.	.			trans	55.9	128	140.8	-67.1	0	0	0	0	119.2	A2463 A2464	S2430-A2463 CarbonylContact O-C 3.58Å; S2430-A2463 PolarHBondContact O-N 3.23Å; S2430-A2464 VanDerWaalsContact CB-CB 3.45Å; S2430-A2464 PolarHBondContact O-N 2.96Å
2431	E	26.5	Very low	29.9	Very low	130 Å²	130	101.5 Å²	101.5	61%	0.607	55%	0.545	S	S	*	.			trans	67.1	131.3	135.5	-64.6	161.3	-146.6	0	0	116.2	A2463	E2431-A2463 WeakPolarHBondContact O-CB 3.33Å; E2431-A2463 PolarHBondContact O-N 3.05Å
2432	S	28	Very low	29.5	Very low	128 Å²	128	102.9 Å²	102.9	90%	0.895	56%	0.555	S	S	*	*	S	Bend	cis	-87.1	140.2	-1.4	40.7	0	0	0	0	113.1
2433	S	31.2	Very low	29.5	Very low	102 Å²	102	107.3 Å²	107.3	71%	0.713	57%	0.573	S	S	*	*			trans	-146.5	132.9	-178.9	50.6	0	0	0	0	112.3
2434	E	30.7	Very low	29.5	Very low	168 Å²	168	109.4 Å²	109.4	79%	0.785	58%	0.583	S	S	*	*			trans	-148.6	134.8	-178.1	-83.4	-163.6	120.3	0	0	113.7
2435	Y	38.9	Very low	29.9	Very low	188 Å²	188	110.4 Å²	110.4	74%	0.737	57%	0.567	S	S	*	*			trans	73.2	80.7	151	-84.2	-84.8	0	0	0	126	F2411	F2411-Y2435 WeakPolarHBondContact CE1-O 3.09Å; F2411-Y2435 VanDerWaalsContact CZ-O 3.28Å; F2411-Y2435 WeakPolarHBondContact CZ-O 3.24Å
2436	S	34.5	Very low	30.4	Very low	83 Å²	83	112.6 Å²	112.6	58%	0.58	58%	0.575	S	S	*	*				86.9	130.3	120.2	71.7	0	0	0	0	127.9
2437	S	36.5	Very low	30.9	Very low	103 Å²	103	112.8 Å²	112.8	72%	0.72	58%	0.58	S	S	*	*			trans	89	132.4	137.5	71.4	0	0	0	0	127.3
2438	A	34.1	Very low	31.1	Very low	65 Å²	65	111.3 Å²	111.3	54%	0.537	58%	0.576	S	S	.	*			trans	81.4	169.1	155.8	0	0	0	0	0	123.9	L20	L20-A2438 HydrophobicContact CD2-CB 4.17Å
2439	S	29.5	Very low	31.8	Very low	70 Å²	70	110.3 Å²	110.3	49%	0.49	57%	0.571	S	S	.	*				176.4	-178.2	-68.8	-88.4	0	0	0	0	117.6	H21 L22 D23	H21-S2439 CarbonylContact O-C 3.57Å; H21-S2439 VanDerWaalsContact O-CA 3.32Å; H21-S2439 WeakPolarHBondContact O-CA 3.28Å; H21-S2439 WeakPolarHBondContact O-CB 3.48Å; H21-S2439 VanDerWaalsContact O-O 3.11Å; L22-S2439 VanDerWaalsContact C-CB 3.45Å; D23-S2439 VanDerWaalsContact N-CB 3.26Å; D23-S2439 PolarHBondContact N-OG 2.78Å
2440	Y	38.2	Very low	32.2	Very low	101 Å²	101	110.8 Å²	110.8	40%	0.396	57%	0.57	S	S	.	*			trans	63.6	134.3	-176.9	-142.7	-127.2	0	0	0	114.2	H21 L22 D23 E2442	H21-Y2440 WeakPolarHBondContact O-CB 3.11Å; H21-Y2440 PolarHBondContact O-N 3.24Å; L22-Y2440 HydrophobicContact CB-CD2 3.33Å; L22-Y2440 HydrophobicContact CB-CE2 3.82Å; L22-Y2440 HydrophobicContact CB-CG 4.05Å; L22-Y2440 HydrophobicContact CD2-CD2 4.38Å; L22-Y2440 HydrophobicContact CD2-CE2 3.99Å; L22-Y2440 HydrophobicContact CG-CD2 4.47Å; L22-Y2440 WeakPolarHBondContact O-CA 2.9Å; L22-Y2440 WeakPolarHBondContact O-CB 2.88Å; L22-Y2440 WeakPolarHBondContact O-CD2 3.02Å; L22-Y2440 PolarHBondContact O-N 3.27Å; D23-Y2440 PolarHBondContact O-N 2.79Å; Y2440-E2442 HydrophobicContact CE1-CB 4.07Å; Y2440-E2442 VanDerWaalsContact CZ-OE2 3.31Å; Y2440-E2442 PolarHBondContact OH-OE2 3.43Å
2441	Q	28.3	Very low	32.6	Very low	123 Å²	123	111.4 Å²	111.4	58%	0.575	57%	0.57	S	S	*	*				36.5	157.6	75.1	-24.2	-177.7	-124.1	0	0	114.9
2442	E	31.4	Very low	32.7	Very low	115 Å²	115	109 Å²	109	54%	0.537	56%	0.564	S	S	.	*			cis	-132.1	174.5	-2.7	-133.8	151.3	-166	0	0	105.4	Y2440	Y2440-E2442 HydrophobicContact CE1-CB 4.07Å; Y2440-E2442 VanDerWaalsContact CZ-OE2 3.31Å; Y2440-E2442 PolarHBondContact OH-OE2 3.43Å
2443	E	30.2	Very low	33	Very low	107 Å²	107	107.5 Å²	107.5	50%	0.5	55%	0.55	S	S	.	.			cis	-157	159.4	33.3	-146.6	-165.4	139.9	0	0	113.7	R2445	E2443-R2445 CarbonylContact O-C 3.55Å; E2443-R2445 PolarHBondContact O-N 2.93Å; E2443-R2445 WeakPolarHBondContact OE1-CD 3.37Å; E2443-R2445 IonicContact OE1-CZ 3.33Å; E2443-R2445 IonicContact OE1-NE 3.61Å; E2443-R2445 IonicContact OE1-NH1 2.63Å; E2443-R2445 PolarHBondContact OE1-NH1 3.15Å; E2443-R2445 IonicContact OE2-NH1 3.71Å
