A0A077ZMS2_TRITR Loading...

dihydropteroate synthase

AlphaFold DB , UniProt , Accession A0A077ZMS2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,660 aa.

						>A0A077ZMS2_TRITR|A0A077ZMS2
MHLSFSSPFREITETVLVDTVDAERPGHHIGRMLSAIDACLDAEYAGKGKHPSRKNGFWRTLMCGFIAGIALPATVAGYHWMKAEPPSTLAYPTSQEWRAEPVTDTETPRPHTEHHVNSIPARPAPTQQEPSSAPAPTAVTEEQHVQAAEARRNLATVLKRNADRGMFTINLSTGHERTLYAFLDPACINCRLLEPALKQLAREFSVVIYPVSVIGGESSTKRTAPLLCEPDSQKRATGWHQLYSADSGMAPTGDAPAAQDGQCLTAARAAIDVNNQAFRQFGFGGTPWVLSDTGWHLPSGILKDATSHHVNPDLIHRTAWGNPLWNALHNLNITGLCLAGSIITALIWPLALPVCLLFTLVTSVIFMLQRWRCPLRMPMTLSLDDPSQDRKVRRSLFSFWPTLFQYEADETFPARGIFYVGYRRINDIGRELWLSMDDLTRHVMFFATTGGGKTETTFAWLLNPLCWGRGFTFVDGKAQNDTTRTIWYLSRRFGREDDIEVINFMNGGKSRSEIIQSGEKSRPQSNTWNPFAFSTEAFTAETMQSMLPQNVQGGEWQSRAIAMNKALVFGTKFWCVREGKTMSLQMLREHMTLEGMAKLYCRGLDDQWPEEAIAPLRNYLQDVPGFDMSLVRTPSAWTEEPRKQHAYLSGQFSETFTTFAETFGDVFAADAGDIDIRDSIHSDRILIVMIPALDTSAHTTSALGRMFVTQQSMLLARDLGYRLEGTDAQTLEVKKYKGSFPYICILDEVGAYYTDRIAVEATQVRSLEFSLIMTAQDQERIEGQTSATNTATLMQNAGTKFAGRIVSDDKTARTVKNAAGEEARARMGSLQRHDGVMGESWVDGNQITIQMESKIDVQDLIRLNAGEFFTVFQGDVVPSASVYIPDSEKSCDSDPVVINRYISVEAPRLERLRRLVPRTVQRRLPTPEHVSSIIGVLTAKPSRKRRKNRTEPYRIIDTFQRQLATAQTSLDLLPQYDTDIESRANELWKKAVHTINNTTREERRVCYITLNRPEEEHSGPEDIPSVKAILNTLLPLEMLLPVPDLTASPPHKKNVAQTPSEAPMNKSLIIFGIVNITSDSFSDGGRYLAPDAAIAQARKLMAEGADVIDLGPASSNPDAAPVSSDTEIARIAPVLDALKADGIPVSLDSYQPATQAYALSRGVAYLNDIRGFPDAAFYPQLAKSSAKLVVMHSVQDGQADRREAPAGDIMDHIAAFFDARIAALTGAGIKRNRLVLDPGMGFFLGAAPETSLSVLARFDELRLRFDLPVLLSVSRKSFLRALTGRGPGDVGAATLAAELAAAAGGADFIRTHEPRPLRDGLAVLAALKETARIRRPDDRIIDLMVRKYFGTDGIRGKANEGAMTAETALRVGMAAGRVFRRGDHRHRVVIGKDTRLSGYMLEPALTAGFTSMGMDVFLFGPLPTTLVSQTDPGAAQPVAPGFRVTPWSRWFRLCASVQIARRIKEGRGQGHGKDYIPWLTVQEVPSSGRSHRIYSHKTGRVHHLLSDLELAVFLSLEWESSVLDIREQFPLLPSDTRQIAIDSGIKHPVIRGVDQVMSTDFLVDCKDGPFEQFAIQVKPAAALQDERTLEKLELERRYWQQKQIPWFIFTDKEINPVVKENIEWLYSVKTEEVSAELLAQLSPLAHILQEKGDENIINV
					

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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	26.7	Very low	26.1	Very low	233 Å²	233	156.5 Å²	156.5	100%	1.148	80%	0.801	S	S	*	*				0	137.5	0	-89.9	179.9	169.5	0	0	108.4
2	H	22.7	Very low	26.2	Very low	179 Å²	179	155.6 Å²	155.6	83%	0.829	80%	0.797	S	S	*	*			trans	57.8	141.6	173.6	-67.7	-74.7	0	0	0	119
3	L	26.1	Very low	26.2	Very low	151 Å²	151	150 Å²	150	79%	0.791	78%	0.775	S	S	*	*			trans	62.9	76.6	177.2	-58.2	-179.6	0	0	0	115.8
4	S	24.2	Very low	26.1	Very low	110 Å²	110	148.9 Å²	148.9	77%	0.769	76%	0.764	S	S	*	*			trans	-55.9	127.2	158.6	47.9	0	0	0	0	112.6
5	F	25.1	Very low	26.1	Very low	201 Å²	201	145.9 Å²	145.9	88%	0.882	76%	0.756	S	S	*	*			trans	-108.5	122.8	160.7	-82	-91	0	0	0	109
6	S	26	Very low	26.1	Very low	98 Å²	98	145.2 Å²	145.2	69%	0.685	76%	0.759	S	S	*	*			trans	-147.3	123.1	-174.6	55.6	0	0	0	0	110.3
7	S	28.1	Very low	26	Very low	110 Å²	110	146.1 Å²	146.1	77%	0.769	76%	0.764	S	S	*	*			trans	67.3	155.8	-169	111.2	0	0	0	0	114.3
8	P	28.3	Very low	26	Very low	101 Å²	101	144.8 Å²	144.8	66%	0.656	76%	0.763	S	S	*	*	S	Bend	cis	-119.7	99.3	6.4	36	-19.2	0	0	0	113.3
9	F	27.8	Very low	25.9	Very low	189 Å²	189	144.6 Å²	144.6	83%	0.829	76%	0.763	S	S	*	*	S	Bend	trans	-145.6	17.6	169	-110	-77.1	0	0	0	113.6
10	R	26.5	Very low	25.8	Very low	195 Å²	195	141.5 Å²	141.5	74%	0.736	75%	0.75	S	S	*	*	S	Bend	trans	-127.6	29.9	-175.7	-157.1	-175.8	174.2	158.4	3.8	112.7
11	E	25.9	Very low	25.9	Very low	154 Å²	154	140.6 Å²	140.6	72%	0.72	75%	0.75	S	S	*	*	S	Bend	trans	-135.7	19.4	-170.4	-150.1	167.3	-144.7	0	0	112.1
12	I	26.8	Very low	25.8	Very low	146 Å²	146	136.9 Å²	136.9	75%	0.749	73%	0.734	S	S	*	*	S	Bend	trans	-128.2	-13.1	-179.7	-65.2	179.9	0	0	0	112
13	T	26.4	Very low	26.1	Very low	83 Å²	83	132.6 Å²	132.6	51%	0.509	73%	0.73	S	S	.	*	S	Bend	trans	-117.3	4.6	-173.7	41.8	0	0	0	0	115.3
14	E	24.7	Very low	26.1	Very low	135 Å²	135	130 Å²	130	63%	0.631	71%	0.714	S	S	*	*	S	Bend	trans	-125.8	25.5	177.8	-69.9	178.7	161.4	0	0	111.7
15	T	25.7	Very low	26.4	Very low	103 Å²	103	131.6 Å²	131.6	63%	0.632	70%	0.703	S	S	*	*	S	Bend	trans	-140.9	32.3	-164.3	-28.5	0	0	0	0	115.3
16	V	26.6	Very low	26.5	Very low	135 Å²	135	128.6 Å²	128.6	82%	0.818	70%	0.704	S	S	*	*	S	Bend	trans	-130.1	1.6	178.1	-170.1	0	0	0	0	113
17	L	24.7	Very low	26.7	Very low	160 Å²	160	127.1 Å²	127.1	84%	0.838	70%	0.704	S	S	*	*	S	Bend	trans	-139.2	132.1	176.9	-81.1	167	0	0	0	110.7
18	V	25.4	Very low	26.8	Very low	123 Å²	123	126 Å²	126	75%	0.745	69%	0.687	S	S	*	*	S	Bend	trans	75.5	103.3	170.3	-167.6	0	0	0	0	117.5
19	D	24.5	Very low	27	Very low	141 Å²	141	129.2 Å²	129.2	75%	0.754	69%	0.692	S	S	*	*			trans	57.7	114.7	138.9	-48.8	-10.3	0	0	0	123.6
20	T	23.8	Very low	27.2	Very low	83 Å²	83	126.8 Å²	126.8	51%	0.509	69%	0.686	S	S	.	*			trans	24.8	149.1	135.8	64.1	0	0	0	0	124.6	V1618	T20-V1618 HydrophobicContact CG2-CG1 4.18Å; T20-V1618 HydrophobicContact CG2-CG2 4.11Å
21	V	27	Very low	27.5	Very low	123 Å²	123	119.7 Å²	119.7	75%	0.745	67%	0.674	S	S	*	*			trans	103	103.9	155.1	-169.5	0	0	0	0	118.6
22	D	25.6	Very low	27.7	Very low	154 Å²	154	119.4 Å²	119.4	82%	0.824	67%	0.666	S	S	*	*			trans	23.4	133.9	147.3	-61.6	-58	0	0	0	124.4
23	A	28.5	Very low	27.9	Very low	90 Å²	90	117.6 Å²	117.6	74%	0.744	66%	0.656	S	S	*	*				155.7	109.6	116.9	0	0	0	0	0	116.2
24	E	26.9	Very low	28.3	Very low	97 Å²	97	118 Å²	118	45%	0.453	66%	0.655	S	S	.	*			trans	45.8	105.2	144.6	-55.7	-137.3	107.2	0	0	124.8	H115	E24-H115 IonicContact OE1-NE2 3.16Å; E24-H115 IonicContact OE2-CE1 2.08Å; E24-H115 PolarHBondContact OE2-CE1 3.01Å; E24-H115 IonicContact OE2-ND1 2.85Å; E24-H115 PolarHBondContact OE2-ND1 3.31Å; E24-H115 IonicContact OE2-NE2 3.05Å; E24-H115 PolarHBondContact OE2-NE2 3.06Å
25	R	29.6	Very low	28.7	Very low	143 Å²	143	114.6 Å²	114.6	54%	0.54	65%	0.646	S	S	.	*				50.7	136.8	117.6	-69.9	178.3	-173.6	138.3	4.2	121	H28	R25-H28 PolarHBondContact NE-CD2 3.23Å; R25-H28 PolarHBondContact NE-NE2 3.15Å; R25-H28 PolarHBondContact NH2-NE2 3.39Å
26	P	28.3	Very low	29	Very low	137 Å²	137	112.1 Å²	112.1	89%	0.89	64%	0.636	S	S	*	*	S	Bend		-146	132.1	57.7	36.7	-16.9	0	0	0	118
27	G	30.3	Very low	29.5	Very low	67 Å²	67	109.8 Å²	109.8	69%	0.691	62%	0.618	S	S	*	*			trans	-170.7	13.1	169.3	0	0	0	0	0	113.9	H29	G27-H29 PolarHBondContact O-N 3.23Å
28	H	29.8	Very low	30	Very low	88 Å²	88	106 Å²	106	41%	0.407	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.4	96.9	-168.2	-83.1	30.2	0	0	0	112.5	R25 R32	R25-H28 PolarHBondContact NE-CD2 3.23Å; R25-H28 PolarHBondContact NE-NE2 3.15Å; R25-H28 PolarHBondContact NH2-NE2 3.39Å; H28-R32 PolarHBondContact CD2-NE 2.98Å
29	H	32	Very low	30.4	Very low	167 Å²	167	103 Å²	103	77%	0.773	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156	-47.4	142.5	-97.4	-60.2	0	0	0	112.6	G27 R32 M33	G27-H29 PolarHBondContact O-N 3.23Å; H29-R32 PolarHBondContact O-N 3.2Å; H29-M33 PolarHBondContact O-N 3.06Å
30	I	32.6	Very low	30.8	Very low	138 Å²	138	101 Å²	101	71%	0.708	58%	0.583	S	S	*	*	H	α-helix	trans	-67.5	-48.8	179.3	-62.9	173.8	0	0	0	110.9	R32 M33 L34	I30-R32 PolarHBondContact O-N 3.38Å; I30-M33 PolarHBondContact O-N 3.34Å; I30-L34 HydrophobicContact CG2-CD1 4.3Å; I30-L34 PolarHBondContact O-N 2.93Å
31	G	31.8	Very low	31.3	Very low	46 Å²	46	102 Å²	102	47%	0.474	58%	0.584	S	S	.	*	H	α-helix	trans	-58.6	-29.6	178.3	0	0	0	0	0	114	S35	G31-S35 VanDerWaalsContact O-CB 3.25Å; G31-S35 WeakPolarHBondContact O-CB 3.44Å; G31-S35 PolarHBondContact O-N 2.81Å; G31-S35 PolarHBondContact O-OG 3.34Å
32	R	31.7	Very low	31.6	Very low	148 Å²	148	101.1 Å²	101.1	56%	0.558	58%	0.575	S	S	*	*	H	α-helix	trans	-79	-19.2	174.7	-91.7	-172.7	170.5	-161	-7.9	114.3	H28 H29 I30 A36	H28-R32 PolarHBondContact CD2-NE 2.98Å; H29-R32 PolarHBondContact O-N 3.2Å; I30-R32 PolarHBondContact O-N 3.38Å; R32-A36 WeakPolarHBondContact O-CB 3.45Å; R32-A36 PolarHBondContact O-N 3Å
33	M	30.1	Very low	31.9	Very low	108 Å²	108	97.5 Å²	97.5	53%	0.532	57%	0.566	S	S	.	*	H	α-helix	trans	-82.9	-38.5	172	-169.2	171.4	178.4	0	0	110.6	H29 I30 A36 I37	H29-M33 PolarHBondContact O-N 3.06Å; I30-M33 PolarHBondContact O-N 3.34Å; M33-A36 PolarHBondContact O-N 3.43Å; M33-I37 WeakPolarHBondContact O-CG1 3.3Å; M33-I37 PolarHBondContact O-N 2.99Å; M33-I37 VanDerWaalsContact O-N 3.08Å
34	L	34.1	Very low	32.2	Very low	92 Å²	92	100.2 Å²	100.2	48%	0.482	56%	0.564	S	S	.	*	H	α-helix	trans	-65.2	-50.2	169.9	-69.1	172	0	0	0	111.1	I30 A36 I37 D38	I30-L34 HydrophobicContact CG2-CD1 4.3Å; I30-L34 PolarHBondContact O-N 2.93Å; L34-A36 PolarHBondContact O-N 3.17Å; L34-A36 VanDerWaalsContact O-N 3.11Å; L34-I37 CarbonylContact O-C 3.6Å; L34-I37 WeakPolarHBondContact O-CA 3.24Å; L34-I37 WeakPolarHBondContact O-CB 3.23Å; L34-I37 PolarHBondContact O-N 2.75Å; L34-D38 PolarHBondContact O-N 2.96Å
35	S	33.3	Very low	32.5	Very low	64 Å²	64	105.2 Å²	105.2	45%	0.448	58%	0.58	S	S	.	*	H	α-helix	trans	-66.1	-15.9	177.2	84.3	0	0	0	0	114	G31 A39	G31-S35 VanDerWaalsContact O-CB 3.25Å; G31-S35 WeakPolarHBondContact O-CB 3.44Å; G31-S35 PolarHBondContact O-N 2.81Å; G31-S35 PolarHBondContact O-OG 3.34Å; S35-A39 WeakPolarHBondContact O-CB 3.45Å; S35-A39 PolarHBondContact O-N 2.88Å
36	A	33.4	Very low	32.5	Very low	50 Å²	50	102.7 Å²	102.7	41%	0.413	59%	0.589	S	S	.	*	H	α-helix	trans	-85.2	-27.6	170.1	0	0	0	0	0	112.3	R32 M33 L34 C40	R32-A36 WeakPolarHBondContact O-CB 3.45Å; R32-A36 PolarHBondContact O-N 3Å; M33-A36 PolarHBondContact O-N 3.43Å; L34-A36 PolarHBondContact O-N 3.17Å; L34-A36 VanDerWaalsContact O-N 3.11Å; A36-C40 WeakPolarHBondContact O-CB 3.41Å; A36-C40 PolarHBondContact O-N 2.92Å; A36-C40 VanDerWaalsContact O-N 3.14Å; A36-C40 PolarHBondContact O-SG 3.4Å
37	I	35.7	Very low	32.5	Very low	87 Å²	87	99.2 Å²	99.2	45%	0.446	58%	0.579	S	S	.	*	H	α-helix	trans	-72.6	-48	169.4	-70.8	163.9	0	0	0	109.1	M33 L34 C40 L41	M33-I37 WeakPolarHBondContact O-CG1 3.3Å; M33-I37 PolarHBondContact O-N 2.99Å; M33-I37 VanDerWaalsContact O-N 3.08Å; L34-I37 CarbonylContact O-C 3.6Å; L34-I37 WeakPolarHBondContact O-CA 3.24Å; L34-I37 WeakPolarHBondContact O-CB 3.23Å; L34-I37 PolarHBondContact O-N 2.75Å; I37-C40 CarbonylContact O-C 3.39Å; I37-C40 WeakPolarHBondContact O-CA 3.27Å; I37-C40 WeakPolarHBondContact O-CB 3.47Å; I37-C40 PolarHBondContact O-N 2.7Å; I37-L41 HydrophobicContact CG2-CD1 3.92Å; I37-L41 VanDerWaalsContact O-CG 3.32Å; I37-L41 WeakPolarHBondContact O-CG 3.27Å; I37-L41 PolarHBondContact O-N 2.85Å
38	D	35.9	Very low	32.3	Very low	81 Å²	81	104.6 Å²	104.6	43%	0.433	58%	0.583	S	S	.	*	H	α-helix	trans	-61.8	-46	175.1	-62.5	-28.4	0	0	0	110.8	L34 C40 L41 D42	L34-D38 PolarHBondContact O-N 2.96Å; D38-C40 PolarHBondContact O-N 3.41Å; D38-C40 VanDerWaalsContact O-N 3.15Å; D38-L41 CarbonylContact O-C 3.6Å; D38-L41 WeakPolarHBondContact O-CA 3.48Å; D38-L41 PolarHBondContact O-N 2.85Å; D38-D42 WeakPolarHBondContact O-CB 3.2Å; D38-D42 PolarHBondContact O-N 3.01Å
39	A	34.3	Very low	32.1	Very low	59 Å²	59	103.3 Å²	103.3	49%	0.488	59%	0.594	S	S	.	*	H	α-helix	trans	-63.3	-21	172.9	0	0	0	0	0	114.1	S35 A43	S35-A39 WeakPolarHBondContact O-CB 3.45Å; S35-A39 PolarHBondContact O-N 2.88Å; A39-A43 WeakPolarHBondContact O-CB 3.24Å
40	C	31.3	Very low	31.9	Very low	100 Å²	100	104.9 Å²	104.9	68%	0.676	60%	0.598	S	S	*	*	H	α-helix	trans	-83.1	-16.3	169.5	-78.9	0	0	0	0	113.7	A36 I37 D38	A36-C40 WeakPolarHBondContact O-CB 3.41Å; A36-C40 PolarHBondContact O-N 2.92Å; A36-C40 VanDerWaalsContact O-N 3.14Å; A36-C40 PolarHBondContact O-SG 3.4Å; I37-C40 CarbonylContact O-C 3.39Å; I37-C40 WeakPolarHBondContact O-CA 3.27Å; I37-C40 WeakPolarHBondContact O-CB 3.47Å; I37-C40 PolarHBondContact O-N 2.7Å; D38-C40 PolarHBondContact O-N 3.41Å; D38-C40 VanDerWaalsContact O-N 3.15Å
41	L	34.9	Very low	31.7	Very low	102 Å²	102	107.8 Å²	107.8	53%	0.534	61%	0.608	S	S	.	*	H	α-helix	trans	-95.3	-47.6	177.2	-67.4	166.4	0	0	0	111.1	I37 D38 A43 E44	I37-L41 HydrophobicContact CG2-CD1 3.92Å; I37-L41 VanDerWaalsContact O-CG 3.32Å; I37-L41 WeakPolarHBondContact O-CG 3.27Å; I37-L41 PolarHBondContact O-N 2.85Å; D38-L41 CarbonylContact O-C 3.6Å; D38-L41 WeakPolarHBondContact O-CA 3.48Å; D38-L41 PolarHBondContact O-N 2.85Å; L41-A43 VanDerWaalsContact C-N 3.27Å; L41-A43 PolarHBondContact O-N 3.17Å; L41-E44 PolarHBondContact O-N 3.14Å; L41-E44 VanDerWaalsContact O-N 3.09Å
42	D	32.8	Very low	31.6	Very low	106 Å²	106	111.1 Å²	111.1	57%	0.567	62%	0.622	S	S	*	*	H	α-helix	trans	-63.6	-31	177.1	-71.4	-32	0	0	0	112.5	D38 E44 Y45 A46	D38-D42 WeakPolarHBondContact O-CB 3.2Å; D38-D42 PolarHBondContact O-N 3.01Å; D42-E44 PolarHBondContact O-N 3.12Å; D42-Y45 PolarHBondContact O-N 3.01Å; D42-A46 PolarHBondContact O-N 3.28Å
43	A	33.7	Very low	31.5	Very low	77 Å²	77	108.8 Å²	108.8	64%	0.636	63%	0.628	S	S	*	*	H	α-helix	trans	-62.3	-19.5	173.8	0	0	0	0	0	113.9	A39 L41	A39-A43 WeakPolarHBondContact O-CB 3.24Å; L41-A43 VanDerWaalsContact C-N 3.27Å; L41-A43 PolarHBondContact O-N 3.17Å
44	E	33.7	Very low	31.7	Very low	148 Å²	148	113.7 Å²	113.7	69%	0.692	64%	0.641	S	S	*	*	H	α-helix	trans	-89.7	-14.5	169.5	-74.6	-160.8	146.6	0	0	113.4	L41 D42 R60	L41-E44 PolarHBondContact O-N 3.14Å; L41-E44 VanDerWaalsContact O-N 3.09Å; D42-E44 PolarHBondContact O-N 3.12Å; E44-R60 IonicContact OE1-NH1 3.4Å; E44-R60 PolarHBondContact OE1-NH1 3.34Å
45	Y	33.1	Very low	31.7	Very low	202 Å²	202	117.9 Å²	117.9	79%	0.792	66%	0.655	S	S	*	*	H	α-helix	trans	-96.3	-20.2	-177	-87.1	-79.1	0	0	0	116	D42 G47	D42-Y45 PolarHBondContact O-N 3.01Å; Y45-G47 PolarHBondContact O-N 3.21Å; Y45-G47 VanDerWaalsContact O-N 3.12Å
46	A	29.9	Very low	31.7	Very low	89 Å²	89	120.8 Å²	120.8	74%	0.736	67%	0.665	S	S	*	*	S	Bend	trans	-67.6	-8.2	177.6	0	0	0	0	0	114.8	D42 K48	D42-A46 PolarHBondContact O-N 3.28Å; A46-K48 PolarHBondContact O-N 3.23Å
47	G	27.3	Very low	31.8	Very low	65 Å²	65	120.3 Å²	120.3	67%	0.67	67%	0.665	S	S	*	*			trans	-85.3	92.4	-172.7	0	0	0	0	0	115.5	Y45 G49	Y45-G47 PolarHBondContact O-N 3.21Å; Y45-G47 VanDerWaalsContact O-N 3.12Å; G47-G49 PolarHBondContact O-N 2.77Å
48	K	27.7	Very low	31.9	Very low	180 Å²	180	123.2 Å²	123.2	78%	0.783	68%	0.675	S	S	*	*			trans	-63.4	92.5	173.6	-78.8	179.3	178.1	169.7	0	113.6	A46	A46-K48 PolarHBondContact O-N 3.23Å
49	G	25.3	Very low	31.8	Very low	61 Å²	61	128.2 Å²	128.2	63%	0.629	69%	0.688	S	S	*	*	S	Bend	trans	98.2	85.1	146.4	0	0	0	0	0	118.4	G47	G47-G49 PolarHBondContact O-N 2.77Å
50	K	28.2	Very low	31.7	Very low	200 Å²	200	133.1 Å²	133.1	87%	0.87	69%	0.694	S	S	*	*			trans	-175.9	138.8	138.2	-97	143.1	-167.9	164.7	0	110.2	P52	K50-P52 VanDerWaalsContact O-CD 3.23Å; K50-P52 WeakPolarHBondContact O-CD 3.1Å
51	H	28.2	Very low	32.3	Very low	198 Å²	198	133.3 Å²	133.3	92%	0.917	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-61	121.5	170.8	-91.1	-66.2	0	0	0	111.7
52	P	29.4	Very low	32.5	Very low	117 Å²	117	132.8 Å²	132.8	76%	0.76	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-75	146.7	162.3	-10.5	29.1	0	0	0	110	K50	K50-P52 VanDerWaalsContact O-CD 3.23Å; K50-P52 WeakPolarHBondContact O-CD 3.1Å
53	S	30	Very low	32.7	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-77.2	138.5	-175.8	72.1	0	0	0	0	113.1	K55	S53-K55 PolarHBondContact O-N 3.46Å
54	R	32.9	Very low	32.9	Very low	211 Å²	211	133.8 Å²	133.8	80%	0.796	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	12.2	-173	-89.5	-176.4	168.9	-175.3	-4.4	117.8
55	K	34	Very low	33.3	Very low	180 Å²	180	128.8 Å²	128.8	78%	0.783	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-21.1	-174.4	-75.6	-165.3	170.7	-170.3	0	116.4	S53	S53-K55 PolarHBondContact O-N 3.46Å
56	N	34.8	Very low	33.5	Very low	125 Å²	125	125.9 Å²	125.9	67%	0.668	67%	0.667	S	S	*	*	S	Bend	trans	-102.1	-8.5	-172.8	-67.2	14.1	0	0	0	114.6
57	G	35.1	Very low	34	Very low	40 Å²	40	127.1 Å²	127.1	41%	0.412	66%	0.66	S	S	.	*	H	α-helix	trans	-66.3	-43.3	-178.4	0	0	0	0	0	113.7	W59 R60 T61	G57-W59 PolarHBondContact O-N 3.41Å; G57-R60 PolarHBondContact O-N 3.09Å; G57-T61 PolarHBondContact O-N 3.06Å; G57-T61 PolarHBondContact O-OG1 3.22Å
58	F	37.1	Very low	34.6	Very low	148 Å²	148	126.2 Å²	126.2	65%	0.649	65%	0.646	S	S	*	*	H	α-helix	trans	-53.4	-49.2	-173.4	-175.9	-101	0	0	0	113.3	L62	F58-L62 HydrophobicContact CE1-CD1 4.15Å; F58-L62 HydrophobicContact CZ-CD1 4.13Å; F58-L62 WeakPolarHBondContact O-CB 3.34Å; F58-L62 PolarHBondContact O-N 3.38Å
59	W	33.8	Very low	35.1	Very low	186 Å²	186	119.1 Å²	119.1	71%	0.705	62%	0.624	S	S	*	*	H	α-helix	trans	-69.4	-31	178.3	-77.4	102.8	0	0	0	113.6	G57 M63	G57-W59 PolarHBondContact O-N 3.41Å; W59-M63 WeakPolarHBondContact O-CB 3.32Å; W59-M63 PolarHBondContact O-N 3.36Å
60	R	33.6	Very low	36	Very low	163 Å²	163	122.3 Å²	122.3	62%	0.615	63%	0.625	S	S	*	*	H	α-helix	trans	-70.1	-48.7	174.3	-83.1	-173.6	167.3	-166.5	-4.7	111.5	E44 G57 L62 M63 C64	E44-R60 IonicContact OE1-NH1 3.4Å; E44-R60 PolarHBondContact OE1-NH1 3.34Å; G57-R60 PolarHBondContact O-N 3.09Å; R60-L62 PolarHBondContact O-N 3.39Å; R60-M63 PolarHBondContact O-N 3.45Å; R60-C64 WeakPolarHBondContact O-CB 3.26Å; R60-C64 PolarHBondContact O-N 2.89Å; R60-C64 PolarHBondContact O-SG 2.72Å; R60-C64 VanDerWaalsContact O-SG 3.36Å
61	T	42.8	Very low	36.5	Very low	104 Å²	104	115.5 Å²	115.5	64%	0.638	61%	0.607	S	S	*	*	H	α-helix	trans	-58.5	-38.9	176.1	-51	0	0	0	0	111.4	G57 G65	G57-T61 PolarHBondContact O-N 3.06Å; G57-T61 PolarHBondContact O-OG1 3.22Å; T61-G65 PolarHBondContact O-N 3.32Å
62	L	39	Very low	36.9	Very low	90 Å²	90	108.6 Å²	108.6	47%	0.471	58%	0.576	S	S	.	*	H	α-helix	trans	-70.9	-38	178.9	-152.5	144.2	0	0	0	112.2	F58 R60 F66	F58-L62 HydrophobicContact CE1-CD1 4.15Å; F58-L62 HydrophobicContact CZ-CD1 4.13Å; F58-L62 WeakPolarHBondContact O-CB 3.34Å; F58-L62 PolarHBondContact O-N 3.38Å; R60-L62 PolarHBondContact O-N 3.39Å; L62-F66 WeakPolarHBondContact O-CB 3.44Å; L62-F66 PolarHBondContact O-N 2.82Å
63	M	36.9	Very low	37.3	Very low	120 Å²	120	107.6 Å²	107.6	59%	0.591	57%	0.57	S	S	*	*	H	α-helix	trans	-66.3	-46.9	171.1	-91.4	-69.1	-177.9	0	0	113	W59 R60 G65 F66 I67	W59-M63 WeakPolarHBondContact O-CB 3.32Å; W59-M63 PolarHBondContact O-N 3.36Å; R60-M63 PolarHBondContact O-N 3.45Å; M63-G65 VanDerWaalsContact C-N 3.31Å; M63-G65 PolarHBondContact O-N 2.96Å; M63-F66 PolarHBondContact O-N 2.71Å; M63-F66 VanDerWaalsContact O-N 3.15Å; M63-I67 WeakPolarHBondContact O-CG1 3.24Å; M63-I67 PolarHBondContact O-N 3.18Å
64	C	38.6	Very low	37.6	Very low	85 Å²	85	106.9 Å²	106.9	57%	0.574	57%	0.569	S	S	*	*	H	α-helix	trans	-62.5	-39.1	177.3	-66.8	0	0	0	0	111.5	R60 I67 A68	R60-C64 WeakPolarHBondContact O-CB 3.26Å; R60-C64 PolarHBondContact O-N 2.89Å; R60-C64 PolarHBondContact O-SG 2.72Å; R60-C64 VanDerWaalsContact O-SG 3.36Å; C64-I67 PolarHBondContact O-N 3.12Å; C64-A68 VanDerWaalsContact O-CB 3.28Å; C64-A68 WeakPolarHBondContact O-CB 3.46Å; C64-A68 PolarHBondContact O-N 2.77Å
65	G	41	Very low	37.9	Very low	42 Å²	42	100.3 Å²	100.3	43%	0.433	55%	0.553	S	S	.	*	H	α-helix	trans	-64	-37.8	172.4	0	0	0	0	0	113.4	T61 M63 G69	T61-G65 PolarHBondContact O-N 3.32Å; M63-G65 VanDerWaalsContact C-N 3.31Å; M63-G65 PolarHBondContact O-N 2.96Å; G65-G69 PolarHBondContact O-N 3.23Å
66	F	37.6	Very low	38.1	Very low	142 Å²	142	93.6 Å²	93.6	62%	0.623	53%	0.527	S	S	*	.	H	α-helix	trans	-68.5	-39.6	176.2	-158.3	-94.4	0	0	0	112.2	L62 M63 I70	L62-F66 WeakPolarHBondContact O-CB 3.44Å; L62-F66 PolarHBondContact O-N 2.82Å; M63-F66 PolarHBondContact O-N 2.71Å; M63-F66 VanDerWaalsContact O-N 3.15Å; F66-I70 HydrophobicContact CD1-CD1 4.04Å; F66-I70 HydrophobicContact CE1-CD1 3.94Å; F66-I70 WeakPolarHBondContact O-CD1 3.42Å; F66-I70 WeakPolarHBondContact O-CG1 3.5Å
67	I	40.5	Very low	38	Very low	115 Å²	115	91 Å²	91	59%	0.59	52%	0.522	S	S	*	.	H	α-helix	trans	-70.7	-43.2	177.3	-67	166	0	0	0	111	M63 C64	M63-I67 WeakPolarHBondContact O-CG1 3.24Å; M63-I67 PolarHBondContact O-N 3.18Å; C64-I67 PolarHBondContact O-N 3.12Å
68	A	39.1	Very low	38	Very low	45 Å²	45	91.2 Å²	91.2	37%	0.372	53%	0.525	S	S	.	.	H	α-helix	trans	-66.1	-41.5	176	0	0	0	0	0	112.4	C64 I70 A71 L72	C64-A68 VanDerWaalsContact O-CB 3.28Å; C64-A68 WeakPolarHBondContact O-CB 3.46Å; C64-A68 PolarHBondContact O-N 2.77Å; A68-I70 PolarHBondContact O-N 2.94Å; A68-I70 VanDerWaalsContact O-N 3.09Å; A68-A71 PolarHBondContact O-N 3.19Å; A68-L72 WeakPolarHBondContact O-CD1 3.49Å; A68-L72 PolarHBondContact O-N 2.82Å
69	G	39.3	Very low	37.9	Very low	31 Å²	31	91.2 Å²	91.2	32%	0.32	52%	0.522	S	S	.	.	H	α-helix	trans	-61.3	-18	-179.1	0	0	0	0	0	115	G65	G65-G69 PolarHBondContact O-N 3.23Å
70	I	43.4	Very low	38.1	Very low	128 Å²	128	86.1 Å²	86.1	66%	0.656	51%	0.506	S	S	*	.	H	α-helix	trans	-91.6	-20.9	177.5	-66.1	168.7	0	0	0	112	F66 A68	F66-I70 HydrophobicContact CD1-CD1 4.04Å; F66-I70 HydrophobicContact CE1-CD1 3.94Å; F66-I70 WeakPolarHBondContact O-CD1 3.42Å; F66-I70 WeakPolarHBondContact O-CG1 3.5Å; A68-I70 PolarHBondContact O-N 2.94Å; A68-I70 VanDerWaalsContact O-N 3.09Å
71	A	38.5	Very low	38	Very low	58 Å²	58	88.2 Å²	88.2	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-99.8	-15.9	-174.2	0	0	0	0	0	115	A68	A68-A71 PolarHBondContact O-N 3.19Å
72	L	37.8	Very low	37.4	Very low	53 Å²	53	91.6 Å²	91.6	28%	0.277	52%	0.524	S	S	.	.	H	α-helix	trans	-75.4	-27.5	-166.4	-113.9	69.2	0	0	0	119.3	A68 A74 T75 V76 M368	A68-L72 WeakPolarHBondContact O-CD1 3.49Å; A68-L72 PolarHBondContact O-N 2.82Å; L72-A74 PolarHBondContact O-N 2.99Å; L72-T75 PolarHBondContact O-N 2.82Å; L72-T75 PolarHBondContact O-OG1 2.75Å; L72-V76 HydrophobicContact CB-CG2 4.26Å; L72-V76 HydrophobicContact CD2-CG2 4.14Å; L72-V76 HydrophobicContact CG-CG2 4.06Å; L72-V76 WeakPolarHBondContact O-CB 3.49Å; L72-V76 VanDerWaalsContact O-CG2 3.31Å; L72-V76 WeakPolarHBondContact O-CG2 3.42Å; L72-V76 PolarHBondContact O-N 2.65Å; L72-V76 VanDerWaalsContact O-N 3.09Å; L72-M368 HydrophobicContact CD2-CE 3.77Å
73	P	38.4	Very low	37.2	Very low	96 Å²	96	94.3 Å²	94.3	62%	0.623	53%	0.532	S	S	*	.	H	α-helix	trans	-58.2	-26.2	-169	-30	36.4	0	0	0	116.4
74	A	36.1	Very low	36.8	Very low	82 Å²	82	91.8 Å²	91.8	68%	0.678	53%	0.53	S	S	*	.	H	α-helix	trans	-90.5	-37.7	179.5	0	0	0	0	0	113.5	L72 A77	L72-A74 PolarHBondContact O-N 2.99Å; A74-A77 PolarHBondContact O-N 2.92Å
75	T	37.9	Very low	36.2	Very low	73 Å²	73	95.7 Å²	95.7	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-71.9	-31.6	178.2	38.4	0	0	0	0	112.2	L72 A77 G78 Y79	L72-T75 PolarHBondContact O-N 2.82Å; L72-T75 PolarHBondContact O-OG1 2.75Å; T75-A77 VanDerWaalsContact C-N 3.28Å; T75-A77 PolarHBondContact O-N 3.4Å; T75-G78 PolarHBondContact O-N 3.3Å; T75-Y79 WeakPolarHBondContact O-CB 3.47Å; T75-Y79 PolarHBondContact O-N 3.04Å
76	V	38.5	Very low	35.5	Very low	40 Å²	40	97.9 Å²	97.9	24%	0.242	55%	0.547	C	S	.	.	H	α-helix	trans	-58.7	-37.3	174	166.4	0	0	0	0	111.9	L72 Y79 H80	L72-V76 HydrophobicContact CB-CG2 4.26Å; L72-V76 HydrophobicContact CD2-CG2 4.14Å; L72-V76 HydrophobicContact CG-CG2 4.06Å; L72-V76 WeakPolarHBondContact O-CB 3.49Å; L72-V76 VanDerWaalsContact O-CG2 3.31Å; L72-V76 WeakPolarHBondContact O-CG2 3.42Å; L72-V76 PolarHBondContact O-N 2.65Å; L72-V76 VanDerWaalsContact O-N 3.09Å; V76-Y79 PolarHBondContact O-N 3.31Å; V76-H80 WeakPolarHBondContact O-CB 3.43Å; V76-H80 PolarHBondContact O-CD2 3.5Å; V76-H80 PolarHBondContact O-N 3.32Å
77	A	33.4	Very low	35	Very low	69 Å²	69	97.1 Å²	97.1	57%	0.57	56%	0.556	S	S	*	*	H	α-helix	trans	-65	-40.7	177.2	0	0	0	0	0	113	A74 T75	A74-A77 PolarHBondContact O-N 2.92Å; T75-A77 VanDerWaalsContact C-N 3.28Å; T75-A77 PolarHBondContact O-N 3.4Å
78	G	35.1	Very low	34.3	Very low	46 Å²	46	95.1 Å²	95.1	47%	0.474	55%	0.552	S	S	.	*	H	α-helix	trans	-70.6	-41.3	174.9	0	0	0	0	0	112.8	T75 H80 W81	T75-G78 PolarHBondContact O-N 3.3Å; G78-H80 PolarHBondContact O-N 3.12Å; G78-W81 PolarHBondContact O-N 3.04Å
79	Y	34.8	Very low	33.6	Very low	147 Å²	147	99.6 Å²	99.6	58%	0.576	58%	0.575	S	S	*	*	H	α-helix	trans	-67.5	-25.8	178.4	-156.5	-95.6	0	0	0	112.6	T75 V76 K83	T75-Y79 WeakPolarHBondContact O-CB 3.47Å; T75-Y79 PolarHBondContact O-N 3.04Å; V76-Y79 PolarHBondContact O-N 3.31Å; Y79-K83 HydrophobicContact CE1-CD 3.93Å; Y79-K83 PolarHBondContact OH-NZ 3.44Å
80	H	37.3	Very low	32.9	Very low	79 Å²	79	106.3 Å²	106.3	37%	0.366	60%	0.603	S	S	.	*	H	α-helix	trans	-70.6	-24.7	170.4	-90.7	-61.7	0	0	0	113.9	V76 G78 A84	V76-H80 WeakPolarHBondContact O-CB 3.43Å; V76-H80 PolarHBondContact O-CD2 3.5Å; V76-H80 PolarHBondContact O-N 3.32Å; G78-H80 PolarHBondContact O-N 3.12Å; H80-A84 WeakPolarHBondContact O-CB 3.48Å
81	W	31.7	Very low	32.1	Very low	208 Å²	208	104.4 Å²	104.4	79%	0.788	61%	0.606	S	S	*	*	H	α-helix	trans	-77.6	-42.2	179.5	-155.3	37.3	0	0	0	111.7	G78 K83 A84	G78-W81 PolarHBondContact O-N 3.04Å; W81-K83 PolarHBondContact O-N 2.93Å; W81-K83 VanDerWaalsContact O-N 3.11Å; W81-A84 PolarHBondContact O-N 2.92Å
82	M	31.6	Very low	31.4	Very low	174 Å²	174	112.5 Å²	112.5	86%	0.857	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-3.6	177	-76.2	-175	71.8	0	0	115.7
83	K	33.6	Very low	30.8	Very low	147 Å²	147	115.7 Å²	115.7	64%	0.639	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.1	13.5	179.3	-84.2	-177.4	171.2	170.6	0	113.9	Y79 W81	Y79-K83 HydrophobicContact CE1-CD 3.93Å; Y79-K83 PolarHBondContact OH-NZ 3.44Å; W81-K83 PolarHBondContact O-N 2.93Å; W81-K83 VanDerWaalsContact O-N 3.11Å
84	A	28.8	Very low	30.2	Very low	67 Å²	67	117.3 Å²	117.3	55%	0.554	66%	0.658	S	S	*	*			trans	-126.5	8.2	-171.5	0	0	0	0	0	116.1	H80 W81 P86	H80-A84 WeakPolarHBondContact O-CB 3.48Å; W81-A84 PolarHBondContact O-N 2.92Å; A84-P86 VanDerWaalsContact O-CD 3.27Å; A84-P86 WeakPolarHBondContact O-CD 3.24Å
85	E	26	Very low	29.7	Very low	167 Å²	167	118.2 Å²	118.2	78%	0.78	66%	0.66	S	S	*	*			trans	-84.6	115.7	166	-70	-161.3	149.2	0	0	110.6
86	P	25.5	Very low	29.2	Very low	89 Å²	89	122.1 Å²	122.1	58%	0.578	67%	0.673	S	S	*	*			trans	-78.7	139.4	168	31.9	-32.2	0	0	0	110	A84 S88	A84-P86 VanDerWaalsContact O-CD 3.27Å; A84-P86 WeakPolarHBondContact O-CD 3.24Å; P86-S88 PolarHBondContact O-N 2.86Å
87	P	28	Very low	28.6	Very low	125 Å²	125	127 Å²	127	81%	0.812	69%	0.693	S	S	*	*			trans	-74.6	65.7	168.7	32	-34.9	0	0	0	110.5
88	S	25.4	Very low	28.2	Very low	73 Å²	73	134.1 Å²	134.1	51%	0.51	71%	0.705	S	S	.	*			trans	-111.1	141.4	173.6	56.9	0	0	0	0	110.4	P86	P86-S88 PolarHBondContact O-N 2.86Å
89	T	25	Very low	27.7	Very low	139 Å²	139	142.3 Å²	142.3	85%	0.853	72%	0.722	S	S	*	*			trans	63.6	63.6	177.6	55.4	0	0	0	0	117
90	L	24.5	Very low	27.3	Very low	172 Å²	172	139.7 Å²	139.7	90%	0.901	73%	0.73	S	S	*	*			trans	-120.7	95.8	134.1	-98.5	174.7	0	0	0	108.4
91	A	25.3	Very low	26.8	Very low	88 Å²	88	145.2 Å²	145.2	73%	0.727	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-78	126.6	174.3	0	0	0	0	0	109.1	P93	A91-P93 VanDerWaalsContact O-CD 3.22Å; A91-P93 WeakPolarHBondContact O-CD 3.2Å
92	Y	23.9	Very low	26.8	Very low	229 Å²	229	140.8 Å²	140.8	90%	0.898	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-69.3	117.1	170.6	-78.2	-90.4	0	0	0	110
93	P	25.7	Very low	26.6	Very low	120 Å²	120	139.4 Å²	139.4	78%	0.779	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-75.4	133	164.1	-3.3	23	0	0	0	108.1	A91	A91-P93 VanDerWaalsContact O-CD 3.22Å; A91-P93 WeakPolarHBondContact O-CD 3.2Å
94	T	25.8	Very low	26.3	Very low	129 Å²	129	137.9 Å²	137.9	79%	0.791	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-69.7	138.8	172.2	43	0	0	0	0	111.6
95	S	26.3	Very low	26.2	Very low	102 Å²	102	141.8 Å²	141.8	71%	0.713	77%	0.77	S	S	*	*			trans	77.3	153	152.8	74.4	0	0	0	0	121.1
96	Q	26.3	Very low	26.2	Very low	154 Å²	154	139.7 Å²	139.7	72%	0.72	77%	0.769	S	S	*	*			trans	84.8	119.2	162	-64.8	-177.5	-100.3	0	0	121.2
97	E	27.6	Very low	26.2	Very low	142 Å²	142	144.2 Å²	144.2	66%	0.664	78%	0.783	S	S	*	*			trans	77.5	113.1	142.4	-73	149.2	-128.9	0	0	120
98	W	23.8	Very low	26.2	Very low	219 Å²	219	144.6 Å²	144.6	83%	0.83	78%	0.783	S	S	*	*				67	125.8	75.2	-75.5	110.3	0	0	0	110.8
99	R	24.9	Very low	26.5	Very low	219 Å²	219	146.1 Å²	146.1	83%	0.826	79%	0.791	S	S	*	*			cis	-146.1	172.8	22	-98.4	165.8	-166.2	148	8.1	112.5
100	A	27.3	Very low	26.6	Very low	91 Å²	91	151 Å²	151	75%	0.752	79%	0.794	S	S	*	*			trans	-93.5	166.8	170	0	0	0	0	0	112.9
101	E	25.5	Very low	27	Very low	195 Å²	195	147.6 Å²	147.6	91%	0.911	78%	0.782	S	S	*	*			trans	-156.4	149.4	138.2	-116.1	170.2	-149.1	0	0	110.4
102	P	32.5	Very low	27.2	Very low	116 Å²	116	151.8 Å²	151.8	75%	0.753	79%	0.786	S	S	*	*			trans	-105.7	159.7	-171.3	39.5	-32.9	0	0	0	114
103	V	27.6	Very low	27.5	Very low	145 Å²	145	145.7 Å²	145.7	88%	0.879	77%	0.773	S	S	*	*			trans	-139.3	130.7	161.9	178.9	0	0	0	0	108.6
104	T	26.4	Very low	27.7	Very low	114 Å²	114	148.2 Å²	148.2	70%	0.699	77%	0.774	S	S	*	*			trans	-88.7	155.7	170.6	52.1	0	0	0	0	110.4
105	D	27.4	Very low	28	Very low	149 Å²	149	148 Å²	148	80%	0.797	76%	0.764	S	S	*	*				177.7	159.2	113.1	-86	-3.4	0	0	0	112.6
106	T	25.8	Very low	28.2	Very low	124 Å²	124	151 Å²	151	76%	0.761	77%	0.766	S	S	*	*			trans	-70.7	168.3	173.1	50.9	0	0	0	0	111
107	E	25.6	Very low	28.5	Very low	184 Å²	184	148.5 Å²	148.5	86%	0.86	76%	0.762	S	S	*	*			cis	-151.6	-166.2	36.8	-66.8	-178.8	129.3	0	0	113.2
108	T	27	Very low	28.7	Very low	133 Å²	133	148.8 Å²	148.8	82%	0.816	77%	0.767	S	S	*	*			trans	-105.1	-172.9	-170.4	53	0	0	0	0	113.9
109	P	32	Very low	29	Very low	105 Å²	105	142.6 Å²	142.6	68%	0.682	76%	0.758	S	S	*	*				-139.1	157.9	-56.6	39.2	-22.2	0	0	0	117
110	R	28.1	Very low	29.1	Very low	241 Å²	241	139.9 Å²	139.9	91%	0.909	76%	0.758	S	S	*	*			trans	64.2	172	159.9	-66.5	-176.6	-174.5	-160.6	1.7	118.1
111	P	32.2	Very low	29.3	Very low	101 Å²	101	141 Å²	141	66%	0.656	76%	0.757	S	S	*	*			cis	-135.2	165.6	-23.3	27.6	-5.4	0	0	0	117.9
112	H	30.4	Very low	29.3	Very low	175 Å²	175	135.9 Å²	135.9	81%	0.81	75%	0.748	S	S	*	*			trans	65.6	163.8	154.6	-64.1	-44.3	0	0	0	120.8
113	T	30.4	Very low	29.1	Very low	101 Å²	101	141.6 Å²	141.6	62%	0.62	76%	0.755	S	S	*	*			cis	-162.5	174.4	-12.9	23.7	0	0	0	0	113.5
114	E	28.9	Very low	29.2	Very low	174 Å²	174	140.4 Å²	140.4	81%	0.813	75%	0.75	S	S	*	*			trans	71.5	166.3	150.1	-73.6	151.6	-87.7	0	0	122.4
115	H	31.5	Very low	29.6	Very low	123 Å²	123	139.5 Å²	139.5	57%	0.569	75%	0.754	S	S	*	*			cis	-173.4	179.8	-39.8	-175.9	64.9	0	0	0	111.5	E24	E24-H115 IonicContact OE1-NE2 3.16Å; E24-H115 IonicContact OE2-CE1 2.08Å; E24-H115 PolarHBondContact OE2-CE1 3.01Å; E24-H115 IonicContact OE2-ND1 2.85Å; E24-H115 PolarHBondContact OE2-ND1 3.31Å; E24-H115 IonicContact OE2-NE2 3.05Å; E24-H115 PolarHBondContact OE2-NE2 3.06Å
116	H	31.8	Very low	29.8	Very low	166 Å²	166	138.2 Å²	138.2	77%	0.769	75%	0.754	S	S	*	*			trans	71.6	157.9	171.6	-70.7	-35.6	0	0	0	121.9
117	V	31.2	Very low	29.8	Very low	102 Å²	102	138.4 Å²	138.4	62%	0.618	76%	0.755	S	S	*	*				-178.9	151.4	-51.9	138	0	0	0	0	113.4
118	N	32.1	Very low	29.8	Very low	147 Å²	147	137.7 Å²	137.7	79%	0.786	75%	0.752	S	S	*	*			trans	114.6	156.5	163.5	-70.4	-60.2	0	0	0	119.7
119	S	31.2	Very low	29.8	Very low	89 Å²	89	140.4 Å²	140.4	62%	0.622	76%	0.755	S	S	*	*			cis	-174.6	162	-41.8	58.5	0	0	0	0	115.5
120	I	26.7	Very low	29.9	Very low	163 Å²	163	144 Å²	144	84%	0.836	76%	0.763	S	S	*	*			trans	90.7	148.4	147.6	-79.3	161.6	0	0	0	124.4
121	P	30.7	Very low	30	Very low	114 Å²	114	138.2 Å²	138.2	74%	0.74	76%	0.757	S	S	*	*			trans	-148.5	-173.8	-148.9	45.3	-23.6	0	0	0	121.9
122	A	26.8	Very low	29.9	Very low	87 Å²	87	138.8 Å²	138.8	72%	0.719	76%	0.763	S	S	*	*			trans	101.3	129.8	134.1	0	0	0	0	0	127.3
123	R	26.7	Very low	29.9	Very low	237 Å²	237	135.8 Å²	135.8	89%	0.894	76%	0.762	S	S	*	*			trans	69.2	169.4	135	-85	-175.3	170.8	-179.4	-2.1	122.9
124	P	30.9	Very low	29.9	Very low	119 Å²	119	135.6 Å²	135.6	77%	0.773	77%	0.771	S	S	*	*			cis	-136.9	-177.1	-33.4	38.8	-20.7	0	0	0	115.1
125	A	33.4	Very low	30.1	Very low	96 Å²	96	133.2 Å²	133.2	79%	0.793	77%	0.77	S	S	*	*			trans	-158.8	142.8	172.4	0	0	0	0	0	117.1
126	P	31.6	Very low	30.2	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	78%	0.781	S	S	*	*			trans	-122.8	-167	157.4	35.8	-17.5	0	0	0	111.3
127	T	26.5	Very low	30.1	Very low	129 Å²	129	130 Å²	130	79%	0.791	78%	0.783	S	S	*	*			cis	-147.5	-140.6	12.3	-33.3	0	0	0	0	111.6
128	Q	26.1	Very low	30.3	Very low	169 Å²	169	131.8 Å²	131.8	79%	0.79	79%	0.794	S	S	*	*			trans	-156.7	160.5	-169.8	-61.4	173.6	-33.3	0	0	113.5
129	Q	26	Very low	30.3	Very low	190 Å²	190	129.6 Å²	129.6	89%	0.888	80%	0.797	S	S	*	*				164.5	148.6	123.7	-89.6	175.2	-4.5	0	0	115.5
130	E	34.5	Very low	30.7	Very low	180 Å²	180	129.2 Å²	129.2	84%	0.841	79%	0.79	S	S	*	*			trans	-142	157.9	174.8	-82.1	-166.9	154.5	0	0	111.7
131	P	30.2	Very low	31.2	Very low	120 Å²	120	125 Å²	125	78%	0.779	77%	0.773	S	S	*	*			trans	-141.9	126.3	162.9	36.4	-18.3	0	0	0	117.9
132	S	30	Very low	31.7	Very low	113 Å²	113	128 Å²	128	79%	0.79	78%	0.776	S	S	*	*			trans	35.3	156.9	130.5	113.9	0	0	0	0	122.7
133	S	31.6	Very low	32.5	Very low	111 Å²	111	131 Å²	131	78%	0.776	78%	0.776	S	S	*	*			cis	-173.9	159.4	0.2	40.4	0	0	0	0	112.7
134	A	29	Very low	33.4	Very low	98 Å²	98	124.6 Å²	124.6	81%	0.81	76%	0.756	S	S	*	*			trans	-163.5	154.5	156.5	0	0	0	0	0	111
135	P	34.6	Very low	34.5	Very low	123 Å²	123	124.9 Å²	124.9	80%	0.799	75%	0.747	S	S	*	*			trans	-131.4	160	-147.2	41	-26.2	0	0	0	120.9
136	A	32	Very low	35.2	Very low	96 Å²	96	124.8 Å²	124.8	79%	0.793	74%	0.736	S	S	*	*			trans	74	144	151.9	0	0	0	0	0	119.3
137	P	30.9	Very low	36.3	Very low	127 Å²	127	125 Å²	125	83%	0.825	73%	0.727	S	S	*	*				-124.7	175.2	72.4	39.9	-32.6	0	0	0	116.6
138	T	35.1	Very low	37.5	Very low	138 Å²	138	121 Å²	121	85%	0.847	71%	0.706	S	S	*	*			trans	-42.1	138.7	-173.5	39	0	0	0	0	118.3
139	A	32.8	Very low	38.8	Very low	101 Å²	101	115.2 Å²	115.2	84%	0.835	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-76.5	143	172.9	0	0	0	0	0	113.6
140	V	38.6	Very low	40.4	Very low	81 Å²	81	111.3 Å²	111.3	49%	0.491	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-85.6	138.4	172.9	172.9	0	0	0	0	109	Q144	V140-Q144 HydrophobicContact CG1-CB 3.44Å; V140-Q144 VanDerWaalsContact CG1-CB 3.44Å; V140-Q144 HydrophobicContact CG1-CG 4.47Å
141	T	36.9	Very low	41.6	Very low	76 Å²	76	104.3 Å²	104.3	47%	0.466	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-74.7	158.1	-178	58.6	0	0	0	0	112.6	E143 Q144 H145	T141-E143 VanDerWaalsContact C-N 3.26Å; T141-E143 PolarHBondContact O-N 3.46Å; T141-Q144 WeakPolarHBondContact O-CB 3.27Å; T141-Q144 PolarHBondContact O-N 3.24Å; T141-Q144 WeakPolarHBondContact OG1-CG 3.23Å; T141-H145 PolarHBondContact O-N 3.05Å
142	E	41.1	Very low	43.1	Very low	175 Å²	175	105.1 Å²	105.1	82%	0.818	63%	0.629	S	S	*	*	H	α-helix	trans	-57.6	-37.8	177	-76.6	-170.8	115.4	0	0	112.5	Q144 H145 V146	E142-Q144 VanDerWaalsContact C-N 3.34Å; E142-Q144 PolarHBondContact O-N 3.23Å; E142-H145 WeakPolarHBondContact O-CB 3.48Å; E142-H145 PolarHBondContact O-N 3.07Å; E142-H145 VanDerWaalsContact O-N 3.16Å; E142-V146 WeakPolarHBondContact O-CG2 3.41Å; E142-V146 PolarHBondContact O-N 2.92Å
143	E	43.2	Very low	44.5	Very low	151 Å²	151	109.2 Å²	109.2	71%	0.706	63%	0.628	S	S	*	*	H	α-helix	trans	-59.4	-42.7	173.6	-69.2	-171.1	124.4	0	0	112.4	T141 H145 V146 Q147	T141-E143 VanDerWaalsContact C-N 3.26Å; T141-E143 PolarHBondContact O-N 3.46Å; E143-H145 VanDerWaalsContact C-N 3.33Å; E143-V146 PolarHBondContact O-N 2.97Å; E143-Q147 WeakPolarHBondContact O-CB 3.27Å; E143-Q147 WeakPolarHBondContact O-CG 2.91Å; E143-Q147 PolarHBondContact O-N 2.91Å
144	Q	46.8	Very low	46.5	Very low	103 Å²	103	107.7 Å²	107.7	48%	0.481	61%	0.611	S	S	.	*	H	α-helix	trans	-67.1	-35.4	176.2	-72.1	174.7	-25.2	0	0	111.5	V140 T141 E142 A148	V140-Q144 HydrophobicContact CG1-CB 3.44Å; V140-Q144 VanDerWaalsContact CG1-CB 3.44Å; V140-Q144 HydrophobicContact CG1-CG 4.47Å; T141-Q144 WeakPolarHBondContact O-CB 3.27Å; T141-Q144 PolarHBondContact O-N 3.24Å; T141-Q144 WeakPolarHBondContact OG1-CG 3.23Å; E142-Q144 VanDerWaalsContact C-N 3.34Å; E142-Q144 PolarHBondContact O-N 3.23Å; Q144-A148 WeakPolarHBondContact O-CB 3.47Å; Q144-A148 PolarHBondContact O-N 2.95Å
145	H	52.8	Low	48.7	Very low	125 Å²	125	103.5 Å²	103.5	58%	0.579	58%	0.575	S	S	*	*	H	α-helix	trans	-65.2	-41.5	172	-98.9	-82.2	0	0	0	112.7	T141 E142 E143 A149	T141-H145 PolarHBondContact O-N 3.05Å; E142-H145 WeakPolarHBondContact O-CB 3.48Å; E142-H145 PolarHBondContact O-N 3.07Å; E142-H145 VanDerWaalsContact O-N 3.16Å; E143-H145 VanDerWaalsContact C-N 3.33Å; H145-A149 WeakPolarHBondContact O-CB 3.41Å; H145-A149 PolarHBondContact O-N 3.35Å
146	V	50	Low	50.7	Low	93 Å²	93	98.3 Å²	98.3	56%	0.564	54%	0.542	S	S	*	.	H	α-helix	trans	-65.9	-48.3	175.6	172.1	0	0	0	0	110.8	E142 E143 A148 A149 E150	E142-V146 WeakPolarHBondContact O-CG2 3.41Å; E142-V146 PolarHBondContact O-N 2.92Å; E143-V146 PolarHBondContact O-N 2.97Å; V146-A148 VanDerWaalsContact C-N 3.35Å; V146-A148 PolarHBondContact O-N 3.1Å; V146-A149 PolarHBondContact O-N 3.18Å; V146-E150 WeakPolarHBondContact O-CB 3.32Å; V146-E150 PolarHBondContact O-N 3.18Å
147	Q	53.9	Low	52.9	Low	127 Å²	127	98.1 Å²	98.1	59%	0.593	53%	0.531	S	S	*	.	H	α-helix	trans	-61	-41.1	176.6	-73.1	179.8	8.5	0	0	112.1	E143 E150 A151	E143-Q147 WeakPolarHBondContact O-CB 3.27Å; E143-Q147 WeakPolarHBondContact O-CG 2.91Å; E143-Q147 PolarHBondContact O-N 2.91Å; Q147-E150 PolarHBondContact O-N 2.91Å; Q147-A151 VanDerWaalsContact O-CB 3.23Å; Q147-A151 WeakPolarHBondContact O-CB 3.29Å; Q147-A151 PolarHBondContact O-N 2.94Å
148	A	51.4	Low	55.2	Low	44 Å²	44	94.2 Å²	94.2	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-65.5	-38	175.6	0	0	0	0	0	112.3	Q144 V146 R152	Q144-A148 WeakPolarHBondContact O-CB 3.47Å; Q144-A148 PolarHBondContact O-N 2.95Å; V146-A148 VanDerWaalsContact C-N 3.35Å; V146-A148 PolarHBondContact O-N 3.1Å; A148-R152 WeakPolarHBondContact O-CB 3.43Å; A148-R152 VanDerWaalsContact O-CG 3.25Å; A148-R152 WeakPolarHBondContact O-CG 3.29Å; A148-R152 PolarHBondContact O-N 2.92Å
149	A	54.4	Low	57.5	Low	47 Å²	47	87.8 Å²	87.8	39%	0.388	47%	0.466	S	S	.	.	H	α-helix	trans	-68.5	-40.9	175.3	0	0	0	0	0	112.3	H145 V146 R152 R153	H145-A149 WeakPolarHBondContact O-CB 3.41Å; H145-A149 PolarHBondContact O-N 3.35Å; V146-A149 PolarHBondContact O-N 3.18Å; A149-R152 PolarHBondContact O-N 3.45Å; A149-R153 WeakPolarHBondContact O-CG 3.5Å; A149-R153 PolarHBondContact O-N 3.12Å
150	E	59.2	Low	59.9	Low	108 Å²	108	88.2 Å²	88.2	51%	0.505	45%	0.448	S	S	.	.	H	α-helix	trans	-71.3	-39.6	178.1	-175.6	161.4	-133.4	0	0	112.5	V146 Q147 R153 N154	V146-E150 WeakPolarHBondContact O-CB 3.32Å; V146-E150 PolarHBondContact O-N 3.18Å; Q147-E150 PolarHBondContact O-N 2.91Å; E150-R153 PolarHBondContact O-N 2.74Å; E150-N154 PolarHBondContact O-N 3.34Å; E150-N154 VanDerWaalsContact O-N 3.09Å; E150-N154 PolarHBondContact O-ND2 3.34Å
151	A	59.7	Low	62	Low	33 Å²	33	90.4 Å²	90.4	27%	0.273	45%	0.448	S	S	.	.	H	α-helix	trans	-65.7	-37.8	173.1	0	0	0	0	0	111.7	Q147 N154 L155 F282	Q147-A151 VanDerWaalsContact O-CB 3.23Å; Q147-A151 WeakPolarHBondContact O-CB 3.29Å; Q147-A151 PolarHBondContact O-N 2.94Å; A151-N154 PolarHBondContact O-N 3.01Å; A151-L155 PolarHBondContact O-N 2.9Å; A151-F282 HydrophobicContact CB-CD1 4.43Å; A151-F282 HydrophobicContact CB-CE1 3.75Å
152	R	60.1	Low	64	Low	137 Å²	137	88.8 Å²	88.8	52%	0.517	44%	0.437	S	S	.	.	H	α-helix	trans	-62.7	-41.7	171.4	-79.9	174.1	174.8	164.6	1.5	112.6	A148 A149 N154 L155	A148-R152 WeakPolarHBondContact O-CB 3.43Å; A148-R152 VanDerWaalsContact O-CG 3.25Å; A148-R152 WeakPolarHBondContact O-CG 3.29Å; A148-R152 PolarHBondContact O-N 2.92Å; A149-R152 PolarHBondContact O-N 3.45Å; R152-N154 VanDerWaalsContact C-N 3.27Å; R152-N154 PolarHBondContact O-N 3.45Å; R152-L155 WeakPolarHBondContact O-CB 3.28Å; R152-L155 PolarHBondContact O-N 3.49Å
153	R	61.4	Low	65.9	Low	199 Å²	199	81 Å²	81	75%	0.751	40%	0.402	S	S	*	.	H	α-helix	trans	-59.3	-37.3	173.6	-76.6	175.6	178.9	159	1	112.6	A149 E150	A149-R153 WeakPolarHBondContact O-CG 3.5Å; A149-R153 PolarHBondContact O-N 3.12Å; E150-R153 PolarHBondContact O-N 2.74Å
154	N	72.2	Confident	67.7	Low	80 Å²	80	79.5 Å²	79.5	43%	0.428	40%	0.399	S	S	.	.	H	α-helix	trans	-86.8	-8.8	-178.9	-71.8	-57.3	0	0	0	114.1	E150 A151 R152 A156 T157 V158	E150-N154 PolarHBondContact O-N 3.34Å; E150-N154 VanDerWaalsContact O-N 3.09Å; E150-N154 PolarHBondContact O-ND2 3.34Å; A151-N154 PolarHBondContact O-N 3.01Å; R152-N154 VanDerWaalsContact C-N 3.27Å; R152-N154 PolarHBondContact O-N 3.45Å; N154-A156 PolarHBondContact O-N 3.28Å; N154-T157 WeakPolarHBondContact O-CB 3.48Å; N154-T157 PolarHBondContact O-N 2.65Å; N154-T157 VanDerWaalsContact O-N 3.15Å; N154-V158 WeakPolarHBondContact O-CG2 3.43Å; N154-V158 PolarHBondContact O-N 2.99Å
155	L	75.5	Confident	69.1	Low	9 Å²	9	81.6 Å²	81.6	5%	0.047	40%	0.402	C	S	.	.	H	α-helix	trans	-56.3	-50.6	-170.9	179.4	63.2	0	0	0	113	A151 R152 T157 V158 L159 F282 W289 L291	A151-L155 PolarHBondContact O-N 2.9Å; R152-L155 WeakPolarHBondContact O-CB 3.28Å; R152-L155 PolarHBondContact O-N 3.49Å; L155-T157 VanDerWaalsContact C-N 3.25Å; L155-T157 PolarHBondContact O-N 3.1Å; L155-V158 WeakPolarHBondContact O-CB 3.48Å; L155-V158 PolarHBondContact O-N 3.47Å; L155-L159 HydrophobicContact CD1-CD1 4.17Å; L155-L159 HydrophobicContact CD1-CD2 4.37Å; L155-L159 HydrophobicContact CD1-CG 4.08Å; L155-L159 HydrophobicContact CG-CD1 4.09Å; L155-L159 HydrophobicContact CG-CG 4.34Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 2.85Å; L155-F282 HydrophobicContact CD1-CB 3.99Å; L155-F282 HydrophobicContact CD1-CD2 3.54Å; L155-F282 HydrophobicContact CD1-CE2 4.2Å; L155-F282 HydrophobicContact CD1-CG 3.77Å; L155-F282 HydrophobicContact CD2-CB 3.98Å; L155-W289 HydrophobicContact CD2-CH2 3.66Å; L155-W289 HydrophobicContact CD2-CZ2 4.27Å; L155-L291 HydrophobicContact CD2-CD1 3.74Å; L155-L291 HydrophobicContact CG-CD1 4.36Å
156	A	76.1	Confident	69.9	Low	14 Å²	14	77.7 Å²	77.7	12%	0.116	40%	0.396	C	S	.	.	H	α-helix	trans	-58.9	-38.3	-179.5	0	0	0	0	0	112.2	N154 L159 K160 D293	N154-A156 PolarHBondContact O-N 3.28Å; A156-L159 PolarHBondContact O-N 2.7Å; A156-K160 VanDerWaalsContact O-CB 3.3Å; A156-K160 WeakPolarHBondContact O-CB 3.25Å; A156-K160 PolarHBondContact O-N 3.03Å; A156-D293 WeakPolarHBondContact CB-O 3.48Å
157	T	79.7	Confident	70.5	Confident	92 Å²	92	77.9 Å²	77.9	56%	0.564	39%	0.392	S	S	*	.	H	α-helix	trans	-67.5	-36.7	175.3	-41.9	0	0	0	0	112.2	N154 L155 R161	N154-T157 WeakPolarHBondContact O-CB 3.48Å; N154-T157 PolarHBondContact O-N 2.65Å; N154-T157 VanDerWaalsContact O-N 3.15Å; L155-T157 VanDerWaalsContact C-N 3.25Å; L155-T157 PolarHBondContact O-N 3.1Å; T157-R161 WeakPolarHBondContact O-CB 3.3Å; T157-R161 PolarHBondContact O-N 2.61Å
158	V	79.2	Confident	71.4	Confident	45 Å²	45	74.8 Å²	74.8	27%	0.273	38%	0.376	S	S	.	.	H	α-helix	trans	-68	-45.6	175	174.7	0	0	0	0	111	N154 L155 R161 N162	N154-V158 WeakPolarHBondContact O-CG2 3.43Å; N154-V158 PolarHBondContact O-N 2.99Å; L155-V158 WeakPolarHBondContact O-CB 3.48Å; L155-V158 PolarHBondContact O-N 3.47Å; V158-R161 PolarHBondContact O-N 2.95Å; V158-N162 WeakPolarHBondContact O-CB 3.48Å; V158-N162 VanDerWaalsContact O-CG 3.28Å; V158-N162 PolarHBondContact O-N 3.09Å
159	L	82	Confident	73	Confident	4 Å²	4	73 Å²	73	2%	0.021	36%	0.361	C	S	.	.	H	α-helix	trans	-65.9	-44.6	177.4	-61.4	-179.4	0	0	0	111.4	L155 A156 R161 N162 A163 Y181 F183 Y210 L291	L155-L159 HydrophobicContact CD1-CD1 4.17Å; L155-L159 HydrophobicContact CD1-CD2 4.37Å; L155-L159 HydrophobicContact CD1-CG 4.08Å; L155-L159 HydrophobicContact CG-CD1 4.09Å; L155-L159 HydrophobicContact CG-CG 4.34Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 2.85Å; A156-L159 PolarHBondContact O-N 2.7Å; L159-R161 PolarHBondContact O-N 3.08Å; L159-N162 PolarHBondContact O-N 2.85Å; L159-A163 WeakPolarHBondContact O-CB 3.43Å; L159-A163 PolarHBondContact O-N 3.37Å; L159-Y181 HydrophobicContact CB-CD1 4.23Å; L159-Y181 HydrophobicContact CB-CD2 3.93Å; L159-Y181 HydrophobicContact CB-CE1 4.45Å; L159-Y181 HydrophobicContact CB-CE2 4.16Å; L159-Y181 HydrophobicContact CB-CG 3.98Å; L159-Y181 HydrophobicContact CD1-CD2 4.1Å; L159-Y181 HydrophobicContact CD1-CG 4.18Å; L159-F183 HydrophobicContact CD1-CE2 3.99Å; L159-F183 HydrophobicContact CD1-CZ 4.38Å; L159-F183 HydrophobicContact CD2-CE2 4.16Å; L159-F183 HydrophobicContact CD2-CZ 3.71Å; L159-Y210 HydrophobicContact CB-CE2 4.34Å; L159-Y210 HydrophobicContact CD2-CE1 4.39Å; L159-Y210 HydrophobicContact CD2-CE2 4.13Å; L159-Y210 PolarHBondContact O-OH 3.27Å; L159-L291 HydrophobicContact CD1-CD1 3.48Å; L159-L291 VanDerWaalsContact CD1-CD1 3.48Å
160	K	83.9	Confident	74.6	Confident	109 Å²	109	70.8 Å²	70.8	47%	0.474	34%	0.343	S	S	.	.	H	α-helix	trans	-55.5	-53	173.8	-177.2	162.3	-177.8	170.7	0	111.1	A156 N162 A163 D164 Y181	A156-K160 VanDerWaalsContact O-CB 3.3Å; A156-K160 WeakPolarHBondContact O-CB 3.25Å; A156-K160 PolarHBondContact O-N 3.03Å; K160-N162 PolarHBondContact O-N 3.02Å; K160-A163 PolarHBondContact O-N 3.24Å; K160-A163 VanDerWaalsContact O-N 3.13Å; K160-D164 WeakPolarHBondContact CG-OD2 3.29Å; K160-D164 WeakPolarHBondContact O-CB 3.43Å; K160-D164 PolarHBondContact O-N 2.83Å; K160-Y181 WeakPolarHBondContact CA-OH 3.43Å; K160-Y181 VanDerWaalsContact CB-OH 3.26Å; K160-Y181 WeakPolarHBondContact CB-OH 3.34Å
161	R	83.2	Confident	75.9	Confident	128 Å²	128	68.5 Å²	68.5	48%	0.483	33%	0.334	S	S	.	.	H	α-helix	trans	-59.4	-30.9	179.3	-178.4	179.3	63.4	-169.5	-3.3	113.5	T157 V158 L159 R165	T157-R161 WeakPolarHBondContact O-CB 3.3Å; T157-R161 PolarHBondContact O-N 2.61Å; V158-R161 PolarHBondContact O-N 2.95Å; L159-R161 PolarHBondContact O-N 3.08Å; R161-R165 WeakPolarHBondContact O-CD 3.36Å; R161-R165 WeakPolarHBondContact O-CG 3.4Å; R161-R165 PolarHBondContact O-N 3.36Å
162	N	78.5	Confident	77.1	Confident	42 Å²	42	68.5 Å²	68.5	23%	0.225	33%	0.329	C	S	.	.	H	α-helix	trans	-79.4	-37.5	177.2	-72.4	-2.6	0	0	0	112	V158 L159 K160 R165 G166 Y210	V158-N162 WeakPolarHBondContact O-CB 3.48Å; V158-N162 VanDerWaalsContact O-CG 3.28Å; V158-N162 PolarHBondContact O-N 3.09Å; L159-N162 PolarHBondContact O-N 2.85Å; K160-N162 PolarHBondContact O-N 3.02Å; N162-R165 PolarHBondContact O-N 3.02Å; N162-G166 PolarHBondContact O-N 3.25Å; N162-Y210 HydrophobicContact CB-CE1 4.34Å; N162-Y210 WeakPolarHBondContact CB-OH 3.13Å
163	A	80.4	Confident	78.2	Confident	12 Å²	12	62.6 Å²	62.6	10%	0.099	31%	0.309	C	S	.	.	H	α-helix	trans	-65.7	-45.7	172.8	0	0	0	0	0	112.1	L159 K160 R165 G166 Y181 V208 Y210	L159-A163 WeakPolarHBondContact O-CB 3.43Å; L159-A163 PolarHBondContact O-N 3.37Å; K160-A163 PolarHBondContact O-N 3.24Å; K160-A163 VanDerWaalsContact O-N 3.13Å; A163-R165 PolarHBondContact O-N 2.87Å; A163-G166 PolarHBondContact O-N 3.43Å; A163-Y181 HydrophobicContact CB-CE1 4.03Å; A163-V208 HydrophobicContact CB-CG1 3.85Å; A163-V208 HydrophobicContact CB-CG2 4.44Å; A163-Y210 PolarHBondContact N-OH 3.27Å
164	D	81.3	Confident	79.1	Confident	118 Å²	118	58.1 Å²	58.1	63%	0.631	30%	0.303	S	S	*	.	H	α-helix	trans	-59	-26.6	175.5	-67	-17.2	0	0	0	112.1	K160 G166	K160-D164 WeakPolarHBondContact CG-OD2 3.29Å; K160-D164 WeakPolarHBondContact O-CB 3.43Å; K160-D164 PolarHBondContact O-N 2.83Å; D164-G166 VanDerWaalsContact C-N 3.35Å
165	R	77.2	Confident	79.4	Confident	148 Å²	148	58.2 Å²	58.2	56%	0.558	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.4	175	-75.5	167.9	171.9	-166.9	-8.6	113.7	R161 N162 A163 M167	R161-R165 WeakPolarHBondContact O-CD 3.36Å; R161-R165 WeakPolarHBondContact O-CG 3.4Å; R161-R165 PolarHBondContact O-N 3.36Å; N162-R165 PolarHBondContact O-N 3.02Å; A163-R165 PolarHBondContact O-N 2.87Å; R165-M167 HydrophobicContact CB-CB 4.44Å; R165-M167 HydrophobicContact CB-CE 4.03Å; R165-M167 HydrophobicContact CB-CG 4.32Å; R165-M167 HydrophobicContact CG-CE 4.36Å; R165-M167 PolarHBondContact O-N 2.78Å
166	G	68.8	Low	79.7	Confident	42 Å²	42	60.6 Å²	60.6	43%	0.433	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	12.5	-175.7	0	0	0	0	0	114.8	N162 A163 D164 F168	N162-G166 PolarHBondContact O-N 3.25Å; A163-G166 PolarHBondContact O-N 3.43Å; D164-G166 VanDerWaalsContact C-N 3.35Å; G166-F168 PolarHBondContact O-N 3.34Å
167	M	62.5	Low	79.9	Confident	98 Å²	98	68 Å²	68	48%	0.483	37%	0.366	S	S	.	.	S	Bend	trans	-84.8	100.2	-171.6	-81	-159.6	-73.7	0	0	110.6	R165 T169	R165-M167 HydrophobicContact CB-CB 4.44Å; R165-M167 HydrophobicContact CB-CE 4.03Å; R165-M167 HydrophobicContact CB-CG 4.32Å; R165-M167 HydrophobicContact CG-CE 4.36Å; R165-M167 PolarHBondContact O-N 2.78Å; M167-T169 VanDerWaalsContact C-N 3.29Å; M167-T169 PolarHBondContact O-N 3.11Å
168	F	72	Confident	79.8	Confident	62 Å²	62	66.3 Å²	66.3	27%	0.272	35%	0.35	S	S	.	.	S	Bend	trans	64.3	27	169.5	-43.3	-80.4	0	0	0	115.5	G166 L228 A267 A271	G166-F168 PolarHBondContact O-N 3.34Å; F168-L228 HydrophobicContact CB-CD1 4.33Å; F168-L228 HydrophobicContact CB-CD2 4.4Å; F168-A267 HydrophobicContact CE1-CB 4.16Å; F168-A267 HydrophobicContact CZ-CB 4.02Å; F168-A271 HydrophobicContact CB-CB 3.37Å; F168-A271 HydrophobicContact CD1-CB 3.53Å; F168-A271 HydrophobicContact CD2-CB 3.27Å; F168-A271 HydrophobicContact CE1-CB 4.08Å; F168-A271 HydrophobicContact CE2-CB 3.87Å; F168-A271 HydrophobicContact CG-CB 3.08Å; F168-A271 HydrophobicContact CZ-CB 4.23Å
169	T	85.6	Confident	80.1	Confident	5 Å²	5	65.5 Å²	65.5	3%	0.031	35%	0.345	C	S	.	.			trans	-98.9	163.6	163.1	59.2	0	0	0	0	111.2	M167 N171 V208 I209 Y210	M167-T169 VanDerWaalsContact C-N 3.29Å; M167-T169 PolarHBondContact O-N 3.11Å; T169-N171 PolarHBondContact OG1-OD1 3.44Å; T169-V208 HydrophobicContact CG2-CG1 3.8Å; T169-I209 CarbonylContact C-O 3.56Å; T169-I209 VanDerWaalsContact CA-O 3.25Å; T169-I209 WeakPolarHBondContact CA-O 3.44Å; T169-I209 WeakPolarHBondContact CB-O 3.17Å; T169-Y210 HydrophobicContact CG2-CD1 3.86Å; T169-Y210 HydrophobicContact CG2-CD2 4.37Å; T169-Y210 HydrophobicContact CG2-CE1 3.39Å; T169-Y210 HydrophobicContact CG2-CE2 3.95Å; T169-Y210 HydrophobicContact CG2-CG 4.32Å; T169-Y210 VanDerWaalsContact CG2-CZ 3.42Å
170	I	87.2	Confident	80.4	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	111.5	171.6	-60.4	165.8	0	0	0	107.5	I209 L227 L228 W240	I170-I209 HydrophobicContact CB-CB 4.33Å; I170-I209 PolarHBondContact N-O 2.83Å; I170-I209 WeakPolarHBondContact O-CB 3.22Å; I170-I209 PolarHBondContact O-N 2.98Å; I170-L227 HydrophobicContact CD1-CD2 3.82Å; I170-L228 HydrophobicContact CD1-CD2 4.32Å; I170-L228 HydrophobicContact CG1-CD2 4.09Å; I170-W240 HydrophobicContact CD1-CB 4.23Å; I170-W240 HydrophobicContact CD1-CD2 3.68Å; I170-W240 HydrophobicContact CD1-CE3 3.34Å; I170-W240 HydrophobicContact CD1-CG 4.1Å; I170-W240 HydrophobicContact CD1-CZ3 3.95Å; I170-W240 HydrophobicContact CG2-CB 4.03Å; I170-W240 HydrophobicContact CG2-CG 4.24Å
171	N	87.2	Confident	80.7	Confident	59 Å²	59	60.3 Å²	60.3	32%	0.316	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	119.3	-178.3	-57.9	-0.2	0	0	0	108.6	T169 T174	T169-N171 PolarHBondContact OG1-OD1 3.44Å; N171-T174 HydrophobicContact CB-CG2 4.18Å
172	L	85.8	Confident	81	Confident	33 Å²	33	54.2 Å²	54.2	17%	0.173	30%	0.299	C	S	.	.	S	Bend	trans	-83.6	-30.4	173.3	-62.7	-169	0	0	0	112.1	A202 V207 I209 A237	L172-A202 HydrophobicContact CB-CB 4.17Å; L172-V207 HydrophobicContact CB-CB 4.24Å; L172-V207 HydrophobicContact CB-CG1 4.38Å; L172-V207 HydrophobicContact CD1-CG1 4.13Å; L172-V207 HydrophobicContact CG-CG1 4.37Å; L172-V207 PolarHBondContact N-O 3.08Å; L172-I209 HydrophobicContact CD1-CD1 3.59Å; L172-I209 HydrophobicContact CD2-CD1 4.02Å; L172-I209 HydrophobicContact CG-CD1 3.62Å; L172-I209 HydrophobicContact CG-CG1 4.38Å; L172-A237 HydrophobicContact CD2-CB 4.12Å
173	S	83.7	Confident	81.5	Confident	14 Å²	14	52.3 Å²	52.3	10%	0.098	29%	0.289	C	S	.	.			trans	-152.6	155.3	178.7	56	0	0	0	0	111.3	A202 F205 S206 V207	S173-A202 WeakPolarHBondContact CB-O 3.28Å; S173-A202 WeakPolarHBondContact OG-CA 3.22Å; S173-A202 PolarHBondContact OG-O 2.93Å; S173-F205 PolarHBondContact OG-O 2.92Å; S173-S206 WeakPolarHBondContact OG-CA 3.4Å; S173-V207 PolarHBondContact O-N 3Å; S173-V207 PolarHBondContact OG-N 2.89Å
174	T	78.8	Confident	82	Confident	104 Å²	104	51.8 Å²	51.8	64%	0.638	28%	0.284	S	S	*	.			trans	-150.4	137.9	-177.6	53.8	0	0	0	0	110	N171	N171-T174 HydrophobicContact CB-CG2 4.18Å
175	G	78.7	Confident	82.3	Confident	82 Å²	82	46.1 Å²	46.1	85%	0.845	25%	0.254	S	S	*	.			trans	115.9	-4.3	173.1	0	0	0	0	0	114.9	S206	G175-S206 PolarHBondContact N-OG 3.06Å
176	H	81.8	Confident	82.7	Confident	60 Å²	60	39.1 Å²	39.1	28%	0.278	23%	0.228	S	C	.	.			trans	-81.4	146.3	171	-49.3	-89.2	0	0	0	110.5	R178 R203 E204 F205 S206	H176-R178 PolarHBondContact O-N 3.07Å; H176-R203 VanDerWaalsContact CE1-C 3.45Å; H176-R203 PolarHBondContact CE1-O 3.21Å; H176-E204 WeakPolarHBondContact CB-O 3.3Å; H176-E204 VanDerWaalsContact ND1-C 3.31Å; H176-E204 PolarHBondContact ND1-O 2.93Å; H176-F205 PolarHBondContact CD2-O 3.38Å; H176-S206 PolarHBondContact N-OG 3.49Å; H176-S206 PolarHBondContact O-OG 3.25Å; H176-S206 VanDerWaalsContact O-OG 3.13Å
177	E	79.6	Confident	83.4	Confident	169 Å²	169	38.5 Å²	38.5	79%	0.79	22%	0.219	S	C	*	.	S	Bend	trans	-53.5	-37.5	-178.4	-172.3	-170.9	175.6	0	0	113
178	R	79.2	Confident	84.4	Confident	57 Å²	57	34 Å²	34	22%	0.215	20%	0.197	C	C	.	.	S	Bend	trans	-106.1	145	-178.6	-69.6	-61.8	-164.6	179.6	3.4	111.4	H176 F205 S206 D293	H176-R178 PolarHBondContact O-N 3.07Å; R178-F205 HydrophobicContact CB-CD1 3.66Å; R178-F205 HydrophobicContact CB-CE1 4.03Å; R178-S206 PolarHBondContact O-N 3.25Å; R178-D293 WeakPolarHBondContact CD-OD1 3.49Å; R178-D293 WeakPolarHBondContact CD-OD2 3.48Å; R178-D293 IonicContact CZ-OD1 2.72Å; R178-D293 IonicContact CZ-OD2 2.69Å; R178-D293 IonicContact NE-OD2 3.75Å; R178-D293 IonicContact NH1-OD1 2.77Å; R178-D293 PolarHBondContact NH1-OD1 3.3Å; R178-D293 IonicContact NH1-OD2 3.83Å; R178-D293 PolarHBondContact NH1-OD2 2.99Å
179	T	85.7	Confident	84.7	Confident	28 Å²	28	36.6 Å²	36.6	17%	0.172	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	142	-178.7	-54.8	0	0	0	0	110.7	Y181 S206 V208 S292 D293	T179-Y181 HydrophobicContact CG2-CD1 4.17Å; T179-Y181 HydrophobicContact CG2-CE1 3.5Å; T179-Y181 HydrophobicContact CG2-CE2 4.47Å; T179-S206 CarbonylContact C-O 3.55Å; T179-S206 VanDerWaalsContact CA-O 3.26Å; T179-S206 WeakPolarHBondContact CA-O 3.41Å; T179-S206 VanDerWaalsContact CG2-O 3.31Å; T179-S206 WeakPolarHBondContact CG2-O 3.44Å; T179-V208 HydrophobicContact CG2-CG2 4.13Å; T179-S292 CarbonylContact O-C 3.5Å; T179-D293 PolarHBondContact O-N 3.05Å
180	L	88	Confident	84.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.1	175.2	-58.9	-179.3	0	0	0	110.1	L201 F205 S206 V207 V208 V290 L291 L298	L180-L201 HydrophobicContact CD1-CB 4.28Å; L180-L201 HydrophobicContact CD1-CD1 4.19Å; L180-F205 HydrophobicContact CD1-CB 3.86Å; L180-F205 HydrophobicContact CD1-CD2 4.38Å; L180-F205 HydrophobicContact CD1-CG 4.05Å; L180-F205 HydrophobicContact CG-CB 3.94Å; L180-F205 HydrophobicContact CG-CG 4.32Å; L180-S206 PolarHBondContact N-O 2.85Å; L180-V207 HydrophobicContact CB-CG2 4.35Å; L180-V207 HydrophobicContact CD1-CG2 4.36Å; L180-V208 PolarHBondContact O-N 2.98Å; L180-V290 HydrophobicContact CB-CG1 4.48Å; L180-L291 CarbonylContact C-O 3.55Å; L180-L291 WeakPolarHBondContact CA-O 3.4Å; L180-L298 HydrophobicContact CD1-CD1 4.29Å; L180-L298 HydrophobicContact CD2-CD1 3.67Å
181	Y	89.5	Confident	84.4	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.016	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	116	178	-51.2	-67.1	0	0	0	110.4	L159 K160 A163 T179 V208 Y210 V290 L291	L159-Y181 HydrophobicContact CB-CD1 4.23Å; L159-Y181 HydrophobicContact CB-CD2 3.93Å; L159-Y181 HydrophobicContact CB-CE1 4.45Å; L159-Y181 HydrophobicContact CB-CE2 4.16Å; L159-Y181 HydrophobicContact CB-CG 3.98Å; L159-Y181 HydrophobicContact CD1-CD2 4.1Å; L159-Y181 HydrophobicContact CD1-CG 4.18Å; K160-Y181 WeakPolarHBondContact CA-OH 3.43Å; K160-Y181 VanDerWaalsContact CB-OH 3.26Å; K160-Y181 WeakPolarHBondContact CB-OH 3.34Å; A163-Y181 HydrophobicContact CB-CE1 4.03Å; T179-Y181 HydrophobicContact CG2-CD1 4.17Å; T179-Y181 HydrophobicContact CG2-CE1 3.5Å; T179-Y181 HydrophobicContact CG2-CE2 4.47Å; Y181-V208 CarbonylContact C-O 3.25Å; Y181-V208 WeakPolarHBondContact CA-O 3.4Å; Y181-V208 HydrophobicContact CD1-CB 4.05Å; Y181-V208 HydrophobicContact CD1-CG1 4.37Å; Y181-V208 HydrophobicContact CE1-CB 4.48Å; Y181-Y210 AromaticContact CD1-CE2 3.91Å; Y181-Y210 HydrophobicContact CD1-CE2 3.91Å; Y181-Y210 HydrophobicContact CG-CE2 4.33Å; Y181-V290 CarbonylContact O-C 3.58Å; Y181-V290 WeakPolarHBondContact O-CA 3.38Å; Y181-L291 PolarHBondContact N-O 2.85Å; Y181-L291 PolarHBondContact O-N 3.41Å
182	A	89.7	Confident	84.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.2	-174.2	0	0	0	0	0	112.8	L184 L198 V208 I209 Y210 W289 V290	A182-L184 HydrophobicContact CB-CD1 4.46Å; A182-L184 HydrophobicContact CB-CG 4.22Å; A182-L198 HydrophobicContact CB-CD1 3.75Å; A182-L198 HydrophobicContact CB-CD2 4.21Å; A182-V208 PolarHBondContact N-O 3.2Å; A182-I209 HydrophobicContact CB-CG1 4.28Å; A182-I209 CarbonylContact O-C 3.49Å; A182-I209 WeakPolarHBondContact O-CA 3.49Å; A182-Y210 PolarHBondContact O-N 3.19Å; A182-W289 CarbonylContact C-O 3.55Å; A182-W289 WeakPolarHBondContact CA-O 3.3Å; A182-V290 HydrophobicContact CB-CG1 4.33Å; A182-V290 HydrophobicContact CB-CG2 3.85Å
183	F	90.1	Very high	83.7	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	114.8	171.9	-68.8	-95.5	0	0	0	110.6	L159 Y210 V212 A278 F279 P288 W289 L291	L159-F183 HydrophobicContact CD1-CE2 3.99Å; L159-F183 HydrophobicContact CD1-CZ 4.38Å; L159-F183 HydrophobicContact CD2-CE2 4.16Å; L159-F183 HydrophobicContact CD2-CZ 3.71Å; F183-Y210 WeakPolarHBondContact CA-O 3.27Å; F183-Y210 VanDerWaalsContact CD1-CB 3.49Å; F183-Y210 HydrophobicContact CD1-CG 4.33Å; F183-Y210 HydrophobicContact CE1-CD1 4.31Å; F183-Y210 AromaticContact CE1-CG 3.92Å; F183-Y210 HydrophobicContact CE1-CG 3.92Å; F183-Y210 HydrophobicContact CE2-CD2 4.4Å; F183-Y210 HydrophobicContact CE2-CG 4.48Å; F183-Y210 HydrophobicContact CZ-CD1 4.46Å; F183-Y210 HydrophobicContact CZ-CD2 4.28Å; F183-Y210 AromaticContact CZ-CG 3.99Å; F183-Y210 HydrophobicContact CZ-CG 3.99Å; F183-V212 HydrophobicContact CB-CG2 4.41Å; F183-V212 HydrophobicContact CD1-CG1 3.84Å; F183-A278 HydrophobicContact CE1-CB 4.4Å; F183-F279 HydrophobicContact CB-CD2 3.83Å; F183-F279 HydrophobicContact CB-CE2 4.45Å; F183-F279 HydrophobicContact CD1-CB 4.11Å; F183-F279 HydrophobicContact CD1-CD2 4.38Å; F183-F279 HydrophobicContact CE1-CB 4.49Å; F183-F279 HydrophobicContact CG-CD2 4.2Å; F183-P288 WeakPolarHBondContact O-CA 3.24Å; F183-W289 HydrophobicContact CB-CB 4.29Å; F183-W289 HydrophobicContact CD2-CD2 4.41Å; F183-W289 AromaticContact CD2-CE3 3.68Å; F183-W289 HydrophobicContact CD2-CE3 3.68Å; F183-W289 HydrophobicContact CD2-CZ3 4.3Å; F183-W289 AromaticContact CE2-CE3 3.99Å; F183-W289 HydrophobicContact CE2-CE3 3.99Å; F183-W289 HydrophobicContact CE2-CZ3 4.13Å; F183-W289 HydrophobicContact CG-CE3 4.27Å; F183-W289 PolarHBondContact N-O 2.86Å; F183-W289 PolarHBondContact O-N 3.21Å; F183-L291 HydrophobicContact CE2-CD1 4.32Å
184	L	89.4	Confident	83.6	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.7	-169.4	-61	-178.6	0	0	0	112.5	A182 C191 L194 L198 I209 Y210 V212 W240 P288	A182-L184 HydrophobicContact CB-CD1 4.46Å; A182-L184 HydrophobicContact CB-CG 4.22Å; L184-C191 HydrophobicContact CD2-CB 4.23Å; L184-L194 HydrophobicContact CD2-CD2 4.37Å; L184-L198 HydrophobicContact CD1-CD1 3.68Å; L184-L198 HydrophobicContact CD2-CD1 4.06Å; L184-L198 HydrophobicContact CG-CD1 4.32Å; L184-I209 HydrophobicContact CB-CG2 4.26Å; L184-I209 HydrophobicContact CD1-CD1 3.82Å; L184-I209 HydrophobicContact CD1-CG1 4.15Å; L184-I209 HydrophobicContact CD1-CG2 3.91Å; L184-I209 HydrophobicContact CG-CG2 4.24Å; L184-Y210 PolarHBondContact N-O 3.07Å; L184-V212 VanDerWaalsContact C-CG2 3.49Å; L184-V212 VanDerWaalsContact O-CG2 3.32Å; L184-V212 WeakPolarHBondContact O-CG2 3.36Å; L184-V212 PolarHBondContact O-N 2.85Å; L184-W240 HydrophobicContact CB-CZ2 3.83Å; L184-W240 HydrophobicContact CD1-CZ2 4.17Å; L184-P288 HydrophobicContact CD2-CB 3.5Å; L184-P288 VanDerWaalsContact CD2-CB 3.5Å
185	D	89	Confident	83.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.			trans	-119.8	124.2	176.4	-174.7	-31.7	0	0	0	110.6	A187 C188 C191 V212 S213 V214 I215 G216 S220 Y244	D185-A187 PolarHBondContact O-N 3.02Å; D185-A187 WeakPolarHBondContact OD1-CB 3.35Å; D185-A187 PolarHBondContact OD1-N 2.98Å; D185-C188 HydrophobicContact CB-CB 3.95Å; D185-C188 WeakPolarHBondContact O-CB 3.34Å; D185-C188 PolarHBondContact O-N 3.09Å; D185-C191 PolarHBondContact N-SG 2.67Å; D185-C191 VanDerWaalsContact O-CB 3.3Å; D185-C191 WeakPolarHBondContact O-CB 3.49Å; D185-V212 WeakPolarHBondContact CA-O 3.26Å; D185-V212 HydrophobicContact CB-CG2 4.28Å; D185-V212 WeakPolarHBondContact CB-O 3.4Å; D185-S213 VanDerWaalsContact OD2-CA 3.27Å; D185-S213 WeakPolarHBondContact OD2-CA 3.42Å; D185-V214 PolarHBondContact OD2-N 2.71Å; D185-I215 WeakPolarHBondContact OD2-CA 3.47Å; D185-I215 PolarHBondContact OD2-N 3.3Å; D185-G216 PolarHBondContact OD2-N 3.16Å; D185-S220 WeakPolarHBondContact OD1-CB 3.36Å; D185-S220 PolarHBondContact OD1-OG 3.28Å; D185-Y244 PolarHBondContact N-OH 3.11Å; D185-Y244 PolarHBondContact O-OH 3.25Å
186	P	85.7	Confident	83.8	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.3	-179.8	-28.6	36	0	0	0	115	R192 W240 L243 Y244	P186-R192 VanDerWaalsContact O-CZ 3.32Å; P186-R192 PolarHBondContact O-NE 2.96Å; P186-R192 PolarHBondContact O-NH2 3.2Å; P186-W240 HydrophobicContact CG-CH2 4Å; P186-W240 HydrophobicContact CG-CZ3 4.02Å; P186-L243 HydrophobicContact CB-CB 4.46Å; P186-L243 HydrophobicContact CG-CD1 4.32Å; P186-Y244 WeakPolarHBondContact CA-OH 3.47Å; P186-Y244 HydrophobicContact CB-CE2 4.47Å; P186-Y244 HydrophobicContact CG-CE2 4.25Å; P186-Y244 VanDerWaalsContact N-OH 3.07Å
187	A	83.5	Confident	83.8	Confident	29 Å²	29	34.6 Å²	34.6	24%	0.24	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-17.5	177.1	0	0	0	0	0	113.3	D185 I189 S220	D185-A187 PolarHBondContact O-N 3.02Å; D185-A187 WeakPolarHBondContact OD1-CB 3.35Å; D185-A187 PolarHBondContact OD1-N 2.98Å; A187-I189 PolarHBondContact O-N 2.8Å; A187-S220 WeakPolarHBondContact CB-OG 3.46Å; A187-S220 PolarHBondContact N-OG 3.43Å
188	C	81.8	Confident	84.1	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.02	14%	0.139	C	C	.	.			trans	-78	120.4	-177.4	174.5	0	0	0	0	111.7	D185 N190 C191 R192 I215 T287	D185-C188 HydrophobicContact CB-CB 3.95Å; D185-C188 WeakPolarHBondContact O-CB 3.34Å; D185-C188 PolarHBondContact O-N 3.09Å; C188-N190 VanDerWaalsContact C-N 3.29Å; C188-N190 PolarHBondContact O-N 2.92Å; C188-N190 PolarHBondContact SG-N 3.33Å; C188-C191 HydrophobicContact CB-CB 3.88Å; C188-C191 WeakPolarHBondContact CB-SG 3.34Å; C188-C191 WeakPolarHBondContact O-CB 3.41Å; C188-C191 PolarHBondContact O-N 2.72Å; C188-C191 PolarHBondContact SG-N 2.82Å; C188-C191 VanDerWaalsContact SG-N 3.42Å; C188-R192 WeakPolarHBondContact O-CG 3.06Å; C188-R192 PolarHBondContact O-N 3.18Å; C188-R192 VanDerWaalsContact O-N 3.17Å; C188-I215 HydrophobicContact CB-CB 4.33Å; C188-I215 HydrophobicContact CB-CD1 3.94Å; C188-T287 WeakPolarHBondContact CB-OG1 3.48Å; C188-T287 PolarHBondContact SG-O 2.91Å; C188-T287 PolarHBondContact SG-OG1 3.08Å
189	I	79.7	Confident	84.3	Confident	116 Å²	116	28 Å²	28	60%	0.595	15%	0.147	S	C	*	.	H	α-helix	trans	-58.9	-39	178.5	-159.8	70.5	0	0	0	112.2	A187 C191 R192 L193	A187-I189 PolarHBondContact O-N 2.8Å; I189-C191 VanDerWaalsContact C-N 3.34Å; I189-C191 PolarHBondContact O-N 2.66Å; I189-R192 PolarHBondContact O-N 2.71Å; I189-L193 WeakPolarHBondContact O-CG 3.45Å; I189-L193 PolarHBondContact O-N 2.92Å; I189-L193 VanDerWaalsContact O-N 3.1Å
190	N	79.8	Confident	84.1	Confident	63 Å²	63	30.3 Å²	30.3	34%	0.337	16%	0.156	S	C	.	.	H	α-helix	trans	-70.2	-28	175.9	-77.7	-49	0	0	0	112.8	C188 R192 L194 P288 K304	C188-N190 VanDerWaalsContact C-N 3.29Å; C188-N190 PolarHBondContact O-N 2.92Å; C188-N190 PolarHBondContact SG-N 3.33Å; N190-R192 VanDerWaalsContact C-N 3.34Å; N190-L194 PolarHBondContact O-N 3.33Å; N190-P288 VanDerWaalsContact CB-CD 3.46Å; N190-P288 HydrophobicContact CB-CG 4.48Å; N190-K304 PolarHBondContact OD1-NZ 3.4Å
191	C	86.6	Confident	83.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69	-35.8	172.7	-65.6	0	0	0	0	110.9	L184 D185 C188 I189 L194 E195 Y244 P288	L184-C191 HydrophobicContact CD2-CB 4.23Å; D185-C191 PolarHBondContact N-SG 2.67Å; D185-C191 VanDerWaalsContact O-CB 3.3Å; D185-C191 WeakPolarHBondContact O-CB 3.49Å; C188-C191 HydrophobicContact CB-CB 3.88Å; C188-C191 WeakPolarHBondContact CB-SG 3.34Å; C188-C191 WeakPolarHBondContact O-CB 3.41Å; C188-C191 PolarHBondContact O-N 2.72Å; C188-C191 PolarHBondContact SG-N 2.82Å; C188-C191 VanDerWaalsContact SG-N 3.42Å; I189-C191 VanDerWaalsContact C-N 3.34Å; I189-C191 PolarHBondContact O-N 2.66Å; C191-L194 PolarHBondContact O-N 3.29Å; C191-E195 PolarHBondContact O-N 2.87Å; C191-Y244 HydrophobicContact CB-CE1 3.81Å; C191-P288 HydrophobicContact CB-CB 4.46Å; C191-P288 VanDerWaalsContact SG-CB 3.57Å
192	R	80.6	Confident	83.7	Confident	68 Å²	68	31.2 Å²	31.2	26%	0.257	16%	0.163	S	C	.	.	H	α-helix	trans	-67.9	-41.5	175.4	-45.7	-147	-172.5	119.4	21.2	112.4	P186 C188 I189 N190 L194 E195 P196 Y244 M250	P186-R192 VanDerWaalsContact O-CZ 3.32Å; P186-R192 PolarHBondContact O-NE 2.96Å; P186-R192 PolarHBondContact O-NH2 3.2Å; C188-R192 WeakPolarHBondContact O-CG 3.06Å; C188-R192 PolarHBondContact O-N 3.18Å; C188-R192 VanDerWaalsContact O-N 3.17Å; I189-R192 PolarHBondContact O-N 2.71Å; N190-R192 VanDerWaalsContact C-N 3.34Å; R192-L194 PolarHBondContact O-N 2.58Å; R192-L194 VanDerWaalsContact O-N 3.16Å; R192-E195 PolarHBondContact O-N 3.19Å; R192-P196 WeakPolarHBondContact O-CD 3.27Å; R192-Y244 HydrophobicContact CB-CD1 4.04Å; R192-Y244 HydrophobicContact CG-CD1 3.71Å; R192-Y244 HydrophobicContact CG-CE1 3.98Å; R192-M250 VanDerWaalsContact CZ-SD 3.55Å; R192-M250 PolarHBondContact NH2-SD 3.35Å
193	L	77.6	Confident	83.4	Confident	101 Å²	101	40.7 Å²	40.7	53%	0.529	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.2	172.4	-65.4	172.8	0	0	0	113.4	I189	I189-L193 WeakPolarHBondContact O-CG 3.45Å; I189-L193 PolarHBondContact O-N 2.92Å; I189-L193 VanDerWaalsContact O-N 3.1Å
194	L	80.7	Confident	82.9	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-16.2	177.4	-139.6	85.8	0	0	0	113.9	L184 N190 C191 R192 A197 L198 P288 V290 L303 K304	L184-L194 HydrophobicContact CD2-CD2 4.37Å; N190-L194 PolarHBondContact O-N 3.33Å; C191-L194 PolarHBondContact O-N 3.29Å; R192-L194 PolarHBondContact O-N 2.58Å; R192-L194 VanDerWaalsContact O-N 3.16Å; L194-A197 PolarHBondContact O-N 3.1Å; L194-L198 HydrophobicContact CD2-CD1 4.08Å; L194-L198 HydrophobicContact CD2-CG 4.31Å; L194-L198 PolarHBondContact O-N 3.44Å; L194-P288 HydrophobicContact CB-CG 4.14Å; L194-P288 HydrophobicContact CD1-CG 4.07Å; L194-P288 HydrophobicContact CD2-CB 3.82Å; L194-P288 HydrophobicContact CD2-CG 3.71Å; L194-P288 HydrophobicContact CG-CG 4.2Å; L194-V290 HydrophobicContact CD2-CG2 3.63Å; L194-L303 HydrophobicContact CD1-CB 3.76Å; L194-L303 HydrophobicContact CD2-CD1 3.95Å; L194-L303 HydrophobicContact CG-CB 4.21Å; L194-K304 HydrophobicContact CD1-CG 4.36Å
195	E	81.7	Confident	82.7	Confident	17 Å²	17	45.8 Å²	45.8	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-44.2	-174.6	-170.7	-92.8	178.1	0	0	112.8	C191 R192 A197 L198 K199 H241 Y244	C191-E195 PolarHBondContact O-N 2.87Å; R192-E195 PolarHBondContact O-N 3.19Å; E195-A197 VanDerWaalsContact C-N 3.34Å; E195-A197 PolarHBondContact O-N 2.82Å; E195-L198 PolarHBondContact O-N 3.4Å; E195-K199 WeakPolarHBondContact O-CB 3.48Å; E195-K199 PolarHBondContact O-N 3.29Å; E195-K199 WeakPolarHBondContact OE1-CE 3.41Å; E195-K199 IonicContact OE1-NZ 2.78Å; E195-K199 PolarHBondContact OE1-NZ 2.85Å; E195-K199 IonicContact OE2-NZ 3.16Å; E195-H241 IonicContact OE1-CE1 2.74Å; E195-H241 IonicContact OE1-CG 3.71Å; E195-H241 IonicContact OE1-ND1 3.38Å; E195-H241 PolarHBondContact OE1-ND1 2.9Å; E195-Y244 HydrophobicContact CB-CD1 4.1Å; E195-Y244 HydrophobicContact CB-CG 4.12Å; E195-Y244 HydrophobicContact CG-CD1 4.38Å; E195-Y244 HydrophobicContact CG-CD2 4.4Å; E195-Y244 HydrophobicContact CG-CG 3.89Å
196	P	81.3	Confident	82.7	Confident	64 Å²	64	46.2 Å²	46.2	42%	0.416	23%	0.225	S	C	.	.	H	α-helix	trans	-60	-41.1	175.2	-25.4	35.5	0	0	0	113.1	R192 K199 Q200	R192-P196 WeakPolarHBondContact O-CD 3.27Å; P196-K199 VanDerWaalsContact O-CB 3.24Å; P196-K199 WeakPolarHBondContact O-CB 3.49Å; P196-K199 PolarHBondContact O-N 2.88Å; P196-Q200 PolarHBondContact O-N 2.77Å
197	A	81.5	Confident	82.8	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.025	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-43.6	179.5	0	0	0	0	0	112.3	L194 E195 K199 Q200 L201 L303 A306	L194-A197 PolarHBondContact O-N 3.1Å; E195-A197 VanDerWaalsContact C-N 3.34Å; E195-A197 PolarHBondContact O-N 2.82Å; A197-K199 VanDerWaalsContact C-N 3.29Å; A197-K199 PolarHBondContact O-N 3.49Å; A197-Q200 PolarHBondContact O-N 3.22Å; A197-L201 WeakPolarHBondContact O-CB 3.45Å; A197-L201 WeakPolarHBondContact O-CG 3.44Å; A197-L201 PolarHBondContact O-N 2.99Å; A197-L303 WeakPolarHBondContact CB-O 3.43Å; A197-A306 HydrophobicContact CB-CB 3.87Å
198	L	85.8	Confident	83.2	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-65.2	-33.2	173.9	-72	174.7	0	0	0	112.2	A182 L184 L194 E195 A202 V207 V290	A182-L198 HydrophobicContact CB-CD1 3.75Å; A182-L198 HydrophobicContact CB-CD2 4.21Å; L184-L198 HydrophobicContact CD1-CD1 3.68Å; L184-L198 HydrophobicContact CD2-CD1 4.06Å; L184-L198 HydrophobicContact CG-CD1 4.32Å; L194-L198 HydrophobicContact CD2-CD1 4.08Å; L194-L198 HydrophobicContact CD2-CG 4.31Å; L194-L198 PolarHBondContact O-N 3.44Å; E195-L198 PolarHBondContact O-N 3.4Å; L198-A202 VanDerWaalsContact O-CB 3.26Å; L198-A202 WeakPolarHBondContact O-CB 3.47Å; L198-A202 PolarHBondContact O-N 3.03Å; L198-V207 HydrophobicContact CB-CG1 4.44Å; L198-V207 HydrophobicContact CD2-CG1 4.22Å; L198-V290 HydrophobicContact CD2-CG1 4.35Å; L198-V290 HydrophobicContact CD2-CG2 4.33Å
199	K	82.8	Confident	83.6	Confident	88 Å²	88	45 Å²	45	38%	0.383	22%	0.215	S	C	.	.	H	α-helix	trans	-66.4	-34.2	173.8	-135.7	167.1	-168.1	152.5	0	113	E195 P196 A197 H241	E195-K199 WeakPolarHBondContact O-CB 3.48Å; E195-K199 PolarHBondContact O-N 3.29Å; E195-K199 WeakPolarHBondContact OE1-CE 3.41Å; E195-K199 IonicContact OE1-NZ 2.78Å; E195-K199 PolarHBondContact OE1-NZ 2.85Å; E195-K199 IonicContact OE2-NZ 3.16Å; P196-K199 VanDerWaalsContact O-CB 3.24Å; P196-K199 WeakPolarHBondContact O-CB 3.49Å; P196-K199 PolarHBondContact O-N 2.88Å; A197-K199 VanDerWaalsContact C-N 3.29Å; A197-K199 PolarHBondContact O-N 3.49Å; K199-H241 VanDerWaalsContact CE-CE1 3.48Å; K199-H241 WeakPolarHBondContact CE-CE1 3.26Å; K199-H241 WeakPolarHBondContact CE-ND1 3.45Å; K199-H241 PolarHBondContact NZ-ND1 2.89Å
200	Q	81.1	Confident	84.1	Confident	75 Å²	75	39.6 Å²	39.6	35%	0.35	19%	0.187	S	C	.	.	H	α-helix	trans	-75.4	-47.5	175.4	-172.5	173.9	-32	0	0	110.8	P196 A197 A202 R203 A306	P196-Q200 PolarHBondContact O-N 2.77Å; A197-Q200 PolarHBondContact O-N 3.22Å; Q200-A202 PolarHBondContact O-N 2.69Å; Q200-R203 WeakPolarHBondContact O-CB 3.44Å; Q200-R203 WeakPolarHBondContact O-CG 3.42Å; Q200-R203 PolarHBondContact O-N 2.81Å; Q200-R203 VanDerWaalsContact O-N 3.07Å; Q200-A306 PolarHBondContact NE2-O 3.22Å; Q200-A306 PolarHBondContact OE1-O 3.39Å
201	L	82.4	Confident	84.6	Confident	7 Å²	7	36.7 Å²	36.7	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-62.2	-27.8	174.8	-72.3	166.1	0	0	0	112.9	L180 A197 R203 E204 F205 V207 L303 V311	L180-L201 HydrophobicContact CD1-CB 4.28Å; L180-L201 HydrophobicContact CD1-CD1 4.19Å; A197-L201 WeakPolarHBondContact O-CB 3.45Å; A197-L201 WeakPolarHBondContact O-CG 3.44Å; A197-L201 PolarHBondContact O-N 2.99Å; L201-R203 PolarHBondContact O-N 3.02Å; L201-E204 PolarHBondContact O-N 2.96Å; L201-F205 HydrophobicContact CB-CD2 4.25Å; L201-F205 HydrophobicContact CD2-CD2 3.68Å; L201-F205 HydrophobicContact CD2-CE2 3.77Å; L201-F205 PolarHBondContact O-N 3.35Å; L201-V207 HydrophobicContact CB-CG2 4.47Å; L201-L303 HydrophobicContact CD1-CD2 3.43Å; L201-L303 VanDerWaalsContact CD1-CD2 3.43Å; L201-V311 HydrophobicContact CD2-CB 4.45Å; L201-V311 HydrophobicContact CD2-CG2 4.23Å
202	A	86.2	Confident	84.7	Confident	16 Å²	16	36.7 Å²	36.7	13%	0.132	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-5	172.9	0	0	0	0	0	114.5	L172 S173 L198 Q200 F205 V207	L172-A202 HydrophobicContact CB-CB 4.17Å; S173-A202 WeakPolarHBondContact CB-O 3.28Å; S173-A202 WeakPolarHBondContact OG-CA 3.22Å; S173-A202 PolarHBondContact OG-O 2.93Å; L198-A202 VanDerWaalsContact O-CB 3.26Å; L198-A202 WeakPolarHBondContact O-CB 3.47Å; L198-A202 PolarHBondContact O-N 3.03Å; Q200-A202 PolarHBondContact O-N 2.69Å; A202-F205 WeakPolarHBondContact CA-O 3.46Å; A202-V207 HydrophobicContact CB-CB 4.24Å; A202-V207 HydrophobicContact CB-CG2 4.03Å
203	R	83.4	Confident	85.2	Confident	199 Å²	199	33.9 Å²	33.9	75%	0.751	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-18.3	170.7	-59.4	177.8	177.6	-177.6	-1.1	113.9	H176 Q200 L201	H176-R203 VanDerWaalsContact CE1-C 3.45Å; H176-R203 PolarHBondContact CE1-O 3.21Å; Q200-R203 WeakPolarHBondContact O-CB 3.44Å; Q200-R203 WeakPolarHBondContact O-CG 3.42Å; Q200-R203 PolarHBondContact O-N 2.81Å; Q200-R203 VanDerWaalsContact O-N 3.07Å; L201-R203 PolarHBondContact O-N 3.02Å
204	E	80.8	Confident	85.5	Confident	96 Å²	96	31.6 Å²	31.6	45%	0.449	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-25.3	-172.4	-68.7	170.5	-167.1	0	0	111.9	H176 L201	H176-E204 WeakPolarHBondContact CB-O 3.3Å; H176-E204 VanDerWaalsContact ND1-C 3.31Å; H176-E204 PolarHBondContact ND1-O 2.93Å; L201-E204 PolarHBondContact O-N 2.96Å
205	F	84.8	Confident	85.5	Confident	13 Å²	13	36.3 Å²	36.3	6%	0.057	18%	0.177	C	C	.	.	S	Bend	trans	-130.8	149.5	-174.8	-57	-81.8	0	0	0	110.7	S173 H176 R178 L180 L201 A202 V207 I316	S173-F205 PolarHBondContact OG-O 2.92Å; H176-F205 PolarHBondContact CD2-O 3.38Å; R178-F205 HydrophobicContact CB-CD1 3.66Å; R178-F205 HydrophobicContact CB-CE1 4.03Å; L180-F205 HydrophobicContact CD1-CB 3.86Å; L180-F205 HydrophobicContact CD1-CD2 4.38Å; L180-F205 HydrophobicContact CD1-CG 4.05Å; L180-F205 HydrophobicContact CG-CB 3.94Å; L180-F205 HydrophobicContact CG-CG 4.32Å; L201-F205 HydrophobicContact CB-CD2 4.25Å; L201-F205 HydrophobicContact CD2-CD2 3.68Å; L201-F205 HydrophobicContact CD2-CE2 3.77Å; L201-F205 PolarHBondContact O-N 3.35Å; A202-F205 WeakPolarHBondContact CA-O 3.46Å; F205-V207 PolarHBondContact O-N 3.2Å; F205-I316 HydrophobicContact CD1-CG2 4.34Å; F205-I316 HydrophobicContact CE1-CB 4.39Å; F205-I316 HydrophobicContact CE1-CD1 3.92Å; F205-I316 HydrophobicContact CE1-CG2 3.66Å; F205-I316 HydrophobicContact CE2-CD1 3.77Å; F205-I316 HydrophobicContact CZ-CB 4.47Å; F205-I316 HydrophobicContact CZ-CD1 3.42Å; F205-I316 VanDerWaalsContact CZ-CD1 3.42Å; F205-I316 HydrophobicContact CZ-CG2 4.21Å
206	S	87.8	Confident	85.4	Confident	9 Å²	9	36.1 Å²	36.1	6%	0.063	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	102.9	174	-60.5	0	0	0	0	109.1	S173 G175 H176 R178 T179 L180	S173-S206 WeakPolarHBondContact OG-CA 3.4Å; G175-S206 PolarHBondContact N-OG 3.06Å; H176-S206 PolarHBondContact N-OG 3.49Å; H176-S206 PolarHBondContact O-OG 3.25Å; H176-S206 VanDerWaalsContact O-OG 3.13Å; R178-S206 PolarHBondContact O-N 3.25Å; T179-S206 CarbonylContact C-O 3.55Å; T179-S206 VanDerWaalsContact CA-O 3.26Å; T179-S206 WeakPolarHBondContact CA-O 3.41Å; T179-S206 VanDerWaalsContact CG2-O 3.31Å; T179-S206 WeakPolarHBondContact CG2-O 3.44Å; L180-S206 PolarHBondContact N-O 2.85Å
207	V	89.3	Confident	85.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	119	-173.8	176.7	0	0	0	0	110.6	L172 S173 L180 L198 L201 A202 F205 I209	L172-V207 HydrophobicContact CB-CB 4.24Å; L172-V207 HydrophobicContact CB-CG1 4.38Å; L172-V207 HydrophobicContact CD1-CG1 4.13Å; L172-V207 HydrophobicContact CG-CG1 4.37Å; L172-V207 PolarHBondContact N-O 3.08Å; S173-V207 PolarHBondContact O-N 3Å; S173-V207 PolarHBondContact OG-N 2.89Å; L180-V207 HydrophobicContact CB-CG2 4.35Å; L180-V207 HydrophobicContact CD1-CG2 4.36Å; L198-V207 HydrophobicContact CB-CG1 4.44Å; L198-V207 HydrophobicContact CD2-CG1 4.22Å; L201-V207 HydrophobicContact CB-CG2 4.47Å; A202-V207 HydrophobicContact CB-CB 4.24Å; A202-V207 HydrophobicContact CB-CG2 4.03Å; F205-V207 PolarHBondContact O-N 3.2Å; V207-I209 HydrophobicContact CG1-CG1 4.36Å
208	V	90.6	Very high	85.7	Confident	7 Å²	7	40 Å²	40	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.2	-178.7	177.7	0	0	0	0	109.8	A163 T169 T179 L180 Y181 A182 Y210	A163-V208 HydrophobicContact CB-CG1 3.85Å; A163-V208 HydrophobicContact CB-CG2 4.44Å; T169-V208 HydrophobicContact CG2-CG1 3.8Å; T179-V208 HydrophobicContact CG2-CG2 4.13Å; L180-V208 PolarHBondContact O-N 2.98Å; Y181-V208 CarbonylContact C-O 3.25Å; Y181-V208 WeakPolarHBondContact CA-O 3.4Å; Y181-V208 HydrophobicContact CD1-CB 4.05Å; Y181-V208 HydrophobicContact CD1-CG1 4.37Å; Y181-V208 HydrophobicContact CE1-CB 4.48Å; A182-V208 PolarHBondContact N-O 3.2Å; V208-Y210 HydrophobicContact CG1-CE2 4.22Å
209	I	90.7	Very high	85.6	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.2	-174.5	-63.2	175.3	0	0	0	110.8	T169 I170 L172 A182 L184 V207 P211 W240	T169-I209 CarbonylContact C-O 3.56Å; T169-I209 VanDerWaalsContact CA-O 3.25Å; T169-I209 WeakPolarHBondContact CA-O 3.44Å; T169-I209 WeakPolarHBondContact CB-O 3.17Å; I170-I209 HydrophobicContact CB-CB 4.33Å; I170-I209 PolarHBondContact N-O 2.83Å; I170-I209 WeakPolarHBondContact O-CB 3.22Å; I170-I209 PolarHBondContact O-N 2.98Å; L172-I209 HydrophobicContact CD1-CD1 3.59Å; L172-I209 HydrophobicContact CD2-CD1 4.02Å; L172-I209 HydrophobicContact CG-CD1 3.62Å; L172-I209 HydrophobicContact CG-CG1 4.38Å; A182-I209 HydrophobicContact CB-CG1 4.28Å; A182-I209 CarbonylContact O-C 3.49Å; A182-I209 WeakPolarHBondContact O-CA 3.49Å; L184-I209 HydrophobicContact CB-CG2 4.26Å; L184-I209 HydrophobicContact CD1-CD1 3.82Å; L184-I209 HydrophobicContact CD1-CG1 4.15Å; L184-I209 HydrophobicContact CD1-CG2 3.91Å; L184-I209 HydrophobicContact CG-CG2 4.24Å; V207-I209 HydrophobicContact CG1-CG1 4.36Å; I209-P211 WeakPolarHBondContact O-CD 3.09Å; I209-W240 VanDerWaalsContact CD1-NE1 3.33Å; I209-W240 HydrophobicContact CG2-CH2 4.34Å; I209-W240 HydrophobicContact CG2-CZ2 3.56Å
210	Y	90.5	Very high	85.7	Confident	3 Å²	3	38.4 Å²	38.4	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	96.6	170.8	-77.5	-85.9	0	0	0	108.7	L159 N162 A163 T169 Y181 A182 F183 L184 V208 V212	L159-Y210 HydrophobicContact CB-CE2 4.34Å; L159-Y210 HydrophobicContact CD2-CE1 4.39Å; L159-Y210 HydrophobicContact CD2-CE2 4.13Å; L159-Y210 PolarHBondContact O-OH 3.27Å; N162-Y210 HydrophobicContact CB-CE1 4.34Å; N162-Y210 WeakPolarHBondContact CB-OH 3.13Å; A163-Y210 PolarHBondContact N-OH 3.27Å; T169-Y210 HydrophobicContact CG2-CD1 3.86Å; T169-Y210 HydrophobicContact CG2-CD2 4.37Å; T169-Y210 HydrophobicContact CG2-CE1 3.39Å; T169-Y210 HydrophobicContact CG2-CE2 3.95Å; T169-Y210 HydrophobicContact CG2-CG 4.32Å; T169-Y210 VanDerWaalsContact CG2-CZ 3.42Å; Y181-Y210 AromaticContact CD1-CE2 3.91Å; Y181-Y210 HydrophobicContact CD1-CE2 3.91Å; Y181-Y210 HydrophobicContact CG-CE2 4.33Å; A182-Y210 PolarHBondContact O-N 3.19Å; F183-Y210 WeakPolarHBondContact CA-O 3.27Å; F183-Y210 VanDerWaalsContact CD1-CB 3.49Å; F183-Y210 HydrophobicContact CD1-CG 4.33Å; F183-Y210 HydrophobicContact CE1-CD1 4.31Å; F183-Y210 AromaticContact CE1-CG 3.92Å; F183-Y210 HydrophobicContact CE1-CG 3.92Å; F183-Y210 HydrophobicContact CE2-CD2 4.4Å; F183-Y210 HydrophobicContact CE2-CG 4.48Å; F183-Y210 HydrophobicContact CZ-CD1 4.46Å; F183-Y210 HydrophobicContact CZ-CD2 4.28Å; F183-Y210 AromaticContact CZ-CG 3.99Å; F183-Y210 HydrophobicContact CZ-CG 3.99Å; L184-Y210 PolarHBondContact N-O 3.07Å; V208-Y210 HydrophobicContact CG1-CE2 4.22Å; Y210-V212 PolarHBondContact O-N 3.39Å
211	P	89.9	Confident	85.9	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	133.9	-179.5	24.2	-32.5	0	0	0	111.7	I209 T224 L228 W240 N275	I209-P211 WeakPolarHBondContact O-CD 3.09Å; P211-T224 HydrophobicContact CB-CG2 3.54Å; P211-T224 HydrophobicContact CG-CG2 3.97Å; P211-L228 HydrophobicContact CG-CD1 4.1Å; P211-L228 HydrophobicContact CG-CD2 4.06Å; P211-L228 HydrophobicContact CG-CG 4.4Å; P211-W240 HydrophobicContact CB-CH2 3.75Å; P211-W240 HydrophobicContact CB-CZ3 3.89Å; P211-N275 WeakPolarHBondContact O-CB 3.27Å; P211-N275 PolarHBondContact O-ND2 3.48Å
212	V	89.7	Confident	86	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	21%	0.209	C	C	.	.			trans	-128.8	165.2	176.4	-72	0	0	0	0	110.8	F183 L184 D185 Y210 V214 N275 N276 F279 T287	F183-V212 HydrophobicContact CB-CG2 4.41Å; F183-V212 HydrophobicContact CD1-CG1 3.84Å; L184-V212 VanDerWaalsContact C-CG2 3.49Å; L184-V212 VanDerWaalsContact O-CG2 3.32Å; L184-V212 WeakPolarHBondContact O-CG2 3.36Å; L184-V212 PolarHBondContact O-N 2.85Å; D185-V212 WeakPolarHBondContact CA-O 3.26Å; D185-V212 HydrophobicContact CB-CG2 4.28Å; D185-V212 WeakPolarHBondContact CB-O 3.4Å; Y210-V212 PolarHBondContact O-N 3.39Å; V212-V214 HydrophobicContact CB-CG2 4.35Å; V212-N275 HydrophobicContact CG1-CB 3.81Å; V212-N276 WeakPolarHBondContact CB-OD1 3.44Å; V212-F279 HydrophobicContact CG1-CB 4.07Å; V212-T287 HydrophobicContact CG2-CG2 3.98Å
213	S	89.7	Confident	85.8	Confident	8 Å²	8	43.5 Å²	43.5	6%	0.056	22%	0.217	C	C	.	.			trans	-135.9	36.1	-176.5	67.4	0	0	0	0	112	D185 G217 T221 N276	D185-S213 VanDerWaalsContact OD2-CA 3.27Å; D185-S213 WeakPolarHBondContact OD2-CA 3.42Å; S213-G217 WeakPolarHBondContact CB-O 3.37Å; S213-G217 WeakPolarHBondContact O-CA 3.3Å; S213-G217 PolarHBondContact O-N 2.8Å; S213-T221 WeakPolarHBondContact CB-OG1 3.36Å; S213-T221 PolarHBondContact OG-OG1 3.13Å; S213-T221 VanDerWaalsContact OG-OG1 3.13Å; S213-N276 PolarHBondContact N-OD1 2.78Å; S213-N276 PolarHBondContact OG-ND2 3.02Å
214	V	83.7	Confident	86	Confident	54 Å²	54	34.1 Å²	34.1	33%	0.327	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-27.8	-175	178.5	0	0	0	0	113.2	D185 V212 N276 F279 T287	D185-V214 PolarHBondContact OD2-N 2.71Å; V212-V214 HydrophobicContact CB-CG2 4.35Å; V214-N276 WeakPolarHBondContact CG2-OD1 3.26Å; V214-F279 HydrophobicContact CB-CE1 4.44Å; V214-F279 HydrophobicContact CG1-CE1 4.16Å; V214-F279 HydrophobicContact CG2-CD1 3.7Å; V214-F279 HydrophobicContact CG2-CE1 4.05Å; V214-F279 HydrophobicContact CG2-CG 4.41Å; V214-T287 HydrophobicContact CB-CG2 4.31Å
215	I	82.4	Confident	86.3	Confident	100 Å²	100	29.6 Å²	29.6	51%	0.513	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-42.5	176.3	-66.2	-169.3	0	0	0	110.9	D185 C188 G217 T287	D185-I215 WeakPolarHBondContact OD2-CA 3.47Å; D185-I215 PolarHBondContact OD2-N 3.3Å; C188-I215 HydrophobicContact CB-CB 4.33Å; C188-I215 HydrophobicContact CB-CD1 3.94Å; I215-G217 VanDerWaalsContact C-N 3.33Å; I215-T287 WeakPolarHBondContact CD1-OG1 3.43Å
216	G	79.4	Confident	86.3	Confident	12 Å²	12	32.2 Å²	32.2	12%	0.124	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-15	-179.9	0	0	0	0	0	114.8	D185 E218 S219 S220	D185-G216 PolarHBondContact OD2-N 3.16Å; G216-E218 PolarHBondContact O-N 3.33Å; G216-S219 WeakPolarHBondContact O-CB 3.39Å; G216-S219 PolarHBondContact O-N 3.16Å; G216-S219 PolarHBondContact O-OG 2.83Å; G216-S220 PolarHBondContact O-N 3Å
217	G	85.4	Confident	86.2	Confident	32 Å²	32	32.8 Å²	32.8	33%	0.33	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	-138.6	-174.5	0	0	0	0	0	111.6	S213 I215 S219 S220 T221	S213-G217 WeakPolarHBondContact CB-O 3.37Å; S213-G217 WeakPolarHBondContact O-CA 3.3Å; S213-G217 PolarHBondContact O-N 2.8Å; I215-G217 VanDerWaalsContact C-N 3.33Å; G217-S219 PolarHBondContact O-N 3.37Å; G217-S220 PolarHBondContact O-N 2.87Å; G217-S220 VanDerWaalsContact O-N 3.16Å; G217-T221 PolarHBondContact O-N 3.27Å; G217-T221 VanDerWaalsContact O-N 3.15Å; G217-T221 PolarHBondContact O-OG1 3.18Å
218	E	84.1	Confident	86.1	Confident	117 Å²	117	33.2 Å²	33.2	55%	0.547	18%	0.183	S	C	.	.	H	α-helix	trans	-60.6	-20	179.9	-143.3	-163.7	153	0	0	113.8	G216 K222	G216-E218 PolarHBondContact O-N 3.33Å; E218-K222 VanDerWaalsContact CD-CE 3.5Å; E218-K222 HydrophobicContact CG-CD 4.48Å; E218-K222 VanDerWaalsContact O-CB 3.29Å; E218-K222 WeakPolarHBondContact O-CB 3.45Å; E218-K222 WeakPolarHBondContact O-CD 3.1Å; E218-K222 WeakPolarHBondContact O-CG 3.47Å; E218-K222 PolarHBondContact O-N 2.85Å; E218-K222 WeakPolarHBondContact OE1-CE 3.12Å; E218-K222 IonicContact OE1-NZ 3.91Å; E218-K222 PolarHBondContact OE1-NZ 3.47Å; E218-K222 IonicContact OE2-NZ 2.72Å; E218-K222 PolarHBondContact OE2-NZ 2.87Å; E218-K222 VanDerWaalsContact OE2-NZ 3.08Å
219	S	82.5	Confident	85.8	Confident	56 Å²	56	34.7 Å²	34.7	39%	0.392	19%	0.194	S	C	.	.	H	α-helix	trans	-72.3	-38.7	177.2	78.1	0	0	0	0	112.5	G216 G217 R223	G216-S219 WeakPolarHBondContact O-CB 3.39Å; G216-S219 PolarHBondContact O-N 3.16Å; G216-S219 PolarHBondContact O-OG 2.83Å; G217-S219 PolarHBondContact O-N 3.37Å; S219-R223 WeakPolarHBondContact O-CG 3.46Å; S219-R223 PolarHBondContact O-N 2.68Å
220	S	84.6	Confident	85.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-71	-42.5	170.8	-76.6	0	0	0	0	110.6	D185 A187 G216 G217 K222 R223 T224	D185-S220 WeakPolarHBondContact OD1-CB 3.36Å; D185-S220 PolarHBondContact OD1-OG 3.28Å; A187-S220 WeakPolarHBondContact CB-OG 3.46Å; A187-S220 PolarHBondContact N-OG 3.43Å; G216-S220 PolarHBondContact O-N 3Å; G217-S220 PolarHBondContact O-N 2.87Å; G217-S220 VanDerWaalsContact O-N 3.16Å; S220-K222 VanDerWaalsContact C-N 3.3Å; S220-K222 PolarHBondContact O-N 3.25Å; S220-R223 PolarHBondContact O-N 3.13Å; S220-R223 VanDerWaalsContact O-N 3.08Å; S220-T224 WeakPolarHBondContact O-CB 3.47Å; S220-T224 PolarHBondContact O-N 3.26Å; S220-T224 PolarHBondContact O-OG1 3.08Å
221	T	86.7	Confident	84.9	Confident	14 Å²	14	42.3 Å²	42.3	9%	0.086	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-41.1	176.3	-48.3	0	0	0	0	112.1	S213 G217 R223 A225 R269 I272	S213-T221 WeakPolarHBondContact CB-OG1 3.36Å; S213-T221 PolarHBondContact OG-OG1 3.13Å; S213-T221 VanDerWaalsContact OG-OG1 3.13Å; G217-T221 PolarHBondContact O-N 3.27Å; G217-T221 VanDerWaalsContact O-N 3.15Å; G217-T221 PolarHBondContact O-OG1 3.18Å; T221-R223 VanDerWaalsContact C-N 3.3Å; T221-R223 PolarHBondContact O-N 2.7Å; T221-A225 WeakPolarHBondContact O-CB 3.36Å; T221-A225 PolarHBondContact O-N 3.49Å; T221-R269 HydrophobicContact CG2-CB 4.47Å; T221-R269 HydrophobicContact CG2-CG 3.87Å; T221-I272 HydrophobicContact CG2-CD1 4.08Å; T221-I272 HydrophobicContact CG2-CG2 4.42Å
222	K	84	Confident	84.5	Confident	113 Å²	113	45 Å²	45	49%	0.491	25%	0.253	S	S	.	.	H	α-helix	trans	-64.9	-27.1	176.9	-80.4	165.9	179.7	155.3	0	114.1	E218 S220 P226	E218-K222 VanDerWaalsContact CD-CE 3.5Å; E218-K222 HydrophobicContact CG-CD 4.48Å; E218-K222 VanDerWaalsContact O-CB 3.29Å; E218-K222 WeakPolarHBondContact O-CB 3.45Å; E218-K222 WeakPolarHBondContact O-CD 3.1Å; E218-K222 WeakPolarHBondContact O-CG 3.47Å; E218-K222 PolarHBondContact O-N 2.85Å; E218-K222 WeakPolarHBondContact OE1-CE 3.12Å; E218-K222 IonicContact OE1-NZ 3.91Å; E218-K222 PolarHBondContact OE1-NZ 3.47Å; E218-K222 IonicContact OE2-NZ 2.72Å; E218-K222 PolarHBondContact OE2-NZ 2.87Å; E218-K222 VanDerWaalsContact OE2-NZ 3.08Å; S220-K222 VanDerWaalsContact C-N 3.3Å; S220-K222 PolarHBondContact O-N 3.25Å; K222-P226 WeakPolarHBondContact O-CD 3.35Å
223	R	82.4	Confident	83.9	Confident	77 Å²	77	48.7 Å²	48.7	29%	0.291	28%	0.279	S	S	.	.	H	α-helix	trans	-90	-37.4	178.9	-67.2	172.8	-171.9	165.4	0.8	112.9	S219 S220 T221 L243 M250	S219-R223 WeakPolarHBondContact O-CG 3.46Å; S219-R223 PolarHBondContact O-N 2.68Å; S220-R223 PolarHBondContact O-N 3.13Å; S220-R223 VanDerWaalsContact O-N 3.08Å; T221-R223 VanDerWaalsContact C-N 3.3Å; T221-R223 PolarHBondContact O-N 2.7Å; R223-L243 HydrophobicContact CB-CD2 3.91Å; R223-M250 PolarHBondContact NH1-SD 3.13Å
224	T	86.6	Confident	83.5	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.012	31%	0.31	C	S	.	.	H	α-helix	trans	-83.3	-36	-176.9	-58.9	0	0	0	0	113.3	P211 S220 L227 L228 W240 I272	P211-T224 HydrophobicContact CB-CG2 3.54Å; P211-T224 HydrophobicContact CG-CG2 3.97Å; S220-T224 WeakPolarHBondContact O-CB 3.47Å; S220-T224 PolarHBondContact O-N 3.26Å; S220-T224 PolarHBondContact O-OG1 3.08Å; T224-L227 WeakPolarHBondContact O-CB 3.24Å; T224-L227 PolarHBondContact O-N 2.93Å; T224-L227 VanDerWaalsContact O-N 3.09Å; T224-L228 HydrophobicContact CG2-CD1 4.19Å; T224-L228 HydrophobicContact CG2-CG 4.18Å; T224-L228 PolarHBondContact O-N 2.83Å; T224-W240 HydrophobicContact CG2-CZ3 4Å; T224-I272 HydrophobicContact CG2-CD1 3.73Å; T224-I272 HydrophobicContact CG2-CG1 4.3Å
225	A	87.4	Confident	83.4	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-60.6	-38.9	-176.3	0	0	0	0	0	114	T221 L265 A268 R269 I272	T221-A225 WeakPolarHBondContact O-CB 3.36Å; T221-A225 PolarHBondContact O-N 3.49Å; A225-L265 HydrophobicContact CB-CD2 4.26Å; A225-A268 HydrophobicContact CB-CB 4.03Å; A225-A268 WeakPolarHBondContact O-CB 3.49Å; A225-R269 HydrophobicContact CB-CG 4.11Å; A225-I272 HydrophobicContact CB-CD1 4.19Å
226	P	84.9	Confident	83.5	Confident	69 Å²	69	55.9 Å²	55.9	45%	0.448	30%	0.302	S	S	.	.	H	α-helix	trans	-62	-42.1	171.1	-22.8	34.3	0	0	0	112.6	K222 L228 C229 L265	K222-P226 WeakPolarHBondContact O-CD 3.35Å; P226-L228 PolarHBondContact O-N 2.9Å; P226-C229 WeakPolarHBondContact O-CB 3.42Å; P226-C229 PolarHBondContact O-N 3.42Å; P226-C229 VanDerWaalsContact O-N 3.09Å; P226-L265 HydrophobicContact CG-CD2 4.24Å
227	L	85.8	Confident	83.6	Confident	20 Å²	20	55.9 Å²	55.9	11%	0.105	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-41.3	179.9	-173.4	75.6	0	0	0	111.9	I170 T224 C229 E230 R236 W240 L243	I170-L227 HydrophobicContact CD1-CD2 3.82Å; T224-L227 WeakPolarHBondContact O-CB 3.24Å; T224-L227 PolarHBondContact O-N 2.93Å; T224-L227 VanDerWaalsContact O-N 3.09Å; L227-C229 PolarHBondContact O-N 2.84Å; L227-C229 VanDerWaalsContact O-N 3.13Å; L227-E230 PolarHBondContact O-N 3.1Å; L227-E230 VanDerWaalsContact O-N 3.12Å; L227-R236 WeakPolarHBondContact O-CD 3.38Å; L227-R236 VanDerWaalsContact O-CG 3.24Å; L227-R236 WeakPolarHBondContact O-CG 3.2Å; L227-W240 HydrophobicContact CD2-CB 3.85Å; L227-W240 HydrophobicContact CD2-CD2 4.49Å; L227-W240 HydrophobicContact CD2-CE3 3.77Å; L227-L243 HydrophobicContact CD2-CD1 4.02Å
228	L	86.5	Confident	83.5	Confident	10 Å²	10	57.9 Å²	57.9	5%	0.052	31%	0.307	C	S	.	.	H	α-helix	trans	-60.5	-21.5	176	-76.9	177.9	0	0	0	113.6	F168 I170 P211 T224 P226 A268 I272	F168-L228 HydrophobicContact CB-CD1 4.33Å; F168-L228 HydrophobicContact CB-CD2 4.4Å; I170-L228 HydrophobicContact CD1-CD2 4.32Å; I170-L228 HydrophobicContact CG1-CD2 4.09Å; P211-L228 HydrophobicContact CG-CD1 4.1Å; P211-L228 HydrophobicContact CG-CD2 4.06Å; P211-L228 HydrophobicContact CG-CG 4.4Å; T224-L228 HydrophobicContact CG2-CD1 4.19Å; T224-L228 HydrophobicContact CG2-CG 4.18Å; T224-L228 PolarHBondContact O-N 2.83Å; P226-L228 PolarHBondContact O-N 2.9Å; L228-A268 HydrophobicContact CB-CB 3.88Å; L228-A268 HydrophobicContact CD1-CB 4.24Å; L228-I272 HydrophobicContact CD1-CD1 3.97Å; L228-I272 HydrophobicContact CD1-CG1 3.78Å
229	C	84.2	Confident	83.5	Confident	38 Å²	38	52.5 Å²	52.5	26%	0.257	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-6.2	177.6	-74.1	0	0	0	0	115	P226 L227 P231 C264	P226-C229 WeakPolarHBondContact O-CB 3.42Å; P226-C229 PolarHBondContact O-N 3.42Å; P226-C229 VanDerWaalsContact O-N 3.09Å; L227-C229 PolarHBondContact O-N 2.84Å; L227-C229 VanDerWaalsContact O-N 3.13Å; C229-P231 WeakPolarHBondContact O-CD 3.27Å; C229-C264 VanDerWaalsContact CA-SG 3.51Å; C229-C264 HydrophobicContact CB-CB 4.17Å; C229-C264 WeakPolarHBondContact CB-SG 3.48Å; C229-C264 WeakPolarHBondContact SG-CB 3.05Å; C229-C264 PolarHBondContact SG-O 2.91Å; C229-C264 VanDerWaalsContact SG-O 3.36Å; C229-C264 CovalentContact SG-SG 2.04Å; C229-C264 PolarHBondContact SG-SG 3.33Å
230	E	83.5	Confident	83.6	Confident	54 Å²	54	49.9 Å²	49.9	25%	0.252	26%	0.264	S	S	.	.			trans	-69.5	120.9	171.7	166.5	61.7	-113.6	0	0	109.3	L227 D232 K235 R236	L227-E230 PolarHBondContact O-N 3.1Å; L227-E230 VanDerWaalsContact O-N 3.12Å; E230-D232 VanDerWaalsContact C-N 3.33Å; E230-D232 HydrophobicContact CG-CB 4.26Å; E230-D232 PolarHBondContact O-N 3.43Å; E230-D232 WeakPolarHBondContact OE1-CB 3.26Å; E230-D232 PolarHBondContact OE1-N 3.36Å; E230-K235 HydrophobicContact CG-CB 3.67Å; E230-K235 HydrophobicContact CG-CD 4.34Å; E230-K235 IonicContact OE1-NZ 3.65Å; E230-K235 PolarHBondContact OE1-NZ 2.93Å; E230-K235 WeakPolarHBondContact OE2-CD 3.32Å; E230-K235 IonicContact OE2-NZ 3.21Å; E230-R236 HydrophobicContact CB-CG 3.84Å; E230-R236 HydrophobicContact CG-CG 4.05Å; E230-R236 WeakPolarHBondContact O-CD 3.49Å; E230-R236 WeakPolarHBondContact O-CG 3.34Å; E230-R236 PolarHBondContact O-NE 2.83Å
231	P	79.8	Confident	83.4	Confident	109 Å²	109	51.8 Å²	51.8	71%	0.708	27%	0.273	S	S	*	.	S	Bend	trans	-64.7	-36	-178.1	23.5	-34.4	0	0	0	113.1	C229 S233 R236	C229-P231 WeakPolarHBondContact O-CD 3.27Å; P231-S233 PolarHBondContact O-N 3.32Å; P231-R236 PolarHBondContact O-NH2 2.87Å