2444	I	26.3	Very low	33	Very low	118 Å²	118	107 Å²	107	61%	0.605	53%	0.532	S	S	*	.	S	Bend	trans	-46.9	119.9	143.7	-62.9	151.6	0	0	0	107
2445	R	37.6	Very low	32.4	Very low	109 Å²	109	104.3 Å²	104.3	41%	0.411	53%	0.527	S	S	.	.	S	Bend	trans	83.1	120.1	-164.1	-39	138.1	-179.4	171.2	-8.2	110.7	S41 T42 E2443	S41-R2445 PolarHBondContact O-NE 3.02Å; S41-R2445 PolarHBondContact O-NH2 2.03Å; T42-R2445 PolarHBondContact O-NE 2.93Å; T42-R2445 PolarHBondContact O-NH2 3.31Å; E2443-R2445 CarbonylContact O-C 3.55Å; E2443-R2445 PolarHBondContact O-N 2.93Å; E2443-R2445 WeakPolarHBondContact OE1-CD 3.37Å; E2443-R2445 IonicContact OE1-CZ 3.33Å; E2443-R2445 IonicContact OE1-NE 3.61Å; E2443-R2445 IonicContact OE1-NH1 2.63Å; E2443-R2445 PolarHBondContact OE1-NH1 3.15Å; E2443-R2445 IonicContact OE2-NH1 3.71Å
2446	R	34.5	Very low	31.6	Very low	186 Å²	186	99 Å²	99	70%	0.702	51%	0.511	S	S	*	.	S	Bend	cis	-129.3	154.9	8.3	-60.5	178.7	-176.9	-174.9	2.4	108.6	V43	V43-R2446 PolarHBondContact O-NH2 2.84Å
2447	K	34.5	Very low	30.9	Very low	173 Å²	173	101.6 Å²	101.6	75%	0.752	52%	0.523	S	S	*	.			trans	-118	142.4	-137.7	-65.8	-173.7	172.3	-169.1	0	116.5
2448	V	30.7	Very low	30.3	Very low	91 Å²	91	100.5 Å²	100.5	55%	0.552	51%	0.512	S	S	*	.			trans	72.7	157.3	163.1	175.7	0	0	0	0	115.1
2449	T	39.3	Very low	29.9	Very low	17 Å²	17	105.2 Å²	105.2	10%	0.104	52%	0.521	C	S	.	.			trans	87.8	114.9	-174.4	73.8	0	0	0	0	112.6	E2402 Q2403 V2404	E2402-T2449 VanDerWaalsContact CA-CA 3.5Å; E2402-T2449 WeakPolarHBondContact OE1-CA 3.07Å; E2402-T2449 PolarHBondContact OE1-N 3Å; Q2403-T2449 VanDerWaalsContact CB-C 3.49Å; Q2403-T2449 VanDerWaalsContact CB-CB 3.44Å; Q2403-T2449 PolarHBondContact NE2-OG1 2.79Å; V2404-T2449 WeakPolarHBondContact CB-O 3.44Å; V2404-T2449 WeakPolarHBondContact CG2-O 3.43Å; V2404-T2449 VanDerWaalsContact N-C 3.26Å; V2404-T2449 PolarHBondContact N-O 2.57Å
2450	K	32.5	Very low	29.7	Very low	102 Å²	102	106.7 Å²	106.7	44%	0.443	53%	0.527	S	S	.	.	B	Isolated β-bridge	trans	-150.6	150.5	-158.5	-151.5	168	162.7	-76.2	0	120	E2402 Q2403 V2404	E2402-K2450 CarbonylContact C-O 3.43Å; E2402-K2450 WeakPolarHBondContact CA-O 3.03Å; E2402-K2450 HydrophobicContact CB-CB 3.81Å; E2402-K2450 WeakPolarHBondContact CB-O 3.05Å; E2402-K2450 HydrophobicContact CG-CB 4.05Å; E2402-K2450 WeakPolarHBondContact OE1-CB 3.05Å; E2402-K2450 PolarHBondContact OE1-N 2.84Å; E2402-K2450 WeakPolarHBondContact OE2-CB 3.19Å; Q2403-K2450 VanDerWaalsContact N-C 3.26Å; Q2403-K2450 PolarHBondContact N-O 2.99Å; Q2403-K2450 CarbonylContact O-C 3.42Å; V2404-K2450 VanDerWaalsContact N-N 3.13Å; V2404-K2450 CarbonylContact O-C 3.37Å; V2404-K2450 VanDerWaalsContact O-CA 3.23Å; V2404-K2450 WeakPolarHBondContact O-CA 3.31Å; V2404-K2450 VanDerWaalsContact O-CG 3.27Å; V2404-K2450 WeakPolarHBondContact O-CG 3.4Å
2451	D	31	Very low	28.9	Very low	60 Å²	60	107.2 Å²	107.2	32%	0.321	54%	0.541	S	S	.	.			trans	91.5	130.9	154.6	-92.2	-47.7	0	0	0	127.6	Q2403 V2404 G2405 S2406	Q2403-D2451 VanDerWaalsContact C-N 3.35Å; Q2403-D2451 PolarHBondContact O-N 3.39Å; V2404-D2451 PolarHBondContact O-N 2.95Å; G2405-D2451 CarbonylContact O-C 3.13Å; G2405-D2451 WeakPolarHBondContact O-CA 3.22Å; S2406-D2451 PolarHBondContact N-OD1 2.89Å
2452	T	29.7	Very low	29.5	Very low	80 Å²	80	104 Å²	104	49%	0.491	53%	0.528	S	S	.	.			trans	64.1	179.4	161.7	64.9	0	0	0	0	118.2	G2405 R2421	G2405-T2452 PolarHBondContact O-N 2.66Å; R2421-T2452 PolarHBondContact NH2-O 2.82Å