232	D	80.6	Confident	83.1	Confident	57 Å²	57	55.1 Å²	55.1	31%	0.305	29%	0.288	S	S	.	.			trans	-70.6	123.6	-177.1	-176.3	-33.2	0	0	0	111.7	E230 Q234 K235 R236	E230-D232 VanDerWaalsContact C-N 3.33Å; E230-D232 HydrophobicContact CG-CB 4.26Å; E230-D232 PolarHBondContact O-N 3.43Å; E230-D232 WeakPolarHBondContact OE1-CB 3.26Å; E230-D232 PolarHBondContact OE1-N 3.36Å; D232-Q234 WeakPolarHBondContact OD1-CA 3.32Å; D232-Q234 WeakPolarHBondContact OD1-CB 3.43Å; D232-Q234 PolarHBondContact OD1-N 3.14Å; D232-K235 HydrophobicContact CB-CB 3.96Å; D232-K235 HydrophobicContact CB-CD 3.95Å; D232-K235 HydrophobicContact CB-CG 3.96Å; D232-K235 PolarHBondContact OD1-N 2.82Å; D232-K235 WeakPolarHBondContact OD2-CE 3.4Å; D232-K235 IonicContact OD2-NZ 2.79Å; D232-R236 WeakPolarHBondContact O-CB 3.44Å; D232-R236 WeakPolarHBondContact O-CG 3.38Å; D232-R236 PolarHBondContact O-N 2.91Å
233	S	78.1	Confident	82.8	Confident	79 Å²	79	50.2 Å²	50.2	55%	0.552	27%	0.267	S	S	*	.	H	α-helix	trans	-70.3	-34.3	-179.9	52.8	0	0	0	0	113.2	P231 R236 A237	P231-S233 PolarHBondContact O-N 3.32Å; S233-R236 PolarHBondContact O-N 2.95Å; S233-A237 PolarHBondContact O-N 3.36Å
234	Q	80.3	Confident	82.5	Confident	152 Å²	152	47 Å²	47	71%	0.71	26%	0.255	S	S	*	.	H	α-helix	trans	-71.4	-40.2	176.4	-70.7	-168.9	-38.2	0	0	110.9	D232 A237 T238	D232-Q234 WeakPolarHBondContact OD1-CA 3.32Å; D232-Q234 WeakPolarHBondContact OD1-CB 3.43Å; D232-Q234 PolarHBondContact OD1-N 3.14Å; Q234-A237 PolarHBondContact O-N 2.76Å; Q234-T238 VanDerWaalsContact O-CB 3.31Å; Q234-T238 WeakPolarHBondContact O-CB 3.08Å; Q234-T238 PolarHBondContact O-N 2.86Å; Q234-T238 PolarHBondContact O-OG1 3.43Å
235	K	81.2	Confident	81.6	Confident	109 Å²	109	48.9 Å²	48.9	47%	0.474	27%	0.268	S	S	.	.	H	α-helix	trans	-66.4	-37.5	172.4	-66.5	-177.9	-148	143.2	0	112.2	E230 D232 T238 G239	E230-K235 HydrophobicContact CG-CB 3.67Å; E230-K235 HydrophobicContact CG-CD 4.34Å; E230-K235 IonicContact OE1-NZ 3.65Å; E230-K235 PolarHBondContact OE1-NZ 2.93Å; E230-K235 WeakPolarHBondContact OE2-CD 3.32Å; E230-K235 IonicContact OE2-NZ 3.21Å; D232-K235 HydrophobicContact CB-CB 3.96Å; D232-K235 HydrophobicContact CB-CD 3.95Å; D232-K235 HydrophobicContact CB-CG 3.96Å; D232-K235 PolarHBondContact OD1-N 2.82Å; D232-K235 WeakPolarHBondContact OD2-CE 3.4Å; D232-K235 IonicContact OD2-NZ 2.79Å; K235-T238 PolarHBondContact O-N 2.81Å; K235-G239 PolarHBondContact O-N 3.37Å
236	R	85.4	Confident	80.3	Confident	52 Å²	52	53.1 Å²	53.1	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-46.8	172.7	-83.7	-171.1	-75.5	-177.9	-9	112.9	L227 E230 P231 D232 S233 W240	L227-R236 WeakPolarHBondContact O-CD 3.38Å; L227-R236 VanDerWaalsContact O-CG 3.24Å; L227-R236 WeakPolarHBondContact O-CG 3.2Å; E230-R236 HydrophobicContact CB-CG 3.84Å; E230-R236 HydrophobicContact CG-CG 4.05Å; E230-R236 WeakPolarHBondContact O-CD 3.49Å; E230-R236 WeakPolarHBondContact O-CG 3.34Å; E230-R236 PolarHBondContact O-NE 2.83Å; P231-R236 PolarHBondContact O-NH2 2.87Å; D232-R236 WeakPolarHBondContact O-CB 3.44Å; D232-R236 WeakPolarHBondContact O-CG 3.38Å; D232-R236 PolarHBondContact O-N 2.91Å; S233-R236 PolarHBondContact O-N 2.95Å; R236-W240 VanDerWaalsContact O-CB 3.3Å; R236-W240 WeakPolarHBondContact O-CB 3.47Å; R236-W240 PolarHBondContact O-N 3.21Å
237	A	82.4	Confident	79.1	Confident	13 Å²	13	57.2 Å²	57.2	11%	0.107	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-44.2	174.4	0	0	0	0	0	111.8	L172 S233 Q234 W240 H241	L172-A237 HydrophobicContact CD2-CB 4.12Å; S233-A237 PolarHBondContact O-N 3.36Å; Q234-A237 PolarHBondContact O-N 2.76Å; A237-W240 WeakPolarHBondContact O-CB 3.3Å; A237-W240 PolarHBondContact O-N 3.01Å; A237-H241 PolarHBondContact O-CD2 3.25Å; A237-H241 PolarHBondContact O-N 2.9Å
238	T	83.2	Confident	77.5	Confident	74 Å²	74	58.1 Å²	58.1	45%	0.454	33%	0.329	S	S	.	.	H	α-helix	trans	-63.4	-48.3	179.7	-56.7	0	0	0	0	112.3	Q234 K235 W240 H241 Q242	Q234-T238 VanDerWaalsContact O-CB 3.31Å; Q234-T238 WeakPolarHBondContact O-CB 3.08Å; Q234-T238 PolarHBondContact O-N 2.86Å; Q234-T238 PolarHBondContact O-OG1 3.43Å; K235-T238 PolarHBondContact O-N 2.81Å; T238-W240 VanDerWaalsContact C-N 3.31Å; T238-W240 PolarHBondContact O-N 2.92Å; T238-H241 WeakPolarHBondContact O-CB 3.41Å; T238-H241 PolarHBondContact O-N 2.88Å; T238-Q242 WeakPolarHBondContact O-CG 3.41Å; T238-Q242 PolarHBondContact O-N 3.38Å
239	G	83.4	Confident	75.9	Confident	4 Å²	4	60.4 Å²	60.4	4%	0.041	36%	0.355	C	S	.	.	H	α-helix	trans	-66.5	-31.2	176.3	0	0	0	0	0	112.6	K235 Q242 L243	K235-G239 PolarHBondContact O-N 3.37Å; G239-Q242 PolarHBondContact O-N 3.09Å; G239-L243 PolarHBondContact O-N 3.22Å; G239-L243 VanDerWaalsContact O-N 3.09Å
240	W	85.7	Confident	74.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.8	-48	170.2	-173.4	-104.5	0	0	0	111.3	I170 L184 P186 I209 P211 T224 L227 R236 A237 T238 Q242 L243 Y244	I170-W240 HydrophobicContact CD1-CB 4.23Å; I170-W240 HydrophobicContact CD1-CD2 3.68Å; I170-W240 HydrophobicContact CD1-CE3 3.34Å; I170-W240 HydrophobicContact CD1-CG 4.1Å; I170-W240 HydrophobicContact CD1-CZ3 3.95Å; I170-W240 HydrophobicContact CG2-CB 4.03Å; I170-W240 HydrophobicContact CG2-CG 4.24Å; L184-W240 HydrophobicContact CB-CZ2 3.83Å; L184-W240 HydrophobicContact CD1-CZ2 4.17Å; P186-W240 HydrophobicContact CG-CH2 4Å; P186-W240 HydrophobicContact CG-CZ3 4.02Å; I209-W240 VanDerWaalsContact CD1-NE1 3.33Å; I209-W240 HydrophobicContact CG2-CH2 4.34Å; I209-W240 HydrophobicContact CG2-CZ2 3.56Å; P211-W240 HydrophobicContact CB-CH2 3.75Å; P211-W240 HydrophobicContact CB-CZ3 3.89Å; T224-W240 HydrophobicContact CG2-CZ3 4Å; L227-W240 HydrophobicContact CD2-CB 3.85Å; L227-W240 HydrophobicContact CD2-CD2 4.49Å; L227-W240 HydrophobicContact CD2-CE3 3.77Å; R236-W240 VanDerWaalsContact O-CB 3.3Å; R236-W240 WeakPolarHBondContact O-CB 3.47Å; R236-W240 PolarHBondContact O-N 3.21Å; A237-W240 WeakPolarHBondContact O-CB 3.3Å; A237-W240 PolarHBondContact O-N 3.01Å; T238-W240 VanDerWaalsContact C-N 3.31Å; T238-W240 PolarHBondContact O-N 2.92Å; W240-Q242 PolarHBondContact O-N 2.9Å; W240-L243 HydrophobicContact CE3-CD1 3.95Å; W240-L243 HydrophobicContact CZ3-CD1 4.21Å; W240-L243 WeakPolarHBondContact O-CB 3.39Å; W240-L243 PolarHBondContact O-N 3.24Å; W240-Y244 HydrophobicContact CD2-CD2 4.42Å; W240-Y244 HydrophobicContact CD2-CE2 4.06Å; W240-Y244 AromaticContact CE2-CE2 3.39Å; W240-Y244 AromaticContact CH2-CE2 3.9Å; W240-Y244 HydrophobicContact CH2-CE2 3.9Å; W240-Y244 HydrophobicContact CZ2-CD2 4.36Å; W240-Y244 AromaticContact CZ2-CE2 3.33Å; W240-Y244 HydrophobicContact CZ2-CE2 3.33Å; W240-Y244 AromaticContact CZ2-CZ 3.91Å; W240-Y244 HydrophobicContact CZ3-CE2 4.43Å; W240-Y244 AromaticContact NE1-CD2 3.89Å; W240-Y244 AromaticContact NE1-CE2 3.63Å; W240-Y244 WeakPolarHBondContact O-CD2 3.24Å
241	H	80.3	Confident	72.5	Confident	40 Å²	40	61.3 Å²	61.3	19%	0.185	37%	0.366	C	S	.	.	H	α-helix	trans	-58.4	-35.9	173.5	-64.5	-47.3	0	0	0	112.4	E195 K199 A237 T238 L243 Y244 S245	E195-H241 IonicContact OE1-CE1 2.74Å; E195-H241 IonicContact OE1-CG 3.71Å; E195-H241 IonicContact OE1-ND1 3.38Å; E195-H241 PolarHBondContact OE1-ND1 2.9Å; K199-H241 VanDerWaalsContact CE-CE1 3.48Å; K199-H241 WeakPolarHBondContact CE-CE1 3.26Å; K199-H241 WeakPolarHBondContact CE-ND1 3.45Å; K199-H241 PolarHBondContact NZ-ND1 2.89Å; A237-H241 PolarHBondContact O-CD2 3.25Å; A237-H241 PolarHBondContact O-N 2.9Å; T238-H241 WeakPolarHBondContact O-CB 3.41Å; T238-H241 PolarHBondContact O-N 2.88Å; H241-L243 VanDerWaalsContact C-N 3.3Å; H241-L243 PolarHBondContact O-N 2.88Å; H241-Y244 PolarHBondContact O-N 2.99Å; H241-Y244 VanDerWaalsContact O-N 3.12Å; H241-S245 PolarHBondContact O-N 3.44Å
242	Q	78.6	Confident	71	Confident	84 Å²	84	60.9 Å²	60.9	39%	0.393	36%	0.363	S	S	.	.	H	α-helix	trans	-70.1	-19.9	175.5	-70.3	173.8	-6.2	0	0	114	T238 G239 W240 Y244 S248 T253	T238-Q242 WeakPolarHBondContact O-CG 3.41Å; T238-Q242 PolarHBondContact O-N 3.38Å; G239-Q242 PolarHBondContact O-N 3.09Å; W240-Q242 PolarHBondContact O-N 2.9Å; Q242-Y244 VanDerWaalsContact C-N 3.3Å; Q242-S248 PolarHBondContact O-OG 3.47Å; Q242-T253 VanDerWaalsContact OE1-CG2 3.25Å
243	L	79.3	Confident	69.4	Low	10 Å²	10	61.1 Å²	61.1	5%	0.052	37%	0.367	C	S	.	.	H	α-helix	trans	-76.3	-16	169.2	-68.8	176.1	0	0	0	113.4	P186 R223 L227 G239 W240 H241	P186-L243 HydrophobicContact CB-CB 4.46Å; P186-L243 HydrophobicContact CG-CD1 4.32Å; R223-L243 HydrophobicContact CB-CD2 3.91Å; L227-L243 HydrophobicContact CD2-CD1 4.02Å; G239-L243 PolarHBondContact O-N 3.22Å; G239-L243 VanDerWaalsContact O-N 3.09Å; W240-L243 HydrophobicContact CE3-CD1 3.95Å; W240-L243 HydrophobicContact CZ3-CD1 4.21Å; W240-L243 WeakPolarHBondContact O-CB 3.39Å; W240-L243 PolarHBondContact O-N 3.24Å; H241-L243 VanDerWaalsContact C-N 3.3Å; H241-L243 PolarHBondContact O-N 2.88Å
244	Y	75.6	Confident	67.6	Low	10 Å²	10	60.7 Å²	60.7	4%	0.039	38%	0.375	C	S	.	.	H	α-helix	trans	-110.3	-26.7	-175.3	-82.4	-80.7	0	0	0	115	D185 P186 C191 R192 E195 W240 H241 Q242 A246	D185-Y244 PolarHBondContact N-OH 3.11Å; D185-Y244 PolarHBondContact O-OH 3.25Å; P186-Y244 WeakPolarHBondContact CA-OH 3.47Å; P186-Y244 HydrophobicContact CB-CE2 4.47Å; P186-Y244 HydrophobicContact CG-CE2 4.25Å; P186-Y244 VanDerWaalsContact N-OH 3.07Å; C191-Y244 HydrophobicContact CB-CE1 3.81Å; R192-Y244 HydrophobicContact CB-CD1 4.04Å; R192-Y244 HydrophobicContact CG-CD1 3.71Å; R192-Y244 HydrophobicContact CG-CE1 3.98Å; E195-Y244 HydrophobicContact CB-CD1 4.1Å; E195-Y244 HydrophobicContact CB-CG 4.12Å; E195-Y244 HydrophobicContact CG-CD1 4.38Å; E195-Y244 HydrophobicContact CG-CD2 4.4Å; E195-Y244 HydrophobicContact CG-CG 3.89Å; W240-Y244 HydrophobicContact CD2-CD2 4.42Å; W240-Y244 HydrophobicContact CD2-CE2 4.06Å; W240-Y244 AromaticContact CE2-CE2 3.39Å; W240-Y244 AromaticContact CH2-CE2 3.9Å; W240-Y244 HydrophobicContact CH2-CE2 3.9Å; W240-Y244 HydrophobicContact CZ2-CD2 4.36Å; W240-Y244 AromaticContact CZ2-CE2 3.33Å; W240-Y244 HydrophobicContact CZ2-CE2 3.33Å; W240-Y244 AromaticContact CZ2-CZ 3.91Å; W240-Y244 HydrophobicContact CZ3-CE2 4.43Å; W240-Y244 AromaticContact NE1-CD2 3.89Å; W240-Y244 AromaticContact NE1-CE2 3.63Å; W240-Y244 WeakPolarHBondContact O-CD2 3.24Å; H241-Y244 PolarHBondContact O-N 2.99Å; H241-Y244 VanDerWaalsContact O-N 3.12Å; Q242-Y244 VanDerWaalsContact C-N 3.3Å; Y244-A246 PolarHBondContact O-N 2.78Å
245	S	67.2	Low	65.9	Low	41 Å²	41	61.8 Å²	61.8	29%	0.287	39%	0.386	S	S	.	.			trans	-50.6	135.4	170.1	164	0	0	0	0	110.7	H241 D247 S248	H241-S245 PolarHBondContact O-N 3.44Å; S245-D247 VanDerWaalsContact C-N 3.3Å; S245-D247 PolarHBondContact OG-N 3.36Å; S245-D247 PolarHBondContact OG-OD2 3.1Å; S245-D247 VanDerWaalsContact OG-OD2 3.11Å; S245-S248 PolarHBondContact O-OG 3.33Å; S245-S248 PolarHBondContact OG-N 2.84Å
246	A	59.8	Low	64.1	Low	91 Å²	91	59.3 Å²	59.3	75%	0.752	39%	0.386	S	S	*	.	S	Bend	trans	-70.2	-32.8	174.1	0	0	0	0	0	111.3	Y244 G249	Y244-A246 PolarHBondContact O-N 2.78Å; A246-G249 PolarHBondContact O-N 3.36Å
247	D	59.4	Low	61.9	Low	154 Å²	154	62.1 Å²	62.1	82%	0.824	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-27.7	-171	-35.5	-69	0	0	0	112.5	S245 G249	S245-D247 VanDerWaalsContact C-N 3.3Å; S245-D247 PolarHBondContact OG-N 3.36Å; S245-D247 PolarHBondContact OG-OD2 3.1Å; S245-D247 VanDerWaalsContact OG-OD2 3.11Å; D247-G249 PolarHBondContact O-N 2.7Å
248	S	53.8	Low	60	Low	39 Å²	39	66.5 Å²	66.5	27%	0.273	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-0.7	177.9	60.9	0	0	0	0	114.3	Q242 S245 M250 A251	Q242-S248 PolarHBondContact O-OG 3.47Å; S245-S248 PolarHBondContact O-OG 3.33Å; S245-S248 PolarHBondContact OG-N 2.84Å; S248-M250 PolarHBondContact O-N 3.34Å; S248-A251 WeakPolarHBondContact O-CB 3.45Å; S248-A251 PolarHBondContact O-N 3.47Å
249	G	51.4	Low	58.3	Low	58 Å²	58	66.1 Å²	66.1	60%	0.598	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	12.5	174.7	0	0	0	0	0	115.8	A246 D247 A251	A246-G249 PolarHBondContact O-N 3.36Å; D247-G249 PolarHBondContact O-N 2.7Å; G249-A251 PolarHBondContact O-N 3.1Å
250	M	49.3	Very low	57	Low	55 Å²	55	74.6 Å²	74.6	27%	0.271	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	25.3	-165.2	-51.9	175	-74.5	0	0	114.3	R192 R223 S248	R192-M250 VanDerWaalsContact CZ-SD 3.55Å; R192-M250 PolarHBondContact NH2-SD 3.35Å; R223-M250 PolarHBondContact NH1-SD 3.13Å; S248-M250 PolarHBondContact O-N 3.34Å
251	A	47.8	Very low	56	Low	56 Å²	56	78.5 Å²	78.5	46%	0.463	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-63.1	141.1	169	0	0	0	0	0	109.6	S248 G249	S248-A251 WeakPolarHBondContact O-CB 3.45Å; S248-A251 PolarHBondContact O-N 3.47Å; G249-A251 PolarHBondContact O-N 3.1Å
252	P	49.2	Very low	55.8	Low	101 Å²	101	78.8 Å²	78.8	66%	0.656	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-59.3	146.1	164.3	29.1	-33.9	0	0	0	108.9	G254	P252-G254 PolarHBondContact O-N 3.31Å; P252-G254 VanDerWaalsContact O-N 3.16Å
253	T	45.6	Very low	56	Low	61 Å²	61	82.2 Å²	82.2	37%	0.374	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-49.8	118.7	-174.8	56.5	0	0	0	0	111.6	Q242 D255	Q242-T253 VanDerWaalsContact OE1-CG2 3.25Å; T253-D255 PolarHBondContact O-N 2.89Å
254	G	41.6	Very low	56.2	Low	70 Å²	70	83.5 Å²	83.5	72%	0.722	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	135.2	-172.4	0	0	0	0	0	113.3	P252 A256	P252-G254 PolarHBondContact O-N 3.31Å; P252-G254 VanDerWaalsContact O-N 3.16Å; G254-A256 PolarHBondContact O-N 3.44Å
255	D	42.8	Very low	56.6	Low	175 Å²	175	86.3 Å²	86.3	94%	0.936	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.8	11	171.1	-53.1	-32.4	0	0	0	117.6	T253	T253-D255 PolarHBondContact O-N 2.89Å
256	A	43.3	Very low	57.4	Low	58 Å²	58	88.8 Å²	88.8	48%	0.479	58%	0.579	S	S	.	*			trans	-69.3	136.2	163.1	0	0	0	0	0	109.7	G254	G254-A256 PolarHBondContact O-N 3.44Å
257	P	40.7	Very low	58.6	Low	110 Å²	110	86.4 Å²	86.4	71%	0.714	56%	0.559	S	S	*	*			trans	-71	140.4	-158.3	26.4	-35.8	0	0	0	114	A259	P257-A259 HydrophobicContact CB-CB 4.04Å; P257-A259 HydrophobicContact CG-CB 4.48Å; P257-A259 PolarHBondContact O-N 3.42Å
258	A	41.4	Very low	59.8	Low	105 Å²	105	79 Å²	79	87%	0.868	52%	0.52	S	S	*	.			trans	-71.2	68.4	164.3	0	0	0	0	0	110.6
259	A	49	Very low	61.4	Low	66 Å²	66	82.6 Å²	82.6	55%	0.545	53%	0.527	S	S	.	.			trans	-145.7	132.6	-173.1	0	0	0	0	0	111.9	P257	P257-A259 HydrophobicContact CB-CB 4.04Å; P257-A259 HydrophobicContact CG-CB 4.48Å; P257-A259 PolarHBondContact O-N 3.42Å
260	Q	56.1	Low	63	Low	182 Å²	182	82.5 Å²	82.5	85%	0.85	52%	0.52	S	S	*	.			cis	-154.2	5.3	-19	-135.1	143.8	67.1	0	0	112.8
261	D	64.8	Low	64.7	Low	83 Å²	83	80.2 Å²	80.2	44%	0.444	51%	0.51	S	S	.	.			trans	-97.9	107.4	-168.3	-177.4	19.4	0	0	0	112.8	Q263 C264 L265	D261-Q263 PolarHBondContact O-N 3.3Å; D261-Q263 WeakPolarHBondContact OD1-CA 3.37Å; D261-Q263 VanDerWaalsContact OD1-CB 3.29Å; D261-Q263 WeakPolarHBondContact OD1-CB 3.34Å; D261-Q263 PolarHBondContact OD1-N 3.41Å; D261-C264 HydrophobicContact CB-CB 4.15Å; D261-C264 PolarHBondContact O-N 3.28Å; D261-C264 WeakPolarHBondContact OD2-CB 3.43Å; D261-C264 PolarHBondContact OD2-N 3.1Å; D261-L265 PolarHBondContact O-N 3Å; D261-L265 VanDerWaalsContact O-N 3.16Å
262	G	75.9	Confident	66.7	Low	46 Å²	46	77.6 Å²	77.6	47%	0.474	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-23.6	172.5	0	0	0	0	0	113.6	T266	G262-T266 WeakPolarHBondContact O-CB 3.29Å; G262-T266 PolarHBondContact O-N 3.46Å; G262-T266 VanDerWaalsContact O-N 3.12Å; G262-T266 PolarHBondContact O-OG1 3.2Å
263	Q	81.3	Confident	68.4	Low	156 Å²	156	76.9 Å²	76.9	73%	0.729	48%	0.479	S	S	*	.	H	α-helix	trans	-71.1	-50.6	174.3	-58	-169.3	1.1	0	0	110.3	D261 L265 T266 A267	D261-Q263 PolarHBondContact O-N 3.3Å; D261-Q263 WeakPolarHBondContact OD1-CA 3.37Å; D261-Q263 VanDerWaalsContact OD1-CB 3.29Å; D261-Q263 WeakPolarHBondContact OD1-CB 3.34Å; D261-Q263 PolarHBondContact OD1-N 3.41Å; Q263-L265 PolarHBondContact O-N 3.21Å; Q263-T266 PolarHBondContact O-N 3.24Å; Q263-T266 VanDerWaalsContact O-N 3.1Å; Q263-A267 WeakPolarHBondContact O-CB 3.44Å; Q263-A267 PolarHBondContact O-N 3.21Å
264	C	83.2	Confident	70.3	Confident	37 Å²	37	77.8 Å²	77.8	25%	0.25	48%	0.484	C	S	.	.	H	α-helix	trans	-57.2	-47	175.2	-170	0	0	0	0	112.4	C229 D261 T266 A267 A268	C229-C264 VanDerWaalsContact CA-SG 3.51Å; C229-C264 HydrophobicContact CB-CB 4.17Å; C229-C264 WeakPolarHBondContact CB-SG 3.48Å; C229-C264 WeakPolarHBondContact SG-CB 3.05Å; C229-C264 PolarHBondContact SG-O 2.91Å; C229-C264 VanDerWaalsContact SG-O 3.36Å; C229-C264 CovalentContact SG-SG 2.04Å; C229-C264 PolarHBondContact SG-SG 3.33Å; D261-C264 HydrophobicContact CB-CB 4.15Å; D261-C264 PolarHBondContact O-N 3.28Å; D261-C264 WeakPolarHBondContact OD2-CB 3.43Å; D261-C264 PolarHBondContact OD2-N 3.1Å; C264-T266 PolarHBondContact O-N 3.25Å; C264-A267 PolarHBondContact O-N 3Å; C264-A267 VanDerWaalsContact O-N 3.15Å; C264-A268 WeakPolarHBondContact O-CB 3.29Å; C264-A268 PolarHBondContact O-N 3.12Å
265	L	84.5	Confident	72.4	Confident	68 Å²	68	74.9 Å²	74.9	36%	0.356	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-31.4	177.3	-83.7	167.4	0	0	0	113.1	A225 P226 D261 Q263 R269	A225-L265 HydrophobicContact CB-CD2 4.26Å; P226-L265 HydrophobicContact CG-CD2 4.24Å; D261-L265 PolarHBondContact O-N 3Å; D261-L265 VanDerWaalsContact O-N 3.16Å; Q263-L265 PolarHBondContact O-N 3.21Å; L265-R269 WeakPolarHBondContact O-CD 3.36Å; L265-R269 VanDerWaalsContact O-CG 3.23Å; L265-R269 WeakPolarHBondContact O-CG 3.16Å; L265-R269 PolarHBondContact O-N 3.49Å
266	T	84.7	Confident	74.5	Confident	94 Å²	94	66.7 Å²	66.7	58%	0.577	41%	0.408	S	S	*	.	H	α-helix	trans	-74.2	-42.3	174.6	-57.7	0	0	0	0	111.4	G262 Q263 C264 R269 A270	G262-T266 WeakPolarHBondContact O-CB 3.29Å; G262-T266 PolarHBondContact O-N 3.46Å; G262-T266 VanDerWaalsContact O-N 3.12Å; G262-T266 PolarHBondContact O-OG1 3.2Å; Q263-T266 PolarHBondContact O-N 3.24Å; Q263-T266 VanDerWaalsContact O-N 3.1Å; C264-T266 PolarHBondContact O-N 3.25Å; T266-R269 PolarHBondContact O-N 3.1Å; T266-A270 PolarHBondContact O-N 3.49Å
267	A	84.7	Confident	76.4	Confident	40 Å²	40	69.5 Å²	69.5	33%	0.331	41%	0.412	S	S	.	.	H	α-helix	trans	-64.3	-43.6	176.5	0	0	0	0	0	112.1	F168 Q263 C264 R269 A270 A271	F168-A267 HydrophobicContact CE1-CB 4.16Å; F168-A267 HydrophobicContact CZ-CB 4.02Å; Q263-A267 WeakPolarHBondContact O-CB 3.44Å; Q263-A267 PolarHBondContact O-N 3.21Å; C264-A267 PolarHBondContact O-N 3Å; C264-A267 VanDerWaalsContact O-N 3.15Å; A267-R269 VanDerWaalsContact C-N 3.34Å; A267-R269 PolarHBondContact O-N 2.64Å; A267-A270 PolarHBondContact O-N 2.75Å; A267-A271 WeakPolarHBondContact O-CB 3.41Å; A267-A271 PolarHBondContact O-N 3.38Å
268	A	85.3	Confident	78.2	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-37.5	175.9	0	0	0	0	0	112.5	A225 L228 C264 I272	A225-A268 HydrophobicContact CB-CB 4.03Å; A225-A268 WeakPolarHBondContact O-CB 3.49Å; L228-A268 HydrophobicContact CB-CB 3.88Å; L228-A268 HydrophobicContact CD1-CB 4.24Å; C264-A268 WeakPolarHBondContact O-CB 3.29Å; C264-A268 PolarHBondContact O-N 3.12Å; A268-I272 VanDerWaalsContact O-CG1 3.32Å; A268-I272 WeakPolarHBondContact O-CG1 3.48Å; A268-I272 PolarHBondContact O-N 3.19Å
269	R	86.9	Confident	80.1	Confident	114 Å²	114	60.8 Å²	60.8	43%	0.43	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-52.1	171.8	-75	172.6	-178.2	-159.7	2.3	111.6	T221 A225 L265 T266 A267 A271 I272 D273	T221-R269 HydrophobicContact CG2-CB 4.47Å; T221-R269 HydrophobicContact CG2-CG 3.87Å; A225-R269 HydrophobicContact CB-CG 4.11Å; L265-R269 WeakPolarHBondContact O-CD 3.36Å; L265-R269 VanDerWaalsContact O-CG 3.23Å; L265-R269 WeakPolarHBondContact O-CG 3.16Å; L265-R269 PolarHBondContact O-N 3.49Å; T266-R269 PolarHBondContact O-N 3.1Å; A267-R269 VanDerWaalsContact C-N 3.34Å; A267-R269 PolarHBondContact O-N 2.64Å; R269-A271 PolarHBondContact O-N 2.93Å; R269-I272 PolarHBondContact O-N 2.86Å; R269-I272 VanDerWaalsContact O-N 3.11Å; R269-D273 PolarHBondContact O-N 3.34Å
270	A	85.7	Confident	81.6	Confident	55 Å²	55	65.6 Å²	65.6	46%	0.455	35%	0.351	S	S	.	.	H	α-helix	trans	-56.9	-35.4	177.9	0	0	0	0	0	112.2	T266 A267 D273 V274	T266-A270 PolarHBondContact O-N 3.49Å; A267-A270 PolarHBondContact O-N 2.75Å; A270-D273 PolarHBondContact O-N 3.44Å; A270-V274 WeakPolarHBondContact O-CG2 3.27Å; A270-V274 PolarHBondContact O-N 3.15Å
271	A	85.2	Confident	82.5	Confident	8 Å²	8	62.9 Å²	62.9	7%	0.066	34%	0.338	C	S	.	.	H	α-helix	trans	-73	-37.7	176.4	0	0	0	0	0	114.1	F168 A267 R269 D273 V274 N275	F168-A271 HydrophobicContact CB-CB 3.37Å; F168-A271 HydrophobicContact CD1-CB 3.53Å; F168-A271 HydrophobicContact CD2-CB 3.27Å; F168-A271 HydrophobicContact CE1-CB 4.08Å; F168-A271 HydrophobicContact CE2-CB 3.87Å; F168-A271 HydrophobicContact CG-CB 3.08Å; F168-A271 HydrophobicContact CZ-CB 4.23Å; A267-A271 WeakPolarHBondContact O-CB 3.41Å; A267-A271 PolarHBondContact O-N 3.38Å; R269-A271 PolarHBondContact O-N 2.93Å; A271-D273 PolarHBondContact O-N 2.77Å; A271-V274 PolarHBondContact O-N 2.81Å; A271-N275 WeakPolarHBondContact O-CB 3.33Å; A271-N275 VanDerWaalsContact O-CG 3.24Å; A271-N275 PolarHBondContact O-N 3.32Å; A271-N275 PolarHBondContact O-OD1 2.86Å
272	I	88	Confident	82.8	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-36	169.4	-69.1	163.7	0	0	0	109.8	T221 T224 A225 L228 A268 R269 N275 N276	T221-I272 HydrophobicContact CG2-CD1 4.08Å; T221-I272 HydrophobicContact CG2-CG2 4.42Å; T224-I272 HydrophobicContact CG2-CD1 3.73Å; T224-I272 HydrophobicContact CG2-CG1 4.3Å; A225-I272 HydrophobicContact CB-CD1 4.19Å; L228-I272 HydrophobicContact CD1-CD1 3.97Å; L228-I272 HydrophobicContact CD1-CG1 3.78Å; A268-I272 VanDerWaalsContact O-CG1 3.32Å; A268-I272 WeakPolarHBondContact O-CG1 3.48Å; A268-I272 PolarHBondContact O-N 3.19Å; R269-I272 PolarHBondContact O-N 2.86Å; R269-I272 VanDerWaalsContact O-N 3.11Å; I272-N275 PolarHBondContact O-N 3.45Å; I272-N276 WeakPolarHBondContact O-CB 3.38Å; I272-N276 PolarHBondContact O-N 3.1Å; I272-N276 PolarHBondContact O-ND2 2.88Å
273	D	85.9	Confident	82.1	Confident	85 Å²	85	59.3 Å²	59.3	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-71.8	-34.8	174.5	-74.2	-37.4	0	0	0	113.9	R269 A270 A271 N276 Q277	R269-D273 PolarHBondContact O-N 3.34Å; A270-D273 PolarHBondContact O-N 3.44Å; A271-D273 PolarHBondContact O-N 2.77Å; D273-N276 WeakPolarHBondContact O-CB 3.42Å; D273-N276 PolarHBondContact O-N 3.1Å; D273-N276 PolarHBondContact OD1-ND2 3.03Å; D273-Q277 WeakPolarHBondContact O-CB 3.3Å; D273-Q277 PolarHBondContact O-N 3.38Å
274	V	84.9	Confident	81.1	Confident	80 Å²	80	56.8 Å²	56.8	49%	0.485	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-41.7	168.4	169	0	0	0	0	111.2	A270 A271 Q277 A278	A270-V274 WeakPolarHBondContact O-CG2 3.27Å; A270-V274 PolarHBondContact O-N 3.15Å; A271-V274 PolarHBondContact O-N 2.81Å; V274-Q277 PolarHBondContact O-N 3.06Å; V274-A278 WeakPolarHBondContact O-CB 3.48Å; V274-A278 PolarHBondContact O-N 3.33Å
275	N	86.8	Confident	80.2	Confident	10 Å²	10	59.3 Å²	59.3	5%	0.053	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-41.6	174.7	-68	-11.3	0	0	0	111.2	P211 V212 A271 I272 Q277 A278 F279	P211-N275 WeakPolarHBondContact O-CB 3.27Å; P211-N275 PolarHBondContact O-ND2 3.48Å; V212-N275 HydrophobicContact CG1-CB 3.81Å; A271-N275 WeakPolarHBondContact O-CB 3.33Å; A271-N275 VanDerWaalsContact O-CG 3.24Å; A271-N275 PolarHBondContact O-N 3.32Å; A271-N275 PolarHBondContact O-OD1 2.86Å; I272-N275 PolarHBondContact O-N 3.45Å; N275-Q277 VanDerWaalsContact C-N 3.32Å; N275-Q277 PolarHBondContact O-N 2.87Å; N275-A278 PolarHBondContact O-N 2.78Å; N275-F279 VanDerWaalsContact O-CB 3.25Å; N275-F279 WeakPolarHBondContact O-CB 3.12Å; N275-F279 PolarHBondContact O-N 3.35Å
276	N	86.8	Confident	79.3	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.011	34%	0.338	C	S	.	.	H	α-helix	trans	-60.8	-40.6	173.1	-74.2	-33.1	0	0	0	111.4	V212 S213 V214 I272 D273 R280	V212-N276 WeakPolarHBondContact CB-OD1 3.44Å; S213-N276 PolarHBondContact N-OD1 2.78Å; S213-N276 PolarHBondContact OG-ND2 3.02Å; V214-N276 WeakPolarHBondContact CG2-OD1 3.26Å; I272-N276 WeakPolarHBondContact O-CB 3.38Å; I272-N276 PolarHBondContact O-N 3.1Å; I272-N276 PolarHBondContact O-ND2 2.88Å; D273-N276 WeakPolarHBondContact O-CB 3.42Å; D273-N276 PolarHBondContact O-N 3.1Å; D273-N276 PolarHBondContact OD1-ND2 3.03Å; N276-R280 WeakPolarHBondContact O-CB 3.38Å; N276-R280 WeakPolarHBondContact O-CD 3.42Å; N276-R280 WeakPolarHBondContact O-CG 3.42Å; N276-R280 PolarHBondContact O-N 3.13Å
277	Q	83.2	Confident	78.4	Confident	118 Å²	118	54.3 Å²	54.3	55%	0.551	31%	0.313	S	S	*	.	H	α-helix	trans	-68	-46.8	177.7	-171.5	174.1	10.8	0	0	111.2	D273 V274 N275 F279 R280 Q281	D273-Q277 WeakPolarHBondContact O-CB 3.3Å; D273-Q277 PolarHBondContact O-N 3.38Å; V274-Q277 PolarHBondContact O-N 3.06Å; N275-Q277 VanDerWaalsContact C-N 3.32Å; N275-Q277 PolarHBondContact O-N 2.87Å; Q277-F279 VanDerWaalsContact C-N 3.34Å; Q277-F279 PolarHBondContact O-N 3.06Å; Q277-R280 PolarHBondContact O-N 2.92Å; Q277-Q281 WeakPolarHBondContact O-CB 3.45Å; Q277-Q281 PolarHBondContact O-N 3.15Å
278	A	78.4	Confident	78.1	Confident	19 Å²	19	53 Å²	53	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-44	175	0	0	0	0	0	111.8	F183 V274 N275 Q281 F282	F183-A278 HydrophobicContact CE1-CB 4.4Å; V274-A278 WeakPolarHBondContact O-CB 3.48Å; V274-A278 PolarHBondContact O-N 3.33Å; N275-A278 PolarHBondContact O-N 2.78Å; A278-Q281 PolarHBondContact O-N 3.47Å; A278-F282 HydrophobicContact CB-CD2 4.14Å; A278-F282 HydrophobicContact CB-CE2 4.26Å; A278-F282 WeakPolarHBondContact O-CB 3.17Å; A278-F282 WeakPolarHBondContact O-CD2 3.43Å; A278-F282 PolarHBondContact O-N 3.27Å
279	F	81.6	Confident	77.9	Confident	13 Å²	13	53.2 Å²	53.2	6%	0.057	30%	0.301	C	S	.	.	H	α-helix	trans	-59.9	-47.1	174.6	176.7	-85.9	0	0	0	111.9	F183 V212 V214 N275 Q277 G283 G286 T287 W289	F183-F279 HydrophobicContact CB-CD2 3.83Å; F183-F279 HydrophobicContact CB-CE2 4.45Å; F183-F279 HydrophobicContact CD1-CB 4.11Å; F183-F279 HydrophobicContact CD1-CD2 4.38Å; F183-F279 HydrophobicContact CE1-CB 4.49Å; F183-F279 HydrophobicContact CG-CD2 4.2Å; V212-F279 HydrophobicContact CG1-CB 4.07Å; V214-F279 HydrophobicContact CB-CE1 4.44Å; V214-F279 HydrophobicContact CG1-CE1 4.16Å; V214-F279 HydrophobicContact CG2-CD1 3.7Å; V214-F279 HydrophobicContact CG2-CE1 4.05Å; V214-F279 HydrophobicContact CG2-CG 4.41Å; N275-F279 VanDerWaalsContact O-CB 3.25Å; N275-F279 WeakPolarHBondContact O-CB 3.12Å; N275-F279 PolarHBondContact O-N 3.35Å; Q277-F279 VanDerWaalsContact C-N 3.34Å; Q277-F279 PolarHBondContact O-N 3.06Å; F279-G283 VanDerWaalsContact O-CA 3.26Å; F279-G283 WeakPolarHBondContact O-CA 3.48Å; F279-G283 PolarHBondContact O-N 3.31Å; F279-G286 WeakPolarHBondContact CZ-O 3.22Å; F279-T287 HydrophobicContact CD2-CG2 4.33Å; F279-T287 HydrophobicContact CE1-CG2 4.05Å; F279-T287 HydrophobicContact CE2-CG2 3.61Å; F279-T287 HydrophobicContact CZ-CG2 3.46Å; F279-T287 VanDerWaalsContact CZ-CG2 3.46Å; F279-W289 HydrophobicContact CD2-CB 4.37Å; F279-W289 HydrophobicContact CD2-CE3 4.21Å; F279-W289 HydrophobicContact CE2-CB 3.87Å
280	R	80.1	Confident	77.9	Confident	166 Å²	166	47.9 Å²	47.9	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-67.5	-33.5	177.9	-71.5	167.4	-172	147.5	3.1	113.3	N276 Q277	N276-R280 WeakPolarHBondContact O-CB 3.38Å; N276-R280 WeakPolarHBondContact O-CD 3.42Å; N276-R280 WeakPolarHBondContact O-CG 3.42Å; N276-R280 PolarHBondContact O-N 3.13Å; Q277-R280 PolarHBondContact O-N 2.92Å
281	Q	74.2	Confident	77.7	Confident	125 Å²	125	45.4 Å²	45.4	58%	0.584	26%	0.261	S	S	*	.	H	α-helix	trans	-82.9	-30.9	-174.9	-170.9	176.5	-0.7	0	0	112.9	Q277 A278	Q277-Q281 WeakPolarHBondContact O-CB 3.45Å; Q277-Q281 PolarHBondContact O-N 3.15Å; A278-Q281 PolarHBondContact O-N 3.47Å
282	F	71.2	Confident	77.6	Confident	34 Å²	34	45.2 Å²	45.2	15%	0.149	26%	0.259	C	S	.	.	H	α-helix	trans	-117.1	-20.7	-173.4	-52.1	-54	0	0	0	114.4	A151 L155 A278 W289	A151-F282 HydrophobicContact CB-CD1 4.43Å; A151-F282 HydrophobicContact CB-CE1 3.75Å; L155-F282 HydrophobicContact CD1-CB 3.99Å; L155-F282 HydrophobicContact CD1-CD2 3.54Å; L155-F282 HydrophobicContact CD1-CE2 4.2Å; L155-F282 HydrophobicContact CD1-CG 3.77Å; L155-F282 HydrophobicContact CD2-CB 3.98Å; A278-F282 HydrophobicContact CB-CD2 4.14Å; A278-F282 HydrophobicContact CB-CE2 4.26Å; A278-F282 WeakPolarHBondContact O-CB 3.17Å; A278-F282 WeakPolarHBondContact O-CD2 3.43Å; A278-F282 PolarHBondContact O-N 3.27Å; F282-W289 HydrophobicContact CB-CH2 3.83Å; F282-W289 HydrophobicContact CB-CZ3 4.14Å; F282-W289 VanDerWaalsContact O-CH2 3.26Å; F282-W289 WeakPolarHBondContact O-CH2 3.23Å
283	G	62.1	Low	77.3	Confident	20 Å²	20	47.3 Å²	47.3	21%	0.206	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-68	160.5	-170.4	0	0	0	0	0	116.2	F279 W289	F279-G283 VanDerWaalsContact O-CA 3.26Å; F279-G283 WeakPolarHBondContact O-CA 3.48Å; F279-G283 PolarHBondContact O-N 3.31Å; G283-W289 VanDerWaalsContact CA-CH2 3.48Å; G283-W289 VanDerWaalsContact CA-CZ3 3.46Å
284	F	60.2	Low	76.6	Confident	103 Å²	103	46.4 Å²	46.4	45%	0.452	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-86.8	155.6	155.4	-48.9	-89.6	0	0	0	108	G286 W289 H297	F284-G286 PolarHBondContact O-N 2.86Å; F284-W289 AromaticContact CD2-CE2 3.77Å; F284-W289 AromaticContact CD2-CZ2 3.93Å; F284-W289 HydrophobicContact CD2-CZ2 3.93Å; F284-W289 AromaticContact CD2-NE1 3.34Å; F284-W289 VanDerWaalsContact CD2-NE1 3.34Å; F284-W289 AromaticContact CE2-CZ2 3.82Å; F284-W289 HydrophobicContact CE2-CZ2 3.82Å; F284-W289 AromaticContact CE2-NE1 3.67Å; F284-H297 HydrophobicContact CD2-CB 4.13Å; F284-H297 AromaticContact CD2-CE1 3.91Å; F284-H297 AromaticContact CD2-CG 3.82Å; F284-H297 AromaticContact CD2-ND1 3.28Å; F284-H297 VanDerWaalsContact CD2-ND1 3.28Å; F284-H297 WeakPolarHBondContact CD2-ND1 3.43Å; F284-H297 HydrophobicContact CE2-CB 3.59Å; F284-H297 AromaticContact CE2-CG 3.82Å; F284-H297 AromaticContact CE2-ND1 3.56Å; F284-H297 AromaticContact CG-ND1 3.91Å; F284-H297 HydrophobicContact CZ-CB 4.4Å
285	G	63.3	Low	76	Confident	91 Å²	91	44.1 Å²	44.1	94%	0.938	26%	0.26	S	S	*	.	S	Bend	trans	-65.5	127	-167.4	0	0	0	0	0	114.8
286	G	66.4	Low	75.2	Confident	49 Å²	49	49.8 Å²	49.8	51%	0.505	28%	0.281	S	S	.	.	S	Bend	trans	97.6	146.2	174.7	0	0	0	0	0	114.2	F279 F284	F279-G286 WeakPolarHBondContact CZ-O 3.22Å; F284-G286 PolarHBondContact O-N 2.86Å
287	T	65.1	Low	74.7	Confident	8 Å²	8	52.3 Å²	52.3	5%	0.049	29%	0.292	C	S	.	.	S	Bend	trans	-90.9	148.3	170.9	54.1	0	0	0	0	109.8	C188 V212 V214 I215 F279	C188-T287 WeakPolarHBondContact CB-OG1 3.48Å; C188-T287 PolarHBondContact SG-O 2.91Å; C188-T287 PolarHBondContact SG-OG1 3.08Å; V212-T287 HydrophobicContact CG2-CG2 3.98Å; V214-T287 HydrophobicContact CB-CG2 4.31Å; I215-T287 WeakPolarHBondContact CD1-OG1 3.43Å; F279-T287 HydrophobicContact CD2-CG2 4.33Å; F279-T287 HydrophobicContact CE1-CG2 4.05Å; F279-T287 HydrophobicContact CE2-CG2 3.61Å; F279-T287 HydrophobicContact CZ-CG2 3.46Å; F279-T287 VanDerWaalsContact CZ-CG2 3.46Å
288	P	79	Confident	74.3	Confident	11 Å²	11	47.4 Å²	47.4	7%	0.071	27%	0.27	C	S	.	.			cis	-80.5	164.3	1.8	33.8	-36.4	0	0	0	113.6	F183 L184 N190 C191 L194	F183-P288 WeakPolarHBondContact O-CA 3.24Å; L184-P288 HydrophobicContact CD2-CB 3.5Å; L184-P288 VanDerWaalsContact CD2-CB 3.5Å; N190-P288 VanDerWaalsContact CB-CD 3.46Å; N190-P288 HydrophobicContact CB-CG 4.48Å; C191-P288 HydrophobicContact CB-CB 4.46Å; C191-P288 VanDerWaalsContact SG-CB 3.57Å; L194-P288 HydrophobicContact CB-CG 4.14Å; L194-P288 HydrophobicContact CD1-CG 4.07Å; L194-P288 HydrophobicContact CD2-CB 3.82Å; L194-P288 HydrophobicContact CD2-CG 3.71Å; L194-P288 HydrophobicContact CG-CG 4.2Å
289	W	81.3	Confident	73.9	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.019	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	135.3	170.8	-177.7	40.1	0	0	0	110.8	L155 A182 F183 F279 F282 G283 F284 L291 H297	L155-W289 HydrophobicContact CD2-CH2 3.66Å; L155-W289 HydrophobicContact CD2-CZ2 4.27Å; A182-W289 CarbonylContact C-O 3.55Å; A182-W289 WeakPolarHBondContact CA-O 3.3Å; F183-W289 HydrophobicContact CB-CB 4.29Å; F183-W289 HydrophobicContact CD2-CD2 4.41Å; F183-W289 AromaticContact CD2-CE3 3.68Å; F183-W289 HydrophobicContact CD2-CE3 3.68Å; F183-W289 HydrophobicContact CD2-CZ3 4.3Å; F183-W289 AromaticContact CE2-CE3 3.99Å; F183-W289 HydrophobicContact CE2-CE3 3.99Å; F183-W289 HydrophobicContact CE2-CZ3 4.13Å; F183-W289 HydrophobicContact CG-CE3 4.27Å; F183-W289 PolarHBondContact N-O 2.86Å; F183-W289 PolarHBondContact O-N 3.21Å; F279-W289 HydrophobicContact CD2-CB 4.37Å; F279-W289 HydrophobicContact CD2-CE3 4.21Å; F279-W289 HydrophobicContact CE2-CB 3.87Å; F282-W289 HydrophobicContact CB-CH2 3.83Å; F282-W289 HydrophobicContact CB-CZ3 4.14Å; F282-W289 VanDerWaalsContact O-CH2 3.26Å; F282-W289 WeakPolarHBondContact O-CH2 3.23Å; G283-W289 VanDerWaalsContact CA-CH2 3.48Å; G283-W289 VanDerWaalsContact CA-CZ3 3.46Å; F284-W289 AromaticContact CD2-CE2 3.77Å; F284-W289 AromaticContact CD2-CZ2 3.93Å; F284-W289 HydrophobicContact CD2-CZ2 3.93Å; F284-W289 AromaticContact CD2-NE1 3.34Å; F284-W289 VanDerWaalsContact CD2-NE1 3.34Å; F284-W289 AromaticContact CE2-CZ2 3.82Å; F284-W289 HydrophobicContact CE2-CZ2 3.82Å; F284-W289 AromaticContact CE2-NE1 3.67Å; W289-L291 HydrophobicContact CD2-CD1 4.35Å; W289-L291 HydrophobicContact CD2-CG 4.47Å; W289-L291 HydrophobicContact CE3-CD1 4.34Å; W289-L291 HydrophobicContact CH2-CD1 3.76Å; W289-L291 HydrophobicContact CZ2-CD1 3.74Å; W289-L291 HydrophobicContact CZ2-CD2 3.75Å; W289-L291 HydrophobicContact CZ2-CG 3.98Å; W289-L291 HydrophobicContact CZ3-CD1 4.05Å; W289-H297 AromaticContact CD1-CD2 3.29Å; W289-H297 AromaticContact CD1-CG 3.75Å; W289-H297 AromaticContact CD1-NE2 3.48Å; W289-H297 AromaticContact NE1-CD2 3.43Å; W289-H297 PolarHBondContact NE1-CD2 2.97Å; W289-H297 AromaticContact NE1-CG 3.4Å; W289-H297 AromaticContact NE1-ND1 3.93Å; W289-H297 AromaticContact NE1-NE2 3.96Å
290	V	86.1	Confident	73.3	Confident	2 Å²	2	51 Å²	51	1%	0.012	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.8	-177.1	-175	0	0	0	0	111.2	L180 Y181 A182 L194 L198 H297 L298 L303	L180-V290 HydrophobicContact CB-CG1 4.48Å; Y181-V290 CarbonylContact O-C 3.58Å; Y181-V290 WeakPolarHBondContact O-CA 3.38Å; A182-V290 HydrophobicContact CB-CG1 4.33Å; A182-V290 HydrophobicContact CB-CG2 3.85Å; L194-V290 HydrophobicContact CD2-CG2 3.63Å; L198-V290 HydrophobicContact CD2-CG1 4.35Å; L198-V290 HydrophobicContact CD2-CG2 4.33Å; V290-H297 CarbonylContact O-C 3.5Å; V290-H297 WeakPolarHBondContact O-CA 3.4Å; V290-H297 PolarHBondContact O-CD2 2.83Å; V290-L298 HydrophobicContact CG1-CD1 4.34Å; V290-L298 PolarHBondContact O-N 3.45Å; V290-L303 HydrophobicContact CB-CD1 3.63Å; V290-L303 HydrophobicContact CG1-CD1 4.01Å; V290-L303 HydrophobicContact CG2-CD1 3.57Å
291	L	82	Confident	72.7	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	142.9	-176.8	-69.7	159.5	0	0	0	111.2	L155 L159 L180 Y181 F183 W289 W296 H297	L155-L291 HydrophobicContact CD2-CD1 3.74Å; L155-L291 HydrophobicContact CG-CD1 4.36Å; L159-L291 HydrophobicContact CD1-CD1 3.48Å; L159-L291 VanDerWaalsContact CD1-CD1 3.48Å; L180-L291 CarbonylContact C-O 3.55Å; L180-L291 WeakPolarHBondContact CA-O 3.4Å; Y181-L291 PolarHBondContact N-O 2.85Å; Y181-L291 PolarHBondContact O-N 3.41Å; F183-L291 HydrophobicContact CE2-CD1 4.32Å; W289-L291 HydrophobicContact CD2-CD1 4.35Å; W289-L291 HydrophobicContact CD2-CG 4.47Å; W289-L291 HydrophobicContact CE3-CD1 4.34Å; W289-L291 HydrophobicContact CH2-CD1 3.76Å; W289-L291 HydrophobicContact CZ2-CD1 3.74Å; W289-L291 HydrophobicContact CZ2-CD2 3.75Å; W289-L291 HydrophobicContact CZ2-CG 3.98Å; W289-L291 HydrophobicContact CZ3-CD1 4.05Å; L291-W296 CarbonylContact C-O 3.56Å; L291-W296 WeakPolarHBondContact CA-O 3.44Å; L291-H297 HydrophobicContact CD2-CB 4.15Å
292	S	82.6	Confident	72.4	Confident	4 Å²	4	42.1 Å²	42.1	3%	0.028	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	167.3	165.3	65.7	0	0	0	0	112.4	T179 T294 G295 W296	T179-S292 CarbonylContact O-C 3.5Å; S292-T294 PolarHBondContact O-N 3.34Å; S292-T294 PolarHBondContact OG-N 3.18Å; S292-T294 PolarHBondContact OG-OG1 3.28Å; S292-G295 PolarHBondContact O-N 3.33Å; S292-G295 PolarHBondContact OG-N 2.92Å; S292-W296 PolarHBondContact N-O 2.86Å; S292-W296 PolarHBondContact OG-N 2.82Å; S292-W296 PolarHBondContact OG-O 3.34Å
293	D	82.1	Confident	72.3	Confident	45 Å²	45	40.5 Å²	40.5	24%	0.241	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-25.5	165.3	69.5	-32.3	0	0	0	113.6	A156 R178 T179 G295	A156-D293 WeakPolarHBondContact CB-O 3.48Å; R178-D293 WeakPolarHBondContact CD-OD1 3.49Å; R178-D293 WeakPolarHBondContact CD-OD2 3.48Å; R178-D293 IonicContact CZ-OD1 2.72Å; R178-D293 IonicContact CZ-OD2 2.69Å; R178-D293 IonicContact NE-OD2 3.75Å; R178-D293 IonicContact NH1-OD1 2.77Å; R178-D293 PolarHBondContact NH1-OD1 3.3Å; R178-D293 IonicContact NH1-OD2 3.83Å; R178-D293 PolarHBondContact NH1-OD2 2.99Å; T179-D293 PolarHBondContact O-N 3.05Å; D293-G295 VanDerWaalsContact C-N 3.31Å
294	T	72	Confident	72.3	Confident	65 Å²	65	43.3 Å²	43.3	40%	0.399	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-0	171.4	56.8	0	0	0	0	114.1	S292 W296	S292-T294 PolarHBondContact O-N 3.34Å; S292-T294 PolarHBondContact OG-N 3.18Å; S292-T294 PolarHBondContact OG-OG1 3.28Å; T294-W296 VanDerWaalsContact C-N 3.34Å
295	G	71.4	Confident	72.2	Confident	32 Å²	32	42.6 Å²	42.6	33%	0.33	27%	0.272	S	S	.	.			trans	79.5	8.9	178.6	0	0	0	0	0	115.4	S292 D293	S292-G295 PolarHBondContact O-N 3.33Å; S292-G295 PolarHBondContact OG-N 2.92Å; D293-G295 VanDerWaalsContact C-N 3.31Å
296	W	70.8	Confident	71.6	Confident	129 Å²	129	38.3 Å²	38.3	49%	0.489	23%	0.228	S	C	.	.			trans	-77	129.5	173.3	-82.1	81	0	0	0	110.5	L291 S292 T294 L298 A320	L291-W296 CarbonylContact C-O 3.56Å; L291-W296 WeakPolarHBondContact CA-O 3.44Å; S292-W296 PolarHBondContact N-O 2.86Å; S292-W296 PolarHBondContact OG-N 2.82Å; S292-W296 PolarHBondContact OG-O 3.34Å; T294-W296 VanDerWaalsContact C-N 3.34Å; W296-L298 PolarHBondContact O-N 3.29Å; W296-A320 HydrophobicContact CZ2-CB 4.29Å
297	H	75.8	Confident	70.8	Confident	55 Å²	55	40.9 Å²	40.9	26%	0.255	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-72.6	120.2	170.2	166.6	-150.1	0	0	0	109.4	F284 W289 V290 L291 P299	F284-H297 HydrophobicContact CD2-CB 4.13Å; F284-H297 AromaticContact CD2-CE1 3.91Å; F284-H297 AromaticContact CD2-CG 3.82Å; F284-H297 AromaticContact CD2-ND1 3.28Å; F284-H297 VanDerWaalsContact CD2-ND1 3.28Å; F284-H297 WeakPolarHBondContact CD2-ND1 3.43Å; F284-H297 HydrophobicContact CE2-CB 3.59Å; F284-H297 AromaticContact CE2-CG 3.82Å; F284-H297 AromaticContact CE2-ND1 3.56Å; F284-H297 AromaticContact CG-ND1 3.91Å; F284-H297 HydrophobicContact CZ-CB 4.4Å; W289-H297 AromaticContact CD1-CD2 3.29Å; W289-H297 AromaticContact CD1-CG 3.75Å; W289-H297 AromaticContact CD1-NE2 3.48Å; W289-H297 AromaticContact NE1-CD2 3.43Å; W289-H297 PolarHBondContact NE1-CD2 2.97Å; W289-H297 AromaticContact NE1-CG 3.4Å; W289-H297 AromaticContact NE1-ND1 3.93Å; W289-H297 AromaticContact NE1-NE2 3.96Å; V290-H297 CarbonylContact O-C 3.5Å; V290-H297 WeakPolarHBondContact O-CA 3.4Å; V290-H297 PolarHBondContact O-CD2 2.83Å; L291-H297 HydrophobicContact CD2-CB 4.15Å; H297-P299 VanDerWaalsContact O-CD 3.29Å; H297-P299 WeakPolarHBondContact O-CD 3.35Å
298	L	75.2	Confident	70.1	Confident	16 Å²	16	44 Å²	44	8%	0.084	26%	0.256	C	S	.	.			trans	-81	108.4	167.9	-68	174	0	0	0	108	L180 V290 W296 L303	L180-L298 HydrophobicContact CD1-CD1 4.29Å; L180-L298 HydrophobicContact CD2-CD1 3.67Å; V290-L298 HydrophobicContact CG1-CD1 4.34Å; V290-L298 PolarHBondContact O-N 3.45Å; W296-L298 PolarHBondContact O-N 3.29Å; L298-L303 HydrophobicContact CB-CD1 4.02Å; L298-L303 HydrophobicContact CB-CD2 4.37Å; L298-L303 HydrophobicContact CB-CG 4.22Å; L298-L303 HydrophobicContact CD1-CD2 4.31Å
299	P	70.2	Confident	68.5	Low	59 Å²	59	49.7 Å²	49.7	38%	0.383	28%	0.281	S	S	.	.			trans	-60.3	141.6	-177	-21.5	34	0	0	0	110.8	H297 G301 I302 L303	H297-P299 VanDerWaalsContact O-CD 3.29Å; H297-P299 WeakPolarHBondContact O-CD 3.35Å; P299-G301 PolarHBondContact O-N 3.37Å; P299-I302 HydrophobicContact CG-CD1 4.3Å; P299-I302 HydrophobicContact CG-CG1 4.46Å; P299-I302 PolarHBondContact O-N 2.98Å; P299-L303 PolarHBondContact O-N 3.19Å
300	S	67.9	Low	67.2	Low	47 Å²	47	56.8 Å²	56.8	33%	0.329	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-13.9	-179.5	59.2	0	0	0	0	114.5	K304	S300-K304 WeakPolarHBondContact O-CB 3.29Å; S300-K304 VanDerWaalsContact O-CG 3.24Å; S300-K304 WeakPolarHBondContact O-CG 3.36Å; S300-K304 PolarHBondContact O-N 2.65Å
301	G	67.8	Low	65.5	Low	38 Å²	38	57.6 Å²	57.6	39%	0.392	32%	0.319	S	S	.	.	H	α-helix	trans	-68	-54.5	168	0	0	0	0	0	112.4	P299 L303 K304 D305	P299-G301 PolarHBondContact O-N 3.37Å; G301-L303 PolarHBondContact O-N 3.28Å; G301-L303 VanDerWaalsContact O-N 3.12Å; G301-K304 PolarHBondContact O-N 3.38Å; G301-D305 PolarHBondContact O-N 3.42Å; G301-D305 VanDerWaalsContact O-N 3.17Å
302	I	67.2	Low	64	Low	67 Å²	67	60.7 Å²	60.7	34%	0.344	34%	0.335	S	S	.	.	H	α-helix	trans	-56.6	-33.3	178.6	-55.5	-169	0	0	0	111.2	P299 V311	P299-I302 HydrophobicContact CG-CD1 4.3Å; P299-I302 HydrophobicContact CG-CG1 4.46Å; P299-I302 PolarHBondContact O-N 2.98Å; I302-V311 HydrophobicContact CG2-CG1 4.07Å
303	L	69.3	Low	62.5	Low	1 Å²	1	64 Å²	64	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-81.5	-29.9	177.6	-63.3	177	0	0	0	113.5	L194 A197 L201 V290 L298 P299 G301 A306	L194-L303 HydrophobicContact CD1-CB 3.76Å; L194-L303 HydrophobicContact CD2-CD1 3.95Å; L194-L303 HydrophobicContact CG-CB 4.21Å; A197-L303 WeakPolarHBondContact CB-O 3.43Å; L201-L303 HydrophobicContact CD1-CD2 3.43Å; L201-L303 VanDerWaalsContact CD1-CD2 3.43Å; V290-L303 HydrophobicContact CB-CD1 3.63Å; V290-L303 HydrophobicContact CG1-CD1 4.01Å; V290-L303 HydrophobicContact CG2-CD1 3.57Å; L298-L303 HydrophobicContact CB-CD1 4.02Å; L298-L303 HydrophobicContact CB-CD2 4.37Å; L298-L303 HydrophobicContact CB-CG 4.22Å; L298-L303 HydrophobicContact CD1-CD2 4.31Å; P299-L303 PolarHBondContact O-N 3.19Å; G301-L303 PolarHBondContact O-N 3.28Å; G301-L303 VanDerWaalsContact O-N 3.12Å; L303-A306 WeakPolarHBondContact O-CB 3.36Å; L303-A306 PolarHBondContact O-N 3.1Å
304	K	62.8	Low	61	Low	78 Å²	78	66.8 Å²	66.8	34%	0.339	37%	0.372	S	S	.	.	H	α-helix	trans	-69	-35.4	175	-85.5	178.7	179.1	-173.3	0	112.3	N190 L194 S300 G301 A306	N190-K304 PolarHBondContact OD1-NZ 3.4Å; L194-K304 HydrophobicContact CD1-CG 4.36Å; S300-K304 WeakPolarHBondContact O-CB 3.29Å; S300-K304 VanDerWaalsContact O-CG 3.24Å; S300-K304 WeakPolarHBondContact O-CG 3.36Å; S300-K304 PolarHBondContact O-N 2.65Å; G301-K304 PolarHBondContact O-N 3.38Å; K304-A306 PolarHBondContact O-N 3.1Å
305	D	57.2	Low	60	Low	88 Å²	88	66.8 Å²	66.8	47%	0.471	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-79.9	3	176.7	-70.6	-43.6	0	0	0	114	G301 T307 S308 H309	G301-D305 PolarHBondContact O-N 3.42Å; G301-D305 VanDerWaalsContact O-N 3.17Å; D305-T307 PolarHBondContact O-N 3.44Å; D305-T307 VanDerWaalsContact O-N 3.07Å; D305-S308 PolarHBondContact O-N 3.44Å; D305-S308 PolarHBondContact O-OG 2.83Å; D305-H309 PolarHBondContact O-N 3.2Å
306	A	51.3	Low	59	Low	2 Å²	2	65.7 Å²	65.7	2%	0.017	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-61.9	-17.7	177.2	0	0	0	0	0	113.6	A197 Q200 L303 K304 V311	A197-A306 HydrophobicContact CB-CB 3.87Å; Q200-A306 PolarHBondContact NE2-O 3.22Å; Q200-A306 PolarHBondContact OE1-O 3.39Å; L303-A306 WeakPolarHBondContact O-CB 3.36Å; L303-A306 PolarHBondContact O-N 3.1Å; K304-A306 PolarHBondContact O-N 3.1Å; A306-V311 HydrophobicContact CB-CG2 3.92Å
307	T	50.5	Low	58	Low	102 Å²	102	63.6 Å²	63.6	63%	0.626	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-81.3	-13.8	173.7	50.4	0	0	0	0	114.3	D305	D305-T307 PolarHBondContact O-N 3.44Å; D305-T307 VanDerWaalsContact O-N 3.07Å
308	S	50.7	Low	56.4	Low	74 Å²	74	64.6 Å²	64.6	52%	0.517	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-28.9	-175.1	40	0	0	0	0	113.1	D305	D305-S308 PolarHBondContact O-N 3.44Å; D305-S308 PolarHBondContact O-OG 2.83Å
309	H	45.3	Very low	54.5	Low	130 Å²	130	69.7 Å²	69.7	60%	0.602	38%	0.384	S	S	*	.	S	Bend	trans	-127	134	177.1	-64.8	-65.6	0	0	0	110.6	D305 V311	D305-H309 PolarHBondContact O-N 3.2Å; H309-V311 PolarHBondContact O-N 3.43Å
310	H	52.8	Low	53	Low	154 Å²	154	69.5 Å²	69.5	71%	0.713	39%	0.388	S	S	*	.			trans	-56.5	124.3	163.3	-86.6	-85.6	0	0	0	108.5	N312	H310-N312 PolarHBondContact O-N 3.42Å
311	V	51.1	Low	51.4	Low	19 Å²	19	79.4 Å²	79.4	12%	0.115	42%	0.418	C	S	.	.			trans	-64.5	105.6	176.4	-177.3	0	0	0	0	107.1	L201 I302 A306 H309 P313 I316	L201-V311 HydrophobicContact CD2-CB 4.45Å; L201-V311 HydrophobicContact CD2-CG2 4.23Å; I302-V311 HydrophobicContact CG2-CG1 4.07Å; A306-V311 HydrophobicContact CB-CG2 3.92Å; H309-V311 PolarHBondContact O-N 3.43Å; V311-P313 WeakPolarHBondContact O-CD 3.35Å; V311-P313 VanDerWaalsContact O-N 3.11Å; V311-I316 HydrophobicContact CG1-CD1 3.78Å; V311-I316 HydrophobicContact CG1-CG1 4.25Å
312	N	50.4	Low	50.2	Low	69 Å²	69	78.6 Å²	78.6	37%	0.369	41%	0.41	S	S	.	.			trans	-51	120.6	-169.6	178.5	-8.7	0	0	0	110.2	H310 D314 L315	H310-N312 PolarHBondContact O-N 3.42Å; N312-D314 PolarHBondContact O-N 3.08Å; N312-D314 VanDerWaalsContact O-N 3.11Å; N312-D314 WeakPolarHBondContact OD1-CB 3.29Å; N312-D314 PolarHBondContact OD1-N 3.44Å; N312-D314 PolarHBondContact OD1-OD2 3.48Å; N312-L315 HydrophobicContact CB-CD1 4.08Å; N312-L315 HydrophobicContact CB-CG 4.14Å; N312-L315 WeakPolarHBondContact O-CB 3.4Å; N312-L315 PolarHBondContact O-N 3.34Å
313	P	50.2	Low	49.2	Very low	74 Å²	74	78.8 Å²	78.8	48%	0.481	41%	0.412	S	S	.	.	H	α-helix	trans	-49.6	-38.2	177.2	-29.6	36.5	0	0	0	112.7	V311 L315 I316 H317	V311-P313 WeakPolarHBondContact O-CD 3.35Å; V311-P313 VanDerWaalsContact O-N 3.11Å; P313-L315 PolarHBondContact O-N 2.66Å; P313-I316 PolarHBondContact O-N 3.02Å; P313-H317 WeakPolarHBondContact O-CB 3.41Å; P313-H317 PolarHBondContact O-CD2 2.72Å; P313-H317 VanDerWaalsContact O-CD2 3.23Å; P313-H317 PolarHBondContact O-N 3Å
314	D	50.1	Low	48.4	Very low	103 Å²	103	82.2 Å²	82.2	55%	0.551	43%	0.434	S	S	*	.	H	α-helix	trans	-62.5	-15.7	178.3	-58	-29.8	0	0	0	114.2	N312 R318	N312-D314 PolarHBondContact O-N 3.08Å; N312-D314 VanDerWaalsContact O-N 3.11Å; N312-D314 WeakPolarHBondContact OD1-CB 3.29Å; N312-D314 PolarHBondContact OD1-N 3.44Å; N312-D314 PolarHBondContact OD1-OD2 3.48Å; D314-R318 WeakPolarHBondContact O-CB 3.29Å; D314-R318 VanDerWaalsContact O-CD 3.25Å; D314-R318 WeakPolarHBondContact O-CD 3.17Å; D314-R318 WeakPolarHBondContact O-CG 3.29Å; D314-R318 PolarHBondContact O-NE 2.71Å
315	L	51	Low	48	Very low	66 Å²	66	84 Å²	84	35%	0.346	45%	0.446	S	S	.	.	H	α-helix	trans	-85.1	-27.6	172.7	-65.8	174.5	0	0	0	112.3	N312 P313	N312-L315 HydrophobicContact CB-CD1 4.08Å; N312-L315 HydrophobicContact CB-CG 4.14Å; N312-L315 WeakPolarHBondContact O-CB 3.4Å; N312-L315 PolarHBondContact O-N 3.34Å; P313-L315 PolarHBondContact O-N 2.66Å
316	I	52.3	Low	48	Very low	8 Å²	8	84.5 Å²	84.5	4%	0.041	44%	0.442	C	S	.	.	H	α-helix	trans	-94.5	-38.2	179	-58.1	174.7	0	0	0	111.2	F205 V311 P313 R318	F205-I316 HydrophobicContact CD1-CG2 4.34Å; F205-I316 HydrophobicContact CE1-CB 4.39Å; F205-I316 HydrophobicContact CE1-CD1 3.92Å; F205-I316 HydrophobicContact CE1-CG2 3.66Å; F205-I316 HydrophobicContact CE2-CD1 3.77Å; F205-I316 HydrophobicContact CZ-CB 4.47Å; F205-I316 HydrophobicContact CZ-CD1 3.42Å; F205-I316 VanDerWaalsContact CZ-CD1 3.42Å; F205-I316 HydrophobicContact CZ-CG2 4.21Å; V311-I316 HydrophobicContact CG1-CD1 3.78Å; V311-I316 HydrophobicContact CG1-CG1 4.25Å; P313-I316 PolarHBondContact O-N 3.02Å; I316-R318 PolarHBondContact O-N 3.01Å
317	H	49	Very low	48.1	Very low	86 Å²	86	88.5 Å²	88.5	40%	0.398	46%	0.463	S	S	.	.	S	Bend	trans	-76.3	-5.7	175.2	-70.2	-85	0	0	0	113.4	P313 T319	P313-H317 WeakPolarHBondContact O-CB 3.41Å; P313-H317 PolarHBondContact O-CD2 2.72Å; P313-H317 VanDerWaalsContact O-CD2 3.23Å; P313-H317 PolarHBondContact O-N 3Å; H317-T319 PolarHBondContact O-N 2.74Å
318	R	41.7	Very low	48.7	Very low	76 Å²	76	84.9 Å²	84.9	29%	0.287	44%	0.443	S	S	.	.			trans	-55.1	110.4	-179.1	-123.3	163.1	-131.8	-132.8	6.4	111.7	D314 I316 G322	D314-R318 WeakPolarHBondContact O-CB 3.29Å; D314-R318 VanDerWaalsContact O-CD 3.25Å; D314-R318 WeakPolarHBondContact O-CD 3.17Å; D314-R318 WeakPolarHBondContact O-CG 3.29Å; D314-R318 PolarHBondContact O-NE 2.71Å; I316-R318 PolarHBondContact O-N 3.01Å; R318-G322 WeakPolarHBondContact CD-O 3.41Å; R318-G322 PolarHBondContact NH1-O 2.92Å
319	T	36.1	Very low	49.3	Very low	122 Å²	122	82 Å²	82	75%	0.748	42%	0.422	S	S	*	.			trans	-56.1	140.9	159	50.4	0	0	0	0	108.7	H317 W321	H317-T319 PolarHBondContact O-N 2.74Å; T319-W321 PolarHBondContact O-N 3.49Å
320	A	37.3	Very low	50.1	Low	55 Å²	55	78 Å²	78	46%	0.455	40%	0.403	S	S	.	.	S	Bend	trans	-65.8	9.3	-157.6	0	0	0	0	0	117.7	W296	W296-A320 HydrophobicContact CZ2-CB 4.29Å
321	W	36	Very low	50.6	Low	255 Å²	255	74 Å²	74	97%	0.966	39%	0.388	S	S	*	.	S	Bend	trans	-129.1	50.8	-179.3	-72.7	91.9	0	0	0	112.4	T319	T319-W321 PolarHBondContact O-N 3.49Å
322	G	41.3	Very low	51.3	Low	21 Å²	21	77.5 Å²	77.5	22%	0.216	41%	0.405	C	S	.	.			trans	-137.4	70.5	165.5	0	0	0	0	0	109.7	R318	R318-G322 WeakPolarHBondContact CD-O 3.41Å; R318-G322 PolarHBondContact NH1-O 2.92Å
323	N	47.6	Very low	52.3	Low	72 Å²	72	79.9 Å²	79.9	39%	0.385	42%	0.418	S	S	.	.			trans	-70	126.4	-176.6	169.8	5.8	0	0	0	109.9	L325 W326 N327	N323-L325 PolarHBondContact O-N 2.87Å; N323-L325 VanDerWaalsContact OD1-CB 3.29Å; N323-L325 WeakPolarHBondContact OD1-CB 3.45Å; N323-L325 PolarHBondContact OD1-N 3.46Å; N323-W326 HydrophobicContact CB-CB 3.68Å; N323-W326 WeakPolarHBondContact O-CA 3.41Å; N323-W326 VanDerWaalsContact O-CB 3.31Å; N323-W326 WeakPolarHBondContact O-CB 3.5Å; N323-W326 PolarHBondContact O-N 2.92Å; N323-N327 PolarHBondContact O-N 3.4Å; N323-N327 PolarHBondContact O-OD1 2.86Å
324	P	51.1	Low	53.4	Low	73 Å²	73	79.5 Å²	79.5	47%	0.474	41%	0.411	S	S	.	.	H	α-helix	trans	-62	-31.4	179.2	25.4	-33.6	0	0	0	112.8	W326 A328	P324-W326 VanDerWaalsContact C-N 3.33Å; P324-A328 WeakPolarHBondContact O-CB 3.41Å; P324-A328 PolarHBondContact O-N 3.33Å
325	L	54.8	Low	54.4	Low	114 Å²	114	74.9 Å²	74.9	60%	0.597	39%	0.387	S	S	*	.	H	α-helix	trans	-67	-35.2	171.5	-162.2	85.3	0	0	0	111.6	N323 A328 L329	N323-L325 PolarHBondContact O-N 2.87Å; N323-L325 VanDerWaalsContact OD1-CB 3.29Å; N323-L325 WeakPolarHBondContact OD1-CB 3.45Å; N323-L325 PolarHBondContact OD1-N 3.46Å; L325-A328 PolarHBondContact O-N 3.08Å; L325-L329 HydrophobicContact CD2-CD1 4.28Å; L325-L329 HydrophobicContact CG-CD1 4.18Å; L325-L329 WeakPolarHBondContact O-CB 3.48Å; L325-L329 VanDerWaalsContact O-CG 3.23Å; L325-L329 WeakPolarHBondContact O-CG 3.42Å; L325-L329 PolarHBondContact O-N 3.27Å
326	W	56.7	Low	55.4	Low	99 Å²	99	73.2 Å²	73.2	38%	0.375	39%	0.386	S	S	.	.	H	α-helix	trans	-68.5	-48.2	176.6	-174.1	-89.9	0	0	0	110.8	N323 P324 A328 L329 H330 I366 L369	N323-W326 HydrophobicContact CB-CB 3.68Å; N323-W326 WeakPolarHBondContact O-CA 3.41Å; N323-W326 VanDerWaalsContact O-CB 3.31Å; N323-W326 WeakPolarHBondContact O-CB 3.5Å; N323-W326 PolarHBondContact O-N 2.92Å; P324-W326 VanDerWaalsContact C-N 3.33Å; W326-A328 PolarHBondContact O-N 2.94Å; W326-L329 CarbonylContact O-C 3.57Å; W326-L329 PolarHBondContact O-N 3.06Å; W326-H330 AromaticContact CD1-CD2 3.9Å; W326-H330 AromaticContact CD1-CE1 3.95Å; W326-H330 AromaticContact CD1-NE2 3.73Å; W326-H330 AromaticContact CE2-CE1 3.33Å; W326-H330 AromaticContact CE2-NE2 3.48Å; W326-H330 AromaticContact CZ2-CE1 3.51Å; W326-H330 AromaticContact CZ2-NE2 3.79Å; W326-H330 AromaticContact NE1-CD2 3.55Å; W326-H330 AromaticContact NE1-CE1 3.24Å; W326-H330 PolarHBondContact NE1-CE1 3.38Å; W326-H330 AromaticContact NE1-ND1 3.94Å; W326-H330 AromaticContact NE1-NE2 2.93Å; W326-H330 PolarHBondContact NE1-NE2 2.95Å; W326-H330 VanDerWaalsContact O-CB 3.31Å; W326-H330 WeakPolarHBondContact O-CB 3.43Å; W326-H330 PolarHBondContact O-N 3.13Å; W326-H330 PolarHBondContact O-ND1 3.32Å; W326-I366 HydrophobicContact CD2-CG2 4.27Å; W326-I366 HydrophobicContact CE3-CD1 4.5Å; W326-I366 HydrophobicContact CE3-CG1 4.38Å; W326-I366 HydrophobicContact CE3-CG2 3.9Å; W326-I366 HydrophobicContact CH2-CG1 4.4Å; W326-I366 HydrophobicContact CH2-CG2 4.22Å; W326-I366 HydrophobicContact CZ3-CB 4.38Å; W326-I366 HydrophobicContact CZ3-CD1 4.28Å; W326-I366 HydrophobicContact CZ3-CG1 3.81Å; W326-I366 HydrophobicContact CZ3-CG2 3.88Å; W326-L369 HydrophobicContact CH2-CD1 4.28Å
327	N	54.1	Low	56.7	Low	86 Å²	86	79 Å²	79	46%	0.46	42%	0.416	S	S	.	.	H	α-helix	trans	-62	-32.6	174.3	-68.3	25.9	0	0	0	112.2	N323 N331	N323-N327 PolarHBondContact O-N 3.4Å; N323-N327 PolarHBondContact O-OD1 2.86Å; N327-N331 PolarHBondContact O-N 2.95Å
328	A	63.6	Low	57.9	Low	26 Å²	26	76.4 Å²	76.4	22%	0.215	41%	0.407	C	S	.	.	H	α-helix	trans	-71.3	-44.3	174.3	0	0	0	0	0	112.3	P324 L325 W326 H330 N331 I334	P324-A328 WeakPolarHBondContact O-CB 3.41Å; P324-A328 PolarHBondContact O-N 3.33Å; L325-A328 PolarHBondContact O-N 3.08Å; W326-A328 PolarHBondContact O-N 2.94Å; A328-H330 PolarHBondContact O-N 3.49Å; A328-N331 VanDerWaalsContact O-CB 3.31Å; A328-N331 WeakPolarHBondContact O-CB 3.44Å; A328-N331 PolarHBondContact O-N 3.43Å; A328-I334 HydrophobicContact CB-CD1 3.88Å; A328-I334 HydrophobicContact CB-CG2 4.31Å; A328-I334 WeakPolarHBondContact O-CB 3.34Å
329	L	63	Low	59.6	Low	13 Å²	13	74.1 Å²	74.1	7%	0.068	40%	0.4	C	S	.	.	H	α-helix	trans	-72.4	-14.4	175.1	-66.9	174.9	0	0	0	113.3	L325 W326 T335 T363 I366	L325-L329 HydrophobicContact CD2-CD1 4.28Å; L325-L329 HydrophobicContact CG-CD1 4.18Å; L325-L329 WeakPolarHBondContact O-CB 3.48Å; L325-L329 VanDerWaalsContact O-CG 3.23Å; L325-L329 WeakPolarHBondContact O-CG 3.42Å; L325-L329 PolarHBondContact O-N 3.27Å; W326-L329 CarbonylContact O-C 3.57Å; W326-L329 PolarHBondContact O-N 3.06Å; L329-T335 PolarHBondContact O-OG1 2.84Å; L329-T363 HydrophobicContact CD1-CG2 4.45Å; L329-T363 HydrophobicContact CD2-CG2 3.51Å; L329-I366 HydrophobicContact CB-CB 4.5Å; L329-I366 HydrophobicContact CB-CG2 3.69Å; L329-I366 HydrophobicContact CD1-CD1 3.75Å; L329-I366 HydrophobicContact CD1-CG2 4.41Å
330	H	61.5	Low	61.8	Low	46 Å²	46	70.4 Å²	70.4	21%	0.213	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.7	165.1	-79.3	19.1	0	0	0	113.5	W326 A328 I366 Q370	W326-H330 AromaticContact CD1-CD2 3.9Å; W326-H330 AromaticContact CD1-CE1 3.95Å; W326-H330 AromaticContact CD1-NE2 3.73Å; W326-H330 AromaticContact CE2-CE1 3.33Å; W326-H330 AromaticContact CE2-NE2 3.48Å; W326-H330 AromaticContact CZ2-CE1 3.51Å; W326-H330 AromaticContact CZ2-NE2 3.79Å; W326-H330 AromaticContact NE1-CD2 3.55Å; W326-H330 AromaticContact NE1-CE1 3.24Å; W326-H330 PolarHBondContact NE1-CE1 3.38Å; W326-H330 AromaticContact NE1-ND1 3.94Å; W326-H330 AromaticContact NE1-NE2 2.93Å; W326-H330 PolarHBondContact NE1-NE2 2.95Å; W326-H330 VanDerWaalsContact O-CB 3.31Å; W326-H330 WeakPolarHBondContact O-CB 3.43Å; W326-H330 PolarHBondContact O-N 3.13Å; W326-H330 PolarHBondContact O-ND1 3.32Å; A328-H330 PolarHBondContact O-N 3.49Å; H330-I366 PolarHBondContact CE1-O 3.42Å; H330-I366 PolarHBondContact ND1-O 2.92Å; H330-Q370 HydrophobicContact CB-CG 4.19Å; H330-Q370 PolarHBondContact O-NE2 3.09Å; H330-Q370 PolarHBondContact O-OE1 2.93Å
331	N	63.7	Low	63.9	Low	72 Å²	72	69.2 Å²	69.2	39%	0.385	38%	0.375	S	S	.	.	S	Bend	trans	-93.6	114.6	174.4	-172.7	-35.7	0	0	0	109.2	N327 A328 N333 I334 T335	N327-N331 PolarHBondContact O-N 2.95Å; A328-N331 VanDerWaalsContact O-CB 3.31Å; A328-N331 WeakPolarHBondContact O-CB 3.44Å; A328-N331 PolarHBondContact O-N 3.43Å; N331-N333 PolarHBondContact O-N 3.41Å; N331-N333 VanDerWaalsContact O-N 3.12Å; N331-N333 WeakPolarHBondContact OD1-CB 3.41Å; N331-N333 PolarHBondContact OD1-N 3.35Å; N331-I334 HydrophobicContact CB-CB 4.33Å; N331-I334 HydrophobicContact CB-CD1 4.11Å; N331-I334 HydrophobicContact CB-CG1 4.21Å; N331-I334 PolarHBondContact O-N 2.97Å; N331-T335 PolarHBondContact O-N 3.04Å
332	L	66.3	Low	66	Low	92 Å²	92	57.6 Å²	57.6	48%	0.482	33%	0.333	S	S	.	.	H	α-helix	trans	-48.5	-40.9	-179.4	-177.9	65.5	0	0	0	112.8	G336 F367	L332-G336 PolarHBondContact O-N 3.28Å; L332-F367 HydrophobicContact CD1-CE2 3.83Å; L332-F367 HydrophobicContact CD1-CZ 3.73Å
333	N	71.2	Confident	67.8	Low	118 Å²	118	61.5 Å²	61.5	63%	0.631	35%	0.348	S	S	*	.	H	α-helix	trans	-68.6	-38.1	-177.9	-64	-9.8	0	0	0	111.8	N331 L337	N331-N333 PolarHBondContact O-N 3.41Å; N331-N333 VanDerWaalsContact O-N 3.12Å; N331-N333 WeakPolarHBondContact OD1-CB 3.41Å; N331-N333 PolarHBondContact OD1-N 3.35Å; N333-L337 WeakPolarHBondContact O-CB 3.38Å; N333-L337 VanDerWaalsContact O-CG 3.27Å; N333-L337 WeakPolarHBondContact O-CG 3.37Å; N333-L337 PolarHBondContact O-N 3.03Å
334	I	72.4	Confident	69.5	Low	66 Å²	66	62.7 Å²	62.7	34%	0.338	35%	0.353	S	S	.	.	H	α-helix	trans	-75.8	-42.5	179.8	-61.3	176.4	0	0	0	110	A328 N331 G336 L337 C338	A328-I334 HydrophobicContact CB-CD1 3.88Å; A328-I334 HydrophobicContact CB-CG2 4.31Å; A328-I334 WeakPolarHBondContact O-CB 3.34Å; N331-I334 HydrophobicContact CB-CB 4.33Å; N331-I334 HydrophobicContact CB-CD1 4.11Å; N331-I334 HydrophobicContact CB-CG1 4.21Å; N331-I334 PolarHBondContact O-N 2.97Å; I334-G336 VanDerWaalsContact C-N 3.31Å; I334-G336 PolarHBondContact O-N 2.8Å; I334-L337 PolarHBondContact O-N 3.22Å; I334-C338 WeakPolarHBondContact O-CB 3.21Å; I334-C338 PolarHBondContact O-N 3.17Å; I334-C338 PolarHBondContact O-SG 2.93Å; I334-C338 VanDerWaalsContact O-SG 3.37Å
335	T	70.7	Confident	70.9	Confident	6 Å²	6	62.4 Å²	62.4	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-36.3	174.9	-63.8	0	0	0	0	111.6	L329 N331 C338 L339 F367	L329-T335 PolarHBondContact O-OG1 2.84Å; N331-T335 PolarHBondContact O-N 3.04Å; T335-C338 WeakPolarHBondContact O-CB 3.46Å; T335-C338 PolarHBondContact O-N 3.33Å; T335-L339 HydrophobicContact CG2-CD1 4.34Å; T335-L339 WeakPolarHBondContact O-CB 3.45Å; T335-L339 WeakPolarHBondContact O-CG 3.44Å; T335-L339 PolarHBondContact O-N 2.68Å; T335-F367 HydrophobicContact CG2-CB 4.36Å; T335-F367 HydrophobicContact CG2-CD2 4.35Å; T335-F367 HydrophobicContact CG2-CG 4.44Å
336	G	72.6	Confident	72	Confident	32 Å²	32	57.9 Å²	57.9	33%	0.33	33%	0.329	S	S	.	.	H	α-helix	trans	-63.3	-43.9	170.2	0	0	0	0	0	113.5	L332 I334 L339 A340	L332-G336 PolarHBondContact O-N 3.28Å; I334-G336 VanDerWaalsContact C-N 3.31Å; I334-G336 PolarHBondContact O-N 2.8Å; G336-L339 PolarHBondContact O-N 3.4Å; G336-A340 WeakPolarHBondContact O-CB 3.35Å; G336-A340 PolarHBondContact O-N 3Å
337	L	79.6	Confident	73	Confident	128 Å²	128	59.6 Å²	59.6	67%	0.67	35%	0.345	S	S	*	.	H	α-helix	trans	-64.2	-37.4	173.1	-76.5	166.7	0	0	0	112.4	N333 I334 G341	N333-L337 WeakPolarHBondContact O-CB 3.38Å; N333-L337 VanDerWaalsContact O-CG 3.27Å; N333-L337 WeakPolarHBondContact O-CG 3.37Å; N333-L337 PolarHBondContact O-N 3.03Å; I334-L337 PolarHBondContact O-N 3.22Å; L337-G341 PolarHBondContact O-N 3.49Å
338	C	75.3	Confident	74.4	Confident	32 Å²	32	61.9 Å²	61.9	22%	0.216	36%	0.356	C	S	.	.	H	α-helix	trans	-64.2	-44.4	173.7	-77.7	0	0	0	0	111.9	I334 T335 S342 F359	I334-C338 WeakPolarHBondContact O-CB 3.21Å; I334-C338 PolarHBondContact O-N 3.17Å; I334-C338 PolarHBondContact O-SG 2.93Å; I334-C338 VanDerWaalsContact O-SG 3.37Å; T335-C338 WeakPolarHBondContact O-CB 3.46Å; T335-C338 PolarHBondContact O-N 3.33Å; C338-S342 WeakPolarHBondContact O-CB 3.2Å; C338-S342 PolarHBondContact O-N 2.9Å; C338-F359 HydrophobicContact CB-CE1 3.81Å; C338-F359 HydrophobicContact CB-CZ 4.24Å
339	L	77.5	Confident	75.3	Confident	28 Å²	28	68.8 Å²	68.8	15%	0.147	38%	0.376	C	S	.	.	H	α-helix	trans	-60.1	-55.5	173.8	-81.1	161	0	0	0	111.1	T335 G336 G341 S342 I343 T360	T335-L339 HydrophobicContact CG2-CD1 4.34Å; T335-L339 WeakPolarHBondContact O-CB 3.45Å; T335-L339 WeakPolarHBondContact O-CG 3.44Å; T335-L339 PolarHBondContact O-N 2.68Å; G336-L339 PolarHBondContact O-N 3.4Å; L339-G341 PolarHBondContact O-N 3.05Å; L339-S342 PolarHBondContact O-N 3.08Å; L339-S342 VanDerWaalsContact O-N 3.12Å; L339-S342 PolarHBondContact O-OG 3.11Å; L339-I343 WeakPolarHBondContact O-CG1 3.34Å; L339-I343 PolarHBondContact O-N 2.94Å; L339-T360 HydrophobicContact CD2-CG2 3.61Å
340	A	81.3	Confident	76	Confident	45 Å²	45	72.6 Å²	72.6	37%	0.372	40%	0.402	S	S	.	.	H	α-helix	trans	-59	-44.4	179.3	0	0	0	0	0	112.2	G336 S342 I343 I344	G336-A340 WeakPolarHBondContact O-CB 3.35Å; G336-A340 PolarHBondContact O-N 3Å; A340-S342 VanDerWaalsContact C-N 3.33Å; A340-S342 PolarHBondContact O-N 3.49Å; A340-I343 PolarHBondContact O-N 2.99Å; A340-I344 VanDerWaalsContact O-CG1 3.3Å; A340-I344 WeakPolarHBondContact O-CG1 3.44Å; A340-I344 PolarHBondContact O-N 3.46Å
341	G	82.2	Confident	76.8	Confident	29 Å²	29	77.2 Å²	77.2	30%	0.299	43%	0.427	S	S	.	.	H	α-helix	trans	-61.4	-37.9	174.9	0	0	0	0	0	113.1	L337 L339 T345	L337-G341 PolarHBondContact O-N 3.49Å; L339-G341 PolarHBondContact O-N 3.05Å; G341-T345 VanDerWaalsContact O-CB 3.27Å; G341-T345 WeakPolarHBondContact O-CB 3.44Å; G341-T345 PolarHBondContact O-N 3.48Å; G341-T345 PolarHBondContact O-OG1 2.91Å
342	S	80	Confident	77.6	Confident	12 Å²	12	74.7 Å²	74.7	8%	0.084	42%	0.417	C	S	.	.	H	α-helix	trans	-67.4	-38	175.2	82.5	0	0	0	0	112.6	C338 L339 A340 T345 A346 T360	C338-S342 WeakPolarHBondContact O-CB 3.2Å; C338-S342 PolarHBondContact O-N 2.9Å; L339-S342 PolarHBondContact O-N 3.08Å; L339-S342 VanDerWaalsContact O-N 3.12Å; L339-S342 PolarHBondContact O-OG 3.11Å; A340-S342 VanDerWaalsContact C-N 3.33Å; A340-S342 PolarHBondContact O-N 3.49Å; S342-T345 PolarHBondContact O-N 3.14Å; S342-A346 WeakPolarHBondContact O-CB 3.24Å; S342-A346 PolarHBondContact O-N 2.9Å; S342-T360 PolarHBondContact OG-OG1 3.32Å
343	I	79.7	Confident	78.2	Confident	102 Å²	102	74.3 Å²	74.3	52%	0.523	42%	0.415	S	S	.	.	H	α-helix	trans	-67.2	-46.6	175.7	-65.3	165.5	0	0	0	110.4	L339 A340 T345 A346 L347	L339-I343 WeakPolarHBondContact O-CG1 3.34Å; L339-I343 PolarHBondContact O-N 2.94Å; A340-I343 PolarHBondContact O-N 2.99Å; I343-T345 VanDerWaalsContact C-N 3.34Å; I343-T345 PolarHBondContact O-N 3.09Å; I343-A346 PolarHBondContact O-N 3.4Å; I343-L347 HydrophobicContact CG2-CD1 4.08Å; I343-L347 WeakPolarHBondContact O-CG 3.45Å; I343-L347 PolarHBondContact O-N 3.09Å
344	I	82.5	Confident	78.6	Confident	97 Å²	97	72.9 Å²	72.9	50%	0.497	41%	0.412	S	S	.	.	H	α-helix	trans	-62.4	-41.7	176.7	-67.6	164.5	0	0	0	110.8	A340 L347 I348	A340-I344 VanDerWaalsContact O-CG1 3.3Å; A340-I344 WeakPolarHBondContact O-CG1 3.44Å; A340-I344 PolarHBondContact O-N 3.46Å; I344-L347 PolarHBondContact O-N 3.45Å; I344-I348 HydrophobicContact CG2-CD1 3.74Å; I344-I348 WeakPolarHBondContact O-CG1 3.5Å; I344-I348 PolarHBondContact O-N 3.34Å
345	T	80.1	Confident	79	Confident	67 Å²	67	74.8 Å²	74.8	41%	0.411	43%	0.426	S	S	.	.	H	α-helix	trans	-65.2	-40.8	177.2	-56.6	0	0	0	0	111.4	G341 S342 I343 L347 I348 W349 A352	G341-T345 VanDerWaalsContact O-CB 3.27Å; G341-T345 WeakPolarHBondContact O-CB 3.44Å; G341-T345 PolarHBondContact O-N 3.48Å; G341-T345 PolarHBondContact O-OG1 2.91Å; S342-T345 PolarHBondContact O-N 3.14Å; I343-T345 VanDerWaalsContact C-N 3.34Å; I343-T345 PolarHBondContact O-N 3.09Å; T345-L347 VanDerWaalsContact C-N 3.35Å; T345-I348 PolarHBondContact O-N 3.43Å; T345-W349 CarbonylContact O-C 3.56Å; T345-W349 WeakPolarHBondContact O-CA 3.44Å; T345-W349 PolarHBondContact O-N 3.46Å; T345-A352 HydrophobicContact CG2-CB 4.02Å
346	A	78.2	Confident	79.6	Confident	19 Å²	19	75.3 Å²	75.3	16%	0.157	43%	0.43	C	S	.	.	H	α-helix	trans	-67.8	-31.2	175.5	0	0	0	0	0	113.2	S342 I343 P350 L353	S342-A346 WeakPolarHBondContact O-CB 3.24Å; S342-A346 PolarHBondContact O-N 2.9Å; I343-A346 PolarHBondContact O-N 3.4Å; A346-P350 WeakPolarHBondContact O-CA 3.4Å; A346-L353 HydrophobicContact CB-CB 4.3Å; A346-L353 HydrophobicContact CB-CD1 4.36Å; A346-L353 HydrophobicContact CB-CG 4.49Å
347	L	78.7	Confident	79.9	Confident	135 Å²	135	78.2 Å²	78.2	71%	0.707	44%	0.438	S	S	*	.	H	α-helix	trans	-71.9	-39.8	174.3	-74.9	166.4	0	0	0	112.7	I343 I344 T345	I343-L347 HydrophobicContact CG2-CD1 4.08Å; I343-L347 WeakPolarHBondContact O-CG 3.45Å; I343-L347 PolarHBondContact O-N 3.09Å; I344-L347 PolarHBondContact O-N 3.45Å; T345-L347 VanDerWaalsContact C-N 3.35Å
348	I	83	Confident	80	Confident	135 Å²	135	77.8 Å²	77.8	69%	0.692	44%	0.435	S	S	*	.	H	α-helix	trans	-80.4	-37.4	179.9	-64.8	170.9	0	0	0	111.5	I344 T345	I344-I348 HydrophobicContact CG2-CD1 3.74Å; I344-I348 WeakPolarHBondContact O-CG1 3.5Å; I344-I348 PolarHBondContact O-N 3.34Å; T345-I348 PolarHBondContact O-N 3.43Å
349	W	82.4	Confident	80.3	Confident	170 Å²	170	80.6 Å²	80.6	64%	0.644	44%	0.444	S	S	*	.			trans	-132.2	84	-175.6	-166.3	-57.1	0	0	0	109.6	T345 L351 A352	T345-W349 CarbonylContact O-C 3.56Å; T345-W349 WeakPolarHBondContact O-CA 3.44Å; T345-W349 PolarHBondContact O-N 3.46Å; W349-L351 PolarHBondContact O-N 2.94Å; W349-L351 VanDerWaalsContact O-N 3.1Å; W349-A352 HydrophobicContact CB-CB 4.39Å; W349-A352 HydrophobicContact CG-CB 4.35Å; W349-A352 VanDerWaalsContact O-CB 3.31Å; W349-A352 WeakPolarHBondContact O-CB 3.42Å; W349-A352 PolarHBondContact O-N 3.33Å
350	P	77.7	Confident	80.3	Confident	93 Å²	93	80.7 Å²	80.7	60%	0.604	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-57	-30.2	-176	-29.3	37	0	0	0	114.9	A346 A352 L353	A346-P350 WeakPolarHBondContact O-CA 3.4Å; P350-A352 PolarHBondContact O-N 2.91Å; P350-L353 WeakPolarHBondContact O-CB 3.29Å; P350-L353 PolarHBondContact O-N 3.41Å; P350-L353 VanDerWaalsContact O-N 3.13Å
351	L	78.1	Confident	80.3	Confident	143 Å²	143	82 Å²	82	75%	0.749	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-64	-15.1	174.6	-78.6	164.1	0	0	0	114.1	W349	W349-L351 PolarHBondContact O-N 2.94Å; W349-L351 VanDerWaalsContact O-N 3.1Å
352	A	81.4	Confident	80.1	Confident	19 Å²	19	84 Å²	84	16%	0.157	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-84.1	-13.3	176.7	0	0	0	0	0	112.5	T345 W349 P350 P354 V355 C356	T345-A352 HydrophobicContact CG2-CB 4.02Å; W349-A352 HydrophobicContact CB-CB 4.39Å; W349-A352 HydrophobicContact CG-CB 4.35Å; W349-A352 VanDerWaalsContact O-CB 3.31Å; W349-A352 WeakPolarHBondContact O-CB 3.42Å; W349-A352 PolarHBondContact O-N 3.33Å; P350-A352 PolarHBondContact O-N 2.91Å; A352-P354 VanDerWaalsContact C-CD 3.45Å; A352-V355 WeakPolarHBondContact O-CA 3.27Å; A352-V355 WeakPolarHBondContact O-CB 3.25Å; A352-V355 PolarHBondContact O-N 2.84Å; A352-C356 PolarHBondContact O-N 3.14Å; A352-C356 PolarHBondContact O-SG 3.39Å
353	L	78.7	Confident	79.7	Confident	85 Å²	85	83.4 Å²	83.4	45%	0.445	45%	0.448	S	S	.	.	H	α-helix	trans	-52.5	-39	-172.8	-176	147.4	0	0	0	114.8	A346 P350 V355 C356 L357	A346-L353 HydrophobicContact CB-CB 4.3Å; A346-L353 HydrophobicContact CB-CD1 4.36Å; A346-L353 HydrophobicContact CB-CG 4.49Å; P350-L353 WeakPolarHBondContact O-CB 3.29Å; P350-L353 PolarHBondContact O-N 3.41Å; P350-L353 VanDerWaalsContact O-N 3.13Å; L353-V355 PolarHBondContact O-N 3.46Å; L353-C356 PolarHBondContact O-N 2.92Å; L353-L357 HydrophobicContact CD2-CD1 3.65Å; L353-L357 HydrophobicContact CD2-CG 4.41Å; L353-L357 HydrophobicContact CG-CD1 4.48Å; L353-L357 WeakPolarHBondContact O-CB 3.33Å; L353-L357 PolarHBondContact O-N 2.89Å
354	P	78.6	Confident	79.4	Confident	88 Å²	88	79.8 Å²	79.8	57%	0.571	43%	0.432	S	S	*	.	H	α-helix	trans	-65	-37.4	174.9	-22	34.4	0	0	0	113.4	A352 L358	A352-P354 VanDerWaalsContact C-CD 3.45Å; P354-L358 PolarHBondContact O-N 3.27Å
355	V	80.1	Confident	78.9	Confident	105 Å²	105	78.5 Å²	78.5	64%	0.636	43%	0.428	S	S	*	.	H	α-helix	trans	-71.5	-41	176.7	-177.4	0	0	0	0	110	A352 L353 L357 L358 F359	A352-V355 WeakPolarHBondContact O-CA 3.27Å; A352-V355 WeakPolarHBondContact O-CB 3.25Å; A352-V355 PolarHBondContact O-N 2.84Å; L353-V355 PolarHBondContact O-N 3.46Å; V355-L357 VanDerWaalsContact C-N 3.35Å; V355-L357 PolarHBondContact O-N 2.69Å; V355-L358 PolarHBondContact O-N 3.07Å; V355-F359 VanDerWaalsContact O-CB 3.25Å; V355-F359 WeakPolarHBondContact O-CB 3.13Å; V355-F359 PolarHBondContact O-N 2.72Å
356	C	83.4	Confident	78.4	Confident	17 Å²	17	76.5 Å²	76.5	12%	0.115	42%	0.415	C	S	.	.	H	α-helix	trans	-61.8	-39.6	174.2	-62.6	0	0	0	0	112.3	A352 L353 T360	A352-C356 PolarHBondContact O-N 3.14Å; A352-C356 PolarHBondContact O-SG 3.39Å; L353-C356 PolarHBondContact O-N 2.92Å; C356-T360 WeakPolarHBondContact O-CB 3.32Å; C356-T360 PolarHBondContact O-N 2.94Å; C356-T360 PolarHBondContact O-OG1 2.9Å
357	L	80.7	Confident	77.9	Confident	94 Å²	94	79 Å²	79	49%	0.492	42%	0.422	S	S	.	.	H	α-helix	trans	-67.2	-46.8	174.3	-84.8	170.4	0	0	0	112.3	L353 V355 F359 T360 L361	L353-L357 HydrophobicContact CD2-CD1 3.65Å; L353-L357 HydrophobicContact CD2-CG 4.41Å; L353-L357 HydrophobicContact CG-CD1 4.48Å; L353-L357 WeakPolarHBondContact O-CB 3.33Å; L353-L357 PolarHBondContact O-N 2.89Å; V355-L357 VanDerWaalsContact C-N 3.35Å; V355-L357 PolarHBondContact O-N 2.69Å; L357-F359 PolarHBondContact O-N 3.5Å; L357-T360 PolarHBondContact O-N 3.49Å; L357-L361 WeakPolarHBondContact O-CB 3.35Å; L357-L361 PolarHBondContact O-N 3.33Å
358	L	80.7	Confident	77.4	Confident	118 Å²	118	78.8 Å²	78.8	62%	0.618	42%	0.419	S	S	*	.	H	α-helix	trans	-63.5	-43	178.3	-178.1	63.9	0	0	0	111.4	P354 V355 L361 V362	P354-L358 PolarHBondContact O-N 3.27Å; V355-L358 PolarHBondContact O-N 3.07Å; L358-L361 PolarHBondContact O-N 2.88Å; L358-V362 WeakPolarHBondContact O-CG2 3.35Å; L358-V362 PolarHBondContact O-N 3.05Å
359	F	80.7	Confident	76.6	Confident	92 Å²	92	77.4 Å²	77.4	40%	0.404	41%	0.413	S	S	.	.	H	α-helix	trans	-60.5	-50.2	174	-178.7	-111.4	0	0	0	110.9	C338 V355 L357 L361 V362 T363	C338-F359 HydrophobicContact CB-CE1 3.81Å; C338-F359 HydrophobicContact CB-CZ 4.24Å; V355-F359 VanDerWaalsContact O-CB 3.25Å; V355-F359 WeakPolarHBondContact O-CB 3.13Å; V355-F359 PolarHBondContact O-N 2.72Å; L357-F359 PolarHBondContact O-N 3.5Å; F359-L361 VanDerWaalsContact C-N 3.29Å; F359-L361 PolarHBondContact O-N 3.25Å; F359-V362 PolarHBondContact O-N 3.07Å; F359-V362 VanDerWaalsContact O-N 3.12Å; F359-T363 HydrophobicContact CD1-CG2 4.33Å; F359-T363 HydrophobicContact CD2-CG2 4.2Å; F359-T363 HydrophobicContact CE1-CG2 4.02Å; F359-T363 HydrophobicContact CE2-CG2 3.87Å; F359-T363 HydrophobicContact CG-CG2 4.42Å; F359-T363 HydrophobicContact CZ-CG2 3.77Å; F359-T363 WeakPolarHBondContact O-CG2 3.34Å; F359-T363 PolarHBondContact O-N 2.85Å; F359-T363 PolarHBondContact O-OG1 3.23Å
360	T	79.3	Confident	75.6	Confident	29 Å²	29	72.6 Å²	72.6	18%	0.178	40%	0.397	C	S	.	.	H	α-helix	trans	-56.4	-39.6	175.7	-69.4	0	0	0	0	112.8	L339 S342 C356 L357 T363 S364	L339-T360 HydrophobicContact CD2-CG2 3.61Å; S342-T360 PolarHBondContact OG-OG1 3.32Å; C356-T360 WeakPolarHBondContact O-CB 3.32Å; C356-T360 PolarHBondContact O-N 2.94Å; C356-T360 PolarHBondContact O-OG1 2.9Å; L357-T360 PolarHBondContact O-N 3.49Å; T360-T363 WeakPolarHBondContact CA-OG1 3.46Å; T360-T363 PolarHBondContact O-OG1 3.09Å; T360-S364 WeakPolarHBondContact O-CB 3.22Å; T360-S364 PolarHBondContact O-N 3.34Å; T360-S364 PolarHBondContact O-OG 3Å
361	L	79.8	Confident	74.9	Confident	74 Å²	74	74.5 Å²	74.5	39%	0.387	39%	0.393	S	S	.	.	H	α-helix	trans	-68.1	-43.5	176.8	-172.6	150.9	0	0	0	110.9	L357 L358 F359 S364 V365	L357-L361 WeakPolarHBondContact O-CB 3.35Å; L357-L361 PolarHBondContact O-N 3.33Å; L358-L361 PolarHBondContact O-N 2.88Å; F359-L361 VanDerWaalsContact C-N 3.29Å; F359-L361 PolarHBondContact O-N 3.25Å; L361-S364 PolarHBondContact O-N 3.5Å; L361-V365 HydrophobicContact CD2-CG2 4.16Å; L361-V365 WeakPolarHBondContact O-CB 3.22Å; L361-V365 VanDerWaalsContact O-CG2 3.29Å; L361-V365 WeakPolarHBondContact O-CG2 3.32Å; L361-V365 PolarHBondContact O-N 2.97Å
362	V	77.5	Confident	74.2	Confident	69 Å²	69	74 Å²	74	42%	0.418	38%	0.381	S	S	.	.	H	α-helix	trans	-65.5	-44.4	176.8	170.7	0	0	0	0	111.7	L358 F359 V365 I366	L358-V362 WeakPolarHBondContact O-CG2 3.35Å; L358-V362 PolarHBondContact O-N 3.05Å; F359-V362 PolarHBondContact O-N 3.07Å; F359-V362 VanDerWaalsContact O-N 3.12Å; V362-V365 PolarHBondContact O-N 3.16Å; V362-I366 HydrophobicContact CG1-CD1 3.84Å; V362-I366 VanDerWaalsContact O-CG1 3.29Å; V362-I366 WeakPolarHBondContact O-CG1 3.35Å; V362-I366 PolarHBondContact O-N 3.47Å
363	T	73.2	Confident	73.5	Confident	1 Å²	1	78.8 Å²	78.8	1%	0.006	40%	0.395	C	S	.	.	H	α-helix	trans	-66.5	-39.3	176.3	59.1	0	0	0	0	111.5	L329 F359 T360 I366 F367	L329-T363 HydrophobicContact CD1-CG2 4.45Å; L329-T363 HydrophobicContact CD2-CG2 3.51Å; F359-T363 HydrophobicContact CD1-CG2 4.33Å; F359-T363 HydrophobicContact CD2-CG2 4.2Å; F359-T363 HydrophobicContact CE1-CG2 4.02Å; F359-T363 HydrophobicContact CE2-CG2 3.87Å; F359-T363 HydrophobicContact CG-CG2 4.42Å; F359-T363 HydrophobicContact CZ-CG2 3.77Å; F359-T363 WeakPolarHBondContact O-CG2 3.34Å; F359-T363 PolarHBondContact O-N 2.85Å; F359-T363 PolarHBondContact O-OG1 3.23Å; T360-T363 WeakPolarHBondContact CA-OG1 3.46Å; T360-T363 PolarHBondContact O-OG1 3.09Å; T363-I366 PolarHBondContact O-N 2.94Å; T363-F367 VanDerWaalsContact O-CB 3.28Å; T363-F367 WeakPolarHBondContact O-CB 3.41Å; T363-F367 PolarHBondContact O-N 3.36Å
364	S	72.6	Confident	73.2	Confident	25 Å²	25	75 Å²	75	18%	0.175	38%	0.375	C	S	.	.	H	α-helix	trans	-63.4	-41.1	174.2	-64.4	0	0	0	0	112.2	T360 L361 F367 M368	T360-S364 WeakPolarHBondContact O-CB 3.22Å; T360-S364 PolarHBondContact O-N 3.34Å; T360-S364 PolarHBondContact O-OG 3Å; L361-S364 PolarHBondContact O-N 3.5Å; S364-F367 PolarHBondContact O-N 3.04Å; S364-M368 WeakPolarHBondContact O-CB 3.32Å; S364-M368 VanDerWaalsContact O-CG 3.3Å; S364-M368 WeakPolarHBondContact O-CG 3.32Å; S364-M368 PolarHBondContact O-N 3.43Å
365	V	73.1	Confident	73.2	Confident	71 Å²	71	71.9 Å²	71.9	43%	0.43	36%	0.355	S	S	.	.	H	α-helix	trans	-66	-42	175.3	167.1	0	0	0	0	111.1	L361 V362 F367 M368 L369	L361-V365 HydrophobicContact CD2-CG2 4.16Å; L361-V365 WeakPolarHBondContact O-CB 3.22Å; L361-V365 VanDerWaalsContact O-CG2 3.29Å; L361-V365 WeakPolarHBondContact O-CG2 3.32Å; L361-V365 PolarHBondContact O-N 2.97Å; V362-V365 PolarHBondContact O-N 3.16Å; V365-F367 VanDerWaalsContact C-N 3.31Å; V365-F367 PolarHBondContact O-N 3.48Å; V365-M368 PolarHBondContact O-N 2.92Å; V365-L369 HydrophobicContact CG1-CD1 4.03Å; V365-L369 WeakPolarHBondContact O-CB 3.34Å; V365-L369 VanDerWaalsContact O-CG 3.25Å; V365-L369 WeakPolarHBondContact O-CG 3.29Å; V365-L369 PolarHBondContact O-N 2.9Å
366	I	69.4	Low	73.5	Confident	24 Å²	24	67 Å²	67	12%	0.123	33%	0.325	C	S	.	.	H	α-helix	trans	-65.1	-36.2	176.2	-68.3	168.3	0	0	0	111.3	W326 L329 H330 V362 T363 L369	W326-I366 HydrophobicContact CD2-CG2 4.27Å; W326-I366 HydrophobicContact CE3-CD1 4.5Å; W326-I366 HydrophobicContact CE3-CG1 4.38Å; W326-I366 HydrophobicContact CE3-CG2 3.9Å; W326-I366 HydrophobicContact CH2-CG1 4.4Å; W326-I366 HydrophobicContact CH2-CG2 4.22Å; W326-I366 HydrophobicContact CZ3-CB 4.38Å; W326-I366 HydrophobicContact CZ3-CD1 4.28Å; W326-I366 HydrophobicContact CZ3-CG1 3.81Å; W326-I366 HydrophobicContact CZ3-CG2 3.88Å; L329-I366 HydrophobicContact CB-CB 4.5Å; L329-I366 HydrophobicContact CB-CG2 3.69Å; L329-I366 HydrophobicContact CD1-CD1 3.75Å; L329-I366 HydrophobicContact CD1-CG2 4.41Å; H330-I366 PolarHBondContact CE1-O 3.42Å; H330-I366 PolarHBondContact ND1-O 2.92Å; V362-I366 HydrophobicContact CG1-CD1 3.84Å; V362-I366 VanDerWaalsContact O-CG1 3.29Å; V362-I366 WeakPolarHBondContact O-CG1 3.35Å; V362-I366 PolarHBondContact O-N 3.47Å; T363-I366 PolarHBondContact O-N 2.94Å; I366-L369 PolarHBondContact O-N 2.89Å
367	F	67.5	Low	73.8	Confident	73 Å²	73	66.4 Å²	66.4	32%	0.32	32%	0.321	S	S	.	.	H	α-helix	trans	-70.5	-40.2	173.9	-176.2	-99.1	0	0	0	112.4	L332 T335 T363 S364 V365 L369 Q370	L332-F367 HydrophobicContact CD1-CE2 3.83Å; L332-F367 HydrophobicContact CD1-CZ 3.73Å; T335-F367 HydrophobicContact CG2-CB 4.36Å; T335-F367 HydrophobicContact CG2-CD2 4.35Å; T335-F367 HydrophobicContact CG2-CG 4.44Å; T363-F367 VanDerWaalsContact O-CB 3.28Å; T363-F367 WeakPolarHBondContact O-CB 3.41Å; T363-F367 PolarHBondContact O-N 3.36Å; S364-F367 PolarHBondContact O-N 3.04Å; V365-F367 VanDerWaalsContact C-N 3.31Å; V365-F367 PolarHBondContact O-N 3.48Å; F367-L369 VanDerWaalsContact C-N 3.26Å; F367-L369 PolarHBondContact O-N 3.26Å; F367-Q370 WeakPolarHBondContact O-CB 3.48Å; F367-Q370 VanDerWaalsContact O-CG 3.3Å; F367-Q370 WeakPolarHBondContact O-CG 3.41Å; F367-Q370 PolarHBondContact O-N 2.92Å
368	M	67.3	Low	74	Confident	129 Å²	129	62.1 Å²	62.1	64%	0.635	30%	0.298	S	S	*	.	H	α-helix	trans	-68.7	-22.9	174.3	-75.6	-175	168.8	0	0	113.4	L72 S364 V365 Q370	L72-M368 HydrophobicContact CD2-CE 3.77Å; S364-M368 WeakPolarHBondContact O-CB 3.32Å; S364-M368 VanDerWaalsContact O-CG 3.3Å; S364-M368 WeakPolarHBondContact O-CG 3.32Å; S364-M368 PolarHBondContact O-N 3.43Å; V365-M368 PolarHBondContact O-N 2.92Å; M368-Q370 PolarHBondContact O-N 3.24Å
369	L	65.5	Low	74.3	Confident	106 Å²	106	56.9 Å²	56.9	56%	0.555	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	1.2	170.7	-71.4	169.3	0	0	0	113.2	W326 V365 I366 F367 R371	W326-L369 HydrophobicContact CH2-CD1 4.28Å; V365-L369 HydrophobicContact CG1-CD1 4.03Å; V365-L369 WeakPolarHBondContact O-CB 3.34Å; V365-L369 VanDerWaalsContact O-CG 3.25Å; V365-L369 WeakPolarHBondContact O-CG 3.29Å; V365-L369 PolarHBondContact O-N 2.9Å; I366-L369 PolarHBondContact O-N 2.89Å; F367-L369 VanDerWaalsContact C-N 3.26Å; F367-L369 PolarHBondContact O-N 3.26Å; L369-R371 PolarHBondContact O-N 3.03Å; L369-R371 VanDerWaalsContact O-N 3.17Å
370	Q	62.5	Low	74.4	Confident	69 Å²	69	57.5 Å²	57.5	32%	0.322	28%	0.277	S	S	.	.			trans	-67.5	112.9	171.4	-71	-162.9	-97.1	0	0	111.4	H330 F367 M368 W372	H330-Q370 HydrophobicContact CB-CG 4.19Å; H330-Q370 PolarHBondContact O-NE2 3.09Å; H330-Q370 PolarHBondContact O-OE1 2.93Å; F367-Q370 WeakPolarHBondContact O-CB 3.48Å; F367-Q370 VanDerWaalsContact O-CG 3.3Å; F367-Q370 WeakPolarHBondContact O-CG 3.41Å; F367-Q370 PolarHBondContact O-N 2.92Å; M368-Q370 PolarHBondContact O-N 3.24Å; Q370-W372 PolarHBondContact O-N 3.48Å
371	R	62.1	Low	74.3	Confident	134 Å²	134	62 Å²	62	51%	0.506	30%	0.304	S	S	.	.			trans	-66.5	94.2	161.4	-76.1	-172.1	176.7	-164.6	-3.8	109.6	L369 P387 D390 T412	L369-R371 PolarHBondContact O-N 3.03Å; L369-R371 VanDerWaalsContact O-N 3.17Å; R371-P387 HydrophobicContact CB-CB 4.41Å; R371-P387 HydrophobicContact CB-CG 3.84Å; R371-P387 HydrophobicContact CG-CG 4.25Å; R371-D390 IonicContact CZ-OD2 2.72Å; R371-D390 VanDerWaalsContact NH1-CG 3.26Å; R371-D390 IonicContact NH1-OD1 3.2Å; R371-D390 PolarHBondContact NH1-OD1 3.44Å; R371-D390 IonicContact NH1-OD2 2.74Å; R371-D390 PolarHBondContact NH1-OD2 3.01Å; R371-T412 VanDerWaalsContact NH1-CG2 3.31Å
372	W	64.2	Low	73.8	Confident	131 Å²	131	62 Å²	62	50%	0.496	30%	0.304	S	S	.	.			trans	-57.2	142.9	164.9	-177.8	77.8	0	0	0	109.3	Q370 C374 M378 L382 P387	Q370-W372 PolarHBondContact O-N 3.48Å; W372-C374 WeakPolarHBondContact CH2-SG 3.44Å; W372-M378 HydrophobicContact CD2-CE 4.48Å; W372-M378 HydrophobicContact CE3-CE 3.49Å; W372-M378 VanDerWaalsContact CE3-CE 3.49Å; W372-M378 HydrophobicContact CE3-SD 4.24Å; W372-M378 HydrophobicContact CZ3-CE 3.86Å; W372-M378 HydrophobicContact CZ3-CG 4.22Å; W372-M378 HydrophobicContact CZ3-SD 4.15Å; W372-M378 WeakPolarHBondContact O-CE 3.41Å; W372-L382 HydrophobicContact CZ3-CD1 4.33Å; W372-P387 WeakPolarHBondContact O-CG 3.37Å
373	R	67.2	Low	73.4	Confident	120 Å²	120	64 Å²	64	45%	0.453	32%	0.321	S	S	.	.			trans	-140.2	130.1	-176.8	170.8	167.3	166.3	-171.2	-9.8	110.4	P387 R431	R373-P387 HydrophobicContact CB-CB 4.48Å; R373-R431 PolarHBondContact O-NH1 2.69Å
374	C	72.4	Confident	73.4	Confident	5 Å²	5	68.9 Å²	68.9	3%	0.034	35%	0.347	C	S	.	.			trans	-65.1	154.5	167.8	-79.9	0	0	0	0	111.2	W372 L376 R377 M378	W372-C374 WeakPolarHBondContact CH2-SG 3.44Å; C374-L376 PolarHBondContact O-N 3.26Å; C374-R377 WeakPolarHBondContact CB-O 3.48Å; C374-R377 PolarHBondContact SG-O 2.9Å; C374-R377 VanDerWaalsContact SG-O 3.33Å; C374-M378 HydrophobicContact CB-CG 4.28Å
375	P	77.9	Confident	73.7	Confident	24 Å²	24	71.4 Å²	71.4	16%	0.156	36%	0.359	C	S	.	.	S	Bend	trans	-62.5	-33	172.8	-19.8	32.4	0	0	0	112.7	R431 L433 V878	P375-R431 HydrophobicContact CG-CB 4.25Å; P375-L433 HydrophobicContact CB-CD2 3.65Å; P375-L433 HydrophobicContact CG-CD2 3.76Å; P375-V878 HydrophobicContact CB-CG1 3.99Å; P375-V878 HydrophobicContact CB-CG2 4.27Å
376	L	86.8	Confident	74	Confident	1 Å²	1	68 Å²	68	1%	0.005	34%	0.338	C	S	.	.	S	Bend	trans	-113	-117.8	170.7	-56.9	-178.3	0	0	0	109.7	C374 S388 L433 W434 L435 T871 F873 V878	C374-L376 PolarHBondContact O-N 3.26Å; L376-S388 WeakPolarHBondContact O-CB 3.5Å; L376-S388 PolarHBondContact O-OG 2.81Å; L376-L433 HydrophobicContact CD1-CB 3.91Å; L376-L433 HydrophobicContact CD1-CD2 4.48Å; L376-L433 HydrophobicContact CG-CB 4.47Å; L376-L433 HydrophobicContact CG-CD2 4.23Å; L376-W434 WeakPolarHBondContact CB-O 3.41Å; L376-L435 HydrophobicContact CD1-CD2 4.13Å; L376-T871 HydrophobicContact CD1-CG2 4.35Å; L376-T871 HydrophobicContact CD2-CG2 4.43Å; L376-F873 HydrophobicContact CD2-CB 3.64Å; L376-F873 HydrophobicContact CD2-CD1 3.62Å; L376-F873 HydrophobicContact CD2-CD2 4.31Å; L376-F873 HydrophobicContact CD2-CE1 4.32Å; L376-F873 HydrophobicContact CD2-CG 3.6Å; L376-V878 HydrophobicContact CD2-CG2 3.97Å
377	R	88.8	Confident	74.3	Confident	6 Å²	6	67.8 Å²	67.8	2%	0.023	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-93.7	163	174.9	-52	-51.3	-168	174	5.4	112.4	C374 S388 Q389 W434 D439	C374-R377 WeakPolarHBondContact CB-O 3.48Å; C374-R377 PolarHBondContact SG-O 2.9Å; C374-R377 VanDerWaalsContact SG-O 3.33Å; R377-S388 WeakPolarHBondContact CD-OG 3.5Å; R377-S388 VanDerWaalsContact NH1-C 3.28Å; R377-S388 PolarHBondContact NH1-O 2.92Å; R377-S388 PolarHBondContact NH1-OG 2.96Å; R377-Q389 VanDerWaalsContact CZ-CD 3.43Å; R377-Q389 VanDerWaalsContact CZ-NE2 3.25Å; R377-W434 HydrophobicContact CB-CB 4.41Å; R377-W434 VanDerWaalsContact CB-O 3.31Å; R377-W434 WeakPolarHBondContact CB-O 3.42Å; R377-W434 WeakPolarHBondContact CG-O 3.43Å; R377-W434 PolarHBondContact N-O 3.36Å; R377-D439 WeakPolarHBondContact CG-OD2 3.14Å; R377-D439 IonicContact CZ-OD1 3.79Å; R377-D439 IonicContact CZ-OD2 3.11Å; R377-D439 IonicContact NE-OD1 3.84Å; R377-D439 IonicContact NE-OD2 2.7Å; R377-D439 PolarHBondContact NE-OD2 2.71Å; R377-D439 IonicContact NH2-OD1 2.96Å; R377-D439 PolarHBondContact NH2-OD1 3.46Å; R377-D439 IonicContact NH2-OD2 2.69Å
378	M	85.7	Confident	74.6	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.02	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-85.1	140.2	162.7	-67.3	-170.8	-174.1	0	0	111.2	W372 C374 L382 D386 P387 A415 R416 G417	W372-M378 HydrophobicContact CD2-CE 4.48Å; W372-M378 HydrophobicContact CE3-CE 3.49Å; W372-M378 VanDerWaalsContact CE3-CE 3.49Å; W372-M378 HydrophobicContact CE3-SD 4.24Å; W372-M378 HydrophobicContact CZ3-CE 3.86Å; W372-M378 HydrophobicContact CZ3-CG 4.22Å; W372-M378 HydrophobicContact CZ3-SD 4.15Å; W372-M378 WeakPolarHBondContact O-CE 3.41Å; C374-M378 HydrophobicContact CB-CG 4.28Å; M378-L382 HydrophobicContact CB-CD1 4.39Å; M378-D386 HydrophobicContact CB-CB 4.09Å; M378-D386 HydrophobicContact CG-CB 4.14Å; M378-D386 PolarHBondContact N-OD2 3.02Å; M378-D386 HydrophobicContact SD-CB 4.25Å; M378-P387 HydrophobicContact CE-CG 4.41Å; M378-A415 HydrophobicContact CB-CB 3.67Å; M378-R416 PolarHBondContact O-N 3.25Å; M378-G417 VanDerWaalsContact O-CA 3.29Å; M378-G417 WeakPolarHBondContact O-CA 3.34Å; M378-G417 PolarHBondContact O-N 3.24Å
379	P	85.8	Confident	75	Confident	8 Å²	8	60 Å²	60	5%	0.052	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-61.4	138.2	172.5	21.8	-29	0	0	0	111.8	T381 L382 A415 G417 W434	P379-T381 PolarHBondContact O-N 2.83Å; P379-T381 VanDerWaalsContact O-N 3.14Å; P379-L382 HydrophobicContact CG-CD1 3.78Å; P379-L382 HydrophobicContact CG-CG 4.05Å; P379-L382 PolarHBondContact O-N 3.42Å; P379-L382 VanDerWaalsContact O-N 3.12Å; P379-A415 VanDerWaalsContact O-CB 3.28Å; P379-A415 WeakPolarHBondContact O-CB 3.23Å; P379-G417 WeakPolarHBondContact CA-O 3.32Å; P379-W434 HydrophobicContact CB-CD2 3.78Å; P379-W434 HydrophobicContact CB-CE3 4.22Å; P379-W434 HydrophobicContact CB-CG 4.13Å; P379-W434 HydrophobicContact CB-CH2 4.4Å; P379-W434 HydrophobicContact CB-CZ2 3.98Å; P379-W434 HydrophobicContact CG-CD2 4.41Å; P379-W434 HydrophobicContact CG-CG 4.43Å; P379-W434 HydrophobicContact CG-CZ2 4.48Å
380	M	83.7	Confident	75.4	Confident	104 Å²	104	57 Å²	57	51%	0.512	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-59.9	-25.8	-174.5	-171	-179.3	-66.6	0	0	113.3	L382 S383 G417 I418	M380-L382 PolarHBondContact O-N 3.34Å; M380-S383 PolarHBondContact O-N 3.48Å; M380-G417 WeakPolarHBondContact CB-O 3.24Å; M380-G417 PolarHBondContact N-O 2.99Å; M380-I418 HydrophobicContact CE-CG2 3.62Å
381	T	77.3	Confident	75.8	Confident	123 Å²	123	60.6 Å²	60.6	76%	0.755	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-63.9	-16.6	176.6	48.1	0	0	0	0	114.5	P379 S383	P379-T381 PolarHBondContact O-N 2.83Å; P379-T381 VanDerWaalsContact O-N 3.14Å; T381-S383 VanDerWaalsContact C-N 3.33Å; T381-S383 PolarHBondContact O-N 2.8Å
382	L	69.9	Low	76.4	Confident	74 Å²	74	61 Å²	61	39%	0.387	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-76.7	-13.4	-179.1	-74.5	174.2	0	0	0	114.5	W372 M378 P379 M380 L384	W372-L382 HydrophobicContact CZ3-CD1 4.33Å; M378-L382 HydrophobicContact CB-CD1 4.39Å; P379-L382 HydrophobicContact CG-CD1 3.78Å; P379-L382 HydrophobicContact CG-CG 4.05Å; P379-L382 PolarHBondContact O-N 3.42Å; P379-L382 VanDerWaalsContact O-N 3.12Å; M380-L382 PolarHBondContact O-N 3.34Å; L382-L384 WeakPolarHBondContact O-CG 3.25Å; L382-L384 PolarHBondContact O-N 3.36Å
383	S	69.4	Low	76.7	Confident	112 Å²	112	56.9 Å²	56.9	78%	0.783	29%	0.293	S	S	*	.			trans	53	14.8	-179.8	-62.9	0	0	0	0	116.4	M380 T381	M380-S383 PolarHBondContact O-N 3.48Å; T381-S383 VanDerWaalsContact C-N 3.33Å; T381-S383 PolarHBondContact O-N 2.8Å
384	L	73.3	Confident	76.6	Confident	104 Å²	104	59.3 Å²	59.3	55%	0.545	30%	0.302	S	S	.	.	S	Bend	trans	-100.4	160.2	-179.5	-73.4	166.1	0	0	0	111.7	L382 P414 A415	L382-L384 WeakPolarHBondContact O-CG 3.25Å; L382-L384 PolarHBondContact O-N 3.36Å; L384-P414 CarbonylContact O-C 3.55Å; L384-P414 WeakPolarHBondContact O-CA 3.31Å; L384-A415 PolarHBondContact O-N 2.94Å
385	D	77.1	Confident	75.8	Confident	78 Å²	78	63.8 Å²	63.8	42%	0.417	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-65.5	131.5	166.6	-83.5	-19.3	0	0	0	110.6	P387 T412 F413	D385-P387 WeakPolarHBondContact O-CD 3.38Å; D385-T412 HydrophobicContact CB-CG2 4.25Å; D385-T412 WeakPolarHBondContact OD2-CB 3.45Å; D385-T412 WeakPolarHBondContact OD2-CG2 3.26Å; D385-T412 PolarHBondContact OD2-OG1 2.69Å; D385-F413 WeakPolarHBondContact CA-O 3.43Å
386	D	79.7	Confident	74.5	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.32	C	S	.	.			trans	-100.4	106.5	-178.7	177.4	-6.6	0	0	0	111	M378 S388 Q389 F413 A415	M378-D386 HydrophobicContact CB-CB 4.09Å; M378-D386 HydrophobicContact CG-CB 4.14Å; M378-D386 PolarHBondContact N-OD2 3.02Å; M378-D386 HydrophobicContact SD-CB 4.25Å; D386-S388 PolarHBondContact O-N 3.33Å; D386-S388 WeakPolarHBondContact OD1-CB 3.37Å; D386-S388 PolarHBondContact OD1-N 3.18Å; D386-S388 PolarHBondContact OD1-OG 3.28Å; D386-S388 PolarHBondContact OD2-OG 3.37Å; D386-S388 VanDerWaalsContact OD2-OG 3.11Å; D386-Q389 HydrophobicContact CB-CG 4.27Å; D386-Q389 WeakPolarHBondContact O-CB 3.5Å; D386-Q389 PolarHBondContact O-N 3.22Å; D386-F413 PolarHBondContact N-O 3.01Å; D386-A415 HydrophobicContact CB-CB 4.4Å
387	P	75.5	Confident	72.4	Confident	19 Å²	19	68.4 Å²	68.4	12%	0.123	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-0.2	-177.7	-18.5	34.8	0	0	0	114.6	R371 W372 R373 M378 D385 Q389 D390	R371-P387 HydrophobicContact CB-CB 4.41Å; R371-P387 HydrophobicContact CB-CG 3.84Å; R371-P387 HydrophobicContact CG-CG 4.25Å; W372-P387 WeakPolarHBondContact O-CG 3.37Å; R373-P387 HydrophobicContact CB-CB 4.48Å; M378-P387 HydrophobicContact CE-CG 4.41Å; D385-P387 WeakPolarHBondContact O-CD 3.38Å; P387-Q389 VanDerWaalsContact C-N 3.29Å; P387-D390 WeakPolarHBondContact CA-OD2 3.3Å; P387-D390 WeakPolarHBondContact CB-OD2 3.47Å
388	S	74.3	Confident	70.4	Confident	20 Å²	20	72.3 Å²	72.3	14%	0.14	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-17.9	164.9	78.7	0	0	0	0	112.5	L376 R377 D386	L376-S388 WeakPolarHBondContact O-CB 3.5Å; L376-S388 PolarHBondContact O-OG 2.81Å; R377-S388 WeakPolarHBondContact CD-OG 3.5Å; R377-S388 VanDerWaalsContact NH1-C 3.28Å; R377-S388 PolarHBondContact NH1-O 2.92Å; R377-S388 PolarHBondContact NH1-OG 2.96Å; D386-S388 PolarHBondContact O-N 3.33Å; D386-S388 WeakPolarHBondContact OD1-CB 3.37Å; D386-S388 PolarHBondContact OD1-N 3.18Å; D386-S388 PolarHBondContact OD1-OG 3.28Å; D386-S388 PolarHBondContact OD2-OG 3.37Å; D386-S388 VanDerWaalsContact OD2-OG 3.11Å
389	Q	74.9	Confident	68.5	Low	17 Å²	17	76.3 Å²	76.3	8%	0.079	39%	0.389	C	S	.	.	S	Bend	trans	-99.9	-11.3	179	-59.5	-76.1	10.2	0	0	112.8	R377 D386 P387 R391 F413	R377-Q389 VanDerWaalsContact CZ-CD 3.43Å; R377-Q389 VanDerWaalsContact CZ-NE2 3.25Å; D386-Q389 HydrophobicContact CB-CG 4.27Å; D386-Q389 WeakPolarHBondContact O-CB 3.5Å; D386-Q389 PolarHBondContact O-N 3.22Å; P387-Q389 VanDerWaalsContact C-N 3.29Å; Q389-R391 WeakPolarHBondContact O-CG 3.35Å; Q389-R391 PolarHBondContact O-N 3.21Å; Q389-F413 HydrophobicContact CB-CB 3.88Å; Q389-F413 HydrophobicContact CB-CD2 4.22Å; Q389-F413 HydrophobicContact CB-CG 4.39Å; Q389-F413 WeakPolarHBondContact O-CD2 3.39Å
390	D	74.4	Confident	66.5	Low	43 Å²	43	81.7 Å²	81.7	23%	0.23	41%	0.412	C	S	.	.			trans	-48.8	122.1	-178.4	-85.4	-16.7	0	0	0	112.1	R371 P387 T412	R371-D390 IonicContact CZ-OD2 2.72Å; R371-D390 VanDerWaalsContact NH1-CG 3.26Å; R371-D390 IonicContact NH1-OD1 3.2Å; R371-D390 PolarHBondContact NH1-OD1 3.44Å; R371-D390 IonicContact NH1-OD2 2.74Å; R371-D390 PolarHBondContact NH1-OD2 3.01Å; P387-D390 WeakPolarHBondContact CA-OD2 3.3Å; P387-D390 WeakPolarHBondContact CB-OD2 3.47Å; D390-T412 WeakPolarHBondContact OD1-CA 3.39Å; D390-T412 VanDerWaalsContact OD1-CG2 3.27Å; D390-T412 WeakPolarHBondContact OD1-CG2 3.41Å
391	R	71.2	Confident	64.5	Low	146 Å²	146	83.7 Å²	83.7	55%	0.551	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	123	176.9	-64.7	-177.1	-173	-171.3	0.8	110.8	Q389 V393 E411 F413	Q389-R391 WeakPolarHBondContact O-CG 3.35Å; Q389-R391 PolarHBondContact O-N 3.21Å; R391-V393 HydrophobicContact CB-CG2 4.44Å; R391-V393 PolarHBondContact O-N 3.2Å; R391-E411 HydrophobicContact CB-CB 4.48Å; R391-E411 PolarHBondContact N-O 3.22Å; R391-E411 WeakPolarHBondContact O-CB 3.38Å; R391-E411 PolarHBondContact O-N 3.1Å; R391-F413 HydrophobicContact CB-CE2 4.11Å; R391-F413 HydrophobicContact CG-CE2 3.76Å; R391-F413 HydrophobicContact CG-CZ 4.47Å
392	K	74.7	Confident	63	Low	143 Å²	143	82 Å²	82	62%	0.622	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	101.5	170.6	-76.1	-173.4	158.4	-148.1	0	111	E408 D410	K392-E408 WeakPolarHBondContact CD-OE2 3.34Å; K392-E408 WeakPolarHBondContact CE-OE2 3.25Å; K392-E408 IonicContact NZ-OE2 2.71Å; K392-E408 PolarHBondContact NZ-OE2 3.15Å; K392-D410 WeakPolarHBondContact CG-OD1 3.18Å
393	V	71.3	Confident	62	Low	44 Å²	44	83.9 Å²	83.9	27%	0.267	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.3	175.7	177.5	0	0	0	0	109.1	R391 R395 A409 E411	R391-V393 HydrophobicContact CB-CG2 4.44Å; R391-V393 PolarHBondContact O-N 3.2Å; V393-R395 HydrophobicContact CG1-CG 4.03Å; V393-R395 PolarHBondContact O-N 3.43Å; V393-R395 VanDerWaalsContact O-N 3.11Å; V393-A409 PolarHBondContact N-O 2.91Å; V393-A409 PolarHBondContact O-N 3.14Å; V393-E411 HydrophobicContact CB-CB 4.27Å; V393-E411 HydrophobicContact CG2-CB 3.68Å; V393-E411 HydrophobicContact CG2-CG 4.35Å
394	R	63.4	Low	60.6	Low	171 Å²	171	82.2 Å²	82.2	65%	0.645	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	109	170.5	-71.6	-169.2	179.9	-172.2	4.9	109.5	Y407 E408	R394-Y407 WeakPolarHBondContact CA-O 3.5Å; R394-E408 HydrophobicContact CG-CG 4.5Å
395	R	55.6	Low	59.3	Low	98 Å²	98	83 Å²	83	37%	0.37	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.6	173.3	-65	-174.4	175.3	177	-6.1	108.4	V393 Q406 Y407 A409 E411	V393-R395 HydrophobicContact CG1-CG 4.03Å; V393-R395 PolarHBondContact O-N 3.43Å; V393-R395 VanDerWaalsContact O-N 3.11Å; R395-Q406 WeakPolarHBondContact O-CA 3.37Å; R395-Y407 HydrophobicContact CB-CE1 3.99Å; R395-Y407 PolarHBondContact N-O 3.24Å; R395-Y407 WeakPolarHBondContact O-CD1 3.42Å; R395-Y407 PolarHBondContact O-N 2.94Å; R395-A409 HydrophobicContact CB-CB 4.25Å; R395-A409 HydrophobicContact CG-CB 3.99Å; R395-E411 IonicContact CZ-OE1 2.77Å; R395-E411 IonicContact NE-OE1 3.39Å; R395-E411 IonicContact NH2-OE1 3.51Å; R395-E411 PolarHBondContact NH2-OE1 3.06Å
396	S	50.5	Low	58	Low	29 Å²	29	83.7 Å²	83.7	20%	0.203	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	139.7	166.1	176.5	0	0	0	0	109	F398 W401 L404	S396-F398 PolarHBondContact O-N 3.2Å; S396-F398 PolarHBondContact OG-N 2.82Å; S396-F398 PolarHBondContact OG-O 3.03Å; S396-W401 PolarHBondContact OG-O 2.96Å; S396-L404 PolarHBondContact OG-O 3.42Å; S396-L404 VanDerWaalsContact OG-O 3.1Å
397	L	43.4	Very low	57	Low	93 Å²	93	87.7 Å²	87.7	49%	0.487	42%	0.417	S	S	.	.	S	Bend	trans	-60.9	-23.5	168.9	-151.3	79.3	0	0	0	111.7	F405 Y407	L397-F405 HydrophobicContact CB-CB 3.76Å; L397-F405 PolarHBondContact N-O 3.4Å; L397-Y407 HydrophobicContact CD1-CD1 4.08Å; L397-Y407 HydrophobicContact CD1-CE1 3.86Å
398	F	46.7	Very low	56.3	Low	89 Å²	89	91.8 Å²	91.8	39%	0.39	44%	0.435	S	S	.	.	S	Bend	trans	-129.2	103.7	-174.7	-62.5	-67.1	0	0	0	111.5	S396 F400 W401 F405	S396-F398 PolarHBondContact O-N 3.2Å; S396-F398 PolarHBondContact OG-N 2.82Å; S396-F398 PolarHBondContact OG-O 3.03Å; F398-F400 HydrophobicContact CB-CD1 3.88Å; F398-F400 HydrophobicContact CB-CE1 3.64Å; F398-F400 AromaticContact CD1-CE1 3.89Å; F398-F400 HydrophobicContact CD1-CE1 3.89Å; F398-F400 AromaticContact CG-CE1 3.97Å; F398-F400 HydrophobicContact CG-CE1 3.97Å; F398-F400 PolarHBondContact O-N 3.12Å; F398-W401 CarbonylContact O-C 3.55Å; F398-W401 PolarHBondContact O-N 3.3Å; F398-F405 HydrophobicContact CD2-CB 4.29Å; F398-F405 AromaticContact CD2-CD2 3.81Å; F398-F405 HydrophobicContact CD2-CD2 3.81Å; F398-F405 HydrophobicContact CD2-CG 4.39Å; F398-F405 HydrophobicContact CE2-CB 4.43Å; F398-F405 AromaticContact CE2-CD2 3.59Å; F398-F405 HydrophobicContact CE2-CD2 3.59Å; F398-F405 HydrophobicContact CE2-CE2 4.12Å; F398-F405 HydrophobicContact CE2-CG 4.18Å
399	S	46	Very low	55.8	Low	88 Å²	88	91.4 Å²	91.4	62%	0.615	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.9	-177.5	55.4	0	0	0	0	115.5	P1441	S399-P1441 WeakPolarHBondContact OG-CG 3.45Å
400	F	43.8	Very low	55.5	Low	120 Å²	120	94.5 Å²	94.5	53%	0.526	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-23.3	176	74.6	-78.2	0	0	0	113.5	F398	F398-F400 HydrophobicContact CB-CD1 3.88Å; F398-F400 HydrophobicContact CB-CE1 3.64Å; F398-F400 AromaticContact CD1-CE1 3.89Å; F398-F400 HydrophobicContact CD1-CE1 3.89Å; F398-F400 AromaticContact CG-CE1 3.97Å; F398-F400 HydrophobicContact CG-CE1 3.97Å; F398-F400 PolarHBondContact O-N 3.12Å
401	W	41.4	Very low	55.5	Low	147 Å²	147	95.4 Å²	95.4	56%	0.557	45%	0.453	S	S	*	.			trans	-125.6	89.9	176.3	-85.6	41.9	0	0	0	109.6	S396 F398 T403 L404	S396-W401 PolarHBondContact OG-O 2.96Å; F398-W401 CarbonylContact O-C 3.55Å; F398-W401 PolarHBondContact O-N 3.3Å; W401-T403 PolarHBondContact O-N 3.33Å; W401-T403 VanDerWaalsContact O-N 3.16Å; W401-L404 HydrophobicContact CB-CB 4.48Å; W401-L404 HydrophobicContact CE3-CB 4.06Å; W401-L404 HydrophobicContact CE3-CD1 3.51Å; W401-L404 HydrophobicContact CE3-CG 4.43Å; W401-L404 HydrophobicContact CZ3-CD1 3.55Å; W401-L404 PolarHBondContact O-N 2.92Å
402	P	46.7	Very low	55.9	Low	86 Å²	86	90.6 Å²	90.6	56%	0.558	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-11.2	-172.6	27.1	-35.1	0	0	0	114.8	Q406	P402-Q406 WeakPolarHBondContact O-CG 3.44Å; P402-Q406 PolarHBondContact O-NE2 3.31Å
403	T	49.5	Very low	56.1	Low	115 Å²	115	85.8 Å²	85.8	71%	0.706	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-13.6	-178.4	48.9	0	0	0	0	114.5	W401	W401-T403 PolarHBondContact O-N 3.33Å; W401-T403 VanDerWaalsContact O-N 3.16Å
404	L	38	Very low	56.6	Low	76 Å²	76	87 Å²	87	40%	0.398	43%	0.427	S	S	.	.	S	Bend	trans	-119.2	132.4	-169.4	-138.7	159	0	0	0	110.2	S396 W401	S396-L404 PolarHBondContact OG-O 3.42Å; S396-L404 VanDerWaalsContact OG-O 3.1Å; W401-L404 HydrophobicContact CB-CB 4.48Å; W401-L404 HydrophobicContact CE3-CB 4.06Å; W401-L404 HydrophobicContact CE3-CD1 3.51Å; W401-L404 HydrophobicContact CE3-CG 4.43Å; W401-L404 HydrophobicContact CZ3-CD1 3.55Å; W401-L404 PolarHBondContact O-N 2.92Å
405	F	47.2	Very low	57.6	Low	122 Å²	122	79 Å²	79	54%	0.535	40%	0.398	S	S	.	.	S	Bend	trans	55.2	46.9	-165.2	-58.1	-79.3	0	0	0	113.3	L397 F398	L397-F405 HydrophobicContact CB-CB 3.76Å; L397-F405 PolarHBondContact N-O 3.4Å; F398-F405 HydrophobicContact CD2-CB 4.29Å; F398-F405 AromaticContact CD2-CD2 3.81Å; F398-F405 HydrophobicContact CD2-CD2 3.81Å; F398-F405 HydrophobicContact CD2-CG 4.39Å; F398-F405 HydrophobicContact CE2-CB 4.43Å; F398-F405 AromaticContact CE2-CD2 3.59Å; F398-F405 HydrophobicContact CE2-CD2 3.59Å; F398-F405 HydrophobicContact CE2-CE2 4.12Å; F398-F405 HydrophobicContact CE2-CG 4.18Å
406	Q	49.4	Very low	59	Low	92 Å²	92	78.4 Å²	78.4	43%	0.43	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	130.2	160.2	-67.6	-170.1	-6	0	0	109.5	R395 P402	R395-Q406 WeakPolarHBondContact O-CA 3.37Å; P402-Q406 WeakPolarHBondContact O-CG 3.44Å; P402-Q406 PolarHBondContact O-NE2 3.31Å
407	Y	58	Low	60.8	Low	84 Å²	84	77.1 Å²	77.1	33%	0.329	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	149.9	168.8	69.6	-76.7	0	0	0	109.3	R394 R395 L397 A409	R394-Y407 WeakPolarHBondContact CA-O 3.5Å; R395-Y407 HydrophobicContact CB-CE1 3.99Å; R395-Y407 PolarHBondContact N-O 3.24Å; R395-Y407 WeakPolarHBondContact O-CD1 3.42Å; R395-Y407 PolarHBondContact O-N 2.94Å; L397-Y407 HydrophobicContact CD1-CD1 4.08Å; L397-Y407 HydrophobicContact CD1-CE1 3.86Å; Y407-A409 HydrophobicContact CD2-CB 4.12Å; Y407-A409 HydrophobicContact CE2-CB 3.62Å; Y407-A409 PolarHBondContact O-N 2.91Å
408	E	62	Low	63	Low	105 Å²	105	73.3 Å²	73.3	49%	0.491	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	119	167.1	-67.2	-176.4	174	0	0	107.6	K392 R394	K392-E408 WeakPolarHBondContact CD-OE2 3.34Å; K392-E408 WeakPolarHBondContact CE-OE2 3.25Å; K392-E408 IonicContact NZ-OE2 2.71Å; K392-E408 PolarHBondContact NZ-OE2 3.15Å; R394-E408 HydrophobicContact CG-CG 4.5Å
409	A	64.2	Low	65.2	Low	12 Å²	12	69.2 Å²	69.2	10%	0.099	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.1	170.7	0	0	0	0	0	107.7	V393 R395 Y407 E411	V393-A409 PolarHBondContact N-O 2.91Å; V393-A409 PolarHBondContact O-N 3.14Å; R395-A409 HydrophobicContact CB-CB 4.25Å; R395-A409 HydrophobicContact CG-CB 3.99Å; Y407-A409 HydrophobicContact CD2-CB 4.12Å; Y407-A409 HydrophobicContact CE2-CB 3.62Å; Y407-A409 PolarHBondContact O-N 2.91Å; A409-E411 PolarHBondContact O-N 3.49Å
410	D	69.1	Low	67.5	Low	81 Å²	81	67.8 Å²	67.8	43%	0.433	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	111.4	170.3	-53.6	-54.6	0	0	0	108.1	K392 T412	K392-D410 WeakPolarHBondContact CG-OD1 3.18Å; D410-T412 PolarHBondContact O-N 3.21Å
411	E	73.2	Confident	69.8	Low	63 Å²	63	62.1 Å²	62.1	29%	0.294	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	104.7	170.8	-173.1	162.4	-85.4	0	0	107.3	R391 V393 R395 A409 F413	R391-E411 HydrophobicContact CB-CB 4.48Å; R391-E411 PolarHBondContact N-O 3.22Å; R391-E411 WeakPolarHBondContact O-CB 3.38Å; R391-E411 PolarHBondContact O-N 3.1Å; V393-E411 HydrophobicContact CB-CB 4.27Å; V393-E411 HydrophobicContact CG2-CB 3.68Å; V393-E411 HydrophobicContact CG2-CG 4.35Å; R395-E411 IonicContact CZ-OE1 2.77Å; R395-E411 IonicContact NE-OE1 3.39Å; R395-E411 IonicContact NH2-OE1 3.51Å; R395-E411 PolarHBondContact NH2-OE1 3.06Å; A409-E411 PolarHBondContact O-N 3.49Å; E411-F413 HydrophobicContact CB-CE2 4.48Å; E411-F413 HydrophobicContact CG-CE2 4.17Å; E411-F413 HydrophobicContact CG-CZ 4.1Å; E411-F413 WeakPolarHBondContact O-CD2 3.38Å; E411-F413 VanDerWaalsContact O-CE2 3.23Å; E411-F413 WeakPolarHBondContact O-CE2 3.29Å
412	T	78.8	Confident	72.1	Confident	44 Å²	44	55.1 Å²	55.1	27%	0.27	28%	0.28	S	S	.	.			trans	-76.2	156	-179.1	55.5	0	0	0	0	111.6	R371 D385 D390 D410	R371-T412 VanDerWaalsContact NH1-CG2 3.31Å; D385-T412 HydrophobicContact CB-CG2 4.25Å; D385-T412 WeakPolarHBondContact OD2-CB 3.45Å; D385-T412 WeakPolarHBondContact OD2-CG2 3.26Å; D385-T412 PolarHBondContact OD2-OG1 2.69Å; D390-T412 WeakPolarHBondContact OD1-CA 3.39Å; D390-T412 VanDerWaalsContact OD1-CG2 3.27Å; D390-T412 WeakPolarHBondContact OD1-CG2 3.41Å; D410-T412 PolarHBondContact O-N 3.21Å
413	F	79.3	Confident	74.2	Confident	42 Å²	42	55.4 Å²	55.4	18%	0.184	27%	0.27	C	S	.	.			trans	-135.7	145.5	172.1	-63	-92.7	0	0	0	108.7	D385 D386 Q389 R391 E411	D385-F413 WeakPolarHBondContact CA-O 3.43Å; D386-F413 PolarHBondContact N-O 3.01Å; Q389-F413 HydrophobicContact CB-CB 3.88Å; Q389-F413 HydrophobicContact CB-CD2 4.22Å; Q389-F413 HydrophobicContact CB-CG 4.39Å; Q389-F413 WeakPolarHBondContact O-CD2 3.39Å; R391-F413 HydrophobicContact CB-CE2 4.11Å; R391-F413 HydrophobicContact CG-CE2 3.76Å; R391-F413 HydrophobicContact CG-CZ 4.47Å; E411-F413 HydrophobicContact CB-CE2 4.48Å; E411-F413 HydrophobicContact CG-CE2 4.17Å; E411-F413 HydrophobicContact CG-CZ 4.1Å; E411-F413 WeakPolarHBondContact O-CD2 3.38Å; E411-F413 VanDerWaalsContact O-CE2 3.23Å; E411-F413 WeakPolarHBondContact O-CE2 3.29Å
414	P	82.2	Confident	76.1	Confident	70 Å²	70	52.3 Å²	52.3	46%	0.455	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-63.8	158.9	176.3	28	-36.2	0	0	0	111.5	L384 R416	L384-P414 CarbonylContact O-C 3.55Å; L384-P414 WeakPolarHBondContact O-CA 3.31Å; P414-R416 WeakPolarHBondContact O-CG 3.25Å
415	A	84.1	Confident	78.4	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.033	23%	0.233	C	C	.	.			trans	-51.2	139.9	172.5	0	0	0	0	0	112.6	M378 P379 L384 D386	M378-A415 HydrophobicContact CB-CB 3.67Å; P379-A415 VanDerWaalsContact O-CB 3.28Å; P379-A415 WeakPolarHBondContact O-CB 3.23Å; L384-A415 PolarHBondContact O-N 2.94Å; D386-A415 HydrophobicContact CB-CB 4.4Å
416	R	86.3	Confident	79.6	Confident	85 Å²	85	48.5 Å²	48.5	32%	0.321	23%	0.227	S	C	.	.			trans	-141.4	2.7	-169.4	-79.2	174.1	-175.3	-147.2	-0.1	114.6	M378 P414 I418 S436 D438	M378-R416 PolarHBondContact O-N 3.25Å; P414-R416 WeakPolarHBondContact O-CG 3.25Å; R416-I418 PolarHBondContact O-N 3.43Å; R416-S436 VanDerWaalsContact O-CA 3.24Å; R416-S436 WeakPolarHBondContact O-CA 3.46Å; R416-S436 WeakPolarHBondContact O-CB 3.36Å; R416-D438 IonicContact NH1-OD2 2.7Å
417	G	87.6	Confident	80.2	Confident	2 Å²	2	49.7 Å²	49.7	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	125	173.6	0	0	0	0	0	110.2	M378 P379 M380 L435	M378-G417 VanDerWaalsContact O-CA 3.29Å; M378-G417 WeakPolarHBondContact O-CA 3.34Å; M378-G417 PolarHBondContact O-N 3.24Å; P379-G417 WeakPolarHBondContact CA-O 3.32Å; M380-G417 WeakPolarHBondContact CB-O 3.24Å; M380-G417 PolarHBondContact N-O 2.99Å; G417-L435 WeakPolarHBondContact CA-O 3.37Å
418	I	90.5	Very high	80.4	Confident	13 Å²	13	49.7 Å²	49.7	7%	0.067	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-26.1	178.5	54.9	165.4	0	0	0	112.4	M380 R416 L435 M437 L440 W468 F741 P742	M380-I418 HydrophobicContact CE-CG2 3.62Å; R416-I418 PolarHBondContact O-N 3.43Å; I418-L435 PolarHBondContact N-O 3.44Å; I418-M437 HydrophobicContact CD1-CB 3.91Å; I418-M437 HydrophobicContact CD1-CG 4.39Å; I418-M437 HydrophobicContact CD1-SD 3.65Å; I418-L440 HydrophobicContact CD1-CD1 4.34Å; I418-L440 HydrophobicContact CG1-CD1 4.5Å; I418-W468 HydrophobicContact CB-CZ2 4.47Å; I418-W468 HydrophobicContact CG1-CZ2 4.47Å; I418-W468 VanDerWaalsContact O-CZ2 3.31Å; I418-W468 WeakPolarHBondContact O-CZ2 3.2Å; I418-W468 PolarHBondContact O-NE1 3.34Å; I418-F741 HydrophobicContact CB-CD1 4.29Å; I418-F741 HydrophobicContact CB-CE1 4.28Å; I418-F741 HydrophobicContact CD1-CD1 4.24Å; I418-F741 HydrophobicContact CG2-CD1 4.44Å; I418-F741 HydrophobicContact CG2-CE1 4.19Å; I418-P742 HydrophobicContact CD1-CG 4.4Å
419	F	92.6	Very high	81	Confident	2 Å²	2	50 Å²	50	1%	0.009	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	121.1	-175.5	176.2	-88.4	0	0	0	110	V421 W434 L435 L440 W461 N464 W468 I744 I773	F419-V421 HydrophobicContact CD1-CG2 3.93Å; F419-V421 HydrophobicContact CE1-CG2 4.01Å; F419-W434 WeakPolarHBondContact O-CA 3.22Å; F419-L435 HydrophobicContact CD1-CB 4.45Å; F419-L435 HydrophobicContact CD1-CD1 4.29Å; F419-L435 PolarHBondContact N-O 3.19Å; F419-L435 PolarHBondContact O-N 2.96Å; F419-L440 HydrophobicContact CB-CD1 3.62Å; F419-L440 HydrophobicContact CB-CD2 4.36Å; F419-L440 HydrophobicContact CB-CG 4.31Å; F419-L440 HydrophobicContact CD1-CD2 3.98Å; F419-L440 HydrophobicContact CD2-CD1 4.27Å; F419-L440 HydrophobicContact CD2-CD2 4.5Å; F419-L440 HydrophobicContact CE1-CD2 4.34Å; F419-L440 HydrophobicContact CG-CD1 4Å; F419-L440 HydrophobicContact CG-CD2 4.06Å; F419-W461 HydrophobicContact CE1-CD2 4.35Å; F419-W461 HydrophobicContact CE1-CG 4.27Å; F419-W461 HydrophobicContact CE2-CB 4.2Å; F419-W461 HydrophobicContact CZ-CB 3.76Å; F419-W461 AromaticContact CZ-CD2 3.92Å; F419-W461 HydrophobicContact CZ-CD2 3.92Å; F419-W461 HydrophobicContact CZ-CE3 4.37Å; F419-W461 AromaticContact CZ-CG 3.64Å; F419-W461 HydrophobicContact CZ-CG 3.64Å; F419-N464 WeakPolarHBondContact CA-OD1 3.43Å; F419-N464 HydrophobicContact CD2-CB 3.55Å; F419-N464 VanDerWaalsContact CD2-CG 3.4Å; F419-N464 HydrophobicContact CE2-CB 3.89Å; F419-W468 HydrophobicContact CB-CH2 4.07Å; F419-W468 HydrophobicContact CB-CZ2 3.88Å; F419-W468 AromaticContact CD2-CH2 3.77Å; F419-W468 HydrophobicContact CD2-CH2 3.77Å; F419-W468 HydrophobicContact CD2-CZ2 4.09Å; F419-W468 HydrophobicContact CG-CH2 4.42Å; F419-I744 HydrophobicContact CD2-CD1 4.14Å; F419-I744 HydrophobicContact CE2-CD1 3.87Å; F419-I773 HydrophobicContact CZ-CD1 4.46Å
420	Y	93	Very high	81.5	Confident	59 Å²	59	51.7 Å²	51.7	23%	0.231	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	119.1	178.3	-176.3	-128.6	0	0	0	109.6	G422 E432 W434 N464 V883	Y420-G422 WeakPolarHBondContact CE2-O 3.42Å; Y420-E432 HydrophobicContact CE2-CB 3.84Å; Y420-E432 HydrophobicContact CE2-CG 3.92Å; Y420-W434 HydrophobicContact CD2-CD2 4.23Å; Y420-W434 AromaticContact CD2-CE2 3.79Å; Y420-W434 HydrophobicContact CD2-CZ2 4.02Å; Y420-W434 AromaticContact CD2-NE1 3.94Å; Y420-W434 HydrophobicContact CG-CH2 4.47Å; Y420-W434 HydrophobicContact CG-CZ2 4.26Å; Y420-N464 PolarHBondContact N-OD1 3.08Å; Y420-N464 PolarHBondContact O-ND2 3.06Å; Y420-N464 VanDerWaalsContact O-ND2 3.11Å; Y420-V883 HydrophobicContact CD1-CG2 4.29Å; Y420-V883 HydrophobicContact CE1-CG2 3.52Å
421	V	91.9	Very high	82	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-28.1	-179.7	178.8	0	0	0	0	111.3	F419 L433 L435 W461 F802 F869	F419-V421 HydrophobicContact CD1-CG2 3.93Å; F419-V421 HydrophobicContact CE1-CG2 4.01Å; V421-L433 HydrophobicContact CB-CB 4.13Å; V421-L433 WeakPolarHBondContact CB-O 2.92Å; V421-L433 PolarHBondContact N-O 3.09Å; V421-L435 HydrophobicContact CG2-CD1 3.77Å; V421-L435 HydrophobicContact CG2-CG 3.71Å; V421-W461 HydrophobicContact CG1-CZ2 4.18Å; V421-W461 PolarHBondContact O-NE1 2.89Å; V421-F802 HydrophobicContact CG1-CE1 3.58Å; V421-F802 HydrophobicContact CG1-CZ 3.76Å; V421-F802 HydrophobicContact CG2-CZ 4.34Å; V421-F869 HydrophobicContact CG1-CE2 3.98Å; V421-F869 HydrophobicContact CG1-CZ 4.02Å
422	G	91.2	Very high	82.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	128.8	-149.5	-167.4	0	0	0	0	0	111.5	Y420 L433 A881	Y420-G422 WeakPolarHBondContact CE2-O 3.42Å; G422-L433 VanDerWaalsContact O-CB 3.29Å; G422-L433 WeakPolarHBondContact O-CB 3.38Å; G422-L433 PolarHBondContact O-N 3.22Å; G422-A881 CarbonylContact C-O 3.54Å; G422-A881 VanDerWaalsContact CA-O 3.29Å; G422-A881 WeakPolarHBondContact CA-O 3.28Å
423	Y	90	Very high	83.2	Confident	91 Å²	91	50.1 Å²	50.1	36%	0.357	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	158.9	-170.5	62.8	-84.5	0	0	0	113.7	R425 R431 L433 S880 A881 S882	Y423-R425 HydrophobicContact CE2-CG 4.46Å; Y423-R431 CarbonylContact C-O 3.55Å; Y423-R431 WeakPolarHBondContact CA-O 3.19Å; Y423-L433 VanDerWaalsContact C-CD1 3.49Å; Y423-S880 CarbonylContact O-C 3.52Å; Y423-S880 WeakPolarHBondContact O-CA 3.41Å; Y423-A881 HydrophobicContact CE1-CB 3.91Å; Y423-A881 HydrophobicContact CE2-CB 3.98Å; Y423-A881 PolarHBondContact N-O 3.19Å; Y423-A881 PolarHBondContact O-N 3.01Å; Y423-S882 WeakPolarHBondContact CE1-O 3.44Å
424	R	88.6	Confident	83.8	Confident	50 Å²	50	50.3 Å²	50.3	19%	0.189	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	132.7	177.4	-168.9	174.4	-177.5	-173	9.4	111.5	I426 N427 D428 I429 G430 R431 L433 V878 P879	R424-I426 PolarHBondContact NE-O 2.7Å; R424-N427 WeakPolarHBondContact CD-O 3.49Å; R424-N427 PolarHBondContact NE-O 3.02Å; R424-N427 PolarHBondContact NH1-O 3.07Å; R424-N427 VanDerWaalsContact NH1-O 3.1Å; R424-D428 IonicContact NH1-OD2 3.36Å; R424-I429 WeakPolarHBondContact O-CA 3.48Å; R424-G430 PolarHBondContact O-N 2.72Å; R424-R431 HydrophobicContact CB-CB 4.39Å; R424-R431 PolarHBondContact N-O 3.29Å; R424-L433 HydrophobicContact CB-CD2 4.26Å; R424-V878 HydrophobicContact CG-CG1 4.2Å; R424-P879 WeakPolarHBondContact CA-O 3.42Å
425	R	86.5	Confident	84.3	Confident	38 Å²	38	47 Å²	47	14%	0.143	23%	0.226	C	C	.	.			trans	-93.2	-32	-179.9	-75.2	-168.7	-70.7	134.3	6.7	115.6	Y423 I429 E868 F869 P879 S880 A881	Y423-R425 HydrophobicContact CE2-CG 4.46Å; R425-I429 WeakPolarHBondContact O-CG1 3.42Å; R425-E868 WeakPolarHBondContact CD-OE1 3.14Å; R425-E868 IonicContact CZ-OE1 3.33Å; R425-E868 IonicContact NE-OE1 3.83Å; R425-E868 PolarHBondContact NE-OE1 3.4Å; R425-E868 IonicContact NH1-OE1 2.66Å; R425-E868 PolarHBondContact NH1-OE1 3.48Å; R425-E868 IonicContact NH1-OE2 3.19Å; R425-E868 PolarHBondContact NH1-OE2 3.43Å; R425-F869 PolarHBondContact NH2-O 2.83Å; R425-P879 PolarHBondContact N-O 3.13Å; R425-S880 PolarHBondContact NE-O 3Å; R425-S880 PolarHBondContact NH2-O 2.85Å; R425-A881 HydrophobicContact CG-CB 3.75Å
426	I	73.7	Confident	84.6	Confident	81 Å²	81	46.9 Å²	46.9	42%	0.415	23%	0.225	S	C	.	.	S	Bend	trans	-130.7	127.8	-170.4	-51.6	177.1	0	0	0	109.7	R424 P879	R424-I426 PolarHBondContact NE-O 2.7Å; I426-P879 HydrophobicContact CB-CB 4Å; I426-P879 HydrophobicContact CB-CG 4.06Å; I426-P879 HydrophobicContact CD1-CB 3.85Å; I426-P879 HydrophobicContact CD1-CG 4.18Å; I426-P879 HydrophobicContact CG1-CB 3.88Å; I426-P879 HydrophobicContact CG1-CG 4.36Å
427	N	62	Low	84.7	Confident	117 Å²	117	44.3 Å²	44.3	63%	0.626	22%	0.217	S	C	*	.	S	Bend	trans	59.9	117.9	-170	-57.8	-24.6	0	0	0	112.3	R424	R424-N427 WeakPolarHBondContact CD-O 3.49Å; R424-N427 PolarHBondContact NE-O 3.02Å; R424-N427 PolarHBondContact NH1-O 3.07Å; R424-N427 VanDerWaalsContact NH1-O 3.1Å
428	D	61.9	Low	84.7	Confident	83 Å²	83	47.2 Å²	47.2	44%	0.444	23%	0.232	S	C	.	.	S	Bend	trans	55.3	62.9	-166.4	-58.1	-72.1	0	0	0	112.9	R424 R431	R424-D428 IonicContact NH1-OD2 3.36Å; D428-R431 HydrophobicContact CB-CG 3.94Å; D428-R431 VanDerWaalsContact CB-NE 3.29Å; D428-R431 PolarHBondContact O-N 3.17Å; D428-R431 IonicContact OD1-CZ 2.77Å; D428-R431 IonicContact OD1-NE 3.66Å; D428-R431 IonicContact OD1-NH2 3.64Å; D428-R431 PolarHBondContact OD1-NH2 3.12Å; D428-R431 IonicContact OD2-CZ 3.57Å; D428-R431 IonicContact OD2-NE 3.61Å; D428-R431 IonicContact OD2-NH1 2.74Å; D428-R431 IonicContact OD2-NH2 3.79Å; D428-R431 PolarHBondContact OD2-NH2 3.23Å; D428-R431 VanDerWaalsContact OD2-NH2 3.1Å
429	I	73.9	Confident	84.7	Confident	113 Å²	113	46.8 Å²	46.8	58%	0.579	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	137.5	-179.4	-47.9	-173.3	0	0	0	110.1	R424 R425	R424-I429 WeakPolarHBondContact O-CA 3.48Å; R425-I429 WeakPolarHBondContact O-CG1 3.42Å
430	G	74.6	Confident	84.5	Confident	46 Å²	46	46.7 Å²	46.7	47%	0.474	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	-2.3	176.1	0	0	0	0	0	115.2	R424 E432	R424-G430 PolarHBondContact O-N 2.72Å; G430-E432 PolarHBondContact O-N 3.31Å
431	R	80.8	Confident	84.3	Confident	77 Å²	77	44.1 Å²	44.1	29%	0.291	22%	0.22	S	C	.	.			trans	-64.7	128.3	170.9	-72.8	-167.1	-170.3	180	15.7	110.9	R373 P375 Y423 R424 D428	R373-R431 PolarHBondContact O-NH1 2.69Å; P375-R431 HydrophobicContact CG-CB 4.25Å; Y423-R431 CarbonylContact C-O 3.55Å; Y423-R431 WeakPolarHBondContact CA-O 3.19Å; R424-R431 HydrophobicContact CB-CB 4.39Å; R424-R431 PolarHBondContact N-O 3.29Å; D428-R431 HydrophobicContact CB-CG 3.94Å; D428-R431 VanDerWaalsContact CB-NE 3.29Å; D428-R431 PolarHBondContact O-N 3.17Å; D428-R431 IonicContact OD1-CZ 2.77Å; D428-R431 IonicContact OD1-NE 3.66Å; D428-R431 IonicContact OD1-NH2 3.64Å; D428-R431 PolarHBondContact OD1-NH2 3.12Å; D428-R431 IonicContact OD2-CZ 3.57Å; D428-R431 IonicContact OD2-NE 3.61Å; D428-R431 IonicContact OD2-NH1 2.74Å; D428-R431 IonicContact OD2-NH2 3.79Å; D428-R431 PolarHBondContact OD2-NH2 3.23Å; D428-R431 VanDerWaalsContact OD2-NH2 3.1Å
432	E	86.4	Confident	84	Confident	78 Å²	78	48.7 Å²	48.7	36%	0.364	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	149.9	176.8	-63.1	179.8	175.6	0	0	113.3	Y420 G430 W434	Y420-E432 HydrophobicContact CE2-CB 3.84Å; Y420-E432 HydrophobicContact CE2-CG 3.92Å; G430-E432 PolarHBondContact O-N 3.31Å; E432-W434 PolarHBondContact OE2-NE1 3.46Å
433	L	90.7	Very high	84	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	109.3	-178.4	-57.6	178.9	0	0	0	109.7	P375 L376 V421 G422 Y423 R424 V878 S880	P375-L433 HydrophobicContact CB-CD2 3.65Å; P375-L433 HydrophobicContact CG-CD2 3.76Å; L376-L433 HydrophobicContact CD1-CB 3.91Å; L376-L433 HydrophobicContact CD1-CD2 4.48Å; L376-L433 HydrophobicContact CG-CB 4.47Å; L376-L433 HydrophobicContact CG-CD2 4.23Å; V421-L433 HydrophobicContact CB-CB 4.13Å; V421-L433 WeakPolarHBondContact CB-O 2.92Å; V421-L433 PolarHBondContact N-O 3.09Å; G422-L433 VanDerWaalsContact O-CB 3.29Å; G422-L433 WeakPolarHBondContact O-CB 3.38Å; G422-L433 PolarHBondContact O-N 3.22Å; Y423-L433 VanDerWaalsContact C-CD1 3.49Å; R424-L433 HydrophobicContact CB-CD2 4.26Å; L433-V878 HydrophobicContact CD1-CG1 4.21Å; L433-V878 HydrophobicContact CD2-CG1 3.84Å; L433-S880 WeakPolarHBondContact CD1-OG 3.37Å
434	W	91.6	Very high	84.1	Confident	47 Å²	47	44.6 Å²	44.6	18%	0.178	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	143.5	-179	-65.6	84	0	0	0	112.4	L376 R377 P379 F419 Y420 E432	L376-W434 WeakPolarHBondContact CB-O 3.41Å; R377-W434 HydrophobicContact CB-CB 4.41Å; R377-W434 VanDerWaalsContact CB-O 3.31Å; R377-W434 WeakPolarHBondContact CB-O 3.42Å; R377-W434 WeakPolarHBondContact CG-O 3.43Å; R377-W434 PolarHBondContact N-O 3.36Å; P379-W434 HydrophobicContact CB-CD2 3.78Å; P379-W434 HydrophobicContact CB-CE3 4.22Å; P379-W434 HydrophobicContact CB-CG 4.13Å; P379-W434 HydrophobicContact CB-CH2 4.4Å; P379-W434 HydrophobicContact CB-CZ2 3.98Å; P379-W434 HydrophobicContact CG-CD2 4.41Å; P379-W434 HydrophobicContact CG-CG 4.43Å; P379-W434 HydrophobicContact CG-CZ2 4.48Å; F419-W434 WeakPolarHBondContact O-CA 3.22Å; Y420-W434 HydrophobicContact CD2-CD2 4.23Å; Y420-W434 AromaticContact CD2-CE2 3.79Å; Y420-W434 HydrophobicContact CD2-CZ2 4.02Å; Y420-W434 AromaticContact CD2-NE1 3.94Å; Y420-W434 HydrophobicContact CG-CH2 4.47Å; Y420-W434 HydrophobicContact CG-CZ2 4.26Å; E432-W434 PolarHBondContact OE2-NE1 3.46Å
435	L	92.2	Very high	84.2	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.3	169.2	-67.8	174.8	0	0	0	110.7	L376 G417 I418 F419 V421 D439 L440 T800 F802 F873	L376-L435 HydrophobicContact CD1-CD2 4.13Å; G417-L435 WeakPolarHBondContact CA-O 3.37Å; I418-L435 PolarHBondContact N-O 3.44Å; F419-L435 HydrophobicContact CD1-CB 4.45Å; F419-L435 HydrophobicContact CD1-CD1 4.29Å; F419-L435 PolarHBondContact N-O 3.19Å; F419-L435 PolarHBondContact O-N 2.96Å; V421-L435 HydrophobicContact CG2-CD1 3.77Å; V421-L435 HydrophobicContact CG2-CG 3.71Å; L435-D439 HydrophobicContact CB-CB 4.49Å; L435-D439 HydrophobicContact CD2-CB 4.19Å; L435-L440 HydrophobicContact CB-CD2 4.28Å; L435-L440 HydrophobicContact CB-CG 4.26Å; L435-L440 HydrophobicContact CD1-CD2 3.92Å; L435-T800 HydrophobicContact CD1-CG2 4.41Å; L435-T800 HydrophobicContact CD2-CG2 4.49Å; L435-F802 HydrophobicContact CD1-CZ 4.34Å; L435-F873 HydrophobicContact CD2-CD2 3.88Å; L435-F873 HydrophobicContact CD2-CE2 3.62Å; L435-F873 HydrophobicContact CD2-CZ 4.45Å
436	S	90.9	Very high	84.4	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.007	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	164.7	173	75.1	0	0	0	0	112.3	R416 D438 D439 L440	R416-S436 VanDerWaalsContact O-CA 3.24Å; R416-S436 WeakPolarHBondContact O-CA 3.46Å; R416-S436 WeakPolarHBondContact O-CB 3.36Å; S436-D438 PolarHBondContact O-N 2.66Å; S436-D439 WeakPolarHBondContact CB-OD2 3.3Å; S436-D439 PolarHBondContact N-OD2 3.14Å; S436-D439 WeakPolarHBondContact O-CA 3.47Å; S436-D439 WeakPolarHBondContact O-CB 3.34Å; S436-D439 PolarHBondContact O-N 2.81Å; S436-D439 VanDerWaalsContact OG-CG 3.28Å; S436-D439 PolarHBondContact OG-OD2 2.73Å; S436-L440 PolarHBondContact O-N 2.8Å
437	M	88.7	Confident	85.1	Confident	31 Å²	31	36.8 Å²	36.8	15%	0.153	19%	0.187	C	C	.	.	H	α-helix	trans	-52.6	-39.2	174.6	-166.5	59.3	160.3	0	0	113.2	I418 D439 T441 P742 E769	I418-M437 HydrophobicContact CD1-CB 3.91Å; I418-M437 HydrophobicContact CD1-CG 4.39Å; I418-M437 HydrophobicContact CD1-SD 3.65Å; M437-D439 PolarHBondContact O-N 3.16Å; M437-T441 HydrophobicContact CE-CG2 4.41Å; M437-T441 HydrophobicContact CG-CG2 4.43Å; M437-T441 WeakPolarHBondContact O-CB 3.36Å; M437-T441 VanDerWaalsContact O-CG2 3.25Å; M437-T441 WeakPolarHBondContact O-CG2 3.43Å; M437-T441 PolarHBondContact O-N 2.77Å; M437-T441 VanDerWaalsContact O-N 3.11Å; M437-T441 PolarHBondContact O-OG1 2.89Å; M437-T441 HydrophobicContact SD-CG2 4.16Å; M437-P742 HydrophobicContact CE-CB 3.83Å; M437-P742 HydrophobicContact CE-CG 4.27Å; M437-P742 HydrophobicContact SD-CB 3.79Å; M437-P742 WeakPolarHBondContact SD-CD 3.23Å; M437-P742 HydrophobicContact SD-CG 3.7Å; M437-E769 HydrophobicContact CE-CB 3.52Å; M437-E769 HydrophobicContact CE-CG 3.62Å; M437-E769 WeakPolarHBondContact CE-OE2 3.44Å
438	D	86.7	Confident	86.3	Confident	64 Å²	64	31.2 Å²	31.2	34%	0.342	16%	0.157	S	C	.	.	H	α-helix	trans	-69.1	-18.5	177.1	-94.6	-48.8	0	0	0	113.7	R416 S436 R442 R766	R416-D438 IonicContact NH1-OD2 2.7Å; S436-D438 PolarHBondContact O-N 2.66Å; D438-R442 WeakPolarHBondContact O-CG 3.35Å; D438-R442 PolarHBondContact O-NE 3.04Å; D438-R442 PolarHBondContact O-NH2 3.22Å; D438-R766 PolarHBondContact O-NH2 3.17Å; D438-R766 IonicContact OD1-NH2 2.67Å
439	D	89.8	Confident	87.4	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-95.1	-43	178.4	-50.9	-57.2	0	0	0	110.9	R377 L435 S436 M437 R442 F873 Q874	R377-D439 WeakPolarHBondContact CG-OD2 3.14Å; R377-D439 IonicContact CZ-OD1 3.79Å; R377-D439 IonicContact CZ-OD2 3.11Å; R377-D439 IonicContact NE-OD1 3.84Å; R377-D439 IonicContact NE-OD2 2.7Å; R377-D439 PolarHBondContact NE-OD2 2.71Å; R377-D439 IonicContact NH2-OD1 2.96Å; R377-D439 PolarHBondContact NH2-OD1 3.46Å; R377-D439 IonicContact NH2-OD2 2.69Å; L435-D439 HydrophobicContact CB-CB 4.49Å; L435-D439 HydrophobicContact CD2-CB 4.19Å; S436-D439 WeakPolarHBondContact CB-OD2 3.3Å; S436-D439 PolarHBondContact N-OD2 3.14Å; S436-D439 WeakPolarHBondContact O-CA 3.47Å; S436-D439 WeakPolarHBondContact O-CB 3.34Å; S436-D439 PolarHBondContact O-N 2.81Å; S436-D439 VanDerWaalsContact OG-CG 3.28Å; S436-D439 PolarHBondContact OG-OD2 2.73Å; M437-D439 PolarHBondContact O-N 3.16Å; D439-R442 PolarHBondContact O-N 3.22Å; D439-F873 HydrophobicContact CB-CE2 3.99Å; D439-Q874 PolarHBondContact OD1-NE2 3.45Å
440	L	89.9	Confident	87.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64	-43.8	176.3	-76.2	-179.1	0	0	0	113.3	I418 F419 L435 S436 R442 H443 V444 W468 P742 S771	I418-L440 HydrophobicContact CD1-CD1 4.34Å; I418-L440 HydrophobicContact CG1-CD1 4.5Å; F419-L440 HydrophobicContact CB-CD1 3.62Å; F419-L440 HydrophobicContact CB-CD2 4.36Å; F419-L440 HydrophobicContact CB-CG 4.31Å; F419-L440 HydrophobicContact CD1-CD2 3.98Å; F419-L440 HydrophobicContact CD2-CD1 4.27Å; F419-L440 HydrophobicContact CD2-CD2 4.5Å; F419-L440 HydrophobicContact CE1-CD2 4.34Å; F419-L440 HydrophobicContact CG-CD1 4Å; F419-L440 HydrophobicContact CG-CD2 4.06Å; L435-L440 HydrophobicContact CB-CD2 4.28Å; L435-L440 HydrophobicContact CB-CG 4.26Å; L435-L440 HydrophobicContact CD1-CD2 3.92Å; S436-L440 PolarHBondContact O-N 2.8Å; L440-R442 PolarHBondContact O-N 2.73Å; L440-H443 WeakPolarHBondContact O-CA 3.18Å; L440-H443 PolarHBondContact O-N 3.23Å; L440-V444 HydrophobicContact CD2-CG2 4.44Å; L440-W468 HydrophobicContact CD1-CH2 4.31Å; L440-P742 HydrophobicContact CD1-CG 3.68Å; L440-S771 PolarHBondContact O-OG 2.68Å
441	T	87.7	Confident	87.7	Confident	6 Å²	6	27.6 Å²	27.6	4%	0.037	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	0.5	-179.2	58.9	0	0	0	0	113.2	M437 H443 R766 E769	M437-T441 HydrophobicContact CE-CG2 4.41Å; M437-T441 HydrophobicContact CG-CG2 4.43Å; M437-T441 WeakPolarHBondContact O-CB 3.36Å; M437-T441 VanDerWaalsContact O-CG2 3.25Å; M437-T441 WeakPolarHBondContact O-CG2 3.43Å; M437-T441 PolarHBondContact O-N 2.77Å; M437-T441 VanDerWaalsContact O-N 3.11Å; M437-T441 PolarHBondContact O-OG1 2.89Å; M437-T441 HydrophobicContact SD-CG2 4.16Å; T441-H443 VanDerWaalsContact C-N 3.32Å; T441-R766 WeakPolarHBondContact O-CB 3.22Å; T441-R766 WeakPolarHBondContact O-CD 3.44Å; T441-R766 WeakPolarHBondContact O-CG 3.27Å; T441-R766 PolarHBondContact O-NE 3.1Å; T441-R766 PolarHBondContact OG1-NE 2.92Å; T441-E769 HydrophobicContact CG2-CB 4.43Å; T441-E769 HydrophobicContact CG2-CG 4.26Å
442	R	86.9	Confident	87.5	Confident	96 Å²	96	24 Å²	24	36%	0.362	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	8	164.5	-56.1	179.8	-156.7	-167.9	7.1	112.7	D438 D439 L440 A798 G799	D438-R442 WeakPolarHBondContact O-CG 3.35Å; D438-R442 PolarHBondContact O-NE 3.04Å; D438-R442 PolarHBondContact O-NH2 3.22Å; D439-R442 PolarHBondContact O-N 3.22Å; L440-R442 PolarHBondContact O-N 2.73Å; R442-A798 CarbonylContact O-C 3.46Å; R442-A798 WeakPolarHBondContact O-CA 2.99Å; R442-G799 PolarHBondContact O-N 3.42Å
443	H	91.1	Very high	87.2	Confident	3 Å²	3	20.7 Å²	20.7	1%	0.014	12%	0.121	C	C	.	.			trans	66	156.8	178.6	-46.6	-51.2	0	0	0	114.7	L440 T441 A762 F770 L772 M774 G799 T800	L440-H443 WeakPolarHBondContact O-CA 3.18Å; L440-H443 PolarHBondContact O-N 3.23Å; T441-H443 VanDerWaalsContact C-N 3.32Å; H443-A762 PolarHBondContact CD2-O 3.35Å; H443-A762 PolarHBondContact NE2-O 3.03Å; H443-F770 PolarHBondContact CE1-O 2.73Å; H443-L772 WeakPolarHBondContact CA-O 3.22Å; H443-L772 HydrophobicContact CB-CB 4.27Å; H443-L772 WeakPolarHBondContact CB-O 3.45Å; H443-L772 PolarHBondContact ND1-N 2.76Å; H443-M774 HydrophobicContact CB-CE 4.4Å; H443-G799 PolarHBondContact O-N 3.1Å; H443-T800 PolarHBondContact O-N 3.19Å
444	V	91.2	Very high	87	Confident	2 Å²	2	21 Å²	21	1%	0.012	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.8	-173.4	173.4	0	0	0	0	109.3	L440 W461 L772 I773 M774 F802	L440-V444 HydrophobicContact CD2-CG2 4.44Å; V444-W461 HydrophobicContact CG1-CZ3 4.47Å; V444-L772 PolarHBondContact N-O 3.06Å; V444-I773 HydrophobicContact CB-CB 4.38Å; V444-I773 HydrophobicContact CB-CG1 4.14Å; V444-I773 HydrophobicContact CB-CG2 4.19Å; V444-I773 HydrophobicContact CG1-CG2 4.03Å; V444-I773 HydrophobicContact CG2-CG1 4.44Å; V444-M774 PolarHBondContact O-N 3Å; V444-F802 HydrophobicContact CG1-CD2 3.46Å; V444-F802 VanDerWaalsContact CG1-CD2 3.46Å; V444-F802 HydrophobicContact CG1-CE2 3.45Å; V444-F802 VanDerWaalsContact CG1-CE2 3.45Å; V444-F802 HydrophobicContact CG2-CE2 4.46Å
445	M	90.3	Very high	86.7	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.1	168.9	-161.5	73	-160.1	0	0	109.8	F447 M774 A776 I782 M795 A798 T800 K801 F802	M445-F447 HydrophobicContact CB-CE2 4.5Å; M445-F447 HydrophobicContact CE-CE1 3.88Å; M445-F447 HydrophobicContact CE-CE2 4.4Å; M445-F447 HydrophobicContact CE-CZ 3.76Å; M445-F447 HydrophobicContact CG-CD2 4.1Å; M445-F447 HydrophobicContact CG-CE2 3.49Å; M445-F447 VanDerWaalsContact CG-CE2 3.49Å; M445-F447 HydrophobicContact CG-CZ 3.79Å; M445-M774 WeakPolarHBondContact CA-O 3.43Å; M445-M774 HydrophobicContact CE-CB 4.16Å; M445-M774 HydrophobicContact SD-CB 3.6Å; M445-M774 HydrophobicContact SD-CE 4.25Å; M445-A776 HydrophobicContact CE-CB 3.73Å; M445-I782 HydrophobicContact CE-CD1 3.91Å; M445-M795 HydrophobicContact CE-CE 4.03Å; M445-M795 HydrophobicContact CG-CE 4.05Å; M445-M795 HydrophobicContact CG-SD 4Å; M445-M795 HydrophobicContact SD-CE 3.71Å; M445-M795 HydrophobicContact SD-SD 4.45Å; M445-A798 HydrophobicContact CB-CB 4.01Å; M445-T800 PolarHBondContact N-O 3.19Å; M445-K801 WeakPolarHBondContact O-CA 3.29Å; M445-F802 PolarHBondContact O-N 3.03Å
446	F	91.1	Very high	86.4	Confident	1 Å²	1	22.4 Å²	22.4	0%	0.004	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	113.6	178	-175.7	-161.9	0	0	0	111.1	A448 K454 T457 W461 M774 T775 A776 F802 F869	F446-A448 HydrophobicContact CE2-CB 4.27Å; F446-K454 HydrophobicContact CE1-CB 4.29Å; F446-K454 HydrophobicContact CE1-CG 4.18Å; F446-K454 HydrophobicContact CZ-CG 4.36Å; F446-T457 HydrophobicContact CE1-CG2 3.84Å; F446-T457 HydrophobicContact CZ-CG2 4.2Å; F446-W461 HydrophobicContact CD1-CH2 4.3Å; F446-W461 HydrophobicContact CD1-CZ3 4.31Å; F446-M774 PolarHBondContact N-O 3.22Å; F446-T775 VanDerWaalsContact O-CA 3.32Å; F446-T775 WeakPolarHBondContact O-CA 3.46Å; F446-A776 PolarHBondContact O-N 3.37Å; F446-F802 WeakPolarHBondContact CA-O 3.48Å; F446-F802 HydrophobicContact CB-CB 4.24Å; F446-F802 HydrophobicContact CD2-CB 3.54Å; F446-F802 HydrophobicContact CE2-CB 4.16Å; F446-F802 HydrophobicContact CG-CB 4.07Å; F446-F869 HydrophobicContact CE2-CB 4.49Å
447	F	88.6	Confident	86.5	Confident	5 Å²	5	22.4 Å²	22.4	2%	0.022	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.8	175.4	-68.1	-73.5	0	0	0	110.6	M445 A776 Q779 M795 F802 G804 T812 V816	M445-F447 HydrophobicContact CB-CE2 4.5Å; M445-F447 HydrophobicContact CE-CE1 3.88Å; M445-F447 HydrophobicContact CE-CE2 4.4Å; M445-F447 HydrophobicContact CE-CZ 3.76Å; M445-F447 HydrophobicContact CG-CD2 4.1Å; M445-F447 HydrophobicContact CG-CE2 3.49Å; M445-F447 VanDerWaalsContact CG-CE2 3.49Å; M445-F447 HydrophobicContact CG-CZ 3.79Å; F447-A776 HydrophobicContact CD1-CB 3.95Å; F447-A776 HydrophobicContact CE1-CB 3.82Å; F447-Q779 HydrophobicContact CE1-CB 4.32Å; F447-M795 HydrophobicContact CE2-SD 3.77Å; F447-M795 HydrophobicContact CZ-CE 4.2Å; F447-M795 HydrophobicContact CZ-SD 3.62Å; F447-F802 PolarHBondContact N-O 3.45Å; F447-G804 PolarHBondContact O-N 2.89Å; F447-T812 HydrophobicContact CB-CG2 3.88Å; F447-T812 HydrophobicContact CD1-CG2 3.45Å; F447-T812 VanDerWaalsContact CD1-CG2 3.45Å; F447-T812 HydrophobicContact CD2-CG2 4.43Å; F447-T812 HydrophobicContact CE1-CG2 4.02Å; F447-T812 HydrophobicContact CG-CG2 3.68Å; F447-V816 HydrophobicContact CD2-CG2 4.41Å
448	A	87.3	Confident	86.6	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.125	C	C	.	.			trans	-164.9	153.8	164.8	0	0	0	0	0	110.9	F446 K454 A776 R805	F446-A448 HydrophobicContact CE2-CB 4.27Å; A448-K454 HydrophobicContact CB-CD 4.09Å; A448-K454 HydrophobicContact CB-CG 3.71Å; A448-K454 VanDerWaalsContact O-CD 3.27Å; A448-K454 WeakPolarHBondContact O-CD 3.31Å; A448-K454 WeakPolarHBondContact O-CE 3.45Å; A448-K454 PolarHBondContact O-NZ 2.84Å; A448-A776 PolarHBondContact N-O 3.2Å; A448-R805 CarbonylContact C-O 3.48Å; A448-R805 WeakPolarHBondContact CA-O 3.5Å; A448-R805 WeakPolarHBondContact CB-O 3.22Å
449	T	84.6	Confident	86.8	Confident	17 Å²	17	18 Å²	18	10%	0.104	11%	0.109	C	C	.	.			trans	-68.4	159.2	176.5	49.1	0	0	0	0	112.2	G451 G452 Q777 R805 V807	T449-G451 PolarHBondContact O-N 2.89Å; T449-G452 WeakPolarHBondContact O-CA 3.49Å; T449-G452 PolarHBondContact O-N 3.4Å; T449-Q777 HydrophobicContact CG2-CG 4.39Å; T449-R805 PolarHBondContact N-O 3.13Å; T449-R805 PolarHBondContact OG1-O 2.9Å; T449-V807 HydrophobicContact CG2-CB 4.26Å; T449-V807 HydrophobicContact CG2-CG2 3.95Å
450	T	79.4	Confident	86.9	Confident	84 Å²	84	18.3 Å²	18.3	52%	0.515	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	135.6	168.1	-67.4	0	0	0	0	110.1	G452 K478 Q777	T450-G452 VanDerWaalsContact C-N 3.32Å; T450-K478 PolarHBondContact OG1-NZ 2.89Å; T450-Q777 VanDerWaalsContact N-OE1 3.15Å; T450-Q777 PolarHBondContact OG1-OE1 3.5Å
451	G	75.9	Confident	87	Confident	65 Å²	65	18.5 Å²	18.5	67%	0.67	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.2	-8.5	-168	0	0	0	0	0	115.3	T449 G453	T449-G451 PolarHBondContact O-N 2.89Å; G451-G453 PolarHBondContact O-N 3.46Å
452	G	77	Confident	87.3	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	-75.3	8.1	176.2	0	0	0	0	0	115.6	T449 T450 G867	T449-G452 WeakPolarHBondContact O-CA 3.49Å; T449-G452 PolarHBondContact O-N 3.4Å; T450-G452 VanDerWaalsContact C-N 3.32Å; G452-G867 PolarHBondContact O-N 3.25Å
453	G	79.4	Confident	87.5	Confident	10 Å²	10	16 Å²	16	10%	0.103	11%	0.106	C	C	.	.	S	Bend	trans	75.7	24.4	-179.2	0	0	0	0	0	115.5	G451 T457	G451-G453 PolarHBondContact O-N 3.46Å; G453-T457 WeakPolarHBondContact O-CB 3.34Å; G453-T457 PolarHBondContact O-N 2.86Å; G453-T457 PolarHBondContact O-OG1 3.47Å
454	K	87.2	Confident	87.6	Confident	5 Å²	5	16.6 Å²	16.6	2%	0.022	11%	0.109	C	C	.	.	H	α-helix	trans	-54.6	-60.2	176.6	-71	-161.1	-68.3	179.7	0	112.4	F446 A448 E456 T457 T458 E749 A776	F446-K454 HydrophobicContact CE1-CB 4.29Å; F446-K454 HydrophobicContact CE1-CG 4.18Å; F446-K454 HydrophobicContact CZ-CG 4.36Å; A448-K454 HydrophobicContact CB-CD 4.09Å; A448-K454 HydrophobicContact CB-CG 3.71Å; A448-K454 VanDerWaalsContact O-CD 3.27Å; A448-K454 WeakPolarHBondContact O-CD 3.31Å; A448-K454 WeakPolarHBondContact O-CE 3.45Å; A448-K454 PolarHBondContact O-NZ 2.84Å; K454-E456 PolarHBondContact O-N 3.49Å; K454-T457 WeakPolarHBondContact O-CB 3.42Å; K454-T457 PolarHBondContact O-N 2.83Å; K454-T457 VanDerWaalsContact O-N 3.13Å; K454-T458 PolarHBondContact O-N 3.15Å; K454-T458 PolarHBondContact O-OG1 3.19Å; K454-E749 IonicContact NZ-OE2 3.35Å; K454-E749 PolarHBondContact NZ-OE2 3.44Å; K454-A776 PolarHBondContact NZ-O 2.92Å; K454-A776 VanDerWaalsContact NZ-O 3.12Å
455	T	85.4	Confident	87.7	Confident	19 Å²	19	16.5 Å²	16.5	12%	0.117	11%	0.108	C	C	.	.	H	α-helix	trans	-63	-41.5	-174	-36.7	0	0	0	0	111.4	T457 T458 F459	T455-T457 PolarHBondContact O-N 3.39Å; T455-T458 VanDerWaalsContact CA-OG1 3.3Å; T455-T458 WeakPolarHBondContact CA-OG1 3.25Å; T455-T458 PolarHBondContact O-N 2.86Å; T455-T458 PolarHBondContact O-OG1 3.35Å; T455-F459 HydrophobicContact CG2-CE1 4.08Å; T455-F459 HydrophobicContact CG2-CE2 3.88Å; T455-F459 HydrophobicContact CG2-CZ 3.57Å; T455-F459 WeakPolarHBondContact O-CD2 3.23Å; T455-F459 VanDerWaalsContact O-CG 3.32Å; T455-F459 WeakPolarHBondContact O-CG 3.32Å; T455-F459 PolarHBondContact O-N 3.47Å
456	E	86.5	Confident	87.8	Confident	59 Å²	59	16.8 Å²	16.8	28%	0.276	11%	0.11	S	C	.	.	H	α-helix	trans	-57.1	-47.5	171.2	-70	-62.3	156.1	0	0	113.2	K454 T458 F459 A460 K890	K454-E456 PolarHBondContact O-N 3.49Å; E456-T458 VanDerWaalsContact C-N 3.3Å; E456-T458 PolarHBondContact O-N 2.92Å; E456-F459 PolarHBondContact O-N 2.68Å; E456-A460 PolarHBondContact O-N 2.92Å; E456-K890 IonicContact OE1-NZ 3.16Å; E456-K890 PolarHBondContact OE1-NZ 3.04Å; E456-K890 VanDerWaalsContact OE2-CE 3.27Å; E456-K890 WeakPolarHBondContact OE2-CE 3.26Å; E456-K890 IonicContact OE2-NZ 2.9Å; E456-K890 PolarHBondContact OE2-NZ 3.21Å
457	T	91	Very high	87.7	Confident	0 Å²	0	20 Å²	20	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.8	-39.3	176.5	-57.5	0	0	0	0	110.8	F446 G453 K454 T455 A460 W461 F869	F446-T457 HydrophobicContact CE1-CG2 3.84Å; F446-T457 HydrophobicContact CZ-CG2 4.2Å; G453-T457 WeakPolarHBondContact O-CB 3.34Å; G453-T457 PolarHBondContact O-N 2.86Å; G453-T457 PolarHBondContact O-OG1 3.47Å; K454-T457 WeakPolarHBondContact O-CB 3.42Å; K454-T457 PolarHBondContact O-N 2.83Å; K454-T457 VanDerWaalsContact O-N 3.13Å; T455-T457 PolarHBondContact O-N 3.39Å; T457-A460 PolarHBondContact O-N 3.44Å; T457-W461 HydrophobicContact CG2-CD2 4.03Å; T457-W461 HydrophobicContact CG2-CE3 4.44Å; T457-W461 HydrophobicContact CG2-CH2 3.97Å; T457-W461 HydrophobicContact CG2-CZ2 3.52Å; T457-W461 HydrophobicContact CG2-CZ3 4.41Å; T457-W461 VanDerWaalsContact O-CG 3.29Å; T457-W461 PolarHBondContact O-N 3.49Å; T457-F869 HydrophobicContact CG2-CE1 3.85Å; T457-F869 HydrophobicContact CG2-CZ 4.48Å
458	T	91.4	Very high	87.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68	-37.7	174.9	52.4	0	0	0	0	113	K454 T455 E456 W461 L462 I746 T775	K454-T458 PolarHBondContact O-N 3.15Å; K454-T458 PolarHBondContact O-OG1 3.19Å; T455-T458 VanDerWaalsContact CA-OG1 3.3Å; T455-T458 WeakPolarHBondContact CA-OG1 3.25Å; T455-T458 PolarHBondContact O-N 2.86Å; T455-T458 PolarHBondContact O-OG1 3.35Å; E456-T458 VanDerWaalsContact C-N 3.3Å; E456-T458 PolarHBondContact O-N 2.92Å; T458-W461 CarbonylContact O-C 3.57Å; T458-W461 PolarHBondContact O-N 3.28Å; T458-W461 VanDerWaalsContact O-N 3.17Å; T458-L462 WeakPolarHBondContact O-CG 3.22Å; T458-L462 PolarHBondContact O-N 3.06Å; T458-I746 HydrophobicContact CG2-CD1 4.31Å; T458-I746 HydrophobicContact CG2-CG2 3.93Å; T458-T775 HydrophobicContact CG2-CG2 4.15Å
459	F	91.5	Very high	87.8	Confident	4 Å²	4	23.5 Å²	23.5	2%	0.018	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-42.6	173.7	-62.9	-34.8	0	0	0	111.9	T455 E456 W461 L462 T483 T486 I487 L490 I885	T455-F459 HydrophobicContact CG2-CE1 4.08Å; T455-F459 HydrophobicContact CG2-CE2 3.88Å; T455-F459 HydrophobicContact CG2-CZ 3.57Å; T455-F459 WeakPolarHBondContact O-CD2 3.23Å; T455-F459 VanDerWaalsContact O-CG 3.32Å; T455-F459 WeakPolarHBondContact O-CG 3.32Å; T455-F459 PolarHBondContact O-N 3.47Å; E456-F459 PolarHBondContact O-N 2.68Å; F459-W461 VanDerWaalsContact C-N 3.31Å; F459-W461 PolarHBondContact O-N 2.69Å; F459-L462 HydrophobicContact CD1-CD1 4.45Å; F459-L462 PolarHBondContact O-N 2.7Å; F459-T483 HydrophobicContact CE1-CG2 4.24Å; F459-T486 HydrophobicContact CD1-CG2 4.24Å; F459-T486 HydrophobicContact CD2-CG2 3.96Å; F459-T486 HydrophobicContact CE1-CG2 4.31Å; F459-T486 HydrophobicContact CE2-CG2 4.03Å; F459-T486 HydrophobicContact CG-CG2 4.07Å; F459-T486 HydrophobicContact CZ-CG2 4.21Å; F459-I487 HydrophobicContact CD1-CG1 4.5Å; F459-I487 HydrophobicContact CE1-CG1 4.28Å; F459-L490 HydrophobicContact CB-CD1 4.39Å; F459-I885 HydrophobicContact CB-CD1 4.25Å
460	A	91.5	Very high	88	Confident	8 Å²	8	24.2 Å²	24.2	7%	0.066	16%	0.159	C	C	.	.	H	α-helix	trans	-61.5	-38.4	172.7	0	0	0	0	0	112.3	E456 T457 L463 S882 V883	E456-A460 PolarHBondContact O-N 2.92Å; T457-A460 PolarHBondContact O-N 3.44Å; A460-L463 WeakPolarHBondContact O-CB 3.43Å; A460-L463 WeakPolarHBondContact O-CG 3.15Å; A460-L463 PolarHBondContact O-N 2.83Å; A460-S882 VanDerWaalsContact CB-OG 3.3Å; A460-S882 WeakPolarHBondContact CB-OG 3.33Å; A460-V883 HydrophobicContact CB-CB 4.31Å; A460-V883 VanDerWaalsContact CB-O 3.22Å; A460-V883 WeakPolarHBondContact CB-O 3.09Å
461	W	93.1	Very high	88.5	Confident	5 Å²	5	20.2 Å²	20.2	2%	0.019	13%	0.134	C	C	.	.	H	α-helix	trans	-70.9	-29.5	175.6	-70.2	-7.9	0	0	0	113.7	F419 V421 V444 F446 T457 T458 F459 L463 N464 P465 I773 F802 F869	F419-W461 HydrophobicContact CE1-CD2 4.35Å; F419-W461 HydrophobicContact CE1-CG 4.27Å; F419-W461 HydrophobicContact CE2-CB 4.2Å; F419-W461 HydrophobicContact CZ-CB 3.76Å; F419-W461 AromaticContact CZ-CD2 3.92Å; F419-W461 HydrophobicContact CZ-CD2 3.92Å; F419-W461 HydrophobicContact CZ-CE3 4.37Å; F419-W461 AromaticContact CZ-CG 3.64Å; F419-W461 HydrophobicContact CZ-CG 3.64Å; V421-W461 HydrophobicContact CG1-CZ2 4.18Å; V421-W461 PolarHBondContact O-NE1 2.89Å; V444-W461 HydrophobicContact CG1-CZ3 4.47Å; F446-W461 HydrophobicContact CD1-CH2 4.3Å; F446-W461 HydrophobicContact CD1-CZ3 4.31Å; T457-W461 HydrophobicContact CG2-CD2 4.03Å; T457-W461 HydrophobicContact CG2-CE3 4.44Å; T457-W461 HydrophobicContact CG2-CH2 3.97Å; T457-W461 HydrophobicContact CG2-CZ2 3.52Å; T457-W461 HydrophobicContact CG2-CZ3 4.41Å; T457-W461 VanDerWaalsContact O-CG 3.29Å; T457-W461 PolarHBondContact O-N 3.49Å; T458-W461 CarbonylContact O-C 3.57Å; T458-W461 PolarHBondContact O-N 3.28Å; T458-W461 VanDerWaalsContact O-N 3.17Å; F459-W461 VanDerWaalsContact C-N 3.31Å; F459-W461 PolarHBondContact O-N 2.69Å; W461-L463 PolarHBondContact O-N 3.45Å; W461-N464 WeakPolarHBondContact O-CB 3.25Å; W461-N464 PolarHBondContact O-N 2.67Å; W461-N464 PolarHBondContact O-ND2 2.83Å; W461-P465 WeakPolarHBondContact O-CD 3.45Å; W461-I773 HydrophobicContact CE3-CD1 4.4Å; W461-I773 HydrophobicContact CE3-CG2 4.31Å; W461-I773 HydrophobicContact CZ3-CG2 4.06Å; W461-F802 HydrophobicContact CH2-CD1 4.44Å; W461-F802 AromaticContact CH2-CD2 3.52Å; W461-F802 HydrophobicContact CH2-CD2 3.52Å; W461-F802 HydrophobicContact CH2-CE1 4.47Å; W461-F802 AromaticContact CH2-CE2 3.59Å; W461-F802 HydrophobicContact CH2-CE2 3.59Å; W461-F802 AromaticContact CH2-CG 3.97Å; W461-F802 HydrophobicContact CH2-CG 3.97Å; W461-F802 HydrophobicContact CH2-CZ 4.08Å; W461-F802 HydrophobicContact CZ2-CD1 4.5Å; W461-F802 HydrophobicContact CZ2-CD2 4.25Å; W461-F802 HydrophobicContact CZ2-CE1 4.28Å; W461-F802 HydrophobicContact CZ2-CE2 4.05Å; W461-F802 HydrophobicContact CZ2-CG 4.46Å; W461-F802 HydrophobicContact CZ2-CZ 4.05Å; W461-F802 HydrophobicContact CZ3-CD2 4.36Å; W461-F802 HydrophobicContact CZ3-CE2 4.36Å; W461-F869 HydrophobicContact CZ2-CZ 4.11Å
462	L	92.8	Very high	89.4	Confident	2 Å²	2	17.2 Å²	17.2	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-63.7	-18.9	173.8	-73	-178.1	0	0	0	113.6	T458 F459 N464 P465 L466 F472 F474 I487 I746	T458-L462 WeakPolarHBondContact O-CG 3.22Å; T458-L462 PolarHBondContact O-N 3.06Å; F459-L462 HydrophobicContact CD1-CD1 4.45Å; F459-L462 PolarHBondContact O-N 2.7Å; L462-N464 PolarHBondContact O-N 3.18Å; L462-P465 HydrophobicContact CD2-CG 4.44Å; L462-P465 VanDerWaalsContact O-CD 3.23Å; L462-P465 WeakPolarHBondContact O-CD 3.49Å; L462-P465 WeakPolarHBondContact O-CG 3.35Å; L462-L466 WeakPolarHBondContact O-CG 3.41Å; L462-L466 PolarHBondContact O-N 2.85Å; L462-F472 HydrophobicContact CB-CZ 4.46Å; L462-F472 HydrophobicContact CD1-CD2 4.41Å; L462-F472 HydrophobicContact CD1-CE2 3.66Å; L462-F472 HydrophobicContact CD1-CZ 3.91Å; L462-F472 HydrophobicContact CD2-CB 4.42Å; L462-F472 HydrophobicContact CD2-CD1 4.05Å; L462-F472 HydrophobicContact CD2-CD2 3.4Å; L462-F472 HydrophobicContact CD2-CE1 4.1Å; L462-F472 HydrophobicContact CD2-CE2 3.45Å; L462-F472 VanDerWaalsContact CD2-CE2 3.45Å; L462-F472 HydrophobicContact CD2-CG 3.7Å; L462-F472 HydrophobicContact CD2-CZ 3.81Å; L462-F472 HydrophobicContact CG-CE2 4.14Å; L462-F472 HydrophobicContact CG-CZ 4.28Å; L462-F474 HydrophobicContact CD1-CD2 3.92Å; L462-F474 HydrophobicContact CD1-CE2 4.22Å; L462-F474 HydrophobicContact CD2-CD2 4.48Å; L462-I487 HydrophobicContact CD1-CD1 4.1Å; L462-I487 HydrophobicContact CD1-CG1 3.88Å; L462-I746 HydrophobicContact CD2-CD1 3.6Å; L462-I746 HydrophobicContact CD2-CG1 4.43Å; L462-I746 HydrophobicContact CG-CD1 4.08Å
463	L	91.7	Very high	90.3	Very high	48 Å²	48	17.2 Å²	17.2	25%	0.251	10%	0.102	S	C	.	.	H	α-helix	trans	-60.4	-28.4	170.1	-59.2	178	0	0	0	112.1	A460 W461 C467 L490 F494 I885	A460-L463 WeakPolarHBondContact O-CB 3.43Å; A460-L463 WeakPolarHBondContact O-CG 3.15Å; A460-L463 PolarHBondContact O-N 2.83Å; W461-L463 PolarHBondContact O-N 3.45Å; L463-C467 VanDerWaalsContact O-CB 3.29Å; L463-C467 WeakPolarHBondContact O-CB 2.94Å; L463-C467 PolarHBondContact O-N 3.15Å; L463-C467 PolarHBondContact O-SG 3.37Å; L463-L490 HydrophobicContact CD2-CD2 4.2Å; L463-F494 HydrophobicContact CD2-CE2 4.11Å; L463-F494 HydrophobicContact CD2-CZ 4.45Å; L463-I885 HydrophobicContact CD1-CD1 4.02Å; L463-I885 HydrophobicContact CD1-CG1 4.33Å; L463-I885 HydrophobicContact CD2-CD1 4.25Å; L463-I885 HydrophobicContact CG-CD1 4.19Å
464	N	93.3	Very high	91	Very high	15 Å²	15	16.7 Å²	16.7	8%	0.08	10%	0.097	C	C	.	.	H	α-helix	trans	-62	-61.2	177.8	-68.9	-89	0	0	0	112.6	F419 Y420 W461 L462 L466 C467 W468	F419-N464 WeakPolarHBondContact CA-OD1 3.43Å; F419-N464 HydrophobicContact CD2-CB 3.55Å; F419-N464 VanDerWaalsContact CD2-CG 3.4Å; F419-N464 HydrophobicContact CE2-CB 3.89Å; Y420-N464 PolarHBondContact N-OD1 3.08Å; Y420-N464 PolarHBondContact O-ND2 3.06Å; Y420-N464 VanDerWaalsContact O-ND2 3.11Å; W461-N464 WeakPolarHBondContact O-CB 3.25Å; W461-N464 PolarHBondContact O-N 2.67Å; W461-N464 PolarHBondContact O-ND2 2.83Å; L462-N464 PolarHBondContact O-N 3.18Å; N464-L466 VanDerWaalsContact C-N 3.27Å; N464-L466 PolarHBondContact O-N 3.42Å; N464-C467 PolarHBondContact O-N 3.21Å; N464-W468 HydrophobicContact CB-CH2 4.08Å; N464-W468 HydrophobicContact CB-CZ2 3.8Å; N464-W468 VanDerWaalsContact O-CD2 3.27Å; N464-W468 PolarHBondContact O-N 2.86Å
465	P	93.2	Very high	91.2	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-64	-30.4	178.8	25.4	-34.8	0	0	0	113.1	W461 L462 W468 G469 R470 F472 I744	W461-P465 WeakPolarHBondContact O-CD 3.45Å; L462-P465 HydrophobicContact CD2-CG 4.44Å; L462-P465 VanDerWaalsContact O-CD 3.23Å; L462-P465 WeakPolarHBondContact O-CD 3.49Å; L462-P465 WeakPolarHBondContact O-CG 3.35Å; P465-W468 HydrophobicContact CB-CE3 4.12Å; P465-W468 HydrophobicContact CB-CZ3 4.46Å; P465-W468 PolarHBondContact O-N 2.99Å; P465-G469 PolarHBondContact O-N 2.97Å; P465-G469 VanDerWaalsContact O-N 3.15Å; P465-R470 HydrophobicContact CB-CB 4.35Å; P465-R470 PolarHBondContact O-N 3.11Å; P465-F472 HydrophobicContact CB-CD1 4.08Å; P465-F472 HydrophobicContact CG-CB 4.42Å; P465-F472 HydrophobicContact CG-CD1 3.75Å; P465-F472 HydrophobicContact CG-CE1 4.39Å; P465-F472 HydrophobicContact CG-CG 4.35Å; P465-I744 HydrophobicContact CG-CD1 4.23Å
466	L	91.8	Very high	91.4	Very high	6 Å²	6	15.6 Å²	15.6	3%	0.031	9%	0.091	C	C	.	.	H	α-helix	trans	-62.2	-50.2	171.7	-70.9	172.6	0	0	0	111.7	L462 N464 W468 G469 F472 L490 F494 I686	L462-L466 WeakPolarHBondContact O-CG 3.41Å; L462-L466 PolarHBondContact O-N 2.85Å; N464-L466 VanDerWaalsContact C-N 3.27Å; N464-L466 PolarHBondContact O-N 3.42Å; L466-W468 VanDerWaalsContact C-N 3.26Å; L466-W468 PolarHBondContact O-N 3.47Å; L466-G469 PolarHBondContact O-N 2.92Å; L466-G469 VanDerWaalsContact O-N 3.11Å; L466-F472 HydrophobicContact CD2-CE1 4.04Å; L466-F472 HydrophobicContact CG-CE1 4.09Å; L466-L490 HydrophobicContact CD1-CB 4.05Å; L466-F494 HydrophobicContact CB-CD1 4.4Å; L466-F494 HydrophobicContact CB-CD2 3.61Å; L466-F494 HydrophobicContact CB-CE1 4.48Å; L466-F494 HydrophobicContact CB-CE2 3.71Å; L466-F494 HydrophobicContact CB-CG 3.98Å; L466-F494 HydrophobicContact CB-CZ 4.16Å; L466-F494 HydrophobicContact CD1-CD2 3.87Å; L466-F494 HydrophobicContact CD1-CE2 3.95Å; L466-F494 HydrophobicContact CD2-CD2 4.41Å; L466-F494 HydrophobicContact CG-CD2 4.17Å; L466-F494 HydrophobicContact CG-CE2 4.43Å; L466-I686 HydrophobicContact CD2-CD1 3.82Å
467	C	89.7	Confident	91.2	Very high	67 Å²	67	12.8 Å²	12.8	45%	0.453	8%	0.078	S	C	.	.	H	α-helix	trans	-61.9	-28.2	173.7	-73.3	0	0	0	0	113.8	L463 N464 G469 F494	L463-C467 VanDerWaalsContact O-CB 3.29Å; L463-C467 WeakPolarHBondContact O-CB 2.94Å; L463-C467 PolarHBondContact O-N 3.15Å; L463-C467 PolarHBondContact O-SG 3.37Å; N464-C467 PolarHBondContact O-N 3.21Å; C467-G469 VanDerWaalsContact C-N 3.34Å; C467-F494 VanDerWaalsContact SG-CE1 3.52Å
468	W	90.2	Very high	90.6	Very high	38 Å²	38	15.1 Å²	15.1	14%	0.144	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.2	176.3	-55.8	-26.1	0	0	0	114.1	I418 F419 L440 N464 P465 L466 R470 F741 P742 I744	I418-W468 HydrophobicContact CB-CZ2 4.47Å; I418-W468 HydrophobicContact CG1-CZ2 4.47Å; I418-W468 VanDerWaalsContact O-CZ2 3.31Å; I418-W468 WeakPolarHBondContact O-CZ2 3.2Å; I418-W468 PolarHBondContact O-NE1 3.34Å; F419-W468 HydrophobicContact CB-CH2 4.07Å; F419-W468 HydrophobicContact CB-CZ2 3.88Å; F419-W468 AromaticContact CD2-CH2 3.77Å; F419-W468 HydrophobicContact CD2-CH2 3.77Å; F419-W468 HydrophobicContact CD2-CZ2 4.09Å; F419-W468 HydrophobicContact CG-CH2 4.42Å; L440-W468 HydrophobicContact CD1-CH2 4.31Å; N464-W468 HydrophobicContact CB-CH2 4.08Å; N464-W468 HydrophobicContact CB-CZ2 3.8Å; N464-W468 VanDerWaalsContact O-CD2 3.27Å; N464-W468 PolarHBondContact O-N 2.86Å; P465-W468 HydrophobicContact CB-CE3 4.12Å; P465-W468 HydrophobicContact CB-CZ3 4.46Å; P465-W468 PolarHBondContact O-N 2.99Å; L466-W468 VanDerWaalsContact C-N 3.26Å; L466-W468 PolarHBondContact O-N 3.47Å; W468-R470 VanDerWaalsContact C-N 3.33Å; W468-R470 HydrophobicContact CB-CB 4.33Å; W468-R470 HydrophobicContact CB-CG 3.94Å; W468-F741 HydrophobicContact CB-CB 4.34Å; W468-F741 HydrophobicContact CB-CD2 3.82Å; W468-F741 HydrophobicContact CB-CE2 4.22Å; W468-F741 HydrophobicContact CB-CG 3.99Å; W468-F741 AromaticContact CD1-CD1 3.89Å; W468-F741 AromaticContact CD1-CE1 3.81Å; W468-F741 HydrophobicContact CD2-CB 3.9Å; W468-F741 AromaticContact CD2-CD1 3.8Å; W468-F741 HydrophobicContact CD2-CD1 3.8Å; W468-F741 HydrophobicContact CD2-CE1 4.48Å; W468-F741 AromaticContact CD2-CG 3.86Å; W468-F741 HydrophobicContact CD2-CG 3.86Å; W468-F741 AromaticContact CE2-CD1 3.84Å; W468-F741 HydrophobicContact CE3-CB 3.71Å; W468-F741 HydrophobicContact CE3-CD1 4.4Å; W468-F741 HydrophobicContact CE3-CG 4.21Å; W468-F741 HydrophobicContact CG-CB 4.21Å; W468-F741 AromaticContact CG-CD1 3.84Å; W468-F741 HydrophobicContact CG-CD1 3.84Å; W468-F741 HydrophobicContact CG-CD2 4.03Å; W468-F741 HydrophobicContact CG-CE1 4.18Å; W468-F741 HydrophobicContact CG-CE2 4.35Å; W468-F741 AromaticContact CG-CG 3.77Å; W468-F741 HydrophobicContact CG-CG 3.77Å; W468-F741 HydrophobicContact CG-CZ 4.42Å; W468-F741 HydrophobicContact CZ2-CD1 4.45Å; W468-F741 HydrophobicContact CZ3-CB 4.29Å; W468-F741 AromaticContact NE1-CD1 3.89Å; W468-F741 AromaticContact NE1-CE1 3.9Å; W468-P742 HydrophobicContact CH2-CG 3.99Å; W468-P742 HydrophobicContact CZ3-CG 3.85Å; W468-I744 HydrophobicContact CH2-CD1 4.12Å; W468-I744 HydrophobicContact CZ3-CD1 3.84Å; W468-I744 HydrophobicContact CZ3-CG1 4.32Å
469	G	86.7	Confident	90	Very high	42 Å²	42	15.7 Å²	15.7	43%	0.433	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	34.1	-170.4	0	0	0	0	0	113.3	P465 L466 C467	P465-G469 PolarHBondContact O-N 2.97Å; P465-G469 VanDerWaalsContact O-N 3.15Å; L466-G469 PolarHBondContact O-N 2.92Å; L466-G469 VanDerWaalsContact O-N 3.11Å; C467-G469 VanDerWaalsContact C-N 3.34Å
470	R	89.9	Confident	89.5	Confident	32 Å²	32	18.7 Å²	18.7	12%	0.121	11%	0.107	C	C	.	.			trans	-115.2	154.5	-176.4	-67.7	-50.7	-140	88.6	18.4	114.3	P465 W468 R496 D684 G739 F741	P465-R470 HydrophobicContact CB-CB 4.35Å; P465-R470 PolarHBondContact O-N 3.11Å; W468-R470 VanDerWaalsContact C-N 3.33Å; W468-R470 HydrophobicContact CB-CB 4.33Å; W468-R470 HydrophobicContact CB-CG 3.94Å; R470-R496 VanDerWaalsContact C-NH1 3.31Å; R470-R496 PolarHBondContact O-NH1 3.5Å; R470-D684 WeakPolarHBondContact CD-OD2 3.43Å; R470-D684 IonicContact CZ-OD1 3.19Å; R470-D684 IonicContact CZ-OD2 3.75Å; R470-D684 IonicContact NE-OD2 3.27Å; R470-D684 VanDerWaalsContact NH1-CG 3.29Å; R470-D684 IonicContact NH1-OD1 2.77Å; R470-D684 PolarHBondContact NH1-OD1 3.3Å; R470-D684 IonicContact NH1-OD2 3.56Å; R470-D684 PolarHBondContact NH1-OD2 3.44Å; R470-G739 VanDerWaalsContact NH2-C 3.29Å; R470-F741 HydrophobicContact CG-CB 4.13Å; R470-F741 PolarHBondContact NH2-O 3.2Å
471	G	90.3	Very high	88.9	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.134	C	C	.	.			trans	-74.5	162.4	177	0	0	0	0	0	112.6	D684 R685 Y743	G471-D684 WeakPolarHBondContact CA-O 3.21Å; G471-D684 PolarHBondContact N-O 2.86Å; G471-D684 VanDerWaalsContact N-O 3.11Å; G471-D684 PolarHBondContact N-OD1 2.91Å; G471-R685 WeakPolarHBondContact CA-O 3.46Å; G471-Y743 VanDerWaalsContact C-CE2 3.44Å
472	F	94.5	Very high	88.6	Confident	1 Å²	1	27.5 Å²	27.5	0%	0.004	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	152	167.8	59.1	-92.7	0	0	0	110.9	L462 P465 L466 F474 I487 R685 I686 L687 Y743 I744	L462-F472 HydrophobicContact CB-CZ 4.46Å; L462-F472 HydrophobicContact CD1-CD2 4.41Å; L462-F472 HydrophobicContact CD1-CE2 3.66Å; L462-F472 HydrophobicContact CD1-CZ 3.91Å; L462-F472 HydrophobicContact CD2-CB 4.42Å; L462-F472 HydrophobicContact CD2-CD1 4.05Å; L462-F472 HydrophobicContact CD2-CD2 3.4Å; L462-F472 HydrophobicContact CD2-CE1 4.1Å; L462-F472 HydrophobicContact CD2-CE2 3.45Å; L462-F472 VanDerWaalsContact CD2-CE2 3.45Å; L462-F472 HydrophobicContact CD2-CG 3.7Å; L462-F472 HydrophobicContact CD2-CZ 3.81Å; L462-F472 HydrophobicContact CG-CE2 4.14Å; L462-F472 HydrophobicContact CG-CZ 4.28Å; P465-F472 HydrophobicContact CB-CD1 4.08Å; P465-F472 HydrophobicContact CG-CB 4.42Å; P465-F472 HydrophobicContact CG-CD1 3.75Å; P465-F472 HydrophobicContact CG-CE1 4.39Å; P465-F472 HydrophobicContact CG-CG 4.35Å; L466-F472 HydrophobicContact CD2-CE1 4.04Å; L466-F472 HydrophobicContact CG-CE1 4.09Å; F472-F474 HydrophobicContact CD2-CB 4.4Å; F472-F474 HydrophobicContact CE2-CB 4.48Å; F472-I487 HydrophobicContact CE2-CG2 3.98Å; F472-I487 HydrophobicContact CZ-CG2 3.86Å; F472-R685 PolarHBondContact N-O 3.1Å; F472-I686 HydrophobicContact CD1-CG1 4.19Å; F472-I686 HydrophobicContact CD2-CG2 4.22Å; F472-I686 HydrophobicContact CE1-CD1 3.84Å; F472-I686 HydrophobicContact CE1-CG1 3.85Å; F472-I686 HydrophobicContact CE1-CG2 4.01Å; F472-I686 HydrophobicContact CE2-CG2 3.6Å; F472-I686 HydrophobicContact CZ-CB 4.46Å; F472-I686 HydrophobicContact CZ-CD1 4.19Å; F472-I686 HydrophobicContact CZ-CG1 4.22Å; F472-I686 HydrophobicContact CZ-CG2 3.49Å; F472-I686 VanDerWaalsContact CZ-CG2 3.49Å; F472-I686 WeakPolarHBondContact O-CA 3.48Å; F472-L687 PolarHBondContact O-N 3.48Å; F472-Y743 PolarHBondContact O-OH 3.25Å; F472-I744 CarbonylContact C-O 3.57Å; F472-I744 WeakPolarHBondContact CA-O 3.29Å; F472-I744 HydrophobicContact CB-CB 4.31Å; F472-I744 VanDerWaalsContact CB-O 3.25Å; F472-I744 WeakPolarHBondContact CB-O 3.33Å
473	T	94.8	Very high	88.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.5	169.3	-59.3	0	0	0	0	108.6	V475 L687 F708 Y743 I744 C745 I746	T473-V475 HydrophobicContact CG2-CG2 4.08Å; T473-L687 CarbonylContact C-O 3.52Å; T473-L687 VanDerWaalsContact CA-O 3.31Å; T473-L687 WeakPolarHBondContact CA-O 3.39Å; T473-L687 HydrophobicContact CG2-CB 4.49Å; T473-L687 HydrophobicContact CG2-CD2 4.37Å; T473-L687 HydrophobicContact CG2-CG 4.45Å; T473-F708 HydrophobicContact CG2-CE1 4.27Å; T473-F708 HydrophobicContact CG2-CZ 3.94Å; T473-Y743 PolarHBondContact N-OH 2.68Å; T473-Y743 WeakPolarHBondContact OG1-CE1 3.46Å; T473-Y743 PolarHBondContact OG1-OH 3.24Å; T473-I744 PolarHBondContact N-O 2.92Å; T473-C745 CarbonylContact O-C 3.6Å; T473-C745 WeakPolarHBondContact O-CA 3.34Å; T473-I746 PolarHBondContact O-N 3.35Å
474	F	94.2	Very high	88.3	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.1	175	-163.7	-77.3	0	0	0	109.9	L462 F472 D476 T483 I487 L687 I688 V689 I746 D748	L462-F474 HydrophobicContact CD1-CD2 3.92Å; L462-F474 HydrophobicContact CD1-CE2 4.22Å; L462-F474 HydrophobicContact CD2-CD2 4.48Å; F472-F474 HydrophobicContact CD2-CB 4.4Å; F472-F474 HydrophobicContact CE2-CB 4.48Å; F474-D476 HydrophobicContact CD1-CB 4.37Å; F474-D476 HydrophobicContact CE1-CB 4.11Å; F474-T483 HydrophobicContact CD1-CG2 3.91Å; F474-T483 HydrophobicContact CE1-CG2 3.55Å; F474-T483 HydrophobicContact CZ-CG2 4.25Å; F474-I487 HydrophobicContact CB-CD1 4.03Å; F474-I487 HydrophobicContact CD1-CD1 4.08Å; F474-I487 HydrophobicContact CD2-CD1 4.09Å; F474-I487 HydrophobicContact CG-CD1 3.8Å; F474-L687 PolarHBondContact N-O 2.91Å; F474-I688 WeakPolarHBondContact O-CA 3.36Å; F474-V689 PolarHBondContact O-N 2.96Å; F474-I746 HydrophobicContact CD2-CB 3.82Å; F474-I746 HydrophobicContact CD2-CD1 4.04Å; F474-I746 HydrophobicContact CD2-CG1 4.3Å; F474-I746 HydrophobicContact CD2-CG2 4.08Å; F474-I746 HydrophobicContact CE2-CB 4.11Å; F474-I746 HydrophobicContact CE2-CD1 4.1Å; F474-I746 HydrophobicContact CE2-CG2 3.83Å; F474-I746 HydrophobicContact CG-CB 4.5Å; F474-I746 HydrophobicContact CZ-CG2 4.42Å; F474-D748 HydrophobicContact CE1-CB 4.44Å; F474-D748 HydrophobicContact CZ-CB 4.44Å
475	V	91.8	Very high	88.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112.2	176.9	-172.7	0	0	0	0	109.1	T473 V689 I691 F708 I746 L747 D748 Y753	T473-V475 HydrophobicContact CG2-CG2 4.08Å; V475-V689 WeakPolarHBondContact CA-O 3.48Å; V475-V689 HydrophobicContact CG1-CB 4.36Å; V475-V689 HydrophobicContact CG2-CB 4.24Å; V475-I691 HydrophobicContact CG1-CD1 3.55Å; V475-I691 HydrophobicContact CG1-CG1 4.15Å; V475-F708 HydrophobicContact CG2-CD1 4.18Å; V475-F708 HydrophobicContact CG2-CE1 3.67Å; V475-F708 HydrophobicContact CG2-CZ 4.45Å; V475-I746 PolarHBondContact N-O 2.88Å; V475-L747 HydrophobicContact CB-CD2 3.8Å; V475-L747 HydrophobicContact CG2-CD2 3.55Å; V475-D748 PolarHBondContact O-N 3.08Å; V475-Y753 HydrophobicContact CG1-CE1 4.38Å; V475-Y753 HydrophobicContact CG1-CE2 3.9Å
476	D	89.6	Confident	87.9	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	104.9	178	-173	-13.2	0	0	0	110.1	F474 K478 A479 Q480 T483 V689 M690 I691	F474-D476 HydrophobicContact CD1-CB 4.37Å; F474-D476 HydrophobicContact CE1-CB 4.11Å; D476-K478 VanDerWaalsContact C-N 3.28Å; D476-K478 WeakPolarHBondContact OD1-CA 3.42Å; D476-K478 WeakPolarHBondContact OD1-CB 3.35Å; D476-K478 PolarHBondContact OD1-N 2.89Å; D476-A479 VanDerWaalsContact CG-N 3.25Å; D476-A479 PolarHBondContact O-N 3.19Å; D476-A479 PolarHBondContact OD1-N 3.28Å; D476-Q480 PolarHBondContact OD2-N 3.44Å; D476-T483 HydrophobicContact CB-CG2 4.33Å; D476-T483 WeakPolarHBondContact OD2-CB 3.16Å; D476-T483 PolarHBondContact OD2-OG1 2.74Å; D476-V689 PolarHBondContact N-O 2.93Å; D476-M690 HydrophobicContact CB-CE 4.11Å; D476-M690 HydrophobicContact CB-SD 3.79Å; D476-I691 PolarHBondContact O-N 3.46Å
477	G	81.6	Confident	88	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.01	16%	0.164	C	C	.	.	S	Bend	trans	-80.2	-0.1	174.9	0	0	0	0	0	115.6	A693 D748	G477-A693 WeakPolarHBondContact O-CB 3.49Å; G477-D748 PolarHBondContact N-O 2.9Å
478	K	79.8	Confident	88.1	Confident	48 Å²	48	28.6 Å²	28.6	21%	0.209	15%	0.146	C	C	.	.	S	Bend	trans	-100.6	-27.4	167.6	-64	176.9	169.5	-170.4	0	111.3	T450 D476 Q480 E749	T450-K478 PolarHBondContact OG1-NZ 2.89Å; D476-K478 VanDerWaalsContact C-N 3.28Å; D476-K478 WeakPolarHBondContact OD1-CA 3.42Å; D476-K478 WeakPolarHBondContact OD1-CB 3.35Å; D476-K478 PolarHBondContact OD1-N 2.89Å; K478-Q480 HydrophobicContact CB-CG 4.01Å; K478-E749 HydrophobicContact CG-CB 4.22Å; K478-E749 HydrophobicContact CG-CG 4.3Å
479	A	78.5	Confident	88.1	Confident	13 Å²	13	27.3 Å²	27.3	11%	0.107	14%	0.142	C	C	.	.			trans	55.7	67.8	-174.6	0	0	0	0	0	112.1	D476 M506 M690	D476-A479 VanDerWaalsContact CG-N 3.25Å; D476-A479 PolarHBondContact O-N 3.19Å; D476-A479 PolarHBondContact OD1-N 3.28Å; A479-M506 HydrophobicContact CB-CG 3.71Å; A479-M506 HydrophobicContact CB-SD 3.7Å; A479-M690 HydrophobicContact CB-CB 4.13Å; A479-M690 HydrophobicContact CB-CE 4.41Å
480	Q	81	Confident	88.2	Confident	67 Å²	67	25.5 Å²	25.5	31%	0.313	12%	0.122	S	C	.	.			trans	-90.3	128.7	176.9	-46	-174.2	-165.8	0	0	111.6	D476 K478 D482 T483 M690	D476-Q480 PolarHBondContact OD2-N 3.44Å; K478-Q480 HydrophobicContact CB-CG 4.01Å; Q480-D482 WeakPolarHBondContact CB-OD1 3.19Å; Q480-D482 PolarHBondContact NE2-OD1 2.68Å; Q480-D482 PolarHBondContact O-N 3.4Å; Q480-D482 VanDerWaalsContact O-N 3.13Å; Q480-T483 VanDerWaalsContact O-CB 3.24Å; Q480-T483 WeakPolarHBondContact O-CB 3.39Å; Q480-T483 PolarHBondContact O-N 3.36Å; Q480-T483 PolarHBondContact O-OG1 2.93Å; Q480-M690 WeakPolarHBondContact O-CE 3.43Å
481	N	79.2	Confident	88.3	Confident	117 Å²	117	24 Å²	24	63%	0.626	12%	0.116	S	C	*	.	H	α-helix	trans	-62.2	-21.5	-176	-78.8	-53.7	0	0	0	114.6	M506	N481-M506 WeakPolarHBondContact OD1-CE 3.48Å
482	D	85.5	Confident	88.2	Confident	81 Å²	81	29.2 Å²	29.2	43%	0.433	14%	0.136	S	C	.	.	H	α-helix	trans	-75.7	-28.7	174.1	54.9	-24.8	0	0	0	113.1	Q480 T484 R485 T486	Q480-D482 WeakPolarHBondContact CB-OD1 3.19Å; Q480-D482 PolarHBondContact NE2-OD1 2.68Å; Q480-D482 PolarHBondContact O-N 3.4Å; Q480-D482 VanDerWaalsContact O-N 3.13Å; D482-T484 PolarHBondContact O-N 3.07Å; D482-R485 PolarHBondContact O-N 3.15Å; D482-T486 WeakPolarHBondContact O-CB 2.95Å; D482-T486 PolarHBondContact O-N 3.3Å; D482-T486 PolarHBondContact O-OG1 3.03Å
483	T	88.8	Confident	87.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-52.3	-57.3	175.8	-57.7	0	0	0	0	111.4	F459 F474 D476 Q480 R485 T486 I487	F459-T483 HydrophobicContact CE1-CG2 4.24Å; F474-T483 HydrophobicContact CD1-CG2 3.91Å; F474-T483 HydrophobicContact CE1-CG2 3.55Å; F474-T483 HydrophobicContact CZ-CG2 4.25Å; D476-T483 HydrophobicContact CB-CG2 4.33Å; D476-T483 WeakPolarHBondContact OD2-CB 3.16Å; D476-T483 PolarHBondContact OD2-OG1 2.74Å; Q480-T483 VanDerWaalsContact O-CB 3.24Å; Q480-T483 WeakPolarHBondContact O-CB 3.39Å; Q480-T483 PolarHBondContact O-N 3.36Å; Q480-T483 PolarHBondContact O-OG1 2.93Å; T483-R485 VanDerWaalsContact C-N 3.33Å; T483-R485 PolarHBondContact O-N 3.12Å; T483-T486 PolarHBondContact O-N 2.85Å; T483-I487 HydrophobicContact CG2-CD1 3.94Å; T483-I487 WeakPolarHBondContact O-CG1 3.37Å; T483-I487 PolarHBondContact O-N 2.85Å
484	T	88.8	Confident	87.5	Confident	19 Å²	19	39.4 Å²	39.4	12%	0.117	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-38.2	-178.4	-48.8	0	0	0	0	112.1	D482 W488 V502 I688 M690	D482-T484 PolarHBondContact O-N 3.07Å; T484-W488 WeakPolarHBondContact O-CB 3.47Å; T484-W488 PolarHBondContact O-N 3.1Å; T484-W488 VanDerWaalsContact O-N 3.07Å; T484-V502 HydrophobicContact CG2-CG1 3.94Å; T484-V502 HydrophobicContact CG2-CG2 3.96Å; T484-I688 HydrophobicContact CG2-CD1 4.04Å; T484-I688 HydrophobicContact CG2-CG2 4.48Å; T484-M690 PolarHBondContact OG1-SD 3.14Å
485	R	89	Confident	87.2	Confident	108 Å²	108	42 Å²	42	41%	0.408	20%	0.204	S	C	.	.	H	α-helix	trans	-65.1	-48	177.7	-68.2	-179.7	59.1	74.8	4.3	111.1	D482 T483 W488 Y489 V897	D482-R485 PolarHBondContact O-N 3.15Å; T483-R485 VanDerWaalsContact C-N 3.33Å; T483-R485 PolarHBondContact O-N 3.12Å; R485-W488 WeakPolarHBondContact O-CB 3.32Å; R485-W488 PolarHBondContact O-N 3.06Å; R485-W488 VanDerWaalsContact O-N 3.17Å; R485-Y489 HydrophobicContact CB-CD2 4.49Å; R485-Y489 HydrophobicContact CB-CE2 4.34Å; R485-Y489 PolarHBondContact NH2-OH 2.94Å; R485-Y489 WeakPolarHBondContact O-CD2 3.23Å; R485-Y489 PolarHBondContact O-N 2.89Å; R485-V897 HydrophobicContact CB-CG2 4.37Å; R485-V897 HydrophobicContact CG-CG2 4.18Å
486	T	91	Very high	87.1	Confident	10 Å²	10	43.4 Å²	43.4	6%	0.061	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-45.8	-179	-58.5	0	0	0	0	111	F459 D482 T483 W488 Y489 L490 K890	F459-T486 HydrophobicContact CD1-CG2 4.24Å; F459-T486 HydrophobicContact CD2-CG2 3.96Å; F459-T486 HydrophobicContact CE1-CG2 4.31Å; F459-T486 HydrophobicContact CE2-CG2 4.03Å; F459-T486 HydrophobicContact CG-CG2 4.07Å; F459-T486 HydrophobicContact CZ-CG2 4.21Å; D482-T486 WeakPolarHBondContact O-CB 2.95Å; D482-T486 PolarHBondContact O-N 3.3Å; D482-T486 PolarHBondContact O-OG1 3.03Å; T483-T486 PolarHBondContact O-N 2.85Å; T486-W488 VanDerWaalsContact C-N 3.28Å; T486-W488 PolarHBondContact O-N 3.08Å; T486-Y489 PolarHBondContact O-N 2.93Å; T486-L490 HydrophobicContact CG2-CD1 3.99Å; T486-L490 HydrophobicContact CG2-CG 4.32Å; T486-L490 WeakPolarHBondContact O-CB 3.31Å; T486-L490 VanDerWaalsContact O-CG 3.26Å; T486-L490 WeakPolarHBondContact O-CG 3.45Å; T486-L490 PolarHBondContact O-N 3.39Å; T486-K890 HydrophobicContact CG2-CB 3.84Å; T486-K890 HydrophobicContact CG2-CD 4.26Å; T486-K890 HydrophobicContact CG2-CG 3.85Å
487	I	92.1	Very high	87.1	Confident	1 Å²	1	45 Å²	45	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-37.8	176.1	-64.5	170.6	0	0	0	111.1	F459 L462 F472 F474 T483 S491 I686 I688	F459-I487 HydrophobicContact CD1-CG1 4.5Å; F459-I487 HydrophobicContact CE1-CG1 4.28Å; L462-I487 HydrophobicContact CD1-CD1 4.1Å; L462-I487 HydrophobicContact CD1-CG1 3.88Å; F472-I487 HydrophobicContact CE2-CG2 3.98Å; F472-I487 HydrophobicContact CZ-CG2 3.86Å; F474-I487 HydrophobicContact CB-CD1 4.03Å; F474-I487 HydrophobicContact CD1-CD1 4.08Å; F474-I487 HydrophobicContact CD2-CD1 4.09Å; F474-I487 HydrophobicContact CG-CD1 3.8Å; T483-I487 HydrophobicContact CG2-CD1 3.94Å; T483-I487 WeakPolarHBondContact O-CG1 3.37Å; T483-I487 PolarHBondContact O-N 2.85Å; I487-S491 WeakPolarHBondContact O-CB 3.49Å; I487-S491 PolarHBondContact O-N 3.27Å; I487-S491 PolarHBondContact O-OG 3.19Å; I487-I686 HydrophobicContact CG2-CG2 3.98Å; I487-I688 HydrophobicContact CB-CD1 3.85Å; I487-I688 HydrophobicContact CD1-CD1 4.22Å; I487-I688 HydrophobicContact CD1-CG1 4.35Å; I487-I688 HydrophobicContact CG2-CD1 3.58Å; I487-I688 HydrophobicContact CG2-CG1 4.19Å
488	W	92.1	Very high	87.5	Confident	22 Å²	22	50.8 Å²	50.8	8%	0.083	25%	0.247	C	C	.	.	H	α-helix	trans	-64.6	-50.8	175.7	-168.4	96.5	0	0	0	112.6	T484 R485 T486 L490 S491 R492 I500 V897 V898	T484-W488 WeakPolarHBondContact O-CB 3.47Å; T484-W488 PolarHBondContact O-N 3.1Å; T484-W488 VanDerWaalsContact O-N 3.07Å; R485-W488 WeakPolarHBondContact O-CB 3.32Å; R485-W488 PolarHBondContact O-N 3.06Å; R485-W488 VanDerWaalsContact O-N 3.17Å; T486-W488 VanDerWaalsContact C-N 3.28Å; T486-W488 PolarHBondContact O-N 3.08Å; W488-L490 VanDerWaalsContact C-N 3.33Å; W488-L490 PolarHBondContact O-N 2.67Å; W488-S491 PolarHBondContact O-N 3.17Å; W488-R492 HydrophobicContact CE3-CB 4.41Å; W488-R492 HydrophobicContact CZ3-CB 4.39Å; W488-R492 HydrophobicContact CZ3-CG 4.27Å; W488-R492 VanDerWaalsContact O-CB 3.24Å; W488-R492 WeakPolarHBondContact O-CB 3.27Å; W488-R492 PolarHBondContact O-N 2.83Å; W488-I500 HydrophobicContact CB-CD1 4.04Å; W488-I500 HydrophobicContact CG-CD1 3.99Å; W488-V897 HydrophobicContact CB-CG1 4.07Å; W488-V897 HydrophobicContact CB-CG2 4.47Å; W488-V897 HydrophobicContact CD2-CB 4.27Å; W488-V897 HydrophobicContact CD2-CG1 3.98Å; W488-V897 HydrophobicContact CD2-CG2 4.07Å; W488-V897 HydrophobicContact CE3-CB 4.37Å; W488-V897 HydrophobicContact CE3-CG2 3.78Å; W488-V897 HydrophobicContact CG-CG1 3.75Å; W488-V897 HydrophobicContact CG-CG2 4.38Å; W488-V897 HydrophobicContact CZ3-CG2 4.36Å; W488-V898 PolarHBondContact NE1-O 3.12Å
489	Y	90.2	Very high	88	Confident	11 Å²	11	50.7 Å²	50.7	4%	0.043	25%	0.249	C	C	.	.	H	α-helix	trans	-65.6	-33.5	178.2	-70	-68.7	0	0	0	112.9	R485 T486 R493 K890 C892 D895 V897	R485-Y489 HydrophobicContact CB-CD2 4.49Å; R485-Y489 HydrophobicContact CB-CE2 4.34Å; R485-Y489 PolarHBondContact NH2-OH 2.94Å; R485-Y489 WeakPolarHBondContact O-CD2 3.23Å; R485-Y489 PolarHBondContact O-N 2.89Å; T486-Y489 PolarHBondContact O-N 2.93Å; Y489-R493 WeakPolarHBondContact O-CG 3.42Å; Y489-R493 PolarHBondContact O-N 2.88Å; Y489-K890 VanDerWaalsContact CD2-O 3.22Å; Y489-K890 WeakPolarHBondContact CD2-O 3.45Å; Y489-C892 HydrophobicContact CD1-CB 3.99Å; Y489-C892 HydrophobicContact CE1-CB 3.74Å; Y489-C892 PolarHBondContact OH-O 2.94Å; Y489-C892 VanDerWaalsContact OH-O 3.11Å; Y489-D895 PolarHBondContact OH-O 3.31Å; Y489-V897 HydrophobicContact CD2-CG2 4.22Å; Y489-V897 HydrophobicContact CE1-CG2 4.38Å; Y489-V897 HydrophobicContact CE2-CG2 3.49Å; Y489-V897 VanDerWaalsContact CE2-CG2 3.49Å
490	L	90.2	Very high	88.7	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-47.7	172.5	-71	178.1	0	0	0	111.4	F459 L463 L466 T486 W488 R492 R493 F494 I885	F459-L490 HydrophobicContact CB-CD1 4.39Å; L463-L490 HydrophobicContact CD2-CD2 4.2Å; L466-L490 HydrophobicContact CD1-CB 4.05Å; T486-L490 HydrophobicContact CG2-CD1 3.99Å; T486-L490 HydrophobicContact CG2-CG 4.32Å; T486-L490 WeakPolarHBondContact O-CB 3.31Å; T486-L490 VanDerWaalsContact O-CG 3.26Å; T486-L490 WeakPolarHBondContact O-CG 3.45Å; T486-L490 PolarHBondContact O-N 3.39Å; W488-L490 VanDerWaalsContact C-N 3.33Å; W488-L490 PolarHBondContact O-N 2.67Å; L490-R492 VanDerWaalsContact C-N 3.33Å; L490-R492 PolarHBondContact O-N 2.78Å; L490-R493 WeakPolarHBondContact O-CB 3.45Å; L490-R493 PolarHBondContact O-N 2.94Å; L490-R493 VanDerWaalsContact O-N 3.16Å; L490-F494 WeakPolarHBondContact O-CD2 3.29Å; L490-I885 HydrophobicContact CD1-CD1 4.03Å; L490-I885 HydrophobicContact CD2-CD1 4.08Å; L490-I885 HydrophobicContact CD2-CG2 4.48Å
491	S	91.1	Very high	89.4	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-37.2	179.7	-48.4	0	0	0	0	112.1	I487 W488 R493 F494 G495 R496 I686	I487-S491 WeakPolarHBondContact O-CB 3.49Å; I487-S491 PolarHBondContact O-N 3.27Å; I487-S491 PolarHBondContact O-OG 3.19Å; W488-S491 PolarHBondContact O-N 3.17Å; S491-R493 PolarHBondContact O-N 3.35Å; S491-F494 CarbonylContact O-C 3.6Å; S491-F494 PolarHBondContact O-N 2.88Å; S491-G495 PolarHBondContact O-N 3.15Å; S491-R496 PolarHBondContact O-N 2.9Å; S491-I686 WeakPolarHBondContact OG-CD1 3.32Å
492	R	88.5	Confident	90	Very high	110 Å²	110	41.6 Å²	41.6	42%	0.415	20%	0.201	S	C	.	.	H	α-helix	trans	-57.8	-32.3	173.1	176.3	59.7	179.9	130.7	9.3	113.1	W488 L490 F494 G495 E497	W488-R492 HydrophobicContact CE3-CB 4.41Å; W488-R492 HydrophobicContact CZ3-CB 4.39Å; W488-R492 HydrophobicContact CZ3-CG 4.27Å; W488-R492 VanDerWaalsContact O-CB 3.24Å; W488-R492 WeakPolarHBondContact O-CB 3.27Å; W488-R492 PolarHBondContact O-N 2.83Å; L490-R492 VanDerWaalsContact C-N 3.33Å; L490-R492 PolarHBondContact O-N 2.78Å; R492-F494 VanDerWaalsContact C-N 3.27Å; R492-F494 PolarHBondContact O-N 3.33Å; R492-G495 PolarHBondContact O-N 3.3Å; R492-E497 WeakPolarHBondContact CA-OE2 3.45Å; R492-E497 HydrophobicContact CB-CB 4.37Å; R492-E497 WeakPolarHBondContact CD-OE1 3.48Å; R492-E497 IonicContact CZ-OE1 3.08Å; R492-E497 IonicContact NE-OE1 3.31Å; R492-E497 PolarHBondContact NE-OE1 3.14Å; R492-E497 IonicContact NH1-OE1 2.81Å; R492-E497 PolarHBondContact NH1-OE1 3.48Å
493	R	86.4	Confident	90.3	Very high	139 Å²	139	37.8 Å²	37.8	53%	0.525	18%	0.18	S	C	.	.	H	α-helix	trans	-70.9	-19.4	174.1	-74.4	163.4	155.8	-113.6	0.5	113.9	Y489 L490 S491 E889	Y489-R493 WeakPolarHBondContact O-CG 3.42Å; Y489-R493 PolarHBondContact O-N 2.88Å; L490-R493 WeakPolarHBondContact O-CB 3.45Å; L490-R493 PolarHBondContact O-N 2.94Å; L490-R493 VanDerWaalsContact O-N 3.16Å; S491-R493 PolarHBondContact O-N 3.35Å; R493-E889 IonicContact CZ-OE2 3.7Å; R493-E889 PolarHBondContact NE-O 3.18Å; R493-E889 IonicContact NH1-OE2 3.46Å; R493-E889 PolarHBondContact NH1-OE2 3.43Å; R493-E889 VanDerWaalsContact NH2-CB 3.3Å; R493-E889 VanDerWaalsContact NH2-CG 3.32Å; R493-E889 IonicContact NH2-OE2 3.01Å; R493-E889 PolarHBondContact NH2-OE2 3.22Å
494	F	88.4	Confident	90.3	Very high	76 Å²	76	38.5 Å²	38.5	33%	0.333	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	5.8	173.8	-67.3	-87.4	0	0	0	112.8	L463 L466 C467 L490 S491 R492 R496	L463-F494 HydrophobicContact CD2-CE2 4.11Å; L463-F494 HydrophobicContact CD2-CZ 4.45Å; L466-F494 HydrophobicContact CB-CD1 4.4Å; L466-F494 HydrophobicContact CB-CD2 3.61Å; L466-F494 HydrophobicContact CB-CE1 4.48Å; L466-F494 HydrophobicContact CB-CE2 3.71Å; L466-F494 HydrophobicContact CB-CG 3.98Å; L466-F494 HydrophobicContact CB-CZ 4.16Å; L466-F494 HydrophobicContact CD1-CD2 3.87Å; L466-F494 HydrophobicContact CD1-CE2 3.95Å; L466-F494 HydrophobicContact CD2-CD2 4.41Å; L466-F494 HydrophobicContact CG-CD2 4.17Å; L466-F494 HydrophobicContact CG-CE2 4.43Å; C467-F494 VanDerWaalsContact SG-CE1 3.52Å; L490-F494 WeakPolarHBondContact O-CD2 3.29Å; S491-F494 CarbonylContact O-C 3.6Å; S491-F494 PolarHBondContact O-N 2.88Å; R492-F494 VanDerWaalsContact C-N 3.27Å; R492-F494 PolarHBondContact O-N 3.33Å; F494-R496 HydrophobicContact CB-CG 4.47Å
495	G	87.4	Confident	90.2	Very high	55 Å²	55	37.6 Å²	37.6	57%	0.567	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.9	32.5	-177.4	0	0	0	0	0	114	S491 R492 E497	S491-G495 PolarHBondContact O-N 3.15Å; R492-G495 PolarHBondContact O-N 3.3Å; G495-E497 WeakPolarHBondContact CA-OE2 3.27Å
496	R	90.2	Very high	89.8	Confident	28 Å²	28	33.7 Å²	33.7	11%	0.106	17%	0.165	C	C	.	.			trans	-122.6	25.7	-175.3	-60.5	-164.8	65.3	-148.8	-3.9	113.8	R470 S491 F494 D498 D499 D684 I686	R470-R496 VanDerWaalsContact C-NH1 3.31Å; R470-R496 PolarHBondContact O-NH1 3.5Å; S491-R496 PolarHBondContact O-N 2.9Å; F494-R496 HydrophobicContact CB-CG 4.47Å; R496-D498 VanDerWaalsContact C-N 3.29Å; R496-D498 PolarHBondContact O-N 3.35Å; R496-D499 IonicContact CZ-OD2 2.66Å; R496-D499 IonicContact NE-OD2 2.8Å; R496-D499 PolarHBondContact NE-OD2 3.08Å; R496-D499 IonicContact NH2-OD2 3.4Å; R496-D499 PolarHBondContact NH2-OD2 2.95Å; R496-D499 PolarHBondContact O-N 3.32Å; R496-D684 PolarHBondContact NH2-O 3.44Å; R496-I686 HydrophobicContact CB-CD1 4.49Å
497	E	88.9	Confident	88.7	Confident	34 Å²	34	34.8 Å²	34.8	16%	0.159	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-62.6	-33.1	173.8	58.8	-90.2	-141.7	0	0	113.1	R492 G495 D499 I500 N900	R492-E497 WeakPolarHBondContact CA-OE2 3.45Å; R492-E497 HydrophobicContact CB-CB 4.37Å; R492-E497 WeakPolarHBondContact CD-OE1 3.48Å; R492-E497 IonicContact CZ-OE1 3.08Å; R492-E497 IonicContact NE-OE1 3.31Å; R492-E497 PolarHBondContact NE-OE1 3.14Å; R492-E497 IonicContact NH1-OE1 2.81Å; R492-E497 PolarHBondContact NH1-OE1 3.48Å; G495-E497 WeakPolarHBondContact CA-OE2 3.27Å; E497-D499 VanDerWaalsContact C-N 3.25Å; E497-D499 PolarHBondContact O-N 2.55Å; E497-I500 PolarHBondContact O-N 3.33Å; E497-N900 PolarHBondContact O-ND2 3.13Å
498	D	90.1	Very high	87.2	Confident	123 Å²	123	36 Å²	36	66%	0.658	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-69.3	-21.8	178.4	-71.5	-36	0	0	0	112.9	R496 I500 N900	R496-D498 VanDerWaalsContact C-N 3.29Å; R496-D498 PolarHBondContact O-N 3.35Å; D498-I500 VanDerWaalsContact C-N 3.26Å; D498-I500 PolarHBondContact O-N 2.82Å; D498-N900 PolarHBondContact O-ND2 2.94Å
499	D	91.6	Very high	85.6	Confident	46 Å²	46	37.9 Å²	37.9	25%	0.246	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-80.1	-1.7	178.2	-73.4	-33.7	0	0	0	113.5	R496 E497 R685 I686	R496-D499 IonicContact CZ-OD2 2.66Å; R496-D499 IonicContact NE-OD2 2.8Å; R496-D499 PolarHBondContact NE-OD2 3.08Å; R496-D499 IonicContact NH2-OD2 3.4Å; R496-D499 PolarHBondContact NH2-OD2 2.95Å; R496-D499 PolarHBondContact O-N 3.32Å; E497-D499 VanDerWaalsContact C-N 3.25Å; E497-D499 PolarHBondContact O-N 2.55Å; D499-R685 HydrophobicContact CB-CG 4.44Å; D499-R685 WeakPolarHBondContact O-CB 3.48Å; D499-I686 HydrophobicContact CB-CG1 4.49Å; D499-I686 PolarHBondContact O-N 3.46Å
500	I	93.3	Very high	84.3	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.015	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	127.1	-174.3	-64	176	0	0	0	112.4	W488 E497 D498 V502 I686 I688 N900	W488-I500 HydrophobicContact CB-CD1 4.04Å; W488-I500 HydrophobicContact CG-CD1 3.99Å; E497-I500 PolarHBondContact O-N 3.33Å; D498-I500 VanDerWaalsContact C-N 3.26Å; D498-I500 PolarHBondContact O-N 2.82Å; I500-V502 HydrophobicContact CG2-CG2 3.76Å; I500-I686 WeakPolarHBondContact CA-O 3.37Å; I500-I686 HydrophobicContact CG1-CB 4.16Å; I500-I686 HydrophobicContact CG1-CD1 4.5Å; I500-I686 HydrophobicContact CG1-CG2 4.2Å; I500-I688 HydrophobicContact CG2-CD1 4.05Å; I500-N900 PolarHBondContact O-ND2 3.29Å
501	E	94.6	Very high	83	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.4	173.1	-71	175.7	171.9	0	0	109.5	I675 S680 R685 I686 L687 I688	E501-I675 HydrophobicContact CB-CD1 3.82Å; E501-I675 HydrophobicContact CB-CG1 4.01Å; E501-I675 HydrophobicContact CG-CD1 4.49Å; E501-I675 HydrophobicContact CG-CG1 4.13Å; E501-S680 VanDerWaalsContact OE2-CB 3.28Å; E501-S680 WeakPolarHBondContact OE2-CB 3.13Å; E501-S680 PolarHBondContact OE2-OG 3.29Å; E501-R685 WeakPolarHBondContact OE1-CD 3.4Å; E501-R685 IonicContact OE1-CZ 2.77Å; E501-R685 IonicContact OE1-NE 3.05Å; E501-R685 IonicContact OE1-NH1 3.6Å; E501-R685 PolarHBondContact OE1-NH1 3.16Å; E501-I686 PolarHBondContact N-O 3.49Å; E501-L687 HydrophobicContact CB-CD1 3.9Å; E501-I688 PolarHBondContact O-N 3.23Å
502	V	92.7	Very high	81.8	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	114.6	-175	-172	0	0	0	0	112	T484 I500 N504 S526 N527 I688 I899	T484-V502 HydrophobicContact CG2-CG1 3.94Å; T484-V502 HydrophobicContact CG2-CG2 3.96Å; I500-V502 HydrophobicContact CG2-CG2 3.76Å; V502-N504 HydrophobicContact CG1-CB 4.28Å; V502-S526 PolarHBondContact O-OG 3.48Å; V502-N527 PolarHBondContact N-OD1 3.01Å; V502-N527 WeakPolarHBondContact O-CB 3.19Å; V502-N527 PolarHBondContact O-N 3.29Å; V502-I688 WeakPolarHBondContact CA-O 3.25Å; V502-I688 HydrophobicContact CG2-CB 4.47Å; V502-I688 HydrophobicContact CG2-CD1 4.36Å; V502-I899 HydrophobicContact CB-CD1 4.34Å; V502-I899 HydrophobicContact CB-CG2 4.34Å; V502-I899 HydrophobicContact CG1-CD1 4.47Å; V502-I899 HydrophobicContact CG2-CD1 4.5Å; V502-I899 HydrophobicContact CG2-CG1 4.2Å; V502-I899 HydrophobicContact CG2-CG2 4.36Å
503	I	91.6	Very high	80.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	107	167.7	-55.8	178.7	0	0	0	108.2	F505 W529 V667 I675 L687 I688 V689 M690 F708	I503-F505 HydrophobicContact CG2-CD2 4.08Å; I503-F505 HydrophobicContact CG2-CE1 4.14Å; I503-F505 HydrophobicContact CG2-CE2 3.41Å; I503-F505 VanDerWaalsContact CG2-CE2 3.41Å; I503-F505 HydrophobicContact CG2-CZ 3.44Å; I503-F505 VanDerWaalsContact CG2-CZ 3.44Å; I503-W529 HydrophobicContact CD1-CB 4.26Å; I503-W529 HydrophobicContact CD1-CD2 4Å; I503-W529 HydrophobicContact CD1-CE3 4.05Å; I503-W529 HydrophobicContact CD1-CG 4.09Å; I503-W529 HydrophobicContact CG2-CE3 4.42Å; I503-V667 HydrophobicContact CG2-CG1 3.89Å; I503-I675 HydrophobicContact CD1-CD1 4.17Å; I503-I675 HydrophobicContact CG1-CD1 3.53Å; I503-L687 HydrophobicContact CD1-CD1 4.17Å; I503-L687 HydrophobicContact CG1-CD1 4.2Å; I503-I688 PolarHBondContact N-O 2.75Å; I503-V689 HydrophobicContact CB-CG1 4.33Å; I503-V689 HydrophobicContact CB-CG2 4.33Å; I503-V689 HydrophobicContact CD1-CG2 4.32Å; I503-V689 HydrophobicContact CG2-CG1 4.46Å; I503-V689 WeakPolarHBondContact O-CA 3.38Å; I503-M690 PolarHBondContact O-N 3.33Å; I503-F708 HydrophobicContact CD1-CE2 4.48Å
504	N	89.2	Confident	79.8	Confident	15 Å²	15	47.5 Å²	47.5	8%	0.08	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	99.2	-174.4	179.9	11.4	0	0	0	112.2	V502 M506 N507 Q525 S526	V502-N504 HydrophobicContact CG1-CB 4.28Å; N504-M506 VanDerWaalsContact C-N 3.31Å; N504-M506 PolarHBondContact O-N 3.44Å; N504-M506 VanDerWaalsContact OD1-CB 3.22Å; N504-M506 WeakPolarHBondContact OD1-CB 3.27Å; N504-M506 WeakPolarHBondContact OD1-CE 3.4Å; N504-M506 WeakPolarHBondContact OD1-CG 3.3Å; N504-M506 PolarHBondContact OD1-N 2.85Å; N504-N507 PolarHBondContact ND2-OD1 3.41Å; N504-Q525 VanDerWaalsContact CB-O 3.28Å; N504-Q525 WeakPolarHBondContact CB-O 3.23Å; N504-Q525 PolarHBondContact ND2-O 3.33Å; N504-S526 PolarHBondContact N-OG 3.24Å
505	F	86.5	Confident	78.9	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-83.6	2.8	175.7	-60.4	-68.6	0	0	0	114.1	I503 N507 W529 F664 V667 F668 V689 M690 P692 L704 M707	I503-F505 HydrophobicContact CG2-CD2 4.08Å; I503-F505 HydrophobicContact CG2-CE1 4.14Å; I503-F505 HydrophobicContact CG2-CE2 3.41Å; I503-F505 VanDerWaalsContact CG2-CE2 3.41Å; I503-F505 HydrophobicContact CG2-CZ 3.44Å; I503-F505 VanDerWaalsContact CG2-CZ 3.44Å; F505-N507 PolarHBondContact O-N 2.7Å; F505-W529 HydrophobicContact CZ-CE3 4.14Å; F505-W529 AromaticContact CZ-CZ3 4Å; F505-W529 HydrophobicContact CZ-CZ3 4Å; F505-F664 HydrophobicContact CB-CE1 4.35Å; F505-F664 HydrophobicContact CD1-CB 4.43Å; F505-F664 HydrophobicContact CD1-CD1 4.24Å; F505-F664 HydrophobicContact CD1-CG 4.14Å; F505-F664 WeakPolarHBondContact O-CE1 3.47Å; F505-V667 HydrophobicContact CD1-CG1 4.28Å; F505-V667 HydrophobicContact CD1-CG2 4.44Å; F505-V667 HydrophobicContact CE1-CB 4.3Å; F505-V667 HydrophobicContact CE1-CG1 3.72Å; F505-V667 HydrophobicContact CZ-CG1 4.27Å; F505-F668 HydrophobicContact CE1-CE2 4.23Å; F505-F668 HydrophobicContact CE1-CZ 4.14Å; F505-V689 HydrophobicContact CE2-CG1 4.23Å; F505-M690 WeakPolarHBondContact CB-O 3.45Å; F505-M690 WeakPolarHBondContact CD2-O 3.27Å; F505-M690 PolarHBondContact N-O 3.4Å; F505-M690 VanDerWaalsContact N-O 3.09Å; F505-P692 HydrophobicContact CB-CG 4.27Å; F505-P692 WeakPolarHBondContact O-CG 3.47Å; F505-L704 HydrophobicContact CB-CD1 4.05Å; F505-L704 HydrophobicContact CD1-CD1 4.31Å; F505-L704 HydrophobicContact CD1-CD2 3.85Å; F505-L704 HydrophobicContact CD2-CD1 4.45Å; F505-L704 HydrophobicContact CE1-CD2 3.77Å; F505-L704 HydrophobicContact CE2-CD2 4.43Å; F505-L704 HydrophobicContact CG-CD1 4.03Å; F505-L704 HydrophobicContact CG-CD2 4.23Å; F505-L704 HydrophobicContact CZ-CD2 4.08Å; F505-M707 HydrophobicContact CZ-CE 4.35Å
506	M	79.8	Confident	78	Confident	26 Å²	26	50.5 Å²	50.5	13%	0.128	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-70.2	-15.1	175	-57.9	179.9	-75.5	0	0	113.1	A479 N481 N504 G508 G509 M690	A479-M506 HydrophobicContact CB-CG 3.71Å; A479-M506 HydrophobicContact CB-SD 3.7Å; N481-M506 WeakPolarHBondContact OD1-CE 3.48Å; N504-M506 VanDerWaalsContact C-N 3.31Å; N504-M506 PolarHBondContact O-N 3.44Å; N504-M506 VanDerWaalsContact OD1-CB 3.22Å; N504-M506 WeakPolarHBondContact OD1-CB 3.27Å; N504-M506 WeakPolarHBondContact OD1-CE 3.4Å; N504-M506 WeakPolarHBondContact OD1-CG 3.3Å; N504-M506 PolarHBondContact OD1-N 2.85Å; M506-G508 PolarHBondContact O-N 3.27Å; M506-G509 PolarHBondContact O-N 3.48Å; M506-M690 HydrophobicContact CE-CB 4.01Å; M506-M690 HydrophobicContact CE-CE 3.99Å; M506-M690 HydrophobicContact CE-CG 4.06Å; M506-M690 HydrophobicContact CG-CB 4.36Å
507	N	67.7	Low	77.1	Confident	34 Å²	34	57 Å²	57	18%	0.182	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-61.3	-15.6	-174.6	-69.4	-3.2	0	0	0	114.5	N504 F505 G509 K510 D666	N504-N507 PolarHBondContact ND2-OD1 3.41Å; F505-N507 PolarHBondContact O-N 2.7Å; N507-G509 PolarHBondContact O-N 2.82Å; N507-K510 PolarHBondContact O-N 3.46Å; N507-D666 PolarHBondContact ND2-OD2 3.43Å
508	G	60.3	Low	76.4	Confident	26 Å²	26	59 Å²	59	27%	0.268	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-59.9	-14.9	176.5	0	0	0	0	0	115.4	M506 T663	M506-G508 PolarHBondContact O-N 3.27Å; G508-T663 VanDerWaalsContact CA-CG2 3.44Å
509	G	58.3	Low	75.2	Confident	61 Å²	61	55.4 Å²	55.4	63%	0.629	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-73.4	-15.6	176.1	0	0	0	0	0	115.9	M506 N507	M506-G509 PolarHBondContact O-N 3.48Å; N507-G509 PolarHBondContact O-N 2.82Å
510	K	64.1	Low	73.8	Confident	111 Å²	111	57.1 Å²	57.1	48%	0.483	32%	0.324	S	S	.	.	S	Bend	trans	-93.4	134.2	170.9	-83.5	-165.4	173.1	-171	0	110	N507 R512 I515 E520	N507-K510 PolarHBondContact O-N 3.46Å; K510-R512 PolarHBondContact O-N 2.87Å; K510-I515 HydrophobicContact CB-CD1 3.91Å; K510-I515 HydrophobicContact CB-CG1 4.3Å; K510-I515 HydrophobicContact CD-CD1 4.06Å; K510-I515 HydrophobicContact CD-CG1 4.08Å; K510-E520 VanDerWaalsContact NZ-CD 3.32Å; K510-E520 IonicContact NZ-OE1 2.79Å; K510-E520 PolarHBondContact NZ-OE1 2.91Å; K510-E520 IonicContact NZ-OE2 3.92Å; K510-E520 PolarHBondContact NZ-OE2 3.41Å
511	S	62	Low	72.3	Confident	49 Å²	49	67 Å²	67	34%	0.343	37%	0.367	S	S	.	.			trans	-69	128.9	172.1	-179.1	0	0	0	0	110.7	S513 E514 I515	S511-S513 PolarHBondContact O-N 2.93Å; S511-S513 PolarHBondContact OG-N 2.85Å; S511-S513 PolarHBondContact OG-OG 2.67Å; S511-E514 VanDerWaalsContact CB-OE2 3.31Å; S511-E514 WeakPolarHBondContact CB-OE2 3.1Å; S511-E514 PolarHBondContact N-OE2 2.91Å; S511-E514 WeakPolarHBondContact O-CB 3.39Å; S511-E514 PolarHBondContact O-N 2.87Å; S511-I515 PolarHBondContact O-N 3.36Å; S511-I515 VanDerWaalsContact O-N 3.13Å
512	R	65.9	Low	70.8	Confident	119 Å²	119	69.9 Å²	69.9	45%	0.449	39%	0.387	S	S	.	.	H	α-helix	trans	-59.7	-27	173.7	-165.1	167.9	-173.3	162.4	-0.1	112.3	K510 I516 A661 E662	K510-R512 PolarHBondContact O-N 2.87Å; R512-I516 HydrophobicContact CG-CD1 4.16Å; R512-I516 WeakPolarHBondContact O-CB 3.43Å; R512-I516 WeakPolarHBondContact O-CD1 3.47Å; R512-I516 VanDerWaalsContact O-CG1 3.23Å; R512-I516 WeakPolarHBondContact O-CG1 3.32Å; R512-I516 PolarHBondContact O-N 3.13Å; R512-I516 VanDerWaalsContact O-N 3.13Å; R512-A661 PolarHBondContact NH1-O 3.49Å; R512-E662 WeakPolarHBondContact CD-O 3.28Å; R512-E662 PolarHBondContact NH1-O 2.84Å
513	S	65.1	Low	69.5	Low	72 Å²	72	77.9 Å²	77.9	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-68.4	-36.7	172.8	68.7	0	0	0	0	112.3	S511 I516 Q517	S511-S513 PolarHBondContact O-N 2.93Å; S511-S513 PolarHBondContact OG-N 2.85Å; S511-S513 PolarHBondContact OG-OG 2.67Å; S513-I516 PolarHBondContact O-N 2.98Å; S513-Q517 WeakPolarHBondContact O-CB 3.37Å; S513-Q517 PolarHBondContact O-N 3.48Å
514	E	69.2	Low	68.6	Low	116 Å²	116	81.2 Å²	81.2	54%	0.542	44%	0.439	S	S	.	.	H	α-helix	trans	-70.6	-41.3	178.3	-66.7	167.8	152.6	0	0	111.2	S511 I516 Q517 S518	S511-E514 VanDerWaalsContact CB-OE2 3.31Å; S511-E514 WeakPolarHBondContact CB-OE2 3.1Å; S511-E514 PolarHBondContact N-OE2 2.91Å; S511-E514 WeakPolarHBondContact O-CB 3.39Å; S511-E514 PolarHBondContact O-N 2.87Å; E514-I516 VanDerWaalsContact C-N 3.32Å; E514-I516 PolarHBondContact O-N 3.4Å; E514-Q517 PolarHBondContact O-N 2.94Å; E514-S518 VanDerWaalsContact O-CB 3.23Å; E514-S518 WeakPolarHBondContact O-CB 3.35Å; E514-S518 PolarHBondContact O-N 3.46Å; E514-S518 PolarHBondContact O-OG 2.85Å
515	I	68.5	Low	68.3	Low	66 Å²	66	85.8 Å²	85.8	34%	0.338	46%	0.46	S	S	.	.	H	α-helix	trans	-61.4	-42.1	174.9	-60.6	172.4	0	0	0	110.5	K510 S511 S518 G519	K510-I515 HydrophobicContact CB-CD1 3.91Å; K510-I515 HydrophobicContact CB-CG1 4.3Å; K510-I515 HydrophobicContact CD-CD1 4.06Å; K510-I515 HydrophobicContact CD-CG1 4.08Å; S511-I515 PolarHBondContact O-N 3.36Å; S511-I515 VanDerWaalsContact O-N 3.13Å; I515-S518 PolarHBondContact O-OG 3.35Å; I515-S518 VanDerWaalsContact O-OG 3.13Å; I515-G519 PolarHBondContact O-N 3.28Å
516	I	69.5	Low	68.4	Low	129 Å²	129	85.8 Å²	85.8	66%	0.662	46%	0.46	S	S	*	.	H	α-helix	trans	-68.9	-42.1	176.6	-69	167.8	0	0	0	111.4	R512 S513 E514 G519	R512-I516 HydrophobicContact CG-CD1 4.16Å; R512-I516 WeakPolarHBondContact O-CB 3.43Å; R512-I516 WeakPolarHBondContact O-CD1 3.47Å; R512-I516 VanDerWaalsContact O-CG1 3.23Å; R512-I516 WeakPolarHBondContact O-CG1 3.32Å; R512-I516 PolarHBondContact O-N 3.13Å; R512-I516 VanDerWaalsContact O-N 3.13Å; S513-I516 PolarHBondContact O-N 2.98Å; E514-I516 VanDerWaalsContact C-N 3.32Å; E514-I516 PolarHBondContact O-N 3.4Å; I516-G519 PolarHBondContact O-N 3.19Å
517	Q	70.8	Confident	68.9	Low	165 Å²	165	84.6 Å²	84.6	77%	0.771	45%	0.454	S	S	*	.	H	α-helix	trans	-73.3	-37	-176.6	-177.7	177.3	1.8	0	0	113.3	S513 E514 G519	S513-Q517 WeakPolarHBondContact O-CB 3.37Å; S513-Q517 PolarHBondContact O-N 3.48Å; E514-Q517 PolarHBondContact O-N 2.94Å; Q517-G519 PolarHBondContact O-N 3.11Å
518	S	72.7	Confident	70	Confident	76 Å²	76	84.7 Å²	84.7	53%	0.531	46%	0.456	S	S	.	.	H	α-helix	trans	-70.7	-20.7	174.8	57.1	0	0	0	0	112.8	E514 I515 E520	E514-S518 VanDerWaalsContact O-CB 3.23Å; E514-S518 WeakPolarHBondContact O-CB 3.35Å; E514-S518 PolarHBondContact O-N 3.46Å; E514-S518 PolarHBondContact O-OG 2.85Å; I515-S518 PolarHBondContact O-OG 3.35Å; I515-S518 VanDerWaalsContact O-OG 3.13Å; S518-E520 PolarHBondContact O-N 3.05Å; S518-E520 VanDerWaalsContact OG-CB 3.3Å; S518-E520 WeakPolarHBondContact OG-CB 3.41Å; S518-E520 PolarHBondContact OG-N 3.01Å
519	G	65.4	Low	71.4	Confident	47 Å²	47	83.7 Å²	83.7	49%	0.485	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	22.5	-170.8	0	0	0	0	0	112.8	I515 I516 Q517 K521	I515-G519 PolarHBondContact O-N 3.28Å; I516-G519 PolarHBondContact O-N 3.19Å; Q517-G519 PolarHBondContact O-N 3.11Å; G519-K521 PolarHBondContact O-N 3.24Å
520	E	62.3	Low	72.9	Confident	82 Å²	82	81.2 Å²	81.2	38%	0.383	42%	0.416	S	S	.	.			trans	-67.4	86.6	-174.3	-167	-161	147.2	0	0	110.6	K510 S518 S522	K510-E520 VanDerWaalsContact NZ-CD 3.32Å; K510-E520 IonicContact NZ-OE1 2.79Å; K510-E520 PolarHBondContact NZ-OE1 2.91Å; K510-E520 IonicContact NZ-OE2 3.92Å; K510-E520 PolarHBondContact NZ-OE2 3.41Å; S518-E520 PolarHBondContact O-N 3.05Å; S518-E520 VanDerWaalsContact OG-CB 3.3Å; S518-E520 WeakPolarHBondContact OG-CB 3.41Å; S518-E520 PolarHBondContact OG-N 3.01Å; E520-S522 VanDerWaalsContact CD-OG 3.3Å; E520-S522 PolarHBondContact O-N 2.89Å; E520-S522 VanDerWaalsContact OE1-CB 3.25Å; E520-S522 WeakPolarHBondContact OE1-CB 3.42Å; E520-S522 PolarHBondContact OE1-OG 3.47Å
521	K	63	Low	74.1	Confident	210 Å²	210	76 Å²	76	91%	0.913	39%	0.394	S	S	*	.			trans	-73	37.4	171.6	-61.7	179.9	-176.9	178.2	0	112.4	G519	G519-K521 PolarHBondContact O-N 3.24Å
522	S	63.1	Low	75.4	Confident	60 Å²	60	73.7 Å²	73.7	42%	0.42	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-67.4	158.5	174	60.1	0	0	0	0	110.3	E520	E520-S522 VanDerWaalsContact CD-OG 3.3Å; E520-S522 PolarHBondContact O-N 2.89Å; E520-S522 VanDerWaalsContact OE1-CB 3.25Å; E520-S522 WeakPolarHBondContact OE1-CB 3.42Å; E520-S522 PolarHBondContact OE1-OG 3.47Å
523	R	64.4	Low	76.3	Confident	171 Å²	171	68.6 Å²	68.6	65%	0.645	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-66.2	131.2	-178.8	-62.6	179.3	-179.4	179.4	-0.9	108.7	Q525	R523-Q525 PolarHBondContact O-N 3.29Å; R523-Q525 PolarHBondContact O-NE2 3Å
524	P	73.8	Confident	76.9	Confident	70 Å²	70	70.8 Å²	70.8	46%	0.455	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-54.4	135.3	177.1	-26.3	34.5	0	0	0	111.2	S526 R901	P524-S526 PolarHBondContact O-N 3.22Å; P524-R901 PolarHBondContact O-NH1 3.33Å; P524-R901 PolarHBondContact O-NH2 2.71Å
525	Q	82	Confident	77.5	Confident	112 Å²	112	65.6 Å²	65.6	52%	0.523	34%	0.338	S	S	.	.	S	Bend	trans	-83.1	22.8	-174.4	-61	-61.9	-69.8	0	0	113.3	N504 R523	N504-Q525 VanDerWaalsContact CB-O 3.28Å; N504-Q525 WeakPolarHBondContact CB-O 3.23Å; N504-Q525 PolarHBondContact ND2-O 3.33Å; R523-Q525 PolarHBondContact O-N 3.29Å; R523-Q525 PolarHBondContact O-NE2 3Å
526	S	87.9	Confident	78.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.333	C	S	.	.	S	Bend	trans	-145.5	160.3	176.7	-165.9	0	0	0	0	109.4	V502 N504 P524 R901	V502-S526 PolarHBondContact O-OG 3.48Å; N504-S526 PolarHBondContact N-OG 3.24Å; P524-S526 PolarHBondContact O-N 3.22Å; S526-R901 PolarHBondContact O-NH1 3.5Å
527	N	90.8	Very high	79	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.319	C	S	.	.			trans	-77.7	162.7	149.6	-69.4	103	0	0	0	110.1	V502 D674 I675 I899 N900	V502-N527 PolarHBondContact N-OD1 3.01Å; V502-N527 WeakPolarHBondContact O-CB 3.19Å; V502-N527 PolarHBondContact O-N 3.29Å; N527-D674 HydrophobicContact CB-CB 4.12Å; N527-I675 HydrophobicContact CB-CD1 3.58Å; N527-I675 HydrophobicContact CB-CG1 4.04Å; N527-I899 WeakPolarHBondContact OD1-CG2 3.06Å; N527-N900 PolarHBondContact ND2-O 2.85Å
528	T	89.8	Confident	79.7	Confident	37 Å²	37	57 Å²	57	23%	0.227	31%	0.307	C	S	.	.			trans	-96.4	148.1	178.6	66.7	0	0	0	0	111.7	V667 G673 D674 I675	T528-V667 CarbonylContact C-O 3.57Å; T528-V667 VanDerWaalsContact CA-O 3.28Å; T528-V667 WeakPolarHBondContact CA-O 3.32Å; T528-G673 WeakPolarHBondContact OG1-CA 3.31Å; T528-D674 WeakPolarHBondContact CB-OD2 3.4Å; T528-D674 PolarHBondContact N-OD2 3.33Å; T528-D674 WeakPolarHBondContact O-CB 3.17Å; T528-D674 PolarHBondContact O-N 2.92Å; T528-D674 VanDerWaalsContact OG1-CG 3.28Å; T528-D674 PolarHBondContact OG1-N 3.09Å; T528-D674 PolarHBondContact OG1-OD2 2.89Å; T528-I675 PolarHBondContact O-N 2.82Å