2453	T	34.4	Very low	29.4	Very low	96 Å²	96	101.9 Å²	101.9	59%	0.589	53%	0.53	S	S	*	.			cis	-130.8	-155.7	-1.7	60.1	0	0	0	0	112.1	A2422	A2422-T2453 CarbonylContact O-C 3.6Å; A2422-T2453 VanDerWaalsContact O-C 3.25Å; A2422-T2453 WeakPolarHBondContact O-CA 3.14Å
2454	R	29.4	Very low	29.4	Very low	93 Å²	93	98 Å²	98	35%	0.351	52%	0.516	S	S	.	.			trans	-144.4	-168.3	-172.4	-112.1	-170.4	-164.4	154.6	-0.6	116.5	E2407 R2421 D2423	E2407-R2454 IonicContact OE2-CZ 2.67Å; E2407-R2454 IonicContact OE2-NE 3.24Å; E2407-R2454 IonicContact OE2-NH2 2.7Å; E2407-R2454 PolarHBondContact OE2-NH2 3.13Å; R2421-R2454 WeakPolarHBondContact O-CD 3.35Å; R2421-R2454 WeakPolarHBondContact O-CG 3.03Å; R2421-R2454 PolarHBondContact O-NE 3.16Å; D2423-R2454 HydrophobicContact CB-CB 3.97Å; D2423-R2454 HydrophobicContact CB-CG 4.48Å; D2423-R2454 PolarHBondContact O-NH1 2.89Å; D2423-R2454 WeakPolarHBondContact OD2-CB 3.39Å
2455	T	18.2	Very low	29.5	Very low	110 Å²	110	95.5 Å²	95.5	68%	0.675	52%	0.519	S	S	*	.			trans	-123.8	113.2	161.8	-69.2	0	0	0	0	108.7
2456	I	23.1	Very low	29.3	Very low	77 Å²	77	93.2 Å²	93.2	40%	0.395	52%	0.517	S	S	.	.			trans	-137.3	141.7	174.2	-68.1	-169.6	0	0	0	112.1	D2423 T2458	D2423-I2456 HydrophobicContact CB-CD1 3.66Å; D2423-I2456 HydrophobicContact CB-CG1 4.38Å; D2423-I2456 WeakPolarHBondContact OD2-CG1 3.37Å; I2456-T2458 HydrophobicContact CG2-CG2 4.03Å
2457	T	19.3	Very low	29	Very low	138 Å²	138	86.2 Å²	86.2	85%	0.847	50%	0.495	S	S	*	.			trans	-131.6	104.3	167.9	-50.2	0	0	0	0	109.2
2458	T	23.8	Very low	28.6	Very low	79 Å²	79	81.7 Å²	81.7	49%	0.485	48%	0.482	S	S	.	.			trans	-130.6	129.8	173.3	44.4	0	0	0	0	108.2	Y2425 I2456	Y2425-T2458 HydrophobicContact CE2-CG2 4.49Å; I2456-T2458 HydrophobicContact CG2-CG2 4.03Å
2459	K	25.4	Very low	28.3	Very low	165 Å²	165	82.6 Å²	82.6	72%	0.717	49%	0.488	S	S	*	.				60.6	116.7	56.9	-68.1	-165.5	174.9	-172.8	0	110.8
2460	T	26.2	Very low	27.5	Very low	101 Å²	101	85.5 Å²	85.5	62%	0.62	51%	0.506	S	S	*	.			cis	64.3	118.5	37	-39.7	0	0	0	0	111.8	D2428	D2428-T2460 PolarHBondContact OD2-N 3.46Å
2461	T	20.8	Very low	27	Very low	112 Å²	112	86.4 Å²	86.4	69%	0.687	52%	0.52	S	S	*	.			trans	56.5	89.7	-179.6	47.7	0	0	0	0	111.7
2462	N	40.7	Very low	26.6	Very low	56 Å²	56	87.1 Å²	87.1	30%	0.299	53%	0.534	S	S	.	.			cis	54.1	127.3	33	87.1	-101.9	0	0	0	113.3	D2428 G2465 V2466	D2428-N2462 HydrophobicContact CB-CB 4.01Å; D2428-N2462 WeakPolarHBondContact OD1-CB 3.4Å; D2428-N2462 PolarHBondContact OD1-OD1 2.04Å; N2462-G2465 PolarHBondContact ND2-N 2.94Å; N2462-V2466 PolarHBondContact ND2-O 2.65Å
2463	A	30.9	Very low	26.2	Very low	70 Å²	70	88.1 Å²	88.1	58%	0.579	55%	0.55	S	S	*	*	S	Bend	trans	-135.3	13.9	167.8	0	0	0	0	0	115.4	S2430 E2431	S2430-A2463 CarbonylContact O-C 3.58Å; S2430-A2463 PolarHBondContact O-N 3.23Å; E2431-A2463 WeakPolarHBondContact O-CB 3.33Å; E2431-A2463 PolarHBondContact O-N 3.05Å
2464	A	29.8	Very low	25.5	Very low	26 Å²	26	90.4 Å²	90.4	22%	0.215	55%	0.552	C	S	.	*	S	Bend		-125.5	138.8	121	0	0	0	0	0	107.7	M2429 S2430 V2466	M2429-A2464 CarbonylContact C-O 3.2Å; M2429-A2464 VanDerWaalsContact CB-O 3.24Å; M2429-A2464 WeakPolarHBondContact CB-O 3.38Å; S2430-A2464 VanDerWaalsContact CB-CB 3.45Å; S2430-A2464 PolarHBondContact O-N 2.96Å; A2464-V2466 CarbonylContact C-O 3.51Å; A2464-V2466 CarbonylContact O-C 3.5Å
2465	G	28.1	Very low	25.3	Very low	65 Å²	65	92.3 Å²	92.3	67%	0.67	57%	0.57	S	S	*	*	S	Bend	cis	162.3	-30.2	14.4	0	0	0	0	0	112.8	N2462	N2462-G2465 PolarHBondContact ND2-N 2.94Å