529	W	90.9	Very high	80.3	Confident	4 Å²	4	55 Å²	55	2%	0.015	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-142.9	140.9	-176	173	47.9	0	0	0	110.8	I503 F505 P531 V667 F668 A669 I677 M707 F708 Q711	I503-W529 HydrophobicContact CD1-CB 4.26Å; I503-W529 HydrophobicContact CD1-CD2 4Å; I503-W529 HydrophobicContact CD1-CE3 4.05Å; I503-W529 HydrophobicContact CD1-CG 4.09Å; I503-W529 HydrophobicContact CG2-CE3 4.42Å; F505-W529 HydrophobicContact CZ-CE3 4.14Å; F505-W529 AromaticContact CZ-CZ3 4Å; F505-W529 HydrophobicContact CZ-CZ3 4Å; W529-P531 HydrophobicContact CH2-CB 4.36Å; W529-P531 HydrophobicContact CZ2-CB 3.78Å; W529-P531 HydrophobicContact CZ2-CG 4.32Å; W529-V667 PolarHBondContact N-O 3.4Å; W529-F668 HydrophobicContact CE3-CE1 4.45Å; W529-F668 WeakPolarHBondContact O-CA 3.44Å; W529-A669 PolarHBondContact O-N 3.01Å; W529-I677 HydrophobicContact CH2-CD1 4.45Å; W529-I677 HydrophobicContact CZ2-CD1 3.52Å; W529-M707 HydrophobicContact CE3-CE 4.48Å; W529-M707 HydrophobicContact CH2-CE 3.76Å; W529-M707 HydrophobicContact CH2-CG 4.2Å; W529-M707 HydrophobicContact CH2-SD 4.18Å; W529-M707 HydrophobicContact CZ3-CE 3.4Å; W529-M707 VanDerWaalsContact CZ3-CE 3.4Å; W529-M707 HydrophobicContact CZ3-SD 4.21Å; W529-F708 HydrophobicContact CH2-CB 4.31Å; W529-F708 HydrophobicContact CH2-CD2 4.15Å; W529-F708 HydrophobicContact CZ2-CD2 4.48Å; W529-Q711 HydrophobicContact CZ2-CB 4.23Å; W529-Q711 HydrophobicContact CZ2-CG 4.05Å
530	N	90	Very high	81.3	Confident	9 Å²	9	52.8 Å²	52.8	5%	0.048	27%	0.266	C	S	.	.			trans	-132.4	103.2	171.4	178.9	5.2	0	0	0	111.8	F532 A533 M583 A669 D671	N530-F532 PolarHBondContact O-N 2.78Å; N530-F532 WeakPolarHBondContact OD1-CB 3.48Å; N530-F532 PolarHBondContact OD1-N 3.37Å; N530-A533 HydrophobicContact CB-CB 4.44Å; N530-A533 PolarHBondContact O-N 3.18Å; N530-M583 PolarHBondContact ND2-O 3.24Å; N530-A669 HydrophobicContact CB-CB 4.15Å; N530-D671 PolarHBondContact ND2-O 3.29Å
531	P	88.1	Confident	82.5	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.019	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-11.2	179.5	26.5	-34.9	0	0	0	114.4	W529 S535 T543 M707 Q711	W529-P531 HydrophobicContact CH2-CB 4.36Å; W529-P531 HydrophobicContact CZ2-CB 3.78Å; W529-P531 HydrophobicContact CZ2-CG 4.32Å; P531-S535 VanDerWaalsContact O-CB 3.29Å; P531-S535 WeakPolarHBondContact O-CB 3.3Å; P531-S535 PolarHBondContact O-OG 3.25Å; P531-T543 HydrophobicContact CB-CG2 4.41Å; P531-M707 HydrophobicContact CG-SD 4.19Å; P531-Q711 HydrophobicContact CB-CG 3.74Å; P531-Q711 PolarHBondContact O-NE2 2.98Å; P531-Q711 PolarHBondContact O-OE1 3.22Å
532	F	89.7	Confident	83.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-13.3	-173.7	-55.5	-56.1	0	0	0	114.3	N530 T540 T543 M544 M547 K573 M583 L585 L588	N530-F532 PolarHBondContact O-N 2.78Å; N530-F532 WeakPolarHBondContact OD1-CB 3.48Å; N530-F532 PolarHBondContact OD1-N 3.37Å; F532-T540 HydrophobicContact CD1-CG2 3.71Å; F532-T540 HydrophobicContact CE1-CG2 4.1Å; F532-T543 HydrophobicContact CE1-CG2 4.09Å; F532-M544 HydrophobicContact CE1-CG 4.18Å; F532-M544 HydrophobicContact CZ-CG 4.34Å; F532-M547 HydrophobicContact CE2-CE 4.31Å; F532-M547 HydrophobicContact CZ-CE 3.7Å; F532-M547 HydrophobicContact CZ-SD 4.49Å; F532-K573 PolarHBondContact O-NZ 3.06Å; F532-M583 CarbonylContact C-O 3.5Å; F532-M583 HydrophobicContact CB-CB 4.48Å; F532-M583 HydrophobicContact CB-CE 4.08Å; F532-M583 HydrophobicContact CB-CG 4.4Å; F532-M583 WeakPolarHBondContact CB-O 3.19Å; F532-L585 HydrophobicContact CD2-CB 4.35Å; F532-L585 HydrophobicContact CE2-CB 3.99Å; F532-L585 HydrophobicContact CE2-CD1 4.01Å; F532-L588 HydrophobicContact CD1-CD1 4.15Å; F532-L588 HydrophobicContact CD2-CD1 4.04Å; F532-L588 HydrophobicContact CE1-CD1 4.19Å; F532-L588 HydrophobicContact CE2-CD1 4.1Å; F532-L588 HydrophobicContact CG-CD1 4.03Å; F532-L588 HydrophobicContact CZ-CD1 4.15Å
533	A	84.3	Confident	84.6	Confident	11 Å²	11	38.5 Å²	38.5	9%	0.091	20%	0.197	C	C	.	.	S	Bend	trans	-59.5	-61.8	-178.1	0	0	0	0	0	112.2	N530 K573 T582	N530-A533 HydrophobicContact CB-CB 4.44Å; N530-A533 PolarHBondContact O-N 3.18Å; A533-K573 PolarHBondContact O-NZ 3.08Å; A533-T582 HydrophobicContact CB-CG2 3.46Å; A533-T582 VanDerWaalsContact CB-CG2 3.46Å
534	F	78.2	Confident	85.6	Confident	118 Å²	118	30.4 Å²	30.4	52%	0.518	17%	0.166	S	C	.	.	S	Bend	trans	-102.3	-4.4	-172.3	-50.4	-64.6	0	0	0	114.4	A672 D676 R718	F534-A672 HydrophobicContact CE2-CB 4.41Å; F534-A672 HydrophobicContact CZ-CB 4.07Å; F534-D676 HydrophobicContact CD2-CB 4.09Å; F534-D676 WeakPolarHBondContact CD2-OD2 3.33Å; F534-D676 HydrophobicContact CE2-CB 4.1Å; F534-R718 PolarHBondContact O-NH1 3.22Å
535	S	81.6	Confident	86	Confident	8 Å²	8	29.8 Å²	29.8	6%	0.056	16%	0.157	C	C	.	.			trans	-61.9	148.1	172.9	-81.1	0	0	0	0	113.1	P531 T540 K573 Q711	P531-S535 VanDerWaalsContact O-CB 3.29Å; P531-S535 WeakPolarHBondContact O-CB 3.3Å; P531-S535 PolarHBondContact O-OG 3.25Å; S535-T540 WeakPolarHBondContact CB-OG1 3.39Å; S535-K573 VanDerWaalsContact O-CE 3.24Å; S535-K573 WeakPolarHBondContact O-CE 3.24Å; S535-K573 PolarHBondContact O-NZ 3.33Å; S535-Q711 PolarHBondContact OG-NE2 3.28Å; S535-Q711 PolarHBondContact OG-OE1 3.45Å
536	T	84.8	Confident	85.9	Confident	39 Å²	39	25 Å²	25	24%	0.239	14%	0.137	C	C	.	.			trans	-75.2	173.8	168.8	64.6	0	0	0	0	111.3	F539 T540	T536-F539 PolarHBondContact O-N 3.4Å; T536-F539 WeakPolarHBondContact OG1-CB 3.39Å; T536-F539 VanDerWaalsContact OG1-CD1 3.24Å; T536-F539 WeakPolarHBondContact OG1-CD1 3.27Å; T536-F539 WeakPolarHBondContact OG1-CG 3.4Å; T536-F539 PolarHBondContact OG1-N 2.91Å; T536-F539 VanDerWaalsContact OG1-N 3.15Å; T536-T540 VanDerWaalsContact O-CB 3.31Å; T536-T540 WeakPolarHBondContact O-CB 3.45Å; T536-T540 PolarHBondContact O-N 2.92Å; T536-T540 PolarHBondContact O-OG1 3.11Å
537	E	86	Confident	85.4	Confident	75 Å²	75	25 Å²	25	35%	0.35	14%	0.137	S	C	.	.	H	α-helix	trans	-58.8	-47.4	173.7	-57.2	70.1	-156.4	0	0	110.4	F539 A541 V569 F570 K573	E537-F539 VanDerWaalsContact C-N 3.35Å; E537-F539 PolarHBondContact O-N 2.79Å; E537-A541 VanDerWaalsContact O-CB 3.29Å; E537-A541 WeakPolarHBondContact O-CB 3.31Å; E537-A541 PolarHBondContact O-N 3.21Å; E537-V569 HydrophobicContact CB-CG1 4.32Å; E537-V569 VanDerWaalsContact O-CG1 3.24Å; E537-V569 WeakPolarHBondContact O-CG1 3.38Å; E537-F570 HydrophobicContact CG-CD2 4.29Å; E537-K573 HydrophobicContact CG-CB 4.03Å; E537-K573 HydrophobicContact CG-CG 4.08Å; E537-K573 WeakPolarHBondContact OE1-CG 3.46Å
538	A	84.9	Confident	84.7	Confident	65 Å²	65	25.4 Å²	25.4	54%	0.537	14%	0.139	S	C	.	.	H	α-helix	trans	-62.6	-41.2	177.1	0	0	0	0	0	112.1	A541 E542	A538-A541 PolarHBondContact O-N 3.02Å; A538-E542 PolarHBondContact O-N 2.83Å
539	F	84.3	Confident	83.5	Confident	34 Å²	34	24.9 Å²	24.9	15%	0.149	14%	0.136	C	C	.	.	H	α-helix	trans	-72.2	-41.9	-176.8	-72.7	13.9	0	0	0	111.7	T536 E537 E542 T543 M714 R718	T536-F539 PolarHBondContact O-N 3.4Å; T536-F539 WeakPolarHBondContact OG1-CB 3.39Å; T536-F539 VanDerWaalsContact OG1-CD1 3.24Å; T536-F539 WeakPolarHBondContact OG1-CD1 3.27Å; T536-F539 WeakPolarHBondContact OG1-CG 3.4Å; T536-F539 PolarHBondContact OG1-N 2.91Å; T536-F539 VanDerWaalsContact OG1-N 3.15Å; E537-F539 VanDerWaalsContact C-N 3.35Å; E537-F539 PolarHBondContact O-N 2.79Å; F539-E542 PolarHBondContact O-N 3.08Å; F539-T543 VanDerWaalsContact O-CB 3.28Å; F539-T543 WeakPolarHBondContact O-CB 3.29Å; F539-T543 PolarHBondContact O-N 3.35Å; F539-T543 PolarHBondContact O-OG1 2.93Å; F539-M714 HydrophobicContact CB-CE 4.5Å; F539-M714 HydrophobicContact CB-SD 3.84Å; F539-M714 HydrophobicContact CD1-CB 4.32Å; F539-M714 HydrophobicContact CD1-CE 3.49Å; F539-M714 VanDerWaalsContact CD1-CE 3.49Å; F539-M714 HydrophobicContact CD1-CG 4.31Å; F539-M714 HydrophobicContact CD1-SD 3.68Å; F539-M714 HydrophobicContact CD2-CB 3.72Å; F539-M714 HydrophobicContact CD2-SD 4.29Å; F539-M714 HydrophobicContact CE1-CB 4.2Å; F539-M714 HydrophobicContact CE1-CE 3.87Å; F539-M714 HydrophobicContact CE1-CG 4.31Å; F539-M714 HydrophobicContact CE1-SD 4.24Å; F539-M714 VanDerWaalsContact CE2-C 3.48Å; F539-M714 HydrophobicContact CE2-CB 3.55Å; F539-M714 HydrophobicContact CE2-CG 4.48Å; F539-M714 WeakPolarHBondContact CE2-O 3.22Å; F539-M714 HydrophobicContact CG-CB 4.09Å; F539-M714 HydrophobicContact CG-CE 4.14Å; F539-M714 HydrophobicContact CG-CG 4.4Å; F539-M714 HydrophobicContact CG-SD 3.69Å; F539-M714 HydrophobicContact CZ-CB 3.8Å; F539-M714 HydrophobicContact CZ-CG 4.37Å; F539-M714 WeakPolarHBondContact CZ-O 3.47Å; F539-R718 HydrophobicContact CE2-CG 3.55Å; F539-R718 HydrophobicContact CZ-CG 3.52Å
540	T	87.1	Confident	82.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-48.5	172.2	-58.5	0	0	0	0	110.2	F532 S535 T536 E542 T543 M544 V569 M583 L588	F532-T540 HydrophobicContact CD1-CG2 3.71Å; F532-T540 HydrophobicContact CE1-CG2 4.1Å; S535-T540 WeakPolarHBondContact CB-OG1 3.39Å; T536-T540 VanDerWaalsContact O-CB 3.31Å; T536-T540 WeakPolarHBondContact O-CB 3.45Å; T536-T540 PolarHBondContact O-N 2.92Å; T536-T540 PolarHBondContact O-OG1 3.11Å; T540-E542 PolarHBondContact O-N 2.67Å; T540-T543 PolarHBondContact O-N 3.04Å; T540-M544 HydrophobicContact CG2-SD 4.3Å; T540-M544 WeakPolarHBondContact O-CG 3.45Å; T540-M544 PolarHBondContact O-N 3.39Å; T540-V569 HydrophobicContact CG2-CB 4.26Å; T540-V569 HydrophobicContact CG2-CG1 3.58Å; T540-V569 HydrophobicContact CG2-CG2 3.63Å; T540-M583 HydrophobicContact CG2-CE 3.42Å; T540-M583 VanDerWaalsContact CG2-CE 3.42Å; T540-M583 HydrophobicContact CG2-SD 4.44Å; T540-M583 VanDerWaalsContact OG1-CE 3.23Å; T540-M583 WeakPolarHBondContact OG1-CE 3.41Å; T540-L588 HydrophobicContact CG2-CD1 4.28Å
541	A	87	Confident	80.6	Confident	5 Å²	5	37.8 Å²	37.8	4%	0.041	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-37.9	-179.4	0	0	0	0	0	112.6	E537 A538 Q545 K566 V569	E537-A541 VanDerWaalsContact O-CB 3.29Å; E537-A541 WeakPolarHBondContact O-CB 3.31Å; E537-A541 PolarHBondContact O-N 3.21Å; A538-A541 PolarHBondContact O-N 3.02Å; A541-Q545 WeakPolarHBondContact O-CG 3.35Å; A541-Q545 PolarHBondContact O-N 2.84Å; A541-Q545 PolarHBondContact O-NE2 3.39Å; A541-K566 HydrophobicContact CB-CG 4.41Å; A541-V569 HydrophobicContact CB-CG1 4.37Å; A541-V569 HydrophobicContact CB-CG2 4.49Å
542	E	84.3	Confident	79	Confident	48 Å²	48	40.8 Å²	40.8	22%	0.224	22%	0.219	C	C	.	.	H	α-helix	trans	-73	-39.4	174.6	-167.9	176.1	130.2	0	0	112.5	A538 F539 T540 M544 Q545 S546 T710 M714 R757	A538-E542 PolarHBondContact O-N 2.83Å; F539-E542 PolarHBondContact O-N 3.08Å; T540-E542 PolarHBondContact O-N 2.67Å; E542-M544 VanDerWaalsContact C-N 3.28Å; E542-M544 PolarHBondContact O-N 3.34Å; E542-Q545 CarbonylContact O-C 3.55Å; E542-Q545 WeakPolarHBondContact O-CA 3.47Å; E542-Q545 WeakPolarHBondContact O-CB 3.48Å; E542-Q545 PolarHBondContact O-N 2.84Å; E542-S546 PolarHBondContact O-N 3.26Å; E542-T710 HydrophobicContact CG-CG2 4.27Å; E542-M714 HydrophobicContact CB-CE 3.66Å; E542-M714 HydrophobicContact CB-SD 4.1Å; E542-M714 HydrophobicContact CG-CE 4.07Å; E542-M714 WeakPolarHBondContact OE2-CE 3.33Å; E542-R757 IonicContact OE1-CZ 3.95Å; E542-R757 IonicContact OE1-NE 3.03Å; E542-R757 PolarHBondContact OE1-NE 3.43Å; E542-R757 IonicContact OE1-NH2 3.31Å; E542-R757 PolarHBondContact OE1-NH2 3.18Å; E542-R757 IonicContact OE2-CZ 2.96Å; E542-R757 IonicContact OE2-NH2 3.17Å; E542-R757 PolarHBondContact OE2-NH2 2.95Å
543	T	85.7	Confident	77.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-36.4	176.6	-55.1	0	0	0	0	111.2	P531 F532 F539 T540 Q545 S546 M547 M707 Q711	P531-T543 HydrophobicContact CB-CG2 4.41Å; F532-T543 HydrophobicContact CE1-CG2 4.09Å; F539-T543 VanDerWaalsContact O-CB 3.28Å; F539-T543 WeakPolarHBondContact O-CB 3.29Å; F539-T543 PolarHBondContact O-N 3.35Å; F539-T543 PolarHBondContact O-OG1 2.93Å; T540-T543 PolarHBondContact O-N 3.04Å; T543-Q545 VanDerWaalsContact C-N 3.35Å; T543-S546 PolarHBondContact O-N 3.06Å; T543-S546 PolarHBondContact O-OG 3.44Å; T543-M547 HydrophobicContact CG2-CE 4.43Å; T543-M547 WeakPolarHBondContact O-CG 3.31Å; T543-M547 PolarHBondContact O-N 3.22Å; T543-M707 HydrophobicContact CG2-CG 3.76Å; T543-Q711 HydrophobicContact CG2-CG 4.1Å; T543-Q711 PolarHBondContact OG1-NE2 3.49Å
544	M	86.1	Confident	75.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-34.2	169	-70.1	173.9	74.6	0	0	112.6	F532 T540 E542 M547 N565 L568 V569 L588 M592 F653 F657	F532-M544 HydrophobicContact CE1-CG 4.18Å; F532-M544 HydrophobicContact CZ-CG 4.34Å; T540-M544 HydrophobicContact CG2-SD 4.3Å; T540-M544 WeakPolarHBondContact O-CG 3.45Å; T540-M544 PolarHBondContact O-N 3.39Å; E542-M544 VanDerWaalsContact C-N 3.28Å; E542-M544 PolarHBondContact O-N 3.34Å; M544-M547 PolarHBondContact O-N 3.43Å; M544-N565 HydrophobicContact CE-CB 4.48Å; M544-L568 HydrophobicContact CE-CD2 4.21Å; M544-V569 HydrophobicContact CE-CG2 4.5Å; M544-V569 HydrophobicContact SD-CG2 3.34Å; M544-V569 WeakPolarHBondContact SD-CG2 3.32Å; M544-L588 HydrophobicContact SD-CD1 4.05Å; M544-L588 HydrophobicContact SD-CD2 4.34Å; M544-M592 HydrophobicContact CE-CE 3.58Å; M544-F653 WeakPolarHBondContact O-CE1 3.24Å; M544-F657 HydrophobicContact CE-CE2 4.44Å; M544-F657 HydrophobicContact CE-CZ 3.93Å
545	Q	82.5	Confident	75.1	Confident	57 Å²	57	47.7 Å²	47.7	27%	0.266	27%	0.27	S	S	.	.	H	α-helix	trans	-71.2	-33.6	175.9	-75	163.6	82	0	0	112.3	A541 E542 T543 M547 L548 I562	A541-Q545 WeakPolarHBondContact O-CG 3.35Å; A541-Q545 PolarHBondContact O-N 2.84Å; A541-Q545 PolarHBondContact O-NE2 3.39Å; E542-Q545 CarbonylContact O-C 3.55Å; E542-Q545 WeakPolarHBondContact O-CA 3.47Å; E542-Q545 WeakPolarHBondContact O-CB 3.48Å; E542-Q545 PolarHBondContact O-N 2.84Å; T543-Q545 VanDerWaalsContact C-N 3.35Å; Q545-M547 PolarHBondContact O-N 2.89Å; Q545-L548 WeakPolarHBondContact O-CB 3.28Å; Q545-L548 PolarHBondContact O-N 3.4Å; Q545-L548 VanDerWaalsContact O-N 3.16Å; Q545-I562 HydrophobicContact CG-CG1 4.07Å
546	S	80	Confident	74.4	Confident	13 Å²	13	53.2 Å²	53.2	9%	0.091	30%	0.295	C	S	.	.	H	α-helix	trans	-67.4	-20.8	175.7	62.5	0	0	0	0	113.3	E542 T543 L548 R706	E542-S546 PolarHBondContact O-N 3.26Å; T543-S546 PolarHBondContact O-N 3.06Å; T543-S546 PolarHBondContact O-OG 3.44Å; S546-L548 VanDerWaalsContact C-N 3.3Å; S546-R706 PolarHBondContact O-NH1 3.42Å; S546-R706 VanDerWaalsContact O-NH1 3.08Å; S546-R706 PolarHBondContact O-NH2 3.26Å
547	M	78.1	Confident	73.6	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.1	173.7	-66.3	170.4	176.1	0	0	114	F532 T543 M544 Q545 T656 F657 F660 M707	F532-M547 HydrophobicContact CE2-CE 4.31Å; F532-M547 HydrophobicContact CZ-CE 3.7Å; F532-M547 HydrophobicContact CZ-SD 4.49Å; T543-M547 HydrophobicContact CG2-CE 4.43Å; T543-M547 WeakPolarHBondContact O-CG 3.31Å; T543-M547 PolarHBondContact O-N 3.22Å; M544-M547 PolarHBondContact O-N 3.43Å; Q545-M547 PolarHBondContact O-N 2.89Å; M547-T656 HydrophobicContact CB-CG2 4.1Å; M547-T656 PolarHBondContact O-OG1 3.09Å; M547-F657 HydrophobicContact SD-CD1 4.4Å; M547-F657 HydrophobicContact SD-CE1 3.73Å; M547-F660 HydrophobicContact CE-CD2 4.08Å; M547-F660 HydrophobicContact CE-CE2 3.92Å; M547-F660 HydrophobicContact CG-CE2 4.04Å; M547-F660 HydrophobicContact SD-CD2 4.45Å; M547-F660 HydrophobicContact SD-CE2 4.27Å; M547-M707 HydrophobicContact CE-CG 3.95Å; M547-M707 HydrophobicContact CE-SD 3.39Å; M547-M707 WeakPolarHBondContact CE-SD 3.14Å
548	L	74.9	Confident	72.8	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.037	29%	0.294	C	S	.	.	S	Bend	trans	-73.4	151.7	179.1	-74.3	173.7	0	0	0	112.1	Q545 S546 Q558 Q652 F653 R706	Q545-L548 WeakPolarHBondContact O-CB 3.28Å; Q545-L548 PolarHBondContact O-N 3.4Å; Q545-L548 VanDerWaalsContact O-N 3.16Å; S546-L548 VanDerWaalsContact C-N 3.3Å; L548-Q558 HydrophobicContact CD1-CG 4.14Å; L548-Q652 HydrophobicContact CD2-CB 3.88Å; L548-Q652 WeakPolarHBondContact CD2-O 3.39Å; L548-F653 HydrophobicContact CD1-CE1 4Å; L548-F653 HydrophobicContact CD1-CZ 3.86Å; L548-F653 HydrophobicContact CD2-CD1 3.81Å; L548-F653 HydrophobicContact CD2-CE1 3.43Å; L548-F653 VanDerWaalsContact CD2-CE1 3.43Å; L548-F653 HydrophobicContact CD2-CE2 4.24Å; L548-F653 HydrophobicContact CD2-CG 4.34Å; L548-F653 HydrophobicContact CD2-CZ 3.65Å; L548-F653 HydrophobicContact CG-CD1 4.29Å; L548-F653 HydrophobicContact CG-CE1 3.55Å; L548-F653 HydrophobicContact CG-CZ 3.9Å; L548-R706 PolarHBondContact O-NH1 3.08Å; L548-R706 VanDerWaalsContact O-NH1 3.1Å; L548-R706 PolarHBondContact O-NH2 3.07Å
549	P	65.3	Low	72.3	Confident	27 Å²	27	54.6 Å²	54.6	18%	0.175	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-63.5	139.8	161.7	-2.6	16.2	0	0	0	110.4	V552 Q558 H699	P549-V552 HydrophobicContact CB-CG2 3.67Å; P549-V552 HydrophobicContact CG-CG2 3.81Å; P549-Q558 PolarHBondContact O-NE2 3.46Å; P549-H699 VanDerWaalsContact CA-NE2 3.25Å; P549-H699 WeakPolarHBondContact CA-NE2 3.27Å; P549-H699 VanDerWaalsContact CB-NE2 3.32Å; P549-H699 WeakPolarHBondContact CB-NE2 3.37Å; P549-H699 WeakPolarHBondContact CG-NE2 3.26Å
550	Q	61.9	Low	72	Confident	121 Å²	121	57.8 Å²	57.8	57%	0.565	30%	0.303	S	S	*	.	S	Bend	trans	-85.5	151.5	158.1	-66.5	179	-6.4	0	0	108.2
551	N	57.4	Low	71.7	Confident	162 Å²	162	57.9 Å²	57.9	87%	0.866	30%	0.303	S	S	*	.	S	Bend	trans	72	25.6	177	-48.6	-37	0	0	0	117.8
552	V	55.3	Low	71.4	Confident	66 Å²	66	59.7 Å²	59.7	40%	0.4	31%	0.312	S	S	.	.			trans	-71.6	139.2	164.9	-167.5	0	0	0	0	110.2	P549 G554	P549-V552 HydrophobicContact CB-CG2 3.67Å; P549-V552 HydrophobicContact CG-CG2 3.81Å; V552-G554 PolarHBondContact O-N 3.39Å
553	Q	50.7	Low	71.4	Confident	207 Å²	207	60 Å²	60	97%	0.967	32%	0.322	S	S	*	.	S	Bend	trans	-70.3	74.4	170.5	-70.3	-173.7	-9.9	0	0	111.3
554	G	57.1	Low	71.6	Confident	21 Å²	21	60 Å²	60	22%	0.216	32%	0.322	C	S	.	.			trans	-176.5	29.4	-173.9	0	0	0	0	0	115.6	V552 E556 W557 Q558	V552-G554 PolarHBondContact O-N 3.39Å; G554-E556 PolarHBondContact O-N 3.49Å; G554-W557 WeakPolarHBondContact O-CA 3.24Å; G554-W557 WeakPolarHBondContact O-CB 3.12Å; G554-W557 PolarHBondContact O-N 2.91Å; G554-Q558 PolarHBondContact O-N 3.39Å
555	G	62.5	Low	71.7	Confident	47 Å²	47	60 Å²	60	49%	0.485	32%	0.322	S	S	.	.	H	α-helix	trans	-53.6	-31.1	-171.8	0	0	0	0	0	115.6	Q558 S559	G555-Q558 PolarHBondContact O-N 2.91Å; G555-S559 PolarHBondContact O-N 2.92Å
556	E	67.5	Low	72	Confident	123 Å²	123	63 Å²	63	58%	0.575	33%	0.334	S	S	*	.	H	α-helix	trans	-66.7	-44.9	173.8	-157.4	-168.1	154.7	0	0	111.7	G554 Q558 S559 R560	G554-E556 PolarHBondContact O-N 3.49Å; E556-Q558 VanDerWaalsContact C-N 3.32Å; E556-Q558 PolarHBondContact O-N 2.88Å; E556-S559 PolarHBondContact O-N 3.04Å; E556-S559 PolarHBondContact O-OG 3.41Å; E556-R560 PolarHBondContact O-N 3.33Å; E556-R560 VanDerWaalsContact O-N 3.13Å; E556-R560 IonicContact OE1-CZ 3.01Å; E556-R560 IonicContact OE1-NE 3.52Å; E556-R560 IonicContact OE1-NH2 3.58Å; E556-R560 PolarHBondContact OE1-NH2 3.48Å
557	W	67.1	Low	72.6	Confident	82 Å²	82	62.5 Å²	62.5	31%	0.311	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-38.4	173.4	-65.2	98.1	0	0	0	111.8	G554 S559 R560 A561 Y648 L649	G554-W557 WeakPolarHBondContact O-CA 3.24Å; G554-W557 WeakPolarHBondContact O-CB 3.12Å; G554-W557 PolarHBondContact O-N 2.91Å; W557-S559 VanDerWaalsContact C-N 3.34Å; W557-S559 PolarHBondContact O-N 2.81Å; W557-R560 PolarHBondContact O-N 3.26Å; W557-A561 WeakPolarHBondContact O-CB 3.34Å; W557-A561 PolarHBondContact O-N 3.22Å; W557-Y648 HydrophobicContact CH2-CD2 4.34Å; W557-Y648 HydrophobicContact CZ3-CG 4.48Å; W557-L649 HydrophobicContact CE3-CD2 3.74Å; W557-L649 HydrophobicContact CE3-CG 4.31Å; W557-L649 HydrophobicContact CZ3-CD2 4.43Å; W557-L649 WeakPolarHBondContact O-CD2 3.31Å
558	Q	70.1	Confident	73.3	Confident	59 Å²	59	62.5 Å²	62.5	28%	0.276	33%	0.331	S	S	.	.	H	α-helix	trans	-60.4	-42.1	174.1	-165.9	172.3	22.2	0	0	111.8	L548 P549 G554 G555 E556 R560 A561 I562	L548-Q558 HydrophobicContact CD1-CG 4.14Å; P549-Q558 PolarHBondContact O-NE2 3.46Å; G554-Q558 PolarHBondContact O-N 3.39Å; G555-Q558 PolarHBondContact O-N 2.91Å; E556-Q558 VanDerWaalsContact C-N 3.32Å; E556-Q558 PolarHBondContact O-N 2.88Å; Q558-R560 PolarHBondContact O-N 3.35Å; Q558-A561 PolarHBondContact O-N 2.72Å; Q558-I562 WeakPolarHBondContact O-CG1 3.4Å; Q558-I562 PolarHBondContact O-N 2.87Å; Q558-I562 VanDerWaalsContact O-N 3.15Å
559	S	73.1	Confident	74.2	Confident	68 Å²	68	62.2 Å²	62.2	48%	0.476	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-37.9	175.5	74.1	0	0	0	0	113.3	G555 E556 W557 I562	G555-S559 PolarHBondContact O-N 2.92Å; E556-S559 PolarHBondContact O-N 3.04Å; E556-S559 PolarHBondContact O-OG 3.41Å; W557-S559 VanDerWaalsContact C-N 3.34Å; W557-S559 PolarHBondContact O-N 2.81Å; S559-I562 PolarHBondContact O-N 2.81Å
560	R	78.1	Confident	75.4	Confident	101 Å²	101	64.3 Å²	64.3	38%	0.381	34%	0.336	S	S	.	.	H	α-helix	trans	-70.4	-36.4	175.6	-66.3	177.6	-169.5	-157.7	6	111.5	E556 W557 Q558 I562 A563 M564 L649	E556-R560 PolarHBondContact O-N 3.33Å; E556-R560 VanDerWaalsContact O-N 3.13Å; E556-R560 IonicContact OE1-CZ 3.01Å; E556-R560 IonicContact OE1-NE 3.52Å; E556-R560 IonicContact OE1-NH2 3.58Å; E556-R560 PolarHBondContact OE1-NH2 3.48Å; W557-R560 PolarHBondContact O-N 3.26Å; Q558-R560 PolarHBondContact O-N 3.35Å; R560-I562 VanDerWaalsContact C-N 3.28Å; R560-I562 PolarHBondContact O-N 2.79Å; R560-A563 WeakPolarHBondContact O-CB 3.47Å; R560-A563 PolarHBondContact O-N 2.66Å; R560-M564 PolarHBondContact O-N 2.89Å; R560-M564 VanDerWaalsContact O-N 3.11Å; R560-L649 HydrophobicContact CB-CD1 4.45Å; R560-L649 HydrophobicContact CB-CD2 3.58Å
561	A	80.4	Confident	76.8	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-65.3	-30.1	176.2	0	0	0	0	0	112.6	W557 Q558 A563 M564 N565 L649 F653	W557-A561 WeakPolarHBondContact O-CB 3.34Å; W557-A561 PolarHBondContact O-N 3.22Å; Q558-A561 PolarHBondContact O-N 2.72Å; A561-A563 VanDerWaalsContact C-N 3.32Å; A561-A563 PolarHBondContact O-N 3.45Å; A561-M564 PolarHBondContact O-N 2.87Å; A561-N565 WeakPolarHBondContact O-CB 3.43Å; A561-N565 PolarHBondContact O-N 3Å; A561-L649 HydrophobicContact CB-CB 4.5Å; A561-L649 HydrophobicContact CB-CD2 4.22Å; A561-F653 HydrophobicContact CB-CE2 4.18Å
562	I	81.2	Confident	78.5	Confident	44 Å²	44	50.9 Å²	50.9	23%	0.226	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-36.1	171.2	-67	167.5	0	0	0	111.4	Q545 Q558 S559 R560 K566	Q545-I562 HydrophobicContact CG-CG1 4.07Å; Q558-I562 WeakPolarHBondContact O-CG1 3.4Å; Q558-I562 PolarHBondContact O-N 2.87Å; Q558-I562 VanDerWaalsContact O-N 3.15Å; S559-I562 PolarHBondContact O-N 2.81Å; R560-I562 VanDerWaalsContact C-N 3.28Å; R560-I562 PolarHBondContact O-N 2.79Å; I562-K566 HydrophobicContact CG2-CD 4.22Å; I562-K566 VanDerWaalsContact O-CG 3.32Å; I562-K566 WeakPolarHBondContact O-CG 3.01Å; I562-K566 PolarHBondContact O-N 3.26Å; I562-K566 VanDerWaalsContact O-N 3.09Å
563	A	83.6	Confident	80.2	Confident	53 Å²	53	48.6 Å²	48.6	44%	0.438	25%	0.253	S	S	.	.	H	α-helix	trans	-69.3	-45.4	175.5	0	0	0	0	0	111.7	R560 A561 N565 K566 A567	R560-A563 WeakPolarHBondContact O-CB 3.47Å; R560-A563 PolarHBondContact O-N 2.66Å; A561-A563 VanDerWaalsContact C-N 3.32Å; A561-A563 PolarHBondContact O-N 3.45Å; A563-N565 PolarHBondContact O-N 3.48Å; A563-K566 PolarHBondContact O-N 2.69Å; A563-A567 PolarHBondContact O-N 3.17Å
564	M	90.1	Very high	82.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-52.7	-51.5	172	-177.8	-168.6	74	0	0	111.3	R560 A561 K566 A567 L568 M592 M597 Y620 L649 F653	R560-M564 PolarHBondContact O-N 2.89Å; R560-M564 VanDerWaalsContact O-N 3.11Å; A561-M564 PolarHBondContact O-N 2.87Å; M564-K566 PolarHBondContact O-N 3.04Å; M564-A567 PolarHBondContact O-N 2.97Å; M564-L568 WeakPolarHBondContact O-CB 3.46Å; M564-L568 PolarHBondContact O-N 3.49Å; M564-M592 HydrophobicContact CE-CE 4.18Å; M564-M592 HydrophobicContact CE-CG 4.17Å; M564-M592 HydrophobicContact CE-SD 4.34Å; M564-M597 HydrophobicContact CG-SD 3.99Å; M564-Y620 HydrophobicContact CB-CD2 4.16Å; M564-Y620 HydrophobicContact CB-CE2 3.52Å; M564-Y620 HydrophobicContact CG-CE1 4.11Å; M564-Y620 HydrophobicContact CG-CE2 3.98Å; M564-L649 HydrophobicContact CE-CB 4.5Å; M564-L649 HydrophobicContact SD-CB 3.85Å; M564-F653 HydrophobicContact CE-CD2 4.18Å; M564-F653 HydrophobicContact CE-CE2 3.91Å
565	N	88.9	Confident	83.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-41.8	-179.9	-82.4	8.3	0	0	0	112.6	M544 A561 A563 A567 L568 V569 F653	M544-N565 HydrophobicContact CE-CB 4.48Å; A561-N565 WeakPolarHBondContact O-CB 3.43Å; A561-N565 PolarHBondContact O-N 3Å; A563-N565 PolarHBondContact O-N 3.48Å; N565-A567 PolarHBondContact O-N 3.16Å; N565-L568 PolarHBondContact O-N 2.83Å; N565-V569 VanDerWaalsContact O-CB 3.23Å; N565-V569 WeakPolarHBondContact O-CB 3.36Å; N565-V569 WeakPolarHBondContact O-CG2 3.34Å; N565-V569 PolarHBondContact O-N 3.02Å; N565-F653 VanDerWaalsContact ND2-CE1 3.31Å; N565-F653 WeakPolarHBondContact ND2-CE1 3.35Å; N565-F653 WeakPolarHBondContact ND2-CZ 3.47Å
566	K	89.2	Confident	85	Confident	120 Å²	120	39.1 Å²	39.1	52%	0.522	19%	0.189	S	C	.	.	H	α-helix	trans	-62	-42.5	177.1	-75.6	171.3	-179.2	176.4	0	111.9	A541 I562 A563 M564 F570	A541-K566 HydrophobicContact CB-CG 4.41Å; I562-K566 HydrophobicContact CG2-CD 4.22Å; I562-K566 VanDerWaalsContact O-CG 3.32Å; I562-K566 WeakPolarHBondContact O-CG 3.01Å; I562-K566 PolarHBondContact O-N 3.26Å; I562-K566 VanDerWaalsContact O-N 3.09Å; A563-K566 PolarHBondContact O-N 2.69Å; M564-K566 PolarHBondContact O-N 3.04Å; K566-F570 WeakPolarHBondContact O-CB 3.47Å; K566-F570 PolarHBondContact O-N 2.92Å; K566-F570 VanDerWaalsContact O-N 3.12Å
567	A	91.5	Very high	85.9	Confident	3 Å²	3	38.3 Å²	38.3	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-66.1	-47.4	176.9	0	0	0	0	0	112.2	A563 M564 N565 G571 M597 P616 L617 Y620	A563-A567 PolarHBondContact O-N 3.17Å; M564-A567 PolarHBondContact O-N 2.97Å; N565-A567 PolarHBondContact O-N 3.16Å; A567-G571 PolarHBondContact O-N 2.95Å; A567-M597 HydrophobicContact CB-CE 3.86Å; A567-P616 HydrophobicContact CB-CB 4.4Å; A567-P616 VanDerWaalsContact CB-O 3.29Å; A567-P616 WeakPolarHBondContact CB-O 3.4Å; A567-L617 HydrophobicContact CB-CD2 4.46Å; A567-L617 VanDerWaalsContact O-CD2 3.31Å; A567-L617 WeakPolarHBondContact O-CD2 3.08Å; A567-Y620 HydrophobicContact CB-CG 4.23Å
568	L	93.5	Very high	86.6	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-56.3	-55.5	176.3	174.2	62.8	0	0	0	111.3	M544 M564 N565 F570 G571 T572 L588 H591 M592 M597	M544-L568 HydrophobicContact CE-CD2 4.21Å; M564-L568 WeakPolarHBondContact O-CB 3.46Å; M564-L568 PolarHBondContact O-N 3.49Å; N565-L568 PolarHBondContact O-N 2.83Å; L568-F570 PolarHBondContact O-N 3.11Å; L568-G571 PolarHBondContact O-N 3.12Å; L568-T572 HydrophobicContact CD1-CG2 3.93Å; L568-T572 PolarHBondContact O-N 2.86Å; L568-T572 PolarHBondContact O-OG1 3.11Å; L568-L588 HydrophobicContact CG-CD2 4.41Å; L568-H591 HydrophobicContact CD1-CB 3.67Å; L568-H591 WeakPolarHBondContact CD1-O 3.39Å; L568-M592 HydrophobicContact CD2-CB 3.83Å; L568-M592 HydrophobicContact CD2-CE 4.03Å; L568-M592 HydrophobicContact CD2-CG 4.28Å; L568-M597 HydrophobicContact CB-CE 4.06Å; L568-M597 HydrophobicContact CB-SD 4.41Å; L568-M597 HydrophobicContact CD1-CG 4.28Å
569	V	92.8	Very high	87.2	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-62.8	-40.4	-175.5	166.2	0	0	0	0	112.3	E537 T540 A541 M544 N565 T572 K573 L588	E537-V569 HydrophobicContact CB-CG1 4.32Å; E537-V569 VanDerWaalsContact O-CG1 3.24Å; E537-V569 WeakPolarHBondContact O-CG1 3.38Å; T540-V569 HydrophobicContact CG2-CB 4.26Å; T540-V569 HydrophobicContact CG2-CG1 3.58Å; T540-V569 HydrophobicContact CG2-CG2 3.63Å; A541-V569 HydrophobicContact CB-CG1 4.37Å; A541-V569 HydrophobicContact CB-CG2 4.49Å; M544-V569 HydrophobicContact CE-CG2 4.5Å; M544-V569 HydrophobicContact SD-CG2 3.34Å; M544-V569 WeakPolarHBondContact SD-CG2 3.32Å; N565-V569 VanDerWaalsContact O-CB 3.23Å; N565-V569 WeakPolarHBondContact O-CB 3.36Å; N565-V569 WeakPolarHBondContact O-CG2 3.34Å; N565-V569 PolarHBondContact O-N 3.02Å; V569-T572 PolarHBondContact O-OG1 2.83Å; V569-K573 WeakPolarHBondContact O-CB 3.45Å; V569-K573 PolarHBondContact O-N 3.07Å; V569-L588 HydrophobicContact CG2-CD2 4.27Å
570	F	91.6	Very high	87.4	Confident	72 Å²	72	39.8 Å²	39.8	32%	0.316	21%	0.21	S	C	.	.	H	α-helix	trans	-62.6	-46.7	176.8	-157.3	-69.1	0	0	0	110.5	E537 K566 L568 F574 A613 P616	E537-F570 HydrophobicContact CG-CD2 4.29Å; K566-F570 WeakPolarHBondContact O-CB 3.47Å; K566-F570 PolarHBondContact O-N 2.92Å; K566-F570 VanDerWaalsContact O-N 3.12Å; L568-F570 PolarHBondContact O-N 3.11Å; F570-F574 VanDerWaalsContact O-CB 3.29Å; F570-F574 WeakPolarHBondContact O-CB 3.28Å; F570-F574 PolarHBondContact O-N 3.26Å; F570-A613 HydrophobicContact CD1-CB 4.35Å; F570-A613 HydrophobicContact CE1-CB 3.94Å; F570-P616 HydrophobicContact CB-CB 4.37Å; F570-P616 HydrophobicContact CB-CG 4.35Å; F570-P616 HydrophobicContact CD1-CG 4.31Å; F570-P616 HydrophobicContact CD2-CG 4.43Å; F570-P616 HydrophobicContact CG-CG 4.1Å
571	G	91	Very high	87.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-47.9	178.1	0	0	0	0	0	113.2	A567 L568 W575	A567-G571 PolarHBondContact O-N 2.95Å; L568-G571 PolarHBondContact O-N 3.12Å; G571-W575 WeakPolarHBondContact O-CB 3.41Å; G571-W575 PolarHBondContact O-N 3.04Å; G571-W575 VanDerWaalsContact O-N 3.07Å
572	T	92.6	Very high	87.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.6	-40	-178.7	56.5	0	0	0	0	111.8	L568 V569 W575 C576 M583 L588 H591 L600	L568-T572 HydrophobicContact CD1-CG2 3.93Å; L568-T572 PolarHBondContact O-N 2.86Å; L568-T572 PolarHBondContact O-OG1 3.11Å; V569-T572 PolarHBondContact O-OG1 2.83Å; T572-W575 PolarHBondContact O-N 3.23Å; T572-C576 WeakPolarHBondContact O-CB 3.47Å; T572-C576 PolarHBondContact O-N 2.95Å; T572-C576 PolarHBondContact O-SG 2.89Å; T572-C576 VanDerWaalsContact O-SG 3.32Å; T572-M583 PolarHBondContact OG1-SD 2.87Å; T572-M583 VanDerWaalsContact OG1-SD 3.41Å; T572-L588 HydrophobicContact CG2-CD2 4.43Å; T572-L588 WeakPolarHBondContact OG1-CD2 3.38Å; T572-H591 HydrophobicContact CG2-CB 3.98Å; T572-L600 HydrophobicContact CG2-CD2 3.83Å
573	K	91.5	Very high	88.2	Confident	18 Å²	18	39.6 Å²	39.6	8%	0.078	22%	0.215	C	C	.	.	H	α-helix	trans	-66.4	-43	177.9	-167.3	76.7	-161.9	-167.2	0	111.4	F532 A533 S535 E537 V569 W575 C576 V577 M583	F532-K573 PolarHBondContact O-NZ 3.06Å; A533-K573 PolarHBondContact O-NZ 3.08Å; S535-K573 VanDerWaalsContact O-CE 3.24Å; S535-K573 WeakPolarHBondContact O-CE 3.24Å; S535-K573 PolarHBondContact O-NZ 3.33Å; E537-K573 HydrophobicContact CG-CB 4.03Å; E537-K573 HydrophobicContact CG-CG 4.08Å; E537-K573 WeakPolarHBondContact OE1-CG 3.46Å; V569-K573 WeakPolarHBondContact O-CB 3.45Å; V569-K573 PolarHBondContact O-N 3.07Å; K573-W575 VanDerWaalsContact C-N 3.33Å; K573-W575 PolarHBondContact O-N 3.06Å; K573-C576 PolarHBondContact O-N 3.02Å; K573-V577 HydrophobicContact CG-CG2 4.46Å; K573-V577 WeakPolarHBondContact O-CG2 3.46Å; K573-V577 PolarHBondContact O-N 2.85Å; K573-M583 HydrophobicContact CB-CE 4.36Å; K573-M583 HydrophobicContact CB-SD 4.11Å; K573-M583 HydrophobicContact CD-CE 3.44Å; K573-M583 VanDerWaalsContact CD-CE 3.44Å; K573-M583 HydrophobicContact CD-SD 3.99Å; K573-M583 HydrophobicContact CG-CE 4.48Å
574	F	90.5	Very high	88.4	Confident	51 Å²	51	37.5 Å²	37.5	22%	0.224	20%	0.197	C	C	.	.	H	α-helix	trans	-59.4	-45.2	175	-175.1	-90.3	0	0	0	111.4	F570 V577 R578 W609 P610 A613	F570-F574 VanDerWaalsContact O-CB 3.29Å; F570-F574 WeakPolarHBondContact O-CB 3.28Å; F570-F574 PolarHBondContact O-N 3.26Å; F574-V577 PolarHBondContact O-N 3.17Å; F574-R578 HydrophobicContact CE1-CB 4.48Å; F574-R578 WeakPolarHBondContact O-CB 3.41Å; F574-R578 PolarHBondContact O-N 2.86Å; F574-W609 AromaticContact CD1-CD2 3.5Å; F574-W609 HydrophobicContact CD1-CD2 3.5Å; F574-W609 AromaticContact CD1-CE3 3.41Å; F574-W609 HydrophobicContact CD1-CE3 3.41Å; F574-W609 VanDerWaalsContact CD1-CE3 3.41Å; F574-W609 HydrophobicContact CD1-CG 4Å; F574-W609 HydrophobicContact CD1-CH2 4.42Å; F574-W609 HydrophobicContact CD1-CZ2 4.5Å; F574-W609 AromaticContact CD1-CZ3 3.9Å; F574-W609 HydrophobicContact CD1-CZ3 3.9Å; F574-W609 HydrophobicContact CE1-CB 3.88Å; F574-W609 AromaticContact CE1-CD2 3.58Å; F574-W609 HydrophobicContact CE1-CD2 3.58Å; F574-W609 AromaticContact CE1-CE3 3.93Å; F574-W609 HydrophobicContact CE1-CE3 3.93Å; F574-W609 AromaticContact CE1-CG 3.54Å; F574-W609 HydrophobicContact CE1-CG 3.54Å; F574-W609 HydrophobicContact CG-CE3 4.29Å; F574-W609 HydrophobicContact CZ-CB 4.49Å; F574-P610 HydrophobicContact CE2-CG 4.27Å; F574-P610 HydrophobicContact CZ-CG 4.01Å; F574-A613 HydrophobicContact CB-CB 4.3Å; F574-A613 HydrophobicContact CD1-CB 3.99Å; F574-A613 HydrophobicContact CD2-CB 3.78Å; F574-A613 HydrophobicContact CE1-CB 4.29Å; F574-A613 HydrophobicContact CE2-CB 4.1Å; F574-A613 HydrophobicContact CG-CB 3.72Å; F574-A613 HydrophobicContact CZ-CB 4.36Å
575	W	91.2	Very high	88.2	Confident	23 Å²	23	38 Å²	38	9%	0.087	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-47.9	175.1	-171.3	46.3	0	0	0	112.3	G571 T572 K573 V577 R578 E579 K581 M587 H591 L600 W609	G571-W575 WeakPolarHBondContact O-CB 3.41Å; G571-W575 PolarHBondContact O-N 3.04Å; G571-W575 VanDerWaalsContact O-N 3.07Å; T572-W575 PolarHBondContact O-N 3.23Å; K573-W575 VanDerWaalsContact C-N 3.33Å; K573-W575 PolarHBondContact O-N 3.06Å; W575-V577 PolarHBondContact O-N 3.45Å; W575-R578 PolarHBondContact O-N 2.99Å; W575-E579 VanDerWaalsContact CD1-CG 3.45Å; W575-E579 HydrophobicContact CG-CG 4.25Å; W575-E579 WeakPolarHBondContact O-CB 3.42Å; W575-E579 VanDerWaalsContact O-CG 3.29Å; W575-E579 WeakPolarHBondContact O-CG 3.21Å; W575-E579 PolarHBondContact O-N 3.01Å; W575-K581 VanDerWaalsContact CH2-NZ 3.32Å; W575-M587 HydrophobicContact CE3-SD 3.98Å; W575-M587 HydrophobicContact CZ3-CE 4.25Å; W575-M587 HydrophobicContact CZ3-CG 4.41Å; W575-M587 HydrophobicContact CZ3-SD 3.89Å; W575-H591 AromaticContact CZ3-CE1 3.76Å; W575-H591 AromaticContact CZ3-NE2 3.84Å; W575-L600 HydrophobicContact CB-CD1 4.43Å; W575-L600 HydrophobicContact CD2-CD1 4.44Å; W575-L600 HydrophobicContact CE3-CD1 4.45Å; W575-L600 HydrophobicContact CG-CD1 4.47Å; W575-W609 HydrophobicContact CB-CH2 3.77Å; W575-W609 HydrophobicContact CB-CZ2 3.97Å; W575-W609 AromaticContact CD1-CZ2 3.82Å; W575-W609 HydrophobicContact CG-CH2 4.3Å; W575-W609 HydrophobicContact CG-CZ2 4.13Å
576	C	89.3	Confident	87.9	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-56.6	-50	176.7	-78.8	0	0	0	0	112.4	T572 K573 R578 G580 K581 M583 M587	T572-C576 WeakPolarHBondContact O-CB 3.47Å; T572-C576 PolarHBondContact O-N 2.95Å; T572-C576 PolarHBondContact O-SG 2.89Å; T572-C576 VanDerWaalsContact O-SG 3.32Å; K573-C576 PolarHBondContact O-N 3.02Å; C576-R578 VanDerWaalsContact C-N 3.33Å; C576-R578 PolarHBondContact O-N 3.4Å; C576-G580 WeakPolarHBondContact O-CA 3.34Å; C576-G580 PolarHBondContact O-N 3.45Å; C576-K581 CarbonylContact C-O 3.58Å; C576-K581 WeakPolarHBondContact CB-O 3.18Å; C576-K581 PolarHBondContact O-N 3.22Å; C576-M583 HydrophobicContact CB-CB 4.32Å; C576-M587 PolarHBondContact SG-SD 2.97Å
577	V	86.2	Confident	87.9	Confident	105 Å²	105	37.3 Å²	37.3	64%	0.636	20%	0.198	S	C	*	.	H	α-helix	trans	-63	-39	179.2	171.8	0	0	0	0	111.6	K573 F574 W575	K573-V577 HydrophobicContact CG-CG2 4.46Å; K573-V577 WeakPolarHBondContact O-CG2 3.46Å; K573-V577 PolarHBondContact O-N 2.85Å; F574-V577 PolarHBondContact O-N 3.17Å; W575-V577 PolarHBondContact O-N 3.45Å
578	R	82.6	Confident	87.8	Confident	93 Å²	93	37.1 Å²	37.1	35%	0.351	20%	0.197	S	C	.	.	H	α-helix	trans	-75.4	-40.1	-177.6	-160.8	-167.8	75.1	163	-1.7	113.6	F574 W575 C576 D607	F574-R578 HydrophobicContact CE1-CB 4.48Å; F574-R578 WeakPolarHBondContact O-CB 3.41Å; F574-R578 PolarHBondContact O-N 2.86Å; W575-R578 PolarHBondContact O-N 2.99Å; C576-R578 VanDerWaalsContact C-N 3.33Å; C576-R578 PolarHBondContact O-N 3.4Å; R578-D607 IonicContact CZ-OD2 2.78Å; R578-D607 PolarHBondContact NH1-O 2.84Å; R578-D607 VanDerWaalsContact NH2-CB 3.33Å; R578-D607 IonicContact NH2-OD2 3.59Å; R578-D607 PolarHBondContact NH2-OD2 3.25Å
579	E	82.2	Confident	87.5	Confident	76 Å²	76	41.1 Å²	41.1	36%	0.355	21%	0.212	S	C	.	.	H	α-helix	trans	-85	-11	179.8	-55.4	-64.5	120.2	0	0	113.1	W575 K581 R603	W575-E579 VanDerWaalsContact CD1-CG 3.45Å; W575-E579 HydrophobicContact CG-CG 4.25Å; W575-E579 WeakPolarHBondContact O-CB 3.42Å; W575-E579 VanDerWaalsContact O-CG 3.29Å; W575-E579 WeakPolarHBondContact O-CG 3.21Å; W575-E579 PolarHBondContact O-N 3.01Å; E579-K581 HydrophobicContact CB-CD 4.07Å; E579-K581 HydrophobicContact CB-CG 3.92Å; E579-R603 IonicContact OE1-NH2 3.56Å; E579-R603 IonicContact OE2-NH2 3.21Å; E579-R603 PolarHBondContact OE2-NH2 3.27Å
580	G	76.5	Confident	87.2	Confident	72 Å²	72	46 Å²	46	74%	0.742	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.9	34.9	-173.7	0	0	0	0	0	113.5	C576	C576-G580 WeakPolarHBondContact O-CA 3.34Å; C576-G580 PolarHBondContact O-N 3.45Å
581	K	82.6	Confident	87.2	Confident	88 Å²	88	44 Å²	44	38%	0.383	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-103.8	147.8	178.7	-61	176.4	-177.7	-175.3	0	111.2	W575 C576 E579 M587	W575-K581 VanDerWaalsContact CH2-NZ 3.32Å; C576-K581 CarbonylContact C-O 3.58Å; C576-K581 WeakPolarHBondContact CB-O 3.18Å; C576-K581 PolarHBondContact O-N 3.22Å; E579-K581 HydrophobicContact CB-CD 4.07Å; E579-K581 HydrophobicContact CB-CG 3.92Å; K581-M587 HydrophobicContact CD-CE 4.41Å
582	T	84.5	Confident	87.2	Confident	53 Å²	53	44.4 Å²	44.4	33%	0.325	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-73.7	143.6	166.2	-39.5	0	0	0	0	110.7	A533 M587 D671	A533-T582 HydrophobicContact CB-CG2 3.46Å; A533-T582 VanDerWaalsContact CB-CG2 3.46Å; T582-M587 WeakPolarHBondContact O-CE 3.19Å; T582-D671 VanDerWaalsContact CG2-O 3.25Å; T582-D671 WeakPolarHBondContact CG2-O 3.33Å
583	M	89.9	Confident	87.1	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-93.2	134.1	171.9	-170.3	168.8	65.4	0	0	108.8	N530 F532 T540 T572 K573 C576 L588	N530-M583 PolarHBondContact ND2-O 3.24Å; F532-M583 CarbonylContact C-O 3.5Å; F532-M583 HydrophobicContact CB-CB 4.48Å; F532-M583 HydrophobicContact CB-CE 4.08Å; F532-M583 HydrophobicContact CB-CG 4.4Å; F532-M583 WeakPolarHBondContact CB-O 3.19Å; T540-M583 HydrophobicContact CG2-CE 3.42Å; T540-M583 VanDerWaalsContact CG2-CE 3.42Å; T540-M583 HydrophobicContact CG2-SD 4.44Å; T540-M583 VanDerWaalsContact OG1-CE 3.23Å; T540-M583 WeakPolarHBondContact OG1-CE 3.41Å; T572-M583 PolarHBondContact OG1-SD 2.87Å; T572-M583 VanDerWaalsContact OG1-SD 3.41Å; K573-M583 HydrophobicContact CB-CE 4.36Å; K573-M583 HydrophobicContact CB-SD 4.11Å; K573-M583 HydrophobicContact CD-CE 3.44Å; K573-M583 VanDerWaalsContact CD-CE 3.44Å; K573-M583 HydrophobicContact CD-SD 3.99Å; K573-M583 HydrophobicContact CG-CE 4.48Å; C576-M583 HydrophobicContact CB-CB 4.32Å; M583-L588 HydrophobicContact CG-CG 4.43Å; M583-L588 HydrophobicContact SD-CD2 4.21Å
584	S	87.8	Confident	87.2	Confident	9 Å²	9	47 Å²	47	6%	0.063	25%	0.246	C	C	.	.			trans	-139.8	165.5	-176.9	62.7	0	0	0	0	111.7	Q586 M587 L588 A670	S584-Q586 VanDerWaalsContact C-N 3.27Å; S584-Q586 PolarHBondContact O-N 2.91Å; S584-M587 PolarHBondContact O-N 3.13Å; S584-M587 VanDerWaalsContact O-N 3.14Å; S584-L588 PolarHBondContact O-N 3.36Å; S584-L588 VanDerWaalsContact O-N 3.11Å; S584-A670 WeakPolarHBondContact CB-O 3.12Å; S584-A670 PolarHBondContact OG-O 2.78Å
585	L	86.6	Confident	87.3	Confident	11 Å²	11	47.1 Å²	47.1	6%	0.058	25%	0.247	C	C	.	.	H	α-helix	trans	-56.7	-40.4	-178.7	-177.9	61.8	0	0	0	112.2	F532 L588 R589 F657 F660	F532-L585 HydrophobicContact CD2-CB 4.35Å; F532-L585 HydrophobicContact CE2-CB 3.99Å; F532-L585 HydrophobicContact CE2-CD1 4.01Å; L585-L588 PolarHBondContact O-N 2.97Å; L585-R589 WeakPolarHBondContact O-CB 3.42Å; L585-R589 PolarHBondContact O-N 3.48Å; L585-F657 HydrophobicContact CD1-CD1 3.92Å; L585-F657 HydrophobicContact CD1-CD2 4.14Å; L585-F657 HydrophobicContact CD1-CE1 3.85Å; L585-F657 HydrophobicContact CD1-CE2 4.07Å; L585-F657 HydrophobicContact CD1-CG 4.06Å; L585-F657 HydrophobicContact CD1-CZ 3.92Å; L585-F660 HydrophobicContact CD2-CB 3.67Å
586	Q	83.3	Confident	87.4	Confident	78 Å²	78	46.3 Å²	46.3	36%	0.364	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-41.6	177.8	175.5	60	20.4	0	0	112	S584 L588 R589 E590	S584-Q586 VanDerWaalsContact C-N 3.27Å; S584-Q586 PolarHBondContact O-N 2.91Å; Q586-L588 VanDerWaalsContact C-N 3.33Å; Q586-L588 PolarHBondContact O-N 3.49Å; Q586-R589 PolarHBondContact O-N 3.43Å; Q586-R589 VanDerWaalsContact OE1-NE 3.11Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.48Å; Q586-E590 PolarHBondContact NE2-OE1 3.31Å; Q586-E590 WeakPolarHBondContact O-CG 3.46Å; Q586-E590 PolarHBondContact O-N 3.15Å
587	M	88.2	Confident	87.6	Confident	26 Å²	26	46.1 Å²	46.1	13%	0.128	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-39.8	176.2	-174.7	-175.7	-65.5	0	0	111.8	W575 C576 K581 T582 S584 H591	W575-M587 HydrophobicContact CE3-SD 3.98Å; W575-M587 HydrophobicContact CZ3-CE 4.25Å; W575-M587 HydrophobicContact CZ3-CG 4.41Å; W575-M587 HydrophobicContact CZ3-SD 3.89Å; C576-M587 PolarHBondContact SG-SD 2.97Å; K581-M587 HydrophobicContact CD-CE 4.41Å; T582-M587 WeakPolarHBondContact O-CE 3.19Å; S584-M587 PolarHBondContact O-N 3.13Å; S584-M587 VanDerWaalsContact O-N 3.14Å; M587-H591 PolarHBondContact O-N 3.45Å; M587-H591 PolarHBondContact O-ND1 3.06Å
588	L	89.7	Confident	87.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-43.9	174.1	-70.2	168	0	0	0	111	F532 T540 M544 L568 V569 T572 M583 S584 L585 Q586 E590 H591 M592	F532-L588 HydrophobicContact CD1-CD1 4.15Å; F532-L588 HydrophobicContact CD2-CD1 4.04Å; F532-L588 HydrophobicContact CE1-CD1 4.19Å; F532-L588 HydrophobicContact CE2-CD1 4.1Å; F532-L588 HydrophobicContact CG-CD1 4.03Å; F532-L588 HydrophobicContact CZ-CD1 4.15Å; T540-L588 HydrophobicContact CG2-CD1 4.28Å; M544-L588 HydrophobicContact SD-CD1 4.05Å; M544-L588 HydrophobicContact SD-CD2 4.34Å; L568-L588 HydrophobicContact CG-CD2 4.41Å; V569-L588 HydrophobicContact CG2-CD2 4.27Å; T572-L588 HydrophobicContact CG2-CD2 4.43Å; T572-L588 WeakPolarHBondContact OG1-CD2 3.38Å; M583-L588 HydrophobicContact CG-CG 4.43Å; M583-L588 HydrophobicContact SD-CD2 4.21Å; S584-L588 PolarHBondContact O-N 3.36Å; S584-L588 VanDerWaalsContact O-N 3.11Å; L585-L588 PolarHBondContact O-N 2.97Å; Q586-L588 VanDerWaalsContact C-N 3.33Å; Q586-L588 PolarHBondContact O-N 3.49Å; L588-E590 PolarHBondContact O-N 2.74Å; L588-H591 PolarHBondContact O-N 3.4Å; L588-M592 VanDerWaalsContact O-CB 3.26Å; L588-M592 WeakPolarHBondContact O-CB 3.41Å; L588-M592 PolarHBondContact O-N 3.38Å
589	R	86.8	Confident	88.4	Confident	84 Å²	84	43.7 Å²	43.7	32%	0.317	23%	0.228	S	C	.	.	H	α-helix	trans	-60.3	-42.4	177	-170.8	170.4	73.4	149.6	-0.9	112.5	L585 Q586 F657	L585-R589 WeakPolarHBondContact O-CB 3.42Å; L585-R589 PolarHBondContact O-N 3.48Å; Q586-R589 PolarHBondContact O-N 3.43Å; Q586-R589 VanDerWaalsContact OE1-NE 3.11Å; R589-F657 HydrophobicContact CB-CD2 4.31Å; R589-F657 HydrophobicContact CG-CD2 4.45Å
590	E	87.3	Confident	88.9	Confident	102 Å²	102	40.2 Å²	40.2	48%	0.477	21%	0.212	S	C	.	.	H	α-helix	trans	-62.7	-45.8	176.8	-73.5	167	-170.8	0	0	112.5	Q586 L588 T593	Q586-E590 WeakPolarHBondContact CG-OE1 3.48Å; Q586-E590 PolarHBondContact NE2-OE1 3.31Å; Q586-E590 WeakPolarHBondContact O-CG 3.46Å; Q586-E590 PolarHBondContact O-N 3.15Å; L588-E590 PolarHBondContact O-N 2.74Å; E590-T593 PolarHBondContact O-OG1 2.96Å; E590-T593 VanDerWaalsContact O-OG1 3.13Å
591	H	91.2	Very high	89.8	Confident	30 Å²	30	37.7 Å²	37.7	14%	0.139	18%	0.181	C	C	.	.	H	α-helix	trans	-84.7	-11.6	-175.4	-66.3	79.6	0	0	0	113.6	L568 T572 W575 M587 L588 T593 G596 M597	L568-H591 HydrophobicContact CD1-CB 3.67Å; L568-H591 WeakPolarHBondContact CD1-O 3.39Å; T572-H591 HydrophobicContact CG2-CB 3.98Å; W575-H591 AromaticContact CZ3-CE1 3.76Å; W575-H591 AromaticContact CZ3-NE2 3.84Å; M587-H591 PolarHBondContact O-N 3.45Å; M587-H591 PolarHBondContact O-ND1 3.06Å; L588-H591 PolarHBondContact O-N 3.4Å; H591-T593 PolarHBondContact O-N 3.11Å; H591-G596 CarbonylContact O-C 3.56Å; H591-M597 WeakPolarHBondContact O-CG 3.35Å; H591-M597 PolarHBondContact O-N 3.5Å
592	M	91	Very high	90.2	Very high	10 Å²	10	34.2 Å²	34.2	5%	0.049	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.2	175.7	-179	174.3	-79.2	0	0	113.6	M544 M564 L568 L588 H646 F653 F657	M544-M592 HydrophobicContact CE-CE 3.58Å; M564-M592 HydrophobicContact CE-CE 4.18Å; M564-M592 HydrophobicContact CE-CG 4.17Å; M564-M592 HydrophobicContact CE-SD 4.34Å; L568-M592 HydrophobicContact CD2-CB 3.83Å; L568-M592 HydrophobicContact CD2-CE 4.03Å; L568-M592 HydrophobicContact CD2-CG 4.28Å; L588-M592 VanDerWaalsContact O-CB 3.26Å; L588-M592 WeakPolarHBondContact O-CB 3.41Å; L588-M592 PolarHBondContact O-N 3.38Å; M592-H646 PolarHBondContact O-NE2 2.88Å; M592-F653 HydrophobicContact CE-CB 4.21Å; M592-F653 HydrophobicContact CE-CD2 3.87Å; M592-F653 HydrophobicContact CE-CE2 4.48Å; M592-F653 HydrophobicContact CE-CG 3.97Å; M592-F653 HydrophobicContact SD-CB 4.06Å; M592-F653 HydrophobicContact SD-CD2 4.1Å; M592-F653 HydrophobicContact SD-CG 4.3Å; M592-F657 HydrophobicContact CE-CD2 4.5Å; M592-F657 HydrophobicContact CE-CE2 3.58Å; M592-F657 HydrophobicContact CE-CZ 3.99Å; M592-F657 HydrophobicContact SD-CD2 4.49Å; M592-F657 HydrophobicContact SD-CE2 4.1Å
593	T	91.4	Very high	90.4	Very high	68 Å²	68	35.8 Å²	35.8	42%	0.417	17%	0.167	S	C	.	.	S	Bend	trans	-68.6	152	171.9	57.1	0	0	0	0	111.6	E590 H591 E595 G596 M597	E590-T593 PolarHBondContact O-OG1 2.96Å; E590-T593 VanDerWaalsContact O-OG1 3.13Å; H591-T593 PolarHBondContact O-N 3.11Å; T593-E595 VanDerWaalsContact C-N 3.31Å; T593-E595 PolarHBondContact O-N 2.98Å; T593-G596 CarbonylContact O-C 3.56Å; T593-G596 WeakPolarHBondContact O-CA 3.49Å; T593-G596 PolarHBondContact O-N 2.94Å; T593-G596 WeakPolarHBondContact OG1-CA 3.44Å; T593-G596 PolarHBondContact OG1-N 3.02Å; T593-M597 PolarHBondContact O-N 2.89Å
594	L	92.9	Very high	90.3	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-44.5	177.2	-178.1	62.6	0	0	0	111	G596 M597 A598 L621 F627 W638 P642 R643 H646	L594-G596 VanDerWaalsContact C-N 3.27Å; L594-G596 PolarHBondContact O-N 3.3Å; L594-M597 PolarHBondContact O-N 3.24Å; L594-A598 WeakPolarHBondContact O-CB 3.15Å; L594-A598 PolarHBondContact O-N 2.89Å; L594-L621 HydrophobicContact CD1-CD2 3.76Å; L594-F627 HydrophobicContact CD1-CD2 4.31Å; L594-F627 HydrophobicContact CD1-CE2 4.14Å; L594-F627 HydrophobicContact CD2-CD2 4.19Å; L594-F627 HydrophobicContact CD2-CE2 4.19Å; L594-F627 HydrophobicContact CG-CE2 4.25Å; L594-W638 HydrophobicContact CD2-CE3 4.18Å; L594-W638 HydrophobicContact CD2-CZ3 4.14Å; L594-W638 HydrophobicContact CG-CE3 4.48Å; L594-W638 HydrophobicContact CG-CZ3 3.96Å; L594-P642 HydrophobicContact CD2-CB 3.82Å; L594-R643 HydrophobicContact CD2-CG 4.32Å; L594-H646 HydrophobicContact CB-CB 4.17Å; L594-H646 HydrophobicContact CD1-CB 4.43Å; L594-H646 HydrophobicContact CD2-CB 4.41Å; L594-H646 PolarHBondContact N-NE2 3.36Å
595	E	92.5	Very high	90.3	Very high	54 Å²	54	38.6 Å²	38.6	25%	0.252	18%	0.181	S	C	.	.	H	α-helix	trans	-59.6	-34.3	171.3	-73.3	73.4	-168.2	0	0	112.7	T593 K599 P635 W638 R643	T593-E595 VanDerWaalsContact C-N 3.31Å; T593-E595 PolarHBondContact O-N 2.98Å; E595-K599 WeakPolarHBondContact O-CB 3.16Å; E595-K599 WeakPolarHBondContact O-CD 3.42Å; E595-K599 WeakPolarHBondContact O-CG 3.36Å; E595-K599 PolarHBondContact O-N 2.9Å; E595-P635 HydrophobicContact CG-CB 4.42Å; E595-W638 HydrophobicContact CG-CH2 4.28Å; E595-W638 HydrophobicContact CG-CZ3 3.82Å; E595-R643 IonicContact OE1-CZ 3.7Å; E595-R643 IonicContact OE1-NE 3.76Å; E595-R643 PolarHBondContact OE1-NE 2.84Å; E595-R643 IonicContact OE1-NH2 2.92Å; E595-R643 PolarHBondContact OE1-NH2 2.97Å
596	G	92.4	Very high	90.2	Very high	5 Å²	5	42.4 Å²	42.4	5%	0.052	20%	0.201	C	C	.	.	H	α-helix	trans	-68	-49.7	174.8	0	0	0	0	0	112.8	H591 T593 L594 A598 K599 L600	H591-G596 CarbonylContact O-C 3.56Å; T593-G596 CarbonylContact O-C 3.56Å; T593-G596 WeakPolarHBondContact O-CA 3.49Å; T593-G596 PolarHBondContact O-N 2.94Å; T593-G596 WeakPolarHBondContact OG1-CA 3.44Å; T593-G596 PolarHBondContact OG1-N 3.02Å; L594-G596 VanDerWaalsContact C-N 3.27Å; L594-G596 PolarHBondContact O-N 3.3Å; G596-A598 PolarHBondContact O-N 3.45Å; G596-K599 PolarHBondContact O-N 3.17Å; G596-L600 WeakPolarHBondContact O-CB 3.43Å; G596-L600 PolarHBondContact O-N 3.09Å
597	M	93.8	Very high	90.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-39.9	176.5	-64.9	-168.5	70	0	0	112	M564 A567 L568 H591 T593 L594 L600 Y601 L617 Y620	M564-M597 HydrophobicContact CG-SD 3.99Å; A567-M597 HydrophobicContact CB-CE 3.86Å; L568-M597 HydrophobicContact CB-CE 4.06Å; L568-M597 HydrophobicContact CB-SD 4.41Å; L568-M597 HydrophobicContact CD1-CG 4.28Å; H591-M597 WeakPolarHBondContact O-CG 3.35Å; H591-M597 PolarHBondContact O-N 3.5Å; T593-M597 PolarHBondContact O-N 2.89Å; L594-M597 PolarHBondContact O-N 3.24Å; M597-L600 PolarHBondContact O-N 3.43Å; M597-Y601 WeakPolarHBondContact O-CB 3.37Å; M597-Y601 PolarHBondContact O-N 3.18Å; M597-L617 HydrophobicContact CE-CD2 3.81Å; M597-Y620 HydrophobicContact CE-CD1 3.5Å; M597-Y620 VanDerWaalsContact CE-CD1 3.5Å; M597-Y620 HydrophobicContact CE-CE1 3.91Å; M597-Y620 HydrophobicContact CE-CG 4.22Å; M597-Y620 HydrophobicContact SD-CD1 3.93Å; M597-Y620 HydrophobicContact SD-CE1 3.68Å
598	A	93.4	Very high	89.9	Confident	3 Å²	3	45.7 Å²	45.7	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-40.3	176	0	0	0	0	0	112.8	L594 G596 L600 Y601 C602 V632 W638	L594-A598 WeakPolarHBondContact O-CB 3.15Å; L594-A598 PolarHBondContact O-N 2.89Å; G596-A598 PolarHBondContact O-N 3.45Å; A598-L600 VanDerWaalsContact C-N 3.34Å; A598-Y601 PolarHBondContact O-N 2.89Å; A598-C602 WeakPolarHBondContact O-CB 3.36Å; A598-C602 PolarHBondContact O-N 2.89Å; A598-C602 PolarHBondContact O-SG 3.07Å; A598-V632 HydrophobicContact CB-CG2 4.2Å; A598-W638 HydrophobicContact CB-CH2 3.49Å; A598-W638 VanDerWaalsContact CB-CH2 3.49Å; A598-W638 HydrophobicContact CB-CZ2 3.83Å
599	K	92.9	Very high	89.8	Confident	144 Å²	144	46.3 Å²	46.3	63%	0.626	22%	0.221	S	C	*	.	H	α-helix	trans	-61.2	-42.8	171.9	-77.9	166.7	-174.8	173	0	111.5	E595 G596 C602 R603	E595-K599 WeakPolarHBondContact O-CB 3.16Å; E595-K599 WeakPolarHBondContact O-CD 3.42Å; E595-K599 WeakPolarHBondContact O-CG 3.36Å; E595-K599 PolarHBondContact O-N 2.9Å; G596-K599 PolarHBondContact O-N 3.17Å; K599-C602 PolarHBondContact O-N 3.38Å; K599-R603 WeakPolarHBondContact O-CB 3.32Å; K599-R603 PolarHBondContact O-N 3Å
600	L	92.8	Very high	89.7	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-42.2	177.8	-166.1	64.4	0	0	0	111.5	T572 W575 G596 M597 A598 R603 G604 W609 L617	T572-L600 HydrophobicContact CG2-CD2 3.83Å; W575-L600 HydrophobicContact CB-CD1 4.43Å; W575-L600 HydrophobicContact CD2-CD1 4.44Å; W575-L600 HydrophobicContact CE3-CD1 4.45Å; W575-L600 HydrophobicContact CG-CD1 4.47Å; G596-L600 WeakPolarHBondContact O-CB 3.43Å; G596-L600 PolarHBondContact O-N 3.09Å; M597-L600 PolarHBondContact O-N 3.43Å; A598-L600 VanDerWaalsContact C-N 3.34Å; L600-R603 PolarHBondContact O-N 3.48Å; L600-G604 PolarHBondContact O-N 3.26Å; L600-W609 HydrophobicContact CD1-CH2 3.82Å; L600-W609 HydrophobicContact CG-CH2 4.19Å; L600-L617 HydrophobicContact CB-CD1 4.38Å; L600-L617 HydrophobicContact CD2-CD1 4.16Å; L600-L617 HydrophobicContact CD2-CD2 4.32Å; L600-L617 HydrophobicContact CG-CD1 4.01Å
601	Y	94.1	Very high	89.6	Confident	19 Å²	19	45.2 Å²	45.2	8%	0.075	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-46.3	173.6	172.5	-103.2	0	0	0	112.8	M597 A598 R603 G604 L605 I614 L617 R618 L621 M629 V632	M597-Y601 WeakPolarHBondContact O-CB 3.37Å; M597-Y601 PolarHBondContact O-N 3.18Å; A598-Y601 PolarHBondContact O-N 2.89Å; Y601-R603 VanDerWaalsContact C-N 3.34Å; Y601-R603 PolarHBondContact O-N 3.22Å; Y601-G604 WeakPolarHBondContact O-CA 3.21Å; Y601-G604 PolarHBondContact O-N 3.43Å; Y601-G604 VanDerWaalsContact O-N 3.08Å; Y601-L605 HydrophobicContact CD1-CD1 4.28Å; Y601-L605 HydrophobicContact CE1-CD1 3.63Å; Y601-L605 HydrophobicContact CE1-CG 4.41Å; Y601-L605 HydrophobicContact CE2-CD1 4.46Å; Y601-L605 HydrophobicContact CE2-CG 4.48Å; Y601-L605 PolarHBondContact O-N 3.12Å; Y601-I614 HydrophobicContact CD2-CG2 3.82Å; Y601-I614 HydrophobicContact CE2-CG2 3.45Å; Y601-I614 VanDerWaalsContact CE2-CG2 3.45Å; Y601-L617 HydrophobicContact CD2-CB 4.17Å; Y601-R618 HydrophobicContact CD2-CB 4.33Å; Y601-R618 HydrophobicContact CE2-CB 3.68Å; Y601-R618 HydrophobicContact CE2-CG 4.05Å; Y601-L621 HydrophobicContact CD1-CD1 4.22Å; Y601-L621 HydrophobicContact CG-CD1 3.97Å; Y601-M629 HydrophobicContact CD1-SD 4.35Å; Y601-M629 HydrophobicContact CE1-CE 4.36Å; Y601-M629 HydrophobicContact CE1-SD 3.51Å; Y601-M629 VanDerWaalsContact CE1-SD 3.51Å; Y601-V632 HydrophobicContact CD1-CG1 4.38Å; Y601-V632 HydrophobicContact CD1-CG2 3.71Å; Y601-V632 HydrophobicContact CE1-CG1 4.05Å; Y601-V632 HydrophobicContact CE1-CG2 4.06Å
602	C	91.6	Very high	89.4	Confident	14 Å²	14	50.4 Å²	50.4	10%	0.095	25%	0.249	C	C	.	.	H	α-helix	trans	-61.8	-43.2	177.2	-66.9	0	0	0	0	111.3	A598 K599 G604 L605 D606	A598-C602 WeakPolarHBondContact O-CB 3.36Å; A598-C602 PolarHBondContact O-N 2.89Å; A598-C602 PolarHBondContact O-SG 3.07Å; K599-C602 PolarHBondContact O-N 3.38Å; C602-G604 VanDerWaalsContact C-N 3.28Å; C602-G604 PolarHBondContact O-N 3.45Å; C602-L605 WeakPolarHBondContact O-CB 3.18Å; C602-L605 PolarHBondContact O-N 3.09Å; C602-L605 VanDerWaalsContact O-N 3.14Å; C602-D606 VanDerWaalsContact O-CG 3.24Å; C602-D606 PolarHBondContact O-N 3.02Å; C602-D606 VanDerWaalsContact O-OD2 3.13Å
603	R	89.7	Confident	89.2	Confident	86 Å²	86	50 Å²	50	33%	0.325	25%	0.247	S	C	.	.	H	α-helix	trans	-61.4	-35.2	172.7	-176.3	169	-175.1	152.5	2.5	112.7	E579 K599 L600 Y601 L605 D606 D607	E579-R603 IonicContact OE1-NH2 3.56Å; E579-R603 IonicContact OE2-NH2 3.21Å; E579-R603 PolarHBondContact OE2-NH2 3.27Å; K599-R603 WeakPolarHBondContact O-CB 3.32Å; K599-R603 PolarHBondContact O-N 3Å; L600-R603 PolarHBondContact O-N 3.48Å; Y601-R603 VanDerWaalsContact C-N 3.34Å; Y601-R603 PolarHBondContact O-N 3.22Å; R603-L605 VanDerWaalsContact C-N 3.34Å; R603-D606 PolarHBondContact O-N 2.88Å; R603-D607 VanDerWaalsContact CG-OD2 3.27Å; R603-D607 WeakPolarHBondContact CG-OD2 3.4Å; R603-D607 IonicContact CZ-OD2 2.94Å; R603-D607 IonicContact NE-OD2 2.85Å; R603-D607 PolarHBondContact NE-OD2 3.26Å; R603-D607 IonicContact NH2-OD2 2.83Å; R603-D607 PolarHBondContact NH2-OD2 2.75Å; R603-D607 WeakPolarHBondContact O-CB 3.23Å; R603-D607 PolarHBondContact O-N 2.68Å
604	G	87.3	Confident	89.1	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-41.4	172.9	0	0	0	0	0	113	L600 Y601 C602 Q608 W609 I614	L600-G604 PolarHBondContact O-N 3.26Å; Y601-G604 WeakPolarHBondContact O-CA 3.21Å; Y601-G604 PolarHBondContact O-N 3.43Å; Y601-G604 VanDerWaalsContact O-N 3.08Å; C602-G604 VanDerWaalsContact C-N 3.28Å; C602-G604 PolarHBondContact O-N 3.45Å; G604-Q608 PolarHBondContact O-N 3.43Å; G604-W609 PolarHBondContact O-N 2.97Å; G604-I614 WeakPolarHBondContact O-CD1 3.29Å
605	L	87.9	Confident	89	Confident	68 Å²	68	47.9 Å²	47.9	36%	0.356	24%	0.236	S	C	.	.	H	α-helix	trans	-69.8	-45.4	173.7	-64.9	172.7	0	0	0	112.4	Y601 C602 R603 Q608 I614	Y601-L605 HydrophobicContact CD1-CD1 4.28Å; Y601-L605 HydrophobicContact CE1-CD1 3.63Å; Y601-L605 HydrophobicContact CE1-CG 4.41Å; Y601-L605 HydrophobicContact CE2-CD1 4.46Å; Y601-L605 HydrophobicContact CE2-CG 4.48Å; Y601-L605 PolarHBondContact O-N 3.12Å; C602-L605 WeakPolarHBondContact O-CB 3.18Å; C602-L605 PolarHBondContact O-N 3.09Å; C602-L605 VanDerWaalsContact O-N 3.14Å; R603-L605 VanDerWaalsContact C-N 3.34Å; L605-Q608 PolarHBondContact O-N 3.13Å; L605-I614 HydrophobicContact CD2-CD1 4.19Å; L605-I614 HydrophobicContact CD2-CG2 4.32Å
606	D	84.2	Confident	89	Confident	91 Å²	91	47.1 Å²	47.1	49%	0.487	24%	0.235	S	C	.	.	H	α-helix	trans	-66.7	-46.8	-175.9	-68.2	-31.3	0	0	0	111.9	C602 R603 Q608 R633	C602-D606 VanDerWaalsContact O-CG 3.24Å; C602-D606 PolarHBondContact O-N 3.02Å; C602-D606 VanDerWaalsContact O-OD2 3.13Å; R603-D606 PolarHBondContact O-N 2.88Å; D606-Q608 PolarHBondContact O-N 2.82Å; D606-R633 VanDerWaalsContact CG-NH1 3.26Å; D606-R633 IonicContact OD1-CZ 3.48Å; D606-R633 IonicContact OD1-NH1 2.68Å; D606-R633 PolarHBondContact OD1-NH1 3.45Å; D606-R633 IonicContact OD1-NH2 3.26Å; D606-R633 PolarHBondContact OD1-NH2 3.45Å; D606-R633 IonicContact OD2-CZ 3.22Å; D606-R633 IonicContact OD2-NH1 3.17Å; D606-R633 PolarHBondContact OD2-NH1 3.38Å; D606-R633 IonicContact OD2-NH2 2.66Å
607	D	83	Confident	89	Confident	53 Å²	53	46.9 Å²	46.9	28%	0.283	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	18	177.8	-50.9	-18.6	0	0	0	112.8	R578 R603 W609	R578-D607 IonicContact CZ-OD2 2.78Å; R578-D607 PolarHBondContact NH1-O 2.84Å; R578-D607 VanDerWaalsContact NH2-CB 3.33Å; R578-D607 IonicContact NH2-OD2 3.59Å; R578-D607 PolarHBondContact NH2-OD2 3.25Å; R603-D607 VanDerWaalsContact CG-OD2 3.27Å; R603-D607 WeakPolarHBondContact CG-OD2 3.4Å; R603-D607 IonicContact CZ-OD2 2.94Å; R603-D607 IonicContact NE-OD2 2.85Å; R603-D607 PolarHBondContact NE-OD2 3.26Å; R603-D607 IonicContact NH2-OD2 2.83Å; R603-D607 PolarHBondContact NH2-OD2 2.75Å; R603-D607 WeakPolarHBondContact O-CB 3.23Å; R603-D607 PolarHBondContact O-N 2.68Å; D607-W609 PolarHBondContact O-N 2.58Å
608	Q	82.7	Confident	89	Confident	121 Å²	121	49.7 Å²	49.7	57%	0.565	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.3	58	175.4	-59.8	-176.6	34.7	0	0	115.2	G604 L605 D606	G604-Q608 PolarHBondContact O-N 3.43Å; L605-Q608 PolarHBondContact O-N 3.13Å; D606-Q608 PolarHBondContact O-N 2.82Å
609	W	87.6	Confident	89	Confident	13 Å²	13	53.2 Å²	53.2	5%	0.049	26%	0.262	C	S	.	.			trans	-68.1	155.4	174.5	-62.5	14.6	0	0	0	111	F574 W575 L600 G604 D607 A613 I614	F574-W609 AromaticContact CD1-CD2 3.5Å; F574-W609 HydrophobicContact CD1-CD2 3.5Å; F574-W609 AromaticContact CD1-CE3 3.41Å; F574-W609 HydrophobicContact CD1-CE3 3.41Å; F574-W609 VanDerWaalsContact CD1-CE3 3.41Å; F574-W609 HydrophobicContact CD1-CG 4Å; F574-W609 HydrophobicContact CD1-CH2 4.42Å; F574-W609 HydrophobicContact CD1-CZ2 4.5Å; F574-W609 AromaticContact CD1-CZ3 3.9Å; F574-W609 HydrophobicContact CD1-CZ3 3.9Å; F574-W609 HydrophobicContact CE1-CB 3.88Å; F574-W609 AromaticContact CE1-CD2 3.58Å; F574-W609 HydrophobicContact CE1-CD2 3.58Å; F574-W609 AromaticContact CE1-CE3 3.93Å; F574-W609 HydrophobicContact CE1-CE3 3.93Å; F574-W609 AromaticContact CE1-CG 3.54Å; F574-W609 HydrophobicContact CE1-CG 3.54Å; F574-W609 HydrophobicContact CG-CE3 4.29Å; F574-W609 HydrophobicContact CZ-CB 4.49Å; W575-W609 HydrophobicContact CB-CH2 3.77Å; W575-W609 HydrophobicContact CB-CZ2 3.97Å; W575-W609 AromaticContact CD1-CZ2 3.82Å; W575-W609 HydrophobicContact CG-CH2 4.3Å; W575-W609 HydrophobicContact CG-CZ2 4.13Å; L600-W609 HydrophobicContact CD1-CH2 3.82Å; L600-W609 HydrophobicContact CG-CH2 4.19Å; G604-W609 PolarHBondContact O-N 2.97Å; D607-W609 PolarHBondContact O-N 2.58Å; W609-A613 HydrophobicContact CB-CB 4.47Å; W609-A613 HydrophobicContact CE3-CB 4.14Å; W609-I614 HydrophobicContact CB-CD1 4Å; W609-I614 HydrophobicContact CB-CG1 3.82Å; W609-I614 WeakPolarHBondContact O-CD1 3.36Å
610	P	84.1	Confident	89	Confident	63 Å²	63	47.2 Å²	47.2	41%	0.409	24%	0.236	S	C	.	.			trans	-56.4	145.3	170.3	-22.1	33.7	0	0	0	111.7	F574 E612 A613 I614	F574-P610 HydrophobicContact CE2-CG 4.27Å; F574-P610 HydrophobicContact CZ-CG 4.01Å; P610-E612 VanDerWaalsContact CB-OE2 3.23Å; P610-E612 WeakPolarHBondContact CB-OE2 3.43Å; P610-E612 PolarHBondContact O-N 3.34Å; P610-E612 VanDerWaalsContact O-N 3.15Å; P610-A613 PolarHBondContact O-N 2.9Å; P610-I614 PolarHBondContact O-N 3.11Å
611	E	85.9	Confident	89	Confident	100 Å²	100	47 Å²	47	47%	0.467	24%	0.235	S	C	.	.	H	α-helix	trans	-57	-32.2	-179.5	174.5	67.6	176.4	0	0	111.6	A613 I614 A615 R618	E611-A613 PolarHBondContact O-N 2.98Å; E611-I614 PolarHBondContact O-N 3.47Å; E611-A615 WeakPolarHBondContact O-CB 3.35Å; E611-A615 PolarHBondContact O-N 3.24Å; E611-R618 VanDerWaalsContact CD-NH1 3.32Å; E611-R618 IonicContact OE1-CZ 3.35Å; E611-R618 IonicContact OE1-NH1 3.94Å; E611-R618 PolarHBondContact OE1-NH1 3.05Å; E611-R618 IonicContact OE1-NH2 3.8Å; E611-R618 PolarHBondContact OE1-NH2 3.11Å; E611-R618 IonicContact OE2-NH1 3.51Å; E611-R618 PolarHBondContact OE2-NH1 2.95Å; E611-R618 VanDerWaalsContact OE2-NH1 3.14Å
612	E	85.9	Confident	88.9	Confident	139 Å²	139	51.2 Å²	51.2	65%	0.65	26%	0.255	S	S	*	.	H	α-helix	trans	-61.2	-29.1	174.9	-59.7	84.1	173	0	0	113.3	P610 P616	P610-E612 VanDerWaalsContact CB-OE2 3.23Å; P610-E612 WeakPolarHBondContact CB-OE2 3.43Å; P610-E612 PolarHBondContact O-N 3.34Å; P610-E612 VanDerWaalsContact O-N 3.15Å; E612-P616 VanDerWaalsContact O-CD 3.28Å; E612-P616 WeakPolarHBondContact O-CD 3.29Å
613	A	86.5	Confident	88.8	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-90.8	-25.7	177.3	0	0	0	0	0	113.3	F570 F574 W609 P610 E611	F570-A613 HydrophobicContact CD1-CB 4.35Å; F570-A613 HydrophobicContact CE1-CB 3.94Å; F574-A613 HydrophobicContact CB-CB 4.3Å; F574-A613 HydrophobicContact CD1-CB 3.99Å; F574-A613 HydrophobicContact CD2-CB 3.78Å; F574-A613 HydrophobicContact CE1-CB 4.29Å; F574-A613 HydrophobicContact CE2-CB 4.1Å; F574-A613 HydrophobicContact CG-CB 3.72Å; F574-A613 HydrophobicContact CZ-CB 4.36Å; W609-A613 HydrophobicContact CB-CB 4.47Å; W609-A613 HydrophobicContact CE3-CB 4.14Å; P610-A613 PolarHBondContact O-N 2.9Å; E611-A613 PolarHBondContact O-N 2.98Å
614	I	89.7	Confident	88.8	Confident	8 Å²	8	53 Å²	53	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-84.1	-37.7	178.2	-60.6	-179.8	0	0	0	111.2	Y601 G604 L605 W609 P610 E611 L617 R618	Y601-I614 HydrophobicContact CD2-CG2 3.82Å; Y601-I614 HydrophobicContact CE2-CG2 3.45Å; Y601-I614 VanDerWaalsContact CE2-CG2 3.45Å; G604-I614 WeakPolarHBondContact O-CD1 3.29Å; L605-I614 HydrophobicContact CD2-CD1 4.19Å; L605-I614 HydrophobicContact CD2-CG2 4.32Å; W609-I614 HydrophobicContact CB-CD1 4Å; W609-I614 HydrophobicContact CB-CG1 3.82Å; W609-I614 WeakPolarHBondContact O-CD1 3.36Å; P610-I614 PolarHBondContact O-N 3.11Å; E611-I614 PolarHBondContact O-N 3.47Å; I614-L617 PolarHBondContact O-N 3.37Å; I614-R618 PolarHBondContact O-N 2.83Å
615	A	91.8	Very high	88.8	Confident	20 Å²	20	55.8 Å²	55.8	17%	0.165	29%	0.288	C	S	.	.	H	α-helix	trans	-57.3	-41.5	-174	0	0	0	0	0	114.7	E611 L617 R618 N619	E611-A615 WeakPolarHBondContact O-CB 3.35Å; E611-A615 PolarHBondContact O-N 3.24Å; A615-L617 PolarHBondContact O-N 2.78Å; A615-R618 PolarHBondContact O-N 3.16Å; A615-N619 WeakPolarHBondContact O-CB 3.48Å; A615-N619 PolarHBondContact O-N 3.44Å; A615-N619 PolarHBondContact O-OD1 2.9Å; A615-N619 VanDerWaalsContact O-OD1 3.06Å
616	P	92.1	Very high	88.7	Confident	37 Å²	37	55.4 Å²	55.4	24%	0.24	30%	0.3	C	S	.	.	H	α-helix	trans	-60.5	-43.2	177.2	-24.6	35.4	0	0	0	112.9	A567 F570 E612 Y620	A567-P616 HydrophobicContact CB-CB 4.4Å; A567-P616 VanDerWaalsContact CB-O 3.29Å; A567-P616 WeakPolarHBondContact CB-O 3.4Å; F570-P616 HydrophobicContact CB-CB 4.37Å; F570-P616 HydrophobicContact CB-CG 4.35Å; F570-P616 HydrophobicContact CD1-CG 4.31Å; F570-P616 HydrophobicContact CD2-CG 4.43Å; F570-P616 HydrophobicContact CG-CG 4.1Å; E612-P616 VanDerWaalsContact O-CD 3.28Å; E612-P616 WeakPolarHBondContact O-CD 3.29Å; P616-Y620 PolarHBondContact O-N 3.28Å
617	L	93	Very high	89	Confident	1 Å²	1	52 Å²	52	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-66.6	-44.4	176	-69.7	172.3	0	0	0	111.5	A567 M597 L600 Y601 I614 A615 L621	A567-L617 HydrophobicContact CB-CD2 4.46Å; A567-L617 VanDerWaalsContact O-CD2 3.31Å; A567-L617 WeakPolarHBondContact O-CD2 3.08Å; M597-L617 HydrophobicContact CE-CD2 3.81Å; L600-L617 HydrophobicContact CB-CD1 4.38Å; L600-L617 HydrophobicContact CD2-CD1 4.16Å; L600-L617 HydrophobicContact CD2-CD2 4.32Å; L600-L617 HydrophobicContact CG-CD1 4.01Å; Y601-L617 HydrophobicContact CD2-CB 4.17Å; I614-L617 PolarHBondContact O-N 3.37Å; A615-L617 PolarHBondContact O-N 2.78Å; L617-L621 WeakPolarHBondContact O-CB 3.28Å; L617-L621 VanDerWaalsContact O-CG 3.31Å; L617-L621 WeakPolarHBondContact O-CG 3.19Å; L617-L621 PolarHBondContact O-N 2.74Å
618	R	93.2	Very high	89.4	Confident	59 Å²	59	53.3 Å²	53.3	22%	0.223	29%	0.288	C	S	.	.	H	α-helix	trans	-59.6	-50.2	178.4	-172.5	178.9	57.1	-140.5	-5.9	111.7	Y601 E611 I614 A615 L621 Q622 M629	Y601-R618 HydrophobicContact CD2-CB 4.33Å; Y601-R618 HydrophobicContact CE2-CB 3.68Å; Y601-R618 HydrophobicContact CE2-CG 4.05Å; E611-R618 VanDerWaalsContact CD-NH1 3.32Å; E611-R618 IonicContact OE1-CZ 3.35Å; E611-R618 IonicContact OE1-NH1 3.94Å; E611-R618 PolarHBondContact OE1-NH1 3.05Å; E611-R618 IonicContact OE1-NH2 3.8Å; E611-R618 PolarHBondContact OE1-NH2 3.11Å; E611-R618 IonicContact OE2-NH1 3.51Å; E611-R618 PolarHBondContact OE2-NH1 2.95Å; E611-R618 VanDerWaalsContact OE2-NH1 3.14Å; I614-R618 PolarHBondContact O-N 2.83Å; A615-R618 PolarHBondContact O-N 3.16Å; R618-L621 PolarHBondContact O-N 3.38Å; R618-Q622 HydrophobicContact CG-CG 4.47Å; R618-Q622 WeakPolarHBondContact O-CG 3.27Å; R618-Q622 PolarHBondContact O-N 2.84Å; R618-M629 HydrophobicContact CG-CE 4.07Å
619	N	92.5	Very high	89.7	Confident	76 Å²	76	49.4 Å²	49.4	41%	0.406	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-47.3	-176	-64.6	5	0	0	0	109.9	A615 L621 Q622 D623	A615-N619 WeakPolarHBondContact O-CB 3.48Å; A615-N619 PolarHBondContact O-N 3.44Å; A615-N619 PolarHBondContact O-OD1 2.9Å; A615-N619 VanDerWaalsContact O-OD1 3.06Å; N619-L621 PolarHBondContact O-N 2.89Å; N619-Q622 PolarHBondContact O-N 2.92Å; N619-Q622 VanDerWaalsContact O-N 3.08Å; N619-D623 VanDerWaalsContact O-CG 3.29Å; N619-D623 PolarHBondContact O-N 3.31Å
620	Y	93.1	Very high	89.8	Confident	18 Å²	18	53.3 Å²	53.3	7%	0.071	30%	0.3	C	S	.	.	H	α-helix	trans	-56.1	-48.4	174.4	175.8	-102.8	0	0	0	112.3	M564 A567 M597 P616 Q622 D623 V624 H646 L649	M564-Y620 HydrophobicContact CB-CD2 4.16Å; M564-Y620 HydrophobicContact CB-CE2 3.52Å; M564-Y620 HydrophobicContact CG-CE1 4.11Å; M564-Y620 HydrophobicContact CG-CE2 3.98Å; A567-Y620 HydrophobicContact CB-CG 4.23Å; M597-Y620 HydrophobicContact CE-CD1 3.5Å; M597-Y620 VanDerWaalsContact CE-CD1 3.5Å; M597-Y620 HydrophobicContact CE-CE1 3.91Å; M597-Y620 HydrophobicContact CE-CG 4.22Å; M597-Y620 HydrophobicContact SD-CD1 3.93Å; M597-Y620 HydrophobicContact SD-CE1 3.68Å; P616-Y620 PolarHBondContact O-N 3.28Å; Y620-Q622 PolarHBondContact O-N 3.38Å; Y620-D623 PolarHBondContact O-N 3.45Å; Y620-D623 VanDerWaalsContact O-N 3.1Å; Y620-V624 HydrophobicContact CD1-CG2 4.37Å; Y620-V624 HydrophobicContact CE1-CG2 3.8Å; Y620-V624 HydrophobicContact CE2-CG2 4.2Å; Y620-V624 WeakPolarHBondContact O-CG2 3.43Å; Y620-V624 PolarHBondContact O-N 2.72Å; Y620-V624 VanDerWaalsContact O-N 3.12Å; Y620-H646 AromaticContact CE1-CE1 3.82Å; Y620-H646 AromaticContact CE1-ND1 3.65Å; Y620-H646 AromaticContact CZ-CE1 4Å; Y620-H646 AromaticContact CZ-ND1 3.67Å; Y620-H646 PolarHBondContact OH-CE1 2.85Å; Y620-H646 PolarHBondContact OH-ND1 3.37Å; Y620-L649 HydrophobicContact CE2-CD1 4.33Å; Y620-L649 WeakPolarHBondContact OH-CD1 3.35Å
621	L	92.8	Very high	90	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.3	-22.8	178.9	-71.1	171.8	0	0	0	113.4	L594 Y601 L617 R618 N619 F627 M629 V632	L594-L621 HydrophobicContact CD1-CD2 3.76Å; Y601-L621 HydrophobicContact CD1-CD1 4.22Å; Y601-L621 HydrophobicContact CG-CD1 3.97Å; L617-L621 WeakPolarHBondContact O-CB 3.28Å; L617-L621 VanDerWaalsContact O-CG 3.31Å; L617-L621 WeakPolarHBondContact O-CG 3.19Å; L617-L621 PolarHBondContact O-N 2.74Å; R618-L621 PolarHBondContact O-N 3.38Å; N619-L621 PolarHBondContact O-N 2.89Å; L621-F627 HydrophobicContact CB-CD1 4.27Å; L621-F627 HydrophobicContact CB-CE1 4.13Å; L621-F627 HydrophobicContact CD2-CE1 4.18Å; L621-F627 HydrophobicContact CD2-CZ 4.14Å; L621-F627 WeakPolarHBondContact O-CD1 3.27Å; L621-M629 HydrophobicContact CB-CE 3.58Å; L621-M629 HydrophobicContact CD1-CE 4.47Å; L621-V632 HydrophobicContact CD1-CG2 4.48Å
622	Q	91.7	Very high	90.2	Very high	107 Å²	107	49 Å²	49	50%	0.5	28%	0.276	S	S	.	.	H	α-helix	trans	-80.3	-30.1	171.2	-72.7	176.8	-47.6	0	0	112.7	R618 N619 Y620 M629	R618-Q622 HydrophobicContact CG-CG 4.47Å; R618-Q622 WeakPolarHBondContact O-CG 3.27Å; R618-Q622 PolarHBondContact O-N 2.84Å; N619-Q622 PolarHBondContact O-N 2.92Å; N619-Q622 VanDerWaalsContact O-N 3.08Å; Y620-Q622 PolarHBondContact O-N 3.38Å; Q622-M629 HydrophobicContact CG-CE 3.85Å
623	D	90.5	Very high	90.3	Very high	130 Å²	130	48.5 Å²	48.5	70%	0.695	27%	0.269	S	S	*	.	H	α-helix	trans	-81.9	-14.4	179.3	-67.1	-28.1	0	0	0	113.2	N619 Y620 P625	N619-D623 VanDerWaalsContact O-CG 3.29Å; N619-D623 PolarHBondContact O-N 3.31Å; Y620-D623 PolarHBondContact O-N 3.45Å; Y620-D623 VanDerWaalsContact O-N 3.1Å; D623-P625 WeakPolarHBondContact O-CD 3.13Å
624	V	89.8	Confident	90.5	Very high	8 Å²	8	51.7 Å²	51.7	5%	0.048	29%	0.288	C	S	.	.	S	Bend	trans	-67.5	119.2	173.5	173.3	0	0	0	0	110.2	Y620 G626 F627 P642	Y620-V624 HydrophobicContact CD1-CG2 4.37Å; Y620-V624 HydrophobicContact CE1-CG2 3.8Å; Y620-V624 HydrophobicContact CE2-CG2 4.2Å; Y620-V624 WeakPolarHBondContact O-CG2 3.43Å; Y620-V624 PolarHBondContact O-N 2.72Å; Y620-V624 VanDerWaalsContact O-N 3.12Å; V624-G626 PolarHBondContact O-N 3.17Å; V624-F627 HydrophobicContact CB-CB 4.04Å; V624-F627 HydrophobicContact CG1-CB 4.07Å; V624-F627 WeakPolarHBondContact O-CB 3.12Å; V624-F627 PolarHBondContact O-N 3.21Å; V624-F627 VanDerWaalsContact O-N 3.15Å; V624-P642 HydrophobicContact CG1-CB 3.81Å
625	P	87.3	Confident	90.3	Very high	59 Å²	59	53.7 Å²	53.7	38%	0.383	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	122.5	-175.3	-25	34.3	0	0	0	113.2	D623 Q645	D623-P625 WeakPolarHBondContact O-CD 3.13Å; P625-Q645 HydrophobicContact CB-CG 4.24Å; P625-Q645 HydrophobicContact CG-CG 4.28Å
626	G	85.6	Confident	90.1	Very high	59 Å²	59	58.3 Å²	58.3	61%	0.608	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	6.5	177.9	0	0	0	0	0	115.7	V624 P642	V624-G626 PolarHBondContact O-N 3.17Å; G626-P642 VanDerWaalsContact C-CG 3.41Å; G626-P642 WeakPolarHBondContact O-CG 3.26Å
627	F	91.3	Very high	89.9	Confident	19 Å²	19	58.9 Å²	58.9	8%	0.083	34%	0.34	C	S	.	.			trans	-83	115.9	178.7	-167.7	-92.1	0	0	0	111.4	L594 L621 V624 M629 V632 W638 P642	L594-F627 HydrophobicContact CD1-CD2 4.31Å; L594-F627 HydrophobicContact CD1-CE2 4.14Å; L594-F627 HydrophobicContact CD2-CD2 4.19Å; L594-F627 HydrophobicContact CD2-CE2 4.19Å; L594-F627 HydrophobicContact CG-CE2 4.25Å; L621-F627 HydrophobicContact CB-CD1 4.27Å; L621-F627 HydrophobicContact CB-CE1 4.13Å; L621-F627 HydrophobicContact CD2-CE1 4.18Å; L621-F627 HydrophobicContact CD2-CZ 4.14Å; L621-F627 WeakPolarHBondContact O-CD1 3.27Å; V624-F627 HydrophobicContact CB-CB 4.04Å; V624-F627 HydrophobicContact CG1-CB 4.07Å; V624-F627 WeakPolarHBondContact O-CB 3.12Å; V624-F627 PolarHBondContact O-N 3.21Å; V624-F627 VanDerWaalsContact O-N 3.15Å; F627-M629 PolarHBondContact O-N 2.97Å; F627-V632 HydrophobicContact CE1-CB 4.3Å; F627-V632 HydrophobicContact CE1-CG2 4.06Å; F627-V632 HydrophobicContact CZ-CB 4.45Å; F627-V632 HydrophobicContact CZ-CG2 4.06Å; F627-W638 AromaticContact CE2-CD2 3.79Å; F627-W638 HydrophobicContact CE2-CD2 3.79Å; F627-W638 AromaticContact CE2-CE2 3.7Å; F627-W638 AromaticContact CE2-CE3 3.99Å; F627-W638 HydrophobicContact CE2-CE3 3.99Å; F627-W638 HydrophobicContact CE2-CG 4.41Å; F627-W638 HydrophobicContact CE2-CH2 4.09Å; F627-W638 AromaticContact CE2-CZ2 3.88Å; F627-W638 HydrophobicContact CE2-CZ2 3.88Å; F627-W638 HydrophobicContact CE2-CZ3 4.13Å; F627-W638 HydrophobicContact CZ-CD2 4.45Å; F627-W638 AromaticContact CZ-CE2 3.9Å; F627-W638 HydrophobicContact CZ-CH2 4.3Å; F627-W638 AromaticContact CZ-CZ2 3.83Å; F627-W638 HydrophobicContact CZ-CZ2 3.83Å; F627-P642 HydrophobicContact CB-CB 4.21Å; F627-P642 HydrophobicContact CB-CG 4.05Å; F627-P642 HydrophobicContact CD2-CB 3.92Å; F627-P642 HydrophobicContact CD2-CG 4.3Å
628	D	89.9	Confident	89.7	Confident	81 Å²	81	59.7 Å²	59.7	43%	0.433	34%	0.344	S	S	.	.			trans	-87.7	107.4	176.4	-171.1	-20	0	0	0	110.7	S630 L631	D628-S630 PolarHBondContact O-N 2.97Å; D628-S630 VanDerWaalsContact O-N 3.16Å; D628-S630 VanDerWaalsContact OD1-CB 3.25Å; D628-S630 WeakPolarHBondContact OD1-CB 3.49Å; D628-S630 PolarHBondContact OD1-N 2.88Å; D628-S630 PolarHBondContact OD1-OG 3.21Å; D628-S630 PolarHBondContact OD2-OG 2.71Å; D628-L631 HydrophobicContact CB-CB 4.45Å; D628-L631 HydrophobicContact CB-CD1 4.12Å; D628-L631 HydrophobicContact CB-CG 4.17Å; D628-L631 PolarHBondContact O-N 2.87Å
629	M	90.1	Very high	89.4	Confident	40 Å²	40	61 Å²	61	20%	0.197	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-59.5	-22.6	177.6	-175.8	57.9	71.1	0	0	113.4	Y601 R618 L621 Q622 F627 L631 V632	Y601-M629 HydrophobicContact CD1-SD 4.35Å; Y601-M629 HydrophobicContact CE1-CE 4.36Å; Y601-M629 HydrophobicContact CE1-SD 3.51Å; Y601-M629 VanDerWaalsContact CE1-SD 3.51Å; R618-M629 HydrophobicContact CG-CE 4.07Å; L621-M629 HydrophobicContact CB-CE 3.58Å; L621-M629 HydrophobicContact CD1-CE 4.47Å; Q622-M629 HydrophobicContact CG-CE 3.85Å; F627-M629 PolarHBondContact O-N 2.97Å; M629-L631 VanDerWaalsContact C-N 3.26Å; M629-L631 PolarHBondContact O-N 2.81Å; M629-V632 WeakPolarHBondContact O-CB 3.46Å; M629-V632 VanDerWaalsContact O-CG1 3.24Å; M629-V632 WeakPolarHBondContact O-CG1 3.46Å; M629-V632 PolarHBondContact O-N 3.28Å; M629-V632 HydrophobicContact SD-CB 4.05Å; M629-V632 HydrophobicContact SD-CG1 4.14Å; M629-V632 HydrophobicContact SD-CG2 4.16Å
630	S	88	Confident	89.3	Confident	94 Å²	94	62.5 Å²	62.5	66%	0.657	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-69.9	-24.1	173.9	75	0	0	0	0	112.9	D628	D628-S630 PolarHBondContact O-N 2.97Å; D628-S630 VanDerWaalsContact O-N 3.16Å; D628-S630 VanDerWaalsContact OD1-CB 3.25Å; D628-S630 WeakPolarHBondContact OD1-CB 3.49Å; D628-S630 PolarHBondContact OD1-N 2.88Å; D628-S630 PolarHBondContact OD1-OG 3.21Å; D628-S630 PolarHBondContact OD2-OG 2.71Å
631	L	89.7	Confident	89.2	Confident	58 Å²	58	65.5 Å²	65.5	30%	0.304	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-97.4	7.2	179.6	-56.9	180	0	0	0	113.1	D628 M629 R633 T634 A637 W638	D628-L631 HydrophobicContact CB-CB 4.45Å; D628-L631 HydrophobicContact CB-CD1 4.12Å; D628-L631 HydrophobicContact CB-CG 4.17Å; D628-L631 PolarHBondContact O-N 2.87Å; M629-L631 VanDerWaalsContact C-N 3.26Å; M629-L631 PolarHBondContact O-N 2.81Å; L631-R633 PolarHBondContact O-N 2.86Å; L631-T634 CarbonylContact O-C 3.46Å; L631-T634 PolarHBondContact O-N 3.2Å; L631-A637 HydrophobicContact CD1-CB 4.1Å; L631-A637 HydrophobicContact CD2-CB 4.35Å; L631-W638 PolarHBondContact O-NE1 3.36Å
632	V	90	Very high	89.1	Confident	14 Å²	14	65.6 Å²	65.6	9%	0.085	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.6	-172.7	70.2	0	0	0	0	114.7	A598 Y601 L621 F627 M629 T634	A598-V632 HydrophobicContact CB-CG2 4.2Å; Y601-V632 HydrophobicContact CD1-CG1 4.38Å; Y601-V632 HydrophobicContact CD1-CG2 3.71Å; Y601-V632 HydrophobicContact CE1-CG1 4.05Å; Y601-V632 HydrophobicContact CE1-CG2 4.06Å; L621-V632 HydrophobicContact CD1-CG2 4.48Å; F627-V632 HydrophobicContact CE1-CB 4.3Å; F627-V632 HydrophobicContact CE1-CG2 4.06Å; F627-V632 HydrophobicContact CZ-CB 4.45Å; F627-V632 HydrophobicContact CZ-CG2 4.06Å; M629-V632 WeakPolarHBondContact O-CB 3.46Å; M629-V632 VanDerWaalsContact O-CG1 3.24Å; M629-V632 WeakPolarHBondContact O-CG1 3.46Å; M629-V632 PolarHBondContact O-N 3.28Å; M629-V632 HydrophobicContact SD-CB 4.05Å; M629-V632 HydrophobicContact SD-CG1 4.14Å; M629-V632 HydrophobicContact SD-CG2 4.16Å; V632-T634 VanDerWaalsContact C-N 3.35Å
633	R	88.3	Confident	89	Confident	130 Å²	130	63.5 Å²	63.5	49%	0.491	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-0.5	175.1	-69.6	-177.9	-177.5	-90.2	3	114.2	D606 L631	D606-R633 VanDerWaalsContact CG-NH1 3.26Å; D606-R633 IonicContact OD1-CZ 3.48Å; D606-R633 IonicContact OD1-NH1 2.68Å; D606-R633 PolarHBondContact OD1-NH1 3.45Å; D606-R633 IonicContact OD1-NH2 3.26Å; D606-R633 PolarHBondContact OD1-NH2 3.45Å; D606-R633 IonicContact OD2-CZ 3.22Å; D606-R633 IonicContact OD2-NH1 3.17Å; D606-R633 PolarHBondContact OD2-NH1 3.38Å; D606-R633 IonicContact OD2-NH2 2.66Å; L631-R633 PolarHBondContact O-N 2.86Å
634	T	89.6	Confident	89	Confident	67 Å²	67	62.3 Å²	62.3	41%	0.411	35%	0.354	S	S	.	.			trans	-133.5	75.6	-170.9	-48	0	0	0	0	111.2	L631 V632 S636 A637	L631-T634 CarbonylContact O-C 3.46Å; L631-T634 PolarHBondContact O-N 3.2Å; V632-T634 VanDerWaalsContact C-N 3.35Å; T634-S636 PolarHBondContact O-N 3.46Å; T634-S636 VanDerWaalsContact O-N 3.08Å; T634-A637 HydrophobicContact CG2-CB 3.92Å; T634-A637 WeakPolarHBondContact O-CB 2.96Å; T634-A637 PolarHBondContact O-N 3.08Å
635	P	85.8	Confident	88.9	Confident	51 Å²	51	63.6 Å²	63.6	33%	0.331	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-58.7	-25.1	-175.3	-26.3	35.8	0	0	0	115.5	E595 A637 W638 R643	E595-P635 HydrophobicContact CG-CB 4.42Å; P635-A637 PolarHBondContact O-N 3.14Å; P635-W638 HydrophobicContact CB-CD2 4.31Å; P635-W638 HydrophobicContact CB-CE3 4.29Å; P635-W638 HydrophobicContact CB-CH2 4.05Å; P635-W638 HydrophobicContact CB-CZ2 4.08Å; P635-W638 HydrophobicContact CB-CZ3 4.17Å; P635-W638 HydrophobicContact CG-CH2 4.02Å; P635-W638 HydrophobicContact CG-CZ2 3.91Å; P635-W638 PolarHBondContact O-N 2.92Å; P635-R643 PolarHBondContact O-NH2 3.42Å
636	S	87.7	Confident	89.1	Confident	117 Å²	117	61 Å²	61	82%	0.818	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-69.9	-13.2	174.5	49.1	0	0	0	0	114.4	T634	T634-S636 PolarHBondContact O-N 3.46Å; T634-S636 VanDerWaalsContact O-N 3.08Å
637	A	87.9	Confident	89.1	Confident	48 Å²	48	60.8 Å²	60.8	40%	0.397	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-98.5	-4.9	177.4	0	0	0	0	0	113.4	L631 T634 P635	L631-A637 HydrophobicContact CD1-CB 4.1Å; L631-A637 HydrophobicContact CD2-CB 4.35Å; T634-A637 HydrophobicContact CG2-CB 3.92Å; T634-A637 WeakPolarHBondContact O-CB 2.96Å; T634-A637 PolarHBondContact O-N 3.08Å; P635-A637 PolarHBondContact O-N 3.14Å
638	W	89.1	Confident	88.9	Confident	19 Å²	19	66.8 Å²	66.8	7%	0.072	36%	0.357	C	S	.	.			trans	-75.9	141.3	179.2	-56	-12	0	0	0	111.5	L594 E595 A598 F627 L631 P635 R643	L594-W638 HydrophobicContact CD2-CE3 4.18Å; L594-W638 HydrophobicContact CD2-CZ3 4.14Å; L594-W638 HydrophobicContact CG-CE3 4.48Å; L594-W638 HydrophobicContact CG-CZ3 3.96Å; E595-W638 HydrophobicContact CG-CH2 4.28Å; E595-W638 HydrophobicContact CG-CZ3 3.82Å; A598-W638 HydrophobicContact CB-CH2 3.49Å; A598-W638 VanDerWaalsContact CB-CH2 3.49Å; A598-W638 HydrophobicContact CB-CZ2 3.83Å; F627-W638 AromaticContact CE2-CD2 3.79Å; F627-W638 HydrophobicContact CE2-CD2 3.79Å; F627-W638 AromaticContact CE2-CE2 3.7Å; F627-W638 AromaticContact CE2-CE3 3.99Å; F627-W638 HydrophobicContact CE2-CE3 3.99Å; F627-W638 HydrophobicContact CE2-CG 4.41Å; F627-W638 HydrophobicContact CE2-CH2 4.09Å; F627-W638 AromaticContact CE2-CZ2 3.88Å; F627-W638 HydrophobicContact CE2-CZ2 3.88Å; F627-W638 HydrophobicContact CE2-CZ3 4.13Å; F627-W638 HydrophobicContact CZ-CD2 4.45Å; F627-W638 AromaticContact CZ-CE2 3.9Å; F627-W638 HydrophobicContact CZ-CH2 4.3Å; F627-W638 AromaticContact CZ-CZ2 3.83Å; F627-W638 HydrophobicContact CZ-CZ2 3.83Å; L631-W638 PolarHBondContact O-NE1 3.36Å; P635-W638 HydrophobicContact CB-CD2 4.31Å; P635-W638 HydrophobicContact CB-CE3 4.29Å; P635-W638 HydrophobicContact CB-CH2 4.05Å; P635-W638 HydrophobicContact CB-CZ2 4.08Å; P635-W638 HydrophobicContact CB-CZ3 4.17Å; P635-W638 HydrophobicContact CG-CH2 4.02Å; P635-W638 HydrophobicContact CG-CZ2 3.91Å; P635-W638 PolarHBondContact O-N 2.92Å; W638-R643 PolarHBondContact O-NH1 3.47Å
639	T	87.5	Confident	88.7	Confident	85 Å²	85	63.4 Å²	63.4	52%	0.521	34%	0.339	S	S	.	.			trans	-69.1	162.5	169.5	66.7	0	0	0	0	111.1	E641 P642	T639-E641 VanDerWaalsContact C-N 3.26Å; T639-E641 PolarHBondContact O-N 3.21Å; T639-P642 WeakPolarHBondContact O-CD 3.36Å; T639-P642 WeakPolarHBondContact OG1-CD 3.36Å
640	E	89.4	Confident	88.5	Confident	109 Å²	109	62.6 Å²	62.6	51%	0.509	34%	0.338	S	S	.	.	H	α-helix	trans	-74.1	-12.6	179.3	-73.7	-62.3	100.6	0	0	114.2	R643 K644	E640-R643 PolarHBondContact O-N 3.13Å; E640-R643 WeakPolarHBondContact OE1-CD 3.31Å; E640-R643 IonicContact OE1-CZ 3.37Å; E640-R643 IonicContact OE1-NE 2.72Å; E640-R643 IonicContact OE1-NH1 3.82Å; E640-R643 PolarHBondContact OE1-NH1 2.8Å; E640-K644 WeakPolarHBondContact O-CG 3.34Å; E640-K644 PolarHBondContact O-N 3.18Å
641	E	90.7	Very high	88.2	Confident	81 Å²	81	59.8 Å²	59.8	38%	0.379	32%	0.324	S	S	.	.	H	α-helix	trans	-71.9	-48	-174.6	-166.1	57.2	-150.3	0	0	112.8	T639 R643 K644 Q645	T639-E641 VanDerWaalsContact C-N 3.26Å; T639-E641 PolarHBondContact O-N 3.21Å; E641-R643 PolarHBondContact O-N 2.75Å; E641-K644 PolarHBondContact O-N 3.4Å; E641-K644 VanDerWaalsContact O-N 3.11Å; E641-Q645 HydrophobicContact CG-CG 4.27Å; E641-Q645 VanDerWaalsContact O-CG 3.27Å; E641-Q645 WeakPolarHBondContact O-CG 3.47Å; E641-Q645 PolarHBondContact O-N 3.44Å; E641-Q645 PolarHBondContact OE1-NE2 2.88Å
642	P	90.5	Very high	87.7	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-52.2	-39.3	170.1	-30.9	37.3	0	0	0	114.2	L594 V624 G626 F627 T639 H646	L594-P642 HydrophobicContact CD2-CB 3.82Å; V624-P642 HydrophobicContact CG1-CB 3.81Å; G626-P642 VanDerWaalsContact C-CG 3.41Å; G626-P642 WeakPolarHBondContact O-CG 3.26Å; F627-P642 HydrophobicContact CB-CB 4.21Å; F627-P642 HydrophobicContact CB-CG 4.05Å; F627-P642 HydrophobicContact CD2-CB 3.92Å; F627-P642 HydrophobicContact CD2-CG 4.3Å; T639-P642 WeakPolarHBondContact O-CD 3.36Å; T639-P642 WeakPolarHBondContact OG1-CD 3.36Å; P642-H646 WeakPolarHBondContact O-CB 3.46Å; P642-H646 PolarHBondContact O-N 2.97Å
643	R	90.9	Very high	87.2	Confident	63 Å²	63	59.2 Å²	59.2	24%	0.238	32%	0.318	C	S	.	.	H	α-helix	trans	-62.7	-46.2	177.6	-69.3	-169.6	175.9	93	16.1	111.6	L594 E595 P635 W638 E640 E641 A647	L594-R643 HydrophobicContact CD2-CG 4.32Å; E595-R643 IonicContact OE1-CZ 3.7Å; E595-R643 IonicContact OE1-NE 3.76Å; E595-R643 PolarHBondContact OE1-NE 2.84Å; E595-R643 IonicContact OE1-NH2 2.92Å; E595-R643 PolarHBondContact OE1-NH2 2.97Å; P635-R643 PolarHBondContact O-NH2 3.42Å; W638-R643 PolarHBondContact O-NH1 3.47Å; E640-R643 PolarHBondContact O-N 3.13Å; E640-R643 WeakPolarHBondContact OE1-CD 3.31Å; E640-R643 IonicContact OE1-CZ 3.37Å; E640-R643 IonicContact OE1-NE 2.72Å; E640-R643 IonicContact OE1-NH1 3.82Å; E640-R643 PolarHBondContact OE1-NH1 2.8Å; E641-R643 PolarHBondContact O-N 2.75Å; R643-A647 WeakPolarHBondContact O-CB 3.22Å; R643-A647 PolarHBondContact O-N 3.32Å
644	K	89.7	Confident	86.6	Confident	105 Å²	105	56 Å²	56	46%	0.457	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-48.7	177	-67.4	167	-172.2	170.9	0	111.7	E640 E641 H646 A647 Y648	E640-K644 WeakPolarHBondContact O-CG 3.34Å; E640-K644 PolarHBondContact O-N 3.18Å; E641-K644 PolarHBondContact O-N 3.4Å; E641-K644 VanDerWaalsContact O-N 3.11Å; K644-H646 VanDerWaalsContact C-N 3.31Å; K644-H646 PolarHBondContact O-N 2.88Å; K644-A647 PolarHBondContact O-N 3.49Å; K644-Y648 WeakPolarHBondContact O-CD2 3.29Å; K644-Y648 PolarHBondContact O-N 3.28Å; K644-Y648 VanDerWaalsContact O-N 3.08Å
645	Q	88.2	Confident	85.8	Confident	36 Å²	36	59.5 Å²	59.5	17%	0.168	33%	0.327	C	S	.	.	H	α-helix	trans	-58.1	-44.4	179.4	-66.2	-68.9	-35.1	0	0	111.3	P625 E641	P625-Q645 HydrophobicContact CB-CG 4.24Å; P625-Q645 HydrophobicContact CG-CG 4.28Å; E641-Q645 HydrophobicContact CG-CG 4.27Å; E641-Q645 VanDerWaalsContact O-CG 3.27Å; E641-Q645 WeakPolarHBondContact O-CG 3.47Å; E641-Q645 PolarHBondContact O-N 3.44Å; E641-Q645 PolarHBondContact OE1-NE2 2.88Å
646	H	90.5	Very high	85.5	Confident	5 Å²	5	57.4 Å²	57.4	2%	0.023	31%	0.314	C	S	.	.	H	α-helix	trans	-68.2	-41	175.1	-170.1	100.5	0	0	0	112.4	M592 L594 Y620 P642 K644 Y648 L649 S650	M592-H646 PolarHBondContact O-NE2 2.88Å; L594-H646 HydrophobicContact CB-CB 4.17Å; L594-H646 HydrophobicContact CD1-CB 4.43Å; L594-H646 HydrophobicContact CD2-CB 4.41Å; L594-H646 PolarHBondContact N-NE2 3.36Å; Y620-H646 AromaticContact CE1-CE1 3.82Å; Y620-H646 AromaticContact CE1-ND1 3.65Å; Y620-H646 AromaticContact CZ-CE1 4Å; Y620-H646 AromaticContact CZ-ND1 3.67Å; Y620-H646 PolarHBondContact OH-CE1 2.85Å; Y620-H646 PolarHBondContact OH-ND1 3.37Å; P642-H646 WeakPolarHBondContact O-CB 3.46Å; P642-H646 PolarHBondContact O-N 2.97Å; K644-H646 VanDerWaalsContact C-N 3.31Å; K644-H646 PolarHBondContact O-N 2.88Å; H646-Y648 VanDerWaalsContact C-N 3.3Å; H646-Y648 PolarHBondContact O-N 2.93Å; H646-L649 WeakPolarHBondContact O-CA 3.24Å; H646-L649 WeakPolarHBondContact O-CB 3.23Å; H646-L649 PolarHBondContact O-N 2.91Å; H646-S650 PolarHBondContact O-N 3.46Å; H646-S650 PolarHBondContact O-OG 3.41Å
647	A	87.2	Confident	85.1	Confident	53 Å²	53	52 Å²	52	44%	0.438	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-35.7	179.5	0	0	0	0	0	113	R643 K644 L649 S650 G651	R643-A647 WeakPolarHBondContact O-CB 3.22Å; R643-A647 PolarHBondContact O-N 3.32Å; K644-A647 PolarHBondContact O-N 3.49Å; A647-L649 VanDerWaalsContact C-N 3.25Å; A647-L649 PolarHBondContact O-N 3.15Å; A647-S650 PolarHBondContact O-OG 3.31Å; A647-G651 WeakPolarHBondContact O-CA 3.31Å; A647-G651 PolarHBondContact O-N 2.92Å
648	Y	85.5	Confident	84.6	Confident	145 Å²	145	52.4 Å²	52.4	57%	0.569	27%	0.273	S	S	*	.	H	α-helix	trans	-64.2	-27.9	172.9	-75.3	-63.9	0	0	0	113.3	W557 K644 H646 Q652	W557-Y648 HydrophobicContact CH2-CD2 4.34Å; W557-Y648 HydrophobicContact CZ3-CG 4.48Å; K644-Y648 WeakPolarHBondContact O-CD2 3.29Å; K644-Y648 PolarHBondContact O-N 3.28Å; K644-Y648 VanDerWaalsContact O-N 3.08Å; H646-Y648 VanDerWaalsContact C-N 3.3Å; H646-Y648 PolarHBondContact O-N 2.93Å; Y648-Q652 PolarHBondContact O-NE2 3.48Å
649	L	85.7	Confident	84.1	Confident	11 Å²	11	53.1 Å²	53.1	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-81.8	-48.3	176.9	-59.6	173.5	0	0	0	111.8	W557 R560 A561 M564 Y620 H646 A647 G651 Q652	W557-L649 HydrophobicContact CE3-CD2 3.74Å; W557-L649 HydrophobicContact CE3-CG 4.31Å; W557-L649 HydrophobicContact CZ3-CD2 4.43Å; W557-L649 WeakPolarHBondContact O-CD2 3.31Å; R560-L649 HydrophobicContact CB-CD1 4.45Å; R560-L649 HydrophobicContact CB-CD2 3.58Å; A561-L649 HydrophobicContact CB-CB 4.5Å; A561-L649 HydrophobicContact CB-CD2 4.22Å; M564-L649 HydrophobicContact CE-CB 4.5Å; M564-L649 HydrophobicContact SD-CB 3.85Å; Y620-L649 HydrophobicContact CE2-CD1 4.33Å; Y620-L649 WeakPolarHBondContact OH-CD1 3.35Å; H646-L649 WeakPolarHBondContact O-CA 3.24Å; H646-L649 WeakPolarHBondContact O-CB 3.23Å; H646-L649 PolarHBondContact O-N 2.91Å; A647-L649 VanDerWaalsContact C-N 3.25Å; A647-L649 PolarHBondContact O-N 3.15Å; L649-G651 VanDerWaalsContact C-N 3.3Å; L649-G651 PolarHBondContact O-N 2.98Å; L649-Q652 WeakPolarHBondContact O-CG 3.24Å; L649-Q652 PolarHBondContact O-N 3.32Å
650	S	86.3	Confident	83.8	Confident	23 Å²	23	49.1 Å²	49.1	16%	0.161	26%	0.255	C	S	.	.	H	α-helix	trans	-69.6	-27.5	177.5	60	0	0	0	0	113	H646 A647 Q652 F653 S654	H646-S650 PolarHBondContact O-N 3.46Å; H646-S650 PolarHBondContact O-OG 3.41Å; A647-S650 PolarHBondContact O-OG 3.31Å; S650-Q652 PolarHBondContact O-N 2.67Å; S650-F653 PolarHBondContact O-N 3.43Å; S650-F653 VanDerWaalsContact O-N 3.14Å; S650-S654 PolarHBondContact O-OG 3.28Å; S650-S654 VanDerWaalsContact O-OG 3.08Å
651	G	83	Confident	83.1	Confident	35 Å²	35	45 Å²	45	36%	0.361	24%	0.239	S	C	.	.	H	α-helix	trans	-56.1	-32.1	176.1	0	0	0	0	0	113.5	A647 L649 F653 S654	A647-G651 WeakPolarHBondContact O-CA 3.31Å; A647-G651 PolarHBondContact O-N 2.92Å; L649-G651 VanDerWaalsContact C-N 3.3Å; L649-G651 PolarHBondContact O-N 2.98Å; G651-F653 PolarHBondContact O-N 3.13Å; G651-F653 VanDerWaalsContact O-N 3.12Å; G651-S654 PolarHBondContact O-N 2.73Å; G651-S654 VanDerWaalsContact O-N 3.1Å
652	Q	78.3	Confident	82.3	Confident	58 Å²	58	46 Å²	46	27%	0.271	25%	0.245	S	C	.	.	H	α-helix	trans	-62	-20.9	179.3	-52.2	-57.4	-49	0	0	113.9	L548 Y648 L649 S650	L548-Q652 HydrophobicContact CD2-CB 3.88Å; L548-Q652 WeakPolarHBondContact CD2-O 3.39Å; Y648-Q652 PolarHBondContact O-NE2 3.48Å; L649-Q652 WeakPolarHBondContact O-CG 3.24Å; L649-Q652 PolarHBondContact O-N 3.32Å; S650-Q652 PolarHBondContact O-N 2.67Å
653	F	78.6	Confident	81.7	Confident	1 Å²	1	48.8 Å²	48.8	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-104.1	-12.4	178.6	-59.1	-83.9	0	0	0	113.1	M544 L548 A561 M564 N565 M592 S650 G651 E655 T656 F657	M544-F653 WeakPolarHBondContact O-CE1 3.24Å; L548-F653 HydrophobicContact CD1-CE1 4Å; L548-F653 HydrophobicContact CD1-CZ 3.86Å; L548-F653 HydrophobicContact CD2-CD1 3.81Å; L548-F653 HydrophobicContact CD2-CE1 3.43Å; L548-F653 VanDerWaalsContact CD2-CE1 3.43Å; L548-F653 HydrophobicContact CD2-CE2 4.24Å; L548-F653 HydrophobicContact CD2-CG 4.34Å; L548-F653 HydrophobicContact CD2-CZ 3.65Å; L548-F653 HydrophobicContact CG-CD1 4.29Å; L548-F653 HydrophobicContact CG-CE1 3.55Å; L548-F653 HydrophobicContact CG-CZ 3.9Å; A561-F653 HydrophobicContact CB-CE2 4.18Å; M564-F653 HydrophobicContact CE-CD2 4.18Å; M564-F653 HydrophobicContact CE-CE2 3.91Å; N565-F653 VanDerWaalsContact ND2-CE1 3.31Å; N565-F653 WeakPolarHBondContact ND2-CE1 3.35Å; N565-F653 WeakPolarHBondContact ND2-CZ 3.47Å; M592-F653 HydrophobicContact CE-CB 4.21Å; M592-F653 HydrophobicContact CE-CD2 3.87Å; M592-F653 HydrophobicContact CE-CE2 4.48Å; M592-F653 HydrophobicContact CE-CG 3.97Å; M592-F653 HydrophobicContact SD-CB 4.06Å; M592-F653 HydrophobicContact SD-CD2 4.1Å; M592-F653 HydrophobicContact SD-CG 4.3Å; S650-F653 PolarHBondContact O-N 3.43Å; S650-F653 VanDerWaalsContact O-N 3.14Å; G651-F653 PolarHBondContact O-N 3.13Å; G651-F653 VanDerWaalsContact O-N 3.12Å; F653-E655 VanDerWaalsContact C-N 3.31Å; F653-E655 PolarHBondContact O-N 3.02Å; F653-T656 PolarHBondContact O-N 3.13Å; F653-F657 HydrophobicContact CB-CD1 4.16Å; F653-F657 HydrophobicContact CB-CD2 4.26Å; F653-F657 HydrophobicContact CB-CE1 4.14Å; F653-F657 HydrophobicContact CB-CE2 4.25Å; F653-F657 HydrophobicContact CB-CG 4.23Å; F653-F657 HydrophobicContact CB-CZ 4.19Å; F653-F657 HydrophobicContact CD1-CE1 4.09Å; F653-F657 HydrophobicContact CD1-CZ 4.2Å; F653-F657 HydrophobicContact CG-CZ 4.42Å; F653-F657 VanDerWaalsContact O-CB 3.27Å; F653-F657 WeakPolarHBondContact O-CB 3.19Å; F653-F657 WeakPolarHBondContact O-CG 3.39Å; F653-F657 PolarHBondContact O-N 2.72Å
654	S	75.9	Confident	81.2	Confident	63 Å²	63	45.8 Å²	45.8	44%	0.441	25%	0.25	S	C	.	.	H	α-helix	trans	-68.4	-28.9	-164.8	-64.1	0	0	0	0	113.4	S650 G651 T658	S650-S654 PolarHBondContact O-OG 3.28Å; S650-S654 VanDerWaalsContact O-OG 3.08Å; G651-S654 PolarHBondContact O-N 2.73Å; G651-S654 VanDerWaalsContact O-N 3.1Å; S654-T658 VanDerWaalsContact O-CB 3.23Å; S654-T658 WeakPolarHBondContact O-CB 3.21Å; S654-T658 PolarHBondContact O-N 2.82Å; S654-T658 PolarHBondContact O-OG1 3.03Å
655	E	74.5	Confident	80.5	Confident	140 Å²	140	41.9 Å²	41.9	65%	0.654	24%	0.24	S	C	*	.	H	α-helix	trans	-70.3	-63.9	172.6	-173.8	171.7	-168.6	0	0	110.4	F653 F657 T658 T659	F653-E655 VanDerWaalsContact C-N 3.31Å; F653-E655 PolarHBondContact O-N 3.02Å; E655-F657 VanDerWaalsContact C-N 3.29Å; E655-F657 PolarHBondContact O-N 3.07Å; E655-T658 PolarHBondContact O-N 3.04Å; E655-T659 PolarHBondContact O-N 2.94Å; E655-T659 PolarHBondContact O-OG1 3.13Å
656	T	78.3	Confident	79.9	Confident	8 Å²	8	43 Å²	43	5%	0.049	25%	0.247	C	C	.	.	H	α-helix	trans	-56	-40.1	-178.1	-40.3	0	0	0	0	112.8	M547 F653 F660 A703	M547-T656 HydrophobicContact CB-CG2 4.1Å; M547-T656 PolarHBondContact O-OG1 3.09Å; F653-T656 PolarHBondContact O-N 3.13Å; T656-F660 HydrophobicContact CG2-CD1 4.07Å; T656-F660 HydrophobicContact CG2-CD2 4.29Å; T656-F660 HydrophobicContact CG2-CE1 3.69Å; T656-F660 HydrophobicContact CG2-CE2 3.94Å; T656-F660 HydrophobicContact CG2-CG 4.36Å; T656-F660 HydrophobicContact CG2-CZ 3.62Å; T656-F660 WeakPolarHBondContact O-CB 3.44Å; T656-F660 WeakPolarHBondContact O-CD1 3.29Å; T656-F660 VanDerWaalsContact O-CG 3.29Å; T656-F660 WeakPolarHBondContact O-CG 3.47Å; T656-F660 PolarHBondContact O-N 3.23Å; T656-A703 HydrophobicContact CG2-CB 4.28Å
657	F	79.4	Confident	79.7	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-70.7	-33.5	179.4	-78.5	18.4	0	0	0	112.7	M544 M547 L585 R589 M592 F653 E655 A661	M544-F657 HydrophobicContact CE-CE2 4.44Å; M544-F657 HydrophobicContact CE-CZ 3.93Å; M547-F657 HydrophobicContact SD-CD1 4.4Å; M547-F657 HydrophobicContact SD-CE1 3.73Å; L585-F657 HydrophobicContact CD1-CD1 3.92Å; L585-F657 HydrophobicContact CD1-CD2 4.14Å; L585-F657 HydrophobicContact CD1-CE1 3.85Å; L585-F657 HydrophobicContact CD1-CE2 4.07Å; L585-F657 HydrophobicContact CD1-CG 4.06Å; L585-F657 HydrophobicContact CD1-CZ 3.92Å; R589-F657 HydrophobicContact CB-CD2 4.31Å; R589-F657 HydrophobicContact CG-CD2 4.45Å; M592-F657 HydrophobicContact CE-CD2 4.5Å; M592-F657 HydrophobicContact CE-CE2 3.58Å; M592-F657 HydrophobicContact CE-CZ 3.99Å; M592-F657 HydrophobicContact SD-CD2 4.49Å; M592-F657 HydrophobicContact SD-CE2 4.1Å; F653-F657 HydrophobicContact CB-CD1 4.16Å; F653-F657 HydrophobicContact CB-CD2 4.26Å; F653-F657 HydrophobicContact CB-CE1 4.14Å; F653-F657 HydrophobicContact CB-CE2 4.25Å; F653-F657 HydrophobicContact CB-CG 4.23Å; F653-F657 HydrophobicContact CB-CZ 4.19Å; F653-F657 HydrophobicContact CD1-CE1 4.09Å; F653-F657 HydrophobicContact CD1-CZ 4.2Å; F653-F657 HydrophobicContact CG-CZ 4.42Å; F653-F657 VanDerWaalsContact O-CB 3.27Å; F653-F657 WeakPolarHBondContact O-CB 3.19Å; F653-F657 WeakPolarHBondContact O-CG 3.39Å; F653-F657 PolarHBondContact O-N 2.72Å; E655-F657 VanDerWaalsContact C-N 3.29Å; E655-F657 PolarHBondContact O-N 3.07Å; F657-A661 VanDerWaalsContact O-CB 3.23Å; F657-A661 WeakPolarHBondContact O-CB 3.25Å; F657-A661 PolarHBondContact O-N 2.83Å
658	T	77.7	Confident	79.7	Confident	56 Å²	56	41.4 Å²	41.4	34%	0.344	23%	0.23	S	C	.	.	H	α-helix	trans	-67.9	-50.1	173.6	-63.2	0	0	0	0	109.8	S654 E655 F660 A661 E662	S654-T658 VanDerWaalsContact O-CB 3.23Å; S654-T658 WeakPolarHBondContact O-CB 3.21Å; S654-T658 PolarHBondContact O-N 2.82Å; S654-T658 PolarHBondContact O-OG1 3.03Å; E655-T658 PolarHBondContact O-N 3.04Å; T658-F660 VanDerWaalsContact C-N 3.34Å; T658-F660 PolarHBondContact O-N 2.98Å; T658-A661 PolarHBondContact O-N 3.1Å; T658-E662 HydrophobicContact CG2-CG 4.38Å; T658-E662 VanDerWaalsContact O-CB 3.26Å; T658-E662 WeakPolarHBondContact O-CB 3.23Å; T658-E662 WeakPolarHBondContact O-CG 3.29Å; T658-E662 PolarHBondContact O-N 3.36Å
659	T	78.1	Confident	79.6	Confident	34 Å²	34	35.1 Å²	35.1	21%	0.209	21%	0.208	C	C	.	.	H	α-helix	trans	-56.2	-46.3	175.2	-50.4	0	0	0	0	111.8	E655 T663 F664 T700	E655-T659 PolarHBondContact O-N 2.94Å; E655-T659 PolarHBondContact O-OG1 3.13Å; T659-T663 WeakPolarHBondContact O-CA 3.34Å; T659-T663 WeakPolarHBondContact O-CB 3.21Å; T659-T663 PolarHBondContact O-N 3Å; T659-T663 PolarHBondContact O-OG1 2.79Å; T659-F664 HydrophobicContact CG2-CE2 4.03Å; T659-F664 PolarHBondContact O-N 3.3Å; T659-T700 HydrophobicContact CG2-CG2 3.93Å
660	F	81.1	Confident	79.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.1	-39.3	-177.6	-73.8	15.3	0	0	0	112.2	M547 L585 T656 T658 F664 G665 F668 T700 A703 L704 M707	M547-F660 HydrophobicContact CE-CD2 4.08Å; M547-F660 HydrophobicContact CE-CE2 3.92Å; M547-F660 HydrophobicContact CG-CE2 4.04Å; M547-F660 HydrophobicContact SD-CD2 4.45Å; M547-F660 HydrophobicContact SD-CE2 4.27Å; L585-F660 HydrophobicContact CD2-CB 3.67Å; T656-F660 HydrophobicContact CG2-CD1 4.07Å; T656-F660 HydrophobicContact CG2-CD2 4.29Å; T656-F660 HydrophobicContact CG2-CE1 3.69Å; T656-F660 HydrophobicContact CG2-CE2 3.94Å; T656-F660 HydrophobicContact CG2-CG 4.36Å; T656-F660 HydrophobicContact CG2-CZ 3.62Å; T656-F660 WeakPolarHBondContact O-CB 3.44Å; T656-F660 WeakPolarHBondContact O-CD1 3.29Å; T656-F660 VanDerWaalsContact O-CG 3.29Å; T656-F660 WeakPolarHBondContact O-CG 3.47Å; T656-F660 PolarHBondContact O-N 3.23Å; T658-F660 VanDerWaalsContact C-N 3.34Å; T658-F660 PolarHBondContact O-N 2.98Å; F660-F664 HydrophobicContact CD1-CD2 4.06Å; F660-F664 HydrophobicContact CD1-CE2 4.43Å; F660-F664 CarbonylContact O-C 3.47Å; F660-F664 VanDerWaalsContact O-C 3.26Å; F660-F664 PolarHBondContact O-N 2.94Å; F660-G665 PolarHBondContact O-N 2.72Å; F660-F668 HydrophobicContact CB-CD2 4.02Å; F660-F668 HydrophobicContact CB-CE2 3.61Å; F660-F668 HydrophobicContact CB-CZ 4.28Å; F660-F668 HydrophobicContact CD1-CE2 4.35Å; F660-F668 HydrophobicContact CD2-CE1 4.48Å; F660-F668 AromaticContact CD2-CE2 3.78Å; F660-F668 HydrophobicContact CD2-CE2 3.78Å; F660-F668 AromaticContact CD2-CZ 3.59Å; F660-F668 HydrophobicContact CD2-CZ 3.59Å; F660-F668 HydrophobicContact CE2-CZ 4.06Å; F660-F668 AromaticContact CG-CE2 3.67Å; F660-F668 HydrophobicContact CG-CE2 3.67Å; F660-F668 AromaticContact CG-CZ 3.98Å; F660-F668 HydrophobicContact CG-CZ 3.98Å; F660-F668 WeakPolarHBondContact O-CD2 3.45Å; F660-T700 HydrophobicContact CE1-CG2 4.29Å; F660-A703 HydrophobicContact CZ-CB 4.12Å; F660-L704 HydrophobicContact CD1-CD2 4.22Å; F660-L704 HydrophobicContact CE1-CD2 3.58Å; F660-L704 HydrophobicContact CE1-CG 3.89Å; F660-L704 HydrophobicContact CE2-CD2 4.18Å; F660-L704 HydrophobicContact CZ-CD2 3.55Å; F660-L704 HydrophobicContact CZ-CG 3.94Å; F660-M707 HydrophobicContact CE2-CE 4.27Å; F660-M707 HydrophobicContact CE2-SD 4.04Å
661	A	75.5	Confident	79	Confident	22 Å²	22	40.3 Å²	40.3	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-76.9	-31.5	179	0	0	0	0	0	113.9	R512 F657 T658 G665	R512-A661 PolarHBondContact NH1-O 3.49Å; F657-A661 VanDerWaalsContact O-CB 3.23Å; F657-A661 WeakPolarHBondContact O-CB 3.25Å; F657-A661 PolarHBondContact O-N 2.83Å; T658-A661 PolarHBondContact O-N 3.1Å; A661-G665 WeakPolarHBondContact O-CA 3.35Å
662	E	74	Confident	78.9	Confident	104 Å²	104	40 Å²	40	49%	0.486	24%	0.24	S	C	.	.	H	α-helix	trans	-98.1	-48.4	-172.7	-63	-177	-172.1	0	0	112.2	R512 T658	R512-E662 WeakPolarHBondContact CD-O 3.28Å; R512-E662 PolarHBondContact NH1-O 2.84Å; T658-E662 HydrophobicContact CG2-CG 4.38Å; T658-E662 VanDerWaalsContact O-CB 3.26Å; T658-E662 WeakPolarHBondContact O-CB 3.23Å; T658-E662 WeakPolarHBondContact O-CG 3.29Å; T658-E662 PolarHBondContact O-N 3.36Å
663	T	76.5	Confident	79.3	Confident	58 Å²	58	38.2 Å²	38.2	36%	0.356	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-35.3	-179.6	-45.9	0	0	0	0	112.9	G508 T659	G508-T663 VanDerWaalsContact CA-CG2 3.44Å; T659-T663 WeakPolarHBondContact O-CA 3.34Å; T659-T663 WeakPolarHBondContact O-CB 3.21Å; T659-T663 PolarHBondContact O-N 3Å; T659-T663 PolarHBondContact O-OG1 2.79Å
664	F	80.9	Confident	79.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	-118	21.3	-178.2	-51.5	-53.8	0	0	0	113.3	F505 T659 F660 D666 V667 F668 T696 T700 L704	F505-F664 HydrophobicContact CB-CE1 4.35Å; F505-F664 HydrophobicContact CD1-CB 4.43Å; F505-F664 HydrophobicContact CD1-CD1 4.24Å; F505-F664 HydrophobicContact CD1-CG 4.14Å; F505-F664 WeakPolarHBondContact O-CE1 3.47Å; T659-F664 HydrophobicContact CG2-CE2 4.03Å; T659-F664 PolarHBondContact O-N 3.3Å; F660-F664 HydrophobicContact CD1-CD2 4.06Å; F660-F664 HydrophobicContact CD1-CE2 4.43Å; F660-F664 CarbonylContact O-C 3.47Å; F660-F664 VanDerWaalsContact O-C 3.26Å; F660-F664 PolarHBondContact O-N 2.94Å; F664-D666 PolarHBondContact O-N 3.34Å; F664-D666 VanDerWaalsContact O-N 3.13Å; F664-V667 PolarHBondContact O-N 3.28Å; F664-F668 HydrophobicContact CB-CD2 3.77Å; F664-F668 HydrophobicContact CB-CE2 3.78Å; F664-F668 HydrophobicContact CD2-CE2 4.46Å; F664-F668 WeakPolarHBondContact O-CD2 3.32Å; F664-F668 PolarHBondContact O-N 3.27Å; F664-T696 HydrophobicContact CZ-CG2 3.87Å; F664-T700 HydrophobicContact CE2-CG2 4.3Å; F664-L704 HydrophobicContact CD2-CD1 4.49Å; F664-L704 HydrophobicContact CD2-CD2 4.24Å; F664-L704 HydrophobicContact CE2-CD1 3.88Å; F664-L704 HydrophobicContact CE2-CD2 4.36Å; F664-L704 HydrophobicContact CZ-CD1 4.17Å
665	G	74.7	Confident	80.5	Confident	24 Å²	24	37 Å²	37	25%	0.247	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	4.9	-179	0	0	0	0	0	115.3	F660 A661	F660-G665 PolarHBondContact O-N 2.72Å; A661-G665 WeakPolarHBondContact O-CA 3.35Å
666	D	77	Confident	81.1	Confident	60 Å²	60	32.6 Å²	32.6	32%	0.321	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-21.3	164.6	67	-43.7	0	0	0	112.4	N507 F664	N507-D666 PolarHBondContact ND2-OD2 3.43Å; F664-D666 PolarHBondContact O-N 3.34Å; F664-D666 VanDerWaalsContact O-N 3.13Å
667	V	86.1	Confident	81.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-47.3	173	-176.1	0	0	0	0	110.8	I503 F505 T528 W529 F664 A669	I503-V667 HydrophobicContact CG2-CG1 3.89Å; F505-V667 HydrophobicContact CD1-CG1 4.28Å; F505-V667 HydrophobicContact CD1-CG2 4.44Å; F505-V667 HydrophobicContact CE1-CB 4.3Å; F505-V667 HydrophobicContact CE1-CG1 3.72Å; F505-V667 HydrophobicContact CZ-CG1 4.27Å; T528-V667 CarbonylContact C-O 3.57Å; T528-V667 VanDerWaalsContact CA-O 3.28Å; T528-V667 WeakPolarHBondContact CA-O 3.32Å; W529-V667 PolarHBondContact N-O 3.4Å; F664-V667 PolarHBondContact O-N 3.28Å; V667-A669 PolarHBondContact O-N 3.5Å
668	F	87.7	Confident	82	Confident	23 Å²	23	37.1 Å²	37.1	10%	0.101	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-77.3	106.7	-176.8	-71.8	-69.6	0	0	0	112.4	F505 W529 F660 F664 L704 M707	F505-F668 HydrophobicContact CE1-CE2 4.23Å; F505-F668 HydrophobicContact CE1-CZ 4.14Å; W529-F668 HydrophobicContact CE3-CE1 4.45Å; W529-F668 WeakPolarHBondContact O-CA 3.44Å; F660-F668 HydrophobicContact CB-CD2 4.02Å; F660-F668 HydrophobicContact CB-CE2 3.61Å; F660-F668 HydrophobicContact CB-CZ 4.28Å; F660-F668 HydrophobicContact CD1-CE2 4.35Å; F660-F668 HydrophobicContact CD2-CE1 4.48Å; F660-F668 AromaticContact CD2-CE2 3.78Å; F660-F668 HydrophobicContact CD2-CE2 3.78Å; F660-F668 AromaticContact CD2-CZ 3.59Å; F660-F668 HydrophobicContact CD2-CZ 3.59Å; F660-F668 HydrophobicContact CE2-CZ 4.06Å; F660-F668 AromaticContact CG-CE2 3.67Å; F660-F668 HydrophobicContact CG-CE2 3.67Å; F660-F668 AromaticContact CG-CZ 3.98Å; F660-F668 HydrophobicContact CG-CZ 3.98Å; F660-F668 WeakPolarHBondContact O-CD2 3.45Å; F664-F668 HydrophobicContact CB-CD2 3.77Å; F664-F668 HydrophobicContact CB-CE2 3.78Å; F664-F668 HydrophobicContact CD2-CE2 4.46Å; F664-F668 WeakPolarHBondContact O-CD2 3.32Å; F664-F668 PolarHBondContact O-N 3.27Å; F668-L704 HydrophobicContact CZ-CD2 4.29Å; F668-M707 HydrophobicContact CE1-CE 3.8Å; F668-M707 HydrophobicContact CE1-SD 3.76Å; F668-M707 HydrophobicContact CZ-CE 3.62Å; F668-M707 HydrophobicContact CZ-SD 3.92Å
669	A	82.8	Confident	82.4	Confident	13 Å²	13	37.2 Å²	37.2	11%	0.107	22%	0.221	C	C	.	.			trans	-71.4	146.8	-176.8	0	0	0	0	0	113.3	W529 N530 V667	W529-A669 PolarHBondContact O-N 3.01Å; N530-A669 HydrophobicContact CB-CB 4.15Å; V667-A669 PolarHBondContact O-N 3.5Å
670	A	78.6	Confident	83	Confident	81 Å²	81	35.6 Å²	35.6	67%	0.669	21%	0.211	S	C	*	.	S	Bend	trans	-85.1	-24.5	172.8	0	0	0	0	0	113	S584	S584-A670 WeakPolarHBondContact CB-O 3.12Å; S584-A670 PolarHBondContact OG-O 2.78Å
671	D	80.6	Confident	83.3	Confident	62 Å²	62	36.4 Å²	36.4	33%	0.332	22%	0.215	S	C	.	.	S	Bend	trans	-100.4	-138	175.6	69.5	-13.4	0	0	0	110.5	N530 T582 G673 S904	N530-D671 PolarHBondContact ND2-O 3.29Å; T582-D671 VanDerWaalsContact CG2-O 3.25Å; T582-D671 WeakPolarHBondContact CG2-O 3.33Å; D671-G673 PolarHBondContact OD1-N 3.39Å; D671-S904 WeakPolarHBondContact OD2-CB 3.17Å; D671-S904 PolarHBondContact OD2-OG 2.78Å
672	A	80.9	Confident	83.7	Confident	30 Å²	30	37 Å²	37	25%	0.248	21%	0.214	C	C	.	.	S	Bend	trans	-73.9	-26.5	176.1	0	0	0	0	0	113.7	F534	F534-A672 HydrophobicContact CE2-CB 4.41Å; F534-A672 HydrophobicContact CZ-CB 4.07Å
673	G	86.1	Confident	84.3	Confident	19 Å²	19	35 Å²	35	20%	0.196	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	77.4	166.9	-164.2	0	0	0	0	0	113.6	T528 D671	T528-G673 WeakPolarHBondContact OG1-CA 3.31Å; D671-G673 PolarHBondContact OD1-N 3.39Å
674	D	88.9	Confident	84.9	Confident	36 Å²	36	34 Å²	34	19%	0.193	20%	0.204	C	C	.	.	S	Bend	trans	-68.7	-42.1	173.6	-64.4	-69	0	0	0	111.4	N527 T528 Y902	N527-D674 HydrophobicContact CB-CB 4.12Å; T528-D674 WeakPolarHBondContact CB-OD2 3.4Å; T528-D674 PolarHBondContact N-OD2 3.33Å; T528-D674 WeakPolarHBondContact O-CB 3.17Å; T528-D674 PolarHBondContact O-N 2.92Å; T528-D674 VanDerWaalsContact OG1-CG 3.28Å; T528-D674 PolarHBondContact OG1-N 3.09Å; T528-D674 PolarHBondContact OG1-OD2 2.89Å; D674-Y902 HydrophobicContact CB-CD2 3.65Å; D674-Y902 HydrophobicContact CB-CE2 4.28Å; D674-Y902 HydrophobicContact CB-CG 4.42Å; D674-Y902 WeakPolarHBondContact OD1-CB 3.17Å; D674-Y902 WeakPolarHBondContact OD1-CD2 3.39Å
675	I	90.4	Very high	85.5	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-101.7	122.5	-171.3	-63.4	169.4	0	0	0	111	E501 I503 N527 T528 I677 L687	E501-I675 HydrophobicContact CB-CD1 3.82Å; E501-I675 HydrophobicContact CB-CG1 4.01Å; E501-I675 HydrophobicContact CG-CD1 4.49Å; E501-I675 HydrophobicContact CG-CG1 4.13Å; I503-I675 HydrophobicContact CD1-CD1 4.17Å; I503-I675 HydrophobicContact CG1-CD1 3.53Å; N527-I675 HydrophobicContact CB-CD1 3.58Å; N527-I675 HydrophobicContact CB-CG1 4.04Å; T528-I675 PolarHBondContact O-N 2.82Å; I675-I677 HydrophobicContact CG2-CG1 4.38Å; I675-L687 HydrophobicContact CD1-CD1 4.05Å; I675-L687 HydrophobicContact CG2-CD1 4.23Å
676	D	88.2	Confident	86.4	Confident	49 Å²	49	35 Å²	35	26%	0.262	20%	0.2	S	C	.	.			trans	-105.4	114.7	153	-178.6	1.3	0	0	0	107.9	F534 R678 D679 S680	F534-D676 HydrophobicContact CD2-CB 4.09Å; F534-D676 WeakPolarHBondContact CD2-OD2 3.33Å; F534-D676 HydrophobicContact CE2-CB 4.1Å; D676-R678 CarbonylContact O-C 3.54Å; D676-R678 PolarHBondContact O-N 3.5Å; D676-R678 VanDerWaalsContact OD1-CB 3.25Å; D676-R678 WeakPolarHBondContact OD1-CB 3.11Å; D676-R678 PolarHBondContact OD1-N 3.16Å; D676-D679 HydrophobicContact CB-CB 4.38Å; D676-D679 WeakPolarHBondContact O-CA 3.3Å; D676-D679 WeakPolarHBondContact O-CB 3.47Å; D676-D679 PolarHBondContact O-N 3.43Å; D676-S680 PolarHBondContact O-N 3.39Å; D676-S680 PolarHBondContact O-OG 3.15Å
677	I	89.6	Confident	87.3	Confident	5 Å²	5	32.1 Å²	32.1	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-53.1	-26	178.2	-62.7	171.3	0	0	0	111.1	W529 I675 I681 L687 F708 Q711 L715	W529-I677 HydrophobicContact CH2-CD1 4.45Å; W529-I677 HydrophobicContact CZ2-CD1 3.52Å; I675-I677 HydrophobicContact CG2-CG1 4.38Å; I677-I681 HydrophobicContact CG2-CD1 3.95Å; I677-I681 WeakPolarHBondContact O-CG1 3.26Å; I677-I681 PolarHBondContact O-N 3.43Å; I677-L687 HydrophobicContact CG1-CD2 4.27Å; I677-F708 HydrophobicContact CD1-CD2 3.87Å; I677-F708 HydrophobicContact CD1-CE2 3.57Å; I677-F708 HydrophobicContact CG1-CE2 4.26Å; I677-Q711 HydrophobicContact CD1-CB 4.23Å; I677-L715 HydrophobicContact CG2-CD2 4.39Å
678	R	86.3	Confident	87.7	Confident	102 Å²	102	32.1 Å²	32.1	39%	0.385	19%	0.185	S	C	.	.	H	α-helix	trans	-60	-52.2	170.5	-171.4	171.5	-180	-155.7	-1.6	112.8	D676 S680 I681 H682 L715 Y737	D676-R678 CarbonylContact O-C 3.54Å; D676-R678 PolarHBondContact O-N 3.5Å; D676-R678 VanDerWaalsContact OD1-CB 3.25Å; D676-R678 WeakPolarHBondContact OD1-CB 3.11Å; D676-R678 PolarHBondContact OD1-N 3.16Å; R678-S680 VanDerWaalsContact C-N 3.33Å; R678-I681 PolarHBondContact O-N 3.5Å; R678-H682 WeakPolarHBondContact CG-ND1 3.41Å; R678-H682 PolarHBondContact NE-CE1 3.1Å; R678-H682 PolarHBondContact NE-ND1 3.33Å; R678-H682 VanDerWaalsContact NE-ND1 3.16Å; R678-H682 WeakPolarHBondContact O-CB 3.33Å; R678-H682 PolarHBondContact O-N 3.02Å; R678-L715 HydrophobicContact CB-CD1 3.52Å; R678-L715 HydrophobicContact CB-CD2 4.26Å; R678-L715 HydrophobicContact CG-CD1 3.76Å; R678-Y737 PolarHBondContact NH2-OH 2.84Å; R678-Y737 VanDerWaalsContact NH2-OH 3.08Å
679	D	87	Confident	88	Confident	58 Å²	58	31 Å²	31	31%	0.31	18%	0.18	S	C	.	.	H	α-helix	trans	-66.5	-39.5	-179.9	-166.5	25.1	0	0	0	109.9	D676 I681 H682 S683 R685	D676-D679 HydrophobicContact CB-CB 4.38Å; D676-D679 WeakPolarHBondContact O-CA 3.3Å; D676-D679 WeakPolarHBondContact O-CB 3.47Å; D676-D679 PolarHBondContact O-N 3.43Å; D679-I681 VanDerWaalsContact C-N 3.27Å; D679-I681 PolarHBondContact O-N 3.05Å; D679-H682 PolarHBondContact O-N 3.3Å; D679-S683 WeakPolarHBondContact O-CA 3.4Å; D679-S683 VanDerWaalsContact O-CB 3.23Å; D679-S683 WeakPolarHBondContact O-CB 3.43Å; D679-S683 PolarHBondContact O-N 3.12Å; D679-S683 WeakPolarHBondContact OD1-CB 3.44Å; D679-S683 PolarHBondContact OD1-OG 3.17Å; D679-R685 IonicContact OD1-NH2 2.79Å; D679-R685 PolarHBondContact OD1-NH2 3.2Å; D679-R685 IonicContact OD2-CZ 3.44Å; D679-R685 IonicContact OD2-NH1 3.77Å; D679-R685 PolarHBondContact OD2-NH1 3.31Å; D679-R685 IonicContact OD2-NH2 3.26Å; D679-R685 PolarHBondContact OD2-NH2 3.49Å
680	S	90	Very high	88.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-53.9	-40.9	175.5	-42.6	0	0	0	0	113.2	E501 D676 R678 R685	E501-S680 VanDerWaalsContact OE2-CB 3.28Å; E501-S680 WeakPolarHBondContact OE2-CB 3.13Å; E501-S680 PolarHBondContact OE2-OG 3.29Å; D676-S680 PolarHBondContact O-N 3.39Å; D676-S680 PolarHBondContact O-OG 3.15Å; R678-S680 VanDerWaalsContact C-N 3.33Å; S680-R685 PolarHBondContact O-N 2.93Å
681	I	87.8	Confident	88.7	Confident	16 Å²	16	26.6 Å²	26.6	8%	0.082	14%	0.143	C	C	.	.	H	α-helix	trans	-88.6	-40.6	179.9	-62.1	172.6	0	0	0	111.7	I677 R678 D679 Q712 L715 L716 Y743 F770	I677-I681 HydrophobicContact CG2-CD1 3.95Å; I677-I681 WeakPolarHBondContact O-CG1 3.26Å; I677-I681 PolarHBondContact O-N 3.43Å; R678-I681 PolarHBondContact O-N 3.5Å; D679-I681 VanDerWaalsContact C-N 3.27Å; D679-I681 PolarHBondContact O-N 3.05Å; I681-Q712 HydrophobicContact CD1-CG 4.47Å; I681-L715 HydrophobicContact CD1-CD2 4.03Å; I681-L716 HydrophobicContact CG2-CD2 4.49Å; I681-Y743 HydrophobicContact CB-CE2 4.44Å; I681-Y743 HydrophobicContact CG1-CE1 4.18Å; I681-Y743 HydrophobicContact CG1-CE2 4.49Å; I681-Y743 HydrophobicContact CG2-CD2 4.32Å; I681-Y743 HydrophobicContact CG2-CE2 4.34Å; I681-Y743 HydrophobicContact CG2-CG 4.42Å; I681-F770 HydrophobicContact CD1-CE2 4.3Å; I681-F770 HydrophobicContact CG2-CE2 4.23Å
682	H	84.5	Confident	88.6	Confident	34 Å²	34	23.7 Å²	23.7	16%	0.157	13%	0.128	C	C	.	.	H	α-helix	trans	-78.1	-22.6	-174.2	-70.3	-171.2	0	0	0	113.6	R678 D679 D719 Y737	R678-H682 WeakPolarHBondContact CG-ND1 3.41Å; R678-H682 PolarHBondContact NE-CE1 3.1Å; R678-H682 PolarHBondContact NE-ND1 3.33Å; R678-H682 VanDerWaalsContact NE-ND1 3.16Å; R678-H682 WeakPolarHBondContact O-CB 3.33Å; R678-H682 PolarHBondContact O-N 3.02Å; D679-H682 PolarHBondContact O-N 3.3Å; H682-D719 IonicContact CD2-OD2 3.59Å; H682-D719 VanDerWaalsContact CE1-CG 3.48Å; H682-D719 IonicContact CE1-OD1 3.17Å; H682-D719 PolarHBondContact CE1-OD1 2.88Å; H682-D719 IonicContact CE1-OD2 2.67Å; H682-D719 PolarHBondContact CE1-OD2 2.94Å; H682-D719 VanDerWaalsContact CE1-OD2 3.27Å; H682-D719 VanDerWaalsContact NE2-CG 3.29Å; H682-D719 IonicContact NE2-OD1 3.53Å; H682-D719 IonicContact NE2-OD2 2.68Å; H682-D719 PolarHBondContact NE2-OD2 2.73Å; H682-Y737 HydrophobicContact CB-CD1 3.88Å; H682-Y737 HydrophobicContact CB-CE1 3.61Å; H682-Y737 AromaticContact CD2-CD1 3.98Å; H682-Y737 AromaticContact CE1-CE1 3.92Å; H682-Y737 AromaticContact CE1-CE2 3.56Å; H682-Y737 AromaticContact CE1-CZ 3.47Å; H682-Y737 VanDerWaalsContact CE1-CZ 3.47Å; H682-Y737 AromaticContact CG-CD1 3.69Å; H682-Y737 AromaticContact CG-CE1 3.41Å; H682-Y737 VanDerWaalsContact CG-CE1 3.41Å; H682-Y737 AromaticContact CG-CZ 3.77Å; H682-Y737 AromaticContact ND1-CD1 3.98Å; H682-Y737 AromaticContact ND1-CE1 3.3Å; H682-Y737 VanDerWaalsContact ND1-CE1 3.3Å; H682-Y737 WeakPolarHBondContact ND1-CE1 3.25Å; H682-Y737 AromaticContact ND1-CE2 3.76Å; H682-Y737 AromaticContact ND1-CZ 3.14Å; H682-Y737 PolarHBondContact ND1-OH 3.12Å
683	S	86.5	Confident	88	Confident	62 Å²	62	24.1 Å²	24.1	43%	0.434	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	17.7	176.5	-57	0	0	0	0	112.4	D679 R685	D679-S683 WeakPolarHBondContact O-CA 3.4Å; D679-S683 VanDerWaalsContact O-CB 3.23Å; D679-S683 WeakPolarHBondContact O-CB 3.43Å; D679-S683 PolarHBondContact O-N 3.12Å; D679-S683 WeakPolarHBondContact OD1-CB 3.44Å; D679-S683 PolarHBondContact OD1-OG 3.17Å; S683-R685 VanDerWaalsContact C-N 3.3Å; S683-R685 PolarHBondContact O-N 2.96Å
684	D	88.9	Confident	86.8	Confident	37 Å²	37	30.9 Å²	30.9	20%	0.198	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	35.6	174	-93.6	-59.5	0	0	0	115	R470 G471 R496	R470-D684 WeakPolarHBondContact CD-OD2 3.43Å; R470-D684 IonicContact CZ-OD1 3.19Å; R470-D684 IonicContact CZ-OD2 3.75Å; R470-D684 IonicContact NE-OD2 3.27Å; R470-D684 VanDerWaalsContact NH1-CG 3.29Å; R470-D684 IonicContact NH1-OD1 2.77Å; R470-D684 PolarHBondContact NH1-OD1 3.3Å; R470-D684 IonicContact NH1-OD2 3.56Å; R470-D684 PolarHBondContact NH1-OD2 3.44Å; G471-D684 WeakPolarHBondContact CA-O 3.21Å; G471-D684 PolarHBondContact N-O 2.86Å; G471-D684 VanDerWaalsContact N-O 3.11Å; G471-D684 PolarHBondContact N-OD1 2.91Å; R496-D684 PolarHBondContact NH2-O 3.44Å
685	R	92.6	Very high	85.4	Confident	46 Å²	46	34.2 Å²	34.2	17%	0.174	18%	0.18	C	C	.	.			trans	-79.2	170.5	175.7	-70.8	-169.8	-165.5	128.3	23.2	113.5	G471 F472 D499 E501 D679 S680 S683 Y743	G471-R685 WeakPolarHBondContact CA-O 3.46Å; F472-R685 PolarHBondContact N-O 3.1Å; D499-R685 HydrophobicContact CB-CG 4.44Å; D499-R685 WeakPolarHBondContact O-CB 3.48Å; E501-R685 WeakPolarHBondContact OE1-CD 3.4Å; E501-R685 IonicContact OE1-CZ 2.77Å; E501-R685 IonicContact OE1-NE 3.05Å; E501-R685 IonicContact OE1-NH1 3.6Å; E501-R685 PolarHBondContact OE1-NH1 3.16Å; D679-R685 IonicContact OD1-NH2 2.79Å; D679-R685 PolarHBondContact OD1-NH2 3.2Å; D679-R685 IonicContact OD2-CZ 3.44Å; D679-R685 IonicContact OD2-NH1 3.77Å; D679-R685 PolarHBondContact OD2-NH1 3.31Å; D679-R685 IonicContact OD2-NH2 3.26Å; D679-R685 PolarHBondContact OD2-NH2 3.49Å; S680-R685 PolarHBondContact O-N 2.93Å; S683-R685 VanDerWaalsContact C-N 3.3Å; S683-R685 PolarHBondContact O-N 2.96Å; R685-Y743 PolarHBondContact O-OH 3.06Å
686	I	94.9	Very high	84.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	101.4	-177.9	-60.5	175.4	0	0	0	108.9	L466 F472 I487 S491 R496 D499 I500 E501 I688	L466-I686 HydrophobicContact CD2-CD1 3.82Å; F472-I686 HydrophobicContact CD1-CG1 4.19Å; F472-I686 HydrophobicContact CD2-CG2 4.22Å; F472-I686 HydrophobicContact CE1-CD1 3.84Å; F472-I686 HydrophobicContact CE1-CG1 3.85Å; F472-I686 HydrophobicContact CE1-CG2 4.01Å; F472-I686 HydrophobicContact CE2-CG2 3.6Å; F472-I686 HydrophobicContact CZ-CB 4.46Å; F472-I686 HydrophobicContact CZ-CD1 4.19Å; F472-I686 HydrophobicContact CZ-CG1 4.22Å; F472-I686 HydrophobicContact CZ-CG2 3.49Å; F472-I686 VanDerWaalsContact CZ-CG2 3.49Å; F472-I686 WeakPolarHBondContact O-CA 3.48Å; I487-I686 HydrophobicContact CG2-CG2 3.98Å; S491-I686 WeakPolarHBondContact OG-CD1 3.32Å; R496-I686 HydrophobicContact CB-CD1 4.49Å; D499-I686 HydrophobicContact CB-CG1 4.49Å; D499-I686 PolarHBondContact O-N 3.46Å; I500-I686 WeakPolarHBondContact CA-O 3.37Å; I500-I686 HydrophobicContact CG1-CB 4.16Å; I500-I686 HydrophobicContact CG1-CD1 4.5Å; I500-I686 HydrophobicContact CG1-CG2 4.2Å; E501-I686 PolarHBondContact N-O 3.49Å; I686-I688 HydrophobicContact CG2-CG1 4.41Å
687	L	95.4	Very high	83.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.8	-176.6	179	60.8	0	0	0	111.2	F472 T473 F474 E501 I503 I675 I677 V689 F708	F472-L687 PolarHBondContact O-N 3.48Å; T473-L687 CarbonylContact C-O 3.52Å; T473-L687 VanDerWaalsContact CA-O 3.31Å; T473-L687 WeakPolarHBondContact CA-O 3.39Å; T473-L687 HydrophobicContact CG2-CB 4.49Å; T473-L687 HydrophobicContact CG2-CD2 4.37Å; T473-L687 HydrophobicContact CG2-CG 4.45Å; F474-L687 PolarHBondContact N-O 2.91Å; E501-L687 HydrophobicContact CB-CD1 3.9Å; I503-L687 HydrophobicContact CD1-CD1 4.17Å; I503-L687 HydrophobicContact CG1-CD1 4.2Å; I675-L687 HydrophobicContact CD1-CD1 4.05Å; I675-L687 HydrophobicContact CG2-CD1 4.23Å; I677-L687 HydrophobicContact CG1-CD2 4.27Å; L687-V689 HydrophobicContact CD1-CG2 4.46Å; L687-V689 HydrophobicContact CG-CG2 4.13Å; L687-F708 HydrophobicContact CD2-CE2 4.12Å; L687-F708 HydrophobicContact CD2-CZ 4.13Å
688	I	94.6	Very high	82.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.8	179.6	-50.7	174.6	0	0	0	109.2	F474 T484 I487 I500 E501 V502 I503 I686 M690	F474-I688 WeakPolarHBondContact O-CA 3.36Å; T484-I688 HydrophobicContact CG2-CD1 4.04Å; T484-I688 HydrophobicContact CG2-CG2 4.48Å; I487-I688 HydrophobicContact CB-CD1 3.85Å; I487-I688 HydrophobicContact CD1-CD1 4.22Å; I487-I688 HydrophobicContact CD1-CG1 4.35Å; I487-I688 HydrophobicContact CG2-CD1 3.58Å; I487-I688 HydrophobicContact CG2-CG1 4.19Å; I500-I688 HydrophobicContact CG2-CD1 4.05Å; E501-I688 PolarHBondContact O-N 3.23Å; V502-I688 WeakPolarHBondContact CA-O 3.25Å; V502-I688 HydrophobicContact CG2-CB 4.47Å; V502-I688 HydrophobicContact CG2-CD1 4.36Å; I503-I688 PolarHBondContact N-O 2.75Å; I686-I688 HydrophobicContact CG2-CG1 4.41Å; I688-M690 HydrophobicContact CG2-CG 4.44Å; I688-M690 HydrophobicContact CG2-SD 3.81Å
689	V	93.1	Very high	82.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	113.9	-178.2	-172.5	0	0	0	0	110.4	F474 V475 D476 I503 F505 L687 I691 F708	F474-V689 PolarHBondContact O-N 2.96Å; V475-V689 WeakPolarHBondContact CA-O 3.48Å; V475-V689 HydrophobicContact CG1-CB 4.36Å; V475-V689 HydrophobicContact CG2-CB 4.24Å; D476-V689 PolarHBondContact N-O 2.93Å; I503-V689 HydrophobicContact CB-CG1 4.33Å; I503-V689 HydrophobicContact CB-CG2 4.33Å; I503-V689 HydrophobicContact CD1-CG2 4.32Å; I503-V689 HydrophobicContact CG2-CG1 4.46Å; I503-V689 WeakPolarHBondContact O-CA 3.38Å; F505-V689 HydrophobicContact CE2-CG1 4.23Å; L687-V689 HydrophobicContact CD1-CG2 4.46Å; L687-V689 HydrophobicContact CG-CG2 4.13Å; V689-I691 HydrophobicContact CG1-CD1 4.43Å; V689-I691 HydrophobicContact CG1-CG1 4.07Å; V689-F708 HydrophobicContact CG1-CD2 4.41Å; V689-F708 HydrophobicContact CG1-CG 4.46Å; V689-F708 HydrophobicContact CG2-CD2 4.22Å; V689-F708 HydrophobicContact CG2-CE1 4.32Å; V689-F708 HydrophobicContact CG2-CE2 3.69Å; V689-F708 HydrophobicContact CG2-CZ 3.75Å
690	M	90.7	Very high	81.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	113.8	-176.6	-51.2	-59.8	-77.5	0	0	109.8	D476 A479 Q480 T484 I503 F505 M506 I688	D476-M690 HydrophobicContact CB-CE 4.11Å; D476-M690 HydrophobicContact CB-SD 3.79Å; A479-M690 HydrophobicContact CB-CB 4.13Å; A479-M690 HydrophobicContact CB-CE 4.41Å; Q480-M690 WeakPolarHBondContact O-CE 3.43Å; T484-M690 PolarHBondContact OG1-SD 3.14Å; I503-M690 PolarHBondContact O-N 3.33Å; F505-M690 WeakPolarHBondContact CB-O 3.45Å; F505-M690 WeakPolarHBondContact CD2-O 3.27Å; F505-M690 PolarHBondContact N-O 3.4Å; F505-M690 VanDerWaalsContact N-O 3.09Å; M506-M690 HydrophobicContact CE-CB 4.01Å; M506-M690 HydrophobicContact CE-CE 3.99Å; M506-M690 HydrophobicContact CE-CG 4.06Å; M506-M690 HydrophobicContact CG-CB 4.36Å; I688-M690 HydrophobicContact CG2-CG 4.44Å; I688-M690 HydrophobicContact CG2-SD 3.81Å
691	I	86.8	Confident	81.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.211	C	C	.	.			trans	-113.2	110.8	-175.7	-47.3	-178.5	0	0	0	110.1	V475 D476 V689 A693 T701 L704 Y753	V475-I691 HydrophobicContact CG1-CD1 3.55Å; V475-I691 HydrophobicContact CG1-CG1 4.15Å; D476-I691 PolarHBondContact O-N 3.46Å; V689-I691 HydrophobicContact CG1-CD1 4.43Å; V689-I691 HydrophobicContact CG1-CG1 4.07Å; I691-A693 PolarHBondContact O-N 2.83Å; I691-T701 HydrophobicContact CG2-CG2 3.87Å; I691-L704 HydrophobicContact CG2-CB 4.22Å; I691-Y753 HydrophobicContact CD1-CD1 4.39Å; I691-Y753 HydrophobicContact CD1-CD2 4.4Å; I691-Y753 HydrophobicContact CD1-CG 4.25Å
692	P	78.4	Confident	80.7	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.013	21%	0.21	C	C	.	.			trans	-71.6	120.3	-171.7	29.2	-37.6	0	0	0	112.7	F505 D695 T696 T701	F505-P692 HydrophobicContact CB-CG 4.27Å; F505-P692 WeakPolarHBondContact O-CG 3.47Å; P692-D695 HydrophobicContact CB-CB 4.27Å; P692-T696 HydrophobicContact CB-CG2 4.4Å; P692-T696 HydrophobicContact CG-CG2 3.7Å; P692-T696 PolarHBondContact O-OG1 2.84Å; P692-T696 VanDerWaalsContact O-OG1 3.13Å; P692-T701 WeakPolarHBondContact O-CG2 3.28Å; P692-T701 PolarHBondContact O-OG1 2.86Å
693	A	68.1	Low	80.5	Confident	38 Å²	38	33.6 Å²	33.6	31%	0.314	20%	0.202	S	C	.	.	S	Bend	trans	-90.4	-8.1	175.1	0	0	0	0	0	114.5	G477 I691	G477-A693 WeakPolarHBondContact O-CB 3.49Å; I691-A693 PolarHBondContact O-N 2.83Å
694	L	61	Low	80.5	Confident	162 Å²	162	30.6 Å²	30.6	85%	0.848	18%	0.182	S	C	*	.	S	Bend	trans	-116.6	-42.5	-176.8	-63.8	178.2	0	0	0	113.3	T696	L694-T696 VanDerWaalsContact C-N 3.25Å; L694-T696 PolarHBondContact O-N 2.55Å
695	D	59	Low	80.2	Confident	105 Å²	105	28.9 Å²	28.9	56%	0.561	17%	0.172	S	C	*	.	S	Bend	trans	-78.6	-6	-173.4	-48.7	-59.7	0	0	0	114.2	P692	P692-D695 HydrophobicContact CB-CB 4.27Å
696	T	66.1	Low	79.7	Confident	26 Å²	26	27.4 Å²	27.4	16%	0.16	17%	0.167	C	C	.	.	S	Bend	trans	-134.6	161.3	-175.3	71.7	0	0	0	0	111.4	F664 P692 L694 T700 T701	F664-T696 HydrophobicContact CZ-CG2 3.87Å; P692-T696 HydrophobicContact CB-CG2 4.4Å; P692-T696 HydrophobicContact CG-CG2 3.7Å; P692-T696 PolarHBondContact O-OG1 2.84Å; P692-T696 VanDerWaalsContact O-OG1 3.13Å; L694-T696 VanDerWaalsContact C-N 3.25Å; L694-T696 PolarHBondContact O-N 2.55Å; T696-T700 HydrophobicContact CG2-CG2 4.48Å; T696-T701 PolarHBondContact OG1-OG1 2.86Å; T696-T701 VanDerWaalsContact OG1-OG1 3.06Å
697	S	72.6	Confident	79.3	Confident	60 Å²	60	27.4 Å²	27.4	42%	0.42	17%	0.167	S	C	.	.			trans	-64.5	146.8	173.7	87.3	0	0	0	0	110.2	H699 T700 T701	S697-H699 PolarHBondContact O-N 3.35Å; S697-H699 VanDerWaalsContact O-N 3.07Å; S697-H699 PolarHBondContact OG-N 3.11Å; S697-T700 CarbonylContact O-C 3.47Å; S697-T700 WeakPolarHBondContact O-CA 3.42Å; S697-T700 VanDerWaalsContact O-CB 3.29Å; S697-T700 WeakPolarHBondContact O-CB 3.37Å; S697-T700 PolarHBondContact O-N 3.14Å; S697-T700 PolarHBondContact OG-N 2.78Å; S697-T700 VanDerWaalsContact OG-N 3.12Å; S697-T700 PolarHBondContact OG-OG1 3.37Å; S697-T701 PolarHBondContact O-N 3.46Å; S697-T701 PolarHBondContact O-OG1 2.91Å
698	A	72.2	Confident	79	Confident	83 Å²	83	27.4 Å²	27.4	69%	0.686	17%	0.167	S	C	*	.	H	α-helix	trans	-58.2	-25.7	177.5	0	0	0	0	0	113.1	S702	A698-S702 WeakPolarHBondContact O-CB 3.4Å; A698-S702 PolarHBondContact O-N 2.93Å
699	H	74.9	Confident	78.7	Confident	52 Å²	52	27.5 Å²	27.5	24%	0.241	17%	0.167	C	C	.	.	H	α-helix	trans	-66.3	-43.3	169.8	167.2	-86.8	0	0	0	111.8	P549 S697 S702 A703	P549-H699 VanDerWaalsContact CA-NE2 3.25Å; P549-H699 WeakPolarHBondContact CA-NE2 3.27Å; P549-H699 VanDerWaalsContact CB-NE2 3.32Å; P549-H699 WeakPolarHBondContact CB-NE2 3.37Å; P549-H699 WeakPolarHBondContact CG-NE2 3.26Å; S697-H699 PolarHBondContact O-N 3.35Å; S697-H699 VanDerWaalsContact O-N 3.07Å; S697-H699 PolarHBondContact OG-N 3.11Å; H699-S702 PolarHBondContact O-N 3.45Å; H699-A703 WeakPolarHBondContact O-CB 3.37Å; H699-A703 PolarHBondContact O-N 3.3Å
700	T	78.1	Confident	78.3	Confident	17 Å²	17	27.6 Å²	27.6	10%	0.104	17%	0.168	C	C	.	.	H	α-helix	trans	-65.8	-47.9	176.2	-44.4	0	0	0	0	111.5	T659 F660 F664 T696 S697 S702 A703 L704	T659-T700 HydrophobicContact CG2-CG2 3.93Å; F660-T700 HydrophobicContact CE1-CG2 4.29Å; F664-T700 HydrophobicContact CE2-CG2 4.3Å; T696-T700 HydrophobicContact CG2-CG2 4.48Å; S697-T700 CarbonylContact O-C 3.47Å; S697-T700 WeakPolarHBondContact O-CA 3.42Å; S697-T700 VanDerWaalsContact O-CB 3.29Å; S697-T700 WeakPolarHBondContact O-CB 3.37Å; S697-T700 PolarHBondContact O-N 3.14Å; S697-T700 PolarHBondContact OG-N 2.78Å; S697-T700 VanDerWaalsContact OG-N 3.12Å; S697-T700 PolarHBondContact OG-OG1 3.37Å; T700-S702 VanDerWaalsContact C-N 3.3Å; T700-S702 PolarHBondContact O-N 3.3Å; T700-A703 PolarHBondContact O-N 2.79Å; T700-A703 VanDerWaalsContact O-N 3.15Å; T700-L704 WeakPolarHBondContact O-CG 3.39Å; T700-L704 PolarHBondContact O-N 2.81Å
701	T	78	Confident	78.2	Confident	5 Å²	5	28.8 Å²	28.8	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-52.6	-49.5	172.8	-47.4	0	0	0	0	110.6	I691 P692 T696 S697 L704 G705	I691-T701 HydrophobicContact CG2-CG2 3.87Å; P692-T701 WeakPolarHBondContact O-CG2 3.28Å; P692-T701 PolarHBondContact O-OG1 2.86Å; T696-T701 PolarHBondContact OG1-OG1 2.86Å; T696-T701 VanDerWaalsContact OG1-OG1 3.06Å; S697-T701 PolarHBondContact O-N 3.46Å; S697-T701 PolarHBondContact O-OG1 2.91Å; T701-L704 PolarHBondContact O-N 2.99Å; T701-G705 PolarHBondContact O-N 2.69Å; T701-G705 VanDerWaalsContact O-N 3.13Å
702	S	78.2	Confident	78.2	Confident	10 Å²	10	28.8 Å²	28.8	7%	0.07	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-43.8	176.9	177.1	0	0	0	0	111.9	A698 H699 T700 L704 R706	A698-S702 WeakPolarHBondContact O-CB 3.4Å; A698-S702 PolarHBondContact O-N 2.93Å; H699-S702 PolarHBondContact O-N 3.45Å; T700-S702 VanDerWaalsContact C-N 3.3Å; T700-S702 PolarHBondContact O-N 3.3Å; S702-L704 PolarHBondContact O-N 3.4Å; S702-R706 WeakPolarHBondContact O-CB 3.48Å; S702-R706 WeakPolarHBondContact O-CG 3.37Å; S702-R706 PolarHBondContact O-N 2.86Å; S702-R706 PolarHBondContact O-NE 2.94Å; S702-R706 PolarHBondContact OG-NE 3.18Å
703	A	80.8	Confident	78.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-39.2	178.5	0	0	0	0	0	112.8	T656 F660 H699 T700 M707	T656-A703 HydrophobicContact CG2-CB 4.28Å; F660-A703 HydrophobicContact CZ-CB 4.12Å; H699-A703 WeakPolarHBondContact O-CB 3.37Å; H699-A703 PolarHBondContact O-N 3.3Å; T700-A703 PolarHBondContact O-N 2.79Å; T700-A703 VanDerWaalsContact O-N 3.15Å; A703-M707 VanDerWaalsContact O-CB 3.25Å; A703-M707 WeakPolarHBondContact O-CB 3.43Å; A703-M707 PolarHBondContact O-N 2.85Å
704	L	85.6	Confident	79.1	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-53.2	176.1	-73.6	170.9	0	0	0	111.7	F505 F660 F664 F668 I691 T700 T701 S702 M707 F708	F505-L704 HydrophobicContact CB-CD1 4.05Å; F505-L704 HydrophobicContact CD1-CD1 4.31Å; F505-L704 HydrophobicContact CD1-CD2 3.85Å; F505-L704 HydrophobicContact CD2-CD1 4.45Å; F505-L704 HydrophobicContact CE1-CD2 3.77Å; F505-L704 HydrophobicContact CE2-CD2 4.43Å; F505-L704 HydrophobicContact CG-CD1 4.03Å; F505-L704 HydrophobicContact CG-CD2 4.23Å; F505-L704 HydrophobicContact CZ-CD2 4.08Å; F660-L704 HydrophobicContact CD1-CD2 4.22Å; F660-L704 HydrophobicContact CE1-CD2 3.58Å; F660-L704 HydrophobicContact CE1-CG 3.89Å; F660-L704 HydrophobicContact CE2-CD2 4.18Å; F660-L704 HydrophobicContact CZ-CD2 3.55Å; F660-L704 HydrophobicContact CZ-CG 3.94Å; F664-L704 HydrophobicContact CD2-CD1 4.49Å; F664-L704 HydrophobicContact CD2-CD2 4.24Å; F664-L704 HydrophobicContact CE2-CD1 3.88Å; F664-L704 HydrophobicContact CE2-CD2 4.36Å; F664-L704 HydrophobicContact CZ-CD1 4.17Å; F668-L704 HydrophobicContact CZ-CD2 4.29Å; I691-L704 HydrophobicContact CG2-CB 4.22Å; T700-L704 WeakPolarHBondContact O-CG 3.39Å; T700-L704 PolarHBondContact O-N 2.81Å; T701-L704 PolarHBondContact O-N 2.99Å; S702-L704 PolarHBondContact O-N 3.4Å; L704-M707 HydrophobicContact CD2-CE 4.1Å; L704-M707 WeakPolarHBondContact O-CB 3.12Å; L704-M707 PolarHBondContact O-N 3.37Å; L704-F708 PolarHBondContact O-N 2.75Å
705	G	83	Confident	80.1	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.5	-36.5	-179.6	0	0	0	0	0	113.4	T701 M707 F708 V709	T701-G705 PolarHBondContact O-N 2.69Å; T701-G705 VanDerWaalsContact O-N 3.13Å; G705-M707 VanDerWaalsContact C-N 3.33Å; G705-M707 PolarHBondContact O-N 3.19Å; G705-F708 PolarHBondContact O-N 3.23Å; G705-V709 WeakPolarHBondContact O-CB 3.49Å; G705-V709 WeakPolarHBondContact O-CG2 3.4Å; G705-V709 PolarHBondContact O-N 2.79Å
706	R	82.4	Confident	81.2	Confident	15 Å²	15	16.6 Å²	16.6	6%	0.057	11%	0.105	C	C	.	.	H	α-helix	trans	-61.5	-40.6	171.6	-72.2	-173	-68.3	137.3	6.6	111.7	S546 L548 S702 T710 T755	S546-R706 PolarHBondContact O-NH1 3.42Å; S546-R706 VanDerWaalsContact O-NH1 3.08Å; S546-R706 PolarHBondContact O-NH2 3.26Å; L548-R706 PolarHBondContact O-NH1 3.08Å; L548-R706 VanDerWaalsContact O-NH1 3.1Å; L548-R706 PolarHBondContact O-NH2 3.07Å; S702-R706 WeakPolarHBondContact O-CB 3.48Å; S702-R706 WeakPolarHBondContact O-CG 3.37Å; S702-R706 PolarHBondContact O-N 2.86Å; S702-R706 PolarHBondContact O-NE 2.94Å; S702-R706 PolarHBondContact OG-NE 3.18Å; R706-T710 WeakPolarHBondContact O-CB 3.27Å; R706-T710 PolarHBondContact O-N 3.19Å; R706-T710 PolarHBondContact O-OG1 3.41Å; R706-T755 HydrophobicContact CG-CG2 4.35Å
707	M	87.1	Confident	81.8	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.9	-47.6	173.7	172.5	-164.1	56	0	0	111.8	F505 W529 P531 T543 M547 F660 F668 A703 L704 G705 T710 Q711	F505-M707 HydrophobicContact CZ-CE 4.35Å; W529-M707 HydrophobicContact CE3-CE 4.48Å; W529-M707 HydrophobicContact CH2-CE 3.76Å; W529-M707 HydrophobicContact CH2-CG 4.2Å; W529-M707 HydrophobicContact CH2-SD 4.18Å; W529-M707 HydrophobicContact CZ3-CE 3.4Å; W529-M707 VanDerWaalsContact CZ3-CE 3.4Å; W529-M707 HydrophobicContact CZ3-SD 4.21Å; P531-M707 HydrophobicContact CG-SD 4.19Å; T543-M707 HydrophobicContact CG2-CG 3.76Å; M547-M707 HydrophobicContact CE-CG 3.95Å; M547-M707 HydrophobicContact CE-SD 3.39Å; M547-M707 WeakPolarHBondContact CE-SD 3.14Å; F660-M707 HydrophobicContact CE2-CE 4.27Å; F660-M707 HydrophobicContact CE2-SD 4.04Å; F668-M707 HydrophobicContact CE1-CE 3.8Å; F668-M707 HydrophobicContact CE1-SD 3.76Å; F668-M707 HydrophobicContact CZ-CE 3.62Å; F668-M707 HydrophobicContact CZ-SD 3.92Å; A703-M707 VanDerWaalsContact O-CB 3.25Å; A703-M707 WeakPolarHBondContact O-CB 3.43Å; A703-M707 PolarHBondContact O-N 2.85Å; L704-M707 HydrophobicContact CD2-CE 4.1Å; L704-M707 WeakPolarHBondContact O-CB 3.12Å; L704-M707 PolarHBondContact O-N 3.37Å; G705-M707 VanDerWaalsContact C-N 3.33Å; G705-M707 PolarHBondContact O-N 3.19Å; M707-T710 PolarHBondContact O-N 3.43Å; M707-Q711 WeakPolarHBondContact O-CG 3.11Å; M707-Q711 PolarHBondContact O-N 2.96Å
708	F	89.2	Confident	81.9	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-51.9	178.9	177.7	-97.1	0	0	0	112	T473 V475 I503 W529 I677 L687 V689 L704 G705 T710 Q711 Q712	T473-F708 HydrophobicContact CG2-CE1 4.27Å; T473-F708 HydrophobicContact CG2-CZ 3.94Å; V475-F708 HydrophobicContact CG2-CD1 4.18Å; V475-F708 HydrophobicContact CG2-CE1 3.67Å; V475-F708 HydrophobicContact CG2-CZ 4.45Å; I503-F708 HydrophobicContact CD1-CE2 4.48Å; W529-F708 HydrophobicContact CH2-CB 4.31Å; W529-F708 HydrophobicContact CH2-CD2 4.15Å; W529-F708 HydrophobicContact CZ2-CD2 4.48Å; I677-F708 HydrophobicContact CD1-CD2 3.87Å; I677-F708 HydrophobicContact CD1-CE2 3.57Å; I677-F708 HydrophobicContact CG1-CE2 4.26Å; L687-F708 HydrophobicContact CD2-CE2 4.12Å; L687-F708 HydrophobicContact CD2-CZ 4.13Å; V689-F708 HydrophobicContact CG1-CD2 4.41Å; V689-F708 HydrophobicContact CG1-CG 4.46Å; V689-F708 HydrophobicContact CG2-CD2 4.22Å; V689-F708 HydrophobicContact CG2-CE1 4.32Å; V689-F708 HydrophobicContact CG2-CE2 3.69Å; V689-F708 HydrophobicContact CG2-CZ 3.75Å; L704-F708 PolarHBondContact O-N 2.75Å; G705-F708 PolarHBondContact O-N 3.23Å; F708-T710 PolarHBondContact O-N 3.02Å; F708-Q711 WeakPolarHBondContact O-CB 3.41Å; F708-Q711 PolarHBondContact O-N 2.98Å; F708-Q711 VanDerWaalsContact O-N 3.15Å; F708-Q712 PolarHBondContact O-N 2.66Å
709	V	86.8	Confident	82	Confident	2 Å²	2	17.2 Å²	17.2	1%	0.012	9%	0.089	C	C	.	.	H	α-helix	trans	-63.1	-41.6	178.7	173.7	0	0	0	0	111.1	G705 Q711 Q712 S713 T755 R757 I758	G705-V709 WeakPolarHBondContact O-CB 3.49Å; G705-V709 WeakPolarHBondContact O-CG2 3.4Å; G705-V709 PolarHBondContact O-N 2.79Å; V709-Q711 VanDerWaalsContact C-N 3.29Å; V709-Q711 PolarHBondContact O-N 2.76Å; V709-Q712 PolarHBondContact O-N 3.18Å; V709-S713 WeakPolarHBondContact O-CB 3.06Å; V709-S713 PolarHBondContact O-N 3.03Å; V709-S713 PolarHBondContact O-OG 3.5Å; V709-S713 VanDerWaalsContact O-OG 3.06Å; V709-T755 HydrophobicContact CB-CG2 3.9Å; V709-T755 HydrophobicContact CG1-CG2 3.6Å; V709-R757 HydrophobicContact CG1-CB 4.21Å; V709-I758 HydrophobicContact CG1-CD1 4.44Å; V709-I758 HydrophobicContact CG1-CG1 3.65Å; V709-I758 HydrophobicContact CG2-CD1 4.47Å; V709-I758 HydrophobicContact CG2-CG1 4.48Å
710	T	85.8	Confident	81.8	Confident	3 Å²	3	17 Å²	17	2%	0.018	9%	0.089	C	C	.	.	H	α-helix	trans	-58.5	-42	174.9	-72.9	0	0	0	0	111.3	E542 R706 M707 F708 M714	E542-T710 HydrophobicContact CG-CG2 4.27Å; R706-T710 WeakPolarHBondContact O-CB 3.27Å; R706-T710 PolarHBondContact O-N 3.19Å; R706-T710 PolarHBondContact O-OG1 3.41Å; M707-T710 PolarHBondContact O-N 3.43Å; F708-T710 PolarHBondContact O-N 3.02Å; T710-M714 HydrophobicContact CG2-CG 4.27Å; T710-M714 HydrophobicContact CG2-SD 3.84Å; T710-M714 WeakPolarHBondContact O-CB 3.45Å; T710-M714 WeakPolarHBondContact O-CG 3.38Å; T710-M714 PolarHBondContact O-N 3.47Å
711	Q	87.6	Confident	81.1	Confident	24 Å²	24	17.6 Å²	17.6	11%	0.112	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-44.9	175	-76.4	-78.4	-57.8	0	0	112.4	W529 P531 S535 T543 I677 M707 F708 V709 M714 L715	W529-Q711 HydrophobicContact CZ2-CB 4.23Å; W529-Q711 HydrophobicContact CZ2-CG 4.05Å; P531-Q711 HydrophobicContact CB-CG 3.74Å; P531-Q711 PolarHBondContact O-NE2 2.98Å; P531-Q711 PolarHBondContact O-OE1 3.22Å; S535-Q711 PolarHBondContact OG-NE2 3.28Å; S535-Q711 PolarHBondContact OG-OE1 3.45Å; T543-Q711 HydrophobicContact CG2-CG 4.1Å; T543-Q711 PolarHBondContact OG1-NE2 3.49Å; I677-Q711 HydrophobicContact CD1-CB 4.23Å; M707-Q711 WeakPolarHBondContact O-CG 3.11Å; M707-Q711 PolarHBondContact O-N 2.96Å; F708-Q711 WeakPolarHBondContact O-CB 3.41Å; F708-Q711 PolarHBondContact O-N 2.98Å; F708-Q711 VanDerWaalsContact O-N 3.15Å; V709-Q711 VanDerWaalsContact C-N 3.29Å; V709-Q711 PolarHBondContact O-N 2.76Å; Q711-M714 PolarHBondContact O-N 2.96Å; Q711-L715 WeakPolarHBondContact O-CB 3.37Å; Q711-L715 PolarHBondContact O-N 2.7Å
712	Q	87.7	Confident	80.5	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-62	-54.7	176.9	-175.9	175.2	39.6	0	0	112.3	I681 F708 V709 M714 L715 L716 C745	I681-Q712 HydrophobicContact CD1-CG 4.47Å; F708-Q712 PolarHBondContact O-N 2.66Å; V709-Q712 PolarHBondContact O-N 3.18Å; Q712-M714 VanDerWaalsContact C-N 3.27Å; Q712-M714 PolarHBondContact O-N 3.26Å; Q712-L715 WeakPolarHBondContact O-CB 3.46Å; Q712-L715 PolarHBondContact O-N 3.44Å; Q712-L716 HydrophobicContact CG-CD1 4.17Å; Q712-L716 WeakPolarHBondContact O-CG 3.27Å; Q712-L716 PolarHBondContact O-N 3.33Å; Q712-C745 PolarHBondContact NE2-SG 2.86Å; Q712-C745 VanDerWaalsContact NE2-SG 3.4Å
713	S	83.7	Confident	79.4	Confident	13 Å²	13	31 Å²	31	9%	0.091	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-38.1	178.7	-53.3	0	0	0	0	111.9	V709 A717 E761	V709-S713 WeakPolarHBondContact O-CB 3.06Å; V709-S713 PolarHBondContact O-N 3.03Å; V709-S713 PolarHBondContact O-OG 3.5Å; V709-S713 VanDerWaalsContact O-OG 3.06Å; S713-A717 VanDerWaalsContact O-CB 3.27Å; S713-A717 WeakPolarHBondContact O-CB 3.46Å; S713-A717 PolarHBondContact O-N 3.26Å; S713-E761 WeakPolarHBondContact CA-OE2 3.4Å; S713-E761 VanDerWaalsContact CB-OE2 3.29Å; S713-E761 WeakPolarHBondContact CB-OE2 3.45Å; S713-E761 PolarHBondContact N-OE2 3.24Å; S713-E761 PolarHBondContact OG-OE2 3.01Å
714	M	81.2	Confident	78.6	Confident	15 Å²	15	37.7 Å²	37.7	7%	0.074	18%	0.184	C	C	.	.	H	α-helix	trans	-71.3	-37.8	178.3	-76.8	-168.1	130.6	0	0	112.6	F539 E542 T710 Q711 Q712 A717 R718	F539-M714 HydrophobicContact CB-CE 4.5Å; F539-M714 HydrophobicContact CB-SD 3.84Å; F539-M714 HydrophobicContact CD1-CB 4.32Å; F539-M714 HydrophobicContact CD1-CE 3.49Å; F539-M714 VanDerWaalsContact CD1-CE 3.49Å; F539-M714 HydrophobicContact CD1-CG 4.31Å; F539-M714 HydrophobicContact CD1-SD 3.68Å; F539-M714 HydrophobicContact CD2-CB 3.72Å; F539-M714 HydrophobicContact CD2-SD 4.29Å; F539-M714 HydrophobicContact CE1-CB 4.2Å; F539-M714 HydrophobicContact CE1-CE 3.87Å; F539-M714 HydrophobicContact CE1-CG 4.31Å; F539-M714 HydrophobicContact CE1-SD 4.24Å; F539-M714 VanDerWaalsContact CE2-C 3.48Å; F539-M714 HydrophobicContact CE2-CB 3.55Å; F539-M714 HydrophobicContact CE2-CG 4.48Å; F539-M714 WeakPolarHBondContact CE2-O 3.22Å; F539-M714 HydrophobicContact CG-CB 4.09Å; F539-M714 HydrophobicContact CG-CE 4.14Å; F539-M714 HydrophobicContact CG-CG 4.4Å; F539-M714 HydrophobicContact CG-SD 3.69Å; F539-M714 HydrophobicContact CZ-CB 3.8Å; F539-M714 HydrophobicContact CZ-CG 4.37Å; F539-M714 WeakPolarHBondContact CZ-O 3.47Å; E542-M714 HydrophobicContact CB-CE 3.66Å; E542-M714 HydrophobicContact CB-SD 4.1Å; E542-M714 HydrophobicContact CG-CE 4.07Å; E542-M714 WeakPolarHBondContact OE2-CE 3.33Å; T710-M714 HydrophobicContact CG2-CG 4.27Å; T710-M714 HydrophobicContact CG2-SD 3.84Å; T710-M714 WeakPolarHBondContact O-CB 3.45Å; T710-M714 WeakPolarHBondContact O-CG 3.38Å; T710-M714 PolarHBondContact O-N 3.47Å; Q711-M714 PolarHBondContact O-N 2.96Å; Q712-M714 VanDerWaalsContact C-N 3.27Å; Q712-M714 PolarHBondContact O-N 3.26Å; M714-A717 PolarHBondContact O-N 2.94Å; M714-R718 PolarHBondContact O-N 2.99Å
715	L	82.4	Confident	77.1	Confident	19 Å²	19	43.3 Å²	43.3	10%	0.099	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-57.4	171.2	-178.3	84.3	0	0	0	110.5	I677 R678 I681 Q711 Q712 A717 R718 D719	I677-L715 HydrophobicContact CG2-CD2 4.39Å; R678-L715 HydrophobicContact CB-CD1 3.52Å; R678-L715 HydrophobicContact CB-CD2 4.26Å; R678-L715 HydrophobicContact CG-CD1 3.76Å; I681-L715 HydrophobicContact CD1-CD2 4.03Å; Q711-L715 WeakPolarHBondContact O-CB 3.37Å; Q711-L715 PolarHBondContact O-N 2.7Å; Q712-L715 WeakPolarHBondContact O-CB 3.46Å; Q712-L715 PolarHBondContact O-N 3.44Å; L715-A717 PolarHBondContact O-N 3Å; L715-R718 WeakPolarHBondContact O-CA 3.46Å; L715-R718 WeakPolarHBondContact O-CB 3.3Å; L715-R718 PolarHBondContact O-N 2.89Å; L715-D719 PolarHBondContact O-N 3.26Å
716	L	82	Confident	76	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-60.7	-31.5	-177.6	-63.2	172	0	0	0	111.4	I681 Q712 R718 D719 L720 E761 V765 L768 F770	I681-L716 HydrophobicContact CG2-CD2 4.49Å; Q712-L716 HydrophobicContact CG-CD1 4.17Å; Q712-L716 WeakPolarHBondContact O-CG 3.27Å; Q712-L716 PolarHBondContact O-N 3.33Å; L716-R718 VanDerWaalsContact C-N 3.32Å; L716-R718 PolarHBondContact O-N 2.88Å; L716-D719 PolarHBondContact O-N 3.43Å; L716-L720 WeakPolarHBondContact O-CG 3.26Å; L716-L720 PolarHBondContact O-N 3.16Å; L716-E761 HydrophobicContact CD1-CG 4.35Å; L716-V765 HydrophobicContact CB-CG1 3.99Å; L716-V765 HydrophobicContact CD1-CG1 3.9Å; L716-L768 HydrophobicContact CB-CD1 4.22Å; L716-L768 HydrophobicContact CD2-CD1 4.07Å; L716-F770 HydrophobicContact CD1-CD1 4.27Å; L716-F770 HydrophobicContact CD1-CD2 4.29Å; L716-F770 HydrophobicContact CD1-CE1 3.98Å; L716-F770 HydrophobicContact CD1-CE2 4.01Å; L716-F770 HydrophobicContact CD1-CG 4.4Å; L716-F770 HydrophobicContact CD1-CZ 3.84Å; L716-F770 HydrophobicContact CD2-CD2 4.31Å; L716-F770 HydrophobicContact CD2-CE2 4.32Å
717	A	78	Confident	74.6	Confident	50 Å²	50	44.5 Å²	44.5	41%	0.413	22%	0.223	S	C	.	.	H	α-helix	trans	-66.8	-24	171.9	0	0	0	0	0	114.8	S713 M714 L715	S713-A717 VanDerWaalsContact O-CB 3.27Å; S713-A717 WeakPolarHBondContact O-CB 3.46Å; S713-A717 PolarHBondContact O-N 3.26Å; M714-A717 PolarHBondContact O-N 2.94Å; L715-A717 PolarHBondContact O-N 3Å
718	R	74.9	Confident	73.4	Confident	115 Å²	115	45 Å²	45	43%	0.434	23%	0.226	S	C	.	.	H	α-helix	trans	-75.9	-39.8	167.7	-68.1	172.7	69.5	172.9	4.7	111.1	F534 F539 M714 L715 L716 L720 G721	F534-R718 PolarHBondContact O-NH1 3.22Å; F539-R718 HydrophobicContact CE2-CG 3.55Å; F539-R718 HydrophobicContact CZ-CG 3.52Å; M714-R718 PolarHBondContact O-N 2.99Å; L715-R718 WeakPolarHBondContact O-CA 3.46Å; L715-R718 WeakPolarHBondContact O-CB 3.3Å; L715-R718 PolarHBondContact O-N 2.89Å; L716-R718 VanDerWaalsContact C-N 3.32Å; L716-R718 PolarHBondContact O-N 2.88Å; R718-L720 VanDerWaalsContact C-N 3.33Å; R718-L720 PolarHBondContact O-N 3.16Å; R718-G721 WeakPolarHBondContact O-CA 3.4Å; R718-G721 PolarHBondContact O-N 3.46Å
719	D	74.6	Confident	71.6	Confident	17 Å²	17	48.1 Å²	48.1	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-70.6	-28.9	-176.7	-61.9	-34	0	0	0	112.4	H682 L715 L716 G721 V734 L768	H682-D719 IonicContact CD2-OD2 3.59Å; H682-D719 VanDerWaalsContact CE1-CG 3.48Å; H682-D719 IonicContact CE1-OD1 3.17Å; H682-D719 PolarHBondContact CE1-OD1 2.88Å; H682-D719 IonicContact CE1-OD2 2.67Å; H682-D719 PolarHBondContact CE1-OD2 2.94Å; H682-D719 VanDerWaalsContact CE1-OD2 3.27Å; H682-D719 VanDerWaalsContact NE2-CG 3.29Å; H682-D719 IonicContact NE2-OD1 3.53Å; H682-D719 IonicContact NE2-OD2 2.68Å; H682-D719 PolarHBondContact NE2-OD2 2.73Å; L715-D719 PolarHBondContact O-N 3.26Å; L716-D719 PolarHBondContact O-N 3.43Å; D719-G721 PolarHBondContact O-N 3.31Å; D719-V734 WeakPolarHBondContact O-CA 3.38Å; D719-V734 WeakPolarHBondContact O-CB 3.14Å; D719-V734 VanDerWaalsContact O-CG1 3.26Å; D719-V734 WeakPolarHBondContact O-CG1 3.42Å; D719-V734 WeakPolarHBondContact O-CG2 3.39Å; D719-L768 HydrophobicContact CB-CD1 4.12Å
720	L	70.7	Confident	69.8	Low	46 Å²	46	52.3 Å²	52.3	24%	0.241	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-22.7	166.6	-74.9	172.8	0	0	0	113.8	L716 R718 Q764 S767 L768	L716-L720 WeakPolarHBondContact O-CG 3.26Å; L716-L720 PolarHBondContact O-N 3.16Å; R718-L720 VanDerWaalsContact C-N 3.33Å; R718-L720 PolarHBondContact O-N 3.16Å; L720-Q764 HydrophobicContact CD1-CB 3.83Å; L720-S767 VanDerWaalsContact CD2-OG 3.27Å; L720-S767 WeakPolarHBondContact CD2-OG 3.39Å; L720-L768 HydrophobicContact CD2-CD1 4.12Å; L720-L768 HydrophobicContact CD2-CD2 4.13Å; L720-L768 HydrophobicContact CD2-CG 3.77Å; L720-L768 HydrophobicContact CG-CD1 4.1Å; L720-L768 HydrophobicContact CG-CG 4.3Å
721	G	62.7	Low	68.5	Low	31 Å²	31	52.6 Å²	52.6	32%	0.32	27%	0.273	S	S	.	.			trans	91	123.3	168.6	0	0	0	0	0	116.2	R718 D719 V734	R718-G721 WeakPolarHBondContact O-CA 3.4Å; R718-G721 PolarHBondContact O-N 3.46Å; D719-G721 PolarHBondContact O-N 3.31Å; G721-V734 VanDerWaalsContact CA-CG2 3.4Å
722	Y	65	Low	67.2	Low	178 Å²	178	54.2 Å²	54.2	70%	0.698	28%	0.282	S	S	*	.	S	Bend	trans	-91.9	-13.5	168.5	72.3	-86.9	0	0	0	113.3	L724	Y722-L724 PolarHBondContact O-N 2.67Å; Y722-L724 VanDerWaalsContact O-N 3.09Å
723	R	56.7	Low	65.4	Low	118 Å²	118	58.2 Å²	58.2	45%	0.445	30%	0.301	S	S	.	.			trans	-81.4	89	-176.6	-73.7	-172.6	179.2	167.2	-3.1	111.2	T731	R723-T731 HydrophobicContact CB-CG2 4.4Å; R723-T731 WeakPolarHBondContact O-CB 3.44Å; R723-T731 VanDerWaalsContact O-CG2 3.25Å; R723-T731 WeakPolarHBondContact O-CG2 3.1Å
724	L	62.7	Low	63.9	Low	140 Å²	140	59.1 Å²	59.1	73%	0.733	31%	0.306	S	S	*	.	S	Bend	trans	-77.1	-29.4	166	-59.5	180	0	0	0	112	Y722 Y1400	Y722-L724 PolarHBondContact O-N 2.67Å; Y722-L724 VanDerWaalsContact O-N 3.09Å; L724-Y1400 VanDerWaalsContact O-CD1 3.29Å; L724-Y1400 WeakPolarHBondContact O-CD1 3.34Å
725	E	54.5	Low	62.9	Low	118 Å²	118	63.8 Å²	63.8	55%	0.551	33%	0.326	S	S	*	.	S	Bend	trans	-98.2	159.7	170.7	-67.3	-168.7	176	0	0	111.4	P1404	E725-P1404 HydrophobicContact CG-CG 4.29Å
726	G	59.8	Low	61.7	Low	21 Å²	21	70.2 Å²	70.2	22%	0.216	35%	0.353	C	S	.	.	S	Bend	trans	118.2	-132	-171.9	0	0	0	0	0	109.1	M1401	G726-M1401 PolarHBondContact O-N 2.83Å
727	T	53.4	Low	60.8	Low	19 Å²	19	74.3 Å²	74.3	12%	0.117	37%	0.369	C	S	.	.			trans	-144.2	145.5	-168.5	68	0	0	0	0	113.2	A729 Q730 T731 A1359 L1397	T727-A729 PolarHBondContact O-N 2.7Å; T727-A729 VanDerWaalsContact O-N 3.13Å; T727-Q730 CarbonylContact O-C 3.59Å; T727-Q730 VanDerWaalsContact O-C 3.25Å; T727-Q730 WeakPolarHBondContact O-CA 3.34Å; T727-Q730 WeakPolarHBondContact O-CB 3.15Å; T727-Q730 PolarHBondContact O-N 3Å; T727-Q730 WeakPolarHBondContact OG1-CB 3.38Å; T727-Q730 WeakPolarHBondContact OG1-CG 3.05Å; T727-Q730 PolarHBondContact OG1-OE1 3.27Å; T727-T731 PolarHBondContact O-N 3.43Å; T727-T731 PolarHBondContact O-OG1 3.07Å; T727-T731 VanDerWaalsContact O-OG1 3.13Å; T727-A1359 HydrophobicContact CG2-CB 4.34Å; T727-L1397 WeakPolarHBondContact CA-O 3.34Å; T727-L1397 VanDerWaalsContact CB-C 3.48Å; T727-L1397 VanDerWaalsContact CB-CD2 3.44Å; T727-L1397 HydrophobicContact CG2-CB 4.21Å; T727-L1397 WeakPolarHBondContact OG1-CD2 3.39Å
728	D	60.9	Low	60.3	Low	12 Å²	12	76.8 Å²	76.8	6%	0.064	37%	0.37	C	S	.	.	H	α-helix	trans	-37.9	-53.3	-179.5	-77.9	64.4	0	0	0	115.1	Q730 T731 L732 T1395 L1397 Y1400	D728-Q730 PolarHBondContact O-N 2.86Å; D728-T731 WeakPolarHBondContact CA-OG1 3.18Å; D728-T731 PolarHBondContact O-N 3.48Å; D728-L732 HydrophobicContact CB-CD1 4.22Å; D728-L732 CarbonylContact O-C 3.52Å; D728-L732 WeakPolarHBondContact O-CA 3.12Å; D728-L732 WeakPolarHBondContact O-CB 3.42Å; D728-L732 WeakPolarHBondContact O-CG 3.16Å; D728-L732 PolarHBondContact O-N 3.15Å; D728-T1395 VanDerWaalsContact CG-C 3.45Å; D728-T1395 WeakPolarHBondContact OD2-CA 3.49Å; D728-L1397 PolarHBondContact OD1-N 3.15Å; D728-Y1400 HydrophobicContact CB-CE2 4.37Å; D728-Y1400 WeakPolarHBondContact OD1-CD2 3.37Å; D728-Y1400 WeakPolarHBondContact OD1-CE2 3.15Å
729	A	52.8	Low	60	Low	65 Å²	65	72.6 Å²	72.6	54%	0.537	36%	0.363	S	S	.	.	H	α-helix	trans	-71.7	-12.2	177.4	0	0	0	0	0	114.6	T727 E733 L1397	T727-A729 PolarHBondContact O-N 2.7Å; T727-A729 VanDerWaalsContact O-N 3.13Å; A729-E733 WeakPolarHBondContact O-CA 3.47Å; A729-E733 WeakPolarHBondContact O-CB 3.46Å; A729-E733 WeakPolarHBondContact O-CG 3.17Å; A729-E733 PolarHBondContact O-N 2.95Å; A729-L1397 HydrophobicContact CB-CD2 3.75Å; A729-L1397 VanDerWaalsContact N-CD2 3.32Å
730	Q	49.6	Very low	60.1	Low	89 Å²	89	76.8 Å²	76.8	42%	0.416	39%	0.393	S	S	.	.	H	α-helix	trans	-101.3	-12.8	172.8	-65.7	176.5	-24.4	0	0	114.6	T727 D728	T727-Q730 CarbonylContact O-C 3.59Å; T727-Q730 VanDerWaalsContact O-C 3.25Å; T727-Q730 WeakPolarHBondContact O-CA 3.34Å; T727-Q730 WeakPolarHBondContact O-CB 3.15Å; T727-Q730 PolarHBondContact O-N 3Å; T727-Q730 WeakPolarHBondContact OG1-CB 3.38Å; T727-Q730 WeakPolarHBondContact OG1-CG 3.05Å; T727-Q730 PolarHBondContact OG1-OE1 3.27Å; D728-Q730 PolarHBondContact O-N 2.86Å
731	T	56.9	Low	60.8	Low	10 Å²	10	77.7 Å²	77.7	6%	0.061	40%	0.395	C	S	.	.	H	α-helix	trans	-114.7	-37.8	-179.6	59.3	0	0	0	0	110.9	R723 T727 D728 V734 Y1400	R723-T731 HydrophobicContact CB-CG2 4.4Å; R723-T731 WeakPolarHBondContact O-CB 3.44Å; R723-T731 VanDerWaalsContact O-CG2 3.25Å; R723-T731 WeakPolarHBondContact O-CG2 3.1Å; T727-T731 PolarHBondContact O-N 3.43Å; T727-T731 PolarHBondContact O-OG1 3.07Å; T727-T731 VanDerWaalsContact O-OG1 3.13Å; D728-T731 WeakPolarHBondContact CA-OG1 3.18Å; D728-T731 PolarHBondContact O-N 3.48Å; T731-V734 WeakPolarHBondContact O-CB 3.44Å; T731-V734 WeakPolarHBondContact O-CG2 3.48Å; T731-Y1400 HydrophobicContact CG2-CD1 4.39Å; T731-Y1400 HydrophobicContact CG2-CD2 4.44Å; T731-Y1400 HydrophobicContact CG2-CG 4.09Å; T731-Y1400 WeakPolarHBondContact OG1-CD2 3.25Å; T731-Y1400 WeakPolarHBondContact OG1-CE2 3.36Å
732	L	60.8	Low	62.1	Low	58 Å²	58	76.2 Å²	76.2	30%	0.304	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-84.1	9.8	156.9	-41.6	176.4	0	0	0	111.7	D728 V734 K735 K736	D728-L732 HydrophobicContact CB-CD1 4.22Å; D728-L732 CarbonylContact O-C 3.52Å; D728-L732 WeakPolarHBondContact O-CA 3.12Å; D728-L732 WeakPolarHBondContact O-CB 3.42Å; D728-L732 WeakPolarHBondContact O-CG 3.16Å; D728-L732 PolarHBondContact O-N 3.15Å; L732-V734 PolarHBondContact O-N 3.46Å; L732-K735 HydrophobicContact CB-CB 4.43Å; L732-K735 HydrophobicContact CB-CD 4.41Å; L732-K735 HydrophobicContact CB-CG 4.43Å; L732-K735 HydrophobicContact CD2-CD 4.15Å; L732-K735 CarbonylContact O-C 3.53Å; L732-K735 WeakPolarHBondContact O-CA 3.47Å; L732-K735 WeakPolarHBondContact O-CB 3.36Å; L732-K735 PolarHBondContact O-N 3.09Å; L732-K736 PolarHBondContact O-N 3.26Å
733	E	50	Low	63.3	Low	84 Å²	84	68.3 Å²	68.3	39%	0.393	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-58.4	-29.4	161.3	-140.9	157.6	-141.4	0	0	110.3	A729 K735 K736	A729-E733 WeakPolarHBondContact O-CA 3.47Å; A729-E733 WeakPolarHBondContact O-CB 3.46Å; A729-E733 WeakPolarHBondContact O-CG 3.17Å; A729-E733 PolarHBondContact O-N 2.95Å; E733-K735 PolarHBondContact O-N 3.1Å; E733-K736 WeakPolarHBondContact O-CB 3.42Å; E733-K736 PolarHBondContact O-N 2.67Å
734	V	53.1	Low	65	Low	32 Å²	32	62.8 Å²	62.8	19%	0.194	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-42.2	-45.2	159	162.4	0	0	0	0	113.1	D719 G721 T731 L732 K736 L768	D719-V734 WeakPolarHBondContact O-CA 3.38Å; D719-V734 WeakPolarHBondContact O-CB 3.14Å; D719-V734 VanDerWaalsContact O-CG1 3.26Å; D719-V734 WeakPolarHBondContact O-CG1 3.42Å; D719-V734 WeakPolarHBondContact O-CG2 3.39Å; G721-V734 VanDerWaalsContact CA-CG2 3.4Å; T731-V734 WeakPolarHBondContact O-CB 3.44Å; T731-V734 WeakPolarHBondContact O-CG2 3.48Å; L732-V734 PolarHBondContact O-N 3.46Å; V734-K736 VanDerWaalsContact C-N 3.32Å; V734-L768 HydrophobicContact CG1-CD2 4.35Å
735	K	58.9	Low	66.5	Low	113 Å²	113	56.1 Å²	56.1	49%	0.491	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-89.8	7.9	-179	-56.3	-174.6	-179.4	176.9	0	112.6	L732 E733 Y737 K738	L732-K735 HydrophobicContact CB-CB 4.43Å; L732-K735 HydrophobicContact CB-CD 4.41Å; L732-K735 HydrophobicContact CB-CG 4.43Å; L732-K735 HydrophobicContact CD2-CD 4.15Å; L732-K735 CarbonylContact O-C 3.53Å; L732-K735 WeakPolarHBondContact O-CA 3.47Å; L732-K735 WeakPolarHBondContact O-CB 3.36Å; L732-K735 PolarHBondContact O-N 3.09Å; E733-K735 PolarHBondContact O-N 3.1Å; K735-Y737 PolarHBondContact O-N 3.18Å; K735-K738 HydrophobicContact CB-CB 4.29Å; K735-K738 WeakPolarHBondContact O-CB 3.29Å; K735-K738 PolarHBondContact O-N 2.98Å; K735-K738 VanDerWaalsContact O-N 3.14Å
736	K	58	Low	68.4	Low	154 Å²	154	50.5 Å²	50.5	67%	0.67	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-65.5	-30.9	174.6	-173	-177.6	175.7	-173.7	0	111.9	L732 E733 V734 K738	L732-K736 PolarHBondContact O-N 3.26Å; E733-K736 WeakPolarHBondContact O-CB 3.42Å; E733-K736 PolarHBondContact O-N 2.67Å; V734-K736 VanDerWaalsContact C-N 3.32Å; K736-K738 PolarHBondContact O-N 3.04Å
737	Y	63.4	Low	69.8	Low	90 Å²	90	49.6 Å²	49.6	35%	0.353	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-84.9	4.3	175.7	-52.2	-70.4	0	0	0	113.1	R678 H682 K735	R678-Y737 PolarHBondContact NH2-OH 2.84Å; R678-Y737 VanDerWaalsContact NH2-OH 3.08Å; H682-Y737 HydrophobicContact CB-CD1 3.88Å; H682-Y737 HydrophobicContact CB-CE1 3.61Å; H682-Y737 AromaticContact CD2-CD1 3.98Å; H682-Y737 AromaticContact CE1-CE1 3.92Å; H682-Y737 AromaticContact CE1-CE2 3.56Å; H682-Y737 AromaticContact CE1-CZ 3.47Å; H682-Y737 VanDerWaalsContact CE1-CZ 3.47Å; H682-Y737 AromaticContact CG-CD1 3.69Å; H682-Y737 AromaticContact CG-CE1 3.41Å; H682-Y737 VanDerWaalsContact CG-CE1 3.41Å; H682-Y737 AromaticContact CG-CZ 3.77Å; H682-Y737 AromaticContact ND1-CD1 3.98Å; H682-Y737 AromaticContact ND1-CE1 3.3Å; H682-Y737 VanDerWaalsContact ND1-CE1 3.3Å; H682-Y737 WeakPolarHBondContact ND1-CE1 3.25Å; H682-Y737 AromaticContact ND1-CE2 3.76Å; H682-Y737 AromaticContact ND1-CZ 3.14Å; H682-Y737 PolarHBondContact ND1-OH 3.12Å; K735-Y737 PolarHBondContact O-N 3.18Å
738	K	66	Low	71.5	Confident	103 Å²	103	48.7 Å²	48.7	45%	0.448	25%	0.252	S	S	.	.			trans	-81	123.3	174.6	-164.8	-163.1	178.9	-171.9	0	109.6	K735 K736 E769	K735-K738 HydrophobicContact CB-CB 4.29Å; K735-K738 WeakPolarHBondContact O-CB 3.29Å; K735-K738 PolarHBondContact O-N 2.98Å; K735-K738 VanDerWaalsContact O-N 3.14Å; K736-K738 PolarHBondContact O-N 3.04Å; K738-E769 WeakPolarHBondContact CE-OE1 3.48Å; K738-E769 WeakPolarHBondContact CE-OE2 3.24Å; K738-E769 VanDerWaalsContact NZ-CD 3.35Å; K738-E769 IonicContact NZ-OE1 3.08Å; K738-E769 PolarHBondContact NZ-OE1 2.96Å; K738-E769 IonicContact NZ-OE2 3.21Å
739	G	70.1	Confident	72.7	Confident	27 Å²	27	48.2 Å²	48.2	28%	0.278	25%	0.249	S	C	.	.			trans	-140.3	172.8	177.8	0	0	0	0	0	113	R470 F741	R470-G739 VanDerWaalsContact NH2-C 3.29Å; G739-F741 PolarHBondContact O-N 3.3Å
740	S	75.8	Confident	74.2	Confident	104 Å²	104	45.1 Å²	45.1	73%	0.727	22%	0.224	S	C	*	.	S	Bend	trans	-59.2	-10.4	-164.7	-46.1	0	0	0	0	117.9
741	F	86.6	Confident	75.6	Confident	65 Å²	65	40.9 Å²	40.9	29%	0.285	20%	0.204	S	C	.	.	S	Bend	trans	-141.2	154.8	-175.2	-61.2	-70.2	0	0	0	108.7	I418 W468 R470 G739	I418-F741 HydrophobicContact CB-CD1 4.29Å; I418-F741 HydrophobicContact CB-CE1 4.28Å; I418-F741 HydrophobicContact CD1-CD1 4.24Å; I418-F741 HydrophobicContact CG2-CD1 4.44Å; I418-F741 HydrophobicContact CG2-CE1 4.19Å; W468-F741 HydrophobicContact CB-CB 4.34Å; W468-F741 HydrophobicContact CB-CD2 3.82Å; W468-F741 HydrophobicContact CB-CE2 4.22Å; W468-F741 HydrophobicContact CB-CG 3.99Å; W468-F741 AromaticContact CD1-CD1 3.89Å; W468-F741 AromaticContact CD1-CE1 3.81Å; W468-F741 HydrophobicContact CD2-CB 3.9Å; W468-F741 AromaticContact CD2-CD1 3.8Å; W468-F741 HydrophobicContact CD2-CD1 3.8Å; W468-F741 HydrophobicContact CD2-CE1 4.48Å; W468-F741 AromaticContact CD2-CG 3.86Å; W468-F741 HydrophobicContact CD2-CG 3.86Å; W468-F741 AromaticContact CE2-CD1 3.84Å; W468-F741 HydrophobicContact CE3-CB 3.71Å; W468-F741 HydrophobicContact CE3-CD1 4.4Å; W468-F741 HydrophobicContact CE3-CG 4.21Å; W468-F741 HydrophobicContact CG-CB 4.21Å; W468-F741 AromaticContact CG-CD1 3.84Å; W468-F741 HydrophobicContact CG-CD1 3.84Å; W468-F741 HydrophobicContact CG-CD2 4.03Å; W468-F741 HydrophobicContact CG-CE1 4.18Å; W468-F741 HydrophobicContact CG-CE2 4.35Å; W468-F741 AromaticContact CG-CG 3.77Å; W468-F741 HydrophobicContact CG-CG 3.77Å; W468-F741 HydrophobicContact CG-CZ 4.42Å; W468-F741 HydrophobicContact CZ2-CD1 4.45Å; W468-F741 HydrophobicContact CZ3-CB 4.29Å; W468-F741 AromaticContact NE1-CD1 3.89Å; W468-F741 AromaticContact NE1-CE1 3.9Å; R470-F741 HydrophobicContact CG-CB 4.13Å; R470-F741 PolarHBondContact NH2-O 3.2Å; G739-F741 PolarHBondContact O-N 3.3Å
742	P	88.9	Confident	76.4	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-81.9	142.1	-176.1	30.3	-28.8	0	0	0	111.4	I418 M437 L440 W468 I744 E769	I418-P742 HydrophobicContact CD1-CG 4.4Å; M437-P742 HydrophobicContact CE-CB 3.83Å; M437-P742 HydrophobicContact CE-CG 4.27Å; M437-P742 HydrophobicContact SD-CB 3.79Å; M437-P742 WeakPolarHBondContact SD-CD 3.23Å; M437-P742 HydrophobicContact SD-CG 3.7Å; L440-P742 HydrophobicContact CD1-CG 3.68Å; W468-P742 HydrophobicContact CH2-CG 3.99Å; W468-P742 HydrophobicContact CZ3-CG 3.85Å; P742-I744 PolarHBondContact O-N 2.93Å; P742-E769 WeakPolarHBondContact CA-O 3.45Å; P742-E769 WeakPolarHBondContact CB-O 3.29Å
743	Y	90.8	Very high	77.3	Confident	12 Å²	12	38.2 Å²	38.2	5%	0.047	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	126.2	162.9	-170.7	-78.7	0	0	0	107.9	G471 F472 T473 I681 R685 F770 S771	G471-Y743 VanDerWaalsContact C-CE2 3.44Å; F472-Y743 PolarHBondContact O-OH 3.25Å; T473-Y743 PolarHBondContact N-OH 2.68Å; T473-Y743 WeakPolarHBondContact OG1-CE1 3.46Å; T473-Y743 PolarHBondContact OG1-OH 3.24Å; I681-Y743 HydrophobicContact CB-CE2 4.44Å; I681-Y743 HydrophobicContact CG1-CE1 4.18Å; I681-Y743 HydrophobicContact CG1-CE2 4.49Å; I681-Y743 HydrophobicContact CG2-CD2 4.32Å; I681-Y743 HydrophobicContact CG2-CE2 4.34Å; I681-Y743 HydrophobicContact CG2-CG 4.42Å; R685-Y743 PolarHBondContact O-OH 3.06Å; Y743-F770 AromaticContact CD1-CD2 3.79Å; Y743-F770 HydrophobicContact CD1-CD2 3.79Å; Y743-F770 AromaticContact CD1-CE2 3.32Å; Y743-F770 HydrophobicContact CD1-CE2 3.32Å; Y743-F770 HydrophobicContact CD1-CZ 4.07Å; Y743-F770 AromaticContact CE1-CE2 3.87Å; Y743-F770 HydrophobicContact CE1-CE2 3.87Å; Y743-F770 HydrophobicContact CE1-CZ 4.38Å; Y743-F770 HydrophobicContact CG-CD2 4.22Å; Y743-F770 HydrophobicContact CG-CE2 4.12Å; Y743-S771 PolarHBondContact O-N 3.25Å
744	I	92.7	Very high	78.8	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.8	-176.7	-63.4	-176.4	0	0	0	109.7	F419 P465 W468 F472 T473 P742 I746 I773	F419-I744 HydrophobicContact CD2-CD1 4.14Å; F419-I744 HydrophobicContact CE2-CD1 3.87Å; P465-I744 HydrophobicContact CG-CD1 4.23Å; W468-I744 HydrophobicContact CH2-CD1 4.12Å; W468-I744 HydrophobicContact CZ3-CD1 3.84Å; W468-I744 HydrophobicContact CZ3-CG1 4.32Å; F472-I744 CarbonylContact C-O 3.57Å; F472-I744 WeakPolarHBondContact CA-O 3.29Å; F472-I744 HydrophobicContact CB-CB 4.31Å; F472-I744 VanDerWaalsContact CB-O 3.25Å; F472-I744 WeakPolarHBondContact CB-O 3.33Å; T473-I744 PolarHBondContact N-O 2.92Å; P742-I744 PolarHBondContact O-N 2.93Å; I744-I746 HydrophobicContact CG2-CD1 4.41Å; I744-I746 HydrophobicContact CG2-CG1 3.78Å; I744-I773 HydrophobicContact CG2-CD1 3.65Å; I744-I773 HydrophobicContact CG2-CG1 4.09Å
745	C	93.7	Very high	80	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	113.7	168.1	178.9	0	0	0	0	109.1	T473 Q712 F770 S771 L772 I773	T473-C745 CarbonylContact O-C 3.6Å; T473-C745 WeakPolarHBondContact O-CA 3.34Å; Q712-C745 PolarHBondContact NE2-SG 2.86Å; Q712-C745 VanDerWaalsContact NE2-SG 3.4Å; C745-F770 HydrophobicContact CB-CE1 3.61Å; C745-F770 HydrophobicContact CB-CZ 3.59Å; C745-S771 PolarHBondContact N-O 2.95Å; C745-L772 HydrophobicContact CB-CD2 4.11Å; C745-L772 CarbonylContact O-C 3.55Å; C745-L772 WeakPolarHBondContact O-CA 3.29Å; C745-I773 PolarHBondContact O-N 3.06Å
746	I	93.3	Very high	80.9	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	121.1	176.3	-51.8	-167.5	0	0	0	108.5	T458 L462 T473 F474 V475 I744 I773	T458-I746 HydrophobicContact CG2-CD1 4.31Å; T458-I746 HydrophobicContact CG2-CG2 3.93Å; L462-I746 HydrophobicContact CD2-CD1 3.6Å; L462-I746 HydrophobicContact CD2-CG1 4.43Å; L462-I746 HydrophobicContact CG-CD1 4.08Å; T473-I746 PolarHBondContact O-N 3.35Å; F474-I746 HydrophobicContact CD2-CB 3.82Å; F474-I746 HydrophobicContact CD2-CD1 4.04Å; F474-I746 HydrophobicContact CD2-CG1 4.3Å; F474-I746 HydrophobicContact CD2-CG2 4.08Å; F474-I746 HydrophobicContact CE2-CB 4.11Å; F474-I746 HydrophobicContact CE2-CD1 4.1Å; F474-I746 HydrophobicContact CE2-CG2 3.83Å; F474-I746 HydrophobicContact CG-CB 4.5Å; F474-I746 HydrophobicContact CZ-CG2 4.42Å; V475-I746 PolarHBondContact N-O 2.88Å; I744-I746 HydrophobicContact CG2-CD1 4.41Å; I744-I746 HydrophobicContact CG2-CG1 3.78Å; I746-I773 WeakPolarHBondContact CA-O 3.42Å; I746-I773 HydrophobicContact CG1-CB 4.3Å; I746-I773 HydrophobicContact CG1-CD1 4.44Å
747	L	90.8	Very high	82	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	91.7	173.8	-58.4	-177.5	0	0	0	107.9	V475 V750 Y753 I758 L772 I773 M774 T775	V475-L747 HydrophobicContact CB-CD2 3.8Å; V475-L747 HydrophobicContact CG2-CD2 3.55Å; L747-V750 HydrophobicContact CB-CB 4.17Å; L747-V750 HydrophobicContact CB-CG2 3.96Å; L747-V750 HydrophobicContact CD1-CG2 4.04Å; L747-Y753 WeakPolarHBondContact CA-OH 3.48Å; L747-I758 HydrophobicContact CD1-CD1 4.19Å; L747-I758 HydrophobicContact CD1-CG2 4.27Å; L747-L772 HydrophobicContact CD1-CD2 4.13Å; L747-I773 PolarHBondContact N-O 3.34Å; L747-M774 HydrophobicContact CD1-CG 4.28Å; L747-T775 PolarHBondContact O-N 2.88Å
748	D	89.3	Confident	83	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	136.8	177.9	-163.5	50.9	0	0	0	110.6	F474 V475 G477 V750 Y753 T775	F474-D748 HydrophobicContact CE1-CB 4.44Å; F474-D748 HydrophobicContact CZ-CB 4.44Å; V475-D748 PolarHBondContact O-N 3.08Å; G477-D748 PolarHBondContact N-O 2.9Å; D748-V750 VanDerWaalsContact C-N 3.28Å; D748-V750 PolarHBondContact O-N 2.97Å; D748-Y753 PolarHBondContact N-OH 3Å; D748-Y753 WeakPolarHBondContact O-CE1 3.31Å; D748-Y753 PolarHBondContact O-OH 3.01Å; D748-T775 HydrophobicContact CB-CG2 4.38Å; D748-T775 WeakPolarHBondContact OD1-CB 3.39Å; D748-T775 WeakPolarHBondContact OD1-CG2 3.17Å; D748-T775 PolarHBondContact OD1-OG1 2.56Å
749	E	84.4	Confident	83.8	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.009	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	40.3	-179.8	-158.6	52.6	-133	0	0	113.8	K454 K478 G751 A752 T775 Q777 R781	K454-E749 IonicContact NZ-OE2 3.35Å; K454-E749 PolarHBondContact NZ-OE2 3.44Å; K478-E749 HydrophobicContact CG-CB 4.22Å; K478-E749 HydrophobicContact CG-CG 4.3Å; E749-G751 PolarHBondContact O-N 3.04Å; E749-A752 WeakPolarHBondContact O-CB 3.23Å; E749-A752 PolarHBondContact O-N 3.43Å; E749-T775 PolarHBondContact N-O 3.4Å; E749-T775 PolarHBondContact N-OG1 3.39Å; E749-T775 VanDerWaalsContact N-OG1 3.13Å; E749-Q777 WeakPolarHBondContact OE1-CB 3.16Å; E749-Q777 PolarHBondContact OE1-N 2.88Å; E749-Q777 PolarHBondContact OE2-N 3.3Å; E749-R781 VanDerWaalsContact CG-NH1 3.32Å; E749-R781 IonicContact OE1-CZ 3.51Å; E749-R781 IonicContact OE1-NH1 3.51Å; E749-R781 PolarHBondContact OE1-NH1 3.05Å
750	V	84.8	Confident	84.3	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-53.1	-25.7	-169.5	76.7	0	0	0	0	115	L747 D748 A752 Y753 Y754 I758 M774 T775 I782	L747-V750 HydrophobicContact CB-CB 4.17Å; L747-V750 HydrophobicContact CB-CG2 3.96Å; L747-V750 HydrophobicContact CD1-CG2 4.04Å; D748-V750 VanDerWaalsContact C-N 3.28Å; D748-V750 PolarHBondContact O-N 2.97Å; V750-A752 PolarHBondContact O-N 3.13Å; V750-A752 VanDerWaalsContact O-N 3.15Å; V750-Y753 HydrophobicContact CG2-CE2 4.05Å; V750-Y753 PolarHBondContact O-N 3.24Å; V750-Y753 VanDerWaalsContact O-N 3.16Å; V750-Y754 HydrophobicContact CG2-CD2 4.39Å; V750-Y754 PolarHBondContact O-N 2.86Å; V750-I758 HydrophobicContact CG2-CD1 3.58Å; V750-M774 HydrophobicContact CG1-CB 4.45Å; V750-T775 WeakPolarHBondContact CG1-O 3.25Å; V750-T775 PolarHBondContact N-O 3.15Å; V750-I782 HydrophobicContact CG1-CD1 4.14Å
751	G	79.2	Confident	84.6	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.01	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-61.9	-16.3	175.7	0	0	0	0	0	114.7	E749	E749-G751 PolarHBondContact O-N 3.04Å
752	A	74.6	Confident	84.4	Confident	12 Å²	12	13.7 Å²	13.7	10%	0.099	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	-75.6	-23.5	175	0	0	0	0	0	113.9	E749 V750	E749-A752 WeakPolarHBondContact O-CB 3.23Å; E749-A752 PolarHBondContact O-N 3.43Å; V750-A752 PolarHBondContact O-N 3.13Å; V750-A752 VanDerWaalsContact O-N 3.15Å
753	Y	79.5	Confident	84	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.2	21.6	-172.1	56.5	-89.7	0	0	0	113.7	V475 I691 L747 D748 V750	V475-Y753 HydrophobicContact CG1-CE1 4.38Å; V475-Y753 HydrophobicContact CG1-CE2 3.9Å; I691-Y753 HydrophobicContact CD1-CD1 4.39Å; I691-Y753 HydrophobicContact CD1-CD2 4.4Å; I691-Y753 HydrophobicContact CD1-CG 4.25Å; L747-Y753 WeakPolarHBondContact CA-OH 3.48Å; D748-Y753 PolarHBondContact N-OH 3Å; D748-Y753 WeakPolarHBondContact O-CE1 3.31Å; D748-Y753 PolarHBondContact O-OH 3.01Å; V750-Y753 HydrophobicContact CG2-CE2 4.05Å; V750-Y753 PolarHBondContact O-N 3.24Å; V750-Y753 VanDerWaalsContact O-N 3.16Å
754	Y	81	Confident	83.4	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.008	12%	0.116	C	C	.	.			trans	-58.3	148.7	-174.3	-174.4	-91.7	0	0	0	113.7	V750 I758 I782 Q785 T786 L794	V750-Y754 HydrophobicContact CG2-CD2 4.39Å; V750-Y754 PolarHBondContact O-N 2.86Å; Y754-I758 HydrophobicContact CD2-CD1 3.8Å; Y754-I758 HydrophobicContact CE2-CB 4Å; Y754-I758 HydrophobicContact CE2-CD1 4.11Å; Y754-I758 HydrophobicContact CE2-CG2 4.32Å; Y754-I758 HydrophobicContact CG-CD1 4.49Å; Y754-I782 HydrophobicContact CD1-CG2 4.12Å; Y754-I782 HydrophobicContact CD2-CG2 3.88Å; Y754-I782 HydrophobicContact CE1-CG2 4.26Å; Y754-I782 HydrophobicContact CE2-CG2 4.02Å; Y754-I782 HydrophobicContact CG-CG2 3.94Å; Y754-Q785 HydrophobicContact CD1-CB 4.22Å; Y754-T786 HydrophobicContact CD1-CG2 3.84Å; Y754-T786 HydrophobicContact CE1-CG2 3.37Å; Y754-L794 HydrophobicContact CE2-CD2 3.72Å
755	T	77.8	Confident	82.8	Confident	22 Å²	22	21.6 Å²	21.6	14%	0.135	12%	0.116	C	C	.	.			trans	-146.8	148.5	169.6	165.1	0	0	0	0	110.4	R706 V709 R757 I758	R706-T755 HydrophobicContact CG-CG2 4.35Å; V709-T755 HydrophobicContact CB-CG2 3.9Å; V709-T755 HydrophobicContact CG1-CG2 3.6Å; T755-R757 HydrophobicContact CG2-CB 4Å; T755-R757 PolarHBondContact O-N 2.9Å; T755-R757 PolarHBondContact OG1-N 3.46Å; T755-I758 HydrophobicContact CG2-CD1 4.4Å; T755-I758 HydrophobicContact CG2-CG1 4.1Å; T755-I758 WeakPolarHBondContact O-CB 3.36Å; T755-I758 WeakPolarHBondContact O-CG1 3.19Å; T755-I758 PolarHBondContact O-N 3.31Å
756	D	78.3	Confident	82.1	Confident	72 Å²	72	26.2 Å²	26.2	39%	0.385	13%	0.134	S	C	.	.	H	α-helix	trans	-53.6	-22.7	173.4	-68.7	-29.7	0	0	0	113.1	I758 A759 V760 T786 N790	D756-I758 PolarHBondContact O-N 3.45Å; D756-A759 PolarHBondContact O-N 3.12Å; D756-A759 VanDerWaalsContact O-N 3.12Å; D756-V760 PolarHBondContact O-N 3.31Å; D756-T786 WeakPolarHBondContact OD1-CB 3.25Å; D756-T786 PolarHBondContact OD1-OG1 3Å; D756-N790 VanDerWaalsContact CG-ND2 3.3Å; D756-N790 PolarHBondContact OD1-ND2 3.5Å; D756-N790 PolarHBondContact OD2-ND2 2.73Å
757	R	81.5	Confident	81.2	Confident	81 Å²	81	29.8 Å²	29.8	31%	0.306	16%	0.159	S	C	.	.	H	α-helix	trans	-55.7	-35.2	171.3	-77.3	-75.4	174.3	-139.1	4.3	112.4	E542 V709 T755 A759 V760 E761	E542-R757 IonicContact OE1-CZ 3.95Å; E542-R757 IonicContact OE1-NE 3.03Å; E542-R757 PolarHBondContact OE1-NE 3.43Å; E542-R757 IonicContact OE1-NH2 3.31Å; E542-R757 PolarHBondContact OE1-NH2 3.18Å; E542-R757 IonicContact OE2-CZ 2.96Å; E542-R757 IonicContact OE2-NH2 3.17Å; E542-R757 PolarHBondContact OE2-NH2 2.95Å; V709-R757 HydrophobicContact CG1-CB 4.21Å; T755-R757 HydrophobicContact CG2-CB 4Å; T755-R757 PolarHBondContact O-N 2.9Å; T755-R757 PolarHBondContact OG1-N 3.46Å; R757-A759 PolarHBondContact O-N 3.29Å; R757-V760 PolarHBondContact O-N 3.28Å; R757-E761 WeakPolarHBondContact O-CB 3.39Å; R757-E761 PolarHBondContact O-N 2.93Å
758	I	84.4	Confident	80.5	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-63.1	-40.5	176.4	-56.7	175.6	0	0	0	111.2	V709 L747 V750 Y754 T755 D756 E761 A762 M774 L794	V709-I758 HydrophobicContact CG1-CD1 4.44Å; V709-I758 HydrophobicContact CG1-CG1 3.65Å; V709-I758 HydrophobicContact CG2-CD1 4.47Å; V709-I758 HydrophobicContact CG2-CG1 4.48Å; L747-I758 HydrophobicContact CD1-CD1 4.19Å; L747-I758 HydrophobicContact CD1-CG2 4.27Å; V750-I758 HydrophobicContact CG2-CD1 3.58Å; Y754-I758 HydrophobicContact CD2-CD1 3.8Å; Y754-I758 HydrophobicContact CE2-CB 4Å; Y754-I758 HydrophobicContact CE2-CD1 4.11Å; Y754-I758 HydrophobicContact CE2-CG2 4.32Å; Y754-I758 HydrophobicContact CG-CD1 4.49Å; T755-I758 HydrophobicContact CG2-CD1 4.4Å; T755-I758 HydrophobicContact CG2-CG1 4.1Å; T755-I758 WeakPolarHBondContact O-CB 3.36Å; T755-I758 WeakPolarHBondContact O-CG1 3.19Å; T755-I758 PolarHBondContact O-N 3.31Å; D756-I758 PolarHBondContact O-N 3.45Å; I758-E761 PolarHBondContact O-N 2.84Å; I758-A762 VanDerWaalsContact O-CB 3.24Å; I758-A762 WeakPolarHBondContact O-CB 3.48Å; I758-A762 PolarHBondContact O-N 3.18Å; I758-M774 HydrophobicContact CG2-SD 3.7Å; I758-L794 HydrophobicContact CG2-CD1 4.34Å
759	A	81.4	Confident	80.3	Confident	12 Å²	12	32.9 Å²	32.9	10%	0.099	17%	0.174	C	C	.	.	H	α-helix	trans	-68.9	-35.6	177.2	0	0	0	0	0	112.4	D756 R757 T763 L794	D756-A759 PolarHBondContact O-N 3.12Å; D756-A759 VanDerWaalsContact O-N 3.12Å; R757-A759 PolarHBondContact O-N 3.29Å; A759-T763 PolarHBondContact O-N 3.15Å; A759-T763 PolarHBondContact O-OG1 2.81Å; A759-L794 HydrophobicContact CB-CD1 4.11Å
760	V	80.9	Confident	80.4	Confident	54 Å²	54	33 Å²	33	33%	0.327	17%	0.174	S	C	.	.	H	α-helix	trans	-66.7	-45	172.9	178.9	0	0	0	0	110.6	D756 R757 T763 Q764	D756-V760 PolarHBondContact O-N 3.31Å; R757-V760 PolarHBondContact O-N 3.28Å; V760-T763 WeakPolarHBondContact O-CB 3.38Å; V760-T763 PolarHBondContact O-N 3.47Å; V760-Q764 HydrophobicContact CG1-CG 4.49Å; V760-Q764 WeakPolarHBondContact O-CG 3.35Å; V760-Q764 PolarHBondContact O-N 2.89Å; V760-Q764 VanDerWaalsContact O-N 3.15Å
761	E	82.6	Confident	80.7	Confident	7 Å²	7	33 Å²	33	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-59	-52.3	177.4	-161.4	175.4	129.7	0	0	110.6	S713 L716 R757 I758 T763 Q764 V765 L772	S713-E761 WeakPolarHBondContact CA-OE2 3.4Å; S713-E761 VanDerWaalsContact CB-OE2 3.29Å; S713-E761 WeakPolarHBondContact CB-OE2 3.45Å; S713-E761 PolarHBondContact N-OE2 3.24Å; S713-E761 PolarHBondContact OG-OE2 3.01Å; L716-E761 HydrophobicContact CD1-CG 4.35Å; R757-E761 WeakPolarHBondContact O-CB 3.39Å; R757-E761 PolarHBondContact O-N 2.93Å; I758-E761 PolarHBondContact O-N 2.84Å; E761-T763 PolarHBondContact O-N 3.45Å; E761-Q764 PolarHBondContact O-N 3.2Å; E761-V765 HydrophobicContact CB-CG1 4.44Å; E761-V765 HydrophobicContact CG-CB 4.36Å; E761-V765 HydrophobicContact CG-CG1 3.37Å; E761-V765 HydrophobicContact CG-CG2 4.1Å; E761-V765 WeakPolarHBondContact O-CG2 3.48Å; E761-V765 PolarHBondContact O-N 3.44Å; E761-L772 HydrophobicContact CB-CD1 4.26Å; E761-L772 HydrophobicContact CG-CD1 4.2Å
762	A	82.2	Confident	81.3	Confident	6 Å²	6	33 Å²	33	5%	0.05	17%	0.174	C	C	.	.	H	α-helix	trans	-63.6	-0.5	174.2	0	0	0	0	0	115.3	H443 I758 L772 L794	H443-A762 PolarHBondContact CD2-O 3.35Å; H443-A762 PolarHBondContact NE2-O 3.03Å; I758-A762 VanDerWaalsContact O-CB 3.24Å; I758-A762 WeakPolarHBondContact O-CB 3.48Å; I758-A762 PolarHBondContact O-N 3.18Å; A762-L772 HydrophobicContact CB-CD1 3.77Å; A762-L794 HydrophobicContact CB-CD1 4.19Å
763	T	79.9	Confident	82.1	Confident	84 Å²	84	32.5 Å²	32.5	52%	0.515	17%	0.17	S	C	.	.	H	α-helix	trans	-103	-28.9	169.6	-54	0	0	0	0	111.9	A759 V760 E761 N797	A759-T763 PolarHBondContact O-N 3.15Å; A759-T763 PolarHBondContact O-OG1 2.81Å; V760-T763 WeakPolarHBondContact O-CB 3.38Å; V760-T763 PolarHBondContact O-N 3.47Å; E761-T763 PolarHBondContact O-N 3.45Å; T763-N797 PolarHBondContact OG1-ND2 3.39Å
764	Q	78.8	Confident	82.6	Confident	92 Å²	92	32.5 Å²	32.5	43%	0.43	17%	0.17	S	C	.	.	H	α-helix	trans	-111.2	-37.2	-166.1	-63.5	-176.3	1.1	0	0	114.4	L720 V760 E761 R766 S767	L720-Q764 HydrophobicContact CD1-CB 3.83Å; V760-Q764 HydrophobicContact CG1-CG 4.49Å; V760-Q764 WeakPolarHBondContact O-CG 3.35Å; V760-Q764 PolarHBondContact O-N 2.89Å; V760-Q764 VanDerWaalsContact O-N 3.15Å; E761-Q764 PolarHBondContact O-N 3.2Å; Q764-R766 PolarHBondContact O-N 3.06Å; Q764-R766 VanDerWaalsContact O-N 3.13Å; Q764-S767 PolarHBondContact O-OG 3.02Å
765	V	79.3	Confident	83.1	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.018	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-73.6	-9	-170.1	-56.2	0	0	0	0	114.3	L716 E761 S767 L768 E769 F770	L716-V765 HydrophobicContact CB-CG1 3.99Å; L716-V765 HydrophobicContact CD1-CG1 3.9Å; E761-V765 HydrophobicContact CB-CG1 4.44Å; E761-V765 HydrophobicContact CG-CB 4.36Å; E761-V765 HydrophobicContact CG-CG1 3.37Å; E761-V765 HydrophobicContact CG-CG2 4.1Å; E761-V765 WeakPolarHBondContact O-CG2 3.48Å; E761-V765 PolarHBondContact O-N 3.44Å; V765-S767 PolarHBondContact O-N 2.67Å; V765-S767 VanDerWaalsContact O-N 3.1Å; V765-L768 WeakPolarHBondContact O-CA 3.46Å; V765-L768 WeakPolarHBondContact O-CB 3.42Å; V765-L768 PolarHBondContact O-N 2.79Å; V765-E769 PolarHBondContact O-N 3.05Å; V765-F770 HydrophobicContact CB-CB 3.96Å; V765-F770 HydrophobicContact CB-CD1 4.33Å; V765-F770 HydrophobicContact CB-CG 4.44Å; V765-F770 HydrophobicContact CG2-CB 3.88Å; V765-F770 HydrophobicContact CG2-CD1 3.72Å; V765-F770 HydrophobicContact CG2-CG 4.21Å
766	R	80.7	Confident	83.5	Confident	98 Å²	98	31.4 Å²	31.4	37%	0.37	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-50.6	-32.9	173.1	178.7	160.7	-162.5	-136.8	-11.7	113.5	D438 T441 Q764 E769	D438-R766 PolarHBondContact O-NH2 3.17Å; D438-R766 IonicContact OD1-NH2 2.67Å; T441-R766 WeakPolarHBondContact O-CB 3.22Å; T441-R766 WeakPolarHBondContact O-CD 3.44Å; T441-R766 WeakPolarHBondContact O-CG 3.27Å; T441-R766 PolarHBondContact O-NE 3.1Å; T441-R766 PolarHBondContact OG1-NE 2.92Å; Q764-R766 PolarHBondContact O-N 3.06Å; Q764-R766 VanDerWaalsContact O-N 3.13Å; R766-E769 PolarHBondContact O-N 3.47Å
767	S	73.9	Confident	83.7	Confident	75 Å²	75	30.4 Å²	30.4	52%	0.524	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-78.1	-14.2	177.1	48.3	0	0	0	0	115.2	L720 Q764 V765 E769	L720-S767 VanDerWaalsContact CD2-OG 3.27Å; L720-S767 WeakPolarHBondContact CD2-OG 3.39Å; Q764-S767 PolarHBondContact O-OG 3.02Å; V765-S767 PolarHBondContact O-N 2.67Å; V765-S767 VanDerWaalsContact O-N 3.1Å; S767-E769 VanDerWaalsContact C-N 3.31Å
768	L	76.8	Confident	83.5	Confident	25 Å²	25	28.5 Å²	28.5	13%	0.131	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-89.4	1	169.4	-59.7	178.2	0	0	0	112.1	L716 D719 L720 V734 V765 F770	L716-L768 HydrophobicContact CB-CD1 4.22Å; L716-L768 HydrophobicContact CD2-CD1 4.07Å; D719-L768 HydrophobicContact CB-CD1 4.12Å; L720-L768 HydrophobicContact CD2-CD1 4.12Å; L720-L768 HydrophobicContact CD2-CD2 4.13Å; L720-L768 HydrophobicContact CD2-CG 3.77Å; L720-L768 HydrophobicContact CG-CD1 4.1Å; L720-L768 HydrophobicContact CG-CG 4.3Å; V734-L768 HydrophobicContact CG1-CD2 4.35Å; V765-L768 WeakPolarHBondContact O-CA 3.46Å; V765-L768 WeakPolarHBondContact O-CB 3.42Å; V765-L768 PolarHBondContact O-N 2.79Å; L768-F770 PolarHBondContact O-N 2.93Å
769	E	83.9	Confident	83.2	Confident	41 Å²	41	29.3 Å²	29.3	19%	0.192	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	31	-174.1	-78.3	-174.4	179	0	0	114.3	M437 T441 K738 P742 V765 R766 S767	M437-E769 HydrophobicContact CE-CB 3.52Å; M437-E769 HydrophobicContact CE-CG 3.62Å; M437-E769 WeakPolarHBondContact CE-OE2 3.44Å; T441-E769 HydrophobicContact CG2-CB 4.43Å; T441-E769 HydrophobicContact CG2-CG 4.26Å; K738-E769 WeakPolarHBondContact CE-OE1 3.48Å; K738-E769 WeakPolarHBondContact CE-OE2 3.24Å; K738-E769 VanDerWaalsContact NZ-CD 3.35Å; K738-E769 IonicContact NZ-OE1 3.08Å; K738-E769 PolarHBondContact NZ-OE1 2.96Å; K738-E769 IonicContact NZ-OE2 3.21Å; P742-E769 WeakPolarHBondContact CA-O 3.45Å; P742-E769 WeakPolarHBondContact CB-O 3.29Å; V765-E769 PolarHBondContact O-N 3.05Å; R766-E769 PolarHBondContact O-N 3.47Å; S767-E769 VanDerWaalsContact C-N 3.31Å
770	F	86.9	Confident	82.9	Confident	5 Å²	5	33 Å²	33	2%	0.022	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	141.8	174.4	-164.9	-91.6	0	0	0	111.1	H443 I681 L716 Y743 C745 V765 L768 L772	H443-F770 PolarHBondContact CE1-O 2.73Å; I681-F770 HydrophobicContact CD1-CE2 4.3Å; I681-F770 HydrophobicContact CG2-CE2 4.23Å; L716-F770 HydrophobicContact CD1-CD1 4.27Å; L716-F770 HydrophobicContact CD1-CD2 4.29Å; L716-F770 HydrophobicContact CD1-CE1 3.98Å; L716-F770 HydrophobicContact CD1-CE2 4.01Å; L716-F770 HydrophobicContact CD1-CG 4.4Å; L716-F770 HydrophobicContact CD1-CZ 3.84Å; L716-F770 HydrophobicContact CD2-CD2 4.31Å; L716-F770 HydrophobicContact CD2-CE2 4.32Å; Y743-F770 AromaticContact CD1-CD2 3.79Å; Y743-F770 HydrophobicContact CD1-CD2 3.79Å; Y743-F770 AromaticContact CD1-CE2 3.32Å; Y743-F770 HydrophobicContact CD1-CE2 3.32Å; Y743-F770 HydrophobicContact CD1-CZ 4.07Å; Y743-F770 AromaticContact CE1-CE2 3.87Å; Y743-F770 HydrophobicContact CE1-CE2 3.87Å; Y743-F770 HydrophobicContact CE1-CZ 4.38Å; Y743-F770 HydrophobicContact CG-CD2 4.22Å; Y743-F770 HydrophobicContact CG-CE2 4.12Å; C745-F770 HydrophobicContact CB-CE1 3.61Å; C745-F770 HydrophobicContact CB-CZ 3.59Å; V765-F770 HydrophobicContact CB-CB 3.96Å; V765-F770 HydrophobicContact CB-CD1 4.33Å; V765-F770 HydrophobicContact CB-CG 4.44Å; V765-F770 HydrophobicContact CG2-CB 3.88Å; V765-F770 HydrophobicContact CG2-CD1 3.72Å; V765-F770 HydrophobicContact CG2-CG 4.21Å; L768-F770 PolarHBondContact O-N 2.93Å; F770-L772 HydrophobicContact CD1-CG 4.39Å; F770-L772 HydrophobicContact CE1-CD2 4.05Å; F770-L772 HydrophobicContact CE1-CG 4.26Å
771	S	90.5	Very high	82.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	93.3	-171.3	178.8	0	0	0	0	112.8	L440 Y743 C745 I773	L440-S771 PolarHBondContact O-OG 2.68Å; Y743-S771 PolarHBondContact O-N 3.25Å; C745-S771 PolarHBondContact N-O 2.95Å; S771-I773 PolarHBondContact O-N 3.46Å
772	L	91.5	Very high	82.6	Confident	1 Å²	1	35 Å²	35	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	125.4	167.2	-66.6	164.4	0	0	0	111.9	H443 V444 C745 L747 E761 A762 F770	H443-L772 WeakPolarHBondContact CA-O 3.22Å; H443-L772 HydrophobicContact CB-CB 4.27Å; H443-L772 WeakPolarHBondContact CB-O 3.45Å; H443-L772 PolarHBondContact ND1-N 2.76Å; V444-L772 PolarHBondContact N-O 3.06Å; C745-L772 HydrophobicContact CB-CD2 4.11Å; C745-L772 CarbonylContact O-C 3.55Å; C745-L772 WeakPolarHBondContact O-CA 3.29Å; L747-L772 HydrophobicContact CD1-CD2 4.13Å; E761-L772 HydrophobicContact CB-CD1 4.26Å; E761-L772 HydrophobicContact CG-CD1 4.2Å; A762-L772 HydrophobicContact CB-CD1 3.77Å; F770-L772 HydrophobicContact CD1-CG 4.39Å; F770-L772 HydrophobicContact CE1-CD2 4.05Å; F770-L772 HydrophobicContact CE1-CG 4.26Å
773	I	92.7	Very high	82.5	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	106	167.7	-56.1	-176.6	0	0	0	107	F419 V444 W461 I744 C745 I746 L747 S771	F419-I773 HydrophobicContact CZ-CD1 4.46Å; V444-I773 HydrophobicContact CB-CB 4.38Å; V444-I773 HydrophobicContact CB-CG1 4.14Å; V444-I773 HydrophobicContact CB-CG2 4.19Å; V444-I773 HydrophobicContact CG1-CG2 4.03Å; V444-I773 HydrophobicContact CG2-CG1 4.44Å; W461-I773 HydrophobicContact CE3-CD1 4.4Å; W461-I773 HydrophobicContact CE3-CG2 4.31Å; W461-I773 HydrophobicContact CZ3-CG2 4.06Å; I744-I773 HydrophobicContact CG2-CD1 3.65Å; I744-I773 HydrophobicContact CG2-CG1 4.09Å; C745-I773 PolarHBondContact O-N 3.06Å; I746-I773 WeakPolarHBondContact CA-O 3.42Å; I746-I773 HydrophobicContact CG1-CB 4.3Å; I746-I773 HydrophobicContact CG1-CD1 4.44Å; L747-I773 PolarHBondContact N-O 3.34Å; S771-I773 PolarHBondContact O-N 3.46Å
774	M	90.6	Very high	82.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.3	-177	-67.7	167.6	-72.3	0	0	109.8	H443 V444 M445 F446 L747 V750 I758 L794	H443-M774 HydrophobicContact CB-CE 4.4Å; V444-M774 PolarHBondContact O-N 3Å; M445-M774 WeakPolarHBondContact CA-O 3.43Å; M445-M774 HydrophobicContact CE-CB 4.16Å; M445-M774 HydrophobicContact SD-CB 3.6Å; M445-M774 HydrophobicContact SD-CE 4.25Å; F446-M774 PolarHBondContact N-O 3.22Å; L747-M774 HydrophobicContact CD1-CG 4.28Å; V750-M774 HydrophobicContact CG1-CB 4.45Å; I758-M774 HydrophobicContact CG2-SD 3.7Å; M774-L794 HydrophobicContact CE-CD1 4.1Å; M774-L794 HydrophobicContact CE-CG 4.34Å; M774-L794 HydrophobicContact SD-CD1 3.87Å; M774-L794 HydrophobicContact SD-CD2 4.1Å; M774-L794 HydrophobicContact SD-CG 4.23Å
775	T	90.2	Very high	82	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	144.3	168.1	111.2	0	0	0	0	110.2	F446 T458 L747 D748 E749 V750	F446-T775 VanDerWaalsContact O-CA 3.32Å; F446-T775 WeakPolarHBondContact O-CA 3.46Å; T458-T775 HydrophobicContact CG2-CG2 4.15Å; L747-T775 PolarHBondContact O-N 2.88Å; D748-T775 HydrophobicContact CB-CG2 4.38Å; D748-T775 WeakPolarHBondContact OD1-CB 3.39Å; D748-T775 WeakPolarHBondContact OD1-CG2 3.17Å; D748-T775 PolarHBondContact OD1-OG1 2.56Å; E749-T775 PolarHBondContact N-O 3.4Å; E749-T775 PolarHBondContact N-OG1 3.39Å; E749-T775 VanDerWaalsContact N-OG1 3.13Å; V750-T775 WeakPolarHBondContact CG1-O 3.25Å; V750-T775 PolarHBondContact N-O 3.15Å
776	A	86.3	Confident	81.8	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.008	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	152.5	171	0	0	0	0	0	109.5	M445 F446 F447 A448 K454 I782	M445-A776 HydrophobicContact CE-CB 3.73Å; F446-A776 PolarHBondContact O-N 3.37Å; F447-A776 HydrophobicContact CD1-CB 3.95Å; F447-A776 HydrophobicContact CE1-CB 3.82Å; A448-A776 PolarHBondContact N-O 3.2Å; K454-A776 PolarHBondContact NZ-O 2.92Å; K454-A776 VanDerWaalsContact NZ-O 3.12Å; A776-I782 HydrophobicContact CB-CD1 4.11Å
777	Q	82.9	Confident	81.5	Confident	51 Å²	51	33.7 Å²	33.7	24%	0.238	19%	0.187	C	C	.	.	S	Bend	trans	-73.9	-61.1	162.4	-154.2	-179.7	-103.6	0	0	109.2	T449 T450 E749	T449-Q777 HydrophobicContact CG2-CG 4.39Å; T450-Q777 VanDerWaalsContact N-OE1 3.15Å; T450-Q777 PolarHBondContact OG1-OE1 3.5Å; E749-Q777 WeakPolarHBondContact OE1-CB 3.16Å; E749-Q777 PolarHBondContact OE1-N 2.88Å; E749-Q777 PolarHBondContact OE2-N 3.3Å
778	D	76.2	Confident	81.7	Confident	41 Å²	41	32.8 Å²	32.8	22%	0.219	18%	0.184	C	C	.	.			trans	-132.3	134.7	-168.6	-56.5	-64	0	0	0	111.1	E780 R781 T812	D778-E780 PolarHBondContact O-N 3.42Å; D778-R781 WeakPolarHBondContact O-CB 3.37Å; D778-R781 PolarHBondContact O-N 3Å; D778-R781 VanDerWaalsContact O-N 3.12Å; D778-T812 WeakPolarHBondContact CA-OG1 3.31Å
779	Q	78.1	Confident	81.7	Confident	17 Å²	17	36.4 Å²	36.4	8%	0.079	21%	0.207	C	C	.	.	H	α-helix	trans	-57.8	-35.3	176.9	177.1	178.8	-38.7	0	0	111.7	F447 R781 I782 E783 T791 T812 T815	F447-Q779 HydrophobicContact CE1-CB 4.32Å; Q779-R781 PolarHBondContact O-N 2.98Å; Q779-I782 WeakPolarHBondContact O-CB 3.36Å; Q779-I782 PolarHBondContact O-N 3.42Å; Q779-E783 HydrophobicContact CG-CG 4.41Å; Q779-E783 PolarHBondContact NE2-OE1 3.13Å; Q779-E783 PolarHBondContact O-N 2.95Å; Q779-E783 VanDerWaalsContact O-N 3.08Å; Q779-T791 HydrophobicContact CG-CG2 3.88Å; Q779-T812 PolarHBondContact N-OG1 3.25Å; Q779-T815 PolarHBondContact OE1-OG1 3.04Å
780	E	76.5	Confident	81.4	Confident	91 Å²	91	36.9 Å²	36.9	43%	0.425	21%	0.211	S	C	.	.	H	α-helix	trans	-63.4	-26.2	-179.1	-53.4	-154.7	125.6	0	0	112.8	D778 I782 E783 G784 K811	D778-E780 PolarHBondContact O-N 3.42Å; E780-I782 VanDerWaalsContact C-N 3.29Å; E780-I782 PolarHBondContact O-N 3.02Å; E780-E783 CarbonylContact O-C 3.55Å; E780-E783 PolarHBondContact O-N 3.24Å; E780-G784 PolarHBondContact O-N 2.92Å; E780-K811 HydrophobicContact CG-CB 4.17Å; E780-K811 HydrophobicContact CG-CD 4.09Å; E780-K811 HydrophobicContact CG-CG 4.25Å; E780-K811 VanDerWaalsContact OE1-CD 3.3Å; E780-K811 WeakPolarHBondContact OE1-CD 3.38Å; E780-K811 WeakPolarHBondContact OE1-CE 3.46Å; E780-K811 WeakPolarHBondContact OE1-CG 3.25Å; E780-K811 IonicContact OE1-NZ 2.68Å; E780-K811 PolarHBondContact OE1-NZ 2.93Å
781	R	77.3	Confident	81	Confident	102 Å²	102	36.7 Å²	36.7	39%	0.385	21%	0.21	S	C	.	.	H	α-helix	trans	-67.2	-32.1	175.1	-158.8	-179.1	-175.7	173.1	5.3	111.8	E749 D778 Q779	E749-R781 VanDerWaalsContact CG-NH1 3.32Å; E749-R781 IonicContact OE1-CZ 3.51Å; E749-R781 IonicContact OE1-NH1 3.51Å; E749-R781 PolarHBondContact OE1-NH1 3.05Å; D778-R781 WeakPolarHBondContact O-CB 3.37Å; D778-R781 PolarHBondContact O-N 3Å; D778-R781 VanDerWaalsContact O-N 3.12Å; Q779-R781 PolarHBondContact O-N 2.98Å
782	I	80	Confident	80.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-76.3	-42.9	173.1	-57	172.9	0	0	0	110.1	M445 V750 Y754 A776 Q779 E780 G784 Q785 T786 T791	M445-I782 HydrophobicContact CE-CD1 3.91Å; V750-I782 HydrophobicContact CG1-CD1 4.14Å; Y754-I782 HydrophobicContact CD1-CG2 4.12Å; Y754-I782 HydrophobicContact CD2-CG2 3.88Å; Y754-I782 HydrophobicContact CE1-CG2 4.26Å; Y754-I782 HydrophobicContact CE2-CG2 4.02Å; Y754-I782 HydrophobicContact CG-CG2 3.94Å; A776-I782 HydrophobicContact CB-CD1 4.11Å; Q779-I782 WeakPolarHBondContact O-CB 3.36Å; Q779-I782 PolarHBondContact O-N 3.42Å; E780-I782 VanDerWaalsContact C-N 3.29Å; E780-I782 PolarHBondContact O-N 3.02Å; I782-G784 PolarHBondContact O-N 3.19Å; I782-G784 VanDerWaalsContact O-N 3.17Å; I782-Q785 PolarHBondContact O-N 2.97Å; I782-T786 HydrophobicContact CG2-CG2 4.14Å; I782-T786 PolarHBondContact O-N 2.97Å; I782-T791 HydrophobicContact CB-CG2 4.33Å; I782-T791 HydrophobicContact CG2-CG2 4.04Å
783	E	80.3	Confident	79.8	Confident	44 Å²	44	41.4 Å²	41.4	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-16.4	173.2	-62.5	178.1	-179.6	0	0	113.7	Q779 E780 T786 A788 T791 K811	Q779-E783 HydrophobicContact CG-CG 4.41Å; Q779-E783 PolarHBondContact NE2-OE1 3.13Å; Q779-E783 PolarHBondContact O-N 2.95Å; Q779-E783 VanDerWaalsContact O-N 3.08Å; E780-E783 CarbonylContact O-C 3.55Å; E780-E783 PolarHBondContact O-N 3.24Å; E783-T786 CarbonylContact C-O 3.55Å; E783-A788 HydrophobicContact CG-CB 4.42Å; E783-T791 HydrophobicContact CG-CG2 4.08Å; E783-K811 WeakPolarHBondContact OE2-CE 3.37Å; E783-K811 IonicContact OE2-NZ 3.67Å; E783-K811 PolarHBondContact OE2-NZ 2.97Å
784	G	74.2	Confident	79.3	Confident	59 Å²	59	41.3 Å²	41.3	61%	0.608	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-15.4	169.5	0	0	0	0	0	114.7	E780 I782	E780-G784 PolarHBondContact O-N 2.92Å; I782-G784 PolarHBondContact O-N 3.19Å; I782-G784 VanDerWaalsContact O-N 3.17Å
785	Q	73	Confident	78.8	Confident	78 Å²	78	42 Å²	42	36%	0.364	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-16	179.4	-59.4	-61.8	-49	0	0	113.1	Y754 I782	Y754-Q785 HydrophobicContact CD1-CB 4.22Å; I782-Q785 PolarHBondContact O-N 2.97Å
786	T	74.6	Confident	78.2	Confident	16 Å²	16	49.3 Å²	49.3	10%	0.098	28%	0.281	C	S	.	.	S	Bend	trans	-149	169.6	177.9	-169.7	0	0	0	0	112.4	Y754 D756 I782 E783 N790 T791	Y754-T786 HydrophobicContact CD1-CG2 3.84Å; Y754-T786 HydrophobicContact CE1-CG2 3.37Å; D756-T786 WeakPolarHBondContact OD1-CB 3.25Å; D756-T786 PolarHBondContact OD1-OG1 3Å; I782-T786 HydrophobicContact CG2-CG2 4.14Å; I782-T786 PolarHBondContact O-N 2.97Å; E783-T786 CarbonylContact C-O 3.55Å; T786-N790 HydrophobicContact CG2-CB 4.07Å; T786-N790 WeakPolarHBondContact OG1-CB 3.46Å; T786-N790 PolarHBondContact OG1-ND2 3.27Å; T786-N790 VanDerWaalsContact OG1-ND2 3.14Å; T786-T791 WeakPolarHBondContact CG2-OG1 3.42Å
787	S	76.1	Confident	77.8	Confident	58 Å²	58	51.8 Å²	51.8	41%	0.406	29%	0.294	S	S	.	.			trans	-62.9	143.5	173.5	76.9	0	0	0	0	111.8	T789 N790 T791	S787-T789 PolarHBondContact O-N 3.21Å; S787-N790 PolarHBondContact O-N 2.89Å; S787-N790 PolarHBondContact OG-N 3.1Å; S787-N790 PolarHBondContact OG-OD1 3.21Å; S787-T791 PolarHBondContact O-N 3.25Å; S787-T791 VanDerWaalsContact O-N 3.13Å; S787-T791 PolarHBondContact O-OG1 3.16Å
788	A	77.6	Confident	77.8	Confident	57 Å²	57	49.4 Å²	49.4	47%	0.471	28%	0.283	S	S	.	.	H	α-helix	trans	-56.8	-24.6	176	0	0	0	0	0	113.3	E783 A792	E783-A788 HydrophobicContact CG-CB 4.42Å; A788-A792 VanDerWaalsContact O-CB 3.31Å; A788-A792 WeakPolarHBondContact O-CB 3.3Å; A788-A792 PolarHBondContact O-N 3.19Å
789	T	77.2	Confident	78.1	Confident	101 Å²	101	49 Å²	49	62%	0.62	29%	0.288	S	S	*	.	H	α-helix	trans	-66.5	-41.9	173	-49.1	0	0	0	0	112.2	S787 A792 T793	S787-T789 PolarHBondContact O-N 3.21Å; T789-A792 PolarHBondContact O-N 3.08Å; T789-T793 PolarHBondContact O-N 2.9Å; T789-T793 PolarHBondContact O-OG1 3.05Å
790	N	77.2	Confident	78.6	Confident	51 Å²	51	48.3 Å²	48.3	27%	0.273	29%	0.285	S	S	.	.	H	α-helix	trans	-69.1	-42	176.5	-67.2	1.3	0	0	0	110.4	D756 T786 S787 A792 T793 L794	D756-N790 VanDerWaalsContact CG-ND2 3.3Å; D756-N790 PolarHBondContact OD1-ND2 3.5Å; D756-N790 PolarHBondContact OD2-ND2 2.73Å; T786-N790 HydrophobicContact CG2-CB 4.07Å; T786-N790 WeakPolarHBondContact OG1-CB 3.46Å; T786-N790 PolarHBondContact OG1-ND2 3.27Å; T786-N790 VanDerWaalsContact OG1-ND2 3.14Å; S787-N790 PolarHBondContact O-N 2.89Å; S787-N790 PolarHBondContact OG-N 3.1Å; S787-N790 PolarHBondContact OG-OD1 3.21Å; N790-A792 VanDerWaalsContact C-N 3.35Å; N790-A792 PolarHBondContact O-N 2.04Å; N790-T793 WeakPolarHBondContact O-CB 3Å; N790-T793 PolarHBondContact O-N 2.89Å; N790-L794 PolarHBondContact O-N 3.35Å