2466	V	33.7	Very low	25.6	Very low	60 Å²	60	91.7 Å²	91.7	36%	0.364	57%	0.566	S	S	.	*			cis	70.5	171	2.7	-140.6	0	0	0	0	114.4	M2429 N2462 A2464 T2468	M2429-V2466 HydrophobicContact CB-CB 4.26Å; M2429-V2466 HydrophobicContact CB-CG1 4.2Å; M2429-V2466 HydrophobicContact CE-CG1 4Å; M2429-V2466 HydrophobicContact CG-CB 4.43Å; M2429-V2466 HydrophobicContact CG-CG1 3.95Å; M2429-V2466 HydrophobicContact SD-CB 3.77Å; M2429-V2466 HydrophobicContact SD-CG1 3.42Å; M2429-V2466 WeakPolarHBondContact SD-CG1 3.43Å; M2429-V2466 HydrophobicContact SD-CG2 4.19Å; N2462-V2466 PolarHBondContact ND2-O 2.65Å; A2464-V2466 CarbonylContact C-O 3.51Å; A2464-V2466 CarbonylContact O-C 3.5Å; V2466-T2468 VanDerWaalsContact C-N 3.26Å; V2466-T2468 WeakPolarHBondContact CA-OG1 3.35Å
2467	T	27.1	Very low	25.8	Very low	40 Å²	40	97.1 Å²	97.1	25%	0.245	58%	0.583	C	S	.	*				-79.1	89.1	-52.4	-34.3	0	0	0	0	105.8	D2428 M2429 T2469	D2428-T2467 PolarHBondContact OD1-N 3.49Å; M2429-T2467 WeakPolarHBondContact CA-OG1 3.5Å; M2429-T2467 WeakPolarHBondContact CB-OG1 3.38Å; M2429-T2467 VanDerWaalsContact CG-OG1 3.31Å; M2429-T2467 WeakPolarHBondContact CG-OG1 3.17Å; M2429-T2467 PolarHBondContact N-OG1 3.44Å; T2467-T2469 PolarHBondContact O-N 3.37Å
2468	T	26.9	Very low	26.5	Very low	77 Å²	77	93.6 Å²	93.6	47%	0.472	56%	0.562	S	S	.	*				44.4	80.6	91.4	-57.5	0	0	0	0	110.2	V2466 T2470	V2466-T2468 VanDerWaalsContact C-N 3.26Å; V2466-T2468 WeakPolarHBondContact CA-OG1 3.35Å; T2468-T2470 PolarHBondContact O-OG1 3.05Å
2469	T	24.4	Very low	26.5	Very low	111 Å²	111	96.2 Å²	96.2	68%	0.681	58%	0.58	S	S	*	*				61.4	-162.8	117.5	-53.5	0	0	0	0	112.6	R2426 T2467	R2426-T2469 PolarHBondContact NH2-O 3.23Å; T2467-T2469 PolarHBondContact O-N 3.37Å
2470	T	22.6	Very low	26.3	Very low	78 Å²	78	95.7 Å²	95.7	48%	0.479	58%	0.58	S	S	.	*			trans	63.2	115.5	179.2	5.7	0	0	0	0	111.3	R2426 T2468	R2426-T2470 PolarHBondContact NH2-O 3.4Å; T2468-T2470 PolarHBondContact O-OG1 3.05Å
2471	T	21.3	Very low	26.1	Very low	121 Å²	121	92.8 Å²	92.8	74%	0.742	57%	0.566	S	S	*	*			cis	47.2	138.3	48.8	86.8	0	0	0	0	111.3
2472	A	22.5	Very low	26.4	Very low	75 Å²	75	93.3 Å²	93.3	62%	0.62	56%	0.564	S	S	*	*			trans	50.1	78.4	-174.7	0	0	0	0	0	114.6	F2474	A2472-F2474 HydrophobicContact CB-CD2 3.93Å; A2472-F2474 HydrophobicContact CB-CE2 3.89Å; A2472-F2474 WeakPolarHBondContact O-CD2 3.49Å
2473	A	21.8	Very low	25.8	Very low	100 Å²	100	95.3 Å²	95.3	83%	0.826	58%	0.578	S	S	*	*				-91.7	112.6	119.5	0	0	0	0	0	104.4
2474	F	20.3	Very low	25.7	Very low	144 Å²	144	100.2 Å²	100.2	63%	0.632	59%	0.589	S	S	*	*				51.4	90.8	68.2	-70.8	-103.7	0	0	0	109.9	A2472	A2472-F2474 HydrophobicContact CB-CD2 3.93Å; A2472-F2474 HydrophobicContact CB-CE2 3.89Å; A2472-F2474 WeakPolarHBondContact O-CD2 3.49Å
2475	N	25.4	Very low	25.5	Very low	134 Å²	134	102.7 Å²	102.7	72%	0.717	61%	0.61	S	S	*	*				73.7	-149.6	92.4	-68.7	-37.5	0	0	0	108.6	Y2477	N2475-Y2477 PolarHBondContact O-N 2.7Å
2476	V	23.2	Very low	25.4	Very low	97 Å²	97	107 Å²	107	59%	0.588	62%	0.616	S	S	*	*			trans	50.5	67.5	138.4	166.9	0	0	0	0	112.9
2477	Y	27.1	Very low	25.1	Very low	191 Å²	191	107.9 Å²	107.9	75%	0.749	63%	0.629	S	S	*	*	S	Bend	cis	-154.6	162.9	20.8	-88.8	-93.7	0	0	0	110.6	N2475	N2475-Y2477 PolarHBondContact O-N 2.7Å
2478	P	35	Very low	24.8	Very low	63 Å²	63	109.4 Å²	109.4	41%	0.409	65%	0.646	S	S	.	*			cis	-149.6	-172	-43	37.6	-18.5	0	0	0	114.2	E2480	P2478-E2480 HydrophobicContact CG-CB 3.57Å; P2478-E2480 HydrophobicContact CG-CG 3.66Å; P2478-E2480 PolarHBondContact O-N 2.89Å
2479	P	23.1	Very low	24.6	Very low	134 Å²	134	113.1 Å²	113.1	87%	0.87	66%	0.657	S	S	*	*			trans	-57.4	79.2	136.9	31.4	-38.4	0	0	0	111.7
2480	E	22	Very low	25	Very low	154 Å²	154	115.2 Å²	115.2	72%	0.72	66%	0.664	S	S	*	*			trans	-128.1	120.7	157.7	-83.5	-173.1	-131.9	0	0	110.4	P2478	P2478-E2480 HydrophobicContact CG-CB 3.57Å; P2478-E2480 HydrophobicContact CG-CG 3.66Å; P2478-E2480 PolarHBondContact O-N 2.89Å