791	T	79.1	Confident	79.3	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.3	-45.7	171.5	-50.6	0	0	0	0	111.6	Q779 I782 E783 T786 S787 T793 L794 M795	Q779-T791 HydrophobicContact CG-CG2 3.88Å; I782-T791 HydrophobicContact CB-CG2 4.33Å; I782-T791 HydrophobicContact CG2-CG2 4.04Å; E783-T791 HydrophobicContact CG-CG2 4.08Å; T786-T791 WeakPolarHBondContact CG2-OG1 3.42Å; S787-T791 PolarHBondContact O-N 3.25Å; S787-T791 VanDerWaalsContact O-N 3.13Å; S787-T791 PolarHBondContact O-OG1 3.16Å; T791-T793 VanDerWaalsContact C-N 3.33Å; T791-T793 PolarHBondContact O-N 3.49Å; T791-L794 WeakPolarHBondContact O-CB 3.48Å; T791-L794 PolarHBondContact O-N 3.43Å; T791-M795 WeakPolarHBondContact O-CG 3.38Å; T791-M795 PolarHBondContact O-N 2.8Å
792	A	78	Confident	79.9	Confident	44 Å²	44	41.3 Å²	41.3	36%	0.364	26%	0.256	S	S	.	.	H	α-helix	trans	-62.9	-38	176.8	0	0	0	0	0	112.5	A788 T789 N790 M795 Q796	A788-A792 VanDerWaalsContact O-CB 3.31Å; A788-A792 WeakPolarHBondContact O-CB 3.3Å; A788-A792 PolarHBondContact O-N 3.19Å; T789-A792 PolarHBondContact O-N 3.08Å; N790-A792 VanDerWaalsContact C-N 3.35Å; N790-A792 PolarHBondContact O-N 2.04Å; A792-M795 PolarHBondContact O-N 3.05Å; A792-Q796 WeakPolarHBondContact O-CG 3.33Å; A792-Q796 PolarHBondContact O-N 3.19Å
793	T	77.2	Confident	80.4	Confident	56 Å²	56	41.4 Å²	41.4	34%	0.344	26%	0.257	S	S	.	.	H	α-helix	trans	-65.1	-43.1	175.7	-55.2	0	0	0	0	111	T789 N790 T791 M795 Q796 N797	T789-T793 PolarHBondContact O-N 2.9Å; T789-T793 PolarHBondContact O-OG1 3.05Å; N790-T793 WeakPolarHBondContact O-CB 3Å; N790-T793 PolarHBondContact O-N 2.89Å; T791-T793 VanDerWaalsContact C-N 3.33Å; T791-T793 PolarHBondContact O-N 3.49Å; T793-M795 VanDerWaalsContact C-N 3.33Å; T793-M795 PolarHBondContact O-N 2.8Å; T793-Q796 PolarHBondContact O-N 2.95Å; T793-Q796 VanDerWaalsContact O-N 3.15Å; T793-N797 PolarHBondContact O-N 3.18Å
794	L	82	Confident	80.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.7	-44.4	173.5	-168.7	74.8	0	0	0	111.5	Y754 I758 A759 A762 M774 N790 T791 Q796 N797 A798	Y754-L794 HydrophobicContact CE2-CD2 3.72Å; I758-L794 HydrophobicContact CG2-CD1 4.34Å; A759-L794 HydrophobicContact CB-CD1 4.11Å; A762-L794 HydrophobicContact CB-CD1 4.19Å; M774-L794 HydrophobicContact CE-CD1 4.1Å; M774-L794 HydrophobicContact CE-CG 4.34Å; M774-L794 HydrophobicContact SD-CD1 3.87Å; M774-L794 HydrophobicContact SD-CD2 4.1Å; M774-L794 HydrophobicContact SD-CG 4.23Å; N790-L794 PolarHBondContact O-N 3.35Å; T791-L794 WeakPolarHBondContact O-CB 3.48Å; T791-L794 PolarHBondContact O-N 3.43Å; L794-Q796 VanDerWaalsContact C-N 3.31Å; L794-Q796 PolarHBondContact O-N 3.43Å; L794-N797 PolarHBondContact O-N 2.81Å; L794-A798 PolarHBondContact O-N 2.98Å; L794-A798 VanDerWaalsContact O-N 3.15Å
795	M	80.6	Confident	81.4	Confident	14 Å²	14	41.6 Å²	41.6	7%	0.069	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-30.7	176.4	-65.6	-50.1	104.5	0	0	113	M445 F447 T791 A792 T793 K801	M445-M795 HydrophobicContact CE-CE 4.03Å; M445-M795 HydrophobicContact CG-CE 4.05Å; M445-M795 HydrophobicContact CG-SD 4Å; M445-M795 HydrophobicContact SD-CE 3.71Å; M445-M795 HydrophobicContact SD-SD 4.45Å; F447-M795 HydrophobicContact CE2-SD 3.77Å; F447-M795 HydrophobicContact CZ-CE 4.2Å; F447-M795 HydrophobicContact CZ-SD 3.62Å; T791-M795 WeakPolarHBondContact O-CG 3.38Å; T791-M795 PolarHBondContact O-N 2.8Å; A792-M795 PolarHBondContact O-N 3.05Å; T793-M795 VanDerWaalsContact C-N 3.33Å; T793-M795 PolarHBondContact O-N 2.8Å; M795-K801 WeakPolarHBondContact O-CE 3.35Å; M795-K801 PolarHBondContact O-NZ 3.29Å
796	Q	77.2	Confident	81.9	Confident	155 Å²	155	38.6 Å²	38.6	72%	0.724	22%	0.224	S	C	*	.	H	α-helix	trans	-75.5	-37.9	176.5	-75.1	177.1	2.4	0	0	112.2	A792 T793 L794	A792-Q796 WeakPolarHBondContact O-CG 3.33Å; A792-Q796 PolarHBondContact O-N 3.19Å; T793-Q796 PolarHBondContact O-N 2.95Å; T793-Q796 VanDerWaalsContact O-N 3.15Å; L794-Q796 VanDerWaalsContact C-N 3.31Å; L794-Q796 PolarHBondContact O-N 3.43Å
797	N	78.2	Confident	82.1	Confident	53 Å²	53	42.7 Å²	42.7	28%	0.283	25%	0.249	S	C	.	.	H	α-helix	trans	-66.6	-40.4	177.1	-75.2	-9.7	0	0	0	112.3	T763 T793 L794 G799	T763-N797 PolarHBondContact OG1-ND2 3.39Å; T793-N797 PolarHBondContact O-N 3.18Å; L794-N797 PolarHBondContact O-N 2.81Å; N797-G799 PolarHBondContact O-N 2.86Å
798	A	82.8	Confident	81.9	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.008	25%	0.245	C	C	.	.			trans	-63.5	99.6	-179.8	0	0	0	0	0	112.7	R442 M445 L794 T800 K801	R442-A798 CarbonylContact O-C 3.46Å; R442-A798 WeakPolarHBondContact O-CA 2.99Å; M445-A798 HydrophobicContact CB-CB 4.01Å; L794-A798 PolarHBondContact O-N 2.98Å; L794-A798 VanDerWaalsContact O-N 3.15Å; A798-T800 PolarHBondContact O-N 3.16Å; A798-K801 PolarHBondContact O-NZ 3.44Å
799	G	83.8	Confident	81.4	Confident	32 Å²	32	42.8 Å²	42.8	33%	0.33	24%	0.241	S	C	.	.			trans	-70.9	-27.2	-170.7	0	0	0	0	0	115.5	R442 H443 N797	R442-G799 PolarHBondContact O-N 3.42Å; H443-G799 PolarHBondContact O-N 3.1Å; N797-G799 PolarHBondContact O-N 2.86Å
800	T	88.7	Confident	81.3	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	134.9	173.9	-53.2	0	0	0	0	109.6	L435 H443 M445 A798 F802 T871 F873	L435-T800 HydrophobicContact CD1-CG2 4.41Å; L435-T800 HydrophobicContact CD2-CG2 4.49Å; H443-T800 PolarHBondContact O-N 3.19Å; M445-T800 PolarHBondContact N-O 3.19Å; A798-T800 PolarHBondContact O-N 3.16Å; T800-F802 HydrophobicContact CG2-CE1 4.44Å; T800-F802 HydrophobicContact CG2-CE2 3.89Å; T800-F802 HydrophobicContact CG2-CZ 3.85Å; T800-T871 HydrophobicContact CG2-CG2 4.04Å; T800-F873 HydrophobicContact CG2-CD2 4.29Å
801	K	90.2	Very high	81.3	Confident	44 Å²	44	42.6 Å²	42.6	19%	0.191	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.9	-178.2	-64.1	173.4	175.3	64.5	0	110.2	M445 M795 A798 A819 V872	M445-K801 WeakPolarHBondContact O-CA 3.29Å; M795-K801 WeakPolarHBondContact O-CE 3.35Å; M795-K801 PolarHBondContact O-NZ 3.29Å; A798-K801 PolarHBondContact O-NZ 3.44Å; K801-A819 HydrophobicContact CD-CB 4.01Å; K801-V872 HydrophobicContact CB-CB 4.3Å; K801-V872 PolarHBondContact N-O 3.03Å; K801-V872 PolarHBondContact O-N 2.96Å
802	F	91	Very high	81.2	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.2	175.1	-62	-77.6	0	0	0	109.7	V421 L435 V444 M445 F446 F447 W461 T800 F869 T871	V421-F802 HydrophobicContact CG1-CE1 3.58Å; V421-F802 HydrophobicContact CG1-CZ 3.76Å; V421-F802 HydrophobicContact CG2-CZ 4.34Å; L435-F802 HydrophobicContact CD1-CZ 4.34Å; V444-F802 HydrophobicContact CG1-CD2 3.46Å; V444-F802 VanDerWaalsContact CG1-CD2 3.46Å; V444-F802 HydrophobicContact CG1-CE2 3.45Å; V444-F802 VanDerWaalsContact CG1-CE2 3.45Å; V444-F802 HydrophobicContact CG2-CE2 4.46Å; M445-F802 PolarHBondContact O-N 3.03Å; F446-F802 WeakPolarHBondContact CA-O 3.48Å; F446-F802 HydrophobicContact CB-CB 4.24Å; F446-F802 HydrophobicContact CD2-CB 3.54Å; F446-F802 HydrophobicContact CE2-CB 4.16Å; F446-F802 HydrophobicContact CG-CB 4.07Å; F447-F802 PolarHBondContact N-O 3.45Å; W461-F802 HydrophobicContact CH2-CD1 4.44Å; W461-F802 AromaticContact CH2-CD2 3.52Å; W461-F802 HydrophobicContact CH2-CD2 3.52Å; W461-F802 HydrophobicContact CH2-CE1 4.47Å; W461-F802 AromaticContact CH2-CE2 3.59Å; W461-F802 HydrophobicContact CH2-CE2 3.59Å; W461-F802 AromaticContact CH2-CG 3.97Å; W461-F802 HydrophobicContact CH2-CG 3.97Å; W461-F802 HydrophobicContact CH2-CZ 4.08Å; W461-F802 HydrophobicContact CZ2-CD1 4.5Å; W461-F802 HydrophobicContact CZ2-CD2 4.25Å; W461-F802 HydrophobicContact CZ2-CE1 4.28Å; W461-F802 HydrophobicContact CZ2-CE2 4.05Å; W461-F802 HydrophobicContact CZ2-CG 4.46Å; W461-F802 HydrophobicContact CZ2-CZ 4.05Å; W461-F802 HydrophobicContact CZ3-CD2 4.36Å; W461-F802 HydrophobicContact CZ3-CE2 4.36Å; T800-F802 HydrophobicContact CG2-CE1 4.44Å; T800-F802 HydrophobicContact CG2-CE2 3.89Å; T800-F802 HydrophobicContact CG2-CZ 3.85Å; F802-F869 AromaticContact CD1-CD2 3.55Å; F802-F869 HydrophobicContact CD1-CD2 3.55Å; F802-F869 AromaticContact CD1-CE2 3.5Å; F802-F869 HydrophobicContact CD1-CE2 3.5Å; F802-F869 VanDerWaalsContact CD1-CE2 3.5Å; F802-F869 HydrophobicContact CD1-CZ 4.45Å; F802-F869 HydrophobicContact CE1-CD2 4.22Å; F802-F869 AromaticContact CE1-CE2 3.71Å; F802-F869 HydrophobicContact CE1-CE2 3.71Å; F802-F869 HydrophobicContact CG-CD2 4.43Å; F802-T871 HydrophobicContact CD1-CG2 3.91Å; F802-T871 HydrophobicContact CE1-CG2 3.45Å; F802-T871 VanDerWaalsContact CE1-CG2 3.45Å; F802-T871 VanDerWaalsContact CE1-OG1 3.3Å; F802-T871 WeakPolarHBondContact CE1-OG1 3.32Å; F802-T871 HydrophobicContact CZ-CG2 4.17Å
803	A	89.4	Confident	81.3	Confident	3 Å²	3	40.8 Å²	40.8	3%	0.025	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	101.6	175.3	0	0	0	0	0	109.1	V816 L861 F869 F870	A803-V816 HydrophobicContact CB-CB 4.36Å; A803-V816 HydrophobicContact CB-CG1 3.51Å; A803-V816 HydrophobicContact CB-CG2 3.89Å; A803-L861 HydrophobicContact CB-CD2 3.87Å; A803-F869 CarbonylContact O-C 3.51Å; A803-F869 VanDerWaalsContact O-CA 3.23Å; A803-F869 WeakPolarHBondContact O-CA 3.11Å; A803-F869 VanDerWaalsContact O-CB 3.28Å; A803-F869 WeakPolarHBondContact O-CB 3.45Å; A803-F870 PolarHBondContact N-O 3.46Å; A803-F870 PolarHBondContact O-N 2.63Å
804	G	88.2	Confident	81.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.			trans	-86	-161.2	170.7	0	0	0	0	0	111.2	F447 L864	F447-G804 PolarHBondContact O-N 2.89Å; G804-L864 VanDerWaalsContact C-CD1 3.41Å
805	R	88.1	Confident	81.1	Confident	107 Å²	107	46 Å²	46	40%	0.404	23%	0.234	S	C	.	.			trans	-59.1	137.8	-177.5	-162.9	-174.2	-169.5	176.7	-0.1	112.7	A448 T449 L861 I862 L864	A448-R805 CarbonylContact C-O 3.48Å; A448-R805 WeakPolarHBondContact CA-O 3.5Å; A448-R805 WeakPolarHBondContact CB-O 3.22Å; T449-R805 PolarHBondContact N-O 3.13Å; T449-R805 PolarHBondContact OG1-O 2.9Å; R805-L861 WeakPolarHBondContact CA-O 3.33Å; R805-I862 PolarHBondContact NE-O 2.95Å; R805-I862 VanDerWaalsContact NE-O 3.15Å; R805-L864 HydrophobicContact CB-CB 4.05Å; R805-L864 WeakPolarHBondContact CD-O 3.46Å; R805-L864 HydrophobicContact CG-CB 4.34Å; R805-L864 VanDerWaalsContact CG-O 3.32Å; R805-L864 WeakPolarHBondContact CG-O 3.29Å; R805-L864 PolarHBondContact NE-O 2.71Å
806	I	83.9	Confident	81.1	Confident	14 Å²	14	45.9 Å²	45.9	7%	0.072	23%	0.234	C	C	.	.			trans	-126.1	172.4	169.4	67.4	-176.8	0	0	0	111.2	A813 V858 L861 I862	I806-A813 HydrophobicContact CD1-CB 3.66Å; I806-V858 HydrophobicContact CD1-CG1 4.1Å; I806-L861 HydrophobicContact CD1-CB 3.64Å; I806-L861 HydrophobicContact CD1-CD1 3.74Å; I806-L861 HydrophobicContact CD1-CG 4.35Å; I806-L861 HydrophobicContact CG1-CB 3.68Å; I806-L861 PolarHBondContact N-O 3.12Å; I806-I862 HydrophobicContact CG1-CG1 3.98Å; I806-I862 WeakPolarHBondContact O-CA 3.39Å
807	V	78.1	Confident	81.4	Confident	102 Å²	102	42.1 Å²	42.1	62%	0.618	22%	0.215	S	C	*	.	S	Bend	trans	-111.2	-26.7	-179.3	170.5	0	0	0	0	113.1	T449	T449-V807 HydrophobicContact CG2-CB 4.26Å; T449-V807 HydrophobicContact CG2-CG2 3.95Å
808	S	72.3	Confident	81.5	Confident	47 Å²	47	45.8 Å²	45.8	33%	0.329	24%	0.235	S	C	.	.	S	Bend	trans	-148.2	157.8	-165.5	26.6	0	0	0	0	113.5	D810	S808-D810 WeakPolarHBondContact CB-OD2 3.36Å; S808-D810 PolarHBondContact O-N 3.03Å; S808-D810 PolarHBondContact OG-OD2 3.4Å
809	D	67.2	Low	81.3	Confident	71 Å²	71	47.5 Å²	47.5	38%	0.38	25%	0.249	S	C	.	.			trans	-80.5	56.9	175.7	180	44.5	0	0	0	112.1	R814 V858	D809-R814 PolarHBondContact O-NE 3.1Å; D809-R814 PolarHBondContact O-NH2 2.97Å; D809-R814 VanDerWaalsContact O-NH2 3.08Å; D809-R814 IonicContact OD1-NE 2.83Å; D809-R814 PolarHBondContact OD1-NE 2.79Å; D809-R814 IonicContact OD2-CZ 3.41Å; D809-R814 IonicContact OD2-NE 3.79Å; D809-R814 PolarHBondContact OD2-NE 2.98Å; D809-R814 VanDerWaalsContact OD2-NE 3.14Å; D809-R814 IonicContact OD2-NH2 3.02Å; D809-R814 PolarHBondContact OD2-NH2 2.85Å; D809-V858 HydrophobicContact CB-CG1 4.08Å
810	D	73.3	Confident	81.2	Confident	61 Å²	61	46 Å²	46	33%	0.326	23%	0.234	S	C	.	.	S	Bend	trans	-84.9	179.3	179.7	-56.3	-43.5	0	0	0	111.3	S808 T812 A813 R814	S808-D810 WeakPolarHBondContact CB-OD2 3.36Å; S808-D810 PolarHBondContact O-N 3.03Å; S808-D810 PolarHBondContact OG-OD2 3.4Å; D810-T812 PolarHBondContact O-N 3.23Å; D810-T812 VanDerWaalsContact O-N 3.1Å; D810-A813 WeakPolarHBondContact O-CB 3.49Å; D810-A813 PolarHBondContact O-N 3.28Å; D810-R814 PolarHBondContact O-N 3.03Å
811	K	77.6	Confident	80.9	Confident	87 Å²	87	47.2 Å²	47.2	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-50.2	-39.7	176.4	-70.5	-166.5	-163	122.4	0	112.3	E780 E783 A813 R814 T815	E780-K811 HydrophobicContact CG-CB 4.17Å; E780-K811 HydrophobicContact CG-CD 4.09Å; E780-K811 HydrophobicContact CG-CG 4.25Å; E780-K811 VanDerWaalsContact OE1-CD 3.3Å; E780-K811 WeakPolarHBondContact OE1-CD 3.38Å; E780-K811 WeakPolarHBondContact OE1-CE 3.46Å; E780-K811 WeakPolarHBondContact OE1-CG 3.25Å; E780-K811 IonicContact OE1-NZ 2.68Å; E780-K811 PolarHBondContact OE1-NZ 2.93Å; E783-K811 WeakPolarHBondContact OE2-CE 3.37Å; E783-K811 IonicContact OE2-NZ 3.67Å; E783-K811 PolarHBondContact OE2-NZ 2.97Å; K811-A813 VanDerWaalsContact C-N 3.35Å; K811-A813 PolarHBondContact O-N 2.93Å; K811-R814 PolarHBondContact O-N 3.42Å; K811-T815 PolarHBondContact O-N 3.03Å; K811-T815 PolarHBondContact O-OG1 2.8Å
812	T	77.4	Confident	80.5	Confident	4 Å²	4	51 Å²	51	3%	0.025	26%	0.264	C	S	.	.	H	α-helix	trans	-54.9	-47.5	177.7	-41.8	0	0	0	0	112	F447 D778 Q779 D810 R814 T815 V816	F447-T812 HydrophobicContact CB-CG2 3.88Å; F447-T812 HydrophobicContact CD1-CG2 3.45Å; F447-T812 VanDerWaalsContact CD1-CG2 3.45Å; F447-T812 HydrophobicContact CD2-CG2 4.43Å; F447-T812 HydrophobicContact CE1-CG2 4.02Å; F447-T812 HydrophobicContact CG-CG2 3.68Å; D778-T812 WeakPolarHBondContact CA-OG1 3.31Å; Q779-T812 PolarHBondContact N-OG1 3.25Å; D810-T812 PolarHBondContact O-N 3.23Å; D810-T812 VanDerWaalsContact O-N 3.1Å; T812-R814 VanDerWaalsContact C-N 3.35Å; T812-R814 PolarHBondContact O-N 3.43Å; T812-T815 PolarHBondContact O-N 3.07Å; T812-V816 WeakPolarHBondContact O-CG2 3.39Å; T812-V816 PolarHBondContact O-N 3.31Å
813	A	79.4	Confident	79.9	Confident	2 Å²	2	54.2 Å²	54.2	2%	0.017	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-43.7	178.7	0	0	0	0	0	111.3	I806 D810 K811 V816 K817 V858	I806-A813 HydrophobicContact CD1-CB 3.66Å; D810-A813 WeakPolarHBondContact O-CB 3.49Å; D810-A813 PolarHBondContact O-N 3.28Å; K811-A813 VanDerWaalsContact C-N 3.35Å; K811-A813 PolarHBondContact O-N 2.93Å; A813-V816 PolarHBondContact O-N 2.5Å; A813-K817 WeakPolarHBondContact O-CB 3.32Å; A813-K817 PolarHBondContact O-N 3.12Å; A813-V858 HydrophobicContact CB-CG1 4.13Å; A813-V858 HydrophobicContact CB-CG2 4.2Å
814	R	78.9	Confident	79.2	Confident	129 Å²	129	57.3 Å²	57.3	49%	0.487	31%	0.305	S	S	.	.	H	α-helix	trans	-69.9	-35.7	-179.4	-61.1	176.7	-172.9	158.4	5	112.3	D809 D810 K811 T812 K817 N818	D809-R814 PolarHBondContact O-NE 3.1Å; D809-R814 PolarHBondContact O-NH2 2.97Å; D809-R814 VanDerWaalsContact O-NH2 3.08Å; D809-R814 IonicContact OD1-NE 2.83Å; D809-R814 PolarHBondContact OD1-NE 2.79Å; D809-R814 IonicContact OD2-CZ 3.41Å; D809-R814 IonicContact OD2-NE 3.79Å; D809-R814 PolarHBondContact OD2-NE 2.98Å; D809-R814 VanDerWaalsContact OD2-NE 3.14Å; D809-R814 IonicContact OD2-NH2 3.02Å; D809-R814 PolarHBondContact OD2-NH2 2.85Å; D810-R814 PolarHBondContact O-N 3.03Å; K811-R814 PolarHBondContact O-N 3.42Å; T812-R814 VanDerWaalsContact C-N 3.35Å; T812-R814 PolarHBondContact O-N 3.43Å; R814-K817 PolarHBondContact O-N 3.29Å; R814-N818 WeakPolarHBondContact O-CB 3.46Å; R814-N818 PolarHBondContact O-N 2.79Å; R814-N818 PolarHBondContact O-ND2 2.26Å; R814-N818 PolarHBondContact O-OD1 2.95Å
815	T	77.8	Confident	78.3	Confident	37 Å²	37	61.4 Å²	61.4	23%	0.227	32%	0.321	C	S	.	.	H	α-helix	trans	-64.9	-43.4	172.1	-64.9	0	0	0	0	111.7	Q779 K811 T812 N818 A819	Q779-T815 PolarHBondContact OE1-OG1 3.04Å; K811-T815 PolarHBondContact O-N 3.03Å; K811-T815 PolarHBondContact O-OG1 2.8Å; T812-T815 PolarHBondContact O-N 3.07Å; T815-N818 PolarHBondContact O-N 2.82Å; T815-A819 VanDerWaalsContact O-CB 3.3Å; T815-A819 WeakPolarHBondContact O-CB 3.1Å; T815-A819 PolarHBondContact O-N 3.05Å
816	V	80.1	Confident	77.3	Confident	11 Å²	11	59.8 Å²	59.8	7%	0.067	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-47.6	173.5	168.7	0	0	0	0	110.8	F447 A803 T812 A813 N818 A819 A820 I856 L861	F447-V816 HydrophobicContact CD2-CG2 4.41Å; A803-V816 HydrophobicContact CB-CB 4.36Å; A803-V816 HydrophobicContact CB-CG1 3.51Å; A803-V816 HydrophobicContact CB-CG2 3.89Å; T812-V816 WeakPolarHBondContact O-CG2 3.39Å; T812-V816 PolarHBondContact O-N 3.31Å; A813-V816 PolarHBondContact O-N 2.5Å; V816-N818 PolarHBondContact O-N 3.3Å; V816-A819 PolarHBondContact O-N 3.23Å; V816-A820 WeakPolarHBondContact O-CB 3.14Å; V816-A820 PolarHBondContact O-N 3.34Å; V816-I856 HydrophobicContact CG1-CD1 4.24Å; V816-L861 HydrophobicContact CG1-CD1 3.95Å
817	K	83.1	Confident	76.2	Confident	75 Å²	75	65.5 Å²	65.5	33%	0.326	35%	0.351	S	S	.	.	H	α-helix	trans	-56.1	-48.2	177.6	-165	178.9	-175.5	169.1	0	112.1	A813 R814 A819 A820 G821 S854	A813-K817 WeakPolarHBondContact O-CB 3.32Å; A813-K817 PolarHBondContact O-N 3.12Å; R814-K817 PolarHBondContact O-N 3.29Å; K817-A819 VanDerWaalsContact C-N 3.35Å; K817-A819 PolarHBondContact O-N 3.34Å; K817-A820 PolarHBondContact O-N 2.98Å; K817-G821 PolarHBondContact O-N 3.41Å; K817-S854 VanDerWaalsContact CE-CB 3.42Å; K817-S854 WeakPolarHBondContact CG-OG 3.48Å
818	N	81.2	Confident	75.7	Confident	130 Å²	130	64.3 Å²	64.3	70%	0.695	34%	0.339	S	S	*	.	H	α-helix	trans	-67.7	-32.6	178.4	-67.1	-10.8	0	0	0	112.6	R814 T815 V816	R814-N818 WeakPolarHBondContact O-CB 3.46Å; R814-N818 PolarHBondContact O-N 2.79Å; R814-N818 PolarHBondContact O-ND2 2.26Å; R814-N818 PolarHBondContact O-OD1 2.95Å; T815-N818 PolarHBondContact O-N 2.82Å; V816-N818 PolarHBondContact O-N 3.3Å
819	A	78.5	Confident	75.4	Confident	37 Å²	37	65 Å²	65	31%	0.306	35%	0.354	S	S	.	.	H	α-helix	trans	-75.9	-31.4	177	0	0	0	0	0	113.1	K801 T815 V816 K817 V872	K801-A819 HydrophobicContact CD-CB 4.01Å; T815-A819 VanDerWaalsContact O-CB 3.3Å; T815-A819 WeakPolarHBondContact O-CB 3.1Å; T815-A819 PolarHBondContact O-N 3.05Å; V816-A819 PolarHBondContact O-N 3.23Å; K817-A819 VanDerWaalsContact C-N 3.35Å; K817-A819 PolarHBondContact O-N 3.34Å; A819-V872 WeakPolarHBondContact O-CG1 3.39Å
820	A	81.7	Confident	75.6	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	35%	0.354	C	S	.	.	H	α-helix	trans	-71.6	-32.1	171.9	0	0	0	0	0	112.4	V816 K817 K855 I856 V872 V877	V816-A820 WeakPolarHBondContact O-CB 3.14Å; V816-A820 PolarHBondContact O-N 3.34Å; K817-A820 PolarHBondContact O-N 2.98Å; A820-K855 HydrophobicContact CB-CB 4.46Å; A820-K855 WeakPolarHBondContact O-CD 3.46Å; A820-I856 HydrophobicContact CB-CD1 3.73Å; A820-I856 HydrophobicContact CB-CG1 3.96Å; A820-V872 HydrophobicContact CB-CG2 4.19Å; A820-V877 HydrophobicContact CB-CG2 3.73Å
821	G	81.2	Confident	75.4	Confident	26 Å²	26	66.1 Å²	66.1	27%	0.268	36%	0.364	S	S	.	.			trans	77.6	-169.7	-179.6	0	0	0	0	0	113.5	K817 S854 K855	K817-G821 PolarHBondContact O-N 3.41Å; G821-S854 WeakPolarHBondContact O-CA 3.08Å; G821-S854 PolarHBondContact O-OG 2.88Å; G821-K855 PolarHBondContact O-N 3.35Å
822	E	82.2	Confident	75	Confident	123 Å²	123	67.4 Å²	67.4	58%	0.575	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	153	-178.2	-60.9	-178.7	165.3	0	0	111.5	M852 E853	E822-M852 HydrophobicContact CB-CE 3.77Å; E822-E853 CarbonylContact C-O 3.51Å; E822-E853 WeakPolarHBondContact CA-O 2.91Å; E822-E853 WeakPolarHBondContact CB-O 3.16Å
823	E	77.6	Confident	74.6	Confident	70 Å²	70	72.9 Å²	72.9	33%	0.327	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148	171.8	62.3	-176.7	-162.4	0	0	110.5	R825 E853 K855	E823-R825 HydrophobicContact CG-CG 4.16Å; E823-R825 PolarHBondContact O-N 3.35Å; E823-R825 IonicContact OE1-CZ 2.72Å; E823-R825 IonicContact OE1-NE 3.96Å; E823-R825 PolarHBondContact OE1-NE 2.66Å; E823-R825 IonicContact OE1-NH2 2.82Å; E823-R825 PolarHBondContact OE1-NH2 2.72Å; E823-E853 PolarHBondContact N-O 3.39Å; E823-E853 PolarHBondContact O-N 2.84Å; E823-K855 HydrophobicContact CB-CG 4.04Å; E823-K855 HydrophobicContact CG-CG 3.85Å
824	A	74.6	Confident	73.9	Confident	68 Å²	68	78.5 Å²	78.5	56%	0.562	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	104.4	179.4	0	0	0	0	0	109.7	I850 M852	A824-I850 HydrophobicContact CB-CG2 3.86Å; A824-M852 HydrophobicContact CB-SD 3.92Å
825	R	69.3	Low	72.9	Confident	87 Å²	87	76.9 Å²	76.9	33%	0.328	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.8	177.8	-75.3	179.6	179.9	170.8	3.6	111.8	E823 R827 I850 Q851 E853	E823-R825 HydrophobicContact CG-CG 4.16Å; E823-R825 PolarHBondContact O-N 3.35Å; E823-R825 IonicContact OE1-CZ 2.72Å; E823-R825 IonicContact OE1-NE 3.96Å; E823-R825 PolarHBondContact OE1-NE 2.66Å; E823-R825 IonicContact OE1-NH2 2.82Å; E823-R825 PolarHBondContact OE1-NH2 2.72Å; R825-R827 PolarHBondContact O-N 3.12Å; R825-I850 WeakPolarHBondContact O-CA 3.48Å; R825-Q851 PolarHBondContact N-O 2.93Å; R825-Q851 PolarHBondContact O-N 3.45Å; R825-E853 HydrophobicContact CB-CG 4.3Å; R825-E853 WeakPolarHBondContact CD-OE2 3.34Å; R825-E853 IonicContact CZ-OE2 2.72Å; R825-E853 IonicContact NE-OE2 3.88Å; R825-E853 IonicContact NH1-OE2 3.41Å; R825-E853 PolarHBondContact NH1-OE2 3.4Å
826	A	68.2	Low	71.9	Confident	73 Å²	73	77.1 Å²	77.1	60%	0.603	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	102.8	172.3	0	0	0	0	0	110	I848	A826-I848 HydrophobicContact CB-CG2 3.61Å
827	R	61	Low	70.8	Confident	134 Å²	134	84 Å²	84	51%	0.506	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	132.5	167.7	-75.7	-162.7	-177.7	-170.3	1.2	110.4	R825 I848 T849 E853	R825-R827 PolarHBondContact O-N 3.12Å; R827-I848 CarbonylContact O-C 3.58Å; R827-I848 WeakPolarHBondContact O-CA 3.24Å; R827-T849 PolarHBondContact N-O 3.16Å; R827-T849 PolarHBondContact O-N 3.24Å; R827-E853 IonicContact CZ-OE1 3.1Å; R827-E853 IonicContact NE-OE1 3.14Å; R827-E853 PolarHBondContact NE-OE1 2.82Å; R827-E853 IonicContact NH2-OE1 3.37Å; R827-E853 PolarHBondContact NH2-OE1 3.13Å
828	M	68.1	Low	69.1	Low	76 Å²	76	89.9 Å²	89.9	37%	0.374	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	136.2	161.3	-76.9	175.5	-175.6	0	0	110.7	D844 Q847 I848	M828-D844 HydrophobicContact CE-CB 3.58Å; M828-D844 HydrophobicContact SD-CB 3.44Å; M828-D844 WeakPolarHBondContact SD-CB 3.26Å; M828-Q847 WeakPolarHBondContact CA-O 3.36Å; M828-I848 HydrophobicContact CE-CD1 3.83Å; M828-I848 HydrophobicContact CE-CG1 3.88Å; M828-I848 HydrophobicContact CG-CG1 3.84Å
829	G	65.5	Low	67.5	Low	62 Å²	62	85.8 Å²	85.8	64%	0.639	49%	0.488	S	S	*	.	S	Bend	trans	-77.7	-18.2	178.5	0	0	0	0	0	114.4	Q847	G829-Q847 PolarHBondContact N-O 2.79Å
830	S	71.8	Confident	66.4	Low	54 Å²	54	89.5 Å²	89.5	38%	0.378	50%	0.5	S	S	.	.			trans	-159.1	141.5	-177.1	61.8	0	0	0	0	111.7	G845	S830-G845 VanDerWaalsContact O-CA 3.29Å; S830-G845 WeakPolarHBondContact O-CA 3.44Å; S830-G845 PolarHBondContact O-N 3.44Å; S830-G845 VanDerWaalsContact O-N 3.11Å
831	L	67.8	Low	65.3	Low	102 Å²	102	92.3 Å²	92.3	53%	0.534	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	137	158.7	-72.1	160.2	0	0	0	108.5	W842	L831-W842 HydrophobicContact CB-CE3 3.94Å
832	Q	69.6	Low	64.7	Low	113 Å²	113	98.3 Å²	98.3	53%	0.528	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.6	174.1	-64.1	-170.3	-1.6	0	0	109.4	H834 V843	Q832-H834 PolarHBondContact O-N 3.07Å; Q832-V843 PolarHBondContact N-O 3.47Å; Q832-V843 PolarHBondContact O-N 3.02Å
833	R	68.3	Low	64	Low	119 Å²	119	95.5 Å²	95.5	45%	0.449	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	122.1	173.7	-158.4	177.7	93	151.5	9.2	109.1	D835 E840 W842	R833-D835 IonicContact CZ-OD1 3Å; R833-D835 IonicContact CZ-OD2 2.78Å; R833-D835 IonicContact NE-OD1 2.67Å; R833-D835 PolarHBondContact NE-OD1 2.77Å; R833-D835 IonicContact NE-OD2 3.66Å; R833-D835 IonicContact NH2-OD1 3.95Å; R833-D835 PolarHBondContact NH2-OD1 3.22Å; R833-D835 IonicContact NH2-OD2 3.39Å; R833-D835 PolarHBondContact NH2-OD2 3.32Å; R833-E840 IonicContact CZ-OE1 3.14Å; R833-E840 IonicContact CZ-OE2 3.14Å; R833-E840 IonicContact NE-OE2 2.86Å; R833-E840 IonicContact NH1-OE1 2.71Å; R833-E840 PolarHBondContact NH1-OE1 2.91Å; R833-E840 IonicContact NH1-OE2 2.71Å; R833-E840 PolarHBondContact NH1-OE2 3.32Å; R833-E840 IonicContact NH2-OE1 3.42Å; R833-E840 PolarHBondContact NH2-OE1 2.92Å; R833-E840 VanDerWaalsContact NH2-OE1 3.16Å; R833-W842 HydrophobicContact CB-CD2 4.47Å; R833-W842 HydrophobicContact CB-CE3 3.99Å; R833-W842 HydrophobicContact CB-CH2 3.97Å; R833-W842 HydrophobicContact CB-CZ2 4.41Å; R833-W842 HydrophobicContact CB-CZ3 3.73Å; R833-W842 HydrophobicContact CG-CD2 4.26Å; R833-W842 HydrophobicContact CG-CE3 4.27Å; R833-W842 HydrophobicContact CG-CH2 4Å; R833-W842 HydrophobicContact CG-CZ2 3.95Å; R833-W842 HydrophobicContact CG-CZ3 4.16Å
834	H	64.8	Low	63.3	Low	121 Å²	121	96.9 Å²	96.9	56%	0.56	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	100.2	175.5	-160.1	-27.3	0	0	0	109.2	Q832 G836 S841 V843	Q832-H834 PolarHBondContact O-N 3.07Å; H834-G836 PolarHBondContact O-N 2.89Å; H834-S841 PolarHBondContact N-O 3.31Å; H834-S841 WeakPolarHBondContact O-CB 3.36Å; H834-S841 PolarHBondContact O-N 2.87Å; H834-V843 HydrophobicContact CB-CG2 3.78Å
835	D	59.6	Low	62.9	Low	95 Å²	95	93.7 Å²	93.7	51%	0.508	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	115.8	179.4	-63.4	-16.8	0	0	0	109.4	R833	R833-D835 IonicContact CZ-OD1 3Å; R833-D835 IonicContact CZ-OD2 2.78Å; R833-D835 IonicContact NE-OD1 2.67Å; R833-D835 PolarHBondContact NE-OD1 2.77Å; R833-D835 IonicContact NE-OD2 3.66Å; R833-D835 IonicContact NH2-OD1 3.95Å; R833-D835 PolarHBondContact NH2-OD1 3.22Å; R833-D835 IonicContact NH2-OD2 3.39Å; R833-D835 PolarHBondContact NH2-OD2 3.32Å
836	G	56.7	Low	62.8	Low	41 Å²	41	97 Å²	97	42%	0.423	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	155.2	-178.8	0	0	0	0	0	112.3	H834 M838 G839	H834-G836 PolarHBondContact O-N 2.89Å; G836-M838 PolarHBondContact O-N 3.17Å; G836-G839 CarbonylContact C-O 3.47Å; G836-G839 WeakPolarHBondContact CA-O 3.47Å; G836-G839 PolarHBondContact N-O 3.35Å; G836-G839 CarbonylContact O-C 3.54Å; G836-G839 PolarHBondContact O-N 2.75Å; G836-G839 VanDerWaalsContact O-O 3.12Å
837	V	56.6	Low	62.8	Low	157 Å²	157	100.2 Å²	100.2	95%	0.952	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.5	-178.7	-176.8	0	0	0	0	113.1
838	M	46.7	Very low	63.2	Low	198 Å²	198	98.7 Å²	98.7	98%	0.975	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	9.3	175.9	-76.6	-73.1	-174.5	0	0	113.9	G836	G836-M838 PolarHBondContact O-N 3.17Å
839	G	47.8	Very low	63.4	Low	43 Å²	43	98.4 Å²	98.4	44%	0.443	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	139.8	165.9	177.7	0	0	0	0	0	113.9	G836 S841	G836-G839 CarbonylContact C-O 3.47Å; G836-G839 WeakPolarHBondContact CA-O 3.47Å; G836-G839 PolarHBondContact N-O 3.35Å; G836-G839 CarbonylContact O-C 3.54Å; G836-G839 PolarHBondContact O-N 2.75Å; G836-G839 VanDerWaalsContact O-O 3.12Å; G839-S841 PolarHBondContact O-N 3.08Å
840	E	55.6	Low	63.9	Low	116 Å²	116	101.4 Å²	101.4	54%	0.542	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	118.2	171.5	-59.6	-168.2	174.3	0	0	109.8	R833	R833-E840 IonicContact CZ-OE1 3.14Å; R833-E840 IonicContact CZ-OE2 3.14Å; R833-E840 IonicContact NE-OE2 2.86Å; R833-E840 IonicContact NH1-OE1 2.71Å; R833-E840 PolarHBondContact NH1-OE1 2.91Å; R833-E840 IonicContact NH1-OE2 2.71Å; R833-E840 PolarHBondContact NH1-OE2 3.32Å; R833-E840 IonicContact NH2-OE1 3.42Å; R833-E840 PolarHBondContact NH2-OE1 2.92Å; R833-E840 VanDerWaalsContact NH2-OE1 3.16Å
841	S	58.5	Low	64.2	Low	60 Å²	60	102.6 Å²	102.6	42%	0.42	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	143.5	173.5	-179	0	0	0	0	109.5	H834 G839	H834-S841 PolarHBondContact N-O 3.31Å; H834-S841 WeakPolarHBondContact O-CB 3.36Å; H834-S841 PolarHBondContact O-N 2.87Å; G839-S841 PolarHBondContact O-N 3.08Å
842	W	68.8	Low	64.7	Low	153 Å²	153	103.2 Å²	103.2	58%	0.58	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.5	168.2	-66.7	89	0	0	0	108.1	L831 R833	L831-W842 HydrophobicContact CB-CE3 3.94Å; R833-W842 HydrophobicContact CB-CD2 4.47Å; R833-W842 HydrophobicContact CB-CE3 3.99Å; R833-W842 HydrophobicContact CB-CH2 3.97Å; R833-W842 HydrophobicContact CB-CZ2 4.41Å; R833-W842 HydrophobicContact CB-CZ3 3.73Å; R833-W842 HydrophobicContact CG-CD2 4.26Å; R833-W842 HydrophobicContact CG-CE3 4.27Å; R833-W842 HydrophobicContact CG-CH2 4Å; R833-W842 HydrophobicContact CG-CZ2 3.95Å; R833-W842 HydrophobicContact CG-CZ3 4.16Å
843	V	67.8	Low	65.1	Low	64 Å²	64	99.7 Å²	99.7	39%	0.388	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134.1	-178.6	-177.8	0	0	0	0	109	Q832 H834 G845	Q832-V843 PolarHBondContact N-O 3.47Å; Q832-V843 PolarHBondContact O-N 3.02Å; H834-V843 HydrophobicContact CB-CG2 3.78Å; V843-G845 PolarHBondContact O-N 3.45Å
844	D	62.8	Low	65.7	Low	98 Å²	98	94.8 Å²	94.8	52%	0.524	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	127.1	175.5	-77.1	-10.8	0	0	0	112	M828	M828-D844 HydrophobicContact CE-CB 3.58Å; M828-D844 HydrophobicContact SD-CB 3.44Å; M828-D844 WeakPolarHBondContact SD-CB 3.26Å
845	G	66.4	Low	66.6	Low	2 Å²	2	91.2 Å²	91.2	2%	0.021	49%	0.49	C	S	.	.			trans	-81.1	144.8	-179.8	0	0	0	0	0	113	S830 V843 Q847	S830-G845 VanDerWaalsContact O-CA 3.29Å; S830-G845 WeakPolarHBondContact O-CA 3.44Å; S830-G845 PolarHBondContact O-N 3.44Å; S830-G845 VanDerWaalsContact O-N 3.11Å; V843-G845 PolarHBondContact O-N 3.45Å; G845-Q847 PolarHBondContact O-N 3.03Å
846	N	67.2	Low	67.7	Low	155 Å²	155	86.8 Å²	86.8	83%	0.829	47%	0.466	S	S	*	.	S	Bend	trans	-65.1	17.4	-174.7	-61.6	-1.3	0	0	0	116.3
847	Q	68.4	Low	69	Low	142 Å²	142	88.5 Å²	88.5	66%	0.664	47%	0.466	S	S	*	.			trans	-124.2	99.3	175.9	-74.3	-167.9	-16.4	0	0	111.1	M828 G829 G845	M828-Q847 WeakPolarHBondContact CA-O 3.36Å; G829-Q847 PolarHBondContact N-O 2.79Å; G845-Q847 PolarHBondContact O-N 3.03Å
848	I	68.4	Low	70.2	Confident	101 Å²	101	81.7 Å²	81.7	52%	0.518	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.7	169	-61	173.4	0	0	0	108.4	A826 R827 M828	A826-I848 HydrophobicContact CB-CG2 3.61Å; R827-I848 CarbonylContact O-C 3.58Å; R827-I848 WeakPolarHBondContact O-CA 3.24Å; M828-I848 HydrophobicContact CE-CD1 3.83Å; M828-I848 HydrophobicContact CE-CG1 3.88Å; M828-I848 HydrophobicContact CG-CG1 3.84Å
849	T	73.2	Confident	71.9	Confident	70 Å²	70	76.6 Å²	76.6	43%	0.429	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.1	169.3	-53.3	0	0	0	0	108.5	R827 Q851	R827-T849 PolarHBondContact N-O 3.16Å; R827-T849 PolarHBondContact O-N 3.24Å; T849-Q851 HydrophobicContact CG2-CG 3.83Å; T849-Q851 PolarHBondContact O-N 3.44Å
850	I	76.1	Confident	73.7	Confident	126 Å²	126	77.4 Å²	77.4	65%	0.646	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	120.8	169.5	-57.7	177.1	0	0	0	107.6	A824 R825	A824-I850 HydrophobicContact CB-CG2 3.86Å; R825-I850 WeakPolarHBondContact O-CA 3.48Å
851	Q	76.6	Confident	75.1	Confident	78 Å²	78	72 Å²	72	36%	0.364	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.2	176.3	-61.9	-171	-13.7	0	0	108.9	R825 T849 E853	R825-Q851 PolarHBondContact N-O 2.93Å; R825-Q851 PolarHBondContact O-N 3.45Å; T849-Q851 HydrophobicContact CG2-CG 3.83Å; T849-Q851 PolarHBondContact O-N 3.44Å; Q851-E853 PolarHBondContact O-N 3.15Å
852	M	79.8	Confident	76.4	Confident	115 Å²	115	71.6 Å²	71.6	57%	0.567	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	115.4	166.6	-63.5	-58.1	-61.2	0	0	107.4	E822 A824	E822-M852 HydrophobicContact CB-CE 3.77Å; A824-M852 HydrophobicContact CB-SD 3.92Å
853	E	77.4	Confident	77.2	Confident	39 Å²	39	72 Å²	72	18%	0.182	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	152.9	172.8	-66.3	-164.6	167.4	0	0	109.4	E822 E823 R825 R827 Q851	E822-E853 CarbonylContact C-O 3.51Å; E822-E853 WeakPolarHBondContact CA-O 2.91Å; E822-E853 WeakPolarHBondContact CB-O 3.16Å; E823-E853 PolarHBondContact N-O 3.39Å; E823-E853 PolarHBondContact O-N 2.84Å; R825-E853 HydrophobicContact CB-CG 4.3Å; R825-E853 WeakPolarHBondContact CD-OE2 3.34Å; R825-E853 IonicContact CZ-OE2 2.72Å; R825-E853 IonicContact NE-OE2 3.88Å; R825-E853 IonicContact NH1-OE2 3.41Å; R825-E853 PolarHBondContact NH1-OE2 3.4Å; R827-E853 IonicContact CZ-OE1 3.1Å; R827-E853 IonicContact NE-OE1 3.14Å; R827-E853 PolarHBondContact NE-OE1 2.82Å; R827-E853 IonicContact NH2-OE1 3.37Å; R827-E853 PolarHBondContact NH2-OE1 3.13Å; Q851-E853 PolarHBondContact O-N 3.15Å
854	S	80.2	Confident	78.2	Confident	17 Å²	17	69.2 Å²	69.2	12%	0.119	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	142.8	167.8	-174.7	0	0	0	0	110.5	K817 G821 I856	K817-S854 VanDerWaalsContact CE-CB 3.42Å; K817-S854 WeakPolarHBondContact CG-OG 3.48Å; G821-S854 WeakPolarHBondContact O-CA 3.08Å; G821-S854 PolarHBondContact O-OG 2.88Å; S854-I856 WeakPolarHBondContact CB-O 3.49Å; S854-I856 PolarHBondContact O-N 3.35Å; S854-I856 VanDerWaalsContact O-N 3.15Å; S854-I856 PolarHBondContact OG-N 3.48Å; S854-I856 PolarHBondContact OG-O 3.02Å; S854-I856 VanDerWaalsContact OG-O 3.13Å
855	K	83.3	Confident	79.4	Confident	46 Å²	46	69.6 Å²	69.6	20%	0.2	35%	0.346	C	S	.	.	S	Bend	trans	-60.3	-21.5	174.6	-60.9	-166.3	-176.5	177.5	0	113.2	A820 G821 E823 G875 V877	A820-K855 HydrophobicContact CB-CB 4.46Å; A820-K855 WeakPolarHBondContact O-CD 3.46Å; G821-K855 PolarHBondContact O-N 3.35Å; E823-K855 HydrophobicContact CB-CG 4.04Å; E823-K855 HydrophobicContact CG-CG 3.85Å; K855-G875 PolarHBondContact NZ-O 2.64Å; K855-V877 HydrophobicContact CB-CB 4.38Å; K855-V877 HydrophobicContact CB-CG2 3.78Å; K855-V877 HydrophobicContact CD-CB 4.5Å; K855-V877 HydrophobicContact CD-CG2 3.9Å; K855-V877 HydrophobicContact CG-CG2 4.49Å
856	I	83.8	Confident	80.2	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.01	37%	0.372	C	S	.	.	S	Bend	trans	-128.5	127.3	177.8	-58.8	177.9	0	0	0	108.6	V816 A820 S854 L861 F870 V872 V877	V816-I856 HydrophobicContact CG1-CD1 4.24Å; A820-I856 HydrophobicContact CB-CD1 3.73Å; A820-I856 HydrophobicContact CB-CG1 3.96Å; S854-I856 WeakPolarHBondContact CB-O 3.49Å; S854-I856 PolarHBondContact O-N 3.35Å; S854-I856 VanDerWaalsContact O-N 3.15Å; S854-I856 PolarHBondContact OG-N 3.48Å; S854-I856 PolarHBondContact OG-O 3.02Å; S854-I856 VanDerWaalsContact OG-O 3.13Å; I856-L861 HydrophobicContact CG2-CD1 3.93Å; I856-L861 HydrophobicContact CG2-CD2 3.85Å; I856-L861 HydrophobicContact CG2-CG 3.65Å; I856-F870 HydrophobicContact CD1-CB 3.85Å; I856-F870 HydrophobicContact CD1-CD1 4.45Å; I856-F870 HydrophobicContact CD1-CG 4.12Å; I856-F870 HydrophobicContact CG1-CD1 4.41Å; I856-F870 HydrophobicContact CG1-CG 4.47Å; I856-V872 HydrophobicContact CD1-CG2 4.23Å; I856-V877 HydrophobicContact CD1-CG1 3.86Å; I856-V877 HydrophobicContact CD1-CG2 4.18Å; I856-V877 HydrophobicContact CG1-CG1 3.74Å; I856-V877 HydrophobicContact CG1-CG2 4.18Å
857	D	82.6	Confident	81	Confident	76 Å²	76	66 Å²	66	41%	0.406	34%	0.339	S	S	.	.			trans	-88.7	149.8	164.4	-166.4	17.5	0	0	0	111.3	Q859 D860 L861	D857-Q859 PolarHBondContact O-N 3.43Å; D857-Q859 WeakPolarHBondContact OD2-CB 3.3Å; D857-D860 PolarHBondContact N-OD2 2.89Å; D857-D860 WeakPolarHBondContact O-CB 3.04Å; D857-D860 PolarHBondContact O-N 3.3Å; D857-L861 PolarHBondContact O-N 3Å
858	V	81.9	Confident	82	Confident	14 Å²	14	61.1 Å²	61.1	9%	0.085	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-32.1	175.9	-178.2	0	0	0	0	110.3	I806 D809 A813 D860 L861 I862	I806-V858 HydrophobicContact CD1-CG1 4.1Å; D809-V858 HydrophobicContact CB-CG1 4.08Å; A813-V858 HydrophobicContact CB-CG1 4.13Å; A813-V858 HydrophobicContact CB-CG2 4.2Å; V858-D860 VanDerWaalsContact C-N 3.31Å; V858-D860 PolarHBondContact O-N 2.95Å; V858-L861 PolarHBondContact O-N 2.95Å; V858-I862 HydrophobicContact CG1-CD1 4.11Å; V858-I862 WeakPolarHBondContact O-CG1 3.19Å; V858-I862 PolarHBondContact O-N 3.13Å; V858-I862 VanDerWaalsContact O-N 3.09Å
859	Q	83.8	Confident	83.1	Confident	91 Å²	91	56.4 Å²	56.4	43%	0.425	29%	0.292	S	S	.	.	H	α-helix	trans	-58.1	-39.4	170.1	-76.3	-75.4	-47.5	0	0	112.8	D857 I862 R863	D857-Q859 PolarHBondContact O-N 3.43Å; D857-Q859 WeakPolarHBondContact OD2-CB 3.3Å; Q859-I862 PolarHBondContact O-N 3.15Å; Q859-R863 VanDerWaalsContact O-CD 3.28Å; Q859-R863 WeakPolarHBondContact O-CD 3.35Å; Q859-R863 WeakPolarHBondContact O-CG 3.36Å; Q859-R863 PolarHBondContact O-N 2.97Å
860	D	84.7	Confident	84	Confident	61 Å²	61	53.9 Å²	53.9	33%	0.326	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-40.1	-179.5	-61	-37.5	0	0	0	110.8	D857 V858 I862 R863 L864 F870	D857-D860 PolarHBondContact N-OD2 2.89Å; D857-D860 WeakPolarHBondContact O-CB 3.04Å; D857-D860 PolarHBondContact O-N 3.3Å; V858-D860 VanDerWaalsContact C-N 3.31Å; V858-D860 PolarHBondContact O-N 2.95Å; D860-I862 PolarHBondContact O-N 3.44Å; D860-R863 PolarHBondContact O-N 2.96Å; D860-L864 WeakPolarHBondContact O-CG 3.33Å; D860-L864 PolarHBondContact O-N 2.83Å; D860-F870 HydrophobicContact CB-CE2 4.13Å; D860-F870 HydrophobicContact CB-CZ 4.05Å
861	L	85.6	Confident	84.7	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-64.7	-35.6	175.1	-61.8	176	0	0	0	112.7	A803 R805 I806 V816 I856 D857 V858 R863 L864 F870	A803-L861 HydrophobicContact CB-CD2 3.87Å; R805-L861 WeakPolarHBondContact CA-O 3.33Å; I806-L861 HydrophobicContact CD1-CB 3.64Å; I806-L861 HydrophobicContact CD1-CD1 3.74Å; I806-L861 HydrophobicContact CD1-CG 4.35Å; I806-L861 HydrophobicContact CG1-CB 3.68Å; I806-L861 PolarHBondContact N-O 3.12Å; V816-L861 HydrophobicContact CG1-CD1 3.95Å; I856-L861 HydrophobicContact CG2-CD1 3.93Å; I856-L861 HydrophobicContact CG2-CD2 3.85Å; I856-L861 HydrophobicContact CG2-CG 3.65Å; D857-L861 PolarHBondContact O-N 3Å; V858-L861 PolarHBondContact O-N 2.95Å; L861-R863 VanDerWaalsContact C-N 3.3Å; L861-R863 PolarHBondContact O-N 3.22Å; L861-L864 HydrophobicContact CD2-CD1 4.04Å; L861-F870 HydrophobicContact CD2-CD2 3.63Å; L861-F870 HydrophobicContact CD2-CE2 4.09Å
862	I	85.3	Confident	85.3	Confident	50 Å²	50	44.8 Å²	44.8	26%	0.256	23%	0.231	S	C	.	.	H	α-helix	trans	-69.4	-30.2	176.9	-68	165.4	0	0	0	112	R805 I806 V858 Q859 D860	R805-I862 PolarHBondContact NE-O 2.95Å; R805-I862 VanDerWaalsContact NE-O 3.15Å; I806-I862 HydrophobicContact CG1-CG1 3.98Å; I806-I862 WeakPolarHBondContact O-CA 3.39Å; V858-I862 HydrophobicContact CG1-CD1 4.11Å; V858-I862 WeakPolarHBondContact O-CG1 3.19Å; V858-I862 PolarHBondContact O-N 3.13Å; V858-I862 VanDerWaalsContact O-N 3.09Å; Q859-I862 PolarHBondContact O-N 3.15Å; D860-I862 PolarHBondContact O-N 3.44Å
863	R	86.3	Confident	85.6	Confident	162 Å²	162	39.9 Å²	39.9	61%	0.611	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-8.3	-177.2	-69.9	165.8	-168	-173.1	3.8	114.8	Q859 D860 L861	Q859-R863 VanDerWaalsContact O-CD 3.28Å; Q859-R863 WeakPolarHBondContact O-CD 3.35Å; Q859-R863 WeakPolarHBondContact O-CG 3.36Å; Q859-R863 PolarHBondContact O-N 2.97Å; D860-R863 PolarHBondContact O-N 2.96Å; L861-R863 VanDerWaalsContact C-N 3.3Å; L861-R863 PolarHBondContact O-N 3.22Å
864	L	88.4	Confident	85.6	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.031	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-62.2	140.2	178.3	-65.3	173.1	0	0	0	112.1	G804 R805 D860 L861 E868 F870	G804-L864 VanDerWaalsContact C-CD1 3.41Å; R805-L864 HydrophobicContact CB-CB 4.05Å; R805-L864 WeakPolarHBondContact CD-O 3.46Å; R805-L864 HydrophobicContact CG-CB 4.34Å; R805-L864 VanDerWaalsContact CG-O 3.32Å; R805-L864 WeakPolarHBondContact CG-O 3.29Å; R805-L864 PolarHBondContact NE-O 2.71Å; D860-L864 WeakPolarHBondContact O-CG 3.33Å; D860-L864 PolarHBondContact O-N 2.83Å; L861-L864 HydrophobicContact CD2-CD1 4.04Å; L864-E868 HydrophobicContact CB-CB 4.27Å; L864-E868 HydrophobicContact CD2-CB 3.99Å; L864-F870 HydrophobicContact CD1-CD2 4.14Å; L864-F870 HydrophobicContact CD1-CE2 4.3Å; L864-F870 HydrophobicContact CD2-CD2 4.27Å; L864-F870 HydrophobicContact CD2-CE2 3.87Å; L864-F870 HydrophobicContact CG-CE2 4.39Å
865	N	87.7	Confident	85.3	Confident	106 Å²	106	44.7 Å²	44.7	57%	0.567	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-79.8	170	167.9	-59.5	-81.2	0	0	0	110.9	G867 E868	N865-G867 PolarHBondContact O-N 3.45Å; N865-E868 HydrophobicContact CB-CG 4.04Å; N865-E868 VanDerWaalsContact CB-OE2 3.32Å; N865-E868 WeakPolarHBondContact CB-OE2 3.26Å; N865-E868 PolarHBondContact N-OE2 2.71Å; N865-E868 PolarHBondContact ND2-OE2 3.15Å; N865-E868 WeakPolarHBondContact O-CB 3.45Å; N865-E868 PolarHBondContact O-N 3.4Å
866	A	83.5	Confident	85.1	Confident	67 Å²	67	46.5 Å²	46.5	55%	0.554	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	132.3	174.7	0	0	0	0	0	110.7	E868	A866-E868 VanDerWaalsContact C-N 3.25Å; A866-E868 PolarHBondContact O-N 2.72Å
867	G	83.6	Confident	85.3	Confident	14 Å²	14	47.9 Å²	47.9	14%	0.144	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-3.7	-176.4	0	0	0	0	0	114.7	G452 N865 A881 S882	G452-G867 PolarHBondContact O-N 3.25Å; N865-G867 PolarHBondContact O-N 3.45Å; G867-A881 WeakPolarHBondContact O-CA 3.42Å; G867-S882 PolarHBondContact O-N 2.87Å
868	E	90.4	Very high	85.6	Confident	40 Å²	40	44.7 Å²	44.7	19%	0.187	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	140.3	169.5	-63	-166.8	116.7	0	0	111.5	R425 L864 N865 A866	R425-E868 WeakPolarHBondContact CD-OE1 3.14Å; R425-E868 IonicContact CZ-OE1 3.33Å; R425-E868 IonicContact NE-OE1 3.83Å; R425-E868 PolarHBondContact NE-OE1 3.4Å; R425-E868 IonicContact NH1-OE1 2.66Å; R425-E868 PolarHBondContact NH1-OE1 3.48Å; R425-E868 IonicContact NH1-OE2 3.19Å; R425-E868 PolarHBondContact NH1-OE2 3.43Å; L864-E868 HydrophobicContact CB-CB 4.27Å; L864-E868 HydrophobicContact CD2-CB 3.99Å; N865-E868 HydrophobicContact CB-CG 4.04Å; N865-E868 VanDerWaalsContact CB-OE2 3.32Å; N865-E868 WeakPolarHBondContact CB-OE2 3.26Å; N865-E868 PolarHBondContact N-OE2 2.71Å; N865-E868 PolarHBondContact ND2-OE2 3.15Å; N865-E868 WeakPolarHBondContact O-CB 3.45Å; N865-E868 PolarHBondContact O-N 3.4Å; A866-E868 VanDerWaalsContact C-N 3.25Å; A866-E868 PolarHBondContact O-N 2.72Å
869	F	91.1	Very high	86	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	173.2	178.1	46.7	-92.6	0	0	0	112.6	V421 R425 F446 T457 W461 F802 A803 S880	V421-F869 HydrophobicContact CG1-CE2 3.98Å; V421-F869 HydrophobicContact CG1-CZ 4.02Å; R425-F869 PolarHBondContact NH2-O 2.83Å; F446-F869 HydrophobicContact CE2-CB 4.49Å; T457-F869 HydrophobicContact CG2-CE1 3.85Å; T457-F869 HydrophobicContact CG2-CZ 4.48Å; W461-F869 HydrophobicContact CZ2-CZ 4.11Å; F802-F869 AromaticContact CD1-CD2 3.55Å; F802-F869 HydrophobicContact CD1-CD2 3.55Å; F802-F869 AromaticContact CD1-CE2 3.5Å; F802-F869 HydrophobicContact CD1-CE2 3.5Å; F802-F869 VanDerWaalsContact CD1-CE2 3.5Å; F802-F869 HydrophobicContact CD1-CZ 4.45Å; F802-F869 HydrophobicContact CE1-CD2 4.22Å; F802-F869 AromaticContact CE1-CE2 3.71Å; F802-F869 HydrophobicContact CE1-CE2 3.71Å; F802-F869 HydrophobicContact CG-CD2 4.43Å; A803-F869 CarbonylContact O-C 3.51Å; A803-F869 VanDerWaalsContact O-CA 3.23Å; A803-F869 WeakPolarHBondContact O-CA 3.11Å; A803-F869 VanDerWaalsContact O-CB 3.28Å; A803-F869 WeakPolarHBondContact O-CB 3.45Å; F869-S880 PolarHBondContact N-O 3.06Å; F869-S880 PolarHBondContact O-N 3.06Å
870	F	91	Very high	86.3	Confident	18 Å²	18	40.4 Å²	40.4	8%	0.079	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132.4	160	-66.9	-95.5	0	0	0	109.1	A803 I856 D860 L861 L864 V877 P879	A803-F870 PolarHBondContact N-O 3.46Å; A803-F870 PolarHBondContact O-N 2.63Å; I856-F870 HydrophobicContact CD1-CB 3.85Å; I856-F870 HydrophobicContact CD1-CD1 4.45Å; I856-F870 HydrophobicContact CD1-CG 4.12Å; I856-F870 HydrophobicContact CG1-CD1 4.41Å; I856-F870 HydrophobicContact CG1-CG 4.47Å; D860-F870 HydrophobicContact CB-CE2 4.13Å; D860-F870 HydrophobicContact CB-CZ 4.05Å; L861-F870 HydrophobicContact CD2-CD2 3.63Å; L861-F870 HydrophobicContact CD2-CE2 4.09Å; L864-F870 HydrophobicContact CD1-CD2 4.14Å; L864-F870 HydrophobicContact CD1-CE2 4.3Å; L864-F870 HydrophobicContact CD2-CD2 4.27Å; L864-F870 HydrophobicContact CD2-CE2 3.87Å; L864-F870 HydrophobicContact CG-CE2 4.39Å; F870-V877 HydrophobicContact CB-CG1 4.32Å; F870-V877 HydrophobicContact CD1-CG1 3.69Å; F870-V877 HydrophobicContact CE1-CG1 4.49Å; F870-V877 HydrophobicContact CG-CG1 4.41Å; F870-P879 HydrophobicContact CD1-CB 4.09Å; F870-P879 HydrophobicContact CD1-CG 3.99Å; F870-P879 HydrophobicContact CE1-CB 3.98Å; F870-P879 HydrophobicContact CE1-CG 3.83Å
871	T	91	Very high	86.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	117.4	171.2	-50.4	0	0	0	0	108.6	L376 T800 F802 F873 V877 V878 S880	L376-T871 HydrophobicContact CD1-CG2 4.35Å; L376-T871 HydrophobicContact CD2-CG2 4.43Å; T800-T871 HydrophobicContact CG2-CG2 4.04Å; F802-T871 HydrophobicContact CD1-CG2 3.91Å; F802-T871 HydrophobicContact CE1-CG2 3.45Å; F802-T871 VanDerWaalsContact CE1-CG2 3.45Å; F802-T871 VanDerWaalsContact CE1-OG1 3.3Å; F802-T871 WeakPolarHBondContact CE1-OG1 3.32Å; F802-T871 HydrophobicContact CZ-CG2 4.17Å; T871-F873 HydrophobicContact CG2-CB 4.23Å; T871-V877 WeakPolarHBondContact O-CA 3.34Å; T871-V878 PolarHBondContact N-O 3.01Å; T871-V878 PolarHBondContact O-N 3.37Å; T871-S880 WeakPolarHBondContact OG1-CB 3.38Å; T871-S880 PolarHBondContact OG1-OG 3.49Å
872	V	89	Confident	86.9	Confident	12 Å²	12	38.1 Å²	38.1	7%	0.073	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	110.3	168.4	-176.7	0	0	0	0	107.8	K801 A819 A820 I856 D876 V877	K801-V872 HydrophobicContact CB-CB 4.3Å; K801-V872 PolarHBondContact N-O 3.03Å; K801-V872 PolarHBondContact O-N 2.96Å; A819-V872 WeakPolarHBondContact O-CG1 3.39Å; A820-V872 HydrophobicContact CB-CG2 4.19Å; I856-V872 HydrophobicContact CD1-CG2 4.23Å; V872-D876 WeakPolarHBondContact CA-O 3.45Å; V872-V877 HydrophobicContact CG2-CG2 4.47Å
873	F	86.6	Confident	87	Confident	13 Å²	13	38.4 Å²	38.4	6%	0.057	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	115.5	-174.8	-178.6	-101.1	0	0	0	110.4	L376 L435 D439 T800 T871 G875 D876	L376-F873 HydrophobicContact CD2-CB 3.64Å; L376-F873 HydrophobicContact CD2-CD1 3.62Å; L376-F873 HydrophobicContact CD2-CD2 4.31Å; L376-F873 HydrophobicContact CD2-CE1 4.32Å; L376-F873 HydrophobicContact CD2-CG 3.6Å; L435-F873 HydrophobicContact CD2-CD2 3.88Å; L435-F873 HydrophobicContact CD2-CE2 3.62Å; L435-F873 HydrophobicContact CD2-CZ 4.45Å; D439-F873 HydrophobicContact CB-CE2 3.99Å; T800-F873 HydrophobicContact CG2-CD2 4.29Å; T871-F873 HydrophobicContact CG2-CB 4.23Å; F873-G875 PolarHBondContact O-N 3Å; F873-D876 PolarHBondContact N-O 3.46Å; F873-D876 PolarHBondContact O-N 2.81Å
874	Q	78.5	Confident	86.9	Confident	120 Å²	120	37.5 Å²	37.5	56%	0.561	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	21	178.7	-54.6	-174	14.5	0	0	115.2	D439	D439-Q874 PolarHBondContact OD1-NE2 3.45Å
875	G	72.6	Confident	86.9	Confident	36 Å²	36	37.7 Å²	37.7	37%	0.371	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.1	-7.8	-177.2	0	0	0	0	0	114.5	K855 F873	K855-G875 PolarHBondContact NZ-O 2.64Å; F873-G875 PolarHBondContact O-N 3Å
876	D	80.1	Confident	86.8	Confident	85 Å²	85	34.9 Å²	34.9	46%	0.455	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	148.2	169.1	-74.1	-29.1	0	0	0	111	V872 F873	V872-D876 WeakPolarHBondContact CA-O 3.45Å; F873-D876 PolarHBondContact N-O 3.46Å; F873-D876 PolarHBondContact O-N 2.81Å
877	V	87.5	Confident	86.7	Confident	31 Å²	31	36 Å²	36	19%	0.188	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	116.4	179.8	173.9	0	0	0	0	108.6	A820 K855 I856 F870 T871 V872	A820-V877 HydrophobicContact CB-CG2 3.73Å; K855-V877 HydrophobicContact CB-CB 4.38Å; K855-V877 HydrophobicContact CB-CG2 3.78Å; K855-V877 HydrophobicContact CD-CB 4.5Å; K855-V877 HydrophobicContact CD-CG2 3.9Å; K855-V877 HydrophobicContact CG-CG2 4.49Å; I856-V877 HydrophobicContact CD1-CG1 3.86Å; I856-V877 HydrophobicContact CD1-CG2 4.18Å; I856-V877 HydrophobicContact CG1-CG1 3.74Å; I856-V877 HydrophobicContact CG1-CG2 4.18Å; F870-V877 HydrophobicContact CB-CG1 4.32Å; F870-V877 HydrophobicContact CD1-CG1 3.69Å; F870-V877 HydrophobicContact CE1-CG1 4.49Å; F870-V877 HydrophobicContact CG-CG1 4.41Å; T871-V877 WeakPolarHBondContact O-CA 3.34Å; V872-V877 HydrophobicContact CG2-CG2 4.47Å
878	V	88.3	Confident	86.6	Confident	8 Å²	8	40 Å²	40	5%	0.048	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.8	177.3	-174.5	0	0	0	0	109.1	P375 L376 R424 L433 T871 S880	P375-V878 HydrophobicContact CB-CG1 3.99Å; P375-V878 HydrophobicContact CB-CG2 4.27Å; L376-V878 HydrophobicContact CD2-CG2 3.97Å; R424-V878 HydrophobicContact CG-CG1 4.2Å; L433-V878 HydrophobicContact CD1-CG1 4.21Å; L433-V878 HydrophobicContact CD2-CG1 3.84Å; T871-V878 PolarHBondContact N-O 3.01Å; T871-V878 PolarHBondContact O-N 3.37Å; V878-S880 PolarHBondContact O-N 3.2Å; V878-S880 PolarHBondContact O-OG 3.18Å
879	P	90.8	Very high	86.1	Confident	16 Å²	16	41.4 Å²	41.4	10%	0.104	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	119.2	171.9	-19.4	34.4	0	0	0	110.2	R424 R425 I426 F870	R424-P879 WeakPolarHBondContact CA-O 3.42Å; R425-P879 PolarHBondContact N-O 3.13Å; I426-P879 HydrophobicContact CB-CB 4Å; I426-P879 HydrophobicContact CB-CG 4.06Å; I426-P879 HydrophobicContact CD1-CB 3.85Å; I426-P879 HydrophobicContact CD1-CG 4.18Å; I426-P879 HydrophobicContact CG1-CB 3.88Å; I426-P879 HydrophobicContact CG1-CG 4.36Å; F870-P879 HydrophobicContact CD1-CB 4.09Å; F870-P879 HydrophobicContact CD1-CG 3.99Å; F870-P879 HydrophobicContact CE1-CB 3.98Å; F870-P879 HydrophobicContact CE1-CG 3.83Å
880	S	91.1	Very high	85.6	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	156.8	-161.8	-55.3	0	0	0	0	112.3	Y423 R425 L433 F869 T871 V878	Y423-S880 CarbonylContact O-C 3.52Å; Y423-S880 WeakPolarHBondContact O-CA 3.41Å; R425-S880 PolarHBondContact NE-O 3Å; R425-S880 PolarHBondContact NH2-O 2.85Å; L433-S880 WeakPolarHBondContact CD1-OG 3.37Å; F869-S880 PolarHBondContact N-O 3.06Å; F869-S880 PolarHBondContact O-N 3.06Å; T871-S880 WeakPolarHBondContact OG1-CB 3.38Å; T871-S880 PolarHBondContact OG1-OG 3.49Å; V878-S880 PolarHBondContact O-N 3.2Å; V878-S880 PolarHBondContact O-OG 3.18Å
881	A	90.8	Very high	85.1	Confident	4 Å²	4	43.8 Å²	43.8	3%	0.033	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.1	167.5	0	0	0	0	0	110.4	G422 Y423 R425 G867	G422-A881 CarbonylContact C-O 3.54Å; G422-A881 VanDerWaalsContact CA-O 3.29Å; G422-A881 WeakPolarHBondContact CA-O 3.28Å; Y423-A881 HydrophobicContact CE1-CB 3.91Å; Y423-A881 HydrophobicContact CE2-CB 3.98Å; Y423-A881 PolarHBondContact N-O 3.19Å; Y423-A881 PolarHBondContact O-N 3.01Å; R425-A881 HydrophobicContact CG-CB 3.75Å; G867-A881 WeakPolarHBondContact O-CA 3.42Å
882	S	90.7	Very high	84.1	Confident	11 Å²	11	46.5 Å²	46.5	8%	0.077	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-70.9	166.1	169.9	-159.1	0	0	0	0	111.7	Y423 A460 G867	Y423-S882 WeakPolarHBondContact CE1-O 3.44Å; A460-S882 VanDerWaalsContact CB-OG 3.3Å; A460-S882 WeakPolarHBondContact CB-OG 3.33Å; G867-S882 PolarHBondContact O-N 2.87Å
883	V	87.3	Confident	83.2	Confident	57 Å²	57	54.2 Å²	54.2	35%	0.345	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-66.9	144.3	154.1	177.6	0	0	0	0	108.6	Y420 A460	Y420-V883 HydrophobicContact CD1-CG2 4.29Å; Y420-V883 HydrophobicContact CE1-CG2 3.52Å; A460-V883 HydrophobicContact CB-CB 4.31Å; A460-V883 VanDerWaalsContact CB-O 3.22Å; A460-V883 WeakPolarHBondContact CB-O 3.09Å
884	Y	86.1	Confident	82.4	Confident	142 Å²	142	57.8 Å²	57.8	56%	0.557	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-100.6	131	169.1	-177.4	-106.2	0	0	0	109.8	D887	Y884-D887 PolarHBondContact OH-OD2 2.8Å; Y884-D887 VanDerWaalsContact OH-OD2 3.09Å
885	I	86.9	Confident	82	Confident	10 Å²	10	54.9 Å²	54.9	5%	0.051	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-93.3	124.4	170.4	-57.1	179.2	0	0	0	107.1	F459 L463 L490 E889 K890	F459-I885 HydrophobicContact CB-CD1 4.25Å; L463-I885 HydrophobicContact CD1-CD1 4.02Å; L463-I885 HydrophobicContact CD1-CG1 4.33Å; L463-I885 HydrophobicContact CD2-CD1 4.25Å; L463-I885 HydrophobicContact CG-CD1 4.19Å; L490-I885 HydrophobicContact CD1-CD1 4.03Å; L490-I885 HydrophobicContact CD2-CD1 4.08Å; L490-I885 HydrophobicContact CD2-CG2 4.48Å; I885-E889 HydrophobicContact CG2-CB 3.97Å; I885-K890 HydrophobicContact CG2-CG 3.93Å; I885-K890 WeakPolarHBondContact O-CE 3.46Å; I885-K890 PolarHBondContact O-NZ 2.81Å
886	P	85.7	Confident	82.3	Confident	48 Å²	48	57.9 Å²	57.9	31%	0.312	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-63.9	147.2	174.9	-20.6	32.9	0	0	0	112	S888 E889 K890	P886-S888 PolarHBondContact O-N 3.01Å; P886-E889 HydrophobicContact CB-CG 4.24Å; P886-E889 WeakPolarHBondContact CD-OE1 3.45Å; P886-E889 HydrophobicContact CG-CG 4.34Å; P886-E889 WeakPolarHBondContact CG-OE1 3.41Å; P886-E889 WeakPolarHBondContact O-CA 3.43Å; P886-E889 WeakPolarHBondContact O-CB 3.43Å; P886-E889 PolarHBondContact O-N 3.34Å; P886-K890 PolarHBondContact O-N 3.4Å
887	D	82.8	Confident	82.5	Confident	91 Å²	91	55.7 Å²	55.7	49%	0.487	32%	0.323	S	S	.	.	H	α-helix	trans	-64.4	-31.3	-176.7	-53.8	-60.9	0	0	0	112.7	Y884 E889 K890 S891	Y884-D887 PolarHBondContact OH-OD2 2.8Å; Y884-D887 VanDerWaalsContact OH-OD2 3.09Å; D887-E889 PolarHBondContact O-N 3.36Å; D887-K890 PolarHBondContact O-N 3.4Å; D887-K890 IonicContact OD1-NZ 2.73Å; D887-K890 PolarHBondContact OD1-NZ 2.96Å; D887-S891 PolarHBondContact O-N 3.24Å; D887-S891 PolarHBondContact O-OG 3.14Å
888	S	81.3	Confident	82.4	Confident	97 Å²	97	57 Å²	57	68%	0.678	33%	0.331	S	S	*	.	H	α-helix	trans	-62	-7.5	169.2	55.3	0	0	0	0	114.5	P886	P886-S888 PolarHBondContact O-N 3.01Å
889	E	79.2	Confident	82.3	Confident	70 Å²	70	57.8 Å²	57.8	33%	0.327	34%	0.335	S	S	.	.	H	α-helix	trans	-109.4	-15.3	175	-56.2	-157.2	-119.5	0	0	113	R493 I885 P886 D887	R493-E889 IonicContact CZ-OE2 3.7Å; R493-E889 PolarHBondContact NE-O 3.18Å; R493-E889 IonicContact NH1-OE2 3.46Å; R493-E889 PolarHBondContact NH1-OE2 3.43Å; R493-E889 VanDerWaalsContact NH2-CB 3.3Å; R493-E889 VanDerWaalsContact NH2-CG 3.32Å; R493-E889 IonicContact NH2-OE2 3.01Å; R493-E889 PolarHBondContact NH2-OE2 3.22Å; I885-E889 HydrophobicContact CG2-CB 3.97Å; P886-E889 HydrophobicContact CB-CG 4.24Å; P886-E889 WeakPolarHBondContact CD-OE1 3.45Å; P886-E889 HydrophobicContact CG-CG 4.34Å; P886-E889 WeakPolarHBondContact CG-OE1 3.41Å; P886-E889 WeakPolarHBondContact O-CA 3.43Å; P886-E889 WeakPolarHBondContact O-CB 3.43Å; P886-E889 PolarHBondContact O-N 3.34Å; D887-E889 PolarHBondContact O-N 3.36Å
890	K	81.5	Confident	82	Confident	12 Å²	12	58.4 Å²	58.4	5%	0.052	34%	0.337	C	S	.	.	H	α-helix	trans	-83.8	-15.1	174.9	-60.3	176.3	-165.2	158.5	0	113.4	E456 T486 Y489 I885 P886 D887	E456-K890 IonicContact OE1-NZ 3.16Å; E456-K890 PolarHBondContact OE1-NZ 3.04Å; E456-K890 VanDerWaalsContact OE2-CE 3.27Å; E456-K890 WeakPolarHBondContact OE2-CE 3.26Å; E456-K890 IonicContact OE2-NZ 2.9Å; E456-K890 PolarHBondContact OE2-NZ 3.21Å; T486-K890 HydrophobicContact CG2-CB 3.84Å; T486-K890 HydrophobicContact CG2-CD 4.26Å; T486-K890 HydrophobicContact CG2-CG 3.85Å; Y489-K890 VanDerWaalsContact CD2-O 3.22Å; Y489-K890 WeakPolarHBondContact CD2-O 3.45Å; I885-K890 HydrophobicContact CG2-CG 3.93Å; I885-K890 WeakPolarHBondContact O-CE 3.46Å; I885-K890 PolarHBondContact O-NZ 2.81Å; P886-K890 PolarHBondContact O-N 3.4Å; D887-K890 PolarHBondContact O-N 3.4Å; D887-K890 IonicContact OD1-NZ 2.73Å; D887-K890 PolarHBondContact OD1-NZ 2.96Å
891	S	78.8	Confident	81.6	Confident	57 Å²	57	63.3 Å²	63.3	40%	0.399	36%	0.355	S	S	.	.			trans	-146	151.9	-179.1	55.1	0	0	0	0	112.5	D887	D887-S891 PolarHBondContact O-N 3.24Å; D887-S891 PolarHBondContact O-OG 3.14Å
892	C	71.5	Confident	81.3	Confident	56 Å²	56	67 Å²	67	38%	0.378	37%	0.369	S	S	.	.			trans	-130.9	136.5	170.2	-168	0	0	0	0	110.2	Y489 S894	Y489-C892 HydrophobicContact CD1-CB 3.99Å; Y489-C892 HydrophobicContact CE1-CB 3.74Å; Y489-C892 PolarHBondContact OH-O 2.94Å; Y489-C892 VanDerWaalsContact OH-O 3.11Å; C892-S894 PolarHBondContact SG-OG 3.08Å; C892-S894 VanDerWaalsContact SG-OG 3.35Å
893	D	70.1	Confident	80.8	Confident	174 Å²	174	73.6 Å²	73.6	93%	0.93	40%	0.402	S	S	*	.	S	Bend	trans	-81.2	-19.4	-175.4	-66	-35.7	0	0	0	113.8
894	S	69.1	Low	79.9	Confident	88 Å²	88	75 Å²	75	62%	0.615	42%	0.415	S	S	*	.	S	Bend	trans	-79.7	-38.1	179.9	59.5	0	0	0	0	113.4	C892	C892-S894 PolarHBondContact SG-OG 3.08Å; C892-S894 VanDerWaalsContact SG-OG 3.35Å
895	D	70.3	Confident	79.4	Confident	60 Å²	60	74 Å²	74	32%	0.321	42%	0.423	S	S	.	.	S	Bend	trans	-105.7	113.9	-163.8	-73.6	31.1	0	0	0	110.2	Y489	Y489-D895 PolarHBondContact OH-O 3.31Å
896	P	79.2	Confident	78.5	Confident	99 Å²	99	79.5 Å²	79.5	64%	0.643	45%	0.448	S	S	*	.			trans	-72.2	131.7	175.4	29.4	-33.3	0	0	0	110.5	V898	P896-V898 PolarHBondContact O-N 2.81Å
897	V	83.7	Confident	77.6	Confident	39 Å²	39	81.2 Å²	81.2	24%	0.236	47%	0.466	C	S	.	.			trans	-59.4	120.8	170.7	175.2	0	0	0	0	109.6	R485 W488 Y489	R485-V897 HydrophobicContact CB-CG2 4.37Å; R485-V897 HydrophobicContact CG-CG2 4.18Å; W488-V897 HydrophobicContact CB-CG1 4.07Å; W488-V897 HydrophobicContact CB-CG2 4.47Å; W488-V897 HydrophobicContact CD2-CB 4.27Å; W488-V897 HydrophobicContact CD2-CG1 3.98Å; W488-V897 HydrophobicContact CD2-CG2 4.07Å; W488-V897 HydrophobicContact CE3-CB 4.37Å; W488-V897 HydrophobicContact CE3-CG2 3.78Å; W488-V897 HydrophobicContact CG-CG1 3.75Å; W488-V897 HydrophobicContact CG-CG2 4.38Å; W488-V897 HydrophobicContact CZ3-CG2 4.36Å; Y489-V897 HydrophobicContact CD2-CG2 4.22Å; Y489-V897 HydrophobicContact CE1-CG2 4.38Å; Y489-V897 HydrophobicContact CE2-CG2 3.49Å; Y489-V897 VanDerWaalsContact CE2-CG2 3.49Å
898	V	84.2	Confident	76.9	Confident	59 Å²	59	80 Å²	80	36%	0.358	46%	0.464	S	S	.	.			trans	-117.8	125.4	175.9	178.9	0	0	0	0	109.4	W488 P896	W488-V898 PolarHBondContact NE1-O 3.12Å; P896-V898 PolarHBondContact O-N 2.81Å
899	I	86.2	Confident	76.2	Confident	24 Å²	24	83.2 Å²	83.2	12%	0.123	46%	0.461	C	S	.	.			trans	-81.1	126	170.6	-61.6	169.2	0	0	0	108.8	V502 N527 R901	V502-I899 HydrophobicContact CB-CD1 4.34Å; V502-I899 HydrophobicContact CB-CG2 4.34Å; V502-I899 HydrophobicContact CG1-CD1 4.47Å; V502-I899 HydrophobicContact CG2-CD1 4.5Å; V502-I899 HydrophobicContact CG2-CG1 4.2Å; V502-I899 HydrophobicContact CG2-CG2 4.36Å; N527-I899 WeakPolarHBondContact OD1-CG2 3.06Å; I899-R901 PolarHBondContact O-NE 3.28Å
900	N	86.5	Confident	75.2	Confident	28 Å²	28	84.7 Å²	84.7	15%	0.15	47%	0.471	C	S	.	.			trans	-58.2	153.4	-176.2	-60.3	-28	0	0	0	112.9	E497 D498 I500 N527	E497-N900 PolarHBondContact O-ND2 3.13Å; D498-N900 PolarHBondContact O-ND2 2.94Å; I500-N900 PolarHBondContact O-ND2 3.29Å; N527-N900 PolarHBondContact ND2-O 2.85Å
901	R	82.6	Confident	74.2	Confident	103 Å²	103	89.4 Å²	89.4	39%	0.389	49%	0.493	S	S	.	.			trans	-134.5	125.8	-173.9	-58.2	-62.7	151.6	169.4	3.7	111.7	P524 S526 I899	P524-R901 PolarHBondContact O-NH1 3.33Å; P524-R901 PolarHBondContact O-NH2 2.71Å; S526-R901 PolarHBondContact O-NH1 3.5Å; I899-R901 PolarHBondContact O-NE 3.28Å
902	Y	83.9	Confident	73.6	Confident	82 Å²	82	94.7 Å²	94.7	32%	0.322	50%	0.504	S	S	.	.			trans	-97.5	159.4	178.1	-52.8	-94.5	0	0	0	109.5	D674	D674-Y902 HydrophobicContact CB-CD2 3.65Å; D674-Y902 HydrophobicContact CB-CE2 4.28Å; D674-Y902 HydrophobicContact CB-CG 4.42Å; D674-Y902 WeakPolarHBondContact OD1-CB 3.17Å; D674-Y902 WeakPolarHBondContact OD1-CD2 3.39Å
903	I	79.5	Confident	73.1	Confident	150 Å²	150	95.4 Å²	95.4	77%	0.769	50%	0.504	S	S	*	.			trans	-107	116.6	175.7	-60.7	176	0	0	0	106.4	V905	I903-V905 HydrophobicContact CG2-CG2 4.33Å; I903-V905 PolarHBondContact O-N 3.39Å; I903-V905 VanDerWaalsContact O-N 3.08Å
904	S	69.8	Low	72.4	Confident	87 Å²	87	91.2 Å²	91.2	61%	0.608	48%	0.475	S	S	*	.			trans	-67.6	108.5	175.4	-174	0	0	0	0	109.5	D671	D671-S904 WeakPolarHBondContact OD2-CB 3.17Å; D671-S904 PolarHBondContact OD2-OG 2.78Å
905	V	74.8	Confident	72.1	Confident	120 Å²	120	95.9 Å²	95.9	73%	0.727	48%	0.479	S	S	*	.			trans	-100.6	104.3	179.5	-179.8	0	0	0	0	109	I903 A907	I903-V905 HydrophobicContact CG2-CG2 4.33Å; I903-V905 PolarHBondContact O-N 3.39Å; I903-V905 VanDerWaalsContact O-N 3.08Å; V905-A907 PolarHBondContact O-N 2.78Å
906	E	68	Low	71.6	Confident	126 Å²	126	98.7 Å²	98.7	59%	0.589	49%	0.493	S	S	*	.			trans	-53.4	125	169.4	-86.6	-165.5	-158.8	0	0	109.6	R909	E906-R909 IonicContact OE1-NH2 3.81Å; E906-R909 PolarHBondContact OE1-NH2 3.5Å; E906-R909 IonicContact OE2-CZ 3.94Å; E906-R909 IonicContact OE2-NE 3.42Å; E906-R909 PolarHBondContact OE2-NE 3.37Å; E906-R909 IonicContact OE2-NH2 2.86Å; E906-R909 PolarHBondContact OE2-NH2 2.6Å
907	A	66.6	Low	70.4	Confident	84 Å²	84	97.3 Å²	97.3	69%	0.694	48%	0.483	S	S	*	.			trans	-54.1	127.3	166.3	0	0	0	0	0	108.7	V905 R909	V905-A907 PolarHBondContact O-N 2.78Å; A907-R909 PolarHBondContact O-N 3.36Å
908	P	69.1	Low	68.7	Low	66 Å²	66	98.5 Å²	98.5	43%	0.429	49%	0.492	S	S	.	.			trans	-59.6	115.1	-169.5	21.7	-33.1	0	0	0	110	L910 L913	P908-L910 PolarHBondContact O-N 3.28Å; P908-L913 HydrophobicContact CB-CD2 4.13Å; P908-L913 HydrophobicContact CB-CG 4.08Å; P908-L913 HydrophobicContact CG-CD1 4.2Å; P908-L913 HydrophobicContact CG-CD2 3.82Å; P908-L913 HydrophobicContact CG-CG 4.02Å; P908-L913 VanDerWaalsContact O-CD1 3.3Å; P908-L913 WeakPolarHBondContact O-CD1 3.46Å; P908-L913 WeakPolarHBondContact O-CG 3.44Å
909	R	66.1	Low	66.7	Low	163 Å²	163	104.3 Å²	104.3	62%	0.615	51%	0.507	S	S	*	.			trans	-45.7	138.1	-172.6	-61.7	-178.1	-171.2	-177	-0.6	110.7	E906 A907 E911 R912 L913	E906-R909 IonicContact OE1-NH2 3.81Å; E906-R909 PolarHBondContact OE1-NH2 3.5Å; E906-R909 IonicContact OE2-CZ 3.94Å; E906-R909 IonicContact OE2-NE 3.42Å; E906-R909 PolarHBondContact OE2-NE 3.37Å; E906-R909 IonicContact OE2-NH2 2.86Å; E906-R909 PolarHBondContact OE2-NH2 2.6Å; A907-R909 PolarHBondContact O-N 3.36Å; R909-E911 CarbonylContact O-C 3.48Å; R909-E911 PolarHBondContact O-N 3.09Å; R909-R912 WeakPolarHBondContact O-CA 3.48Å; R909-R912 WeakPolarHBondContact O-CB 3.48Å; R909-R912 PolarHBondContact O-N 2.82Å; R909-L913 PolarHBondContact O-N 2.71Å
910	L	57.5	Low	64.7	Low	102 Å²	102	108.1 Å²	108.1	53%	0.534	53%	0.532	S	S	.	.	H	α-helix	trans	-54.8	-29.5	-172.9	-173.9	59.1	0	0	0	112.9	P908 R914	P908-L910 PolarHBondContact O-N 3.28Å; L910-R914 VanDerWaalsContact CD2-NH2 3.33Å; L910-R914 WeakPolarHBondContact O-CB 3.07Å; L910-R914 WeakPolarHBondContact O-CD 3.41Å; L910-R914 WeakPolarHBondContact O-CG 3.41Å; L910-R914 PolarHBondContact O-N 3.36Å
911	E	60.7	Low	62.5	Low	111 Å²	111	109.4 Å²	109.4	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-67	-42.9	171.2	-158.5	-158.1	144.6	0	0	113.8	R909 R914 R915	R909-E911 CarbonylContact O-C 3.48Å; R909-E911 PolarHBondContact O-N 3.09Å; E911-R914 WeakPolarHBondContact O-CB 3.38Å; E911-R914 PolarHBondContact O-N 3.46Å; E911-R915 WeakPolarHBondContact O-CG 3.19Å; E911-R915 PolarHBondContact O-N 2.99Å; E911-R915 IonicContact OE1-CZ 3.43Å; E911-R915 IonicContact OE1-NE 3.58Å; E911-R915 PolarHBondContact OE1-NE 3.33Å; E911-R915 IonicContact OE1-NH2 2.8Å; E911-R915 PolarHBondContact OE1-NH2 2.75Å
912	R	66	Low	60.5	Low	167 Å²	167	106.4 Å²	106.4	63%	0.63	53%	0.531	S	S	*	.	H	α-helix	trans	-64.9	-41.5	174.6	-173	179.1	-179.7	-175.8	-0.4	111	R909 R915 L916	R909-R912 WeakPolarHBondContact O-CA 3.48Å; R909-R912 WeakPolarHBondContact O-CB 3.48Å; R909-R912 PolarHBondContact O-N 2.82Å; R912-R915 PolarHBondContact O-N 2.81Å; R912-L916 HydrophobicContact CG-CD1 4.05Å; R912-L916 WeakPolarHBondContact O-CB 3.24Å; R912-L916 WeakPolarHBondContact O-CG 3.47Å; R912-L916 PolarHBondContact O-N 3.25Å
913	L	61.4	Low	58.3	Low	72 Å²	72	113.7 Å²	113.7	38%	0.377	56%	0.558	S	S	.	*	H	α-helix	trans	-61	-42.1	172.6	-75.5	176	0	0	0	112.1	P908 R909 R915 L916 V917	P908-L913 HydrophobicContact CB-CD2 4.13Å; P908-L913 HydrophobicContact CB-CG 4.08Å; P908-L913 HydrophobicContact CG-CD1 4.2Å; P908-L913 HydrophobicContact CG-CD2 3.82Å; P908-L913 HydrophobicContact CG-CG 4.02Å; P908-L913 VanDerWaalsContact O-CD1 3.3Å; P908-L913 WeakPolarHBondContact O-CD1 3.46Å; P908-L913 WeakPolarHBondContact O-CG 3.44Å; R909-L913 PolarHBondContact O-N 2.71Å; L913-R915 VanDerWaalsContact C-N 3.35Å; L913-R915 PolarHBondContact O-N 3.14Å; L913-L916 PolarHBondContact O-N 3.49Å; L913-V917 PolarHBondContact O-N 3.44Å
914	R	55.6	Low	56.4	Low	85 Å²	85	114.9 Å²	114.9	32%	0.321	55%	0.552	S	S	.	*	H	α-helix	trans	-61.2	-39.2	174.4	-75.7	168.3	-173.1	170.5	6.1	112.7	L910 E911 V917 V921	L910-R914 VanDerWaalsContact CD2-NH2 3.33Å; L910-R914 WeakPolarHBondContact O-CB 3.07Å; L910-R914 WeakPolarHBondContact O-CD 3.41Å; L910-R914 WeakPolarHBondContact O-CG 3.41Å; L910-R914 PolarHBondContact O-N 3.36Å; E911-R914 WeakPolarHBondContact O-CB 3.38Å; E911-R914 PolarHBondContact O-N 3.46Å; R914-V917 CarbonylContact O-C 3.43Å; R914-V921 HydrophobicContact CB-CG2 3.66Å; R914-V921 HydrophobicContact CG-CG2 3.93Å; R914-V921 VanDerWaalsContact O-CG2 3.23Å; R914-V921 WeakPolarHBondContact O-CG2 3.14Å
915	R	62.5	Low	54.8	Low	187 Å²	187	117.9 Å²	117.9	71%	0.706	56%	0.561	S	S	*	*	H	α-helix	trans	-68.4	-36.8	174.8	-67.2	177.6	-170.3	-149	7	112.4	E911 R912 L913	E911-R915 WeakPolarHBondContact O-CG 3.19Å; E911-R915 PolarHBondContact O-N 2.99Å; E911-R915 IonicContact OE1-CZ 3.43Å; E911-R915 IonicContact OE1-NE 3.58Å; E911-R915 PolarHBondContact OE1-NE 3.33Å; E911-R915 IonicContact OE1-NH2 2.8Å; E911-R915 PolarHBondContact OE1-NH2 2.75Å; R912-R915 PolarHBondContact O-N 2.81Å; L913-R915 VanDerWaalsContact C-N 3.35Å; L913-R915 PolarHBondContact O-N 3.14Å
916	L	59.6	Low	53.3	Low	118 Å²	118	115.6 Å²	115.6	62%	0.618	55%	0.549	S	S	*	.	H	α-helix	trans	-79.7	-27.8	-179.7	-70.8	170.5	0	0	0	113.8	R912 L913	R912-L916 HydrophobicContact CG-CD1 4.05Å; R912-L916 WeakPolarHBondContact O-CB 3.24Å; R912-L916 WeakPolarHBondContact O-CG 3.47Å; R912-L916 PolarHBondContact O-N 3.25Å; L913-L916 PolarHBondContact O-N 3.49Å
917	V	55	Low	52.1	Low	70 Å²	70	111.8 Å²	111.8	42%	0.424	53%	0.534	S	S	.	.			trans	-129.8	78.6	179.5	-168.1	0	0	0	0	110	L913 R914 R919 T920	L913-V917 PolarHBondContact O-N 3.44Å; R914-V917 CarbonylContact O-C 3.43Å; V917-R919 PolarHBondContact O-N 3.25Å; V917-R919 VanDerWaalsContact O-N 3.09Å; V917-T920 HydrophobicContact CG1-CG2 4.49Å; V917-T920 WeakPolarHBondContact CG1-OG1 3.17Å; V917-T920 PolarHBondContact O-N 3.15Å; V917-T920 VanDerWaalsContact O-N 3.13Å; V917-T920 PolarHBondContact O-OG1 3.21Å
918	P	48.1	Very low	50.7	Low	65 Å²	65	112.3 Å²	112.3	42%	0.422	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-54.3	-33.3	-177.9	-28.8	36.5	0	0	0	114	T920 V921	P918-T920 VanDerWaalsContact C-N 3.27Å; P918-T920 PolarHBondContact O-N 3.06Å; P918-V921 VanDerWaalsContact O-CB 3.29Å; P918-V921 WeakPolarHBondContact O-CB 3.25Å; P918-V921 VanDerWaalsContact O-CG2 3.28Å; P918-V921 WeakPolarHBondContact O-CG2 3.37Å; P918-V921 PolarHBondContact O-N 2.71Å
919	R	41.4	Very low	49.4	Very low	181 Å²	181	113 Å²	113	68%	0.683	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-63	-23	-179.3	-69.7	179.7	172.5	164.7	-0.1	114.8	V917 D978	V917-R919 PolarHBondContact O-N 3.25Å; V917-R919 VanDerWaalsContact O-N 3.09Å; R919-D978 IonicContact CZ-OD2 3.17Å; R919-D978 IonicContact NE-OD2 3.92Å; R919-D978 PolarHBondContact NE-OD2 3.18Å; R919-D978 IonicContact NH2-OD2 2.73Å; R919-D978 PolarHBondContact NH2-OD2 3.41Å; R919-D978 VanDerWaalsContact NH2-OD2 3.1Å
920	T	43.3	Very low	48.5	Very low	104 Å²	104	110.9 Å²	110.9	64%	0.638	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-92.4	-5.7	174	37.4	0	0	0	0	113.9	V917 P918 Q922	V917-T920 HydrophobicContact CG1-CG2 4.49Å; V917-T920 WeakPolarHBondContact CG1-OG1 3.17Å; V917-T920 PolarHBondContact O-N 3.15Å; V917-T920 VanDerWaalsContact O-N 3.13Å; V917-T920 PolarHBondContact O-OG1 3.21Å; P918-T920 VanDerWaalsContact C-N 3.27Å; P918-T920 PolarHBondContact O-N 3.06Å; T920-Q922 VanDerWaalsContact C-N 3.31Å
921	V	41.7	Very low	47.9	Very low	54 Å²	54	108.3 Å²	108.3	33%	0.327	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-70.9	-30.4	175	-169	0	0	0	0	111.6	R914 P918 R923	R914-V921 HydrophobicContact CB-CG2 3.66Å; R914-V921 HydrophobicContact CG-CG2 3.93Å; R914-V921 VanDerWaalsContact O-CG2 3.23Å; R914-V921 WeakPolarHBondContact O-CG2 3.14Å; P918-V921 VanDerWaalsContact O-CB 3.29Å; P918-V921 WeakPolarHBondContact O-CB 3.25Å; P918-V921 VanDerWaalsContact O-CG2 3.28Å; P918-V921 WeakPolarHBondContact O-CG2 3.37Å; P918-V921 PolarHBondContact O-N 2.71Å; V921-R923 VanDerWaalsContact C-N 3.28Å; V921-R923 PolarHBondContact O-N 2.91Å; V921-R923 VanDerWaalsContact O-N 3.13Å
922	Q	40.6	Very low	47.1	Very low	41 Å²	41	106.3 Å²	106.3	19%	0.192	51%	0.511	C	S	.	.	G	3₁₀ helix	trans	-76.5	2.1	-163.2	-57	173.2	0.9	0	0	115.6	T920 D978	T920-Q922 VanDerWaalsContact C-N 3.31Å; Q922-D978 PolarHBondContact NE2-O 2.84Å; Q922-D978 PolarHBondContact NE2-OD1 2.88Å
923	R	37.6	Very low	46.2	Very low	235 Å²	235	101.5 Å²	101.5	89%	0.887	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-114.2	22.2	-172.5	-71.2	-168.2	178.3	-174.3	1.2	116.4	V921	V921-R923 VanDerWaalsContact C-N 3.28Å; V921-R923 PolarHBondContact O-N 2.91Å; V921-R923 VanDerWaalsContact O-N 3.13Å
924	R	38.6	Very low	45.6	Very low	174 Å²	174	102 Å²	102	66%	0.657	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-85.4	121.2	164.4	-84	-168.4	168.1	-163	-5.7	110.4
925	L	37	Very low	45.1	Very low	151 Å²	151	101 Å²	101	79%	0.791	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-53.3	150.9	158.1	-70.8	163.8	0	0	0	109.3	T927	L925-T927 PolarHBondContact O-N 3.48Å
926	P	42.6	Very low	44.4	Very low	72 Å²	72	93.9 Å²	93.9	47%	0.468	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-51.6	135.2	165.8	23.7	-33.3	0	0	0	108.9	H930 V931	P926-H930 HydrophobicContact CB-CB 4.26Å; P926-V931 HydrophobicContact CB-CG2 3.92Å; P926-V931 HydrophobicContact CG-CG2 3.7Å; P926-V931 WeakPolarHBondContact O-CG2 3.44Å
927	T	42.5	Very low	43.8	Very low	45 Å²	45	91.6 Å²	91.6	28%	0.276	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-64.6	157.9	-169.6	63.6	0	0	0	0	111.4	L925 E929 H930 V931	L925-T927 PolarHBondContact O-N 3.48Å; T927-E929 WeakPolarHBondContact CB-OE2 3.45Å; T927-E929 PolarHBondContact O-N 2.72Å; T927-E929 VanDerWaalsContact O-N 3.08Å; T927-E929 PolarHBondContact OG1-OE2 2.99Å; T927-H930 PolarHBondContact O-N 3.36Å; T927-H930 PolarHBondContact OG1-N 3.44Å; T927-H930 PolarHBondContact OG1-ND1 3.15Å; T927-V931 PolarHBondContact O-N 2.98Å
928	P	38	Very low	43.2	Very low	95 Å²	95	91.3 Å²	91.3	62%	0.617	48%	0.476	S	S	*	.	H	α-helix	trans	-52.3	-31.9	177.6	-28.7	37.2	0	0	0	113.4	S932	P928-S932 WeakPolarHBondContact O-CA 3.25Å; P928-S932 WeakPolarHBondContact O-CB 3.49Å; P928-S932 PolarHBondContact O-N 3.28Å
929	E	40.9	Very low	43	Very low	81 Å²	81	91.4 Å²	91.4	38%	0.379	48%	0.476	S	S	.	.	H	α-helix	trans	-73.2	-38.3	175.3	-39.3	76.3	-167.3	0	0	112.1	T927 S933	T927-E929 WeakPolarHBondContact CB-OE2 3.45Å; T927-E929 PolarHBondContact O-N 2.72Å; T927-E929 VanDerWaalsContact O-N 3.08Å; T927-E929 PolarHBondContact OG1-OE2 2.99Å; E929-S933 WeakPolarHBondContact O-CB 3.08Å; E929-S933 PolarHBondContact O-N 2.89Å; E929-S933 PolarHBondContact O-OG 2.88Å
930	H	47.9	Very low	43.2	Very low	118 Å²	118	86.1 Å²	86.1	55%	0.546	47%	0.471	S	S	.	.	H	α-helix	trans	-66.9	-41.1	173.4	-79.1	98.3	0	0	0	111.9	P926 T927 S933 I934	P926-H930 HydrophobicContact CB-CB 4.26Å; T927-H930 PolarHBondContact O-N 3.36Å; T927-H930 PolarHBondContact OG1-N 3.44Å; T927-H930 PolarHBondContact OG1-ND1 3.15Å; H930-S933 WeakPolarHBondContact CA-OG 3.33Å; H930-S933 PolarHBondContact O-OG 3.33Å; H930-S933 VanDerWaalsContact O-OG 3.1Å; H930-I934 WeakPolarHBondContact O-CB 3.26Å; H930-I934 WeakPolarHBondContact O-CD1 2.82Å; H930-I934 VanDerWaalsContact O-CG1 3.22Å; H930-I934 WeakPolarHBondContact O-CG1 3.41Å; H930-I934 PolarHBondContact O-N 2.9Å
931	V	45.3	Very low	42.9	Very low	48 Å²	48	91 Å²	91	29%	0.291	48%	0.483	S	S	.	.	H	α-helix	trans	-70.8	-41	176.5	179.3	0	0	0	0	110.8	P926 T927 I935	P926-V931 HydrophobicContact CB-CG2 3.92Å; P926-V931 HydrophobicContact CG-CG2 3.7Å; P926-V931 WeakPolarHBondContact O-CG2 3.44Å; T927-V931 PolarHBondContact O-N 2.98Å; V931-I935 HydrophobicContact CG1-CD1 3.73Å; V931-I935 HydrophobicContact CG1-CG1 4.43Å; V931-I935 WeakPolarHBondContact O-CB 3.21Å; V931-I935 VanDerWaalsContact O-CG1 3.22Å; V931-I935 WeakPolarHBondContact O-CG1 2.86Å; V931-I935 PolarHBondContact O-N 3.31Å
932	S	43.1	Very low	42.8	Very low	70 Å²	70	92.8 Å²	92.8	49%	0.49	50%	0.496	S	S	.	.	H	α-helix	trans	-75.8	-29.4	-179.2	-170.7	0	0	0	0	113.5	P928 G936	P928-S932 WeakPolarHBondContact O-CA 3.25Å; P928-S932 WeakPolarHBondContact O-CB 3.49Å; P928-S932 PolarHBondContact O-N 3.28Å; S932-G936 WeakPolarHBondContact O-CA 3.1Å; S932-G936 PolarHBondContact O-N 3.04Å
933	S	47.8	Very low	42.8	Very low	65 Å²	65	95.1 Å²	95.1	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-69.5	-45.5	170.2	53.2	0	0	0	0	111.2	E929 H930 I935 G936 V937	E929-S933 WeakPolarHBondContact O-CB 3.08Å; E929-S933 PolarHBondContact O-N 2.89Å; E929-S933 PolarHBondContact O-OG 2.88Å; H930-S933 WeakPolarHBondContact CA-OG 3.33Å; H930-S933 PolarHBondContact O-OG 3.33Å; H930-S933 VanDerWaalsContact O-OG 3.1Å; S933-I935 PolarHBondContact O-N 3.21Å; S933-G936 PolarHBondContact O-N 3Å; S933-V937 WeakPolarHBondContact O-CG2 3.36Å; S933-V937 PolarHBondContact O-N 3.37Å
934	I	47.7	Very low	42.9	Very low	83 Å²	83	95.9 Å²	95.9	43%	0.426	52%	0.52	S	S	.	.	H	α-helix	trans	-58.2	-48.4	171.7	-70	170.1	0	0	0	110.6	H930 G936 L938	H930-I934 WeakPolarHBondContact O-CB 3.26Å; H930-I934 WeakPolarHBondContact O-CD1 2.82Å; H930-I934 VanDerWaalsContact O-CG1 3.22Å; H930-I934 WeakPolarHBondContact O-CG1 3.41Å; H930-I934 PolarHBondContact O-N 2.9Å; I934-G936 PolarHBondContact O-N 3.38Å; I934-L938 HydrophobicContact CG2-CD1 3.72Å; I934-L938 WeakPolarHBondContact O-CB 3.49Å; I934-L938 WeakPolarHBondContact O-CD1 3.36Å; I934-L938 WeakPolarHBondContact O-CG 3.23Å; I934-L938 PolarHBondContact O-N 3.27Å; I934-L938 VanDerWaalsContact O-N 3.1Å
935	I	45.7	Very low	43.2	Very low	65 Å²	65	97.1 Å²	97.1	33%	0.333	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-40.4	176.4	-72.8	172.5	0	0	0	111.5	V931 S933 L938 T939	V931-I935 HydrophobicContact CG1-CD1 3.73Å; V931-I935 HydrophobicContact CG1-CG1 4.43Å; V931-I935 WeakPolarHBondContact O-CB 3.21Å; V931-I935 VanDerWaalsContact O-CG1 3.22Å; V931-I935 WeakPolarHBondContact O-CG1 2.86Å; V931-I935 PolarHBondContact O-N 3.31Å; S933-I935 PolarHBondContact O-N 3.21Å; I935-L938 CarbonylContact O-C 3.54Å; I935-L938 PolarHBondContact O-N 3.09Å; I935-L938 VanDerWaalsContact O-N 3.1Å; I935-T939 HydrophobicContact CG2-CG2 3.85Å; I935-T939 VanDerWaalsContact O-CB 3.29Å; I935-T939 WeakPolarHBondContact O-CB 3.32Å; I935-T939 VanDerWaalsContact O-CG2 3.29Å; I935-T939 WeakPolarHBondContact O-CG2 3.39Å; I935-T939 PolarHBondContact O-N 3.39Å; I935-T939 PolarHBondContact O-OG1 2.96Å
936	G	47.4	Very low	43.4	Very low	36 Å²	36	98 Å²	98	37%	0.371	52%	0.523	S	S	.	.	H	α-helix	trans	-62.7	-44.9	179.8	0	0	0	0	0	112.4	S932 S933 I934 L938 T939 A940	S932-G936 WeakPolarHBondContact O-CA 3.1Å; S932-G936 PolarHBondContact O-N 3.04Å; S933-G936 PolarHBondContact O-N 3Å; I934-G936 PolarHBondContact O-N 3.38Å; G936-L938 VanDerWaalsContact C-N 3.26Å; G936-L938 PolarHBondContact O-N 3.27Å; G936-T939 PolarHBondContact O-N 2.99Å; G936-A940 PolarHBondContact O-N 2.9Å
937	V	47.9	Very low	43.4	Very low	70 Å²	70	106.5 Å²	106.5	42%	0.424	55%	0.546	S	S	.	.	H	α-helix	trans	-59.7	-37.4	171.4	170.4	0	0	0	0	111.3	S933 T1010 L1011	S933-V937 WeakPolarHBondContact O-CG2 3.36Å; S933-V937 PolarHBondContact O-N 3.37Å; V937-T1010 VanDerWaalsContact O-CG2 3.29Å; V937-T1010 WeakPolarHBondContact O-CG2 3.5Å; V937-L1011 HydrophobicContact CG1-CD2 3.96Å
938	L	42.1	Very low	43.5	Very low	64 Å²	64	113.5 Å²	113.5	34%	0.335	57%	0.572	S	S	.	*	H	α-helix	trans	-87.8	-9.2	-177.5	-64.6	167.8	0	0	0	115	I934 I935 G936 I957	I934-L938 HydrophobicContact CG2-CD1 3.72Å; I934-L938 WeakPolarHBondContact O-CB 3.49Å; I934-L938 WeakPolarHBondContact O-CD1 3.36Å; I934-L938 WeakPolarHBondContact O-CG 3.23Å; I934-L938 PolarHBondContact O-N 3.27Å; I934-L938 VanDerWaalsContact O-N 3.1Å; I935-L938 CarbonylContact O-C 3.54Å; I935-L938 PolarHBondContact O-N 3.09Å; I935-L938 VanDerWaalsContact O-N 3.1Å; G936-L938 VanDerWaalsContact C-N 3.26Å; G936-L938 PolarHBondContact O-N 3.27Å; L938-I957 HydrophobicContact CB-CD1 3.66Å; L938-I957 HydrophobicContact CB-CG1 4.05Å; L938-I957 HydrophobicContact CD1-CD1 4.46Å; L938-I957 HydrophobicContact CD1-CG1 4.09Å; L938-I957 HydrophobicContact CD1-CG2 3.94Å
939	T	44.3	Very low	43.4	Very low	68 Å²	68	115.5 Å²	115.5	42%	0.417	58%	0.578	S	S	.	*	H	α-helix	trans	-121.1	3.2	-174.8	58.2	0	0	0	0	115.1	I935 G936 K941 I957	I935-T939 HydrophobicContact CG2-CG2 3.85Å; I935-T939 VanDerWaalsContact O-CB 3.29Å; I935-T939 WeakPolarHBondContact O-CB 3.32Å; I935-T939 VanDerWaalsContact O-CG2 3.29Å; I935-T939 WeakPolarHBondContact O-CG2 3.39Å; I935-T939 PolarHBondContact O-N 3.39Å; I935-T939 PolarHBondContact O-OG1 2.96Å; G936-T939 PolarHBondContact O-N 2.99Å; T939-K941 PolarHBondContact O-N 2.93Å; T939-I957 HydrophobicContact CG2-CD1 4.4Å
940	A	44.7	Very low	43.3	Very low	70 Å²	70	123.9 Å²	123.9	58%	0.579	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-50.3	125.7	177.5	0	0	0	0	0	112.7	G936	G936-A940 PolarHBondContact O-N 2.9Å
941	K	38.5	Very low	43.1	Very low	205 Å²	205	124.1 Å²	124.1	89%	0.891	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-60.3	123.4	-167.8	-76.5	175.6	178.5	166.4	0	112.7	T939	T939-K941 PolarHBondContact O-N 2.93Å
942	P	39.7	Very low	43.1	Very low	92 Å²	92	128.4 Å²	128.4	60%	0.597	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-69.9	147.3	177.2	28.3	-34.5	0	0	0	112.2	R946	P942-R946 HydrophobicContact CB-CB 4.24Å
943	S	40.4	Very low	43	Very low	90 Å²	90	127.9 Å²	127.9	63%	0.629	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-68.6	160.5	-174.8	71.8	0	0	0	0	114	K945 R946	S943-K945 PolarHBondContact O-N 3.11Å; S943-R946 PolarHBondContact O-N 2.66Å
944	R	38.2	Very low	42.8	Very low	251 Å²	251	131.6 Å²	131.6	95%	0.947	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.6	-22.6	-170.1	-117.2	177.4	-179.7	174	-0.5	116.1
945	K	44.9	Very low	42.6	Very low	201 Å²	201	137 Å²	137	87%	0.874	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-20.7	179	-76.3	-174.8	174.3	180	0	115	S943 R947	S943-K945 PolarHBondContact O-N 3.11Å; K945-R947 PolarHBondContact O-N 2.96Å
946	R	42.7	Very low	42.7	Very low	170 Å²	170	136.5 Å²	136.5	64%	0.642	65%	0.645	S	S	*	*			trans	-80.9	-1	-170.3	-89.1	-172.1	173.4	-176.8	0.4	116.5	P942 S943 K948	P942-R946 HydrophobicContact CB-CB 4.24Å; S943-R946 PolarHBondContact O-N 2.66Å; R946-K948 PolarHBondContact O-N 3.3Å
947	R	42.1	Very low	42.9	Very low	249 Å²	249	135.7 Å²	135.7	94%	0.94	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	12.3	-169.8	-116.3	-176.6	-174.7	-172.5	0.3	117.4	K945	K945-R947 PolarHBondContact O-N 2.96Å
948	K	43.6	Very low	42.9	Very low	193 Å²	193	135.4 Å²	135.4	84%	0.839	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	-16.3	-166.5	-138.3	178.3	-176.8	-175.2	0	116.5	R946	R946-K948 PolarHBondContact O-N 3.3Å
949	N	37.7	Very low	43.5	Very low	137 Å²	137	135.2 Å²	135.2	73%	0.733	63%	0.63	S	S	*	*			trans	-114	134.7	180	-69.3	17	0	0	0	111.1	T951	N949-T951 PolarHBondContact O-N 2.92Å
950	R	38.7	Very low	44.1	Very low	256 Å²	256	134.6 Å²	134.6	97%	0.966	62%	0.621	S	S	*	*			trans	-89.6	62.7	-176.8	-73.4	177.1	158.8	179	-7	112.6
951	T	43.1	Very low	44.7	Very low	123 Å²	123	134.7 Å²	134.7	76%	0.755	61%	0.61	S	S	*	*			trans	-118.7	112.4	171.8	37.5	0	0	0	0	110.3	N949	N949-T951 PolarHBondContact O-N 2.92Å
952	E	44.6	Very low	45.6	Very low	138 Å²	138	132.2 Å²	132.2	65%	0.645	60%	0.595	S	S	*	*			trans	-85.9	120.8	-174	-72.4	-178.7	177.2	0	0	111.5	Y954	E952-Y954 HydrophobicContact CB-CD2 3.86Å; E952-Y954 HydrophobicContact CB-CE2 4.21Å; E952-Y954 HydrophobicContact CG-CD2 4.32Å; E952-Y954 HydrophobicContact CG-CE2 4.31Å; E952-Y954 PolarHBondContact O-N 2.84Å
953	P	41.6	Very low	46.7	Very low	59 Å²	59	132 Å²	132	38%	0.383	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.6	-20.5	-176.5	27.6	-34.5	0	0	0	113.2	R955 I956	P953-R955 VanDerWaalsContact C-N 3.29Å; P953-R955 PolarHBondContact O-N 3.25Å; P953-I956 PolarHBondContact O-N 2.86Å
954	Y	42.5	Very low	47.8	Very low	144 Å²	144	130 Å²	130	57%	0.565	57%	0.568	S	S	*	*	H	α-helix	trans	-62.5	-31.6	-170.8	-40.2	-62.1	0	0	0	113.5	E952 I956 I957 D958	E952-Y954 HydrophobicContact CB-CD2 3.86Å; E952-Y954 HydrophobicContact CB-CE2 4.21Å; E952-Y954 HydrophobicContact CG-CD2 4.32Å; E952-Y954 HydrophobicContact CG-CE2 4.31Å; E952-Y954 PolarHBondContact O-N 2.84Å; Y954-I956 VanDerWaalsContact C-N 3.34Å; Y954-I956 PolarHBondContact O-N 2.82Å; Y954-I957 PolarHBondContact O-N 3.34Å; Y954-D958 PolarHBondContact O-N 2.87Å
955	R	43.3	Very low	48.8	Very low	197 Å²	197	120.3 Å²	120.3	74%	0.743	54%	0.542	S	S	*	.	H	α-helix	trans	-65.2	-33.3	178.6	-86	-174.4	169.8	-171.9	-3.4	113.7	P953 T959	P953-R955 VanDerWaalsContact C-N 3.29Å; P953-R955 PolarHBondContact O-N 3.25Å; R955-T959 WeakPolarHBondContact O-CB 3.49Å; R955-T959 PolarHBondContact O-N 2.95Å; R955-T959 VanDerWaalsContact O-N 3.08Å; R955-T959 PolarHBondContact O-OG1 3.47Å
956	I	49.5	Very low	49.7	Very low	53 Å²	53	115 Å²	115	27%	0.272	53%	0.526	S	S	.	.	H	α-helix	trans	-70.3	-40.3	-178.3	-59.5	169.3	0	0	0	109.3	P953 Y954 T959 F960 E1003	P953-I956 PolarHBondContact O-N 2.86Å; Y954-I956 VanDerWaalsContact C-N 3.34Å; Y954-I956 PolarHBondContact O-N 2.82Å; I956-T959 PolarHBondContact O-N 2.83Å; I956-F960 PolarHBondContact O-N 3.5Å; I956-E1003 HydrophobicContact CD1-CG 4.13Å; I956-E1003 HydrophobicContact CG1-CG 4.24Å; I956-E1003 HydrophobicContact CG2-CB 4.46Å; I956-E1003 HydrophobicContact CG2-CG 4.19Å
957	I	50.1	Low	50.7	Low	20 Å²	20	107.5 Å²	107.5	10%	0.103	50%	0.501	C	S	.	.	H	α-helix	trans	-60.3	-54.9	176.5	-50.5	175.1	0	0	0	110.7	L938 T939 Y954 T959 F960 Q961	L938-I957 HydrophobicContact CB-CD1 3.66Å; L938-I957 HydrophobicContact CB-CG1 4.05Å; L938-I957 HydrophobicContact CD1-CD1 4.46Å; L938-I957 HydrophobicContact CD1-CG1 4.09Å; L938-I957 HydrophobicContact CD1-CG2 3.94Å; T939-I957 HydrophobicContact CG2-CD1 4.4Å; Y954-I957 PolarHBondContact O-N 3.34Å; I957-T959 VanDerWaalsContact C-N 3.29Å; I957-T959 PolarHBondContact O-N 2.7Å; I957-F960 PolarHBondContact O-N 2.78Å; I957-Q961 HydrophobicContact CG2-CG 4.38Å; I957-Q961 WeakPolarHBondContact O-CB 3.46Å; I957-Q961 WeakPolarHBondContact O-CG 3.48Å; I957-Q961 PolarHBondContact O-N 3.45Å
958	D	49	Very low	51.8	Low	64 Å²	64	98.5 Å²	98.5	34%	0.342	47%	0.469	S	S	.	.	H	α-helix	trans	-60.2	-36.3	-179.7	-177.1	47.1	0	0	0	112.1	Y954 R962	Y954-D958 PolarHBondContact O-N 2.87Å; D958-R962 WeakPolarHBondContact O-CG 3.44Å; D958-R962 PolarHBondContact O-N 2.56Å; D958-R962 IonicContact OD1-CZ 3.9Å; D958-R962 IonicContact OD1-NE 4Å; D958-R962 IonicContact OD1-NH2 3.61Å; D958-R962 PolarHBondContact OD1-NH2 3.05Å; D958-R962 IonicContact OD2-CZ 3.74Å; D958-R962 IonicContact OD2-NH1 3.55Å; D958-R962 PolarHBondContact OD2-NH1 2.86Å; D958-R962 IonicContact OD2-NH2 2.71Å; D958-R962 PolarHBondContact OD2-NH2 2.81Å
959	T	53.8	Low	52.5	Low	60 Å²	60	93.3 Å²	93.3	37%	0.368	45%	0.454	S	S	.	.	H	α-helix	trans	-67.8	-47.9	175.8	-53.9	0	0	0	0	112.1	R955 I956 I957 R962 Q963	R955-T959 WeakPolarHBondContact O-CB 3.49Å; R955-T959 PolarHBondContact O-N 2.95Å; R955-T959 VanDerWaalsContact O-N 3.08Å; R955-T959 PolarHBondContact O-OG1 3.47Å; I956-T959 PolarHBondContact O-N 2.83Å; I957-T959 VanDerWaalsContact C-N 3.29Å; I957-T959 PolarHBondContact O-N 2.7Å; T959-R962 PolarHBondContact O-N 3.42Å; T959-Q963 WeakPolarHBondContact O-CG 3.3Å; T959-Q963 PolarHBondContact O-N 3.29Å; T959-Q963 VanDerWaalsContact O-N 3.09Å
960	F	58	Low	53.8	Low	54 Å²	54	89.4 Å²	89.4	24%	0.237	44%	0.437	C	S	.	.	H	α-helix	trans	-62.6	-44.4	176.9	177.3	-105.9	0	0	0	111.8	I956 I957 R962 Q963 L964 T995 I996	I956-F960 PolarHBondContact O-N 3.5Å; I957-F960 PolarHBondContact O-N 2.78Å; F960-R962 PolarHBondContact O-N 2.8Å; F960-Q963 PolarHBondContact O-N 2.75Å; F960-L964 WeakPolarHBondContact O-CB 3.5Å; F960-L964 PolarHBondContact O-N 2.95Å; F960-T995 HydrophobicContact CD2-CG2 3.77Å; F960-T995 HydrophobicContact CE2-CG2 4.04Å; F960-I996 HydrophobicContact CE2-CD1 4.43Å; F960-I996 HydrophobicContact CE2-CG1 4Å
961	Q	57.5	Low	55	Low	72 Å²	72	77.4 Å²	77.4	34%	0.336	39%	0.392	S	S	.	.	H	α-helix	trans	-61.5	-43	178	-75.1	177.2	-21.1	0	0	112.1	I957 L964 A965	I957-Q961 HydrophobicContact CG2-CG 4.38Å; I957-Q961 WeakPolarHBondContact O-CB 3.46Å; I957-Q961 WeakPolarHBondContact O-CG 3.48Å; I957-Q961 PolarHBondContact O-N 3.45Å; Q961-L964 PolarHBondContact O-N 2.7Å; Q961-A965 VanDerWaalsContact O-CB 3.27Å; Q961-A965 WeakPolarHBondContact O-CB 3.39Å; Q961-A965 PolarHBondContact O-N 3.17Å
962	R	57.3	Low	55.7	Low	154 Å²	154	74 Å²	74	58%	0.581	37%	0.369	S	S	*	.	H	α-helix	trans	-62.9	-42	173.8	-77	-175.4	-168.1	137.3	23.4	112.9	D958 T959 F960 T966	D958-R962 WeakPolarHBondContact O-CG 3.44Å; D958-R962 PolarHBondContact O-N 2.56Å; D958-R962 IonicContact OD1-CZ 3.9Å; D958-R962 IonicContact OD1-NE 4Å; D958-R962 IonicContact OD1-NH2 3.61Å; D958-R962 PolarHBondContact OD1-NH2 3.05Å; D958-R962 IonicContact OD2-CZ 3.74Å; D958-R962 IonicContact OD2-NH1 3.55Å; D958-R962 PolarHBondContact OD2-NH1 2.86Å; D958-R962 IonicContact OD2-NH2 2.71Å; D958-R962 PolarHBondContact OD2-NH2 2.81Å; T959-R962 PolarHBondContact O-N 3.42Å; F960-R962 PolarHBondContact O-N 2.8Å; R962-T966 WeakPolarHBondContact O-CB 3.43Å; R962-T966 PolarHBondContact O-N 3.28Å; R962-T966 PolarHBondContact O-OG1 2.94Å
963	Q	62	Low	56.3	Low	86 Å²	86	73.9 Å²	73.9	40%	0.402	37%	0.372	S	S	.	.	H	α-helix	trans	-66.3	-41.5	179.7	-73.7	175	-15.5	0	0	111.3	T959 F960 A967 T995	T959-Q963 WeakPolarHBondContact O-CG 3.3Å; T959-Q963 PolarHBondContact O-N 3.29Å; T959-Q963 VanDerWaalsContact O-N 3.09Å; F960-Q963 PolarHBondContact O-N 2.75Å; Q963-A967 VanDerWaalsContact O-CB 3.23Å; Q963-A967 WeakPolarHBondContact O-CB 3.42Å; Q963-A967 PolarHBondContact O-N 2.87Å; Q963-T995 HydrophobicContact CB-CG2 4.18Å
964	L	63.6	Low	57	Low	48 Å²	48	74.3 Å²	74.3	25%	0.251	37%	0.371	S	S	.	.	H	α-helix	trans	-66.8	-44.1	176	-161.6	76.2	0	0	0	112.2	F960 Q961 A967 Q968 L988 A992	F960-L964 WeakPolarHBondContact O-CB 3.5Å; F960-L964 PolarHBondContact O-N 2.95Å; Q961-L964 PolarHBondContact O-N 2.7Å; L964-A967 WeakPolarHBondContact O-CB 3.44Å; L964-A967 PolarHBondContact O-N 3.48Å; L964-Q968 WeakPolarHBondContact O-CB 3.47Å; L964-Q968 PolarHBondContact O-N 2.92Å; L964-L988 HydrophobicContact CD1-CD2 3.94Å; L964-L988 HydrophobicContact CG-CD2 4.12Å; L964-A992 HydrophobicContact CD1-CB 3.69Å
965	A	59.7	Low	57.6	Low	48 Å²	48	72.8 Å²	72.8	40%	0.397	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-44.4	175.5	0	0	0	0	0	111.8	Q961 A967 Q968 T969	Q961-A965 VanDerWaalsContact O-CB 3.27Å; Q961-A965 WeakPolarHBondContact O-CB 3.39Å; Q961-A965 PolarHBondContact O-N 3.17Å; A965-A967 VanDerWaalsContact C-N 3.33Å; A965-A967 PolarHBondContact O-N 2.88Å; A965-Q968 WeakPolarHBondContact O-CB 3.33Å; A965-Q968 PolarHBondContact O-N 3.45Å; A965-T969 PolarHBondContact O-N 2.85Å; A965-T969 PolarHBondContact O-OG1 2.75Å; A965-T969 VanDerWaalsContact O-OG1 3.05Å
966	T	63.3	Low	58.3	Low	89 Å²	89	69.1 Å²	69.1	55%	0.546	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-42.3	175.2	-52.1	0	0	0	0	111.2	R962 Q968 S970	R962-T966 WeakPolarHBondContact O-CB 3.43Å; R962-T966 PolarHBondContact O-N 3.28Å; R962-T966 PolarHBondContact O-OG1 2.94Å; T966-Q968 VanDerWaalsContact C-N 3.33Å; T966-Q968 PolarHBondContact O-N 3.27Å; T966-S970 WeakPolarHBondContact O-CB 3.1Å; T966-S970 PolarHBondContact O-N 2.9Å; T966-S970 PolarHBondContact O-OG 2.74Å
967	A	64.4	Low	58.8	Low	13 Å²	13	68.3 Å²	68.3	11%	0.107	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-37.5	176.5	0	0	0	0	0	113	Q963 L964 A965 L971 K991	Q963-A967 VanDerWaalsContact O-CB 3.23Å; Q963-A967 WeakPolarHBondContact O-CB 3.42Å; Q963-A967 PolarHBondContact O-N 2.87Å; L964-A967 WeakPolarHBondContact O-CB 3.44Å; L964-A967 PolarHBondContact O-N 3.48Å; A965-A967 VanDerWaalsContact C-N 3.33Å; A965-A967 PolarHBondContact O-N 2.88Å; A967-L971 WeakPolarHBondContact O-CG 3.44Å; A967-L971 PolarHBondContact O-N 3.48Å; A967-K991 HydrophobicContact CB-CB 4.15Å; A967-K991 HydrophobicContact CB-CD 3.66Å; A967-K991 PolarHBondContact O-NZ 3.19Å
968	Q	63.6	Low	58.7	Low	60 Å²	60	69.5 Å²	69.5	28%	0.28	37%	0.371	S	S	.	.	H	α-helix	trans	-68	-53.8	174	173.8	172.2	-0.8	0	0	111.7	L964 A965 T966 S970 L971 D972 L988	L964-Q968 WeakPolarHBondContact O-CB 3.47Å; L964-Q968 PolarHBondContact O-N 2.92Å; A965-Q968 WeakPolarHBondContact O-CB 3.33Å; A965-Q968 PolarHBondContact O-N 3.45Å; T966-Q968 VanDerWaalsContact C-N 3.33Å; T966-Q968 PolarHBondContact O-N 3.27Å; Q968-S970 PolarHBondContact O-N 2.99Å; Q968-S970 VanDerWaalsContact O-N 3.11Å; Q968-L971 WeakPolarHBondContact O-CA 3.4Å; Q968-L971 PolarHBondContact O-N 2.93Å; Q968-D972 VanDerWaalsContact CG-OD2 3.27Å; Q968-D972 WeakPolarHBondContact CG-OD2 3.46Å; Q968-D972 PolarHBondContact O-N 2.94Å; Q968-L988 HydrophobicContact CB-CD1 4.03Å; Q968-L988 HydrophobicContact CB-CD2 4.4Å; Q968-L988 HydrophobicContact CB-CG 4.49Å; Q968-L988 HydrophobicContact CG-CD1 4.06Å
969	T	59.8	Low	58.6	Low	84 Å²	84	72.2 Å²	72.2	52%	0.515	39%	0.39	S	S	.	.	H	α-helix	trans	-55.2	-33.2	176	-51.3	0	0	0	0	111.9	A965 L973	A965-T969 PolarHBondContact O-N 2.85Å; A965-T969 PolarHBondContact O-OG1 2.75Å; A965-T969 VanDerWaalsContact O-OG1 3.05Å; T969-L973 HydrophobicContact CG2-CD1 4.47Å; T969-L973 WeakPolarHBondContact O-CD1 3.34Å; T969-L973 VanDerWaalsContact O-CG 3.32Å; T969-L973 WeakPolarHBondContact O-CG 3.47Å; T969-L973 PolarHBondContact O-N 3.22Å
970	S	64.1	Low	59.1	Low	56 Å²	56	72.3 Å²	72.3	39%	0.392	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-17.8	175.3	-51.6	0	0	0	0	114.7	T966 Q968 L974	T966-S970 WeakPolarHBondContact O-CB 3.1Å; T966-S970 PolarHBondContact O-N 2.9Å; T966-S970 PolarHBondContact O-OG 2.74Å; Q968-S970 PolarHBondContact O-N 2.99Å; Q968-S970 VanDerWaalsContact O-N 3.11Å; S970-L974 WeakPolarHBondContact O-CD1 3.37Å
971	L	65.1	Low	58.9	Low	3 Å²	3	75 Å²	75	2%	0.016	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-38.1	173	-70.5	167.8	0	0	0	111.1	A967 Q968 L973 L974 Y977 R984 E987 L988 K991	A967-L971 WeakPolarHBondContact O-CG 3.44Å; A967-L971 PolarHBondContact O-N 3.48Å; Q968-L971 WeakPolarHBondContact O-CA 3.4Å; Q968-L971 PolarHBondContact O-N 2.93Å; L971-L973 PolarHBondContact O-N 2.82Å; L971-L973 VanDerWaalsContact O-N 3.12Å; L971-L974 PolarHBondContact O-N 2.72Å; L971-L974 VanDerWaalsContact O-N 3.11Å; L971-Y977 HydrophobicContact CB-CD2 4.37Å; L971-Y977 HydrophobicContact CD2-CD2 3.67Å; L971-Y977 HydrophobicContact CD2-CE2 3.43Å; L971-Y977 VanDerWaalsContact CD2-CE2 3.43Å; L971-R984 HydrophobicContact CB-CG 4.22Å; L971-R984 HydrophobicContact CD1-CG 4.49Å; L971-E987 HydrophobicContact CD1-CB 4.09Å; L971-E987 HydrophobicContact CD2-CB 3.91Å; L971-L988 HydrophobicContact CD1-CB 4.05Å; L971-L988 HydrophobicContact CD1-CD1 4.14Å; L971-L988 HydrophobicContact CD1-CG 3.83Å; L971-K991 HydrophobicContact CD1-CD 4.32Å
972	D	57.3	Low	58.7	Low	51 Å²	51	78.8 Å²	78.8	27%	0.273	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-6.9	178.6	-61.9	-26.6	0	0	0	113.5	Q968 R984	Q968-D972 VanDerWaalsContact CG-OD2 3.27Å; Q968-D972 WeakPolarHBondContact CG-OD2 3.46Å; Q968-D972 PolarHBondContact O-N 2.94Å; D972-R984 IonicContact OD1-CZ 3.97Å; D972-R984 IonicContact OD1-NH1 3.71Å; D972-R984 PolarHBondContact OD1-NH1 3.49Å
973	L	56.4	Low	59	Low	136 Å²	136	73.7 Å²	73.7	71%	0.712	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-3.6	174.4	-72.8	170.6	0	0	0	114.1	T969 L971	T969-L973 HydrophobicContact CG2-CD1 4.47Å; T969-L973 WeakPolarHBondContact O-CD1 3.34Å; T969-L973 VanDerWaalsContact O-CG 3.32Å; T969-L973 WeakPolarHBondContact O-CG 3.47Å; T969-L973 PolarHBondContact O-N 3.22Å; L971-L973 PolarHBondContact O-N 2.82Å; L971-L973 VanDerWaalsContact O-N 3.12Å
974	L	55.8	Low	59	Low	69 Å²	69	71.2 Å²	71.2	36%	0.361	40%	0.396	S	S	.	.			trans	-103.9	118.8	-174.2	-71.1	170.7	0	0	0	111.3	S970 L971 Q976 Y977	S970-L974 WeakPolarHBondContact O-CD1 3.37Å; L971-L974 PolarHBondContact O-N 2.72Å; L971-L974 VanDerWaalsContact O-N 3.11Å; L974-Q976 HydrophobicContact CB-CG 4.17Å; L974-Q976 PolarHBondContact O-N 3.2Å; L974-Y977 HydrophobicContact CB-CD2 3.82Å; L974-Y977 HydrophobicContact CB-CE2 4.24Å; L974-Y977 HydrophobicContact CD1-CD2 4.12Å; L974-Y977 HydrophobicContact CD1-CE2 3.81Å; L974-Y977 PolarHBondContact O-N 2.84Å
975	P	55.7	Low	58.7	Low	112 Å²	112	71.7 Å²	71.7	73%	0.727	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-55.8	-29.5	-176.1	-28.7	35.5	0	0	0	115	Y977 D978	P975-Y977 PolarHBondContact O-N 3.48Å; P975-Y977 VanDerWaalsContact O-N 3.11Å; P975-D978 WeakPolarHBondContact O-CB 3.42Å; P975-D978 PolarHBondContact O-N 3.24Å; P975-D978 VanDerWaalsContact O-N 3.16Å
976	Q	57.7	Low	59	Low	119 Å²	119	73 Å²	73	56%	0.556	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-62.9	-11.9	176.3	72.9	-153.2	53.7	0	0	114.5	L974	L974-Q976 HydrophobicContact CB-CG 4.17Å; L974-Q976 PolarHBondContact O-N 3.2Å
977	Y	60.6	Low	59.2	Low	36 Å²	36	71.1 Å²	71.1	14%	0.141	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-117.4	9.1	177.6	-55.9	-52.3	0	0	0	113.2	L971 L974 P975 T979 R984 E987	L971-Y977 HydrophobicContact CB-CD2 4.37Å; L971-Y977 HydrophobicContact CD2-CD2 3.67Å; L971-Y977 HydrophobicContact CD2-CE2 3.43Å; L971-Y977 VanDerWaalsContact CD2-CE2 3.43Å; L974-Y977 HydrophobicContact CB-CD2 3.82Å; L974-Y977 HydrophobicContact CB-CE2 4.24Å; L974-Y977 HydrophobicContact CD1-CD2 4.12Å; L974-Y977 HydrophobicContact CD1-CE2 3.81Å; L974-Y977 PolarHBondContact O-N 2.84Å; P975-Y977 PolarHBondContact O-N 3.48Å; P975-Y977 VanDerWaalsContact O-N 3.11Å; Y977-T979 VanDerWaalsContact C-N 3.3Å; Y977-R984 HydrophobicContact CD1-CB 4.36Å; Y977-R984 HydrophobicContact CG-CB 4.35Å; Y977-E987 HydrophobicContact CE1-CG 4.16Å
978	D	48	Very low	59.2	Low	45 Å²	45	72.3 Å²	72.3	24%	0.241	40%	0.397	C	S	.	.	S	Bend	trans	-68.4	-30.6	176.7	-164.3	25.8	0	0	0	111.4	R919 Q922 P975	R919-D978 IonicContact CZ-OD2 3.17Å; R919-D978 IonicContact NE-OD2 3.92Å; R919-D978 PolarHBondContact NE-OD2 3.18Å; R919-D978 IonicContact NH2-OD2 2.73Å; R919-D978 PolarHBondContact NH2-OD2 3.41Å; R919-D978 VanDerWaalsContact NH2-OD2 3.1Å; Q922-D978 PolarHBondContact NE2-O 2.84Å; Q922-D978 PolarHBondContact NE2-OD1 2.88Å; P975-D978 WeakPolarHBondContact O-CB 3.42Å; P975-D978 PolarHBondContact O-N 3.24Å; P975-D978 VanDerWaalsContact O-N 3.16Å
979	T	47	Very low	59.4	Low	121 Å²	121	75 Å²	75	74%	0.742	40%	0.404	S	S	*	.	S	Bend	trans	-110.6	-28.1	-176.8	51.5	0	0	0	0	114.9	Y977	Y977-T979 VanDerWaalsContact C-N 3.3Å
980	D	63.8	Low	59.9	Low	62 Å²	62	76.6 Å²	76.6	33%	0.332	40%	0.404	S	S	.	.			trans	-99.3	100.1	-174.7	-171.2	-14.9	0	0	0	112.1	E982 S983 R984	D980-E982 PolarHBondContact OD1-N 3.02Å; D980-S983 PolarHBondContact OD1-N 3.13Å; D980-S983 WeakPolarHBondContact OD2-CB 3.19Å; D980-S983 PolarHBondContact OD2-OG 3.26Å; D980-R984 VanDerWaalsContact O-CB 3.31Å; D980-R984 WeakPolarHBondContact O-CB 3.39Å; D980-R984 PolarHBondContact O-N 2.66Å
981	I	53.6	Low	60	Low	110 Å²	110	76.6 Å²	76.6	56%	0.564	40%	0.397	S	S	*	.	H	α-helix	trans	-71.9	-36.1	179.2	-60.2	177.8	0	0	0	111.3	A985	I981-A985 VanDerWaalsContact O-CB 3.26Å; I981-A985 WeakPolarHBondContact O-CB 3.04Å; I981-A985 PolarHBondContact O-N 3.43Å
982	E	53.2	Low	59.9	Low	152 Å²	152	77 Å²	77	71%	0.71	40%	0.401	S	S	*	.	H	α-helix	trans	-75.9	-43.5	-176.4	-68.7	-171.7	150.7	0	0	111.3	D980 R984 A985 N986	D980-E982 PolarHBondContact OD1-N 3.02Å; E982-R984 VanDerWaalsContact C-N 3.34Å; E982-R984 PolarHBondContact O-N 3.25Å; E982-A985 PolarHBondContact O-N 3.14Å; E982-N986 VanDerWaalsContact O-CB 3.24Å; E982-N986 WeakPolarHBondContact O-CB 3.27Å; E982-N986 PolarHBondContact O-N 2.91Å; E982-N986 PolarHBondContact O-ND2 2.87Å
983	S	63.8	Low	60.1	Low	47 Å²	47	76.4 Å²	76.4	33%	0.329	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-40	170.9	-69.1	0	0	0	0	111.6	D980 N986 E987	D980-S983 PolarHBondContact OD1-N 3.13Å; D980-S983 WeakPolarHBondContact OD2-CB 3.19Å; D980-S983 PolarHBondContact OD2-OG 3.26Å; S983-N986 PolarHBondContact O-N 2.71Å; S983-E987 WeakPolarHBondContact O-CB 3.48Å; S983-E987 WeakPolarHBondContact O-CG 3.42Å; S983-E987 PolarHBondContact O-N 3.08Å
984	R	61.7	Low	60.5	Low	35 Å²	35	75.4 Å²	75.4	13%	0.132	39%	0.39	C	S	.	.	H	α-helix	trans	-64.4	-43.2	176	-171	168.9	49.3	142.7	-1.3	111.7	L971 D972 Y977 D980 E982 E987 L988	L971-R984 HydrophobicContact CB-CG 4.22Å; L971-R984 HydrophobicContact CD1-CG 4.49Å; D972-R984 IonicContact OD1-CZ 3.97Å; D972-R984 IonicContact OD1-NH1 3.71Å; D972-R984 PolarHBondContact OD1-NH1 3.49Å; Y977-R984 HydrophobicContact CD1-CB 4.36Å; Y977-R984 HydrophobicContact CG-CB 4.35Å; D980-R984 VanDerWaalsContact O-CB 3.31Å; D980-R984 WeakPolarHBondContact O-CB 3.39Å; D980-R984 PolarHBondContact O-N 2.66Å; E982-R984 VanDerWaalsContact C-N 3.34Å; E982-R984 PolarHBondContact O-N 3.25Å; R984-E987 PolarHBondContact O-N 3.06Å; R984-L988 WeakPolarHBondContact O-CB 3.24Å; R984-L988 PolarHBondContact O-N 3.13Å
985	A	58	Low	60.9	Low	57 Å²	57	73 Å²	73	47%	0.471	38%	0.379	S	S	.	.	H	α-helix	trans	-64	-43.8	175.8	0	0	0	0	0	111.7	I981 E982 E987 L988 W989	I981-A985 VanDerWaalsContact O-CB 3.26Å; I981-A985 WeakPolarHBondContact O-CB 3.04Å; I981-A985 PolarHBondContact O-N 3.43Å; E982-A985 PolarHBondContact O-N 3.14Å; A985-E987 PolarHBondContact O-N 3Å; A985-L988 PolarHBondContact O-N 2.91Å; A985-W989 VanDerWaalsContact O-CB 3.31Å; A985-W989 WeakPolarHBondContact O-CB 3.29Å; A985-W989 PolarHBondContact O-N 2.86Å
986	N	66.3	Low	61.1	Low	75 Å²	75	71.1 Å²	71.1	40%	0.401	36%	0.362	S	S	.	.	H	α-helix	trans	-63.4	-38.3	175.6	-82.6	-51.2	0	0	0	112.5	E982 S983 W989 K990	E982-N986 VanDerWaalsContact O-CB 3.24Å; E982-N986 WeakPolarHBondContact O-CB 3.27Å; E982-N986 PolarHBondContact O-N 2.91Å; E982-N986 PolarHBondContact O-ND2 2.87Å; S983-N986 PolarHBondContact O-N 2.71Å; N986-W989 PolarHBondContact O-N 3.31Å; N986-K990 WeakPolarHBondContact O-CB 3.37Å; N986-K990 WeakPolarHBondContact O-CG 3.46Å; N986-K990 PolarHBondContact O-N 2.85Å
987	E	67.9	Low	61.1	Low	51 Å²	51	67.9 Å²	67.9	24%	0.238	35%	0.348	C	S	.	.	H	α-helix	trans	-71.9	-36.3	173.9	-74.1	-57	135.9	0	0	112.7	L971 Y977 S983 R984 A985 W989 K990 K991	L971-E987 HydrophobicContact CD1-CB 4.09Å; L971-E987 HydrophobicContact CD2-CB 3.91Å; Y977-E987 HydrophobicContact CE1-CG 4.16Å; S983-E987 WeakPolarHBondContact O-CB 3.48Å; S983-E987 WeakPolarHBondContact O-CG 3.42Å; S983-E987 PolarHBondContact O-N 3.08Å; R984-E987 PolarHBondContact O-N 3.06Å; A985-E987 PolarHBondContact O-N 3Å; E987-W989 VanDerWaalsContact C-N 3.32Å; E987-K990 PolarHBondContact O-N 3.37Å; E987-K990 VanDerWaalsContact OE1-CD 3.27Å; E987-K990 WeakPolarHBondContact OE1-CD 3.38Å; E987-K990 WeakPolarHBondContact OE1-CE 3.47Å; E987-K990 IonicContact OE1-NZ 3.51Å; E987-K990 PolarHBondContact OE1-NZ 3.1Å; E987-K991 WeakPolarHBondContact O-CB 3.18Å; E987-K991 VanDerWaalsContact O-CG 3.27Å; E987-K991 WeakPolarHBondContact O-CG 3.42Å; E987-K991 PolarHBondContact O-N 3.41Å
988	L	64.8	Low	61.1	Low	37 Å²	37	71.1 Å²	71.1	19%	0.194	37%	0.368	C	S	.	.	H	α-helix	trans	-64.5	-38.7	171.8	-125.3	151.7	0	0	0	111.1	L964 Q968 L971 R984 A985 K991 A992	L964-L988 HydrophobicContact CD1-CD2 3.94Å; L964-L988 HydrophobicContact CG-CD2 4.12Å; Q968-L988 HydrophobicContact CB-CD1 4.03Å; Q968-L988 HydrophobicContact CB-CD2 4.4Å; Q968-L988 HydrophobicContact CB-CG 4.49Å; Q968-L988 HydrophobicContact CG-CD1 4.06Å; L971-L988 HydrophobicContact CD1-CB 4.05Å; L971-L988 HydrophobicContact CD1-CD1 4.14Å; L971-L988 HydrophobicContact CD1-CG 3.83Å; R984-L988 WeakPolarHBondContact O-CB 3.24Å; R984-L988 PolarHBondContact O-N 3.13Å; A985-L988 PolarHBondContact O-N 2.91Å; L988-K991 PolarHBondContact O-N 3.18Å; L988-A992 WeakPolarHBondContact O-CB 3.35Å; L988-A992 PolarHBondContact O-N 3.01Å
989	W	65.8	Low	61.7	Low	117 Å²	117	70.3 Å²	70.3	44%	0.443	36%	0.364	S	S	.	.	H	α-helix	trans	-66.7	-48	174.1	-174	-113.1	0	0	0	112.2	A985 N986 E987 K991 A992 V993 V1027 I1030	A985-W989 VanDerWaalsContact O-CB 3.31Å; A985-W989 WeakPolarHBondContact O-CB 3.29Å; A985-W989 PolarHBondContact O-N 2.86Å; N986-W989 PolarHBondContact O-N 3.31Å; E987-W989 VanDerWaalsContact C-N 3.32Å; W989-K991 VanDerWaalsContact C-N 3.31Å; W989-K991 PolarHBondContact O-N 2.84Å; W989-A992 WeakPolarHBondContact O-CB 3.32Å; W989-A992 PolarHBondContact O-N 3.25Å; W989-A992 VanDerWaalsContact O-N 3.15Å; W989-V993 HydrophobicContact CD2-CG2 4.44Å; W989-V993 WeakPolarHBondContact O-CB 3.38Å; W989-V993 WeakPolarHBondContact O-CG2 3.31Å; W989-V993 PolarHBondContact O-N 3.02Å; W989-V1027 HydrophobicContact CH2-CG2 4.08Å; W989-I1030 HydrophobicContact CZ2-CD1 3.99Å
990	K	71.5	Confident	62.1	Low	117 Å²	117	68.2 Å²	68.2	51%	0.509	35%	0.352	S	S	.	.	H	α-helix	trans	-57.4	-43	172.8	-73	167.7	-161	173.3	0	111.3	N986 E987 V993 H994	N986-K990 WeakPolarHBondContact O-CB 3.37Å; N986-K990 WeakPolarHBondContact O-CG 3.46Å; N986-K990 PolarHBondContact O-N 2.85Å; E987-K990 PolarHBondContact O-N 3.37Å; E987-K990 VanDerWaalsContact OE1-CD 3.27Å; E987-K990 WeakPolarHBondContact OE1-CD 3.38Å; E987-K990 WeakPolarHBondContact OE1-CE 3.47Å; E987-K990 IonicContact OE1-NZ 3.51Å; E987-K990 PolarHBondContact OE1-NZ 3.1Å; K990-V993 PolarHBondContact O-N 3.25Å; K990-H994 WeakPolarHBondContact O-CB 3.42Å; K990-H994 PolarHBondContact O-N 2.97Å
991	K	66.4	Low	61.4	Low	57 Å²	57	75.3 Å²	75.3	25%	0.248	37%	0.374	C	S	.	.	H	α-helix	trans	-65.7	-40.9	174.8	-72.6	-177.3	-168	-175.8	0	112	A967 L971 E987 L988 W989 H994 T995	A967-K991 HydrophobicContact CB-CB 4.15Å; A967-K991 HydrophobicContact CB-CD 3.66Å; A967-K991 PolarHBondContact O-NZ 3.19Å; L971-K991 HydrophobicContact CD1-CD 4.32Å; E987-K991 WeakPolarHBondContact O-CB 3.18Å; E987-K991 VanDerWaalsContact O-CG 3.27Å; E987-K991 WeakPolarHBondContact O-CG 3.42Å; E987-K991 PolarHBondContact O-N 3.41Å; L988-K991 PolarHBondContact O-N 3.18Å; W989-K991 VanDerWaalsContact C-N 3.31Å; W989-K991 PolarHBondContact O-N 2.84Å; K991-H994 PolarHBondContact O-N 3.15Å; K991-T995 WeakPolarHBondContact O-CB 3.43Å; K991-T995 PolarHBondContact O-N 3.39Å; K991-T995 PolarHBondContact O-OG1 2.9Å
992	A	62	Low	61.3	Low	12 Å²	12	77 Å²	77	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-61	-48.7	174.3	0	0	0	0	0	111.9	L964 L988 W989 H994 T995 I996	L964-A992 HydrophobicContact CD1-CB 3.69Å; L988-A992 WeakPolarHBondContact O-CB 3.35Å; L988-A992 PolarHBondContact O-N 3.01Å; W989-A992 WeakPolarHBondContact O-CB 3.32Å; W989-A992 PolarHBondContact O-N 3.25Å; W989-A992 VanDerWaalsContact O-N 3.15Å; A992-H994 VanDerWaalsContact C-N 3.35Å; A992-H994 PolarHBondContact O-N 2.95Å; A992-T995 WeakPolarHBondContact O-CB 3.49Å; A992-T995 PolarHBondContact O-N 3.42Å; A992-I996 VanDerWaalsContact O-CG1 3.29Å; A992-I996 WeakPolarHBondContact O-CG1 3.43Å; A992-I996 PolarHBondContact O-N 3.06Å
993	V	62.3	Low	61.1	Low	37 Å²	37	71.6 Å²	71.6	22%	0.224	35%	0.354	C	S	.	.	H	α-helix	trans	-62.5	-39.9	175.8	171.7	0	0	0	0	111.2	W989 K990 I996 N997	W989-V993 HydrophobicContact CD2-CG2 4.44Å; W989-V993 WeakPolarHBondContact O-CB 3.38Å; W989-V993 WeakPolarHBondContact O-CG2 3.31Å; W989-V993 PolarHBondContact O-N 3.02Å; K990-V993 PolarHBondContact O-N 3.25Å; V993-I996 PolarHBondContact O-N 3.36Å; V993-N997 VanDerWaalsContact O-CB 3.25Å; V993-N997 WeakPolarHBondContact O-CB 3.44Å; V993-N997 VanDerWaalsContact O-CG 3.23Å; V993-N997 PolarHBondContact O-N 3.4Å; V993-N997 PolarHBondContact O-ND2 3.12Å
994	H	65.8	Low	60.5	Low	116 Å²	116	73.9 Å²	73.9	54%	0.537	36%	0.355	S	S	.	.	H	α-helix	trans	-65.4	-40.4	174.6	-171.4	73.5	0	0	0	112	K990 K991 A992 N997 N998	K990-H994 WeakPolarHBondContact O-CB 3.42Å; K990-H994 PolarHBondContact O-N 2.97Å; K991-H994 PolarHBondContact O-N 3.15Å; A992-H994 VanDerWaalsContact C-N 3.35Å; A992-H994 PolarHBondContact O-N 2.95Å; H994-N997 CarbonylContact O-C 3.54Å; H994-N997 PolarHBondContact O-N 3.47Å; H994-N998 PolarHBondContact CD2-ND2 3.09Å; H994-N998 VanDerWaalsContact CD2-ND2 3.28Å; H994-N998 PolarHBondContact CE1-ND2 3.06Å; H994-N998 PolarHBondContact NE2-ND2 3.4Å; H994-N998 VanDerWaalsContact O-CB 3.32Å; H994-N998 WeakPolarHBondContact O-CB 3.47Å; H994-N998 PolarHBondContact O-N 3.31Å; H994-N998 PolarHBondContact O-ND2 3.31Å
995	T	62.8	Low	59.6	Low	19 Å²	19	79.9 Å²	79.9	12%	0.117	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-43.5	172.9	-65.2	0	0	0	0	111.7	F960 Q963 K991 A992 N997 N998 T999	F960-T995 HydrophobicContact CD2-CG2 3.77Å; F960-T995 HydrophobicContact CE2-CG2 4.04Å; Q963-T995 HydrophobicContact CB-CG2 4.18Å; K991-T995 WeakPolarHBondContact O-CB 3.43Å; K991-T995 PolarHBondContact O-N 3.39Å; K991-T995 PolarHBondContact O-OG1 2.9Å; A992-T995 WeakPolarHBondContact O-CB 3.49Å; A992-T995 PolarHBondContact O-N 3.42Å; T995-N997 VanDerWaalsContact C-N 3.32Å; T995-N997 PolarHBondContact O-N 2.98Å; T995-N998 PolarHBondContact O-N 2.91Å; T995-T999 PolarHBondContact O-N 2.91Å; T995-T999 PolarHBondContact O-OG1 3.48Å
996	I	59.2	Low	59	Low	72 Å²	72	80.8 Å²	80.8	37%	0.369	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-38.1	173.8	-67.8	162.6	0	0	0	111.2	F960 A992 V993 N998 T999 R1004	F960-I996 HydrophobicContact CE2-CD1 4.43Å; F960-I996 HydrophobicContact CE2-CG1 4Å; A992-I996 VanDerWaalsContact O-CG1 3.29Å; A992-I996 WeakPolarHBondContact O-CG1 3.43Å; A992-I996 PolarHBondContact O-N 3.06Å; V993-I996 PolarHBondContact O-N 3.36Å; I996-N998 VanDerWaalsContact C-N 3.3Å; I996-N998 PolarHBondContact O-N 3.29Å; I996-T999 WeakPolarHBondContact CA-OG1 3.12Å; I996-T999 PolarHBondContact O-OG1 3.17Å; I996-R1004 WeakPolarHBondContact O-CD 3.23Å; I996-R1004 PolarHBondContact O-NE 2.76Å
997	N	58.3	Low	57.8	Low	51 Å²	51	80 Å²	80	27%	0.273	38%	0.377	S	S	.	.	H	α-helix	trans	-76.4	-14.1	178.2	-75.5	-21.8	0	0	0	114.1	V993 H994 T995 R1004	V993-N997 VanDerWaalsContact O-CB 3.25Å; V993-N997 WeakPolarHBondContact O-CB 3.44Å; V993-N997 VanDerWaalsContact O-CG 3.23Å; V993-N997 PolarHBondContact O-N 3.4Å; V993-N997 PolarHBondContact O-ND2 3.12Å; H994-N997 CarbonylContact O-C 3.54Å; H994-N997 PolarHBondContact O-N 3.47Å; T995-N997 VanDerWaalsContact C-N 3.32Å; T995-N997 PolarHBondContact O-N 2.98Å; N997-R1004 PolarHBondContact O-NH1 3.2Å; N997-R1004 PolarHBondContact O-NH2 3.19Å
998	N	61.1	Low	56.6	Low	103 Å²	103	83 Å²	83	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-106.7	-21.4	177.4	-68.2	-11.7	0	0	0	114	H994 T995 I996	H994-N998 PolarHBondContact CD2-ND2 3.09Å; H994-N998 VanDerWaalsContact CD2-ND2 3.28Å; H994-N998 PolarHBondContact CE1-ND2 3.06Å; H994-N998 PolarHBondContact NE2-ND2 3.4Å; H994-N998 VanDerWaalsContact O-CB 3.32Å; H994-N998 WeakPolarHBondContact O-CB 3.47Å; H994-N998 PolarHBondContact O-N 3.31Å; H994-N998 PolarHBondContact O-ND2 3.31Å; T995-N998 PolarHBondContact O-N 2.91Å; I996-N998 VanDerWaalsContact C-N 3.3Å; I996-N998 PolarHBondContact O-N 3.29Å
999	T	60	Low	55.5	Low	28 Å²	28	86.5 Å²	86.5	17%	0.172	41%	0.405	C	S	.	.	S	Bend	trans	-58.7	150.5	170.3	33.8	0	0	0	0	110.9	T995 I996 R1004	T995-T999 PolarHBondContact O-N 2.91Å; T995-T999 PolarHBondContact O-OG1 3.48Å; I996-T999 WeakPolarHBondContact CA-OG1 3.12Å; I996-T999 PolarHBondContact O-OG1 3.17Å; T999-R1004 VanDerWaalsContact O-CZ 3.22Å; T999-R1004 PolarHBondContact O-NE 3.11Å; T999-R1004 PolarHBondContact O-NH2 2.89Å
1000	T	56.9	Low	54.4	Low	77 Å²	77	84.2 Å²	84.2	47%	0.472	40%	0.404	S	S	.	.			trans	-65.6	163.2	-165	65.5	0	0	0	0	113.3	E1002 E1003 R1004	T1000-E1002 PolarHBondContact O-N 2.95Å; T1000-E1003 VanDerWaalsContact CB-OE2 3.29Å; T1000-E1003 WeakPolarHBondContact CB-OE2 3.33Å; T1000-E1003 WeakPolarHBondContact CG2-OE2 3.4Å; T1000-E1003 PolarHBondContact N-OE2 3.48Å; T1000-E1003 PolarHBondContact O-N 3.47Å; T1000-E1003 VanDerWaalsContact O-N 3.15Å; T1000-E1003 VanDerWaalsContact OG1-CD 3.29Å; T1000-E1003 WeakPolarHBondContact OG1-CG 3.4Å; T1000-E1003 PolarHBondContact OG1-N 2.88Å; T1000-E1003 PolarHBondContact OG1-OE2 2.89Å; T1000-R1004 PolarHBondContact O-N 2.7Å; T1000-R1004 VanDerWaalsContact O-N 3.12Å
1001	R	48.8	Very low	52.9	Low	212 Å²	212	83.2 Å²	83.2	80%	0.8	40%	0.404	S	S	*	.	H	α-helix	trans	-62.3	-23.4	179.8	-159.7	177.4	-172.9	-171.4	2.7	112.9
1002	E	50.2	Low	51.5	Low	144 Å²	144	87.4 Å²	87.4	67%	0.673	43%	0.429	S	S	*	.	H	α-helix	trans	-78.4	-44.9	173.4	-67.2	-108.3	106.4	0	0	111.5	T1000 R1004 R1005 V1006	T1000-E1002 PolarHBondContact O-N 2.95Å; E1002-R1004 PolarHBondContact O-N 2.96Å; E1002-R1005 VanDerWaalsContact O-CB 3.26Å; E1002-R1005 WeakPolarHBondContact O-CB 3.42Å; E1002-R1005 PolarHBondContact O-N 3.44Å; E1002-R1005 VanDerWaalsContact O-N 3.1Å; E1002-V1006 PolarHBondContact O-N 3Å
1003	E	50.6	Low	50.3	Low	39 Å²	39	96.9 Å²	96.9	18%	0.182	46%	0.462	C	S	.	.	H	α-helix	trans	-63.1	-44.4	-179.3	-70.5	163.7	128.8	0	0	111.9	I956 T1000 R1005 V1006 C1007	I956-E1003 HydrophobicContact CD1-CG 4.13Å; I956-E1003 HydrophobicContact CG1-CG 4.24Å; I956-E1003 HydrophobicContact CG2-CB 4.46Å; I956-E1003 HydrophobicContact CG2-CG 4.19Å; T1000-E1003 VanDerWaalsContact CB-OE2 3.29Å; T1000-E1003 WeakPolarHBondContact CB-OE2 3.33Å; T1000-E1003 WeakPolarHBondContact CG2-OE2 3.4Å; T1000-E1003 PolarHBondContact N-OE2 3.48Å; T1000-E1003 PolarHBondContact O-N 3.47Å; T1000-E1003 VanDerWaalsContact O-N 3.15Å; T1000-E1003 VanDerWaalsContact OG1-CD 3.29Å; T1000-E1003 WeakPolarHBondContact OG1-CG 3.4Å; T1000-E1003 PolarHBondContact OG1-N 2.88Å; T1000-E1003 PolarHBondContact OG1-OE2 2.89Å; E1003-R1005 PolarHBondContact O-N 2.91Å; E1003-V1006 WeakPolarHBondContact O-CB 3.49Å; E1003-V1006 PolarHBondContact O-N 3.48Å; E1003-C1007 PolarHBondContact O-N 2.82Å
1004	R	49.3	Very low	49	Very low	95 Å²	95	101 Å²	101	36%	0.358	49%	0.489	S	S	.	.	H	α-helix	trans	-58.1	-31.5	174	-76.7	-177.1	-105	-161.1	-11.3	113	I996 N997 T999 T1000 E1002 V1006 C1007 Y1008	I996-R1004 WeakPolarHBondContact O-CD 3.23Å; I996-R1004 PolarHBondContact O-NE 2.76Å; N997-R1004 PolarHBondContact O-NH1 3.2Å; N997-R1004 PolarHBondContact O-NH2 3.19Å; T999-R1004 VanDerWaalsContact O-CZ 3.22Å; T999-R1004 PolarHBondContact O-NE 3.11Å; T999-R1004 PolarHBondContact O-NH2 2.89Å; T1000-R1004 PolarHBondContact O-N 2.7Å; T1000-R1004 VanDerWaalsContact O-N 3.12Å; E1002-R1004 PolarHBondContact O-N 2.96Å; R1004-V1006 VanDerWaalsContact C-N 3.32Å; R1004-V1006 PolarHBondContact O-N 2.81Å; R1004-C1007 PolarHBondContact O-N 3.01Å; R1004-Y1008 PolarHBondContact O-N 3.02Å
1005	R	44.2	Very low	47.6	Very low	161 Å²	161	103.5 Å²	103.5	61%	0.608	50%	0.501	S	S	*	.	H	α-helix	trans	-72.8	-22.5	177.8	-157.8	179.1	-173.6	-172.1	4	112.9	E1002 E1003 I1009	E1002-R1005 VanDerWaalsContact O-CB 3.26Å; E1002-R1005 WeakPolarHBondContact O-CB 3.42Å; E1002-R1005 PolarHBondContact O-N 3.44Å; E1002-R1005 VanDerWaalsContact O-N 3.1Å; E1003-R1005 PolarHBondContact O-N 2.91Å; R1005-I1009 WeakPolarHBondContact O-CD1 3.38Å
1006	V	44.2	Very low	46.1	Very low	76 Å²	76	111.3 Å²	111.3	46%	0.461	54%	0.537	S	S	.	.	H	α-helix	trans	-77.5	-41	172.3	179.1	0	0	0	0	110.8	E1002 E1003 R1004 T1010	E1002-V1006 PolarHBondContact O-N 3Å; E1003-V1006 WeakPolarHBondContact O-CB 3.49Å; E1003-V1006 PolarHBondContact O-N 3.48Å; R1004-V1006 VanDerWaalsContact C-N 3.32Å; R1004-V1006 PolarHBondContact O-N 2.81Å; V1006-T1010 PolarHBondContact O-OG1 2.78Å
1007	C	42.9	Very low	44.8	Very low	58 Å²	58	116.5 Å²	116.5	39%	0.392	56%	0.56	S	S	.	*	H	α-helix	trans	-65.1	-46.6	179.2	-62.3	0	0	0	0	112.8	E1003 R1004 I1009 T1010	E1003-C1007 PolarHBondContact O-N 2.82Å; R1004-C1007 PolarHBondContact O-N 3.01Å; C1007-I1009 VanDerWaalsContact C-N 3.27Å; C1007-I1009 PolarHBondContact O-N 2.95Å; C1007-T1010 PolarHBondContact O-N 3.48Å; C1007-T1010 VanDerWaalsContact O-N 3.1Å
1008	Y	41.2	Very low	43.6	Very low	114 Å²	114	122.7 Å²	122.7	45%	0.447	59%	0.586	S	S	.	*	H	α-helix	trans	-63.8	-27	-172.8	-166.4	-110.3	0	0	0	114.5	R1004 T1010 L1035	R1004-Y1008 PolarHBondContact O-N 3.02Å; Y1008-T1010 VanDerWaalsContact C-N 3.28Å; Y1008-T1010 PolarHBondContact O-N 2.89Å; Y1008-L1035 HydrophobicContact CD2-CD1 3.32Å; Y1008-L1035 HydrophobicContact CE2-CD1 3.27Å; Y1008-L1035 HydrophobicContact CG-CD1 4.02Å
1009	I	42.3	Very low	42.3	Very low	111 Å²	111	124 Å²	124	57%	0.569	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-15.3	-179.8	-65	174.4	0	0	0	112.2	R1005 C1007	R1005-I1009 WeakPolarHBondContact O-CD1 3.38Å; C1007-I1009 VanDerWaalsContact C-N 3.27Å; C1007-I1009 PolarHBondContact O-N 2.95Å
1010	T	41.9	Very low	41.2	Very low	70 Å²	70	125.5 Å²	125.5	43%	0.429	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.7	-19.7	-165.9	-42.3	0	0	0	0	113.5	V937 V1006 C1007 Y1008	V937-T1010 VanDerWaalsContact O-CG2 3.29Å; V937-T1010 WeakPolarHBondContact O-CG2 3.5Å; V1006-T1010 PolarHBondContact O-OG1 2.78Å; C1007-T1010 PolarHBondContact O-N 3.48Å; C1007-T1010 VanDerWaalsContact O-N 3.1Å; Y1008-T1010 VanDerWaalsContact C-N 3.28Å; Y1008-T1010 PolarHBondContact O-N 2.89Å
1011	L	40.3	Very low	40.2	Very low	95 Å²	95	128 Å²	128	50%	0.497	64%	0.642	S	S	.	*			trans	-92.3	5.1	-174.6	-72.1	166.3	0	0	0	115	V937 R1013 L1031	V937-L1011 HydrophobicContact CG1-CD2 3.96Å; L1011-R1013 PolarHBondContact O-N 2.72Å; L1011-L1031 HydrophobicContact CD1-CD1 4.12Å
1012	N	38	Very low	39.6	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	65%	0.649	S	S	*	*			trans	-94.7	67.3	-168.9	-139.3	-9.9	0	0	0	112.2
1013	R	36.9	Very low	39.5	Very low	211 Å²	211	128 Å²	128	80%	0.796	66%	0.656	S	S	*	*			trans	-131.7	140.4	175.9	-128.2	-177.3	-175.8	-177.4	-2.1	110.6	L1011	L1011-R1013 PolarHBondContact O-N 2.72Å
1014	P	33.9	Very low	39	Very low	123 Å²	123	132.2 Å²	132.2	80%	0.799	68%	0.679	S	S	*	*			trans	-94.2	110.4	-176.9	34.2	-29.6	0	0	0	111.7
1015	E	35.8	Very low	38.9	Very low	169 Å²	169	131.7 Å²	131.7	79%	0.79	69%	0.688	S	S	*	*			trans	-132.7	161	165.9	-69.5	177	-169.6	0	0	108.3
1016	E	33	Very low	39.1	Very low	183 Å²	183	127.3 Å²	127.3	86%	0.855	68%	0.682	S	S	*	*			trans	-84.8	154.3	-142.9	-60.2	178.4	143.6	0	0	115.9
1017	E	30.6	Very low	39.1	Very low	182 Å²	182	127.6 Å²	127.6	85%	0.85	68%	0.684	S	S	*	*			trans	-74.2	132.6	176.2	-65.6	178.8	156.5	0	0	110.5
1018	H	34.1	Very low	39.1	Very low	180 Å²	180	131.9 Å²	131.9	83%	0.833	70%	0.696	S	S	*	*			trans	-128.4	130.6	169.3	-94.3	42.6	0	0	0	109.6
1019	S	32.3	Very low	39.7	Very low	130 Å²	130	128.5 Å²	128.5	91%	0.909	69%	0.691	S	S	*	*			trans	-81.9	119	-170.2	52.8	0	0	0	0	112.8
1020	G	38.2	Very low	40	Very low	61 Å²	61	124.8 Å²	124.8	63%	0.629	67%	0.672	S	S	*	*			trans	-123.4	169.6	164.6	0	0	0	0	0	110.9	E1022	G1020-E1022 PolarHBondContact O-N 3.31Å
1021	P	35.6	Very low	40.1	Very low	129 Å²	129	123.6 Å²	123.6	84%	0.838	66%	0.663	S	S	*	*			trans	-68.8	102.2	-163.8	24.3	-33.6	0	0	0	115.6	D1023	P1021-D1023 PolarHBondContact O-N 2.89Å
1022	E	36.2	Very low	40.7	Very low	199 Å²	199	124 Å²	124	93%	0.93	67%	0.666	S	S	*	*	S	Bend	trans	43.1	-35.1	149.6	-55.9	-162.1	128.6	0	0	123.2	G1020	G1020-E1022 PolarHBondContact O-N 3.31Å
1023	D	48.2	Very low	41.3	Very low	156 Å²	156	123 Å²	123	83%	0.834	67%	0.665	S	S	*	*	S	Bend	trans	-98.6	3	-161.7	-101	-40.3	0	0	0	117.1	P1021	P1021-D1023 PolarHBondContact O-N 2.89Å
1024	I	40.4	Very low	41.7	Very low	129 Å²	129	116.6 Å²	116.6	66%	0.662	65%	0.646	S	S	*	*	S	Bend	trans	-121.3	114.2	-176.8	-54.3	-179	0	0	0	111.8
1025	P	47.3	Very low	42.1	Very low	83 Å²	83	113 Å²	113	54%	0.539	62%	0.62	S	S	.	*			trans	-68.9	137	178.4	27.5	-33.6	0	0	0	111.7	I1030	P1025-I1030 HydrophobicContact CG-CD1 4.4Å; P1025-I1030 HydrophobicContact CG-CG1 4.35Å; P1025-I1030 WeakPolarHBondContact O-CD1 3.33Å
1026	S	47.6	Very low	42.5	Very low	69 Å²	69	108.6 Å²	108.6	48%	0.483	61%	0.606	S	S	.	*			trans	-62.5	152.7	-174.9	72.8	0	0	0	0	113.2	K1028 A1029 I1030	S1026-K1028 PolarHBondContact O-N 3Å; S1026-K1028 VanDerWaalsContact O-N 3.07Å; S1026-A1029 WeakPolarHBondContact O-CA 3.45Å; S1026-A1029 WeakPolarHBondContact O-CB 3.46Å; S1026-A1029 PolarHBondContact O-N 3.06Å; S1026-A1029 PolarHBondContact OG-N 3.44Å; S1026-I1030 PolarHBondContact O-N 3.38Å
1027	V	43.5	Very low	42.8	Very low	83 Å²	83	107.1 Å²	107.1	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-53.3	-33.7	177	-177.6	0	0	0	0	111.8	W989 I1030 L1031	W989-V1027 HydrophobicContact CH2-CG2 4.08Å; V1027-I1030 PolarHBondContact O-N 2.68Å; V1027-L1031 HydrophobicContact CG1-CD1 4.01Å; V1027-L1031 HydrophobicContact CG1-CG 4.5Å; V1027-L1031 WeakPolarHBondContact O-CB 3.44Å; V1027-L1031 WeakPolarHBondContact O-CG 3.44Å; V1027-L1031 PolarHBondContact O-N 2.84Å
1028	K	44.8	Very low	43.4	Very low	147 Å²	147	106.2 Å²	106.2	64%	0.639	60%	0.599	S	S	*	*	H	α-helix	trans	-65.9	-42.1	174.5	-172.3	178.6	178.8	-175.3	0	112.4	S1026 N1032	S1026-K1028 PolarHBondContact O-N 3Å; S1026-K1028 VanDerWaalsContact O-N 3.07Å; K1028-N1032 WeakPolarHBondContact O-CB 3.4Å; K1028-N1032 PolarHBondContact O-N 3.29Å; K1028-N1032 PolarHBondContact O-ND2 3.5Å
1029	A	52.3	Low	43.7	Very low	43 Å²	43	102.8 Å²	102.8	36%	0.355	58%	0.584	S	S	.	*	H	α-helix	trans	-67.9	-38.8	175.2	0	0	0	0	0	112.5	S1026 N1032 T1033	S1026-A1029 WeakPolarHBondContact O-CA 3.45Å; S1026-A1029 WeakPolarHBondContact O-CB 3.46Å; S1026-A1029 PolarHBondContact O-N 3.06Å; S1026-A1029 PolarHBondContact OG-N 3.44Å; A1029-N1032 PolarHBondContact O-N 3.21Å; A1029-T1033 PolarHBondContact O-N 3.38Å; A1029-T1033 VanDerWaalsContact O-N 3.16Å; A1029-T1033 PolarHBondContact O-OG1 3.02Å
1030	I	48.6	Very low	43.9	Very low	33 Å²	33	103.4 Å²	103.4	17%	0.169	58%	0.577	C	S	.	*	H	α-helix	trans	-65.6	-45.3	175.8	-64.2	168.7	0	0	0	110.8	W989 P1025 S1026 V1027 N1032 T1033 L1034	W989-I1030 HydrophobicContact CZ2-CD1 3.99Å; P1025-I1030 HydrophobicContact CG-CD1 4.4Å; P1025-I1030 HydrophobicContact CG-CG1 4.35Å; P1025-I1030 WeakPolarHBondContact O-CD1 3.33Å; S1026-I1030 PolarHBondContact O-N 3.38Å; V1027-I1030 PolarHBondContact O-N 2.68Å; I1030-N1032 VanDerWaalsContact C-N 3.33Å; I1030-N1032 PolarHBondContact O-N 3.01Å; I1030-T1033 PolarHBondContact O-N 3.25Å; I1030-T1033 PolarHBondContact O-OG1 3.25Å; I1030-T1033 VanDerWaalsContact O-OG1 3.09Å; I1030-L1034 HydrophobicContact CG2-CD1 3.72Å; I1030-L1034 WeakPolarHBondContact O-CG 3.14Å; I1030-L1034 PolarHBondContact O-N 2.9Å
1031	L	44.7	Very low	43.7	Very low	45 Å²	45	107.7 Å²	107.7	24%	0.236	59%	0.585	C	S	.	*	H	α-helix	trans	-66.5	-33.5	177.1	-74.5	169.5	0	0	0	112.9	L1011 V1027	L1011-L1031 HydrophobicContact CD1-CD1 4.12Å; V1027-L1031 HydrophobicContact CG1-CD1 4.01Å; V1027-L1031 HydrophobicContact CG1-CG 4.5Å; V1027-L1031 WeakPolarHBondContact O-CB 3.44Å; V1027-L1031 WeakPolarHBondContact O-CG 3.44Å; V1027-L1031 PolarHBondContact O-N 2.84Å
1032	N	52.2	Low	43.5	Very low	105 Å²	105	106.6 Å²	106.6	56%	0.561	58%	0.578	S	S	*	*	H	α-helix	trans	-73.6	-23.6	177.4	-74	-8.4	0	0	0	113.7	K1028 A1029 I1030	K1028-N1032 WeakPolarHBondContact O-CB 3.4Å; K1028-N1032 PolarHBondContact O-N 3.29Å; K1028-N1032 PolarHBondContact O-ND2 3.5Å; A1029-N1032 PolarHBondContact O-N 3.21Å; I1030-N1032 VanDerWaalsContact C-N 3.33Å; I1030-N1032 PolarHBondContact O-N 3.01Å
1033	T	52	Low	43.3	Very low	122 Å²	122	103.4 Å²	103.4	75%	0.748	57%	0.571	S	S	*	*	H	α-helix	trans	-88	-20.8	175	42	0	0	0	0	113.5	A1029 I1030	A1029-T1033 PolarHBondContact O-N 3.38Å; A1029-T1033 VanDerWaalsContact O-N 3.16Å; A1029-T1033 PolarHBondContact O-OG1 3.02Å; I1030-T1033 PolarHBondContact O-N 3.25Å; I1030-T1033 PolarHBondContact O-OG1 3.25Å; I1030-T1033 VanDerWaalsContact O-OG1 3.09Å
1034	L	43.8	Very low	42.6	Very low	78 Å²	78	101.5 Å²	101.5	41%	0.408	57%	0.568	S	S	.	*	S	Bend	trans	-92.5	-2.4	-177.7	-69.7	171.3	0	0	0	115.2	I1030	I1030-L1034 HydrophobicContact CG2-CD1 3.72Å; I1030-L1034 WeakPolarHBondContact O-CG 3.14Å; I1030-L1034 PolarHBondContact O-N 2.9Å
1035	L	43.2	Very low	42	Very low	48 Å²	48	102.4 Å²	102.4	25%	0.251	57%	0.574	S	S	.	*	S	Bend	trans	-130	102.6	-173.8	-69.2	170.1	0	0	0	111.5	Y1008 M1039	Y1008-L1035 HydrophobicContact CD2-CD1 3.32Å; Y1008-L1035 HydrophobicContact CE2-CD1 3.27Å; Y1008-L1035 HydrophobicContact CG-CD1 4.02Å; L1035-M1039 HydrophobicContact CD2-CE 3.8Å; L1035-M1039 HydrophobicContact CD2-SD 3.68Å
1036	P	43	Very low	41.3	Very low	75 Å²	75	104.8 Å²	104.8	49%	0.487	58%	0.581	S	S	.	*			trans	-68.8	146.9	179.9	27.5	-33.8	0	0	0	112.2	E1038 M1039	P1036-E1038 PolarHBondContact O-N 2.85Å; P1036-M1039 HydrophobicContact CG-CG 4.46Å; P1036-M1039 PolarHBondContact O-N 2.98Å; P1036-M1039 VanDerWaalsContact O-N 3.08Å
1037	L	40.1	Very low	40.3	Very low	153 Å²	153	107.7 Å²	107.7	80%	0.801	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-55	-24.4	-175.1	-147.1	76.3	0	0	0	113.9	M1039 L1040	L1037-M1039 PolarHBondContact O-N 3.46Å; L1037-L1040 PolarHBondContact O-N 3.37Å
1038	E	43.2	Very low	39.8	Very low	163 Å²	163	108.5 Å²	108.5	76%	0.762	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-64.7	-17.8	179.6	-60.4	170.6	163.3	0	0	113.6	P1036 L1040	P1036-E1038 PolarHBondContact O-N 2.85Å; E1038-L1040 PolarHBondContact O-N 3.36Å
1039	M	40.8	Very low	39.1	Very low	107 Å²	107	107.1 Å²	107.1	53%	0.527	62%	0.621	S	S	.	*	G	3₁₀ helix	trans	-70	2	178.2	-72.7	-173.9	51.9	0	0	114.8	L1035 P1036 L1037	L1035-M1039 HydrophobicContact CD2-CE 3.8Å; L1035-M1039 HydrophobicContact CD2-SD 3.68Å; P1036-M1039 HydrophobicContact CG-CG 4.46Å; P1036-M1039 PolarHBondContact O-N 2.98Å; P1036-M1039 VanDerWaalsContact O-N 3.08Å; L1037-M1039 PolarHBondContact O-N 3.46Å
1040	L	36.5	Very low	38.5	Very low	144 Å²	144	110.7 Å²	110.7	75%	0.754	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-86.7	-2.6	179.4	-71.7	167.2	0	0	0	114.8	L1037 E1038	L1037-L1040 PolarHBondContact O-N 3.37Å; E1038-L1040 PolarHBondContact O-N 3.36Å
1041	L	32.6	Very low	37.7	Very low	151 Å²	151	115.3 Å²	115.3	79%	0.791	67%	0.672	S	S	*	*	S	Bend	trans	-114.8	148.7	-176.3	-62.4	175.5	0	0	0	113.5
1042	P	31.5	Very low	37.1	Very low	106 Å²	106	121.7 Å²	121.7	69%	0.688	70%	0.701	S	S	*	*			trans	-111.5	125.2	-165.9	37.3	-28.4	0	0	0	117.1
1043	V	33.8	Very low	36.2	Very low	132 Å²	132	126.3 Å²	126.3	80%	0.8	72%	0.715	S	S	*	*			trans	71.8	139	144.8	-176.5	0	0	0	0	115
1044	P	31.9	Very low	35.3	Very low	116 Å²	116	128.9 Å²	128.9	75%	0.753	72%	0.716	S	S	*	*			cis	-139.4	159.3	38.6	38.6	-18.2	0	0	0	120.4
1045	D	29	Very low	34.7	Very low	148 Å²	148	131.6 Å²	131.6	79%	0.791	73%	0.731	S	S	*	*			trans	33.2	159.8	138.6	-136.7	-5.4	0	0	0	126.5
1046	L	31.4	Very low	34.4	Very low	132 Å²	132	136.6 Å²	136.6	69%	0.691	76%	0.763	S	S	*	*			trans	81.8	97.2	159.8	-62	-179.5	0	0	0	122.7
1047	T	27.3	Very low	33.7	Very low	130 Å²	130	137.2 Å²	137.2	80%	0.798	78%	0.775	S	S	*	*				45.9	111.6	127.4	60.4	0	0	0	0	122.8
1048	A	32.4	Very low	33.3	Very low	101 Å²	101	138.7 Å²	138.7	84%	0.835	78%	0.778	S	S	*	*			trans	-164.1	164.3	144.5	0	0	0	0	0	112.5
1049	S	29.7	Very low	32.5	Very low	118 Å²	118	137.2 Å²	137.2	83%	0.825	78%	0.78	S	S	*	*			trans	-156.6	-173.1	177.4	-62.1	0	0	0	0	109.9
1050	P	40.8	Very low	32	Very low	118 Å²	118	138 Å²	138	77%	0.766	79%	0.793	S	S	*	*				-108.6	-169	-60.7	39	-26.1	0	0	0	111.3
1051	P	32.7	Very low	31.6	Very low	130 Å²	130	136.6 Å²	136.6	84%	0.844	80%	0.795	S	S	*	*				-158.9	-174.7	104.2	40.2	-19.1	0	0	0	118
1052	H	31.2	Very low	31.4	Very low	179 Å²	179	138.4 Å²	138.4	83%	0.829	80%	0.8	S	S	*	*			trans	-88.5	161.5	-174.5	-59.7	-88.5	0	0	0	118
1053	K	32.6	Very low	31.2	Very low	201 Å²	201	138.3 Å²	138.3	87%	0.874	81%	0.808	S	S	*	*			trans	162.5	163.9	131	-90.3	162.1	-175.4	177.4	0	111.5
1054	K	33	Very low	31	Very low	176 Å²	176	137.6 Å²	137.6	77%	0.765	81%	0.806	S	S	*	*			cis	-169.5	147.1	-41.7	-131.4	-166.1	175.8	-176.9	0	110.3
1055	N	31.3	Very low	30.9	Very low	135 Å²	135	140.8 Å²	140.8	72%	0.722	81%	0.813	S	S	*	*			trans	39.8	119.4	156.1	-62	19.5	0	0	0	122.8
1056	V	36.5	Very low	31.2	Very low	153 Å²	153	141.6 Å²	141.6	93%	0.927	82%	0.817	S	S	*	*			trans	-140	158.2	133.4	-176.1	0	0	0	0	107.3
1057	A	30.1	Very low	32.3	Very low	88 Å²	88	142.6 Å²	142.6	73%	0.727	82%	0.816	S	S	*	*			trans	-142.9	149.5	-176.2	0	0	0	0	0	112.9
1058	Q	30.2	Very low	34	Very low	184 Å²	184	141.3 Å²	141.3	86%	0.86	81%	0.812	S	S	*	*			trans	-167.9	150	159.2	-112.4	159.7	10.6	0	0	113.7
1059	T	27.7	Very low	36.7	Very low	132 Å²	132	137.8 Å²	137.8	81%	0.81	78%	0.779	S	S	*	*			trans	52.8	146	162.4	38.9	0	0	0	0	121.9
1060	P	28.9	Very low	39.7	Very low	124 Å²	124	134.3 Å²	134.3	81%	0.805	75%	0.751	S	S	*	*			trans	-93.1	138	-175.7	36	-32.7	0	0	0	113
1061	S	28.7	Very low	42.4	Very low	114 Å²	114	128.7 Å²	128.7	80%	0.797	71%	0.714	S	S	*	*			trans	-145.5	146.2	166.5	56.4	0	0	0	0	113.6
1062	E	28.9	Very low	45.4	Very low	190 Å²	190	122.5 Å²	122.5	89%	0.888	67%	0.674	S	S	*	*			trans	-10.3	123.1	165.5	-57.8	174.6	160.2	0	0	117.7	P1064	E1062-P1064 WeakPolarHBondContact O-CD 3.48Å
1063	A	26.2	Very low	48.5	Very low	104 Å²	104	114 Å²	114	86%	0.86	64%	0.635	S	S	*	*			trans	-102.1	121.9	-177.9	0	0	0	0	0	113.8
1064	P	30.2	Very low	51.4	Low	116 Å²	116	104.7 Å²	104.7	75%	0.753	60%	0.595	S	S	*	*			trans	-106.7	137.3	157.2	34.7	-28	0	0	0	111.6	E1062 N1066	E1062-P1064 WeakPolarHBondContact O-CD 3.48Å; P1064-N1066 PolarHBondContact O-N 3.36Å
1065	M	29.5	Very low	54.2	Low	184 Å²	184	96.3 Å²	96.3	91%	0.906	56%	0.558	S	S	*	*			trans	-71.2	127.6	-174.7	-60.6	-174.8	-68.8	0	0	113.3
1066	N	35.2	Very low	56.9	Low	164 Å²	164	91 Å²	91	88%	0.877	53%	0.53	S	S	*	.			trans	-145.7	75.8	161.5	-166.1	13.9	0	0	0	111.2	P1064	P1064-N1066 PolarHBondContact O-N 3.36Å
1067	K	55	Low	59.4	Low	154 Å²	154	83.8 Å²	83.8	67%	0.67	49%	0.486	S	S	*	.			trans	-105.6	125.7	175.5	-126.9	-177.1	175.5	-169.1	0	108	D1308	K1067-D1308 IonicContact NZ-OD1 3.57Å; K1067-D1308 PolarHBondContact NZ-OD1 3.17Å
1068	S	64.4	Low	61.8	Low	103 Å²	103	79.7 Å²	79.7	72%	0.72	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-77.1	133.2	177.5	50.7	0	0	0	0	111.7
1069	L	88.2	Confident	63.7	Low	26 Å²	26	73.6 Å²	73.6	14%	0.136	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-58.9	136.3	168.8	-178.5	79.2	0	0	0	110.3	I1071 A1303 A1307 I1310 L1322	L1069-I1071 HydrophobicContact CD2-CG1 4.15Å; L1069-A1303 HydrophobicContact CD2-CB 4.23Å; L1069-A1307 WeakPolarHBondContact CD1-O 3.18Å; L1069-I1310 HydrophobicContact CD1-CD1 4.29Å; L1069-I1310 HydrophobicContact CD1-CG1 4.07Å; L1069-I1310 HydrophobicContact CD2-CB 4.41Å; L1069-I1310 HydrophobicContact CD2-CD1 3.99Å; L1069-I1310 HydrophobicContact CD2-CG1 4.31Å; L1069-L1322 HydrophobicContact CD2-CD1 3.64Å; L1069-L1322 HydrophobicContact CD2-CD2 4.41Å
1070	I	93.6	Very high	65.5	Low	45 Å²	45	70.2 Å²	70.2	23%	0.231	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.1	176	-62.1	173.8	0	0	0	109.6	F1072 D1107 V1108 D1308 F1309 I1310	I1070-F1072 HydrophobicContact CG2-CD2 4.24Å; I1070-F1072 HydrophobicContact CG2-CE2 4.02Å; I1070-D1107 WeakPolarHBondContact CA-OD2 3.31Å; I1070-D1107 HydrophobicContact CG2-CB 3.76Å; I1070-V1108 HydrophobicContact CG2-CG2 3.96Å; I1070-D1308 PolarHBondContact N-O 2.56Å; I1070-F1309 HydrophobicContact CB-CD1 3.54Å; I1070-F1309 HydrophobicContact CB-CE1 3.81Å; I1070-F1309 HydrophobicContact CB-CG 4.48Å; I1070-F1309 HydrophobicContact CD1-CD1 4.3Å; I1070-F1309 HydrophobicContact CD1-CE1 3.66Å; I1070-F1309 HydrophobicContact CD1-CZ 4.24Å; I1070-F1309 HydrophobicContact CG1-CD1 4.45Å; I1070-F1309 HydrophobicContact CG1-CE1 4.29Å; I1070-F1309 HydrophobicContact CG2-CD1 3.66Å; I1070-F1309 HydrophobicContact CG2-CE1 3.8Å; I1070-F1309 VanDerWaalsContact O-CA 3.26Å; I1070-F1309 WeakPolarHBondContact O-CA 2.79Å; I1070-I1310 PolarHBondContact O-N 3.26Å; I1070-I1310 VanDerWaalsContact O-N 3.13Å
1071	I	96	Very high	66.7	Low	0 Å²	0	65 Å²	65	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	124.5	-176.2	-57.5	-180	0	0	0	110.7	L1069 D1107 V1108 I1310 T1312 P1315 L1318 R1319 L1322	L1069-I1071 HydrophobicContact CD2-CG1 4.15Å; I1071-D1107 PolarHBondContact N-OD2 3.48Å; I1071-D1107 PolarHBondContact O-N 3.37Å; I1071-V1108 PolarHBondContact O-N 2.87Å; I1071-I1310 WeakPolarHBondContact CA-O 3.37Å; I1071-T1312 HydrophobicContact CG2-CG2 3.87Å; I1071-P1315 HydrophobicContact CG2-CB 3.84Å; I1071-L1318 HydrophobicContact CD1-CB 4.47Å; I1071-L1318 HydrophobicContact CD1-CD2 3.88Å; I1071-L1318 HydrophobicContact CD1-CG 3.95Å; I1071-L1318 HydrophobicContact CG1-CD2 4.16Å; I1071-L1318 HydrophobicContact CG2-CD2 4.33Å; I1071-R1319 HydrophobicContact CD1-CG 3.81Å; I1071-L1322 HydrophobicContact CD1-CD1 4.15Å
1072	F	96.5	Very high	67.9	Low	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	112.1	174.3	-83.3	-140.3	0	0	0	109.4	I1070 V1108 D1110 Y1166 L1271 F1309 I1310 R1311 T1312	I1070-F1072 HydrophobicContact CG2-CD2 4.24Å; I1070-F1072 HydrophobicContact CG2-CE2 4.02Å; F1072-V1108 CarbonylContact C-O 3.26Å; F1072-V1108 WeakPolarHBondContact CA-O 3.26Å; F1072-V1108 HydrophobicContact CD1-CG1 4.39Å; F1072-V1108 HydrophobicContact CD2-CB 3.73Å; F1072-V1108 HydrophobicContact CD2-CG1 4.29Å; F1072-V1108 HydrophobicContact CD2-CG2 3.98Å; F1072-V1108 HydrophobicContact CE1-CG1 4.2Å; F1072-V1108 HydrophobicContact CE2-CB 3.76Å; F1072-V1108 HydrophobicContact CE2-CG1 4.07Å; F1072-V1108 HydrophobicContact CE2-CG2 3.61Å; F1072-V1108 HydrophobicContact CG-CB 4.16Å; F1072-V1108 HydrophobicContact CG-CG1 4.43Å; F1072-V1108 HydrophobicContact CZ-CB 4.25Å; F1072-V1108 HydrophobicContact CZ-CG1 4.03Å; F1072-V1108 HydrophobicContact CZ-CG2 4.25Å; F1072-D1110 HydrophobicContact CB-CB 4.41Å; F1072-D1110 HydrophobicContact CD1-CB 4Å; F1072-Y1166 HydrophobicContact CE1-CD1 4.38Å; F1072-Y1166 HydrophobicContact CE1-CG 4.24Å; F1072-Y1166 HydrophobicContact CE2-CE1 4.32Å; F1072-Y1166 HydrophobicContact CE2-CE2 4.36Å; F1072-Y1166 AromaticContact CZ-CD1 3.62Å; F1072-Y1166 HydrophobicContact CZ-CD1 3.62Å; F1072-Y1166 AromaticContact CZ-CD2 3.86Å; F1072-Y1166 HydrophobicContact CZ-CD2 3.86Å; F1072-Y1166 AromaticContact CZ-CE1 3.76Å; F1072-Y1166 HydrophobicContact CZ-CE1 3.76Å; F1072-Y1166 HydrophobicContact CZ-CE2 4.02Å; F1072-Y1166 AromaticContact CZ-CG 3.71Å; F1072-Y1166 HydrophobicContact CZ-CG 3.71Å; F1072-Y1166 AromaticContact CZ-CZ 3.99Å; F1072-L1271 HydrophobicContact CD1-CD1 4.16Å; F1072-L1271 HydrophobicContact CE1-CD1 4.06Å; F1072-L1271 HydrophobicContact CG-CD1 4.46Å; F1072-L1271 HydrophobicContact CZ-CD1 4.27Å; F1072-F1309 HydrophobicContact CD2-CD1 4.15Å; F1072-F1309 AromaticContact CE2-CD1 3.49Å; F1072-F1309 HydrophobicContact CE2-CD1 3.49Å; F1072-F1309 VanDerWaalsContact CE2-CD1 3.49Å; F1072-F1309 AromaticContact CE2-CE1 3.93Å; F1072-F1309 HydrophobicContact CE2-CE1 3.93Å; F1072-F1309 HydrophobicContact CE2-CG 4.45Å; F1072-F1309 HydrophobicContact CZ-CD1 4.21Å; F1072-F1309 HydrophobicContact CZ-CE1 4.44Å; F1072-I1310 PolarHBondContact N-O 3.01Å; F1072-R1311 HydrophobicContact CB-CB 4.1Å; F1072-R1311 HydrophobicContact CB-CG 4.08Å; F1072-R1311 WeakPolarHBondContact O-CA 3.03Å; F1072-T1312 PolarHBondContact O-N 3.18Å
1073	G	95.5	Very high	69	Low	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	117.4	174.9	0	0	0	0	0	111.5	V1108 D1110	G1073-V1108 PolarHBondContact N-O 3.43Å; G1073-D1110 PolarHBondContact O-N 3.26Å
1074	I	93.4	Very high	70.5	Confident	6 Å²	6	53.3 Å²	53.3	3%	0.031	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	128.1	-175.9	-58.3	168.2	0	0	0	111.4	N1076 L1101 R1311 T1312	I1074-N1076 WeakPolarHBondContact CG2-ND2 3.41Å; I1074-L1101 VanDerWaalsContact O-CD1 3.3Å; I1074-L1101 WeakPolarHBondContact O-CD1 3.25Å; I1074-R1311 HydrophobicContact CD1-CG 3.92Å; I1074-R1311 HydrophobicContact CG1-CG 3.64Å; I1074-T1312 WeakPolarHBondContact CG1-O 3.5Å; I1074-T1312 PolarHBondContact N-O 3.31Å
1075	V	92.5	Very high	71.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	101.9	168.2	-177.8	0	0	0	0	110	I1077 A1094 Q1097 A1098 L1101 I1109 D1110 L1111 G1112	V1075-I1077 HydrophobicContact CG1-CG1 4.46Å; V1075-A1094 HydrophobicContact CG1-CB 4.06Å; V1075-Q1097 HydrophobicContact CG2-CG 4.22Å; V1075-A1098 HydrophobicContact CG2-CB 4.15Å; V1075-L1101 HydrophobicContact CG2-CD1 3.61Å; V1075-I1109 HydrophobicContact CB-CG2 4.39Å; V1075-I1109 HydrophobicContact CG2-CG2 3.86Å; V1075-D1110 PolarHBondContact N-O 2.72Å; V1075-L1111 HydrophobicContact CB-CD2 4.01Å; V1075-L1111 HydrophobicContact CG1-CD2 4.29Å; V1075-G1112 PolarHBondContact O-N 2.78Å
1076	N	88.4	Confident	73.3	Confident	23 Å²	23	42.9 Å²	42.9	12%	0.123	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	109.7	179.3	-60.4	-58.3	0	0	0	110.8	I1074 T1078 D1084 G1112	I1074-N1076 WeakPolarHBondContact CG2-ND2 3.41Å; N1076-T1078 VanDerWaalsContact C-N 3.26Å; N1076-T1078 PolarHBondContact O-N 2.95Å; N1076-D1084 PolarHBondContact ND2-OD2 2.8Å; N1076-G1112 CarbonylContact C-O 3.53Å
1077	I	89.4	Confident	74.7	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	24%	0.242	C	C	.	.			trans	-92.2	60.3	175.1	-47.9	173.2	0	0	0	108.2	V1075 A1094 L1111 G1112 R1131 V1135	V1075-I1077 HydrophobicContact CG1-CG1 4.46Å; I1077-A1094 HydrophobicContact CD1-CB 4.3Å; I1077-A1094 HydrophobicContact CG1-CB 4.15Å; I1077-L1111 HydrophobicContact CD1-CD2 4.44Å; I1077-G1112 PolarHBondContact N-O 2.85Å; I1077-R1131 HydrophobicContact CB-CB 4.49Å; I1077-R1131 HydrophobicContact CG2-CB 3.85Å; I1077-R1131 HydrophobicContact CG2-CG 4.13Å; I1077-R1131 WeakPolarHBondContact O-CD 3.3Å; I1077-V1135 HydrophobicContact CD1-CB 4.16Å; I1077-V1135 HydrophobicContact CD1-CG1 4.29Å; I1077-V1135 HydrophobicContact CD1-CG2 3.86Å
1078	T	80.3	Confident	75.7	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.012	22%	0.216	C	C	.	.			trans	-130.6	151	-171.2	60.6	0	0	0	0	111.7	N1076 G1086 G1112 A1114	N1076-T1078 VanDerWaalsContact C-N 3.26Å; N1076-T1078 PolarHBondContact O-N 2.95Å; T1078-G1086 WeakPolarHBondContact O-CA 3.43Å; T1078-G1112 WeakPolarHBondContact CG2-O 3.46Å; T1078-A1114 VanDerWaalsContact CG2-C 3.42Å
1079	S	70.4	Confident	76.4	Confident	57 Å²	57	36.5 Å²	36.5	40%	0.399	20%	0.201	S	C	.	.	S	Bend	trans	-70.7	-36.5	170.6	41.9	0	0	0	0	112	S1081	S1079-S1081 PolarHBondContact O-N 2.84Å
1080	D	64.4	Low	76.3	Confident	60 Å²	60	37.8 Å²	37.8	32%	0.321	22%	0.216	S	C	.	.			trans	-100.8	28	-160.8	-44.4	-13.8	0	0	0	112.6	F1082 N1117 A1121	D1080-F1082 PolarHBondContact O-N 2.81Å; D1080-N1117 PolarHBondContact O-ND2 2.85Å; D1080-A1121 PolarHBondContact OD2-N 2.89Å; D1080-A1121 VanDerWaalsContact OD2-N 3.12Å
1081	S	54.1	Low	76	Confident	14 Å²	14	38 Å²	38	10%	0.098	22%	0.22	C	C	.	.			trans	-72	111.8	-173.5	175.9	0	0	0	0	113.1	S1079 S1083 D1084 G1085	S1079-S1081 PolarHBondContact O-N 2.84Å; S1081-S1083 PolarHBondContact O-N 3.04Å; S1081-D1084 PolarHBondContact O-N 3.49Å; S1081-D1084 WeakPolarHBondContact OG-CB 3.42Å; S1081-D1084 PolarHBondContact OG-N 3.04Å; S1081-D1084 VanDerWaalsContact OG-N 3.07Å; S1081-D1084 PolarHBondContact OG-OD2 2.57Å; S1081-G1085 PolarHBondContact O-N 2.88Å
1082	F	53.2	Low	75.6	Confident	112 Å²	112	44.3 Å²	44.3	49%	0.491	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-5.4	178.5	-127.4	-79	0	0	0	116.1	D1080	D1080-F1082 PolarHBondContact O-N 2.81Å
1083	S	53	Low	75.2	Confident	40 Å²	40	45.9 Å²	45.9	28%	0.28	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	-20.9	175.2	71.2	0	0	0	0	115	S1081 R1276	S1081-S1083 PolarHBondContact O-N 3.04Å; S1083-R1276 PolarHBondContact OG-NH1 3.31Å
1084	D	57.3	Low	74.9	Confident	12 Å²	12	45.9 Å²	45.9	6%	0.064	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-7.4	-176.4	-43.7	-53	0	0	0	113.4	N1076 S1081 G1086 R1087 Y1088 R1276	N1076-D1084 PolarHBondContact ND2-OD2 2.8Å; S1081-D1084 PolarHBondContact O-N 3.49Å; S1081-D1084 WeakPolarHBondContact OG-CB 3.42Å; S1081-D1084 PolarHBondContact OG-N 3.04Å; S1081-D1084 VanDerWaalsContact OG-N 3.07Å; S1081-D1084 PolarHBondContact OG-OD2 2.57Å; D1084-G1086 PolarHBondContact O-N 2.9Å; D1084-R1087 WeakPolarHBondContact O-CB 3.42Å; D1084-R1087 VanDerWaalsContact O-CD 3.24Å; D1084-R1087 WeakPolarHBondContact O-CD 3.39Å; D1084-R1087 WeakPolarHBondContact O-CG 3.44Å; D1084-R1087 PolarHBondContact O-N 3.23Å; D1084-Y1088 HydrophobicContact CB-CD2 4.24Å; D1084-Y1088 HydrophobicContact CB-CE2 3.74Å; D1084-R1276 IonicContact OD1-NH1 2.71Å; D1084-R1276 PolarHBondContact OD1-NH1 2.74Å
1085	G	53.7	Low	74.9	Confident	62 Å²	62	46.4 Å²	46.4	64%	0.639	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	44.4	166.8	0	0	0	0	0	115.5	S1081 R1087	S1081-G1085 PolarHBondContact O-N 2.88Å; G1085-R1087 VanDerWaalsContact C-N 3.26Å; G1085-R1087 PolarHBondContact O-N 3.34Å
1086	G	65.1	Low	74.8	Confident	18 Å²	18	49.1 Å²	49.1	19%	0.186	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	0	176.8	0	0	0	0	0	116.4	T1078 D1084 Y1088 L1089	T1078-G1086 WeakPolarHBondContact O-CA 3.43Å; D1084-G1086 PolarHBondContact O-N 2.9Å; G1086-Y1088 PolarHBondContact O-N 3.11Å; G1086-L1089 PolarHBondContact O-N 2.97Å; G1086-L1089 VanDerWaalsContact O-N 3.15Å
1087	R	65.2	Low	75.1	Confident	177 Å²	177	49.3 Å²	49.3	67%	0.668	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-23.9	-171.9	-76	170.5	-174.6	173.5	2.4	116	D1084 G1085 A1093	D1084-R1087 WeakPolarHBondContact O-CB 3.42Å; D1084-R1087 VanDerWaalsContact O-CD 3.24Å; D1084-R1087 WeakPolarHBondContact O-CD 3.39Å; D1084-R1087 WeakPolarHBondContact O-CG 3.44Å; D1084-R1087 PolarHBondContact O-N 3.23Å; G1085-R1087 VanDerWaalsContact C-N 3.26Å; G1085-R1087 PolarHBondContact O-N 3.34Å; R1087-A1093 WeakPolarHBondContact O-CB 3.44Å
1088	Y	75.8	Confident	75.2	Confident	30 Å²	30	49.2 Å²	49.2	12%	0.118	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	16.2	-174.7	-45.1	-55.1	0	0	0	113.7	D1084 G1086 A1090 A1093 Q1097	D1084-Y1088 HydrophobicContact CB-CD2 4.24Å; D1084-Y1088 HydrophobicContact CB-CE2 3.74Å; G1086-Y1088 PolarHBondContact O-N 3.11Å; Y1088-A1090 PolarHBondContact O-N 2.84Å; Y1088-A1093 HydrophobicContact CD1-CB 4.35Å; Y1088-Q1097 HydrophobicContact CD1-CB 3.87Å; Y1088-Q1097 HydrophobicContact CD1-CG 4.22Å; Y1088-Q1097 HydrophobicContact CE1-CB 3.63Å; Y1088-Q1097 HydrophobicContact CE1-CG 3.72Å; Y1088-Q1097 HydrophobicContact CE2-CG 4.04Å
1089	L	79	Confident	75.9	Confident	81 Å²	81	55 Å²	55	42%	0.424	31%	0.313	S	S	.	.			trans	-62.3	-29.3	171.4	-79.8	171	0	0	0	113.2	G1086	G1086-L1089 PolarHBondContact O-N 2.97Å; G1086-L1089 VanDerWaalsContact O-N 3.15Å
1090	A	84.9	Confident	77	Confident	53 Å²	53	57 Å²	57	44%	0.438	32%	0.315	S	S	.	.	S	Bend	trans	-79.9	128.4	173.1	0	0	0	0	0	110.1	Y1088 D1092 A1093 A1094	Y1088-A1090 PolarHBondContact O-N 2.84Å; A1090-D1092 VanDerWaalsContact C-N 3.31Å; A1090-D1092 PolarHBondContact O-N 2.96Å; A1090-A1093 HydrophobicContact CB-CB 4.27Å; A1090-A1093 WeakPolarHBondContact O-CB 3.36Å; A1090-A1093 PolarHBondContact O-N 3.22Å; A1090-A1094 PolarHBondContact O-N 3.09Å; A1090-A1094 VanDerWaalsContact O-N 3.14Å
1091	P	87	Confident	78.4	Confident	50 Å²	50	54.2 Å²	54.2	33%	0.325	30%	0.3	S	S	.	.	H	α-helix	trans	-54.1	-42.8	-176.9	-29.8	36.4	0	0	0	113.9	A1093 A1094 I1095 P1134 V1135	P1091-A1093 VanDerWaalsContact C-N 3.27Å; P1091-A1093 PolarHBondContact O-N 2.87Å; P1091-A1094 PolarHBondContact O-N 2.9Å; P1091-A1094 VanDerWaalsContact O-N 3.17Å; P1091-I1095 WeakPolarHBondContact O-CB 3.41Å; P1091-I1095 WeakPolarHBondContact O-CD1 3.39Å; P1091-I1095 VanDerWaalsContact O-CG1 3.24Å; P1091-I1095 WeakPolarHBondContact O-CG1 3.39Å; P1091-I1095 PolarHBondContact O-N 2.87Å; P1091-P1134 HydrophobicContact CB-CB 3.99Å; P1091-P1134 HydrophobicContact CB-CG 3.83Å; P1091-P1134 HydrophobicContact CG-CB 4.18Å; P1091-P1134 HydrophobicContact CG-CG 3.6Å; P1091-V1135 HydrophobicContact CB-CG2 4.08Å
1092	D	88.8	Confident	80.3	Confident	131 Å²	131	56 Å²	56	70%	0.701	31%	0.307	S	S	*	.	H	α-helix	trans	-61.1	-35.7	178.9	-59.3	-45.7	0	0	0	112.6	A1090 A1096	A1090-D1092 VanDerWaalsContact C-N 3.31Å; A1090-D1092 PolarHBondContact O-N 2.96Å; D1092-A1096 WeakPolarHBondContact O-CB 3.48Å; D1092-A1096 PolarHBondContact O-N 2.71Å
1093	A	88.3	Confident	82.1	Confident	34 Å²	34	55 Å²	55	28%	0.281	32%	0.319	S	S	.	.	H	α-helix	trans	-72	-38.6	177.2	0	0	0	0	0	111.6	R1087 Y1088 A1090 P1091 Q1097	R1087-A1093 WeakPolarHBondContact O-CB 3.44Å; Y1088-A1093 HydrophobicContact CD1-CB 4.35Å; A1090-A1093 HydrophobicContact CB-CB 4.27Å; A1090-A1093 WeakPolarHBondContact O-CB 3.36Å; A1090-A1093 PolarHBondContact O-N 3.22Å; P1091-A1093 VanDerWaalsContact C-N 3.27Å; P1091-A1093 PolarHBondContact O-N 2.87Å; A1093-Q1097 VanDerWaalsContact O-CB 3.32Å; A1093-Q1097 WeakPolarHBondContact O-CB 3.48Å; A1093-Q1097 PolarHBondContact O-N 2.73Å
1094	A	89	Confident	83.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.3	-43.9	172.7	0	0	0	0	0	112	V1075 I1077 A1090 P1091 Q1097 A1098 V1135	V1075-A1094 HydrophobicContact CG1-CB 4.06Å; I1077-A1094 HydrophobicContact CD1-CB 4.3Å; I1077-A1094 HydrophobicContact CG1-CB 4.15Å; A1090-A1094 PolarHBondContact O-N 3.09Å; A1090-A1094 VanDerWaalsContact O-N 3.14Å; P1091-A1094 PolarHBondContact O-N 2.9Å; P1091-A1094 VanDerWaalsContact O-N 3.17Å; A1094-Q1097 PolarHBondContact O-N 3.29Å; A1094-A1098 VanDerWaalsContact O-CB 3.26Å; A1094-A1098 WeakPolarHBondContact O-CB 3.31Å; A1094-A1098 PolarHBondContact O-N 2.81Å; A1094-V1135 HydrophobicContact CB-CG1 4.13Å; A1094-V1135 HydrophobicContact CB-CG2 3.75Å
1095	I	92.7	Very high	85.5	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.082	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-44.3	176.5	-65.8	160.4	0	0	0	110.6	P1091 A1098 R1099 V1135 A1138	P1091-I1095 WeakPolarHBondContact O-CB 3.41Å; P1091-I1095 WeakPolarHBondContact O-CD1 3.39Å; P1091-I1095 VanDerWaalsContact O-CG1 3.24Å; P1091-I1095 WeakPolarHBondContact O-CG1 3.39Å; P1091-I1095 PolarHBondContact O-N 2.87Å; I1095-A1098 PolarHBondContact O-N 2.8Å; I1095-R1099 WeakPolarHBondContact O-CB 3.44Å; I1095-R1099 WeakPolarHBondContact O-CG 3.5Å; I1095-R1099 PolarHBondContact O-N 2.91Å; I1095-V1135 HydrophobicContact CG1-CB 4.33Å; I1095-V1135 HydrophobicContact CG1-CG1 4.06Å; I1095-V1135 HydrophobicContact CG1-CG2 4.31Å; I1095-A1138 HydrophobicContact CD1-CB 3.51Å; I1095-A1138 HydrophobicContact CG1-CB 3.9Å; I1095-A1138 HydrophobicContact CG2-CB 4.4Å
1096	A	91.4	Very high	87.5	Confident	58 Å²	58	53.1 Å²	53.1	48%	0.479	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-43	176.5	0	0	0	0	0	112.2	D1092 K1100	D1092-A1096 WeakPolarHBondContact O-CB 3.48Å; D1092-A1096 PolarHBondContact O-N 2.71Å; A1096-K1100 VanDerWaalsContact O-CB 3.29Å; A1096-K1100 WeakPolarHBondContact O-CB 3.06Å; A1096-K1100 PolarHBondContact O-N 3.25Å
1097	Q	93.1	Very high	88.9	Confident	26 Å²	26	54.9 Å²	54.9	12%	0.121	30%	0.3	C	S	.	.	H	α-helix	trans	-67.1	-40.9	176	176.9	62.9	9.4	0	0	111.8	V1075 Y1088 A1093 A1094 K1100 L1101	V1075-Q1097 HydrophobicContact CG2-CG 4.22Å; Y1088-Q1097 HydrophobicContact CD1-CB 3.87Å; Y1088-Q1097 HydrophobicContact CD1-CG 4.22Å; Y1088-Q1097 HydrophobicContact CE1-CB 3.63Å; Y1088-Q1097 HydrophobicContact CE1-CG 3.72Å; Y1088-Q1097 HydrophobicContact CE2-CG 4.04Å; A1093-Q1097 VanDerWaalsContact O-CB 3.32Å; A1093-Q1097 WeakPolarHBondContact O-CB 3.48Å; A1093-Q1097 PolarHBondContact O-N 2.73Å; A1094-Q1097 PolarHBondContact O-N 3.29Å; Q1097-K1100 WeakPolarHBondContact O-CB 3.42Å; Q1097-K1100 PolarHBondContact O-N 2.77Å; Q1097-L1101 HydrophobicContact CG-CD1 4.13Å; Q1097-L1101 HydrophobicContact CG-CG 4.46Å; Q1097-L1101 VanDerWaalsContact O-CG 3.29Å; Q1097-L1101 WeakPolarHBondContact O-CG 3.47Å; Q1097-L1101 PolarHBondContact O-N 2.8Å
1098	A	92.8	Very high	90.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-49	174.8	0	0	0	0	0	112	V1075 A1094 I1095 K1100 L1101 M1102 I1109 L1139	V1075-A1098 HydrophobicContact CG2-CB 4.15Å; A1094-A1098 VanDerWaalsContact O-CB 3.26Å; A1094-A1098 WeakPolarHBondContact O-CB 3.31Å; A1094-A1098 PolarHBondContact O-N 2.81Å; I1095-A1098 PolarHBondContact O-N 2.8Å; A1098-K1100 VanDerWaalsContact C-N 3.3Å; A1098-K1100 PolarHBondContact O-N 2.88Å; A1098-L1101 PolarHBondContact O-N 2.98Å; A1098-M1102 WeakPolarHBondContact O-CG 3.46Å; A1098-M1102 PolarHBondContact O-N 2.95Å; A1098-I1109 HydrophobicContact CB-CD1 4.45Å; A1098-I1109 HydrophobicContact CB-CG1 4.13Å; A1098-I1109 HydrophobicContact CB-CG2 3.87Å; A1098-I1109 WeakPolarHBondContact O-CD1 3.31Å; A1098-L1139 HydrophobicContact CB-CD1 3.8Å; A1098-L1139 HydrophobicContact CB-CD2 3.6Å; A1098-L1139 HydrophobicContact CB-CG 4.31Å
1099	R	94	Very high	91.3	Very high	123 Å²	123	45.2 Å²	45.2	46%	0.464	26%	0.264	S	S	.	.	H	α-helix	trans	-59.1	-40.4	174.1	-73.6	172	171.9	168.1	-4.4	112	I1095 A1103 D1142 I1144	I1095-R1099 WeakPolarHBondContact O-CB 3.44Å; I1095-R1099 WeakPolarHBondContact O-CG 3.5Å; I1095-R1099 PolarHBondContact O-N 2.91Å; R1099-A1103 WeakPolarHBondContact O-CB 3.28Å; R1099-A1103 PolarHBondContact O-N 3.29Å; R1099-D1142 IonicContact CZ-OD1 3.65Å; R1099-D1142 IonicContact CZ-OD2 3.26Å; R1099-D1142 VanDerWaalsContact CZ-OD2 3.26Å; R1099-D1142 IonicContact NE-OD1 3.73Å; R1099-D1142 IonicContact NE-OD2 2.7Å; R1099-D1142 PolarHBondContact NE-OD2 3.28Å; R1099-D1142 VanDerWaalsContact NH2-CG 3.27Å; R1099-D1142 IonicContact NH2-OD1 2.75Å; R1099-D1142 PolarHBondContact NH2-OD1 2.97Å; R1099-D1142 IonicContact NH2-OD2 2.99Å; R1099-D1142 PolarHBondContact NH2-OD2 3.44Å; R1099-I1144 HydrophobicContact CG-CD1 4.44Å
1100	K	93.6	Very high	92.1	Very high	101 Å²	101	41.4 Å²	41.4	44%	0.439	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-47.4	174.1	179.1	-169.4	158.7	-162	0	111.5	A1096 Q1097 A1098 M1102 A1103 E1104	A1096-K1100 VanDerWaalsContact O-CB 3.29Å; A1096-K1100 WeakPolarHBondContact O-CB 3.06Å; A1096-K1100 PolarHBondContact O-N 3.25Å; Q1097-K1100 WeakPolarHBondContact O-CB 3.42Å; Q1097-K1100 PolarHBondContact O-N 2.77Å; A1098-K1100 VanDerWaalsContact C-N 3.3Å; A1098-K1100 PolarHBondContact O-N 2.88Å; K1100-M1102 VanDerWaalsContact C-N 3.34Å; K1100-M1102 PolarHBondContact O-N 2.94Å; K1100-A1103 CarbonylContact O-C 3.48Å; K1100-A1103 PolarHBondContact O-N 2.81Å; K1100-A1103 VanDerWaalsContact O-N 3.11Å; K1100-E1104 WeakPolarHBondContact CE-OE1 3.46Å; K1100-E1104 VanDerWaalsContact CE-OE2 3.27Å; K1100-E1104 WeakPolarHBondContact CE-OE2 3.33Å; K1100-E1104 HydrophobicContact CG-CG 4.4Å; K1100-E1104 IonicContact NZ-OE1 2.72Å; K1100-E1104 IonicContact NZ-OE2 3.66Å; K1100-E1104 WeakPolarHBondContact O-CB 3.15Å; K1100-E1104 WeakPolarHBondContact O-CG 3.3Å; K1100-E1104 PolarHBondContact O-N 3.28Å
1101	L	93.8	Very high	92.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-37.1	-179.9	-71.3	170.5	0	0	0	112.2	I1074 V1075 Q1097 A1098 E1104 G1105 A1106 I1109 P1315	I1074-L1101 VanDerWaalsContact O-CD1 3.3Å; I1074-L1101 WeakPolarHBondContact O-CD1 3.25Å; V1075-L1101 HydrophobicContact CG2-CD1 3.61Å; Q1097-L1101 HydrophobicContact CG-CD1 4.13Å; Q1097-L1101 HydrophobicContact CG-CG 4.46Å; Q1097-L1101 VanDerWaalsContact O-CG 3.29Å; Q1097-L1101 WeakPolarHBondContact O-CG 3.47Å; Q1097-L1101 PolarHBondContact O-N 2.8Å; A1098-L1101 PolarHBondContact O-N 2.98Å; L1101-E1104 CarbonylContact O-C 3.58Å; L1101-E1104 PolarHBondContact O-N 2.99Å; L1101-G1105 PolarHBondContact O-N 3.38Å; L1101-G1105 VanDerWaalsContact O-N 3.07Å; L1101-A1106 HydrophobicContact CB-CB 4.41Å; L1101-A1106 WeakPolarHBondContact O-CB 3.42Å; L1101-A1106 PolarHBondContact O-N 3.47Å; L1101-I1109 HydrophobicContact CB-CD1 3.71Å; L1101-I1109 HydrophobicContact CD1-CD1 4.44Å; L1101-P1315 HydrophobicContact CB-CG 4.38Å; L1101-P1315 VanDerWaalsContact CD2-CD 3.4Å; L1101-P1315 HydrophobicContact CD2-CG 3.63Å
1102	M	93.7	Very high	92.7	Very high	52 Å²	52	36.5 Å²	36.5	26%	0.256	21%	0.208	S	C	.	.	H	α-helix	trans	-62.1	-44.7	170	-68.5	-56.7	-62.6	0	0	111.7	A1098 K1100 E1104 G1105 A1106 I1109 I1144	A1098-M1102 WeakPolarHBondContact O-CG 3.46Å; A1098-M1102 PolarHBondContact O-N 2.95Å; K1100-M1102 VanDerWaalsContact C-N 3.34Å; K1100-M1102 PolarHBondContact O-N 2.94Å; M1102-E1104 VanDerWaalsContact C-N 3.29Å; M1102-E1104 PolarHBondContact O-N 3.4Å; M1102-G1105 WeakPolarHBondContact O-CA 3.13Å; M1102-G1105 PolarHBondContact O-N 2.98Å; M1102-A1106 VanDerWaalsContact CE-O 3.24Å; M1102-A1106 WeakPolarHBondContact CE-O 3.37Å; M1102-A1106 HydrophobicContact SD-CB 4.2Å; M1102-A1106 VanDerWaalsContact SD-O 3.38Å; M1102-I1109 HydrophobicContact CG-CD1 3.89Å; M1102-I1109 HydrophobicContact CG-CG1 3.78Å; M1102-I1109 HydrophobicContact SD-CD1 3.84Å; M1102-I1109 HydrophobicContact SD-CG1 3.7Å; M1102-I1144 HydrophobicContact CE-CG2 4.42Å; M1102-I1144 HydrophobicContact CG-CD1 4Å; M1102-I1144 HydrophobicContact CG-CG1 4.18Å; M1102-I1144 HydrophobicContact CG-CG2 3.96Å; M1102-I1144 HydrophobicContact SD-CG2 3.9Å
1103	A	90.9	Very high	92.7	Very high	90 Å²	90	30.3 Å²	30.3	74%	0.744	18%	0.175	S	C	*	.	H	α-helix	trans	-68.3	-26.7	176.5	0	0	0	0	0	113.5	R1099 K1100	R1099-A1103 WeakPolarHBondContact O-CB 3.28Å; R1099-A1103 PolarHBondContact O-N 3.29Å; K1100-A1103 CarbonylContact O-C 3.48Å; K1100-A1103 PolarHBondContact O-N 2.81Å; K1100-A1103 VanDerWaalsContact O-N 3.11Å
1104	E	92.7	Very high	92.7	Very high	52 Å²	52	29.4 Å²	29.4	24%	0.243	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	0.6	169.5	-76.1	-179.7	165.5	0	0	112.8	K1100 L1101 M1102 P1315 R1316	K1100-E1104 WeakPolarHBondContact CE-OE1 3.46Å; K1100-E1104 VanDerWaalsContact CE-OE2 3.27Å; K1100-E1104 WeakPolarHBondContact CE-OE2 3.33Å; K1100-E1104 HydrophobicContact CG-CG 4.4Å; K1100-E1104 IonicContact NZ-OE1 2.72Å; K1100-E1104 IonicContact NZ-OE2 3.66Å; K1100-E1104 WeakPolarHBondContact O-CB 3.15Å; K1100-E1104 WeakPolarHBondContact O-CG 3.3Å; K1100-E1104 PolarHBondContact O-N 3.28Å; L1101-E1104 CarbonylContact O-C 3.58Å; L1101-E1104 PolarHBondContact O-N 2.99Å; M1102-E1104 VanDerWaalsContact C-N 3.29Å; M1102-E1104 PolarHBondContact O-N 3.4Å; E1104-P1315 HydrophobicContact CB-CG 3.98Å; E1104-P1315 CarbonylContact O-C 3.59Å; E1104-R1316 HydrophobicContact CB-CB 3.82Å; E1104-R1316 HydrophobicContact CG-CB 4.08Å; E1104-R1316 VanDerWaalsContact O-CA 3.3Å; E1104-R1316 WeakPolarHBondContact O-CA 3.35Å; E1104-R1316 PolarHBondContact O-N 2.76Å
1105	G	90.7	Very high	92.4	Very high	19 Å²	19	30.4 Å²	30.4	20%	0.196	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.3	19.2	166.6	0	0	0	0	0	116.1	L1101 M1102 R1319	L1101-G1105 PolarHBondContact O-N 3.38Å; L1101-G1105 VanDerWaalsContact O-N 3.07Å; M1102-G1105 WeakPolarHBondContact O-CA 3.13Å; M1102-G1105 PolarHBondContact O-N 2.98Å; G1105-R1319 PolarHBondContact O-NE 3.11Å; G1105-R1319 PolarHBondContact O-NH2 2.81Å
1106	A	94.2	Very high	91.9	Very high	4 Å²	4	30.7 Å²	30.7	3%	0.033	18%	0.178	C	C	.	.			trans	-63.6	147	162.9	0	0	0	0	0	111.1	L1101 M1102 I1109 P1315	L1101-A1106 HydrophobicContact CB-CB 4.41Å; L1101-A1106 WeakPolarHBondContact O-CB 3.42Å; L1101-A1106 PolarHBondContact O-N 3.47Å; M1102-A1106 VanDerWaalsContact CE-O 3.24Å; M1102-A1106 WeakPolarHBondContact CE-O 3.37Å; M1102-A1106 HydrophobicContact SD-CB 4.2Å; M1102-A1106 VanDerWaalsContact SD-O 3.38Å; A1106-I1109 HydrophobicContact CB-CD1 4.19Å; A1106-P1315 HydrophobicContact CB-CB 4.26Å; A1106-P1315 HydrophobicContact CB-CG 4.38Å
1107	D	94.6	Very high	91.3	Very high	55 Å²	55	29.1 Å²	29.1	29%	0.294	16%	0.161	S	C	.	.	S	Bend	trans	-95.9	-26.8	174.2	-60.8	-70.5	0	0	0	112	I1070 I1071 P1145 R1319	I1070-D1107 WeakPolarHBondContact CA-OD2 3.31Å; I1070-D1107 HydrophobicContact CG2-CB 3.76Å; I1071-D1107 PolarHBondContact N-OD2 3.48Å; I1071-D1107 PolarHBondContact O-N 3.37Å; D1107-P1145 WeakPolarHBondContact O-CG 3.41Å; D1107-R1319 IonicContact OD1-CZ 3.43Å; D1107-R1319 IonicContact OD1-NH2 3.3Å; D1107-R1319 PolarHBondContact OD1-NH2 3.33Å; D1107-R1319 IonicContact OD2-CZ 2.7Å; D1107-R1319 IonicContact OD2-NH1 3.05Å; D1107-R1319 IonicContact OD2-NH2 2.71Å; D1107-R1319 PolarHBondContact OD2-NH2 3.35Å
1108	V	95.1	Very high	90.6	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.03	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	138.7	-178.6	-175.4	0	0	0	0	107.9	I1070 I1071 F1072 G1073 P1145 Y1166	I1070-V1108 HydrophobicContact CG2-CG2 3.96Å; I1071-V1108 PolarHBondContact O-N 2.87Å; F1072-V1108 CarbonylContact C-O 3.26Å; F1072-V1108 WeakPolarHBondContact CA-O 3.26Å; F1072-V1108 HydrophobicContact CD1-CG1 4.39Å; F1072-V1108 HydrophobicContact CD2-CB 3.73Å; F1072-V1108 HydrophobicContact CD2-CG1 4.29Å; F1072-V1108 HydrophobicContact CD2-CG2 3.98Å; F1072-V1108 HydrophobicContact CE1-CG1 4.2Å; F1072-V1108 HydrophobicContact CE2-CB 3.76Å; F1072-V1108 HydrophobicContact CE2-CG1 4.07Å; F1072-V1108 HydrophobicContact CE2-CG2 3.61Å; F1072-V1108 HydrophobicContact CG-CB 4.16Å; F1072-V1108 HydrophobicContact CG-CG1 4.43Å; F1072-V1108 HydrophobicContact CZ-CB 4.25Å; F1072-V1108 HydrophobicContact CZ-CG1 4.03Å; F1072-V1108 HydrophobicContact CZ-CG2 4.25Å; G1073-V1108 PolarHBondContact N-O 3.43Å; V1108-P1145 WeakPolarHBondContact CA-O 3.18Å; V1108-P1145 HydrophobicContact CG1-CB 4.45Å; V1108-P1145 WeakPolarHBondContact CG1-O 3.16Å; V1108-P1145 HydrophobicContact CG2-CB 4.21Å; V1108-Y1166 HydrophobicContact CG1-CD2 3.94Å; V1108-Y1166 HydrophobicContact CG1-CE2 4.18Å; V1108-Y1166 HydrophobicContact CG2-CD2 4.34Å; V1108-Y1166 HydrophobicContact CG2-CE2 3.74Å
1109	I	96.9	Very high	90.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	129.3	168.6	-63.3	-56.4	0	0	0	109.4	V1075 A1098 L1101 M1102 A1106 L1111 L1139 I1144 P1145 V1146 S1147	V1075-I1109 HydrophobicContact CB-CG2 4.39Å; V1075-I1109 HydrophobicContact CG2-CG2 3.86Å; A1098-I1109 HydrophobicContact CB-CD1 4.45Å; A1098-I1109 HydrophobicContact CB-CG1 4.13Å; A1098-I1109 HydrophobicContact CB-CG2 3.87Å; A1098-I1109 WeakPolarHBondContact O-CD1 3.31Å; L1101-I1109 HydrophobicContact CB-CD1 3.71Å; L1101-I1109 HydrophobicContact CD1-CD1 4.44Å; M1102-I1109 HydrophobicContact CG-CD1 3.89Å; M1102-I1109 HydrophobicContact CG-CG1 3.78Å; M1102-I1109 HydrophobicContact SD-CD1 3.84Å; M1102-I1109 HydrophobicContact SD-CG1 3.7Å; A1106-I1109 HydrophobicContact CB-CD1 4.19Å; I1109-L1111 HydrophobicContact CG2-CD2 3.79Å; I1109-L1111 HydrophobicContact CG2-CG 4.45Å; I1109-L1139 HydrophobicContact CB-CD1 4.47Å; I1109-L1139 HydrophobicContact CG2-CD1 4.04Å; I1109-I1144 HydrophobicContact CB-CG2 4.27Å; I1109-I1144 HydrophobicContact CG1-CG2 3.82Å; I1109-P1145 PolarHBondContact N-O 3.38Å; I1109-V1146 CarbonylContact O-C 3.44Å; I1109-V1146 WeakPolarHBondContact O-CA 3.5Å; I1109-S1147 PolarHBondContact O-N 2.85Å
1110	D	95.3	Very high	89.2	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	108.6	-178.5	-172.5	69.6	0	0	0	109.9	F1072 G1073 V1075 S1147 R1311	F1072-D1110 HydrophobicContact CB-CB 4.41Å; F1072-D1110 HydrophobicContact CD1-CB 4Å; G1073-D1110 PolarHBondContact O-N 3.26Å; V1075-D1110 PolarHBondContact N-O 2.72Å; D1110-S1147 WeakPolarHBondContact OD1-CB 3.44Å; D1110-S1147 PolarHBondContact OD1-OG 2.6Å; D1110-R1311 IonicContact OD2-CZ 3.77Å; D1110-R1311 IonicContact OD2-NE 3.23Å; D1110-R1311 PolarHBondContact OD2-NE 2.91Å; D1110-R1311 IonicContact OD2-NH2 3.77Å; D1110-R1311 PolarHBondContact OD2-NH2 2.97Å
1111	L	94	Very high	88.6	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	118.5	-176.2	-60.1	-176.8	0	0	0	110.2	V1075 I1077 I1109 P1113 V1135 L1139 V1146 S1147 D1149	V1075-L1111 HydrophobicContact CB-CD2 4.01Å; V1075-L1111 HydrophobicContact CG1-CD2 4.29Å; I1077-L1111 HydrophobicContact CD1-CD2 4.44Å; I1109-L1111 HydrophobicContact CG2-CD2 3.79Å; I1109-L1111 HydrophobicContact CG2-CG 4.45Å; L1111-P1113 WeakPolarHBondContact O-CD 3.18Å; L1111-V1135 HydrophobicContact CD1-CG1 4.1Å; L1111-V1135 HydrophobicContact CD2-CG1 3.99Å; L1111-L1139 HydrophobicContact CD1-CD1 4.4Å; L1111-L1139 HydrophobicContact CD2-CD1 4.13Å; L1111-V1146 HydrophobicContact CD1-CG1 3.82Å; L1111-V1146 HydrophobicContact CG-CG1 3.95Å; L1111-S1147 PolarHBondContact N-O 3.06Å; L1111-D1149 PolarHBondContact O-N 2.86Å
1112	G	90.2	Very high	87.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	102.4	172.6	0	0	0	0	0	111.5	V1075 N1076 I1077 T1078	V1075-G1112 PolarHBondContact O-N 2.78Å; N1076-G1112 CarbonylContact C-O 3.53Å; I1077-G1112 PolarHBondContact N-O 2.85Å; T1078-G1112 WeakPolarHBondContact CG2-O 3.46Å
1113	P	89.6	Confident	87.6	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-86.4	-12.3	-179.7	33.5	-35.6	0	0	0	114.8	L1111 E1128 R1131 I1132 L1148 D1149	L1111-P1113 WeakPolarHBondContact O-CD 3.18Å; P1113-E1128 HydrophobicContact CB-CB 4.01Å; P1113-E1128 HydrophobicContact CB-CG 4.16Å; P1113-E1128 HydrophobicContact CG-CB 3.78Å; P1113-E1128 HydrophobicContact CG-CG 3.87Å; P1113-R1131 HydrophobicContact CB-CB 4Å; P1113-R1131 VanDerWaalsContact O-CD 3.3Å; P1113-R1131 WeakPolarHBondContact O-CD 3.43Å; P1113-R1131 PolarHBondContact O-NH1 2.82Å; P1113-I1132 HydrophobicContact CB-CG2 3.6Å; P1113-I1132 HydrophobicContact CG-CG2 3.68Å; P1113-L1148 HydrophobicContact CG-CD1 4.18Å; P1113-D1149 WeakPolarHBondContact CD-O 3.23Å
1114	A	87.9	Confident	87.6	Confident	15 Å²	15	29 Å²	29	12%	0.124	19%	0.187	C	C	.	.	S	Bend	trans	-124.6	157.7	169.6	0	0	0	0	0	109	T1078 V1123 E1128	T1078-A1114 VanDerWaalsContact CG2-C 3.42Å; A1114-V1123 HydrophobicContact CB-CB 3.94Å; A1114-V1123 HydrophobicContact CB-CG2 3.87Å; A1114-E1128 HydrophobicContact CB-CG 4.22Å; A1114-E1128 VanDerWaalsContact CB-OE1 3.27Å; A1114-E1128 WeakPolarHBondContact CB-OE1 3.34Å
1115	S	83.7	Confident	87.5	Confident	22 Å²	22	27.7 Å²	27.7	15%	0.154	18%	0.183	C	C	.	.			trans	-104.1	128.2	176.4	-162.1	0	0	0	0	110.6	N1117 A1120 Q1199	S1115-N1117 VanDerWaalsContact C-N 3.25Å; S1115-N1117 PolarHBondContact O-N 3.18Å; S1115-N1117 PolarHBondContact OG-ND2 3.19Å; S1115-A1120 WeakPolarHBondContact O-CB 3.46Å; S1115-Q1199 PolarHBondContact O-NE2 3.24Å; S1115-Q1199 VanDerWaalsContact O-NE2 3.12Å
1116	S	81.2	Confident	87.6	Confident	21 Å²	21	32.4 Å²	32.4	15%	0.147	20%	0.204	C	C	.	.			trans	-89.9	17.1	178.6	51.8	0	0	0	0	113.2	A1200	S1116-A1200 PolarHBondContact O-N 3.48Å
1117	N	80.1	Confident	87.4	Confident	26 Å²	26	35 Å²	35	14%	0.139	22%	0.22	C	C	.	.	S	Bend	trans	-83.4	157.4	-179.3	90.8	67.8	0	0	0	112.5	D1080 S1115 D1119 A1120	D1080-N1117 PolarHBondContact O-ND2 2.85Å; S1115-N1117 VanDerWaalsContact C-N 3.25Å; S1115-N1117 PolarHBondContact O-N 3.18Å; S1115-N1117 PolarHBondContact OG-ND2 3.19Å; N1117-D1119 PolarHBondContact O-N 2.84Å; N1117-D1119 PolarHBondContact OD1-N 3.39Å; N1117-A1120 WeakPolarHBondContact O-CB 3.44Å; N1117-A1120 PolarHBondContact O-N 2.96Å
1118	P	78.1	Confident	87.4	Confident	36 Å²	36	32.4 Å²	32.4	23%	0.234	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-6.5	-172.8	-24	35.4	0	0	0	118	A1200 R1202 F1243	P1118-A1200 WeakPolarHBondContact CA-O 3.48Å; P1118-A1200 WeakPolarHBondContact CB-O 3.44Å; P1118-A1200 HydrophobicContact CG-CB 4.15Å; P1118-A1200 WeakPolarHBondContact CG-O 3.46Å; P1118-R1202 HydrophobicContact CB-CG 4.37Å; P1118-F1243 HydrophobicContact CG-CB 4.16Å; P1118-F1243 HydrophobicContact CG-CD2 3.84Å; P1118-F1243 HydrophobicContact CG-CE2 4.49Å; P1118-F1243 HydrophobicContact CG-CG 4.11Å
1119	D	80.8	Confident	87.3	Confident	88 Å²	88	33.9 Å²	33.9	47%	0.471	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	6.6	-177.4	-51.1	-53.4	0	0	0	112.3	N1117 R1202	N1117-D1119 PolarHBondContact O-N 2.84Å; N1117-D1119 PolarHBondContact OD1-N 3.39Å; D1119-R1202 IonicContact OD1-CZ 3.34Å; D1119-R1202 VanDerWaalsContact OD1-CZ 3.23Å; D1119-R1202 IonicContact OD1-NH1 3.96Å; D1119-R1202 PolarHBondContact OD1-NH1 3.41Å; D1119-R1202 IonicContact OD1-NH2 3.18Å; D1119-R1202 PolarHBondContact OD1-NH2 3.12Å; D1119-R1202 IonicContact OD2-CZ 3.52Å; D1119-R1202 IonicContact OD2-NH1 3.03Å; D1119-R1202 IonicContact OD2-NH2 3.21Å; D1119-R1202 PolarHBondContact OD2-NH2 3.37Å
1120	A	76.3	Confident	87	Confident	11 Å²	11	37.2 Å²	37.2	9%	0.091	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-87.4	138.2	-172.3	0	0	0	0	0	113.7	S1115 N1117 Q1199	S1115-A1120 WeakPolarHBondContact O-CB 3.46Å; N1117-A1120 WeakPolarHBondContact O-CB 3.44Å; N1117-A1120 PolarHBondContact O-N 2.96Å; A1120-Q1199 PolarHBondContact O-NE2 2.83Å
1121	A	79.9	Confident	86.8	Confident	57 Å²	57	39.8 Å²	39.8	47%	0.471	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-69.5	142.3	177	0	0	0	0	0	112.1	D1080	D1080-A1121 PolarHBondContact OD2-N 2.89Å; D1080-A1121 VanDerWaalsContact OD2-N 3.12Å
1122	P	80.5	Confident	86.8	Confident	112 Å²	112	39.8 Å²	39.8	73%	0.727	25%	0.25	S	S	*	.	P	Polyproline II helix	trans	-59	138.2	170.7	-25	35	0	0	0	112.2
1123	V	86.4	Confident	86.9	Confident	27 Å²	27	40.8 Å²	40.8	16%	0.164	26%	0.259	C	S	.	.			trans	-118	137.1	-178	-175.2	0	0	0	0	109.1	A1114 T1127 E1128 Q1152	A1114-V1123 HydrophobicContact CB-CB 3.94Å; A1114-V1123 HydrophobicContact CB-CG2 3.87Å; V1123-T1127 HydrophobicContact CG1-CG2 3.67Å; V1123-E1128 HydrophobicContact CB-CG 4.44Å; V1123-E1128 HydrophobicContact CG1-CG 3.89Å; V1123-Q1152 PolarHBondContact O-NE2 3.24Å
1124	S	90.6	Very high	87	Confident	57 Å²	57	43.5 Å²	43.5	40%	0.399	28%	0.276	S	S	.	.			trans	-75.6	151.9	174.7	65.8	0	0	0	0	112	D1126 T1127 E1128	S1124-D1126 PolarHBondContact O-N 3.02Å; S1124-D1126 VanDerWaalsContact O-N 3.17Å; S1124-T1127 WeakPolarHBondContact O-CA 3.23Å; S1124-T1127 WeakPolarHBondContact O-CB 3.49Å; S1124-T1127 PolarHBondContact O-N 3.47Å; S1124-T1127 PolarHBondContact OG-N 2.84Å; S1124-T1127 PolarHBondContact OG-OG1 2.87Å; S1124-E1128 PolarHBondContact O-N 3.19Å
1125	S	91	Very high	87.3	Confident	25 Å²	25	42.8 Å²	42.8	18%	0.175	27%	0.27	C	S	.	.	H	α-helix	trans	-49.1	-40.9	172.5	52.2	0	0	0	0	112.7	T1127 E1128 I1129	S1125-T1127 VanDerWaalsContact C-N 3.3Å; S1125-T1127 PolarHBondContact O-N 3Å; S1125-E1128 PolarHBondContact O-N 2.99Å; S1125-I1129 WeakPolarHBondContact O-CB 3.33Å; S1125-I1129 VanDerWaalsContact O-CG1 3.23Å; S1125-I1129 WeakPolarHBondContact O-CG1 3.43Å; S1125-I1129 PolarHBondContact O-N 2.89Å
1126	D	92.3	Very high	87.7	Confident	118 Å²	118	41.8 Å²	41.8	63%	0.631	26%	0.264	S	S	*	.	H	α-helix	trans	-68.5	-34.7	-177.2	-50	-18	0	0	0	111	S1124 A1130	S1124-D1126 PolarHBondContact O-N 3.02Å; S1124-D1126 VanDerWaalsContact O-N 3.17Å; D1126-A1130 VanDerWaalsContact O-CB 3.27Å; D1126-A1130 WeakPolarHBondContact O-CB 3.34Å; D1126-A1130 PolarHBondContact O-N 3.43Å
1127	T	91.5	Very high	88.1	Confident	58 Å²	58	43.9 Å²	43.9	36%	0.356	27%	0.273	S	S	.	.	H	α-helix	trans	-71.5	-38.1	173.2	-53.1	0	0	0	0	111.3	V1123 S1124 S1125 R1131	V1123-T1127 HydrophobicContact CG1-CG2 3.67Å; S1124-T1127 WeakPolarHBondContact O-CA 3.23Å; S1124-T1127 WeakPolarHBondContact O-CB 3.49Å; S1124-T1127 PolarHBondContact O-N 3.47Å; S1124-T1127 PolarHBondContact OG-N 2.84Å; S1124-T1127 PolarHBondContact OG-OG1 2.87Å; S1125-T1127 VanDerWaalsContact C-N 3.3Å; S1125-T1127 PolarHBondContact O-N 3Å; T1127-R1131 WeakPolarHBondContact O-CB 3.32Å; T1127-R1131 WeakPolarHBondContact O-CD 3.17Å; T1127-R1131 VanDerWaalsContact O-CG 3.24Å; T1127-R1131 WeakPolarHBondContact O-CG 3.36Å; T1127-R1131 PolarHBondContact O-N 3.42Å
1128	E	93.1	Very high	88.7	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-63.8	-46.3	173.2	-69.4	-173.7	179.7	0	0	111.6	P1113 A1114 V1123 S1124 S1125 R1131 I1132 S1150 Q1152 T1155	P1113-E1128 HydrophobicContact CB-CB 4.01Å; P1113-E1128 HydrophobicContact CB-CG 4.16Å; P1113-E1128 HydrophobicContact CG-CB 3.78Å; P1113-E1128 HydrophobicContact CG-CG 3.87Å; A1114-E1128 HydrophobicContact CB-CG 4.22Å; A1114-E1128 VanDerWaalsContact CB-OE1 3.27Å; A1114-E1128 WeakPolarHBondContact CB-OE1 3.34Å; V1123-E1128 HydrophobicContact CB-CG 4.44Å; V1123-E1128 HydrophobicContact CG1-CG 3.89Å; S1124-E1128 PolarHBondContact O-N 3.19Å; S1125-E1128 PolarHBondContact O-N 2.99Å; E1128-R1131 WeakPolarHBondContact O-CB 3.32Å; E1128-R1131 PolarHBondContact O-N 2.85Å; E1128-I1132 WeakPolarHBondContact O-CG1 3.4Å; E1128-I1132 PolarHBondContact O-N 2.95Å; E1128-S1150 WeakPolarHBondContact OE2-CB 3.25Å; E1128-S1150 PolarHBondContact OE2-OG 3.32Å; E1128-Q1152 PolarHBondContact OE1-NE2 3.48Å; E1128-T1155 HydrophobicContact CB-CG2 3.69Å; E1128-T1155 WeakPolarHBondContact OE2-CB 3.42Å; E1128-T1155 VanDerWaalsContact OE2-CG2 3.29Å; E1128-T1155 WeakPolarHBondContact OE2-CG2 3.43Å; E1128-T1155 PolarHBondContact OE2-OG1 2.8Å
1129	I	93.5	Very high	89.4	Confident	37 Å²	37	42 Å²	42	19%	0.19	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-46.2	177.5	-70.4	166.6	0	0	0	110.4	S1125 R1131 I1132 A1133 T1155 Y1158	S1125-I1129 WeakPolarHBondContact O-CB 3.33Å; S1125-I1129 VanDerWaalsContact O-CG1 3.23Å; S1125-I1129 WeakPolarHBondContact O-CG1 3.43Å; S1125-I1129 PolarHBondContact O-N 2.89Å; I1129-R1131 VanDerWaalsContact C-N 3.27Å; I1129-R1131 PolarHBondContact O-N 2.87Å; I1129-I1132 PolarHBondContact O-N 3.21Å; I1129-A1133 VanDerWaalsContact O-CB 3.23Å; I1129-A1133 WeakPolarHBondContact O-CB 3.42Å; I1129-A1133 PolarHBondContact O-N 3Å; I1129-T1155 HydrophobicContact CG1-CG2 4.16Å; I1129-Y1158 HydrophobicContact CD1-CG 4.31Å; I1129-Y1158 HydrophobicContact CG1-CD1 4.29Å; I1129-Y1158 HydrophobicContact CG1-CG 4.02Å; I1129-Y1158 HydrophobicContact CG2-CD1 4.11Å; I1129-Y1158 HydrophobicContact CG2-CD2 3.85Å; I1129-Y1158 HydrophobicContact CG2-CE1 4.18Å; I1129-Y1158 HydrophobicContact CG2-CE2 3.92Å; I1129-Y1158 HydrophobicContact CG2-CG 3.96Å
1130	A	91.3	Very high	89.9	Confident	70 Å²	70	41.3 Å²	41.3	58%	0.579	26%	0.257	S	S	*	.	H	α-helix	trans	-61.4	-33.8	176.4	0	0	0	0	0	113.1	D1126	D1126-A1130 VanDerWaalsContact O-CB 3.27Å; D1126-A1130 WeakPolarHBondContact O-CB 3.34Å; D1126-A1130 PolarHBondContact O-N 3.43Å
1131	R	91.4	Very high	90.5	Very high	53 Å²	53	45 Å²	45	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-71.5	-44.6	175.3	-76.8	168.4	176.8	-174	3	112.5	I1077 P1113 T1127 E1128 I1129	I1077-R1131 HydrophobicContact CB-CB 4.49Å; I1077-R1131 HydrophobicContact CG2-CB 3.85Å; I1077-R1131 HydrophobicContact CG2-CG 4.13Å; I1077-R1131 WeakPolarHBondContact O-CD 3.3Å; P1113-R1131 HydrophobicContact CB-CB 4Å; P1113-R1131 VanDerWaalsContact O-CD 3.3Å; P1113-R1131 WeakPolarHBondContact O-CD 3.43Å; P1113-R1131 PolarHBondContact O-NH1 2.82Å; T1127-R1131 WeakPolarHBondContact O-CB 3.32Å; T1127-R1131 WeakPolarHBondContact O-CD 3.17Å; T1127-R1131 VanDerWaalsContact O-CG 3.24Å; T1127-R1131 WeakPolarHBondContact O-CG 3.36Å; T1127-R1131 PolarHBondContact O-N 3.42Å; E1128-R1131 WeakPolarHBondContact O-CB 3.32Å; E1128-R1131 PolarHBondContact O-N 2.85Å; I1129-R1131 VanDerWaalsContact C-N 3.27Å; I1129-R1131 PolarHBondContact O-N 2.87Å
1132	I	93.6	Very high	91	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-81.8	-33.1	-176.8	67	-175.1	0	0	0	113.9	P1113 E1128 I1129 V1135 L1136 L1148 T1155 Y1158	P1113-I1132 HydrophobicContact CB-CG2 3.6Å; P1113-I1132 HydrophobicContact CG-CG2 3.68Å; E1128-I1132 WeakPolarHBondContact O-CG1 3.4Å; E1128-I1132 PolarHBondContact O-N 2.95Å; I1129-I1132 PolarHBondContact O-N 3.21Å; I1132-V1135 PolarHBondContact O-N 3.45Å; I1132-V1135 VanDerWaalsContact O-N 3.09Å; I1132-L1136 VanDerWaalsContact O-CB 3.24Å; I1132-L1136 WeakPolarHBondContact O-CB 3.2Å; I1132-L1136 PolarHBondContact O-N 3.43Å; I1132-L1148 HydrophobicContact CD1-CD1 3.82Å; I1132-L1148 HydrophobicContact CD1-CD2 4.32Å; I1132-L1148 HydrophobicContact CG2-CD1 3.94Å; I1132-T1155 HydrophobicContact CD1-CG2 3.72Å; I1132-Y1158 HydrophobicContact CD1-CD1 4.01Å; I1132-Y1158 HydrophobicContact CD1-CE1 4.39Å; I1132-Y1158 HydrophobicContact CG1-CD1 4.33Å; I1132-Y1158 HydrophobicContact CG1-CE1 4.25Å
1133	A	92.4	Very high	91.5	Very high	21 Å²	21	43 Å²	43	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-49	-56.2	-170.2	0	0	0	0	0	114.8	I1129 V1135 L1136 D1137 Y1158	I1129-A1133 VanDerWaalsContact O-CB 3.23Å; I1129-A1133 WeakPolarHBondContact O-CB 3.42Å; I1129-A1133 PolarHBondContact O-N 3Å; A1133-V1135 VanDerWaalsContact C-N 3.32Å; A1133-V1135 PolarHBondContact O-N 3.13Å; A1133-L1136 PolarHBondContact O-N 3.31Å; A1133-D1137 WeakPolarHBondContact O-CB 3.38Å; A1133-D1137 PolarHBondContact O-N 2.86Å; A1133-Y1158 HydrophobicContact CB-CE1 4.3Å; A1133-Y1158 VanDerWaalsContact CB-OH 3.27Å; A1133-Y1158 WeakPolarHBondContact CB-OH 3.23Å
1134	P	91.7	Very high	91.8	Very high	57 Å²	57	42.6 Å²	42.6	37%	0.37	27%	0.274	S	S	.	.	H	α-helix	trans	-67.8	-30.2	-178.8	27.5	-35.5	0	0	0	113.2	P1091 A1138	P1091-P1134 HydrophobicContact CB-CB 3.99Å; P1091-P1134 HydrophobicContact CB-CG 3.83Å; P1091-P1134 HydrophobicContact CG-CB 4.18Å; P1091-P1134 HydrophobicContact CG-CG 3.6Å; P1134-A1138 WeakPolarHBondContact O-CB 3.4Å; P1134-A1138 PolarHBondContact O-N 3.02Å
1135	V	93	Very high	92	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-76.3	-42.9	179.3	-177.5	0	0	0	0	110.7	I1077 P1091 A1094 I1095 L1111 I1132 A1133 A1138 L1139	I1077-V1135 HydrophobicContact CD1-CB 4.16Å; I1077-V1135 HydrophobicContact CD1-CG1 4.29Å; I1077-V1135 HydrophobicContact CD1-CG2 3.86Å; P1091-V1135 HydrophobicContact CB-CG2 4.08Å; A1094-V1135 HydrophobicContact CB-CG1 4.13Å; A1094-V1135 HydrophobicContact CB-CG2 3.75Å; I1095-V1135 HydrophobicContact CG1-CB 4.33Å; I1095-V1135 HydrophobicContact CG1-CG1 4.06Å; I1095-V1135 HydrophobicContact CG1-CG2 4.31Å; L1111-V1135 HydrophobicContact CD1-CG1 4.1Å; L1111-V1135 HydrophobicContact CD2-CG1 3.99Å; I1132-V1135 PolarHBondContact O-N 3.45Å; I1132-V1135 VanDerWaalsContact O-N 3.09Å; A1133-V1135 VanDerWaalsContact C-N 3.32Å; A1133-V1135 PolarHBondContact O-N 3.13Å; V1135-A1138 PolarHBondContact O-N 3.04Å; V1135-L1139 HydrophobicContact CG1-CD1 3.9Å; V1135-L1139 HydrophobicContact CG1-CG 4.33Å; V1135-L1139 WeakPolarHBondContact O-CB 3.33Å; V1135-L1139 VanDerWaalsContact O-CG 3.28Å; V1135-L1139 WeakPolarHBondContact O-CG 3.25Å; V1135-L1139 PolarHBondContact O-N 2.95Å
1136	L	92.8	Very high	92.2	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-44.6	-180	179.2	55.6	0	0	0	111.3	I1132 A1133 A1138 L1139 K1140 V1146 Y1158 A1159 R1162 V1164	I1132-L1136 VanDerWaalsContact O-CB 3.24Å; I1132-L1136 WeakPolarHBondContact O-CB 3.2Å; I1132-L1136 PolarHBondContact O-N 3.43Å; A1133-L1136 PolarHBondContact O-N 3.31Å; L1136-A1138 VanDerWaalsContact C-N 3.33Å; L1136-A1138 PolarHBondContact O-N 2.74Å; L1136-L1139 PolarHBondContact O-N 3.25Å; L1136-K1140 HydrophobicContact CD1-CG 4.11Å; L1136-K1140 VanDerWaalsContact O-CB 3.3Å; L1136-K1140 WeakPolarHBondContact O-CB 3.49Å; L1136-K1140 VanDerWaalsContact O-CG 3.25Å; L1136-K1140 WeakPolarHBondContact O-CG 3.45Å; L1136-K1140 PolarHBondContact O-N 3.35Å; L1136-V1146 HydrophobicContact CD1-CB 4.1Å; L1136-V1146 HydrophobicContact CD1-CG1 3.88Å; L1136-V1146 HydrophobicContact CD1-CG2 4.21Å; L1136-Y1158 HydrophobicContact CD2-CE1 4.35Å; L1136-A1159 HydrophobicContact CD2-CB 4.49Å; L1136-R1162 HydrophobicContact CD2-CB 3.68Å; L1136-R1162 HydrophobicContact CD2-CG 3.89Å; L1136-R1162 HydrophobicContact CG-CB 4.12Å; L1136-R1162 HydrophobicContact CG-CG 4.41Å; L1136-V1164 HydrophobicContact CD1-CG1 3.79Å; L1136-V1164 HydrophobicContact CD2-CG1 4.24Å
1137	D	90.8	Very high	92.4	Very high	65 Å²	65	35.5 Å²	35.5	35%	0.348	23%	0.233	S	C	.	.	H	α-helix	trans	-63.3	-39.3	177.4	-71.6	-10.6	0	0	0	111.5	A1133 A1141 R1162	A1133-D1137 WeakPolarHBondContact O-CB 3.38Å; A1133-D1137 PolarHBondContact O-N 2.86Å; D1137-A1141 PolarHBondContact O-N 3.46Å; D1137-R1162 IonicContact OD1-CZ 3.97Å; D1137-R1162 IonicContact OD1-NE 3.79Å; D1137-R1162 PolarHBondContact OD1-NE 2.71Å; D1137-R1162 IonicContact OD1-NH2 3.27Å; D1137-R1162 PolarHBondContact OD1-NH2 3.16Å; D1137-R1162 IonicContact OD2-CZ 2.9Å; D1137-R1162 IonicContact OD2-NE 3.63Å; D1137-R1162 IonicContact OD2-NH2 2.73Å; D1137-R1162 PolarHBondContact OD2-NH2 3.31Å
1138	A	92.3	Very high	92.6	Very high	23 Å²	23	33 Å²	33	19%	0.19	22%	0.217	C	C	.	.	H	α-helix	trans	-67.3	-48	175.3	0	0	0	0	0	113.1	I1095 P1134 V1135 L1136 K1140 A1141 D1142	I1095-A1138 HydrophobicContact CD1-CB 3.51Å; I1095-A1138 HydrophobicContact CG1-CB 3.9Å; I1095-A1138 HydrophobicContact CG2-CB 4.4Å; P1134-A1138 WeakPolarHBondContact O-CB 3.4Å; P1134-A1138 PolarHBondContact O-N 3.02Å; V1135-A1138 PolarHBondContact O-N 3.04Å; L1136-A1138 VanDerWaalsContact C-N 3.33Å; L1136-A1138 PolarHBondContact O-N 2.74Å; A1138-K1140 PolarHBondContact O-N 2.8Å; A1138-A1141 WeakPolarHBondContact O-CB 3.38Å; A1138-A1141 PolarHBondContact O-N 2.6Å; A1138-A1141 VanDerWaalsContact O-N 3.12Å; A1138-D1142 PolarHBondContact O-N 3.14Å
1139	L	93.2	Very high	92.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.2	-28.1	178	-65.6	178.1	0	0	0	112.2	A1098 I1109 L1111 V1135 L1136 D1142 G1143 I1144 V1146	A1098-L1139 HydrophobicContact CB-CD1 3.8Å; A1098-L1139 HydrophobicContact CB-CD2 3.6Å; A1098-L1139 HydrophobicContact CB-CG 4.31Å; I1109-L1139 HydrophobicContact CB-CD1 4.47Å; I1109-L1139 HydrophobicContact CG2-CD1 4.04Å; L1111-L1139 HydrophobicContact CD1-CD1 4.4Å; L1111-L1139 HydrophobicContact CD2-CD1 4.13Å; V1135-L1139 HydrophobicContact CG1-CD1 3.9Å; V1135-L1139 HydrophobicContact CG1-CG 4.33Å; V1135-L1139 WeakPolarHBondContact O-CB 3.33Å; V1135-L1139 VanDerWaalsContact O-CG 3.28Å; V1135-L1139 WeakPolarHBondContact O-CG 3.25Å; V1135-L1139 PolarHBondContact O-N 2.95Å; L1136-L1139 PolarHBondContact O-N 3.25Å; L1139-D1142 PolarHBondContact O-N 2.88Å; L1139-G1143 PolarHBondContact O-N 2.82Å; L1139-I1144 HydrophobicContact CB-CB 4.33Å; L1139-I1144 HydrophobicContact CD2-CD1 3.63Å; L1139-I1144 WeakPolarHBondContact O-CB 3.45Å; L1139-I1144 PolarHBondContact O-N 3.38Å; L1139-V1146 HydrophobicContact CB-CG2 3.81Å; L1139-V1146 HydrophobicContact CD1-CG2 4.09Å
1140	K	90.3	Very high	92.6	Very high	72 Å²	72	31.7 Å²	31.7	31%	0.313	21%	0.211	S	C	.	.	H	α-helix	trans	-70.6	-38.1	170.2	-76	-54.9	-163.7	176.1	0	113.2	L1136 A1138 D1142 G1143 R1162 G1163	L1136-K1140 HydrophobicContact CD1-CG 4.11Å; L1136-K1140 VanDerWaalsContact O-CB 3.3Å; L1136-K1140 WeakPolarHBondContact O-CB 3.49Å; L1136-K1140 VanDerWaalsContact O-CG 3.25Å; L1136-K1140 WeakPolarHBondContact O-CG 3.45Å; L1136-K1140 PolarHBondContact O-N 3.35Å; A1138-K1140 PolarHBondContact O-N 2.8Å; K1140-D1142 VanDerWaalsContact C-N 3.3Å; K1140-G1143 PolarHBondContact O-N 3.14Å; K1140-G1143 VanDerWaalsContact O-N 3.12Å; K1140-R1162 VanDerWaalsContact CE-O 3.27Å; K1140-R1162 WeakPolarHBondContact CE-O 3.37Å; K1140-G1163 WeakPolarHBondContact CE-O 3.36Å; K1140-G1163 PolarHBondContact NZ-O 3.46Å
1141	A	89.5	Confident	92.6	Very high	88 Å²	88	30.5 Å²	30.5	73%	0.727	19%	0.192	S	C	*	.	H	α-helix	trans	-64	-35.7	172.1	0	0	0	0	0	112.2	D1137 A1138 G1143	D1137-A1141 PolarHBondContact O-N 3.46Å; A1138-A1141 WeakPolarHBondContact O-CB 3.38Å; A1138-A1141 PolarHBondContact O-N 2.6Å; A1138-A1141 VanDerWaalsContact O-N 3.12Å; A1141-G1143 PolarHBondContact O-N 2.77Å
1142	D	89.8	Confident	92.6	Very high	67 Å²	67	29.8 Å²	29.8	36%	0.358	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-8	173.2	-66.8	-19	0	0	0	113.9	R1099 A1138 L1139 K1140 I1144	R1099-D1142 IonicContact CZ-OD1 3.65Å; R1099-D1142 IonicContact CZ-OD2 3.26Å; R1099-D1142 VanDerWaalsContact CZ-OD2 3.26Å; R1099-D1142 IonicContact NE-OD1 3.73Å; R1099-D1142 IonicContact NE-OD2 2.7Å; R1099-D1142 PolarHBondContact NE-OD2 3.28Å; R1099-D1142 VanDerWaalsContact NH2-CG 3.27Å; R1099-D1142 IonicContact NH2-OD1 2.75Å; R1099-D1142 PolarHBondContact NH2-OD1 2.97Å; R1099-D1142 IonicContact NH2-OD2 2.99Å; R1099-D1142 PolarHBondContact NH2-OD2 3.44Å; A1138-D1142 PolarHBondContact O-N 3.14Å; L1139-D1142 PolarHBondContact O-N 2.88Å; K1140-D1142 VanDerWaalsContact C-N 3.3Å; D1142-I1144 VanDerWaalsContact C-N 3.27Å; D1142-I1144 HydrophobicContact CB-CD1 3.68Å; D1142-I1144 HydrophobicContact CB-CG1 3.86Å; D1142-I1144 PolarHBondContact O-N 3.37Å
1143	G	91.4	Very high	92.5	Very high	62 Å²	62	31.6 Å²	31.6	64%	0.639	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.1	12.4	-175.2	0	0	0	0	0	115	L1139 K1140 A1141	L1139-G1143 PolarHBondContact O-N 2.82Å; K1140-G1143 PolarHBondContact O-N 3.14Å; K1140-G1143 VanDerWaalsContact O-N 3.12Å; A1141-G1143 PolarHBondContact O-N 2.77Å
1144	I	92.8	Very high	92.6	Very high	18 Å²	18	33 Å²	33	9%	0.092	21%	0.214	C	C	.	.			trans	-72.5	133.3	-175.3	-68.7	167.1	0	0	0	110.6	R1099 M1102 I1109 L1139 D1142 V1146	R1099-I1144 HydrophobicContact CG-CD1 4.44Å; M1102-I1144 HydrophobicContact CE-CG2 4.42Å; M1102-I1144 HydrophobicContact CG-CD1 4Å; M1102-I1144 HydrophobicContact CG-CG1 4.18Å; M1102-I1144 HydrophobicContact CG-CG2 3.96Å; M1102-I1144 HydrophobicContact SD-CG2 3.9Å; I1109-I1144 HydrophobicContact CB-CG2 4.27Å; I1109-I1144 HydrophobicContact CG1-CG2 3.82Å; L1139-I1144 HydrophobicContact CB-CB 4.33Å; L1139-I1144 HydrophobicContact CD2-CD1 3.63Å; L1139-I1144 WeakPolarHBondContact O-CB 3.45Å; L1139-I1144 PolarHBondContact O-N 3.38Å; D1142-I1144 VanDerWaalsContact C-N 3.27Å; D1142-I1144 HydrophobicContact CB-CD1 3.68Å; D1142-I1144 HydrophobicContact CB-CG1 3.86Å; D1142-I1144 PolarHBondContact O-N 3.37Å; I1144-V1146 PolarHBondContact O-N 3.44Å
1145	P	94.1	Very high	92.7	Very high	50 Å²	50	30.3 Å²	30.3	33%	0.325	20%	0.196	S	C	.	.			trans	-65.9	122.5	170.1	-20.9	34.4	0	0	0	110.7	D1107 V1108 I1109 A1165	D1107-P1145 WeakPolarHBondContact O-CG 3.41Å; V1108-P1145 WeakPolarHBondContact CA-O 3.18Å; V1108-P1145 HydrophobicContact CG1-CB 4.45Å; V1108-P1145 WeakPolarHBondContact CG1-O 3.16Å; V1108-P1145 HydrophobicContact CG2-CB 4.21Å; I1109-P1145 PolarHBondContact N-O 3.38Å; P1145-A1165 HydrophobicContact CB-CB 4.4Å
1146	V	96.3	Very high	92.8	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.3	-179.8	-179.4	0	0	0	0	111.1	I1109 L1111 L1136 L1139 I1144 V1164 A1165 Y1166	I1109-V1146 CarbonylContact O-C 3.44Å; I1109-V1146 WeakPolarHBondContact O-CA 3.5Å; L1111-V1146 HydrophobicContact CD1-CG1 3.82Å; L1111-V1146 HydrophobicContact CG-CG1 3.95Å; L1136-V1146 HydrophobicContact CD1-CB 4.1Å; L1136-V1146 HydrophobicContact CD1-CG1 3.88Å; L1136-V1146 HydrophobicContact CD1-CG2 4.21Å; L1139-V1146 HydrophobicContact CB-CG2 3.81Å; L1139-V1146 HydrophobicContact CD1-CG2 4.09Å; I1144-V1146 PolarHBondContact O-N 3.44Å; V1146-V1164 HydrophobicContact CB-CG1 4.44Å; V1146-V1164 HydrophobicContact CG1-CG1 4.26Å; V1146-A1165 PolarHBondContact O-N 2.7Å; V1146-Y1166 PolarHBondContact O-N 2.6Å
1147	S	96.4	Very high	92.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	147.4	163.4	179.3	0	0	0	0	109.5	I1109 D1110 L1111 Y1166	I1109-S1147 PolarHBondContact O-N 2.85Å; D1110-S1147 WeakPolarHBondContact OD1-CB 3.44Å; D1110-S1147 PolarHBondContact OD1-OG 2.6Å; L1111-S1147 PolarHBondContact N-O 3.06Å; S1147-Y1166 WeakPolarHBondContact CA-O 3.4Å
1148	L	95.6	Very high	93	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.1	172.5	176.2	73.4	0	0	0	109.8	P1113 I1132 S1150 T1155 A1159 Y1166 L1167 N1168	P1113-L1148 HydrophobicContact CG-CD1 4.18Å; I1132-L1148 HydrophobicContact CD1-CD1 3.82Å; I1132-L1148 HydrophobicContact CD1-CD2 4.32Å; I1132-L1148 HydrophobicContact CG2-CD1 3.94Å; L1148-S1150 PolarHBondContact O-N 2.69Å; L1148-T1155 HydrophobicContact CD2-CG2 3.85Å; L1148-A1159 HydrophobicContact CB-CB 4.32Å; L1148-A1159 HydrophobicContact CD2-CB 3.56Å; L1148-A1159 HydrophobicContact CG-CB 4.48Å; L1148-Y1166 PolarHBondContact N-O 3.11Å; L1148-L1167 HydrophobicContact CB-CD2 4.28Å; L1148-L1167 HydrophobicContact CD2-CD2 4.35Å; L1148-N1168 WeakPolarHBondContact O-CB 3.33Å; L1148-N1168 PolarHBondContact O-N 3.45Å
1149	D	94.2	Very high	93.1	Very high	10 Å²	10	29.8 Å²	29.8	5%	0.053	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	90.6	168.8	-176.4	6.9	0	0	0	109.2	L1111 P1113 R1311	L1111-D1149 PolarHBondContact O-N 2.86Å; P1113-D1149 WeakPolarHBondContact CD-O 3.23Å; D1149-R1311 IonicContact OD2-CZ 3.06Å; D1149-R1311 VanDerWaalsContact OD2-CZ 3.24Å; D1149-R1311 IonicContact OD2-NH1 3.93Å; D1149-R1311 PolarHBondContact OD2-NH1 2.93Å; D1149-R1311 IonicContact OD2-NH2 2.74Å; D1149-R1311 PolarHBondContact OD2-NH2 3.42Å
1150	S	92.5	Very high	93.1	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.014	20%	0.198	C	C	.	.			trans	-157	140.3	174.2	171.9	0	0	0	0	110.3	E1128 L1148 Q1152 Q1156 N1168	E1128-S1150 WeakPolarHBondContact OE2-CB 3.25Å; E1128-S1150 PolarHBondContact OE2-OG 3.32Å; L1148-S1150 PolarHBondContact O-N 2.69Å; S1150-Q1152 PolarHBondContact OG-N 2.88Å; S1150-Q1156 PolarHBondContact O-NE2 3.32Å; S1150-N1168 PolarHBondContact N-O 3.08Å; S1150-N1168 VanDerWaalsContact N-O 3.1Å
1151	Y	90.4	Very high	93.1	Very high	45 Å²	45	32 Å²	32	18%	0.176	21%	0.213	C	C	.	.			trans	-101.4	9	178.3	60.5	-91.5	0	0	0	113.6	D1169 I1170 R1171	Y1151-D1169 VanDerWaalsContact CB-OD1 3.3Å; Y1151-D1169 WeakPolarHBondContact CB-OD1 3.22Å; Y1151-I1170 HydrophobicContact CD1-CD1 3.46Å; Y1151-I1170 VanDerWaalsContact CD1-CD1 3.46Å; Y1151-I1170 HydrophobicContact CD1-CG1 3.71Å; Y1151-I1170 HydrophobicContact CE1-CD1 3.81Å; Y1151-I1170 HydrophobicContact CG-CD1 4.3Å; Y1151-I1170 HydrophobicContact CG-CG1 4.15Å; Y1151-R1171 PolarHBondContact O-NH2 2.93Å
1152	Q	91.8	Very high	93.2	Very high	37 Å²	37	32.8 Å²	32.8	17%	0.173	20%	0.197	C	C	.	.			trans	-94.9	116.9	-179.2	-57.4	-158.7	52.5	0	0	110.4	V1123 E1128 S1150 A1154 T1155 Q1156	V1123-Q1152 PolarHBondContact O-NE2 3.24Å; E1128-Q1152 PolarHBondContact OE1-NE2 3.48Å; S1150-Q1152 PolarHBondContact OG-N 2.88Å; Q1152-A1154 PolarHBondContact O-N 2.79Å; Q1152-A1154 VanDerWaalsContact O-N 3.09Å; Q1152-T1155 PolarHBondContact O-N 2.87Å; Q1152-T1155 VanDerWaalsContact O-N 3.08Å; Q1152-Q1156 WeakPolarHBondContact O-CG 3.44Å; Q1152-Q1156 PolarHBondContact O-N 3.23Å
1153	P	92.3	Very high	93.2	Very high	40 Å²	40	31.6 Å²	31.6	26%	0.26	20%	0.201	S	C	.	.	H	α-helix	trans	-56.5	-30.3	-177.8	-29.1	36.6	0	0	0	114.4	A1157 D1175 F1178	P1153-A1157 WeakPolarHBondContact O-CB 3.36Å; P1153-A1157 PolarHBondContact O-N 3.01Å; P1153-D1175 HydrophobicContact CG-CB 4.48Å; P1153-F1178 HydrophobicContact CB-CB 4.38Å; P1153-F1178 HydrophobicContact CB-CD2 4.13Å; P1153-F1178 HydrophobicContact CB-CG 4.1Å
1154	A	93.4	Very high	93.3	Very high	50 Å²	50	28.8 Å²	28.8	41%	0.413	17%	0.171	S	C	.	.	H	α-helix	trans	-67.4	-47	175.5	0	0	0	0	0	112.7	Q1152 A1157 Y1158	Q1152-A1154 PolarHBondContact O-N 2.79Å; Q1152-A1154 VanDerWaalsContact O-N 3.09Å; A1154-A1157 PolarHBondContact O-N 3.18Å; A1154-Y1158 PolarHBondContact O-N 3.36Å
1155	T	94.6	Very high	93.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.7	-41.6	175.5	-41.9	0	0	0	0	111	E1128 I1129 I1132 L1148 Q1152 Y1158 A1159	E1128-T1155 HydrophobicContact CB-CG2 3.69Å; E1128-T1155 WeakPolarHBondContact OE2-CB 3.42Å; E1128-T1155 VanDerWaalsContact OE2-CG2 3.29Å; E1128-T1155 WeakPolarHBondContact OE2-CG2 3.43Å; E1128-T1155 PolarHBondContact OE2-OG1 2.8Å; I1129-T1155 HydrophobicContact CG1-CG2 4.16Å; I1132-T1155 HydrophobicContact CD1-CG2 3.72Å; L1148-T1155 HydrophobicContact CD2-CG2 3.85Å; Q1152-T1155 PolarHBondContact O-N 2.87Å; Q1152-T1155 VanDerWaalsContact O-N 3.08Å; T1155-Y1158 PolarHBondContact O-N 3Å; T1155-A1159 PolarHBondContact O-N 3.34Å
1156	Q	95	Very high	93.5	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.009	17%	0.169	C	C	.	.	H	α-helix	trans	-59.3	-46.5	174.1	-68.5	177.1	-4.3	0	0	111.1	S1150 Q1152 Y1158 A1159 L1160 L1167 D1169 F1178	S1150-Q1156 PolarHBondContact O-NE2 3.32Å; Q1152-Q1156 WeakPolarHBondContact O-CG 3.44Å; Q1152-Q1156 PolarHBondContact O-N 3.23Å; Q1156-Y1158 PolarHBondContact O-N 2.81Å; Q1156-A1159 PolarHBondContact O-N 3.07Å; Q1156-L1160 WeakPolarHBondContact O-CG 3.42Å; Q1156-L1160 PolarHBondContact O-N 2.9Å; Q1156-L1167 HydrophobicContact CB-CD1 4.04Å; Q1156-L1167 HydrophobicContact CB-CD2 4.25Å; Q1156-L1167 HydrophobicContact CG-CD1 4.32Å; Q1156-L1167 HydrophobicContact CG-CD2 4.32Å; Q1156-D1169 PolarHBondContact NE2-OD2 2.64Å; Q1156-F1178 HydrophobicContact CB-CE1 3.66Å; Q1156-F1178 HydrophobicContact CB-CZ 3.65Å; Q1156-F1178 HydrophobicContact CG-CE1 4.45Å
1157	A	93.2	Very high	93.5	Very high	29 Å²	29	28 Å²	28	24%	0.24	17%	0.168	C	C	.	.	H	α-helix	trans	-60	-44	176.5	0	0	0	0	0	112.5	P1153 A1154 L1160 S1161 F1178	P1153-A1157 WeakPolarHBondContact O-CB 3.36Å; P1153-A1157 PolarHBondContact O-N 3.01Å; A1154-A1157 PolarHBondContact O-N 3.18Å; A1157-L1160 PolarHBondContact O-N 2.93Å; A1157-S1161 PolarHBondContact O-N 3.05Å; A1157-F1178 HydrophobicContact CB-CE2 3.94Å; A1157-F1178 HydrophobicContact CB-CZ 4.37Å
1158	Y	94.3	Very high	93.5	Very high	48 Å²	48	28.2 Å²	28.2	19%	0.188	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-48.4	175.1	177.8	-92.1	0	0	0	111.4	I1129 I1132 A1133 L1136 A1154 T1155 Q1156 L1160 S1161 R1162	I1129-Y1158 HydrophobicContact CD1-CG 4.31Å; I1129-Y1158 HydrophobicContact CG1-CD1 4.29Å; I1129-Y1158 HydrophobicContact CG1-CG 4.02Å; I1129-Y1158 HydrophobicContact CG2-CD1 4.11Å; I1129-Y1158 HydrophobicContact CG2-CD2 3.85Å; I1129-Y1158 HydrophobicContact CG2-CE1 4.18Å; I1129-Y1158 HydrophobicContact CG2-CE2 3.92Å; I1129-Y1158 HydrophobicContact CG2-CG 3.96Å; I1132-Y1158 HydrophobicContact CD1-CD1 4.01Å; I1132-Y1158 HydrophobicContact CD1-CE1 4.39Å; I1132-Y1158 HydrophobicContact CG1-CD1 4.33Å; I1132-Y1158 HydrophobicContact CG1-CE1 4.25Å; A1133-Y1158 HydrophobicContact CB-CE1 4.3Å; A1133-Y1158 VanDerWaalsContact CB-OH 3.27Å; A1133-Y1158 WeakPolarHBondContact CB-OH 3.23Å; L1136-Y1158 HydrophobicContact CD2-CE1 4.35Å; A1154-Y1158 PolarHBondContact O-N 3.36Å; T1155-Y1158 PolarHBondContact O-N 3Å; Q1156-Y1158 PolarHBondContact O-N 2.81Å; Y1158-L1160 PolarHBondContact O-N 2.9Å; Y1158-S1161 WeakPolarHBondContact O-CB 3.39Å; Y1158-S1161 PolarHBondContact O-N 3.14Å; Y1158-S1161 VanDerWaalsContact O-N 3.1Å; Y1158-S1161 PolarHBondContact O-OG 3.22Å; Y1158-R1162 HydrophobicContact CE1-CG 4.15Å; Y1158-R1162 PolarHBondContact O-N 3.03Å
1159	A	93.2	Very high	93.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.4	-35.7	178.5	0	0	0	0	0	113.3	L1136 L1148 T1155 Q1156 S1161 R1162 G1163 V1164 L1167	L1136-A1159 HydrophobicContact CD2-CB 4.49Å; L1148-A1159 HydrophobicContact CB-CB 4.32Å; L1148-A1159 HydrophobicContact CD2-CB 3.56Å; L1148-A1159 HydrophobicContact CG-CB 4.48Å; T1155-A1159 PolarHBondContact O-N 3.34Å; Q1156-A1159 PolarHBondContact O-N 3.07Å; A1159-S1161 VanDerWaalsContact C-N 3.32Å; A1159-S1161 PolarHBondContact O-N 2.59Å; A1159-R1162 CarbonylContact O-C 3.52Å; A1159-R1162 PolarHBondContact O-N 2.89Å; A1159-G1163 PolarHBondContact O-N 3.32Å; A1159-G1163 VanDerWaalsContact O-N 3.1Å; A1159-V1164 HydrophobicContact CB-CG1 3.81Å; A1159-V1164 HydrophobicContact CB-CG2 3.93Å; A1159-V1164 PolarHBondContact O-N 3.45Å; A1159-L1167 HydrophobicContact CB-CD2 4.36Å
1160	L	93.5	Very high	93.3	Very high	30 Å²	30	27.9 Å²	27.9	16%	0.157	17%	0.167	C	C	.	.	H	α-helix	trans	-62.8	-37.7	170.8	-70.4	-177.5	0	0	0	112	Q1156 A1157 Y1158 R1162 G1163 V1164 L1167 F1178 L1182 A1187	Q1156-L1160 WeakPolarHBondContact O-CG 3.42Å; Q1156-L1160 PolarHBondContact O-N 2.9Å; A1157-L1160 PolarHBondContact O-N 2.93Å; Y1158-L1160 PolarHBondContact O-N 2.9Å; L1160-R1162 PolarHBondContact O-N 2.71Å; L1160-G1163 WeakPolarHBondContact O-CA 3.46Å; L1160-G1163 PolarHBondContact O-N 3.33Å; L1160-V1164 HydrophobicContact CD2-CG2 4.31Å; L1160-L1167 HydrophobicContact CD1-CD1 4.05Å; L1160-L1167 HydrophobicContact CD2-CD1 3.81Å; L1160-L1167 HydrophobicContact CD2-CD2 4.42Å; L1160-L1167 HydrophobicContact CD2-CG 4.03Å; L1160-L1167 HydrophobicContact CG-CD1 3.9Å; L1160-L1167 HydrophobicContact CG-CG 4.47Å; L1160-F1178 HydrophobicContact CD1-CZ 3.87Å; L1160-L1182 HydrophobicContact CD1-CD2 4.43Å; L1160-A1187 HydrophobicContact CD2-CB 3.76Å