2481	A	22.1	Very low	24.9	Very low	40 Å²	40	116.7 Å²	116.7	33%	0.331	67%	0.667	S	S	.	*	S	Bend	cis	-154.4	152.1	-7.2	0	0	0	0	0	109.8	R2398	R2398-A2481 PolarHBondContact NH1-O 3.06Å; R2398-A2481 PolarHBondContact NH2-O 3.1Å
2482	I	25.6	Very low	24.9	Very low	123 Å²	123	118.6 Å²	118.6	63%	0.631	67%	0.668	S	S	*	*			trans	58.3	77.8	153.8	-63.7	160.1	0	0	0	109.8	R2398	R2398-I2482 PolarHBondContact NH2-O 3.17Å
2483	T	28.2	Very low	24.9	Very low	99 Å²	99	120.3 Å²	120.3	61%	0.607	67%	0.671	S	S	*	*				52.7	119	94.8	64.9	0	0	0	0	111.6
2484	E	30	Very low	24.8	Very low	173 Å²	173	124.8 Å²	124.8	81%	0.808	67%	0.668	S	S	*	*				179.8	130.3	123.4	-96	151.2	-141.7	0	0	107.5
2485	A	26	Very low	24.9	Very low	78 Å²	78	122.9 Å²	122.9	65%	0.645	66%	0.663	S	S	*	*			cis	-155.3	148.2	2.8	0	0	0	0	0	107.9
2486	I	25.8	Very low	24.6	Very low	155 Å²	155	126.3 Å²	126.3	80%	0.795	67%	0.666	S	S	*	*				35.9	102.5	80.8	-44.2	166.4	0	0	0	109.3
2487	A	26.6	Very low	24.4	Very low	78 Å²	78	129 Å²	129	65%	0.645	68%	0.676	S	S	*	*			cis	-152.8	155.7	36.3	0	0	0	0	0	109.4
2488	A	21.3	Very low	24	Very low	72 Å²	72	123 Å²	123	60%	0.595	67%	0.673	S	S	*	*			cis	62.3	121.3	37.9	0	0	0	0	0	113.1
2489	H	21.8	Very low	23.3	Very low	155 Å²	155	128.2 Å²	128.2	72%	0.718	69%	0.689	S	S	*	*			trans	65.1	159.3	-177	-44	-80.2	0	0	0	113.4	I2491	H2489-I2491 WeakPolarHBondContact ND1-CD1 3.38Å
2490	L	32.6	Very low	23.2	Very low	155 Å²	155	128.5 Å²	128.5	81%	0.812	68%	0.679	S	S	*	*			cis	-108.9	143	2.5	-65.7	149.9	0	0	0	109.8
2491	I	21.8	Very low	23	Very low	109 Å²	109	126.4 Å²	126.4	56%	0.559	68%	0.68	S	S	*	*				63.2	117.5	57.5	-76.6	178.1	0	0	0	111.9	H2489	H2489-I2491 WeakPolarHBondContact ND1-CD1 3.38Å
2492	E	21.4	Very low	22.9	Very low	161 Å²	161	136.1 Å²	136.1	75%	0.752	71%	0.708	S	S	*	*			trans	62.6	103	150.7	-69	-179.2	139.9	0	0	121.8
2493	T	22.3	Very low	22.8	Very low	112 Å²	112	135.5 Å²	135.5	69%	0.687	71%	0.709	S	S	*	*				79.9	149.1	116.8	67.4	0	0	0	0	122.4
2494	Y	20	Very low	22.6	Very low	194 Å²	194	136.4 Å²	136.4	76%	0.761	72%	0.715	S	S	*	*			trans	83.4	111.8	131	-93	-142.3	0	0	0	121.2
2495	I	20.8	Very low	22.3	Very low	104 Å²	104	133.8 Å²	133.8	53%	0.533	71%	0.711	S	S	.	*				71.7	100.4	118.8	-68.4	-167.2	0	0	0	117.6
2496	R	19.3	Very low	22.2	Very low	206 Å²	206	136.5 Å²	136.5	78%	0.777	71%	0.713	S	S	*	*			trans	71.5	159.3	131.8	-67.3	-177.9	-175.4	157.9	-4.3	119.3
2497	L	20.1	Very low	22	Very low	153 Å²	153	140.1 Å²	140.1	80%	0.801	72%	0.717	S	S	*	*			trans	50.8	98.1	152.2	-65.2	155	0	0	0	114.8
2498	G	19.3	Very low	21.8	Very low	65 Å²	65	145 Å²	145	67%	0.67	72%	0.724	S	S	*	*			cis	89.9	149.4	29.1	0	0	0	0	0	111.7
2499	K	19.9	Very low	21.8	Very low	172 Å²	172	148.4 Å²	148.4	75%	0.748	73%	0.73	S	S	*	*			trans	75.8	162.8	-175.7	-46	173.5	77.5	-140.8	0	115.4
2500	E	19.7	Very low	22.2	Very low	141 Å²	141	148.3 Å²	148.3	66%	0.659	73%	0.733	S	S	*	*			trans	62.9	113.3	160.1	-76.7	138.6	-118.3	0	0	117.6
2501	C	19.2	Very low	21.7	Very low	109 Å²	109	145.6 Å²	145.6	74%	0.736	73%	0.726	S	S	*	*				94.5	141.3	58.9	-80.8	0	0	0	0	112.6
2502	W	19.1	Very low	21.7	Very low	244 Å²	244	148.9 Å²	148.9	92%	0.924	74%	0.737	S	S	*	*			trans	72.1	150.3	171.4	-61	17.9	0	0	0	113.9
2503	V	23.4	Very low	21.7	Very low	110 Å²	110	146 Å²	146	67%	0.667	73%	0.734	S	S	*	*			cis	-157.8	164.8	16.8	86.4	0	0	0	0	113.3
2504	T	23.4	Very low	22	Very low	119 Å²	119	145.3 Å²	145.3	73%	0.73	73%	0.732	S	S	*	*			trans	75.9	137.7	158.6	42.8	0	0	0	0	125.9
2505	V	25.4	Very low	22	Very low	117 Å²	117	142 Å²	142	71%	0.709	73%	0.732	S	S	*	*			trans	87.8	90.5	136.6	169.8	0	0	0	0	122.4
2506	I	23.6	Very low	22.1	Very low	136 Å²	136	142.5 Å²	142.5	70%	0.697	74%	0.743	S	S	*	*				53	122	116.8	-58.6	166.4	0	0	0	121.3
2507	R	21	Very low	22.1	Very low	231 Å²	231	137.8 Å²	137.8	87%	0.872	74%	0.741	S	S	*	*			trans	68	137.1	158.1	-73.9	167.9	178.1	176	-1.7	117
2508	K	22.2	Very low	22	Very low	181 Å²	181	139.6 Å²	139.6	79%	0.787	74%	0.743	S	S	*	*			cis	-139.8	134.7	7	-70.5	-177.3	178.6	172.3	0	112.7
2509	I	22.2	Very low	22.1	Very low	143 Å²	143	141.2 Å²	141.2	73%	0.733	74%	0.744	S	S	*	*			trans	61.8	110.6	130	-58.9	178.4	0	0	0	120.4
2510	I	29.4	Very low	22.2	Very low	152 Å²	152	139.5 Å²	139.5	78%	0.779	74%	0.743	S	S	*	*			trans	90.3	116.8	143.4	-72	171.9	0	0	0	122.4
2511	C	22.3	Very low	22.2	Very low	99 Å²	99	142.8 Å²	142.8	67%	0.669	75%	0.749	S	S	*	*			trans	67.7	112.5	146.3	-72	0	0	0	0	126
2512	F	21.8	Very low	22.3	Very low	177 Å²	177	147.6 Å²	147.6	78%	0.776	75%	0.751	S	S	*	*			trans	61.9	-166.7	141.2	-73.3	-82.7	0	0	0	119.8
2513	S	21.2	Very low	22.3	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	74%	0.741	S	S	*	*				50.8	134.3	-84.8	-165.5	0	0	0	0	117.6
2514	P	28.2	Very low	22.3	Very low	97 Å²	97	144.5 Å²	144.5	63%	0.63	74%	0.737	S	S	*	*			cis	-126.5	-178.7	39.7	18.4	8.1	0	0	0	113.9
2515	V	21.7	Very low	22.2	Very low	126 Å²	126	145.9 Å²	145.9	76%	0.764	74%	0.736	S	S	*	*			cis	82.4	149.8	29.3	-171.9	0	0	0	0	114.7
2516	C	21	Very low	22	Very low	114 Å²	114	146.4 Å²	146.4	77%	0.77	73%	0.734	S	S	*	*			trans	80	136	-172.2	-60	0	0	0	0	115.3
2517	S	19.7	Very low	21.8	Very low	106 Å²	106	147.6 Å²	147.6	74%	0.741	73%	0.734	S	S	*	*			cis	84.8	148.8	17.6	-155.5	0	0	0	0	116.8
2518	F	19.5	Very low	21.7	Very low	192 Å²	192	144.1 Å²	144.1	84%	0.842	73%	0.725	S	S	*	*			trans	74.9	92.3	179.5	-85.9	-98.7	0	0	0	120.8
2519	S	20.3	Very low	21.7	Very low	98 Å²	98	141.9 Å²	141.9	69%	0.685	72%	0.722	S	S	*	*				32.6	125	116	-168.6	0	0	0	0	120.9
2520	L	21.1	Very low	21.6	Very low	137 Å²	137	141.3 Å²	141.3	72%	0.717	72%	0.72	S	S	*	*				177.3	117.2	116.5	-94.9	162.9	0	0	0	116
2521	R	20.1	Very low	21.2	Very low	210 Å²	210	138.7 Å²	138.7	79%	0.792	72%	0.715	S	S	*	*			trans	47.9	130.9	135.4	-77	-179.4	-174.5	168.3	0.8	123.8
2522	R	21.1	Very low	21.3	Very low	209 Å²	209	143.1 Å²	143.1	79%	0.789	72%	0.723	S	S	*	*			trans	93.2	105.5	131	-78.8	178.2	175.7	-168.8	-0.1	121.9
2523	K	20.8	Very low	21.4	Very low	163 Å²	163	144.8 Å²	144.8	71%	0.709	73%	0.726	S	S	*	*				77.5	128.8	115.8	-78.1	-166.3	162	-117.1	0	122.3
2524	H	22	Very low	21.9	Very low	127 Å²	127	143.9 Å²	143.9	59%	0.588	72%	0.724	S	S	*	*			trans	86.7	109	132.6	-82.5	-130.3	0	0	0	121.5
2525	Q	21.7	Very low	22.3	Very low	148 Å²	148	145.4 Å²	145.4	69%	0.692	73%	0.732	S	S	*	*				93.6	128.5	114.7	-85.1	-172.8	-58.4	0	0	123.5
2526	L	21.7	Very low	23.2	Very low	128 Å²	128	145.3 Å²	145.3	67%	0.67	73%	0.732	S	S	*	*			trans	83	117.1	137.3	-62.9	163.3	0	0	0	122
2527	F	19.4	Very low	24.3	Very low	161 Å²	161	147.1 Å²	147.1	71%	0.706	73%	0.733	S	S	*	*				89.3	117.1	127.6	-89.5	-131.2	0	0	0	123.9
2528	F	19.3	Very low	25	Very low	157 Å²	157	149.2 Å²	149.2	69%	0.689	73%	0.731	S	S	*	*				73.8	117.2	126.8	-84.8	-128	0	0	0	123.5
2529	L	20.9	Very low	25.3	Very low	135 Å²	135	146.2 Å²	146.2	71%	0.707	72%	0.724	S	S	*	*			trans	81.1	134.9	132.7	-66.7	-178.7	0	0	0	124.9
2530	N	21.1	Very low	25.7	Very low	130 Å²	130	150.5 Å²	150.5	70%	0.695	73%	0.733	S	S	*	*			trans	91.3	114.4	133.5	-74.4	-5.3	0	0	0	125.4
2531	S	21.3	Very low	25.9	Very low	97 Å²	97	152.1 Å²	152.1	68%	0.678	74%	0.737	S	S	*	*				89	162.6	121.8	-59.8	0	0	0	0	123.7
2532	F	23.7	Very low	26	Very low	192 Å²	192	148.3 Å²	148.3	84%	0.842	73%	0.732	S	S	*	*			trans	91.5	149.2	172	-68.4	-98.1	0	0	0	119.1
2533	Y	23.5	Very low	26.2	Very low	213 Å²	213	147.4 Å²	147.4	84%	0.835	73%	0.734	S	S	*	*			cis	-174.5	163.6	-40.9	-132.9	-85.2	0	0	0	111
2534	A	32.9	Very low	26.3	Very low	81 Å²	81	144 Å²	144	67%	0.669	73%	0.731	S	S	*	*			trans	76.1	162.6	162	0	0	0	0	0	118.6
2535	T	35	Very low	27.4	Very low	130 Å²	130	143.8 Å²	143.8	80%	0.798	74%	0.744	S	S	*	*			cis	-178.4	165.4	-20.5	32.2	0	0	0	0	108.8
2536	V	40.7	Very low	28.6	Very low	124 Å²	124	142 Å²	142	75%	0.752	74%	0.743	S	S	*	*			cis	-178.4	174.6	-26	72.4	0	0	0	0	110.1
2537	L	44.2	Very low	30.2	Very low	151 Å²	151	143.1 Å²	143.1	79%	0.791	75%	0.745	S	S	*	*			trans	83.3	135.2	-175.7	-56.2	170.4	0	0	0	115.3
2538	Q	33.9	Very low	31.7	Very low	151 Å²	151	144.5 Å²	144.5	71%	0.706	75%	0.747	S	S	*	*			cis	-150	151.2	7.1	-125.5	-179.7	-78.7	0	0	113.6
2539	D	26.3	Very low	32.9	Very low	128 Å²	128	144.2 Å²	144.2	68%	0.684	75%	0.752	S	S	*	*			trans	59.6	114.1	153.1	-50.9	-22.4	0	0	0	126.6
2540	E	28.5	Very low	33.8	Very low	189 Å²	189	146.5 Å²	146.5	88%	0.883	76%	0.759	S	S	*	*			trans	49.6	148.7	140	-56.1	-163.3	139	0	0	127.8
2541	Q	26.3	Very low	34.2	Very low	170 Å²	170	144.2 Å²	144.2	79%	0.794	76%	0.759	S	S	*	*			trans	72.1	108.3	171.2	-58.4	-149.9	-99.7	0	0	118.7
2542	D	22.7	Very low	34.3	Very low	131 Å²	131	144.1 Å²	144.1	70%	0.701	76%	0.764	S	S	*	*				78.3	125.1	97.8	-66.5	-43.1	0	0	0	114.1
2543	F	23.6	Very low	34.3	Very low	189 Å²	189	140.2 Å²	140.2	83%	0.829	76%	0.761	S	S	*	*			cis	-120	-153.5	16.2	-133.1	-97.6	0	0	0	111.5	S2545	F2543-S2545 PolarHBondContact O-N 2.7Å
2544	S	24.5	Very low	34.2	Very low	92 Å²	92	136.9 Å²	136.9	64%	0.643	76%	0.757	S	S	*	*	S	Bend	trans	-43.4	118.6	162.6	49.7	0	0	0	0	111.9	T2546	S2544-T2546 PolarHBondContact O-N 2.89Å; S2544-T2546 PolarHBondContact O-OG1 2.79Å
2545	S	45.5	Very low	33.7	Very low	122 Å²	122	138.6 Å²	138.6	85%	0.853	76%	0.759	S	S	*	*			trans	-74.5	107.7	-159.9	55.6	0	0	0	0	114.8	F2543	F2543-S2545 PolarHBondContact O-N 2.7Å
2546	T	46.6	Very low	33	Very low	111 Å²	111	137.6 Å²	137.6	68%	0.681	76%	0.758	S	S	*	*			trans	-147.2	126.7	-178.4	48.7	0	0	0	0	113.3	S2544	S2544-T2546 PolarHBondContact O-N 2.89Å; S2544-T2546 PolarHBondContact O-OG1 2.79Å
2547	E	53.7	Low	32.1	Very low	151 Å²	151	137 Å²	137	71%	0.706	76%	0.759	S	S	*	*			trans	72.5	155.2	153.9	-56	176.8	150.6	0	0	120.8
2548	Y	50.7	Low	30.9	Very low	190 Å²	190	139.3 Å²	139.3	75%	0.745	77%	0.766	S	S	*	*			trans	77.4	150.6	170.6	-49.7	-71.7	0	0	0	119.4
2549	D	45	Very low	30.4	Very low	151 Å²	151	140 Å²	140	81%	0.807	77%	0.772	S	S	*	*			cis	-168.2	-172.3	-30.2	-140.1	-65.8	0	0	0	113.1
2550	E	40.6	Very low	30.2	Very low	183 Å²	183	142.4 Å²	142.4	86%	0.855	78%	0.784	S	S	*	*			trans	94.5	136.8	158.2	-122	-170.2	-149	0	0	126.3
2551	A	28.4	Very low	30.1	Very low	83 Å²	83	136.7 Å²	136.7	69%	0.686	78%	0.776	S	S	*	*			trans	77.1	99	142.5	0	0	0	0	0	127.5
2552	A	25	Very low	30	Very low	95 Å²	95	135.6 Å²	135.6	79%	0.785	78%	0.781	S	S	*	*				63.6	128.2	119.4	0	0	0	0	0	128
2553	S	22.6	Very low	30.2	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	79%	0.791	S	S	*	*			trans	95.6	125.1	135.9	67.6	0	0	0	0	125.3
2554	D	22	Very low	30.2	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	79%	0.788	S	S	*	*			trans	77.4	106.1	138.1	-68	6.5	0	0	0	127.5
2555	T	21.9	Very low	30.2	Very low	116 Å²	116	139 Å²	139	71%	0.712	80%	0.795	S	S	*	*				72.2	95.7	128.7	60.6	0	0	0	0	123.6
2556	S	20.9	Very low	29.2	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	79%	0.79	S	S	*	*				58.1	135.8	121.8	64.1	0	0	0	0	124.2
2557	S	20.6	Very low	28	Very low	111 Å²	111	142.9 Å²	142.9	78%	0.776	80%	0.801	S	S	*	*			trans	85.4	103.3	157	78.3	0	0	0	0	119.6
2558	Q	20.5	Very low	26.5	Very low	201 Å²	201	142.7 Å²	142.7	94%	0.939	80%	0.804	S	S	*	*				-170	167.4	116.6	-104	-175	27.6	0	0	112.3
2559	I	22	Very low	25.2	Very low	164 Å²	164	141.7 Å²	141.7	84%	0.841	81%	0.811	S	S	*	*			trans	-103.3	137.6	-175.5	-61.7	164.1	0	0	0	110.2
2560	L	23.4	Very low	24.1	Very low	179 Å²	179	140.5 Å²	140.5	94%	0.937	81%	0.809	S	S	*	*			trans	-165.7	145.2	154.4	-111.5	164.6	0	0	0	110.6
2561	G	25.2	Very low	23.2	Very low	69 Å²	69	139.8 Å²	139.8	71%	0.711	81%	0.805	S	S	*	*			trans	172.7	22.1	-179.2	0	0	0	0	0	122.9
2562	V	25.1	Very low	22.9	Very low	147 Å²	147	141.8 Å²	141.8	89%	0.891	80%	0.803	S	S	*	*			trans	-144.5	124.8	158.8	-173.4	0	0	0	0	110.7
2563	K	26.3	Very low	22.7	Very low	211 Å²	211	144.4 Å²	144.4	92%	0.917	80%	0.799	S	S	*	*			trans	-161	172.6	159.3	-130.4	179.8	-178.1	-178.2	0	111.6
2564	D	24	Very low	22.8	Very low	144 Å²	144	146 Å²	146	77%	0.77	79%	0.794	S	S	*	*			trans	-143.2	163.6	-166.3	-165.9	5.7	0	0	0	110.9
2565	V	24	Very low	22.8	Very low	128 Å²	128	146.7 Å²	146.7	78%	0.776	79%	0.793	S	S	*	*			trans	70.5	136.1	171.7	-168.6	0	0	0	0	118
2566	S	25.1	Very low	22.8	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	79%	0.786	S	S	*	*			trans	-101.3	152.3	-174.3	-22.9	0	0	0	0	114.2
2567	F	21.4	Very low	22.9	Very low	207 Å²	207	149.3 Å²	149.3	91%	0.908	79%	0.786	S	S	*	*			trans	-162.8	160.2	138	-125	-85.6	0	0	0	111.5
2568	L	22.1	Very low	23.1	Very low	147 Å²	147	148.2 Å²	148.2	77%	0.77	78%	0.783	S	S	*	*			trans	-80.7	147.9	-179.1	-71.2	73.9	0	0	0	112.7
2569	L	22.3	Very low	23.3	Very low	170 Å²	170	145.7 Å²	145.7	89%	0.89	78%	0.775	S	S	*	*				-174.2	179.8	114.4	-97.5	166.2	0	0	0	112.3
2570	V	22.2	Very low	23.4	Very low	126 Å²	126	145 Å²	145	76%	0.764	77%	0.772	S	S	*	*			trans	-104.1	167.8	-161	-149.4	0	0	0	0	113.1
2571	Q	22.7	Very low	23.6	Very low	167 Å²	167	143.5 Å²	143.5	78%	0.78	76%	0.764	S	S	*	*			trans	75.9	157.9	157.3	-73.5	-162.6	-24.6	0	0	118.8
2572	I	21.3	Very low	23.6	Very low	125 Å²	125	146.6 Å²	146.6	64%	0.641	76%	0.763	S	S	*	*			cis	-166.7	155.5	-35.5	-133.7	172.8	0	0	0	109.5
2573	E	22.1	Very low	23.5	Very low	150 Å²	150	146.2 Å²	146.2	70%	0.701	76%	0.761	S	S	*	*			trans	62.8	155.3	157.1	-81.1	-178.7	-147.2	0	0	126.4
2574	Q	23.6	Very low	23.8	Very low	145 Å²	145	147.1 Å²	147.1	68%	0.678	77%	0.774	S	S	*	*			trans	103.8	109.7	133.7	-96.6	174.5	61	0	0	125
2575	Q	22.5	Very low	23.8	Very low	157 Å²	157	147.3 Å²	147.3	73%	0.734	77%	0.774	S	S	*	*				59.5	144.1	121.9	-74.8	-175.5	-1.8	0	0	126.6
2576	D	22.5	Very low	23.8	Very low	106 Å²	106	148.3 Å²	148.3	57%	0.567	77%	0.774	S	S	*	*			trans	90	116.6	132.8	-94.3	-2.1	0	0	0	125.7
2577	K	22.5	Very low	23.7	Very low	173 Å²	173	150.6 Å²	150.6	75%	0.752	78%	0.775	S	S	*	*				75	156	125.1	-72	174.7	-176.7	114	0	124.8
2578	A	25	Very low	23.9	Very low	88 Å²	88	147.2 Å²	147.2	73%	0.727	77%	0.767	S	S	*	*			trans	75.6	140.3	164.3	0	0	0	0	0	118.6
2579	I	23.7	Very low	24	Very low	148 Å²	148	147.3 Å²	147.3	76%	0.759	77%	0.767	S	S	*	*			cis	114	108.1	9.3	-72	171.7	0	0	0	114.1
2580	I	24.4	Very low	24.1	Very low	151 Å²	151	145.7 Å²	145.7	77%	0.774	76%	0.759	S	S	*	*			trans	63.2	142.7	145.5	-66.4	178.6	0	0	0	117
2581	N	26.8	Very low	24.2	Very low	147 Å²	147	147.1 Å²	147.1	79%	0.786	76%	0.759	S	S	*	*			cis	-145.2	172.5	27	-147.9	-9.2	0	0	0	114.9
2582	I	25.7	Very low	24.4	Very low	133 Å²	133	145.6 Å²	145.6	68%	0.682	76%	0.757	S	S	*	*			trans	-97.1	153.3	179.3	-68.6	162	0	0	0	111.7
2583	T	22.5	Very low	24.6	Very low	140 Å²	140	147.3 Å²	147.3	86%	0.859	77%	0.767	S	S	*	*			trans	-146.2	80.8	151.1	-54.2	0	0	0	0	110.6
2584	I	34	Very low	24.8	Very low	230 Å²	230	147.1 Å²	147.1	100%	1.179	77%	0.772	S	S	*	*			trans	50.9	0	176.8	-44.9	-176	0	0	0	113.5

Retrieved 2,584 of 2,584 residues in 7544.9 ms (Link to these results)

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