1161	S	91.7	Very high	93.2	Very high	90 Å²	90	30.5 Å²	30.5	63%	0.629	18%	0.177	S	C	*	.	H	α-helix	trans	-64.8	-27.3	174.6	85	0	0	0	0	113.2	A1157 Y1158 A1159 G1163	A1157-S1161 PolarHBondContact O-N 3.05Å; Y1158-S1161 WeakPolarHBondContact O-CB 3.39Å; Y1158-S1161 PolarHBondContact O-N 3.14Å; Y1158-S1161 VanDerWaalsContact O-N 3.1Å; Y1158-S1161 PolarHBondContact O-OG 3.22Å; A1159-S1161 VanDerWaalsContact C-N 3.32Å; A1159-S1161 PolarHBondContact O-N 2.59Å; S1161-G1163 VanDerWaalsContact C-N 3.35Å
1162	R	91.3	Very high	93.3	Very high	104 Å²	104	28.4 Å²	28.4	39%	0.392	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	2.8	170.5	-64.2	-54.1	-145.1	-134.8	8.8	113.8	L1136 D1137 K1140 Y1158 A1159 L1160	L1136-R1162 HydrophobicContact CD2-CB 3.68Å; L1136-R1162 HydrophobicContact CD2-CG 3.89Å; L1136-R1162 HydrophobicContact CG-CB 4.12Å; L1136-R1162 HydrophobicContact CG-CG 4.41Å; D1137-R1162 IonicContact OD1-CZ 3.97Å; D1137-R1162 IonicContact OD1-NE 3.79Å; D1137-R1162 PolarHBondContact OD1-NE 2.71Å; D1137-R1162 IonicContact OD1-NH2 3.27Å; D1137-R1162 PolarHBondContact OD1-NH2 3.16Å; D1137-R1162 IonicContact OD2-CZ 2.9Å; D1137-R1162 IonicContact OD2-NE 3.63Å; D1137-R1162 IonicContact OD2-NH2 2.73Å; D1137-R1162 PolarHBondContact OD2-NH2 3.31Å; K1140-R1162 VanDerWaalsContact CE-O 3.27Å; K1140-R1162 WeakPolarHBondContact CE-O 3.37Å; Y1158-R1162 HydrophobicContact CE1-CG 4.15Å; Y1158-R1162 PolarHBondContact O-N 3.03Å; A1159-R1162 CarbonylContact O-C 3.52Å; A1159-R1162 PolarHBondContact O-N 2.89Å; L1160-R1162 PolarHBondContact O-N 2.71Å
1163	G	89.7	Confident	93.4	Very high	42 Å²	42	26.8 Å²	26.8	43%	0.433	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	40.5	174.6	0	0	0	0	0	114.9	K1140 A1159 L1160 S1161	K1140-G1163 WeakPolarHBondContact CE-O 3.36Å; K1140-G1163 PolarHBondContact NZ-O 3.46Å; A1159-G1163 PolarHBondContact O-N 3.32Å; A1159-G1163 VanDerWaalsContact O-N 3.1Å; L1160-G1163 WeakPolarHBondContact O-CA 3.46Å; L1160-G1163 PolarHBondContact O-N 3.33Å; S1161-G1163 VanDerWaalsContact C-N 3.35Å
1164	V	93.4	Very high	93.4	Very high	3 Å²	3	27 Å²	27	2%	0.018	16%	0.162	C	C	.	.			trans	-52.9	150.2	171.3	-69	0	0	0	0	112.4	L1136 V1146 A1159 L1160 Y1166 L1167 A1187	L1136-V1164 HydrophobicContact CD1-CG1 3.79Å; L1136-V1164 HydrophobicContact CD2-CG1 4.24Å; V1146-V1164 HydrophobicContact CB-CG1 4.44Å; V1146-V1164 HydrophobicContact CG1-CG1 4.26Å; A1159-V1164 HydrophobicContact CB-CG1 3.81Å; A1159-V1164 HydrophobicContact CB-CG2 3.93Å; A1159-V1164 PolarHBondContact O-N 3.45Å; L1160-V1164 HydrophobicContact CD2-CG2 4.31Å; V1164-Y1166 WeakPolarHBondContact CG2-O 3.43Å; V1164-L1167 HydrophobicContact CG2-CD2 3.85Å; V1164-L1167 HydrophobicContact CG2-CG 4.43Å; V1164-A1187 WeakPolarHBondContact O-CB 3.23Å
1165	A	94.2	Very high	93.3	Very high	34 Å²	34	27.7 Å²	27.7	28%	0.281	16%	0.159	S	C	.	.	S	Bend	trans	-80.2	-30.1	-178.9	0	0	0	0	0	112.1	P1145 V1146 A1187 K1188	P1145-A1165 HydrophobicContact CB-CB 4.4Å; V1146-A1165 PolarHBondContact O-N 2.7Å; A1165-A1187 WeakPolarHBondContact O-CA 3.26Å; A1165-K1188 PolarHBondContact O-N 3.29Å
1166	Y	96.5	Very high	93.1	Very high	19 Å²	19	30.7 Å²	30.7	8%	0.075	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	149.2	178.3	-58.8	-104.4	0	0	0	110.8	F1072 V1108 V1146 S1147 L1148 V1164 K1188 V1190 F1309	F1072-Y1166 HydrophobicContact CE1-CD1 4.38Å; F1072-Y1166 HydrophobicContact CE1-CG 4.24Å; F1072-Y1166 HydrophobicContact CE2-CE1 4.32Å; F1072-Y1166 HydrophobicContact CE2-CE2 4.36Å; F1072-Y1166 AromaticContact CZ-CD1 3.62Å; F1072-Y1166 HydrophobicContact CZ-CD1 3.62Å; F1072-Y1166 AromaticContact CZ-CD2 3.86Å; F1072-Y1166 HydrophobicContact CZ-CD2 3.86Å; F1072-Y1166 AromaticContact CZ-CE1 3.76Å; F1072-Y1166 HydrophobicContact CZ-CE1 3.76Å; F1072-Y1166 HydrophobicContact CZ-CE2 4.02Å; F1072-Y1166 AromaticContact CZ-CG 3.71Å; F1072-Y1166 HydrophobicContact CZ-CG 3.71Å; F1072-Y1166 AromaticContact CZ-CZ 3.99Å; V1108-Y1166 HydrophobicContact CG1-CD2 3.94Å; V1108-Y1166 HydrophobicContact CG1-CE2 4.18Å; V1108-Y1166 HydrophobicContact CG2-CD2 4.34Å; V1108-Y1166 HydrophobicContact CG2-CE2 3.74Å; V1146-Y1166 PolarHBondContact O-N 2.6Å; S1147-Y1166 WeakPolarHBondContact CA-O 3.4Å; L1148-Y1166 PolarHBondContact N-O 3.11Å; V1164-Y1166 WeakPolarHBondContact CG2-O 3.43Å; Y1166-K1188 CarbonylContact C-O 3.51Å; Y1166-K1188 VanDerWaalsContact CA-O 3.26Å; Y1166-K1188 WeakPolarHBondContact CA-O 3.28Å; Y1166-K1188 HydrophobicContact CD1-CB 3.44Å; Y1166-K1188 VanDerWaalsContact CD1-CB 3.44Å; Y1166-K1188 HydrophobicContact CD1-CD 4.02Å; Y1166-K1188 HydrophobicContact CD1-CG 4.38Å; Y1166-K1188 HydrophobicContact CE1-CB 3.65Å; Y1166-K1188 HydrophobicContact CE1-CD 3.3Å; Y1166-K1188 HydrophobicContact CE1-CG 4.12Å; Y1166-K1188 HydrophobicContact CG-CB 4.2Å; Y1166-K1188 PolarHBondContact OH-NZ 3.06Å; Y1166-V1190 HydrophobicContact CD1-CG2 4.47Å; Y1166-F1309 AromaticContact CE1-CE1 3.81Å; Y1166-F1309 HydrophobicContact CE1-CE1 3.81Å; Y1166-F1309 AromaticContact CE1-CZ 3.98Å; Y1166-F1309 HydrophobicContact CE1-CZ 3.98Å; Y1166-F1309 AromaticContact CZ-CE1 3.95Å
1167	L	96.7	Very high	93	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	140	155.9	-67.4	179.4	0	0	0	108.1	L1148 Q1156 A1159 L1160 V1164 F1173 F1178 L1182 K1188 L1189 V1190	L1148-L1167 HydrophobicContact CB-CD2 4.28Å; L1148-L1167 HydrophobicContact CD2-CD2 4.35Å; Q1156-L1167 HydrophobicContact CB-CD1 4.04Å; Q1156-L1167 HydrophobicContact CB-CD2 4.25Å; Q1156-L1167 HydrophobicContact CG-CD1 4.32Å; Q1156-L1167 HydrophobicContact CG-CD2 4.32Å; A1159-L1167 HydrophobicContact CB-CD2 4.36Å; L1160-L1167 HydrophobicContact CD1-CD1 4.05Å; L1160-L1167 HydrophobicContact CD2-CD1 3.81Å; L1160-L1167 HydrophobicContact CD2-CD2 4.42Å; L1160-L1167 HydrophobicContact CD2-CG 4.03Å; L1160-L1167 HydrophobicContact CG-CD1 3.9Å; L1160-L1167 HydrophobicContact CG-CG 4.47Å; V1164-L1167 HydrophobicContact CG2-CD2 3.85Å; V1164-L1167 HydrophobicContact CG2-CG 4.43Å; L1167-F1173 HydrophobicContact CB-CE1 4.04Å; L1167-F1173 HydrophobicContact CB-CZ 3.85Å; L1167-F1173 HydrophobicContact CD1-CE1 4.19Å; L1167-F1178 HydrophobicContact CD1-CE1 4.38Å; L1167-L1182 HydrophobicContact CD1-CD2 3.77Å; L1167-K1188 PolarHBondContact N-O 3.31Å; L1167-L1189 HydrophobicContact CB-CD2 4.12Å; L1167-L1189 HydrophobicContact CD1-CD2 4.19Å; L1167-L1189 HydrophobicContact CG-CD2 4.49Å; L1167-V1190 PolarHBondContact O-N 3.41Å
1168	N	95	Very high	93	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	116.4	178.1	180	23.4	0	0	0	108.5	L1148 S1150 V1190	L1148-N1168 WeakPolarHBondContact O-CB 3.33Å; L1148-N1168 PolarHBondContact O-N 3.45Å; S1150-N1168 PolarHBondContact N-O 3.08Å; S1150-N1168 VanDerWaalsContact N-O 3.1Å; N1168-V1190 HydrophobicContact CB-CB 4.18Å; N1168-V1190 HydrophobicContact CB-CG2 4.42Å
1169	D	94	Very high	93	Very high	3 Å²	3	32 Å²	32	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	112.7	-173.4	-171.4	-27.7	0	0	0	110	Y1151 Q1156 R1171 G1172 F1173 V1190 M1192	Y1151-D1169 VanDerWaalsContact CB-OD1 3.3Å; Y1151-D1169 WeakPolarHBondContact CB-OD1 3.22Å; Q1156-D1169 PolarHBondContact NE2-OD2 2.64Å; D1169-R1171 PolarHBondContact O-N 3.43Å; D1169-R1171 VanDerWaalsContact O-N 3.09Å; D1169-R1171 WeakPolarHBondContact OD1-CA 3.26Å; D1169-R1171 WeakPolarHBondContact OD1-CB 3.44Å; D1169-R1171 PolarHBondContact OD1-N 3.27Å; D1169-G1172 PolarHBondContact O-N 3.36Å; D1169-G1172 PolarHBondContact OD1-N 3.34Å; D1169-F1173 HydrophobicContact CB-CD1 3.89Å; D1169-F1173 HydrophobicContact CB-CD2 4.05Å; D1169-F1173 HydrophobicContact CB-CE1 3.63Å; D1169-F1173 HydrophobicContact CB-CE2 3.77Å; D1169-F1173 HydrophobicContact CB-CG 4.1Å; D1169-F1173 HydrophobicContact CB-CZ 3.56Å; D1169-F1173 WeakPolarHBondContact OD2-CA 3.45Å; D1169-F1173 WeakPolarHBondContact OD2-CD1 3.29Å; D1169-F1173 PolarHBondContact OD2-N 2.94Å; D1169-V1190 PolarHBondContact N-O 3.45Å; D1169-M1192 WeakPolarHBondContact O-CB 3.48Å; D1169-M1192 PolarHBondContact O-N 3.39Å
1170	I	92.2	Very high	93	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.021	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-12.6	179.9	66.7	179.8	0	0	0	113.9	Y1151 M1192 G1198 F1244	Y1151-I1170 HydrophobicContact CD1-CD1 3.46Å; Y1151-I1170 VanDerWaalsContact CD1-CD1 3.46Å; Y1151-I1170 HydrophobicContact CD1-CG1 3.71Å; Y1151-I1170 HydrophobicContact CE1-CD1 3.81Å; Y1151-I1170 HydrophobicContact CG-CD1 4.3Å; Y1151-I1170 HydrophobicContact CG-CG1 4.15Å; I1170-M1192 HydrophobicContact CB-CE 3.75Å; I1170-M1192 HydrophobicContact CB-SD 4.25Å; I1170-M1192 HydrophobicContact CG2-CE 4.11Å; I1170-M1192 HydrophobicContact CG2-SD 4.07Å; I1170-M1192 WeakPolarHBondContact O-CE 3.25Å; I1170-G1198 VanDerWaalsContact CD1-O 3.28Å; I1170-G1198 WeakPolarHBondContact CD1-O 3.45Å; I1170-F1244 HydrophobicContact CB-CE1 4.45Å; I1170-F1244 HydrophobicContact CD1-CE1 4.4Å
1171	R	91.5	Very high	92.9	Very high	58 Å²	58	38.9 Å²	38.9	22%	0.219	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	0.2	174.7	-53.4	-170.2	-67.7	159.9	-3.2	112.8	Y1151 D1169 F1173 P1174 D1197	Y1151-R1171 PolarHBondContact O-NH2 2.93Å; D1169-R1171 PolarHBondContact O-N 3.43Å; D1169-R1171 VanDerWaalsContact O-N 3.09Å; D1169-R1171 WeakPolarHBondContact OD1-CA 3.26Å; D1169-R1171 WeakPolarHBondContact OD1-CB 3.44Å; D1169-R1171 PolarHBondContact OD1-N 3.27Å; R1171-F1173 PolarHBondContact O-N 3.07Å; R1171-P1174 HydrophobicContact CB-CG 3.9Å; R1171-D1197 WeakPolarHBondContact CD-OD1 3.48Å; R1171-D1197 IonicContact NH1-OD1 2.85Å; R1171-D1197 PolarHBondContact NH1-OD1 3.18Å
1172	G	92.1	Very high	92.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.208	C	C	.	.			trans	65	34.4	179.2	0	0	0	0	0	114.7	D1169 M1192 R1221	D1169-G1172 PolarHBondContact O-N 3.36Å; D1169-G1172 PolarHBondContact OD1-N 3.34Å; G1172-M1192 PolarHBondContact N-O 3.13Å; G1172-R1221 WeakPolarHBondContact O-CD 3.31Å; G1172-R1221 VanDerWaalsContact O-CG 3.24Å; G1172-R1221 WeakPolarHBondContact O-CG 3.23Å; G1172-R1221 PolarHBondContact O-NE 3.13Å
1173	F	93.9	Very high	93	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.018	20%	0.204	C	C	.	.			trans	59.5	72.7	-178.2	-49	-84	0	0	0	113	L1167 D1169 R1171 Y1179 L1182 L1189 V1190 V1191 R1221 L1225	L1167-F1173 HydrophobicContact CB-CE1 4.04Å; L1167-F1173 HydrophobicContact CB-CZ 3.85Å; L1167-F1173 HydrophobicContact CD1-CE1 4.19Å; D1169-F1173 HydrophobicContact CB-CD1 3.89Å; D1169-F1173 HydrophobicContact CB-CD2 4.05Å; D1169-F1173 HydrophobicContact CB-CE1 3.63Å; D1169-F1173 HydrophobicContact CB-CE2 3.77Å; D1169-F1173 HydrophobicContact CB-CG 4.1Å; D1169-F1173 HydrophobicContact CB-CZ 3.56Å; D1169-F1173 WeakPolarHBondContact OD2-CA 3.45Å; D1169-F1173 WeakPolarHBondContact OD2-CD1 3.29Å; D1169-F1173 PolarHBondContact OD2-N 2.94Å; R1171-F1173 PolarHBondContact O-N 3.07Å; F1173-Y1179 HydrophobicContact CB-CE1 4.45Å; F1173-Y1179 WeakPolarHBondContact O-CE1 3.39Å; F1173-Y1179 PolarHBondContact O-OH 3.22Å; F1173-L1182 HydrophobicContact CB-CD1 4.2Å; F1173-L1182 HydrophobicContact CD1-CD1 3.86Å; F1173-L1182 HydrophobicContact CD1-CD2 4.27Å; F1173-L1182 HydrophobicContact CE1-CD2 4.22Å; F1173-L1182 HydrophobicContact CG-CD1 4.1Å; F1173-L1189 HydrophobicContact CD2-CB 4.43Å; F1173-L1189 HydrophobicContact CE1-CD2 4.38Å; F1173-L1189 HydrophobicContact CE2-CB 3.68Å; F1173-L1189 HydrophobicContact CE2-CD2 4.49Å; F1173-L1189 HydrophobicContact CE2-CG 4.46Å; F1173-L1189 HydrophobicContact CZ-CB 4Å; F1173-L1189 HydrophobicContact CZ-CD2 4.01Å; F1173-L1189 HydrophobicContact CZ-CG 4.46Å; F1173-V1190 WeakPolarHBondContact CE2-O 3.29Å; F1173-V1191 HydrophobicContact CD2-CG2 4.2Å; F1173-V1191 HydrophobicContact CE2-CG2 4.31Å; F1173-R1221 PolarHBondContact O-NH1 3.38Å; F1173-R1221 VanDerWaalsContact O-NH1 3.1Å; F1173-L1225 HydrophobicContact CB-CD2 4.2Å
1174	P	92.2	Very high	93	Very high	43 Å²	43	38.4 Å²	38.4	28%	0.279	22%	0.222	S	C	.	.			trans	-71.7	-30.3	179.9	27.7	-33.5	0	0	0	113.7	R1171 A1176 R1221	R1171-P1174 HydrophobicContact CB-CG 3.9Å; P1174-A1176 PolarHBondContact O-N 3.09Å; P1174-R1221 PolarHBondContact O-NH1 2.87Å
1175	D	91.1	Very high	92.9	Very high	65 Å²	65	39.5 Å²	39.5	35%	0.348	23%	0.23	S	C	.	.			trans	-84	107.1	-169.3	-178.5	8.8	0	0	0	113.5	P1153 A1177 F1178 Y1179	P1153-D1175 HydrophobicContact CG-CB 4.48Å; D1175-A1177 VanDerWaalsContact C-N 3.26Å; D1175-A1177 PolarHBondContact O-N 3.01Å; D1175-A1177 VanDerWaalsContact OD1-CB 3.27Å; D1175-A1177 WeakPolarHBondContact OD1-CB 3.31Å; D1175-A1177 PolarHBondContact OD1-N 3.47Å; D1175-F1178 PolarHBondContact O-N 3.26Å; D1175-Y1179 VanDerWaalsContact O-CD1 3.26Å; D1175-Y1179 WeakPolarHBondContact O-CD1 3.19Å; D1175-Y1179 WeakPolarHBondContact O-CE1 3.24Å
1176	A	91.3	Very high	92.8	Very high	64 Å²	64	43.2 Å²	43.2	53%	0.529	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.3	176.9	0	0	0	0	0	114.1	P1174 F1178 Y1179	P1174-A1176 PolarHBondContact O-N 3.09Å; A1176-F1178 PolarHBondContact O-N 3.37Å; A1176-Y1179 HydrophobicContact CB-CD2 4.08Å; A1176-Y1179 HydrophobicContact CB-CE2 3.98Å; A1176-Y1179 WeakPolarHBondContact O-CB 3.45Å; A1176-Y1179 PolarHBondContact O-N 2.84Å
1177	A	92.3	Very high	92.5	Very high	78 Å²	78	42.4 Å²	42.4	65%	0.645	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-22.1	176.5	0	0	0	0	0	112.3	D1175 P1180	D1175-A1177 VanDerWaalsContact C-N 3.26Å; D1175-A1177 PolarHBondContact O-N 3.01Å; D1175-A1177 VanDerWaalsContact OD1-CB 3.27Å; D1175-A1177 WeakPolarHBondContact OD1-CB 3.31Å; D1175-A1177 PolarHBondContact OD1-N 3.47Å; A1177-P1180 WeakPolarHBondContact O-CD 3.39Å
1178	F	93.3	Very high	92.5	Very high	9 Å²	9	45.9 Å²	45.9	4%	0.039	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-19.9	175.7	-166.6	-126.4	0	0	0	113.4	P1153 Q1156 A1157 L1160 L1167 D1175 A1176 P1180 Q1181 L1182	P1153-F1178 HydrophobicContact CB-CB 4.38Å; P1153-F1178 HydrophobicContact CB-CD2 4.13Å; P1153-F1178 HydrophobicContact CB-CG 4.1Å; Q1156-F1178 HydrophobicContact CB-CE1 3.66Å; Q1156-F1178 HydrophobicContact CB-CZ 3.65Å; Q1156-F1178 HydrophobicContact CG-CE1 4.45Å; A1157-F1178 HydrophobicContact CB-CE2 3.94Å; A1157-F1178 HydrophobicContact CB-CZ 4.37Å; L1160-F1178 HydrophobicContact CD1-CZ 3.87Å; L1167-F1178 HydrophobicContact CD1-CE1 4.38Å; D1175-F1178 PolarHBondContact O-N 3.26Å; A1176-F1178 PolarHBondContact O-N 3.37Å; F1178-P1180 VanDerWaalsContact C-CD 3.44Å; F1178-Q1181 HydrophobicContact CD2-CB 3.96Å; F1178-Q1181 HydrophobicContact CD2-CG 4.15Å; F1178-Q1181 HydrophobicContact CE2-CB 3.77Å; F1178-Q1181 HydrophobicContact CE2-CG 4.2Å; F1178-Q1181 HydrophobicContact CZ-CB 4.45Å; F1178-Q1181 WeakPolarHBondContact O-CB 2.87Å; F1178-Q1181 PolarHBondContact O-N 3.25Å; F1178-L1182 HydrophobicContact CD1-CD1 4.01Å; F1178-L1182 HydrophobicContact CD1-CD2 3.77Å; F1178-L1182 HydrophobicContact CD1-CG 3.65Å; F1178-L1182 HydrophobicContact CE1-CD1 4.48Å; F1178-L1182 HydrophobicContact CE1-CD2 3.39Å; F1178-L1182 HydrophobicContact CE1-CG 3.8Å; F1178-L1182 HydrophobicContact CG-CG 4.43Å; F1178-L1182 HydrophobicContact CZ-CD2 4.24Å; F1178-L1182 PolarHBondContact O-N 3.07Å; F1178-L1182 VanDerWaalsContact O-N 3.11Å
1179	Y	94.4	Very high	92.6	Very high	18 Å²	18	45.7 Å²	45.7	7%	0.071	27%	0.265	C	S	.	.	H	α-helix	trans	-53.1	-38.8	-178.4	-64.2	-4.6	0	0	0	114.8	F1173 D1175 A1176 Q1181 L1182 A1183 R1221 A1224 L1225 A1228	F1173-Y1179 HydrophobicContact CB-CE1 4.45Å; F1173-Y1179 WeakPolarHBondContact O-CE1 3.39Å; F1173-Y1179 PolarHBondContact O-OH 3.22Å; D1175-Y1179 VanDerWaalsContact O-CD1 3.26Å; D1175-Y1179 WeakPolarHBondContact O-CD1 3.19Å; D1175-Y1179 WeakPolarHBondContact O-CE1 3.24Å; A1176-Y1179 HydrophobicContact CB-CD2 4.08Å; A1176-Y1179 HydrophobicContact CB-CE2 3.98Å; A1176-Y1179 WeakPolarHBondContact O-CB 3.45Å; A1176-Y1179 PolarHBondContact O-N 2.84Å; Y1179-Q1181 PolarHBondContact O-N 3.14Å; Y1179-L1182 HydrophobicContact CD1-CD1 4.05Å; Y1179-L1182 WeakPolarHBondContact O-CB 3.39Å; Y1179-L1182 PolarHBondContact O-N 3.32Å; Y1179-A1183 WeakPolarHBondContact O-CB 3.47Å; Y1179-A1183 PolarHBondContact O-N 3.13Å; Y1179-R1221 PolarHBondContact OH-NH1 2.85Å; Y1179-A1224 HydrophobicContact CE2-CB 4.15Å; Y1179-L1225 HydrophobicContact CD1-CD2 3.87Å; Y1179-L1225 HydrophobicContact CE1-CD2 3.5Å; Y1179-L1225 VanDerWaalsContact CE1-CD2 3.5Å; Y1179-A1228 HydrophobicContact CD2-CB 3.61Å; Y1179-A1228 HydrophobicContact CG-CB 4.05Å
1180	P	91.6	Very high	92.7	Very high	76 Å²	76	45.6 Å²	45.6	49%	0.494	26%	0.264	S	S	.	.	H	α-helix	trans	-65.1	-21.5	176.1	-23	35.6	0	0	0	114.3	A1177 F1178 K1184	A1177-P1180 WeakPolarHBondContact O-CD 3.39Å; F1178-P1180 VanDerWaalsContact C-CD 3.44Å; P1180-K1184 WeakPolarHBondContact O-CD 3.34Å; P1180-K1184 VanDerWaalsContact O-CG 3.3Å; P1180-K1184 WeakPolarHBondContact O-CG 3.45Å
1181	Q	91.6	Very high	92.9	Very high	100 Å²	100	45.4 Å²	45.4	47%	0.467	26%	0.264	S	S	.	.	H	α-helix	trans	-84	-43	172.6	-54.2	-166.2	32.3	0	0	110.7	F1178 Y1179 A1183 K1184 S1185	F1178-Q1181 HydrophobicContact CD2-CB 3.96Å; F1178-Q1181 HydrophobicContact CD2-CG 4.15Å; F1178-Q1181 HydrophobicContact CE2-CB 3.77Å; F1178-Q1181 HydrophobicContact CE2-CG 4.2Å; F1178-Q1181 HydrophobicContact CZ-CB 4.45Å; F1178-Q1181 WeakPolarHBondContact O-CB 2.87Å; F1178-Q1181 PolarHBondContact O-N 3.25Å; Y1179-Q1181 PolarHBondContact O-N 3.14Å; Q1181-A1183 VanDerWaalsContact C-N 3.32Å; Q1181-A1183 PolarHBondContact O-N 3.48Å; Q1181-K1184 PolarHBondContact O-N 2.54Å; Q1181-S1185 PolarHBondContact O-N 3.25Å
1182	L	93.5	Very high	93.1	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.5	-47.3	171.4	-65.6	179.4	0	0	0	111.3	L1160 L1167 F1173 F1178 Y1179 K1184 S1185 L1189 L1225 I1230 R1234	L1160-L1182 HydrophobicContact CD1-CD2 4.43Å; L1167-L1182 HydrophobicContact CD1-CD2 3.77Å; F1173-L1182 HydrophobicContact CB-CD1 4.2Å; F1173-L1182 HydrophobicContact CD1-CD1 3.86Å; F1173-L1182 HydrophobicContact CD1-CD2 4.27Å; F1173-L1182 HydrophobicContact CE1-CD2 4.22Å; F1173-L1182 HydrophobicContact CG-CD1 4.1Å; F1178-L1182 HydrophobicContact CD1-CD1 4.01Å; F1178-L1182 HydrophobicContact CD1-CD2 3.77Å; F1178-L1182 HydrophobicContact CD1-CG 3.65Å; F1178-L1182 HydrophobicContact CE1-CD1 4.48Å; F1178-L1182 HydrophobicContact CE1-CD2 3.39Å; F1178-L1182 HydrophobicContact CE1-CG 3.8Å; F1178-L1182 HydrophobicContact CG-CG 4.43Å; F1178-L1182 HydrophobicContact CZ-CD2 4.24Å; F1178-L1182 PolarHBondContact O-N 3.07Å; F1178-L1182 VanDerWaalsContact O-N 3.11Å; Y1179-L1182 HydrophobicContact CD1-CD1 4.05Å; Y1179-L1182 WeakPolarHBondContact O-CB 3.39Å; Y1179-L1182 PolarHBondContact O-N 3.32Å; L1182-K1184 VanDerWaalsContact C-N 3.33Å; L1182-K1184 PolarHBondContact O-N 2.95Å; L1182-S1185 PolarHBondContact O-N 2.85Å; L1182-S1185 PolarHBondContact O-OG 3.17Å; L1182-L1189 HydrophobicContact CB-CD1 4.32Å; L1182-L1189 HydrophobicContact CD1-CD1 4.15Å; L1182-L1189 HydrophobicContact CD2-CD1 4.25Å; L1182-L1189 HydrophobicContact CD2-CD2 3.82Å; L1182-L1189 HydrophobicContact CG-CD1 4.5Å; L1182-L1225 HydrophobicContact CD1-CD2 4.32Å; L1182-I1230 HydrophobicContact CB-CD1 3.68Å; L1182-I1230 HydrophobicContact CB-CG1 4.35Å; L1182-I1230 HydrophobicContact CD1-CD1 4.11Å; L1182-R1234 VanDerWaalsContact O-CZ 3.29Å; L1182-R1234 PolarHBondContact O-NH1 3.33Å; L1182-R1234 PolarHBondContact O-NH2 2.9Å
1183	A	92.2	Very high	93.1	Very high	38 Å²	38	43.5 Å²	43.5	31%	0.314	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-35.6	179.8	0	0	0	0	0	113.7	Y1179 Q1181 I1230	Y1179-A1183 WeakPolarHBondContact O-CB 3.47Å; Y1179-A1183 PolarHBondContact O-N 3.13Å; Q1181-A1183 VanDerWaalsContact C-N 3.32Å; Q1181-A1183 PolarHBondContact O-N 3.48Å; A1183-I1230 HydrophobicContact CB-CG1 4.2Å
1184	K	91	Very high	92.9	Very high	187 Å²	187	44.1 Å²	44.1	81%	0.813	26%	0.262	S	S	*	.	H	α-helix	trans	-74.5	-26.6	178.1	-73.4	172.6	-176.3	178.4	0	114	P1180 Q1181 L1182	P1180-K1184 WeakPolarHBondContact O-CD 3.34Å; P1180-K1184 VanDerWaalsContact O-CG 3.3Å; P1180-K1184 WeakPolarHBondContact O-CG 3.45Å; Q1181-K1184 PolarHBondContact O-N 2.54Å; L1182-K1184 VanDerWaalsContact C-N 3.33Å; L1182-K1184 PolarHBondContact O-N 2.95Å
1185	S	90.8	Very high	92.7	Very high	27 Å²	27	43.9 Å²	43.9	19%	0.189	26%	0.26	C	S	.	.	S	Bend	trans	-79.4	162.6	-179.2	64.9	0	0	0	0	113.2	Q1181 L1182 R1234	Q1181-S1185 PolarHBondContact O-N 3.25Å; L1182-S1185 PolarHBondContact O-N 2.85Å; L1182-S1185 PolarHBondContact O-OG 3.17Å; S1185-R1234 PolarHBondContact O-NH1 3.48Å; S1185-R1234 PolarHBondContact O-NH2 2.95Å; S1185-R1234 PolarHBondContact OG-NH2 2.87Å
1186	S	90.6	Very high	92.2	Very high	111 Å²	111	41.3 Å²	41.3	78%	0.776	25%	0.246	S	C	*	.			trans	-95.6	-11.6	173.5	52.8	0	0	0	0	114
1187	A	92.2	Very high	91.5	Very high	2 Å²	2	44.7 Å²	44.7	2%	0.017	26%	0.255	C	S	.	.			trans	-58.3	146.1	-176.2	0	0	0	0	0	112.3	L1160 V1164 A1165 R1234	L1160-A1187 HydrophobicContact CD2-CB 3.76Å; V1164-A1187 WeakPolarHBondContact O-CB 3.23Å; A1165-A1187 WeakPolarHBondContact O-CA 3.26Å; A1187-R1234 VanDerWaalsContact O-CZ 3.23Å; A1187-R1234 PolarHBondContact O-NE 3.13Å; A1187-R1234 PolarHBondContact O-NH2 3.16Å
1188	K	95.6	Very high	90.8	Very high	73 Å²	73	41.3 Å²	41.3	32%	0.317	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	153.1	167.3	-75.3	174.2	177.9	178.1	0	110.4	A1165 Y1166 L1167 R1234	A1165-K1188 PolarHBondContact O-N 3.29Å; Y1166-K1188 CarbonylContact C-O 3.51Å; Y1166-K1188 VanDerWaalsContact CA-O 3.26Å; Y1166-K1188 WeakPolarHBondContact CA-O 3.28Å; Y1166-K1188 HydrophobicContact CD1-CB 3.44Å; Y1166-K1188 VanDerWaalsContact CD1-CB 3.44Å; Y1166-K1188 HydrophobicContact CD1-CD 4.02Å; Y1166-K1188 HydrophobicContact CD1-CG 4.38Å; Y1166-K1188 HydrophobicContact CE1-CB 3.65Å; Y1166-K1188 HydrophobicContact CE1-CD 3.3Å; Y1166-K1188 HydrophobicContact CE1-CG 4.12Å; Y1166-K1188 HydrophobicContact CG-CB 4.2Å; Y1166-K1188 PolarHBondContact OH-NZ 3.06Å; L1167-K1188 PolarHBondContact N-O 3.31Å; K1188-R1234 CarbonylContact C-O 3.57Å; K1188-R1234 VanDerWaalsContact CA-O 3.23Å; K1188-R1234 WeakPolarHBondContact CA-O 3.19Å; K1188-R1234 WeakPolarHBondContact CB-O 3.48Å
1189	L	96.7	Very high	90.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	111.6	-174.8	-53.8	-175.3	0	0	0	108.8	L1167 F1173 L1182 V1191 I1230 R1234 L1235 V1236	L1167-L1189 HydrophobicContact CB-CD2 4.12Å; L1167-L1189 HydrophobicContact CD1-CD2 4.19Å; L1167-L1189 HydrophobicContact CG-CD2 4.49Å; F1173-L1189 HydrophobicContact CD2-CB 4.43Å; F1173-L1189 HydrophobicContact CE1-CD2 4.38Å; F1173-L1189 HydrophobicContact CE2-CB 3.68Å; F1173-L1189 HydrophobicContact CE2-CD2 4.49Å; F1173-L1189 HydrophobicContact CE2-CG 4.46Å; F1173-L1189 HydrophobicContact CZ-CB 4Å; F1173-L1189 HydrophobicContact CZ-CD2 4.01Å; F1173-L1189 HydrophobicContact CZ-CG 4.46Å; L1182-L1189 HydrophobicContact CB-CD1 4.32Å; L1182-L1189 HydrophobicContact CD1-CD1 4.15Å; L1182-L1189 HydrophobicContact CD2-CD1 4.25Å; L1182-L1189 HydrophobicContact CD2-CD2 3.82Å; L1182-L1189 HydrophobicContact CG-CD1 4.5Å; L1189-V1191 PolarHBondContact O-N 3.38Å; L1189-I1230 HydrophobicContact CD1-CD1 4.1Å; L1189-I1230 HydrophobicContact CD1-CG2 3.89Å; L1189-R1234 PolarHBondContact N-O 2.96Å; L1189-L1235 HydrophobicContact CB-CD2 4.26Å; L1189-L1235 HydrophobicContact CD1-CD2 4.28Å; L1189-V1236 PolarHBondContact O-N 3.29Å
1190	V	96.8	Very high	89.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	108.8	169.3	-171	0	0	0	0	107.4	Y1166 L1167 N1168 D1169 F1173 V1236 D1238 L1271	Y1166-V1190 HydrophobicContact CD1-CG2 4.47Å; L1167-V1190 PolarHBondContact O-N 3.41Å; N1168-V1190 HydrophobicContact CB-CB 4.18Å; N1168-V1190 HydrophobicContact CB-CG2 4.42Å; D1169-V1190 PolarHBondContact N-O 3.45Å; F1173-V1190 WeakPolarHBondContact CE2-O 3.29Å; V1190-V1236 WeakPolarHBondContact CA-O 3.49Å; V1190-V1236 HydrophobicContact CG2-CB 4.17Å; V1190-V1236 HydrophobicContact CG2-CG1 4.44Å; V1190-D1238 HydrophobicContact CG1-CB 3.97Å; V1190-L1271 HydrophobicContact CG1-CB 4.3Å; V1190-L1271 HydrophobicContact CG1-CD1 4.11Å; V1190-L1271 HydrophobicContact CG1-CD2 4.42Å; V1190-L1271 HydrophobicContact CG2-CD1 4.06Å
1191	V	95.8	Very high	89.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	104.3	179.1	-175	0	0	0	0	106.6	F1173 L1189 F1217 F1218 R1221 L1225 L1235 V1236 D1238	F1173-V1191 HydrophobicContact CD2-CG2 4.2Å; F1173-V1191 HydrophobicContact CE2-CG2 4.31Å; L1189-V1191 PolarHBondContact O-N 3.38Å; V1191-F1217 HydrophobicContact CG1-CE1 4.16Å; V1191-F1218 HydrophobicContact CB-CE1 4.34Å; V1191-F1218 HydrophobicContact CG1-CD1 4.34Å; V1191-F1218 HydrophobicContact CG1-CE1 4.05Å; V1191-F1218 WeakPolarHBondContact O-CE1 3.41Å; V1191-R1221 HydrophobicContact CG1-CB 4.42Å; V1191-R1221 HydrophobicContact CG1-CG 3.7Å; V1191-L1225 HydrophobicContact CG2-CD1 3.82Å; V1191-L1235 HydrophobicContact CG2-CD2 4.39Å; V1191-V1236 PolarHBondContact N-O 3.26Å; V1191-D1238 PolarHBondContact O-N 3.24Å
1192	M	95.3	Very high	89	Confident	7 Å²	7	43.3 Å²	43.3	3%	0.034	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	141.9	175.5	-153.4	-176.2	85.5	0	0	111.4	D1169 I1170 G1172 F1217 D1238 F1244	D1169-M1192 WeakPolarHBondContact O-CB 3.48Å; D1169-M1192 PolarHBondContact O-N 3.39Å; I1170-M1192 HydrophobicContact CB-CE 3.75Å; I1170-M1192 HydrophobicContact CB-SD 4.25Å; I1170-M1192 HydrophobicContact CG2-CE 4.11Å; I1170-M1192 HydrophobicContact CG2-SD 4.07Å; I1170-M1192 WeakPolarHBondContact O-CE 3.25Å; G1172-M1192 PolarHBondContact N-O 3.13Å; M1192-F1217 WeakPolarHBondContact O-CE1 3.36Å; M1192-F1217 WeakPolarHBondContact O-CZ 3.44Å; M1192-D1238 CarbonylContact C-O 3.52Å; M1192-D1238 VanDerWaalsContact CA-O 3.22Å; M1192-D1238 WeakPolarHBondContact CA-O 3.44Å; M1192-D1238 HydrophobicContact CB-CB 4.33Å; M1192-D1238 HydrophobicContact CG-CB 3.88Å; M1192-F1244 HydrophobicContact CE-CB 4.06Å; M1192-F1244 HydrophobicContact CE-CD1 3.49Å; M1192-F1244 VanDerWaalsContact CE-CD1 3.49Å; M1192-F1244 HydrophobicContact CE-CD2 3.87Å; M1192-F1244 HydrophobicContact CE-CE1 3.78Å; M1192-F1244 HydrophobicContact CE-CE2 4.14Å; M1192-F1244 HydrophobicContact CE-CG 3.53Å; M1192-F1244 HydrophobicContact CE-CZ 4.09Å
1193	H	93.5	Very high	88.7	Confident	11 Å²	11	48.7 Å²	48.7	5%	0.051	25%	0.248	C	C	.	.			trans	-87.3	142.2	162.3	163.9	-90.8	0	0	0	111	I1214 F1217 F1218 D1238 P1239	H1193-I1214 WeakPolarHBondContact ND1-CG1 3.42Å; H1193-F1217 HydrophobicContact CB-CD1 3.7Å; H1193-F1217 HydrophobicContact CB-CE1 3.85Å; H1193-F1217 HydrophobicContact CB-CG 4.35Å; H1193-F1217 AromaticContact CD2-CD1 3.98Å; H1193-F1217 AromaticContact CD2-CG 3.73Å; H1193-F1218 HydrophobicContact CB-CE2 4.47Å; H1193-F1218 HydrophobicContact CB-CZ 4.16Å; H1193-D1238 PolarHBondContact N-O 3.46Å; H1193-P1239 PolarHBondContact ND1-O 3.35Å
1194	S	90.1	Very high	88.4	Confident	18 Å²	18	55.1 Å²	55.1	13%	0.126	27%	0.272	C	S	.	.			trans	-149.4	141.1	175.5	175.7	0	0	0	0	110.2	Q1196	S1194-Q1196 VanDerWaalsContact CB-O 3.32Å; S1194-Q1196 WeakPolarHBondContact CB-O 3.4Å; S1194-Q1196 PolarHBondContact OG-N 2.79Å; S1194-Q1196 VanDerWaalsContact OG-N 3.1Å; S1194-Q1196 PolarHBondContact OG-O 3.39Å; S1194-Q1196 PolarHBondContact OG-OE1 3.32Å
1195	V	87.2	Confident	88.1	Confident	37 Å²	37	47.9 Å²	47.9	22%	0.224	25%	0.247	C	C	.	.	S	Bend	trans	-76.9	-13.7	172.4	-176.9	0	0	0	0	111.3	R1203 P1206 I1210 F1244	V1195-R1203 PolarHBondContact O-NH1 3.01Å; V1195-P1206 HydrophobicContact CG2-CG 4.48Å; V1195-I1210 HydrophobicContact CG2-CD1 4.49Å; V1195-F1244 WeakPolarHBondContact CG2-O 3.43Å; V1195-F1244 PolarHBondContact N-O 3.28Å
1196	Q	81	Confident	87.9	Confident	11 Å²	11	48.5 Å²	48.5	5%	0.051	25%	0.25	C	S	.	.	S	Bend	trans	-109.9	141.4	171	-51.4	93.6	-4.5	0	0	112.1	S1194 G1198 D1201 F1243	S1194-Q1196 VanDerWaalsContact CB-O 3.32Å; S1194-Q1196 WeakPolarHBondContact CB-O 3.4Å; S1194-Q1196 PolarHBondContact OG-N 2.79Å; S1194-Q1196 VanDerWaalsContact OG-N 3.1Å; S1194-Q1196 PolarHBondContact OG-O 3.39Å; S1194-Q1196 PolarHBondContact OG-OE1 3.32Å; Q1196-G1198 VanDerWaalsContact C-N 3.32Å; Q1196-G1198 PolarHBondContact O-N 2.96Å; Q1196-D1201 HydrophobicContact CG-CB 4.37Å; Q1196-D1201 PolarHBondContact NE2-O 2.99Å; Q1196-D1201 PolarHBondContact NE2-OD1 3.13Å; Q1196-F1243 PolarHBondContact NE2-O 2.9Å; Q1196-F1243 PolarHBondContact OE1-O 3Å
1197	D	76.3	Confident	87.6	Confident	136 Å²	136	47.9 Å²	47.9	73%	0.727	25%	0.252	S	S	*	.	S	Bend	trans	-78.6	77.1	169.4	-176.8	11.5	0	0	0	110.6	R1171	R1171-D1197 WeakPolarHBondContact CD-OD1 3.48Å; R1171-D1197 IonicContact NH1-OD1 2.85Å; R1171-D1197 PolarHBondContact NH1-OD1 3.18Å
1198	G	78.3	Confident	87.3	Confident	6 Å²	6	51.1 Å²	51.1	6%	0.062	29%	0.286	C	S	.	.	S	Bend	trans	133.3	-129.9	176.5	0	0	0	0	0	114.2	I1170 Q1196	I1170-G1198 VanDerWaalsContact CD1-O 3.28Å; I1170-G1198 WeakPolarHBondContact CD1-O 3.45Å; Q1196-G1198 VanDerWaalsContact C-N 3.32Å; Q1196-G1198 PolarHBondContact O-N 2.96Å
1199	Q	80.5	Confident	87	Confident	55 Å²	55	50 Å²	50	26%	0.257	28%	0.283	S	S	.	.	S	Bend	trans	-63.7	147.1	177	-59.9	175.5	-76.7	0	0	110.5	S1115 A1120	S1115-Q1199 PolarHBondContact O-NE2 3.24Å; S1115-Q1199 VanDerWaalsContact O-NE2 3.12Å; A1120-Q1199 PolarHBondContact O-NE2 2.83Å
1200	A	82.4	Confident	86.7	Confident	6 Å²	6	50.6 Å²	50.6	5%	0.05	29%	0.286	C	S	.	.			trans	-65.2	150.4	177.3	0	0	0	0	0	111.4	S1116 P1118 F1243 F1244	S1116-A1200 PolarHBondContact O-N 3.48Å; P1118-A1200 WeakPolarHBondContact CA-O 3.48Å; P1118-A1200 WeakPolarHBondContact CB-O 3.44Å; P1118-A1200 HydrophobicContact CG-CB 4.15Å; P1118-A1200 WeakPolarHBondContact CG-O 3.46Å; A1200-F1243 HydrophobicContact CB-CB 3.83Å; A1200-F1244 HydrophobicContact CB-CD1 3.75Å; A1200-F1244 HydrophobicContact CB-CD2 4.45Å; A1200-F1244 HydrophobicContact CB-CE1 3.69Å; A1200-F1244 HydrophobicContact CB-CE2 4.38Å; A1200-F1244 HydrophobicContact CB-CG 4.15Å; A1200-F1244 HydrophobicContact CB-CZ 4.01Å
1201	D	83.2	Confident	86.5	Confident	51 Å²	51	50.8 Å²	50.8	27%	0.273	29%	0.287	S	S	.	.			trans	-128.4	-173.8	169.3	76	16.4	0	0	0	111.7	Q1196 R1203 F1243	Q1196-D1201 HydrophobicContact CG-CB 4.37Å; Q1196-D1201 PolarHBondContact NE2-O 2.99Å; Q1196-D1201 PolarHBondContact NE2-OD1 3.13Å; D1201-R1203 VanDerWaalsContact CG-NE 3.33Å; D1201-R1203 VanDerWaalsContact OD1-CB 3.27Å; D1201-R1203 WeakPolarHBondContact OD1-CB 3.31Å; D1201-R1203 WeakPolarHBondContact OD1-CD 3.17Å; D1201-R1203 WeakPolarHBondContact OD1-CG 3.14Å; D1201-R1203 IonicContact OD1-CZ 3.5Å; D1201-R1203 PolarHBondContact OD1-N 3.03Å; D1201-R1203 IonicContact OD1-NE 3.59Å; D1201-R1203 PolarHBondContact OD1-NE 2.89Å; D1201-R1203 IonicContact OD2-CZ 3.8Å; D1201-R1203 VanDerWaalsContact OD2-CZ 3.23Å; D1201-R1203 IonicContact OD2-NE 2.72Å; D1201-R1203 PolarHBondContact OD2-NE 2.87Å; D1201-R1203 IonicContact OD2-NH2 3.37Å; D1201-R1203 PolarHBondContact OD2-NH2 3.33Å; D1201-F1243 WeakPolarHBondContact O-CB 3.5Å
1202	R	86.4	Confident	86.4	Confident	133 Å²	133	55.7 Å²	55.7	50%	0.502	31%	0.313	S	S	.	.	S	Bend	trans	-99.6	24.2	-175.5	-63.3	179.3	174.5	88.8	-1.9	113.8	P1118 D1119 F1243	P1118-R1202 HydrophobicContact CB-CG 4.37Å; D1119-R1202 IonicContact OD1-CZ 3.34Å; D1119-R1202 VanDerWaalsContact OD1-CZ 3.23Å; D1119-R1202 IonicContact OD1-NH1 3.96Å; D1119-R1202 PolarHBondContact OD1-NH1 3.41Å; D1119-R1202 IonicContact OD1-NH2 3.18Å; D1119-R1202 PolarHBondContact OD1-NH2 3.12Å; D1119-R1202 IonicContact OD2-CZ 3.52Å; D1119-R1202 IonicContact OD2-NH1 3.03Å; D1119-R1202 IonicContact OD2-NH2 3.21Å; D1119-R1202 PolarHBondContact OD2-NH2 3.37Å; R1202-F1243 HydrophobicContact CG-CE1 4.33Å
1203	R	87.1	Confident	86.2	Confident	114 Å²	114	58.8 Å²	58.8	43%	0.43	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-67	163.4	177.8	73.1	-174.6	57.8	-171.4	-5.4	113.1	V1195 D1201 G1246 A1247	V1195-R1203 PolarHBondContact O-NH1 3.01Å; D1201-R1203 VanDerWaalsContact CG-NE 3.33Å; D1201-R1203 VanDerWaalsContact OD1-CB 3.27Å; D1201-R1203 WeakPolarHBondContact OD1-CB 3.31Å; D1201-R1203 WeakPolarHBondContact OD1-CD 3.17Å; D1201-R1203 WeakPolarHBondContact OD1-CG 3.14Å; D1201-R1203 IonicContact OD1-CZ 3.5Å; D1201-R1203 PolarHBondContact OD1-N 3.03Å; D1201-R1203 IonicContact OD1-NE 3.59Å; D1201-R1203 PolarHBondContact OD1-NE 2.89Å; D1201-R1203 IonicContact OD2-CZ 3.8Å; D1201-R1203 VanDerWaalsContact OD2-CZ 3.23Å; D1201-R1203 IonicContact OD2-NE 2.72Å; D1201-R1203 PolarHBondContact OD2-NE 2.87Å; D1201-R1203 IonicContact OD2-NH2 3.37Å; D1201-R1203 PolarHBondContact OD2-NH2 3.33Å; R1203-G1246 CarbonylContact O-C 3.59Å; R1203-G1246 VanDerWaalsContact O-CA 3.32Å; R1203-G1246 WeakPolarHBondContact O-CA 3.48Å; R1203-A1247 PolarHBondContact O-N 2.91Å
1204	E	85.6	Confident	86.2	Confident	172 Å²	172	58.3 Å²	58.3	80%	0.804	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-75.8	158	167.9	-62.3	-171	157	0	0	111.3
1205	A	84.7	Confident	86.4	Confident	35 Å²	35	57.6 Å²	57.6	29%	0.289	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-66.8	151.2	175.4	0	0	0	0	0	111	L1245 T1251	A1205-L1245 WeakPolarHBondContact CA-O 3.14Å; A1205-L1245 WeakPolarHBondContact CB-O 3.42Å; A1205-T1251 HydrophobicContact CB-CG2 3.94Å
1206	P	86.2	Confident	86.7	Confident	41 Å²	41	58.7 Å²	58.7	27%	0.266	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-65	150.9	175.4	30	-36.1	0	0	0	111.2	V1195 I1210	V1195-P1206 HydrophobicContact CG2-CG 4.48Å; P1206-I1210 HydrophobicContact CG-CD1 4.33Å
1207	A	84.4	Confident	87.3	Confident	97 Å²	97	60.4 Å²	60.4	80%	0.802	34%	0.341	S	S	*	.	S	Bend	trans	-65.4	142.2	178.3	0	0	0	0	0	112	H1213	A1207-H1213 PolarHBondContact O-NE2 2.89Å
1208	G	85.7	Confident	88.2	Confident	71 Å²	71	53.9 Å²	53.9	73%	0.732	31%	0.306	S	S	*	.	S	Bend	trans	112.7	-165.3	-174.5	0	0	0	0	0	112.2
1209	D	89.1	Confident	89	Confident	50 Å²	50	57.1 Å²	57.1	27%	0.267	32%	0.322	S	S	.	.			trans	-84	129.6	168.5	-173.9	0.5	0	0	0	109.7	M1211 D1212 H1213 R1258	D1209-M1211 PolarHBondContact O-N 3.39Å; D1209-M1211 PolarHBondContact OD1-N 3.27Å; D1209-M1211 VanDerWaalsContact OD1-N 3.12Å; D1209-D1212 PolarHBondContact O-N 2.68Å; D1209-H1213 PolarHBondContact O-CD2 3.46Å; D1209-R1258 VanDerWaalsContact CG-NH1 3.27Å; D1209-R1258 IonicContact OD1-NH1 2.96Å; D1209-R1258 PolarHBondContact OD1-NH1 2.78Å; D1209-R1258 VanDerWaalsContact OD1-NH1 3.07Å; D1209-R1258 IonicContact OD2-CZ 3.24Å; D1209-R1258 IonicContact OD2-NH1 2.71Å; D1209-R1258 PolarHBondContact OD2-NH1 2.84Å; D1209-R1258 IonicContact OD2-NH2 2.67Å; D1209-R1258 PolarHBondContact OD2-NH2 2.77Å
1210	I	91.8	Very high	89.7	Confident	12 Å²	12	57.6 Å²	57.6	6%	0.062	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-29.3	178	-169.1	65.6	0	0	0	112	V1195 P1206 D1212 H1213 I1214 L1245 T1251 V1255	V1195-I1210 HydrophobicContact CG2-CD1 4.49Å; P1206-I1210 HydrophobicContact CG-CD1 4.33Å; I1210-D1212 VanDerWaalsContact C-N 3.34Å; I1210-D1212 PolarHBondContact O-N 3.13Å; I1210-H1213 PolarHBondContact O-N 2.93Å; I1210-I1214 HydrophobicContact CG1-CD1 3.87Å; I1210-I1214 HydrophobicContact CG1-CG1 4.36Å; I1210-I1214 WeakPolarHBondContact O-CD1 3.45Å; I1210-I1214 VanDerWaalsContact O-CG1 3.27Å; I1210-I1214 WeakPolarHBondContact O-CG1 3.38Å; I1210-I1214 PolarHBondContact O-N 3.19Å; I1210-L1245 HydrophobicContact CD1-CD2 4.24Å; I1210-L1245 HydrophobicContact CG1-CD2 4.18Å; I1210-T1251 HydrophobicContact CB-CG2 3.94Å; I1210-T1251 HydrophobicContact CD1-CG2 4.03Å; I1210-T1251 HydrophobicContact CG1-CG2 3.67Å; I1210-T1251 HydrophobicContact CG2-CG2 4.12Å; I1210-V1255 HydrophobicContact CG1-CG2 4.29Å; I1210-V1255 HydrophobicContact CG2-CG2 3.76Å
1211	M	93.1	Very high	90.2	Very high	4 Å²	4	59.7 Å²	59.7	2%	0.02	34%	0.342	C	S	.	.	H	α-helix	trans	-66.7	-34	178.3	-66.2	-59.5	-64.8	0	0	112.7	D1209 I1214 A1215 V1255 R1258 E1261 L1262	D1209-M1211 PolarHBondContact O-N 3.39Å; D1209-M1211 PolarHBondContact OD1-N 3.27Å; D1209-M1211 VanDerWaalsContact OD1-N 3.12Å; M1211-I1214 HydrophobicContact SD-CD1 4.19Å; M1211-A1215 VanDerWaalsContact O-CB 3.23Å; M1211-A1215 WeakPolarHBondContact O-CB 3.46Å; M1211-A1215 PolarHBondContact O-N 2.75Å; M1211-V1255 HydrophobicContact SD-CB 4.39Å; M1211-V1255 HydrophobicContact SD-CG1 4.45Å; M1211-V1255 HydrophobicContact SD-CG2 4.01Å; M1211-R1258 HydrophobicContact CE-CB 4.13Å; M1211-R1258 WeakPolarHBondContact CE-O 3.47Å; M1211-R1258 HydrophobicContact CG-CB 4.29Å; M1211-R1258 VanDerWaalsContact CG-CZ 3.49Å; M1211-R1258 HydrophobicContact SD-CB 4.2Å; M1211-E1261 HydrophobicContact CE-CB 4.04Å; M1211-L1262 HydrophobicContact CE-CD1 4.32Å; M1211-L1262 HydrophobicContact CE-CD2 4Å; M1211-L1262 HydrophobicContact CE-CG 3.89Å
1212	D	92	Very high	90.8	Very high	103 Å²	103	57.6 Å²	57.6	55%	0.551	33%	0.33	S	S	*	.	H	α-helix	trans	-67.3	-42.4	174.9	-74.1	-38.2	0	0	0	111.4	D1209 I1210 A1215 A1216	D1209-D1212 PolarHBondContact O-N 2.68Å; I1210-D1212 VanDerWaalsContact C-N 3.34Å; I1210-D1212 PolarHBondContact O-N 3.13Å; D1212-A1215 PolarHBondContact O-N 3.4Å; D1212-A1216 VanDerWaalsContact O-CB 3.31Å; D1212-A1216 WeakPolarHBondContact O-CB 3.42Å; D1212-A1216 PolarHBondContact O-N 3.33Å
1213	H	91.5	Very high	91.2	Very high	72 Å²	72	54.1 Å²	54.1	33%	0.333	33%	0.33	S	S	.	.	H	α-helix	trans	-61.7	-48.2	175.4	-72.5	-82.6	0	0	0	111.7	A1207 D1209 I1210 A1215 A1216 F1217	A1207-H1213 PolarHBondContact O-NE2 2.89Å; D1209-H1213 PolarHBondContact O-CD2 3.46Å; I1210-H1213 PolarHBondContact O-N 2.93Å; H1213-A1215 VanDerWaalsContact C-N 3.34Å; H1213-A1215 PolarHBondContact O-N 2.81Å; H1213-A1216 PolarHBondContact O-N 2.81Å; H1213-F1217 PolarHBondContact O-N 2.98Å; H1213-F1217 VanDerWaalsContact O-N 3.09Å
1214	I	94.2	Very high	91.6	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.9	-45.8	176.7	-69.3	161.1	0	0	0	110.8	H1193 I1210 M1211 F1217 F1218 P1239 L1245 V1255 L1262	H1193-I1214 WeakPolarHBondContact ND1-CG1 3.42Å; I1210-I1214 HydrophobicContact CG1-CD1 3.87Å; I1210-I1214 HydrophobicContact CG1-CG1 4.36Å; I1210-I1214 WeakPolarHBondContact O-CD1 3.45Å; I1210-I1214 VanDerWaalsContact O-CG1 3.27Å; I1210-I1214 WeakPolarHBondContact O-CG1 3.38Å; I1210-I1214 PolarHBondContact O-N 3.19Å; M1211-I1214 HydrophobicContact SD-CD1 4.19Å; I1214-F1217 PolarHBondContact O-N 3.44Å; I1214-F1218 HydrophobicContact CG2-CD2 3.67Å; I1214-F1218 HydrophobicContact CG2-CE2 3.43Å; I1214-F1218 VanDerWaalsContact CG2-CE2 3.43Å; I1214-F1218 VanDerWaalsContact O-CD2 3.25Å; I1214-F1218 WeakPolarHBondContact O-CD2 3.37Å; I1214-F1218 PolarHBondContact O-N 3.25Å; I1214-F1218 VanDerWaalsContact O-N 3.09Å; I1214-P1239 HydrophobicContact CD1-CB 4.12Å; I1214-P1239 HydrophobicContact CG2-CB 3.97Å; I1214-L1245 HydrophobicContact CD1-CD2 4.2Å; I1214-L1245 HydrophobicContact CG1-CD2 4.5Å; I1214-V1255 HydrophobicContact CD1-CG1 4.27Å; I1214-V1255 HydrophobicContact CD1-CG2 3.5Å; I1214-V1255 VanDerWaalsContact CD1-CG2 3.5Å; I1214-L1262 HydrophobicContact CG2-CD1 3.84Å; I1214-L1262 HydrophobicContact CG2-CD2 3.83Å
1215	A	93.4	Very high	92	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.033	29%	0.286	C	S	.	.	H	α-helix	trans	-69.7	-40.9	-177.4	0	0	0	0	0	112.5	M1211 D1212 H1213 F1217 F1218 D1219 L1262 F1266	M1211-A1215 VanDerWaalsContact O-CB 3.23Å; M1211-A1215 WeakPolarHBondContact O-CB 3.46Å; M1211-A1215 PolarHBondContact O-N 2.75Å; D1212-A1215 PolarHBondContact O-N 3.4Å; H1213-A1215 VanDerWaalsContact C-N 3.34Å; H1213-A1215 PolarHBondContact O-N 2.81Å; A1215-F1217 VanDerWaalsContact C-N 3.32Å; A1215-F1217 PolarHBondContact O-N 2.8Å; A1215-F1218 PolarHBondContact O-N 3.03Å; A1215-F1218 VanDerWaalsContact O-N 3.14Å; A1215-D1219 PolarHBondContact O-N 2.86Å; A1215-L1262 HydrophobicContact CB-CD2 4.37Å; A1215-F1266 HydrophobicContact CB-CE2 4.49Å; A1215-F1266 HydrophobicContact CB-CZ 4.41Å
1216	A	93	Very high	92.5	Very high	60 Å²	60	42.9 Å²	42.9	50%	0.496	29%	0.286	S	S	.	.	H	α-helix	trans	-61.7	-38.8	175.4	0	0	0	0	0	112.4	D1212 H1213 A1220	D1212-A1216 VanDerWaalsContact O-CB 3.31Å; D1212-A1216 WeakPolarHBondContact O-CB 3.42Å; D1212-A1216 PolarHBondContact O-N 3.33Å; H1213-A1216 PolarHBondContact O-N 2.81Å; A1216-A1220 PolarHBondContact O-N 2.87Å
1217	F	94.5	Very high	92.8	Very high	46 Å²	46	44.2 Å²	44.2	20%	0.202	31%	0.308	C	S	.	.	H	α-helix	trans	-60.6	-45.8	171.3	169.2	-91.7	0	0	0	111.9	V1191 M1192 H1193 H1213 I1214 A1215 A1220 R1221	V1191-F1217 HydrophobicContact CG1-CE1 4.16Å; M1192-F1217 WeakPolarHBondContact O-CE1 3.36Å; M1192-F1217 WeakPolarHBondContact O-CZ 3.44Å; H1193-F1217 HydrophobicContact CB-CD1 3.7Å; H1193-F1217 HydrophobicContact CB-CE1 3.85Å; H1193-F1217 HydrophobicContact CB-CG 4.35Å; H1193-F1217 AromaticContact CD2-CD1 3.98Å; H1193-F1217 AromaticContact CD2-CG 3.73Å; H1213-F1217 PolarHBondContact O-N 2.98Å; H1213-F1217 VanDerWaalsContact O-N 3.09Å; I1214-F1217 PolarHBondContact O-N 3.44Å; A1215-F1217 VanDerWaalsContact C-N 3.32Å; A1215-F1217 PolarHBondContact O-N 2.8Å; F1217-A1220 PolarHBondContact O-N 2.99Å; F1217-R1221 WeakPolarHBondContact O-CB 3.42Å; F1217-R1221 PolarHBondContact O-N 2.52Å
1218	F	96.1	Very high	93.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-68.8	-40.6	-179.2	-76.5	-47	0	0	0	113.4	V1191 H1193 I1214 A1215 A1220 R1221 I1222 L1237 D1238 L1262 F1266	V1191-F1218 HydrophobicContact CB-CE1 4.34Å; V1191-F1218 HydrophobicContact CG1-CD1 4.34Å; V1191-F1218 HydrophobicContact CG1-CE1 4.05Å; V1191-F1218 WeakPolarHBondContact O-CE1 3.41Å; H1193-F1218 HydrophobicContact CB-CE2 4.47Å; H1193-F1218 HydrophobicContact CB-CZ 4.16Å; I1214-F1218 HydrophobicContact CG2-CD2 3.67Å; I1214-F1218 HydrophobicContact CG2-CE2 3.43Å; I1214-F1218 VanDerWaalsContact CG2-CE2 3.43Å; I1214-F1218 VanDerWaalsContact O-CD2 3.25Å; I1214-F1218 WeakPolarHBondContact O-CD2 3.37Å; I1214-F1218 PolarHBondContact O-N 3.25Å; I1214-F1218 VanDerWaalsContact O-N 3.09Å; A1215-F1218 PolarHBondContact O-N 3.03Å; A1215-F1218 VanDerWaalsContact O-N 3.14Å; F1218-A1220 VanDerWaalsContact C-N 3.33Å; F1218-A1220 PolarHBondContact O-N 3.25Å; F1218-R1221 PolarHBondContact O-N 2.9Å; F1218-I1222 HydrophobicContact CB-CD1 4.04Å; F1218-I1222 VanDerWaalsContact O-CB 3.22Å; F1218-I1222 WeakPolarHBondContact O-CB 3.36Å; F1218-I1222 WeakPolarHBondContact O-CD1 3.28Å; F1218-I1222 WeakPolarHBondContact O-CG1 3.16Å; F1218-I1222 PolarHBondContact O-N 3.47Å; F1218-L1237 HydrophobicContact CD1-CD2 3.75Å; F1218-L1237 HydrophobicContact CD2-CD1 4.37Å; F1218-L1237 HydrophobicContact CE1-CB 4.03Å; F1218-L1237 HydrophobicContact CE1-CD2 3.84Å; F1218-L1237 HydrophobicContact CE1-CG 4.41Å; F1218-L1237 HydrophobicContact CE2-CB 4.16Å; F1218-L1237 HydrophobicContact CG-CD1 4.37Å; F1218-L1237 HydrophobicContact CG-CD2 4.33Å; F1218-L1237 HydrophobicContact CZ-CB 3.8Å; F1218-L1237 HydrophobicContact CZ-CD2 4.45Å; F1218-D1238 WeakPolarHBondContact CZ-O 3.42Å; F1218-L1262 HydrophobicContact CD2-CD2 4.38Å; F1218-L1262 HydrophobicContact CE2-CD1 4.22Å; F1218-F1266 HydrophobicContact CB-CD2 4.33Å; F1218-F1266 HydrophobicContact CB-CE1 4.07Å; F1218-F1266 HydrophobicContact CB-CE2 3.6Å; F1218-F1266 HydrophobicContact CB-CZ 3.46Å; F1218-F1266 VanDerWaalsContact CB-CZ 3.46Å; F1218-F1266 HydrophobicContact CD2-CE2 4.17Å; F1218-F1266 HydrophobicContact CG-CE2 4.29Å
1219	D	94.1	Very high	93.4	Very high	73 Å²	73	40.5 Å²	40.5	39%	0.39	28%	0.275	S	S	.	.	H	α-helix	trans	-53.5	-51.6	172.7	-83.3	-52.1	0	0	0	110.9	A1215 A1223 R1265 F1266	A1215-D1219 PolarHBondContact O-N 2.86Å; D1219-A1223 VanDerWaalsContact O-CB 3.32Å; D1219-A1223 WeakPolarHBondContact O-CB 3.22Å; D1219-A1223 PolarHBondContact O-N 2.94Å; D1219-A1223 VanDerWaalsContact O-N 3.14Å; D1219-R1265 IonicContact OD2-CZ 2.69Å; D1219-R1265 IonicContact OD2-NE 3.91Å; D1219-R1265 PolarHBondContact OD2-NE 2.9Å; D1219-R1265 IonicContact OD2-NH2 2.93Å; D1219-R1265 PolarHBondContact OD2-NH2 2.76Å; D1219-F1266 WeakPolarHBondContact OD1-CE1 3.24Å
1220	A	94.4	Very high	93.6	Very high	65 Å²	65	38.2 Å²	38.2	54%	0.537	26%	0.263	S	S	.	.	H	α-helix	trans	-63.9	-44.9	179.3	0	0	0	0	0	112.9	A1216 F1217 F1218 A1224	A1216-A1220 PolarHBondContact O-N 2.87Å; F1217-A1220 PolarHBondContact O-N 2.99Å; F1218-A1220 VanDerWaalsContact C-N 3.33Å; F1218-A1220 PolarHBondContact O-N 3.25Å; A1220-A1224 PolarHBondContact O-N 2.97Å; A1220-A1224 VanDerWaalsContact O-N 3.07Å
1221	R	94.8	Very high	93.7	Very high	51 Å²	51	44.7 Å²	44.7	19%	0.192	29%	0.291	C	S	.	.	H	α-helix	trans	-75.2	-38.3	-175.1	-169	58.3	63.3	-170.1	-3.9	113	G1172 F1173 P1174 Y1179 V1191 F1217 F1218 A1223 A1224 L1225	G1172-R1221 WeakPolarHBondContact O-CD 3.31Å; G1172-R1221 VanDerWaalsContact O-CG 3.24Å; G1172-R1221 WeakPolarHBondContact O-CG 3.23Å; G1172-R1221 PolarHBondContact O-NE 3.13Å; F1173-R1221 PolarHBondContact O-NH1 3.38Å; F1173-R1221 VanDerWaalsContact O-NH1 3.1Å; P1174-R1221 PolarHBondContact O-NH1 2.87Å; Y1179-R1221 PolarHBondContact OH-NH1 2.85Å; V1191-R1221 HydrophobicContact CG1-CB 4.42Å; V1191-R1221 HydrophobicContact CG1-CG 3.7Å; F1217-R1221 WeakPolarHBondContact O-CB 3.42Å; F1217-R1221 PolarHBondContact O-N 2.52Å; F1218-R1221 PolarHBondContact O-N 2.9Å; R1221-A1223 VanDerWaalsContact C-N 3.33Å; R1221-A1224 PolarHBondContact O-N 3.43Å; R1221-L1225 HydrophobicContact CG-CD1 3.98Å; R1221-L1225 HydrophobicContact CG-CG 4.43Å; R1221-L1225 WeakPolarHBondContact O-CG 3.16Å; R1221-L1225 PolarHBondContact O-N 2.83Å
1222	I	95.5	Very high	93.7	Very high	6 Å²	6	49.9 Å²	49.9	3%	0.031	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-42.2	174.4	-65.1	162.3	0	0	0	109.6	F1218 T1226 L1235 L1237 F1266 L1268	F1218-I1222 HydrophobicContact CB-CD1 4.04Å; F1218-I1222 VanDerWaalsContact O-CB 3.22Å; F1218-I1222 WeakPolarHBondContact O-CB 3.36Å; F1218-I1222 WeakPolarHBondContact O-CD1 3.28Å; F1218-I1222 WeakPolarHBondContact O-CG1 3.16Å; F1218-I1222 PolarHBondContact O-N 3.47Å; I1222-T1226 HydrophobicContact CG2-CG2 4.13Å; I1222-T1226 WeakPolarHBondContact O-CB 3.19Å; I1222-T1226 WeakPolarHBondContact O-CG2 3.34Å; I1222-T1226 PolarHBondContact O-N 2.87Å; I1222-T1226 PolarHBondContact O-OG1 2.91Å; I1222-L1235 HydrophobicContact CG1-CD1 4.36Å; I1222-L1235 HydrophobicContact CG2-CD1 4.12Å; I1222-L1237 HydrophobicContact CD1-CD1 4.42Å; I1222-L1237 HydrophobicContact CD1-CD2 4.06Å; I1222-L1237 HydrophobicContact CG1-CD2 4.34Å; I1222-F1266 HydrophobicContact CD1-CB 4.32Å; I1222-F1266 HydrophobicContact CD1-CD1 3.48Å; I1222-F1266 VanDerWaalsContact CD1-CD1 3.48Å; I1222-F1266 HydrophobicContact CD1-CE1 3.88Å; I1222-F1266 HydrophobicContact CD1-CG 3.88Å; I1222-L1268 HydrophobicContact CD1-CD1 3.67Å; I1222-L1268 HydrophobicContact CG1-CD1 4.07Å; I1222-L1268 HydrophobicContact CG2-CD1 4.47Å
1223	A	94.4	Very high	93.6	Very high	60 Å²	60	51 Å²	51	50%	0.496	32%	0.316	S	S	.	.	H	α-helix	trans	-59.5	-46.9	174.8	0	0	0	0	0	112	D1219 R1221 T1226 G1227	D1219-A1223 VanDerWaalsContact O-CB 3.32Å; D1219-A1223 WeakPolarHBondContact O-CB 3.22Å; D1219-A1223 PolarHBondContact O-N 2.94Å; D1219-A1223 VanDerWaalsContact O-N 3.14Å; R1221-A1223 VanDerWaalsContact C-N 3.33Å; A1223-T1226 PolarHBondContact O-OG1 2.81Å; A1223-G1227 PolarHBondContact O-N 2.94Å
1224	A	94.6	Very high	93.8	Very high	38 Å²	38	48.9 Å²	48.9	31%	0.314	31%	0.305	S	S	.	.	H	α-helix	trans	-62.6	-45.4	179.4	0	0	0	0	0	113.1	Y1179 A1220 R1221 A1228	Y1179-A1224 HydrophobicContact CE2-CB 4.15Å; A1220-A1224 PolarHBondContact O-N 2.97Å; A1220-A1224 VanDerWaalsContact O-N 3.07Å; R1221-A1224 PolarHBondContact O-N 3.43Å; A1224-A1228 PolarHBondContact O-N 3.16Å
1225	L	95	Very high	93.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-70.2	-41.6	-179.9	-66.9	170.8	0	0	0	112.1	F1173 Y1179 L1182 V1191 R1221 A1228 I1230 L1235	F1173-L1225 HydrophobicContact CB-CD2 4.2Å; Y1179-L1225 HydrophobicContact CD1-CD2 3.87Å; Y1179-L1225 HydrophobicContact CE1-CD2 3.5Å; Y1179-L1225 VanDerWaalsContact CE1-CD2 3.5Å; L1182-L1225 HydrophobicContact CD1-CD2 4.32Å; V1191-L1225 HydrophobicContact CG2-CD1 3.82Å; R1221-L1225 HydrophobicContact CG-CD1 3.98Å; R1221-L1225 HydrophobicContact CG-CG 4.43Å; R1221-L1225 WeakPolarHBondContact O-CG 3.16Å; R1221-L1225 PolarHBondContact O-N 2.83Å; L1225-A1228 PolarHBondContact O-N 2.8Å; L1225-I1230 HydrophobicContact CB-CD1 4.09Å; L1225-I1230 HydrophobicContact CD2-CD1 3.64Å; L1225-I1230 HydrophobicContact CG-CD1 4.46Å; L1225-I1230 VanDerWaalsContact O-CB 3.29Å; L1225-I1230 WeakPolarHBondContact O-CB 3.45Å; L1225-I1230 PolarHBondContact O-N 2.82Å; L1225-L1235 HydrophobicContact CB-CD2 4.43Å; L1225-L1235 HydrophobicContact CD1-CD2 3.98Å
1226	T	94.3	Very high	94	Very high	47 Å²	47	48.7 Å²	48.7	29%	0.288	30%	0.304	S	S	.	.	H	α-helix	trans	-72.3	-34.3	178.9	56.1	0	0	0	0	112.6	I1222 A1223 A1228 G1229 R1232 L1235	I1222-T1226 HydrophobicContact CG2-CG2 4.13Å; I1222-T1226 WeakPolarHBondContact O-CB 3.19Å; I1222-T1226 WeakPolarHBondContact O-CG2 3.34Å; I1222-T1226 PolarHBondContact O-N 2.87Å; I1222-T1226 PolarHBondContact O-OG1 2.91Å; A1223-T1226 PolarHBondContact O-OG1 2.81Å; T1226-A1228 PolarHBondContact O-N 3.36Å; T1226-G1229 PolarHBondContact O-N 3.06Å; T1226-R1232 HydrophobicContact CG2-CG 3.68Å; T1226-L1235 HydrophobicContact CG2-CD1 4.21Å
1227	G	92.6	Very high	94.1	Very high	70 Å²	70	45.9 Å²	45.9	72%	0.722	28%	0.28	S	S	*	.	H	α-helix	trans	-61.1	-29.1	170.4	0	0	0	0	0	113.4	A1223 G1229	A1223-G1227 PolarHBondContact O-N 2.94Å; G1227-G1229 PolarHBondContact O-N 2.72Å
1228	A	92.4	Very high	94.1	Very high	36 Å²	36	43.8 Å²	43.8	30%	0.298	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	11.2	172.2	0	0	0	0	0	114.4	Y1179 A1224 L1225 T1226	Y1179-A1228 HydrophobicContact CD2-CB 3.61Å; Y1179-A1228 HydrophobicContact CG-CB 4.05Å; A1224-A1228 PolarHBondContact O-N 3.16Å; L1225-A1228 PolarHBondContact O-N 2.8Å; T1226-A1228 PolarHBondContact O-N 3.36Å
1229	G	91.3	Very high	94.1	Very high	53 Å²	53	43.8 Å²	43.8	55%	0.546	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	5.4	176.7	0	0	0	0	0	115.3	T1226 G1227 K1231	T1226-G1229 PolarHBondContact O-N 3.06Å; G1227-G1229 PolarHBondContact O-N 2.72Å; G1229-K1231 PolarHBondContact O-N 2.77Å
1230	I	93.8	Very high	93.9	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	25%	0.253	C	S	.	.			trans	-75	116	175.8	-56	165.3	0	0	0	108.5	L1182 A1183 L1189 L1225 R1232 R1234 L1235	L1182-I1230 HydrophobicContact CB-CD1 3.68Å; L1182-I1230 HydrophobicContact CB-CG1 4.35Å; L1182-I1230 HydrophobicContact CD1-CD1 4.11Å; A1183-I1230 HydrophobicContact CB-CG1 4.2Å; L1189-I1230 HydrophobicContact CD1-CD1 4.1Å; L1189-I1230 HydrophobicContact CD1-CG2 3.89Å; L1225-I1230 HydrophobicContact CB-CD1 4.09Å; L1225-I1230 HydrophobicContact CD2-CD1 3.64Å; L1225-I1230 HydrophobicContact CG-CD1 4.46Å; L1225-I1230 VanDerWaalsContact O-CB 3.29Å; L1225-I1230 WeakPolarHBondContact O-CB 3.45Å; L1225-I1230 PolarHBondContact O-N 2.82Å; I1230-R1232 PolarHBondContact O-N 2.88Å; I1230-R1234 HydrophobicContact CG2-CB 4.43Å; I1230-L1235 HydrophobicContact CG2-CD2 4.03Å
1231	K	92.1	Very high	93.8	Very high	149 Å²	149	37.3 Å²	37.3	65%	0.648	23%	0.227	S	C	*	.			trans	-64.4	134.1	-176.5	-60.8	-175.3	179.6	-177.1	0	111.3	G1229 N1233 R1234	G1229-K1231 PolarHBondContact O-N 2.77Å; K1231-N1233 VanDerWaalsContact CB-OD1 3.29Å; K1231-N1233 WeakPolarHBondContact CB-OD1 3.48Å; K1231-N1233 PolarHBondContact O-N 2.83Å; K1231-N1233 VanDerWaalsContact O-N 3.08Å; K1231-R1234 WeakPolarHBondContact O-CB 3.32Å; K1231-R1234 PolarHBondContact O-N 2.86Å
1232	R	93.1	Very high	93.5	Very high	113 Å²	113	34.9 Å²	34.9	43%	0.426	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-47	-41.3	179.1	-73.6	-173.6	78.2	96	-2.9	113.4	T1226 I1230 R1234 L1235 F1266 L1268	T1226-R1232 HydrophobicContact CG2-CG 3.68Å; I1230-R1232 PolarHBondContact O-N 2.88Å; R1232-R1234 PolarHBondContact O-N 2.85Å; R1232-L1235 WeakPolarHBondContact O-CB 3.45Å; R1232-L1235 PolarHBondContact O-N 2.99Å; R1232-F1266 PolarHBondContact NH2-O 3.37Å; R1232-L1268 HydrophobicContact CB-CD2 4.18Å; R1232-L1268 VanDerWaalsContact O-CD2 3.24Å; R1232-L1268 WeakPolarHBondContact O-CD2 3.29Å
1233	N	91.3	Very high	93.3	Very high	127 Å²	127	37.1 Å²	37.1	68%	0.679	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-68.1	-2.8	-179.6	74.4	-26.2	0	0	0	115.5	K1231	K1231-N1233 VanDerWaalsContact CB-OD1 3.29Å; K1231-N1233 WeakPolarHBondContact CB-OD1 3.48Å; K1231-N1233 PolarHBondContact O-N 2.83Å; K1231-N1233 VanDerWaalsContact O-N 3.08Å
1234	R	94.3	Very high	93.1	Very high	26 Å²	26	35.1 Å²	35.1	10%	0.098	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-91.6	-17.8	167.7	-66.5	178	59.2	-158.3	-8.6	113.1	L1182 S1185 A1187 K1188 L1189 I1230 K1231 R1232	L1182-R1234 VanDerWaalsContact O-CZ 3.29Å; L1182-R1234 PolarHBondContact O-NH1 3.33Å; L1182-R1234 PolarHBondContact O-NH2 2.9Å; S1185-R1234 PolarHBondContact O-NH1 3.48Å; S1185-R1234 PolarHBondContact O-NH2 2.95Å; S1185-R1234 PolarHBondContact OG-NH2 2.87Å; A1187-R1234 VanDerWaalsContact O-CZ 3.23Å; A1187-R1234 PolarHBondContact O-NE 3.13Å; A1187-R1234 PolarHBondContact O-NH2 3.16Å; K1188-R1234 CarbonylContact C-O 3.57Å; K1188-R1234 VanDerWaalsContact CA-O 3.23Å; K1188-R1234 WeakPolarHBondContact CA-O 3.19Å; K1188-R1234 WeakPolarHBondContact CB-O 3.48Å; L1189-R1234 PolarHBondContact N-O 2.96Å; I1230-R1234 HydrophobicContact CG2-CB 4.43Å; K1231-R1234 WeakPolarHBondContact O-CB 3.32Å; K1231-R1234 PolarHBondContact O-N 2.86Å; R1232-R1234 PolarHBondContact O-N 2.85Å
1235	L	96.1	Very high	92.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	144.6	-176.8	-53.4	-178.9	0	0	0	110.9	L1189 V1191 I1222 L1225 T1226 I1230 R1232 L1268 P1269	L1189-L1235 HydrophobicContact CB-CD2 4.26Å; L1189-L1235 HydrophobicContact CD1-CD2 4.28Å; V1191-L1235 HydrophobicContact CG2-CD2 4.39Å; I1222-L1235 HydrophobicContact CG1-CD1 4.36Å; I1222-L1235 HydrophobicContact CG2-CD1 4.12Å; L1225-L1235 HydrophobicContact CB-CD2 4.43Å; L1225-L1235 HydrophobicContact CD1-CD2 3.98Å; T1226-L1235 HydrophobicContact CG2-CD1 4.21Å; I1230-L1235 HydrophobicContact CG2-CD2 4.03Å; R1232-L1235 WeakPolarHBondContact O-CB 3.45Å; R1232-L1235 PolarHBondContact O-N 2.99Å; L1235-L1268 HydrophobicContact CB-CD1 4.13Å; L1235-L1268 HydrophobicContact CB-CD2 4.32Å; L1235-L1268 HydrophobicContact CD1-CD1 4.28Å; L1235-P1269 WeakPolarHBondContact O-CD 3.21Å; L1235-P1269 WeakPolarHBondContact O-CG 3.44Å
1236	V	95.7	Very high	92.6	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.4	171.4	-174.9	0	0	0	0	106.5	L1189 V1190 V1191 P1269 L1271 F1309	L1189-V1236 PolarHBondContact O-N 3.29Å; V1190-V1236 WeakPolarHBondContact CA-O 3.49Å; V1190-V1236 HydrophobicContact CG2-CB 4.17Å; V1190-V1236 HydrophobicContact CG2-CG1 4.44Å; V1191-V1236 PolarHBondContact N-O 3.26Å; V1236-P1269 WeakPolarHBondContact CA-O 3.37Å; V1236-P1269 HydrophobicContact CB-CG 4.49Å; V1236-P1269 HydrophobicContact CG1-CG 4.49Å; V1236-P1269 WeakPolarHBondContact CG1-O 3.47Å; V1236-P1269 HydrophobicContact CG2-CG 4.13Å; V1236-L1271 HydrophobicContact CG1-CB 3.78Å; V1236-F1309 HydrophobicContact CB-CE2 4.31Å; V1236-F1309 HydrophobicContact CG1-CD2 3.52Å; V1236-F1309 HydrophobicContact CG1-CE2 3.56Å; V1236-F1309 HydrophobicContact CG1-CG 4.48Å; V1236-F1309 HydrophobicContact CG2-CD2 4.48Å; V1236-F1309 HydrophobicContact CG2-CE2 3.7Å; V1236-F1309 HydrophobicContact CG2-CZ 4.08Å
1237	L	96.1	Very high	92.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.4	-177.3	-50.5	-175.4	0	0	0	110.1	F1218 I1222 F1266 L1268 P1269 V1270 L1271	F1218-L1237 HydrophobicContact CD1-CD2 3.75Å; F1218-L1237 HydrophobicContact CD2-CD1 4.37Å; F1218-L1237 HydrophobicContact CE1-CB 4.03Å; F1218-L1237 HydrophobicContact CE1-CD2 3.84Å; F1218-L1237 HydrophobicContact CE1-CG 4.41Å; F1218-L1237 HydrophobicContact CE2-CB 4.16Å; F1218-L1237 HydrophobicContact CG-CD1 4.37Å; F1218-L1237 HydrophobicContact CG-CD2 4.33Å; F1218-L1237 HydrophobicContact CZ-CB 3.8Å; F1218-L1237 HydrophobicContact CZ-CD2 4.45Å; I1222-L1237 HydrophobicContact CD1-CD1 4.42Å; I1222-L1237 HydrophobicContact CD1-CD2 4.06Å; I1222-L1237 HydrophobicContact CG1-CD2 4.34Å; L1237-F1266 HydrophobicContact CD1-CB 3.88Å; L1237-F1266 HydrophobicContact CD1-CD2 3.63Å; L1237-F1266 HydrophobicContact CD1-CE2 4.49Å; L1237-F1266 HydrophobicContact CD1-CG 3.95Å; L1237-L1268 HydrophobicContact CD1-CB 3.97Å; L1237-L1268 HydrophobicContact CD1-CD1 4.34Å; L1237-L1268 HydrophobicContact CD2-CD1 3.95Å; L1237-L1268 HydrophobicContact CG-CB 3.97Å; L1237-L1268 HydrophobicContact CG-CD1 4.29Å; L1237-P1269 PolarHBondContact N-O 3.32Å; L1237-V1270 CarbonylContact O-C 3.52Å; L1237-V1270 WeakPolarHBondContact O-CA 3.29Å; L1237-L1271 PolarHBondContact O-N 2.9Å
1238	D	95.1	Very high	92	Very high	3 Å²	3	32 Å²	32	2%	0.016	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	114.4	165.2	-177.4	-22.4	0	0	0	108.5	V1190 V1191 M1192 H1193 F1218 G1240 L1271	V1190-D1238 HydrophobicContact CG1-CB 3.97Å; V1191-D1238 PolarHBondContact O-N 3.24Å; M1192-D1238 CarbonylContact C-O 3.52Å; M1192-D1238 VanDerWaalsContact CA-O 3.22Å; M1192-D1238 WeakPolarHBondContact CA-O 3.44Å; M1192-D1238 HydrophobicContact CB-CB 4.33Å; M1192-D1238 HydrophobicContact CG-CB 3.88Å; H1193-D1238 PolarHBondContact N-O 3.46Å; F1218-D1238 WeakPolarHBondContact CZ-O 3.42Å; D1238-G1240 PolarHBondContact O-N 2.67Å; D1238-G1240 VanDerWaalsContact O-N 3.08Å; D1238-G1240 PolarHBondContact OD1-N 3.21Å; D1238-L1271 WeakPolarHBondContact CA-O 3.38Å; D1238-L1271 HydrophobicContact CB-CB 4.38Å; D1238-L1271 HydrophobicContact CB-CD2 4.12Å; D1238-L1271 WeakPolarHBondContact OD2-CD2 3.48Å
1239	P	94.3	Very high	91.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.175	C	C	.	.			trans	-66.5	-9.1	-177.5	28.6	-35.7	0	0	0	114.3	H1193 I1214 L1245 V1255 L1262 L1272	H1193-P1239 PolarHBondContact ND1-O 3.35Å; I1214-P1239 HydrophobicContact CD1-CB 4.12Å; I1214-P1239 HydrophobicContact CG2-CB 3.97Å; P1239-L1245 WeakPolarHBondContact O-CD2 3.47Å; P1239-V1255 HydrophobicContact CB-CG1 3.67Å; P1239-V1255 HydrophobicContact CG-CG1 3.61Å; P1239-L1262 HydrophobicContact CB-CD1 3.78Å; P1239-L1262 HydrophobicContact CG-CD1 4.29Å; P1239-L1272 HydrophobicContact CG-CD2 3.61Å
1240	G	91	Very high	91.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.			trans	82.1	156.5	-167	0	0	0	0	0	111.4	D1238 L1245	D1238-G1240 PolarHBondContact O-N 2.67Å; D1238-G1240 VanDerWaalsContact O-N 3.08Å; D1238-G1240 PolarHBondContact OD1-N 3.21Å; G1240-L1245 WeakPolarHBondContact O-CD1 3.33Å
1241	M	91.7	Very high	91.6	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.183	C	C	.	.			trans	-155.8	143.3	179.8	-80.4	-66.1	170.1	0	0	110.2	V1255 L1256 L1272 S1273 V1274 K1277 F1279	M1241-V1255 HydrophobicContact CE-CB 3.98Å; M1241-V1255 HydrophobicContact CE-CG1 3.61Å; M1241-L1256 HydrophobicContact CE-CB 3.88Å; M1241-L1256 HydrophobicContact CE-CD1 4.3Å; M1241-L1272 HydrophobicContact CE-CD2 3.87Å; M1241-S1273 VanDerWaalsContact CB-O 3.27Å; M1241-S1273 WeakPolarHBondContact CB-O 3.34Å; M1241-V1274 HydrophobicContact CG-CG1 4.21Å; M1241-V1274 HydrophobicContact SD-CG1 4.4Å; M1241-K1277 HydrophobicContact CB-CD 3.88Å; M1241-K1277 WeakPolarHBondContact O-CD 3.44Å; M1241-K1277 PolarHBondContact O-NZ 2.99Å; M1241-F1279 HydrophobicContact CB-CE1 4.49Å; M1241-F1279 HydrophobicContact SD-CE1 4.43Å; M1241-F1279 HydrophobicContact SD-CZ 4.37Å
1242	G	89.7	Confident	91.6	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.01	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	75	-141.5	-175.4	0	0	0	0	0	112	F1244 L1245 G1246 S1252	G1242-F1244 PolarHBondContact O-N 3.07Å; G1242-L1245 PolarHBondContact O-N 2.97Å; G1242-G1246 PolarHBondContact O-N 3.23Å; G1242-S1252 WeakPolarHBondContact CA-OG 3.41Å; G1242-S1252 PolarHBondContact N-OG 3.44Å
1243	F	90.1	Very high	91.6	Very high	52 Å²	52	26.3 Å²	26.3	23%	0.228	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-58.1	-17	-173.9	-70	-55.4	0	0	0	115.9	P1118 Q1196 A1200 D1201 R1202 L1245 A1247 S1278	P1118-F1243 HydrophobicContact CG-CB 4.16Å; P1118-F1243 HydrophobicContact CG-CD2 3.84Å; P1118-F1243 HydrophobicContact CG-CE2 4.49Å; P1118-F1243 HydrophobicContact CG-CG 4.11Å; Q1196-F1243 PolarHBondContact NE2-O 2.9Å; Q1196-F1243 PolarHBondContact OE1-O 3Å; A1200-F1243 HydrophobicContact CB-CB 3.83Å; D1201-F1243 WeakPolarHBondContact O-CB 3.5Å; R1202-F1243 HydrophobicContact CG-CE1 4.33Å; F1243-L1245 PolarHBondContact O-N 2.92Å; F1243-A1247 HydrophobicContact CE1-CB 4.4Å; F1243-S1278 VanDerWaalsContact CE2-CB 3.48Å; F1243-S1278 WeakPolarHBondContact CE2-OG 3.49Å
1244	F	90.4	Very high	91.6	Very high	18 Å²	18	22 Å²	22	8%	0.079	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-66.5	-19.5	169.8	-64.6	-70.7	0	0	0	114.2	I1170 M1192 V1195 A1200 G1242	I1170-F1244 HydrophobicContact CB-CE1 4.45Å; I1170-F1244 HydrophobicContact CD1-CE1 4.4Å; M1192-F1244 HydrophobicContact CE-CB 4.06Å; M1192-F1244 HydrophobicContact CE-CD1 3.49Å; M1192-F1244 VanDerWaalsContact CE-CD1 3.49Å; M1192-F1244 HydrophobicContact CE-CD2 3.87Å; M1192-F1244 HydrophobicContact CE-CE1 3.78Å; M1192-F1244 HydrophobicContact CE-CE2 4.14Å; M1192-F1244 HydrophobicContact CE-CG 3.53Å; M1192-F1244 HydrophobicContact CE-CZ 4.09Å; V1195-F1244 WeakPolarHBondContact CG2-O 3.43Å; V1195-F1244 PolarHBondContact N-O 3.28Å; A1200-F1244 HydrophobicContact CB-CD1 3.75Å; A1200-F1244 HydrophobicContact CB-CD2 4.45Å; A1200-F1244 HydrophobicContact CB-CE1 3.69Å; A1200-F1244 HydrophobicContact CB-CE2 4.38Å; A1200-F1244 HydrophobicContact CB-CG 4.15Å; A1200-F1244 HydrophobicContact CB-CZ 4.01Å; G1242-F1244 PolarHBondContact O-N 3.07Å
1245	L	90.6	Very high	91.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-26.4	176.2	-60.4	178.3	0	0	0	112.6	A1205 I1210 I1214 P1239 G1240 G1242 F1243 T1251 V1255	A1205-L1245 WeakPolarHBondContact CA-O 3.14Å; A1205-L1245 WeakPolarHBondContact CB-O 3.42Å; I1210-L1245 HydrophobicContact CD1-CD2 4.24Å; I1210-L1245 HydrophobicContact CG1-CD2 4.18Å; I1214-L1245 HydrophobicContact CD1-CD2 4.2Å; I1214-L1245 HydrophobicContact CG1-CD2 4.5Å; P1239-L1245 WeakPolarHBondContact O-CD2 3.47Å; G1240-L1245 WeakPolarHBondContact O-CD1 3.33Å; G1242-L1245 PolarHBondContact O-N 2.97Å; F1243-L1245 PolarHBondContact O-N 2.92Å; L1245-T1251 HydrophobicContact CB-CG2 3.81Å; L1245-T1251 HydrophobicContact CD1-CG2 4.49Å; L1245-V1255 HydrophobicContact CD1-CB 4.25Å; L1245-V1255 HydrophobicContact CD1-CG2 3.71Å
1246	G	87.8	Confident	91.4	Very high	2 Å²	2	22 Å²	22	2%	0.021	13%	0.128	C	C	.	.			trans	147.9	174.8	-179.5	0	0	0	0	0	112.6	R1203 G1242	R1203-G1246 CarbonylContact O-C 3.59Å; R1203-G1246 VanDerWaalsContact O-CA 3.32Å; R1203-G1246 WeakPolarHBondContact O-CA 3.48Å; G1242-G1246 PolarHBondContact O-N 3.23Å
1247	A	86.7	Confident	91.3	Very high	49 Å²	49	25.5 Å²	25.5	41%	0.405	16%	0.157	S	C	.	.	S	Bend	trans	-74.1	-23.1	178.9	0	0	0	0	0	114.6	R1203 F1243	R1203-A1247 PolarHBondContact O-N 2.91Å; F1243-A1247 HydrophobicContact CE1-CB 4.4Å
1248	A	87.5	Confident	91.1	Very high	39 Å²	39	28.6 Å²	28.6	32%	0.322	17%	0.169	S	C	.	.			trans	-75.6	125.9	-176.2	0	0	0	0	0	112.3	E1250 T1251	A1248-E1250 PolarHBondContact O-N 2.9Å; A1248-T1251 PolarHBondContact O-N 2.93Å
1249	P	88.9	Confident	91.1	Very high	28 Å²	28	28.6 Å²	28.6	18%	0.182	17%	0.169	C	C	.	.	H	α-helix	trans	-57.5	-34.6	176.1	-26.8	35.9	0	0	0	113.9	T1251 S1252 L1253 F1279 A1282	P1249-T1251 VanDerWaalsContact C-N 3.27Å; P1249-T1251 PolarHBondContact O-N 3.22Å; P1249-S1252 PolarHBondContact O-N 3.01Å; P1249-S1252 VanDerWaalsContact O-N 3.15Å; P1249-L1253 WeakPolarHBondContact O-CG 3.46Å; P1249-L1253 PolarHBondContact O-N 2.96Å; P1249-F1279 HydrophobicContact CB-CB 3.99Å; P1249-A1282 HydrophobicContact CG-CB 3.71Å
1250	E	89.5	Confident	90.8	Very high	127 Å²	127	31.7 Å²	31.7	59%	0.593	19%	0.185	S	C	*	.	H	α-helix	trans	-59.2	-36.9	-177.2	-64.2	67	-146.1	0	0	111.7	A1248 S1252 L1253 S1254	A1248-E1250 PolarHBondContact O-N 2.9Å; E1250-S1252 PolarHBondContact O-N 3.4Å; E1250-L1253 PolarHBondContact O-N 3.33Å; E1250-S1254 WeakPolarHBondContact O-CB 3.37Å; E1250-S1254 PolarHBondContact O-N 3.2Å
1251	T	91.3	Very high	90.9	Very high	19 Å²	19	35.3 Å²	35.3	12%	0.117	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-42.3	178	-48	0	0	0	0	111.5	A1205 I1210 L1245 A1248 P1249 V1255	A1205-T1251 HydrophobicContact CB-CG2 3.94Å; I1210-T1251 HydrophobicContact CB-CG2 3.94Å; I1210-T1251 HydrophobicContact CD1-CG2 4.03Å; I1210-T1251 HydrophobicContact CG1-CG2 3.67Å; I1210-T1251 HydrophobicContact CG2-CG2 4.12Å; L1245-T1251 HydrophobicContact CB-CG2 3.81Å; L1245-T1251 HydrophobicContact CD1-CG2 4.49Å; A1248-T1251 PolarHBondContact O-N 2.93Å; P1249-T1251 VanDerWaalsContact C-N 3.27Å; P1249-T1251 PolarHBondContact O-N 3.22Å; T1251-V1255 WeakPolarHBondContact O-CG2 3.26Å; T1251-V1255 PolarHBondContact O-N 3.02Å
1252	S	92.8	Very high	90.8	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-72.4	-34.1	176.6	-61.9	0	0	0	0	112.3	G1242 P1249 E1250 L1256	G1242-S1252 WeakPolarHBondContact CA-OG 3.41Å; G1242-S1252 PolarHBondContact N-OG 3.44Å; P1249-S1252 PolarHBondContact O-N 3.01Å; P1249-S1252 VanDerWaalsContact O-N 3.15Å; E1250-S1252 PolarHBondContact O-N 3.4Å; S1252-L1256 WeakPolarHBondContact O-CB 3.49Å; S1252-L1256 PolarHBondContact O-N 2.93Å
1253	L	92.2	Very high	90.7	Very high	58 Å²	58	38.8 Å²	38.8	30%	0.304	22%	0.215	S	C	.	.	H	α-helix	trans	-69.2	-36.2	175.4	-67.7	170.7	0	0	0	112.2	P1249 E1250 L1256 A1257 F1279 L1283	P1249-L1253 WeakPolarHBondContact O-CG 3.46Å; P1249-L1253 PolarHBondContact O-N 2.96Å; E1250-L1253 PolarHBondContact O-N 3.33Å; L1253-L1256 PolarHBondContact O-N 2.79Å; L1253-A1257 WeakPolarHBondContact O-CB 3.17Å; L1253-A1257 PolarHBondContact O-N 2.93Å; L1253-F1279 HydrophobicContact CD2-CD2 4.02Å; L1253-F1279 HydrophobicContact CD2-CE2 4Å; L1253-F1279 HydrophobicContact CG-CD2 4.19Å; L1253-L1283 HydrophobicContact CD1-CD2 4.34Å; L1253-L1283 HydrophobicContact CD2-CD2 4.2Å
1254	S	91.6	Very high	90.6	Very high	37 Å²	37	43 Å²	43	26%	0.259	24%	0.239	S	C	.	.	H	α-helix	trans	-59.7	-50.4	173.7	-172.2	0	0	0	0	111.2	E1250 L1256 A1257 R1258	E1250-S1254 WeakPolarHBondContact O-CB 3.37Å; E1250-S1254 PolarHBondContact O-N 3.2Å; S1254-L1256 PolarHBondContact O-N 3.06Å; S1254-A1257 PolarHBondContact O-N 3.25Å; S1254-R1258 WeakPolarHBondContact O-CB 3.43Å; S1254-R1258 PolarHBondContact O-N 3.11Å
1255	V	94.2	Very high	90.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-43	176.9	178.8	0	0	0	0	111.4	I1210 M1211 I1214 P1239 M1241 L1245 T1251 A1257 R1258 F1259	I1210-V1255 HydrophobicContact CG1-CG2 4.29Å; I1210-V1255 HydrophobicContact CG2-CG2 3.76Å; M1211-V1255 HydrophobicContact SD-CB 4.39Å; M1211-V1255 HydrophobicContact SD-CG1 4.45Å; M1211-V1255 HydrophobicContact SD-CG2 4.01Å; I1214-V1255 HydrophobicContact CD1-CG1 4.27Å; I1214-V1255 HydrophobicContact CD1-CG2 3.5Å; I1214-V1255 VanDerWaalsContact CD1-CG2 3.5Å; P1239-V1255 HydrophobicContact CB-CG1 3.67Å; P1239-V1255 HydrophobicContact CG-CG1 3.61Å; M1241-V1255 HydrophobicContact CE-CB 3.98Å; M1241-V1255 HydrophobicContact CE-CG1 3.61Å; L1245-V1255 HydrophobicContact CD1-CB 4.25Å; L1245-V1255 HydrophobicContact CD1-CG2 3.71Å; T1251-V1255 WeakPolarHBondContact O-CG2 3.26Å; T1251-V1255 PolarHBondContact O-N 3.02Å; V1255-A1257 PolarHBondContact O-N 2.93Å; V1255-R1258 PolarHBondContact O-N 3.09Å; V1255-R1258 VanDerWaalsContact O-N 3.11Å; V1255-F1259 WeakPolarHBondContact O-CB 3.45Å; V1255-F1259 PolarHBondContact O-N 3.36Å
1256	L	93.2	Very high	90.7	Very high	25 Å²	25	48.9 Å²	48.9	13%	0.131	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-23.3	179.6	-175.3	59.9	0	0	0	112.8	M1241 S1252 L1253 S1254 F1259 L1272 V1274 F1279 A1298 A1302	M1241-L1256 HydrophobicContact CE-CB 3.88Å; M1241-L1256 HydrophobicContact CE-CD1 4.3Å; S1252-L1256 WeakPolarHBondContact O-CB 3.49Å; S1252-L1256 PolarHBondContact O-N 2.93Å; L1253-L1256 PolarHBondContact O-N 2.79Å; S1254-L1256 PolarHBondContact O-N 3.06Å; L1256-F1259 WeakPolarHBondContact O-CD1 3.37Å; L1256-L1272 HydrophobicContact CD1-CD1 4.3Å; L1256-V1274 HydrophobicContact CD1-CG1 4.17Å; L1256-V1274 HydrophobicContact CD2-CG1 4.46Å; L1256-F1279 HydrophobicContact CD2-CE2 4.35Å; L1256-F1279 HydrophobicContact CD2-CZ 4.5Å; L1256-A1298 HydrophobicContact CD2-CB 3.93Å; L1256-A1302 HydrophobicContact CD1-CB 4.15Å
1257	A	91.7	Very high	90.9	Very high	75 Å²	75	55.5 Å²	55.5	62%	0.62	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-6.3	176.8	0	0	0	0	0	114.6	L1253 S1254 V1255	L1253-A1257 WeakPolarHBondContact O-CB 3.17Å; L1253-A1257 PolarHBondContact O-N 2.93Å; S1254-A1257 PolarHBondContact O-N 3.25Å; V1255-A1257 PolarHBondContact O-N 2.93Å
1258	R	93.6	Very high	91.1	Very high	65 Å²	65	53.4 Å²	53.4	25%	0.245	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.1	3.9	-168.8	-66.1	175.1	60.8	-157	-6.8	115.5	D1209 M1211 S1254 V1255 D1260 E1261	D1209-R1258 VanDerWaalsContact CG-NH1 3.27Å; D1209-R1258 IonicContact OD1-NH1 2.96Å; D1209-R1258 PolarHBondContact OD1-NH1 2.78Å; D1209-R1258 VanDerWaalsContact OD1-NH1 3.07Å; D1209-R1258 IonicContact OD2-CZ 3.24Å; D1209-R1258 IonicContact OD2-NH1 2.71Å; D1209-R1258 PolarHBondContact OD2-NH1 2.84Å; D1209-R1258 IonicContact OD2-NH2 2.67Å; D1209-R1258 PolarHBondContact OD2-NH2 2.77Å; M1211-R1258 HydrophobicContact CE-CB 4.13Å; M1211-R1258 WeakPolarHBondContact CE-O 3.47Å; M1211-R1258 HydrophobicContact CG-CB 4.29Å; M1211-R1258 VanDerWaalsContact CG-CZ 3.49Å; M1211-R1258 HydrophobicContact SD-CB 4.2Å; S1254-R1258 WeakPolarHBondContact O-CB 3.43Å; S1254-R1258 PolarHBondContact O-N 3.11Å; V1255-R1258 PolarHBondContact O-N 3.09Å; V1255-R1258 VanDerWaalsContact O-N 3.11Å; R1258-D1260 VanDerWaalsContact C-OD1 3.23Å; R1258-D1260 WeakPolarHBondContact CA-OD1 3.31Å; R1258-D1260 PolarHBondContact O-N 2.79Å; R1258-D1260 VanDerWaalsContact O-N 3.08Å; R1258-E1261 HydrophobicContact CB-CG 4.48Å; R1258-E1261 IonicContact CZ-OE1 2.66Å; R1258-E1261 IonicContact CZ-OE2 2.66Å; R1258-E1261 IonicContact NE-OE1 2.71Å; R1258-E1261 PolarHBondContact NE-OE1 2.84Å; R1258-E1261 IonicContact NE-OE2 3.23Å; R1258-E1261 IonicContact NH2-OE1 3.34Å; R1258-E1261 PolarHBondContact NH2-OE1 2.87Å; R1258-E1261 IonicContact NH2-OE2 3.18Å; R1258-E1261 PolarHBondContact NH2-OE2 2.72Å; R1258-E1261 VanDerWaalsContact O-CB 3.25Å; R1258-E1261 WeakPolarHBondContact O-CB 3.42Å; R1258-E1261 WeakPolarHBondContact O-CG 3.42Å; R1258-E1261 PolarHBondContact O-N 2.91Å
1259	F	93.5	Very high	91.4	Very high	4 Å²	4	53 Å²	53	2%	0.018	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.7	-176.6	70.3	-88.8	0	0	0	113.9	V1255 L1256 E1261 L1262 V1270 L1272 A1302 G1305 A1307	V1255-F1259 WeakPolarHBondContact O-CB 3.45Å; V1255-F1259 PolarHBondContact O-N 3.36Å; L1256-F1259 WeakPolarHBondContact O-CD1 3.37Å; F1259-E1261 PolarHBondContact O-N 3.17Å; F1259-L1262 VanDerWaalsContact O-CB 3.29Å; F1259-L1262 WeakPolarHBondContact O-CB 2.98Å; F1259-L1262 PolarHBondContact O-N 2.73Å; F1259-L1262 VanDerWaalsContact O-N 3.09Å; F1259-V1270 HydrophobicContact CD2-CB 4.48Å; F1259-V1270 HydrophobicContact CD2-CG1 4.02Å; F1259-L1272 HydrophobicContact CB-CD2 4.46Å; F1259-L1272 HydrophobicContact CD1-CD1 3.66Å; F1259-L1272 HydrophobicContact CD2-CD1 3.87Å; F1259-L1272 HydrophobicContact CE1-CD1 3.68Å; F1259-L1272 HydrophobicContact CE2-CD1 3.89Å; F1259-L1272 HydrophobicContact CG-CD1 3.76Å; F1259-L1272 HydrophobicContact CG-CD2 4.46Å; F1259-L1272 HydrophobicContact CZ-CD1 3.8Å; F1259-A1302 WeakPolarHBondContact CZ-O 3.46Å; F1259-G1305 WeakPolarHBondContact CZ-O 3.4Å; F1259-A1307 HydrophobicContact CE2-CB 4.05Å; F1259-A1307 HydrophobicContact CZ-CB 4.36Å
1260	D	89	Confident	91.7	Very high	64 Å²	64	51.6 Å²	51.6	34%	0.342	26%	0.263	S	S	.	.	H	α-helix	trans	-64.6	-26.3	172.4	63	-55.1	0	0	0	112.4	R1258 L1262 R1263 L1264	R1258-D1260 VanDerWaalsContact C-OD1 3.23Å; R1258-D1260 WeakPolarHBondContact CA-OD1 3.31Å; R1258-D1260 PolarHBondContact O-N 2.79Å; R1258-D1260 VanDerWaalsContact O-N 3.08Å; D1260-L1262 PolarHBondContact O-N 3.04Å; D1260-R1263 WeakPolarHBondContact O-CB 3.35Å; D1260-R1263 PolarHBondContact O-N 2.63Å; D1260-L1264 WeakPolarHBondContact O-CG 3.19Å; D1260-L1264 PolarHBondContact O-N 2.94Å
1261	E	92	Very high	91.9	Very high	77 Å²	77	45.6 Å²	45.6	36%	0.36	24%	0.235	S	C	.	.	H	α-helix	trans	-54.8	-35.3	168.4	-65.1	175.4	-165.7	0	0	111.5	M1211 R1258 F1259 R1265	M1211-E1261 HydrophobicContact CE-CB 4.04Å; R1258-E1261 HydrophobicContact CB-CG 4.48Å; R1258-E1261 IonicContact CZ-OE1 2.66Å; R1258-E1261 IonicContact CZ-OE2 2.66Å; R1258-E1261 IonicContact NE-OE1 2.71Å; R1258-E1261 PolarHBondContact NE-OE1 2.84Å; R1258-E1261 IonicContact NE-OE2 3.23Å; R1258-E1261 IonicContact NH2-OE1 3.34Å; R1258-E1261 PolarHBondContact NH2-OE1 2.87Å; R1258-E1261 IonicContact NH2-OE2 3.18Å; R1258-E1261 PolarHBondContact NH2-OE2 2.72Å; R1258-E1261 VanDerWaalsContact O-CB 3.25Å; R1258-E1261 WeakPolarHBondContact O-CB 3.42Å; R1258-E1261 WeakPolarHBondContact O-CG 3.42Å; R1258-E1261 PolarHBondContact O-N 2.91Å; F1259-E1261 PolarHBondContact O-N 3.17Å; E1261-R1265 WeakPolarHBondContact O-CB 3.12Å; E1261-R1265 PolarHBondContact O-N 2.82Å
1262	L	91.4	Very high	92.1	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-73.2	-40.1	177	-51.6	171.7	0	0	0	111.3	M1211 I1214 A1215 F1218 P1239 F1259 D1260 L1264 R1265 F1266	M1211-L1262 HydrophobicContact CE-CD1 4.32Å; M1211-L1262 HydrophobicContact CE-CD2 4Å; M1211-L1262 HydrophobicContact CE-CG 3.89Å; I1214-L1262 HydrophobicContact CG2-CD1 3.84Å; I1214-L1262 HydrophobicContact CG2-CD2 3.83Å; A1215-L1262 HydrophobicContact CB-CD2 4.37Å; F1218-L1262 HydrophobicContact CD2-CD2 4.38Å; F1218-L1262 HydrophobicContact CE2-CD1 4.22Å; P1239-L1262 HydrophobicContact CB-CD1 3.78Å; P1239-L1262 HydrophobicContact CG-CD1 4.29Å; F1259-L1262 VanDerWaalsContact O-CB 3.29Å; F1259-L1262 WeakPolarHBondContact O-CB 2.98Å; F1259-L1262 PolarHBondContact O-N 2.73Å; F1259-L1262 VanDerWaalsContact O-N 3.09Å; D1260-L1262 PolarHBondContact O-N 3.04Å; L1262-L1264 VanDerWaalsContact C-N 3.31Å; L1262-L1264 PolarHBondContact O-N 2.89Å; L1262-R1265 PolarHBondContact O-N 2.9Å; L1262-F1266 HydrophobicContact CB-CD2 4.31Å; L1262-F1266 HydrophobicContact CD2-CE2 4.15Å; L1262-F1266 WeakPolarHBondContact O-CB 3.4Å; L1262-F1266 VanDerWaalsContact O-CD2 3.26Å; L1262-F1266 WeakPolarHBondContact O-CD2 3.47Å; L1262-F1266 PolarHBondContact O-N 3.11Å
1263	R	86.5	Confident	92.1	Very high	72 Å²	72	44.9 Å²	44.9	27%	0.272	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-45.4	174.6	-169.5	-169.8	-175.1	94.1	34.4	110.4	D1260 D1267 V1270 G1306 D1308	D1260-R1263 WeakPolarHBondContact O-CB 3.35Å; D1260-R1263 PolarHBondContact O-N 2.63Å; R1263-D1267 WeakPolarHBondContact O-CA 3.16Å; R1263-D1267 PolarHBondContact O-N 3.08Å; R1263-V1270 HydrophobicContact CB-CG2 4.19Å; R1263-G1306 PolarHBondContact NH1-O 2.95Å; R1263-D1308 IonicContact CZ-OD1 2.7Å; R1263-D1308 IonicContact CZ-OD2 2.72Å; R1263-D1308 VanDerWaalsContact CZ-OD2 3.26Å; R1263-D1308 VanDerWaalsContact NH1-CG 3.32Å; R1263-D1308 IonicContact NH1-OD1 3.73Å; R1263-D1308 IonicContact NH1-OD2 2.66Å; R1263-D1308 PolarHBondContact NH1-OD2 3.3Å; R1263-D1308 IonicContact NH2-OD1 3.22Å; R1263-D1308 PolarHBondContact NH2-OD1 2.72Å; R1263-D1308 IonicContact NH2-OD2 3.65Å; R1263-D1308 PolarHBondContact NH2-OD2 3.21Å; R1263-D1308 VanDerWaalsContact NH2-OD2 3.17Å
1264	L	87.7	Confident	92.1	Very high	142 Å²	142	42.1 Å²	42.1	74%	0.743	22%	0.216	S	C	*	.	H	α-helix	trans	-68.6	-40.6	179	-68.6	168.7	0	0	0	112.6	D1260 L1262	D1260-L1264 WeakPolarHBondContact O-CG 3.19Å; D1260-L1264 PolarHBondContact O-N 2.94Å; L1262-L1264 VanDerWaalsContact C-N 3.31Å; L1262-L1264 PolarHBondContact O-N 2.89Å
1265	R	92.3	Very high	91.9	Very high	131 Å²	131	40.7 Å²	40.7	49%	0.494	21%	0.206	S	C	.	.	H	α-helix	trans	-70.5	-36.7	179.6	-176	174.3	-178.2	143.5	-7.5	113.3	D1219 E1261 L1262	D1219-R1265 IonicContact OD2-CZ 2.69Å; D1219-R1265 IonicContact OD2-NE 3.91Å; D1219-R1265 PolarHBondContact OD2-NE 2.9Å; D1219-R1265 IonicContact OD2-NH2 2.93Å; D1219-R1265 PolarHBondContact OD2-NH2 2.76Å; E1261-R1265 WeakPolarHBondContact O-CB 3.12Å; E1261-R1265 PolarHBondContact O-N 2.82Å; L1262-R1265 PolarHBondContact O-N 2.9Å
1266	F	92.3	Very high	91.5	Very high	10 Å²	10	42.7 Å²	42.7	4%	0.044	21%	0.214	C	C	.	.	H	α-helix	trans	-110.2	-16.8	-169	-63.2	-64.4	0	0	0	115.8	A1215 F1218 D1219 I1222 R1232 L1237 L1262 L1268	A1215-F1266 HydrophobicContact CB-CE2 4.49Å; A1215-F1266 HydrophobicContact CB-CZ 4.41Å; F1218-F1266 HydrophobicContact CB-CD2 4.33Å; F1218-F1266 HydrophobicContact CB-CE1 4.07Å; F1218-F1266 HydrophobicContact CB-CE2 3.6Å; F1218-F1266 HydrophobicContact CB-CZ 3.46Å; F1218-F1266 VanDerWaalsContact CB-CZ 3.46Å; F1218-F1266 HydrophobicContact CD2-CE2 4.17Å; F1218-F1266 HydrophobicContact CG-CE2 4.29Å; D1219-F1266 WeakPolarHBondContact OD1-CE1 3.24Å; I1222-F1266 HydrophobicContact CD1-CB 4.32Å; I1222-F1266 HydrophobicContact CD1-CD1 3.48Å; I1222-F1266 VanDerWaalsContact CD1-CD1 3.48Å; I1222-F1266 HydrophobicContact CD1-CE1 3.88Å; I1222-F1266 HydrophobicContact CD1-CG 3.88Å; R1232-F1266 PolarHBondContact NH2-O 3.37Å; L1237-F1266 HydrophobicContact CD1-CB 3.88Å; L1237-F1266 HydrophobicContact CD1-CD2 3.63Å; L1237-F1266 HydrophobicContact CD1-CE2 4.49Å; L1237-F1266 HydrophobicContact CD1-CG 3.95Å; L1262-F1266 HydrophobicContact CB-CD2 4.31Å; L1262-F1266 HydrophobicContact CD2-CE2 4.15Å; L1262-F1266 WeakPolarHBondContact O-CB 3.4Å; L1262-F1266 VanDerWaalsContact O-CD2 3.26Å; L1262-F1266 WeakPolarHBondContact O-CD2 3.47Å; L1262-F1266 PolarHBondContact O-N 3.11Å; F1266-L1268 HydrophobicContact CB-CB 4.24Å; F1266-L1268 HydrophobicContact CB-CD1 4.37Å; F1266-L1268 HydrophobicContact CB-CG 4.33Å; F1266-L1268 PolarHBondContact O-N 3.44Å
1267	D	90.4	Very high	91.1	Very high	140 Å²	140	43.2 Å²	43.2	75%	0.749	22%	0.215	S	C	*	.			trans	44.5	48.3	-166.7	-170.2	35.8	0	0	0	112.2	R1263	R1263-D1267 WeakPolarHBondContact O-CA 3.16Å; R1263-D1267 PolarHBondContact O-N 3.08Å
1268	L	92.2	Very high	90.9	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.031	19%	0.193	C	C	.	.			trans	-127.4	147.9	176.2	-73.3	178.6	0	0	0	109.4	I1222 R1232 L1235 L1237 F1266	I1222-L1268 HydrophobicContact CD1-CD1 3.67Å; I1222-L1268 HydrophobicContact CG1-CD1 4.07Å; I1222-L1268 HydrophobicContact CG2-CD1 4.47Å; R1232-L1268 HydrophobicContact CB-CD2 4.18Å; R1232-L1268 VanDerWaalsContact O-CD2 3.24Å; R1232-L1268 WeakPolarHBondContact O-CD2 3.29Å; L1235-L1268 HydrophobicContact CB-CD1 4.13Å; L1235-L1268 HydrophobicContact CB-CD2 4.32Å; L1235-L1268 HydrophobicContact CD1-CD1 4.28Å; L1237-L1268 HydrophobicContact CD1-CB 3.97Å; L1237-L1268 HydrophobicContact CD1-CD1 4.34Å; L1237-L1268 HydrophobicContact CD2-CD1 3.95Å; L1237-L1268 HydrophobicContact CG-CB 3.97Å; L1237-L1268 HydrophobicContact CG-CD1 4.29Å; F1266-L1268 HydrophobicContact CB-CB 4.24Å; F1266-L1268 HydrophobicContact CB-CD1 4.37Å; F1266-L1268 HydrophobicContact CB-CG 4.33Å; F1266-L1268 PolarHBondContact O-N 3.44Å
1269	P	93	Very high	90.7	Very high	29 Å²	29	37.8 Å²	37.8	19%	0.188	18%	0.182	C	C	.	.			trans	-71.4	141.4	-178.4	30.7	-35.5	0	0	0	111.3	L1235 V1236 L1237 D1308 F1309	L1235-P1269 WeakPolarHBondContact O-CD 3.21Å; L1235-P1269 WeakPolarHBondContact O-CG 3.44Å; V1236-P1269 WeakPolarHBondContact CA-O 3.37Å; V1236-P1269 HydrophobicContact CB-CG 4.49Å; V1236-P1269 HydrophobicContact CG1-CG 4.49Å; V1236-P1269 WeakPolarHBondContact CG1-O 3.47Å; V1236-P1269 HydrophobicContact CG2-CG 4.13Å; L1237-P1269 PolarHBondContact N-O 3.32Å; P1269-D1308 WeakPolarHBondContact CA-OD2 3.49Å; P1269-D1308 HydrophobicContact CB-CB 3.67Å; P1269-D1308 WeakPolarHBondContact CB-OD2 3.46Å; P1269-F1309 HydrophobicContact CB-CD2 4.44Å; P1269-F1309 HydrophobicContact CB-CE2 3.91Å; P1269-F1309 HydrophobicContact CG-CE2 4.18Å
1270	V	94.4	Very high	90.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-104.6	135.6	-177	-175.3	0	0	0	0	110.8	L1237 F1259 R1263 L1272 D1308 F1309	L1237-V1270 CarbonylContact O-C 3.52Å; L1237-V1270 WeakPolarHBondContact O-CA 3.29Å; F1259-V1270 HydrophobicContact CD2-CB 4.48Å; F1259-V1270 HydrophobicContact CD2-CG1 4.02Å; R1263-V1270 HydrophobicContact CB-CG2 4.19Å; V1270-L1272 HydrophobicContact CG1-CD2 4.37Å; V1270-L1272 HydrophobicContact CG1-CG 4.32Å; V1270-D1308 PolarHBondContact N-OD2 3.49Å; V1270-D1308 PolarHBondContact O-N 3.07Å; V1270-F1309 PolarHBondContact O-N 3.02Å
1271	L	95.4	Very high	90.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.5	170.4	-174.4	149	0	0	0	109.7	F1072 V1190 V1236 L1237 D1238 F1309 R1311	F1072-L1271 HydrophobicContact CD1-CD1 4.16Å; F1072-L1271 HydrophobicContact CE1-CD1 4.06Å; F1072-L1271 HydrophobicContact CG-CD1 4.46Å; F1072-L1271 HydrophobicContact CZ-CD1 4.27Å; V1190-L1271 HydrophobicContact CG1-CB 4.3Å; V1190-L1271 HydrophobicContact CG1-CD1 4.11Å; V1190-L1271 HydrophobicContact CG1-CD2 4.42Å; V1190-L1271 HydrophobicContact CG2-CD1 4.06Å; V1236-L1271 HydrophobicContact CG1-CB 3.78Å; L1237-L1271 PolarHBondContact O-N 2.9Å; D1238-L1271 WeakPolarHBondContact CA-O 3.38Å; D1238-L1271 HydrophobicContact CB-CB 4.38Å; D1238-L1271 HydrophobicContact CB-CD2 4.12Å; D1238-L1271 WeakPolarHBondContact OD2-CD2 3.48Å; L1271-F1309 WeakPolarHBondContact CA-O 3.24Å; L1271-F1309 HydrophobicContact CB-CB 3.77Å; L1271-F1309 HydrophobicContact CB-CD2 4.38Å; L1271-F1309 HydrophobicContact CB-CG 4.42Å; L1271-F1309 HydrophobicContact CD1-CB 3.71Å; L1271-F1309 HydrophobicContact CD1-CG 4.24Å; L1271-F1309 HydrophobicContact CG-CB 3.67Å; L1271-R1311 HydrophobicContact CD2-CB 4.17Å
1272	L	94.5	Very high	90.4	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.8	175.4	-69.4	177.9	0	0	0	112.4	P1239 M1241 L1256 F1259 V1270 A1302 A1307 F1309 I1310 R1311	P1239-L1272 HydrophobicContact CG-CD2 3.61Å; M1241-L1272 HydrophobicContact CE-CD2 3.87Å; L1256-L1272 HydrophobicContact CD1-CD1 4.3Å; F1259-L1272 HydrophobicContact CB-CD2 4.46Å; F1259-L1272 HydrophobicContact CD1-CD1 3.66Å; F1259-L1272 HydrophobicContact CD2-CD1 3.87Å; F1259-L1272 HydrophobicContact CE1-CD1 3.68Å; F1259-L1272 HydrophobicContact CE2-CD1 3.89Å; F1259-L1272 HydrophobicContact CG-CD1 3.76Å; F1259-L1272 HydrophobicContact CG-CD2 4.46Å; F1259-L1272 HydrophobicContact CZ-CD1 3.8Å; V1270-L1272 HydrophobicContact CG1-CD2 4.37Å; V1270-L1272 HydrophobicContact CG1-CG 4.32Å; L1272-A1302 HydrophobicContact CB-CB 4.42Å; L1272-A1302 HydrophobicContact CD1-CB 3.6Å; L1272-A1307 HydrophobicContact CD1-CB 4.14Å; L1272-A1307 HydrophobicContact CG-CB 4.43Å; L1272-F1309 PolarHBondContact N-O 3.2Å; L1272-I1310 WeakPolarHBondContact O-CA 3.41Å; L1272-R1311 PolarHBondContact O-N 2.96Å
1273	S	93.3	Very high	90.3	Very high	4 Å²	4	42.1 Å²	42.1	3%	0.028	21%	0.212	C	C	.	.			trans	-126.6	92.6	179.3	-177.3	0	0	0	0	110.5	M1241 K1277	M1241-S1273 VanDerWaalsContact CB-O 3.27Å; M1241-S1273 WeakPolarHBondContact CB-O 3.34Å; S1273-K1277 VanDerWaalsContact O-CD 3.24Å; S1273-K1277 WeakPolarHBondContact O-CD 3.34Å; S1273-K1277 WeakPolarHBondContact O-CE 3.47Å; S1273-K1277 PolarHBondContact O-NZ 3.15Å
1274	V	91.7	Very high	90.4	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	22%	0.216	C	C	.	.			trans	-104.3	-13.3	178	-60.7	0	0	0	0	113.5	M1241 L1256 R1276 K1277 F1279 L1280 A1298 E1299	M1241-V1274 HydrophobicContact CG-CG1 4.21Å; M1241-V1274 HydrophobicContact SD-CG1 4.4Å; L1256-V1274 HydrophobicContact CD1-CG1 4.17Å; L1256-V1274 HydrophobicContact CD2-CG1 4.46Å; V1274-R1276 PolarHBondContact O-N 2.9Å; V1274-K1277 WeakPolarHBondContact O-CB 3.32Å; V1274-K1277 PolarHBondContact O-N 3.06Å; V1274-K1277 VanDerWaalsContact O-N 3.14Å; V1274-F1279 HydrophobicContact CB-CE1 4.45Å; V1274-F1279 HydrophobicContact CB-CZ 4.12Å; V1274-F1279 HydrophobicContact CG1-CE1 4.49Å; V1274-F1279 HydrophobicContact CG1-CZ 3.97Å; V1274-L1280 HydrophobicContact CB-CD1 4.39Å; V1274-A1298 HydrophobicContact CB-CB 4.25Å; V1274-A1298 HydrophobicContact CG2-CB 3.83Å; V1274-E1299 HydrophobicContact CG2-CG 3.47Å; V1274-E1299 VanDerWaalsContact CG2-CG 3.47Å
1275	S	88.4	Confident	90.4	Very high	6 Å²	6	38 Å²	38	4%	0.042	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	119.7	-164.7	-160.9	0	0	0	0	114	K1277 E1299 T1312 H1313	S1275-K1277 PolarHBondContact O-N 3.4Å; S1275-K1277 VanDerWaalsContact O-N 3.08Å; S1275-E1299 WeakPolarHBondContact CB-OE1 3.08Å; S1275-E1299 PolarHBondContact OG-OE1 3.11Å; S1275-T1312 PolarHBondContact OG-OG1 3.03Å; S1275-T1312 VanDerWaalsContact OG-OG1 3.13Å; S1275-H1313 WeakPolarHBondContact CB-ND1 3.23Å; S1275-H1313 PolarHBondContact OG-N 2.89Å; S1275-H1313 PolarHBondContact OG-ND1 3.03Å
1276	R	84.1	Confident	90	Very high	43 Å²	43	38.7 Å²	38.7	16%	0.162	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	12.5	-178.9	-54.1	179	-179	161	-3	116.3	S1083 D1084 V1274 R1281 V1291 T1295 E1314	S1083-R1276 PolarHBondContact OG-NH1 3.31Å; D1084-R1276 IonicContact OD1-NH1 2.71Å; D1084-R1276 PolarHBondContact OD1-NH1 2.74Å; V1274-R1276 PolarHBondContact O-N 2.9Å; R1276-R1281 PolarHBondContact O-NH1 2.86Å; R1276-V1291 HydrophobicContact CB-CG1 4Å; R1276-V1291 HydrophobicContact CG-CG1 4.07Å; R1276-T1295 PolarHBondContact N-OG1 3.37Å; R1276-T1295 VanDerWaalsContact N-OG1 3.13Å; R1276-E1314 IonicContact CZ-OE1 3.21Å; R1276-E1314 IonicContact NE-OE1 2.66Å; R1276-E1314 PolarHBondContact NE-OE1 2.83Å; R1276-E1314 IonicContact NH2-OE1 2.8Å; R1276-E1314 PolarHBondContact NH2-OE1 2.9Å
1277	K	86.8	Confident	89.4	Confident	36 Å²	36	39.7 Å²	39.7	16%	0.157	23%	0.231	C	C	.	.			trans	-69.2	160.3	-173.5	-72.5	-166	174.3	176.4	0	114.7	M1241 S1273 V1274 S1275 F1279 L1280 R1281	M1241-K1277 HydrophobicContact CB-CD 3.88Å; M1241-K1277 WeakPolarHBondContact O-CD 3.44Å; M1241-K1277 PolarHBondContact O-NZ 2.99Å; S1273-K1277 VanDerWaalsContact O-CD 3.24Å; S1273-K1277 WeakPolarHBondContact O-CD 3.34Å; S1273-K1277 WeakPolarHBondContact O-CE 3.47Å; S1273-K1277 PolarHBondContact O-NZ 3.15Å; V1274-K1277 WeakPolarHBondContact O-CB 3.32Å; V1274-K1277 PolarHBondContact O-N 3.06Å; V1274-K1277 VanDerWaalsContact O-N 3.14Å; S1275-K1277 PolarHBondContact O-N 3.4Å; S1275-K1277 VanDerWaalsContact O-N 3.08Å; K1277-F1279 HydrophobicContact CB-CD1 3.97Å; K1277-F1279 HydrophobicContact CB-CE1 3.93Å; K1277-F1279 PolarHBondContact O-N 2.91Å; K1277-L1280 PolarHBondContact O-N 3.36Å; K1277-R1281 PolarHBondContact O-N 2.7Å
1278	S	86.7	Confident	88.6	Confident	22 Å²	22	35.1 Å²	35.1	15%	0.154	21%	0.209	C	C	.	.	H	α-helix	trans	-56.7	-43	-171.8	45.8	0	0	0	0	114.4	F1243 L1280 R1281 A1282	F1243-S1278 VanDerWaalsContact CE2-CB 3.48Å; F1243-S1278 WeakPolarHBondContact CE2-OG 3.49Å; S1278-L1280 VanDerWaalsContact C-N 3.33Å; S1278-L1280 PolarHBondContact O-N 3.43Å; S1278-R1281 WeakPolarHBondContact O-CB 3.33Å; S1278-R1281 PolarHBondContact O-N 3.21Å; S1278-R1281 VanDerWaalsContact O-N 3.1Å; S1278-A1282 PolarHBondContact O-N 2.81Å
1279	F	89.7	Confident	87.7	Confident	3 Å²	3	37.9 Å²	37.9	1%	0.013	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-38.1	-178.1	75.8	-83	0	0	0	113	M1241 P1249 L1253 L1256 V1274 K1277 A1282 L1283	M1241-F1279 HydrophobicContact CB-CE1 4.49Å; M1241-F1279 HydrophobicContact SD-CE1 4.43Å; M1241-F1279 HydrophobicContact SD-CZ 4.37Å; P1249-F1279 HydrophobicContact CB-CB 3.99Å; L1253-F1279 HydrophobicContact CD2-CD2 4.02Å; L1253-F1279 HydrophobicContact CD2-CE2 4Å; L1253-F1279 HydrophobicContact CG-CD2 4.19Å; L1256-F1279 HydrophobicContact CD2-CE2 4.35Å; L1256-F1279 HydrophobicContact CD2-CZ 4.5Å; V1274-F1279 HydrophobicContact CB-CE1 4.45Å; V1274-F1279 HydrophobicContact CB-CZ 4.12Å; V1274-F1279 HydrophobicContact CG1-CE1 4.49Å; V1274-F1279 HydrophobicContact CG1-CZ 3.97Å; K1277-F1279 HydrophobicContact CB-CD1 3.97Å; K1277-F1279 HydrophobicContact CB-CE1 3.93Å; K1277-F1279 PolarHBondContact O-N 2.91Å; F1279-A1282 PolarHBondContact O-N 3.08Å; F1279-L1283 VanDerWaalsContact O-CB 3.3Å; F1279-L1283 WeakPolarHBondContact O-CB 3.47Å; F1279-L1283 PolarHBondContact O-N 2.71Å
1280	L	91	Very high	87.1	Confident	7 Å²	7	41.7 Å²	41.7	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-36.1	175	-62.8	179.2	0	0	0	112.2	V1274 K1277 S1278 T1284 V1291 A1298	V1274-L1280 HydrophobicContact CB-CD1 4.39Å; K1277-L1280 PolarHBondContact O-N 3.36Å; S1278-L1280 VanDerWaalsContact C-N 3.33Å; S1278-L1280 PolarHBondContact O-N 3.43Å; L1280-T1284 WeakPolarHBondContact O-CB 3.45Å; L1280-T1284 WeakPolarHBondContact O-CG2 3.34Å; L1280-T1284 PolarHBondContact O-N 3.4Å; L1280-T1284 VanDerWaalsContact O-N 3.13Å; L1280-T1284 PolarHBondContact O-OG1 3.46Å; L1280-V1291 HydrophobicContact CB-CG2 3.84Å; L1280-A1298 HydrophobicContact CD1-CB 4.07Å; L1280-A1298 HydrophobicContact CD2-CB 4.01Å
1281	R	89.3	Confident	86.8	Confident	58 Å²	58	41.7 Å²	41.7	22%	0.219	26%	0.258	C	S	.	.	H	α-helix	trans	-67.9	-41.7	175.5	-60.4	-166.4	-52.2	-119.1	16.8	111.4	R1276 K1277 S1278 T1284 G1285 R1286 V1291	R1276-R1281 PolarHBondContact O-NH1 2.86Å; K1277-R1281 PolarHBondContact O-N 2.7Å; S1278-R1281 WeakPolarHBondContact O-CB 3.33Å; S1278-R1281 PolarHBondContact O-N 3.21Å; S1278-R1281 VanDerWaalsContact O-N 3.1Å; R1281-T1284 PolarHBondContact O-N 3.2Å; R1281-G1285 WeakPolarHBondContact O-CA 3.27Å; R1281-G1285 PolarHBondContact O-N 3.06Å; R1281-R1286 WeakPolarHBondContact CB-O 3.39Å; R1281-R1286 WeakPolarHBondContact CG-O 3.47Å; R1281-R1286 PolarHBondContact O-N 2.89Å; R1281-V1291 HydrophobicContact CG-CB 4.18Å; R1281-V1291 HydrophobicContact CG-CG1 4.28Å; R1281-V1291 HydrophobicContact CG-CG2 3.93Å
1282	A	88.3	Confident	86.4	Confident	67 Å²	67	42.4 Å²	42.4	55%	0.554	27%	0.265	S	S	*	.	H	α-helix	trans	-63.2	-45.7	174.3	0	0	0	0	0	112	P1249 S1278 F1279 T1284	P1249-A1282 HydrophobicContact CG-CB 3.71Å; S1278-A1282 PolarHBondContact O-N 2.81Å; F1279-A1282 PolarHBondContact O-N 3.08Å; A1282-T1284 VanDerWaalsContact C-N 3.3Å; A1282-T1284 PolarHBondContact O-N 3.13Å
1283	L	88.6	Confident	86.2	Confident	106 Å²	106	46.2 Å²	46.2	56%	0.555	30%	0.297	S	S	*	.	H	α-helix	trans	-64.3	-29.6	179.5	-177.1	63.3	0	0	0	113.7	L1253 F1279	L1253-L1283 HydrophobicContact CD1-CD2 4.34Å; L1253-L1283 HydrophobicContact CD2-CD2 4.2Å; F1279-L1283 VanDerWaalsContact O-CB 3.3Å; F1279-L1283 WeakPolarHBondContact O-CB 3.47Å; F1279-L1283 PolarHBondContact O-N 2.71Å
1284	T	88.6	Confident	86	Confident	58 Å²	58	47 Å²	47	36%	0.356	30%	0.303	S	S	.	.	H	α-helix	trans	-115.5	-6.3	-171.8	62.5	0	0	0	0	115.2	L1280 R1281 A1282 R1286 A1294	L1280-T1284 WeakPolarHBondContact O-CB 3.45Å; L1280-T1284 WeakPolarHBondContact O-CG2 3.34Å; L1280-T1284 PolarHBondContact O-N 3.4Å; L1280-T1284 VanDerWaalsContact O-N 3.13Å; L1280-T1284 PolarHBondContact O-OG1 3.46Å; R1281-T1284 PolarHBondContact O-N 3.2Å; A1282-T1284 VanDerWaalsContact C-N 3.3Å; A1282-T1284 PolarHBondContact O-N 3.13Å; T1284-R1286 PolarHBondContact O-N 3.26Å; T1284-A1294 HydrophobicContact CG2-CB 3.82Å
1285	G	86.5	Confident	86.1	Confident	71 Å²	71	47 Å²	47	73%	0.732	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	14	-174.1	0	0	0	0	0	114.6	R1281	R1281-G1285 WeakPolarHBondContact O-CA 3.27Å; R1281-G1285 PolarHBondContact O-N 3.06Å
1286	R	85.8	Confident	86.4	Confident	144 Å²	144	48.7 Å²	48.7	54%	0.543	31%	0.312	S	S	.	.			trans	-92.2	141.3	-173.9	-66.7	-59	-179	162.8	-2.5	113.1	R1281 T1284 D1290 V1291	R1281-R1286 WeakPolarHBondContact CB-O 3.39Å; R1281-R1286 WeakPolarHBondContact CG-O 3.47Å; R1281-R1286 PolarHBondContact O-N 2.89Å; T1284-R1286 PolarHBondContact O-N 3.26Å; R1286-D1290 HydrophobicContact CB-CB 4.06Å; R1286-D1290 HydrophobicContact CG-CB 4.35Å; R1286-V1291 HydrophobicContact CB-CB 4.2Å
1287	G	79.4	Confident	86.8	Confident	31 Å²	31	49.7 Å²	49.7	32%	0.32	33%	0.329	S	S	.	.			trans	-67.8	166.9	172.1	0	0	0	0	0	112.6	G1289 D1290 V1291	G1287-G1289 PolarHBondContact O-N 2.83Å; G1287-G1289 VanDerWaalsContact O-N 3.09Å; G1287-D1290 PolarHBondContact O-N 3.45Å; G1287-V1291 PolarHBondContact O-N 2.76Å
1288	P	71.9	Confident	87.1	Confident	44 Å²	44	48.3 Å²	48.3	29%	0.286	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.5	-177	-25.7	35.1	0	0	0	115.6
1289	G	74	Confident	87.5	Confident	65 Å²	65	47.3 Å²	47.3	67%	0.67	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-29.2	173.9	0	0	0	0	0	114.6	G1287	G1287-G1289 PolarHBondContact O-N 2.83Å; G1287-G1289 VanDerWaalsContact O-N 3.09Å
1290	D	81.5	Confident	87.7	Confident	109 Å²	109	49 Å²	49	58%	0.583	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-8.1	-173.9	-55.7	-39.4	0	0	0	113.3	R1286 G1287 G1292	R1286-D1290 HydrophobicContact CB-CB 4.06Å; R1286-D1290 HydrophobicContact CG-CB 4.35Å; G1287-D1290 PolarHBondContact O-N 3.45Å; D1290-G1292 PolarHBondContact O-N 3.27Å
1291	V	87.3	Confident	87.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	3.6	-176.3	74.3	0	0	0	0	113.4	R1276 L1280 R1281 R1286 G1287 A1293 A1294 T1295	R1276-V1291 HydrophobicContact CB-CG1 4Å; R1276-V1291 HydrophobicContact CG-CG1 4.07Å; L1280-V1291 HydrophobicContact CB-CG2 3.84Å; R1281-V1291 HydrophobicContact CG-CB 4.18Å; R1281-V1291 HydrophobicContact CG-CG1 4.28Å; R1281-V1291 HydrophobicContact CG-CG2 3.93Å; R1286-V1291 HydrophobicContact CB-CB 4.2Å; G1287-V1291 PolarHBondContact O-N 2.76Å; V1291-A1293 PolarHBondContact O-N 2.94Å; V1291-A1294 HydrophobicContact CG2-CB 3.95Å; V1291-A1294 PolarHBondContact O-N 2.94Å; V1291-A1294 VanDerWaalsContact O-N 3.16Å; V1291-T1295 WeakPolarHBondContact O-CB 3.42Å; V1291-T1295 PolarHBondContact O-N 2.91Å; V1291-T1295 PolarHBondContact O-OG1 2.94Å
1292	G	87.4	Confident	87.8	Confident	14 Å²	14	48.4 Å²	48.4	14%	0.144	34%	0.335	C	S	.	.	H	α-helix	trans	-57	-43	-178.8	0	0	0	0	0	113.8	D1290 A1294 T1295 L1296	D1290-G1292 PolarHBondContact O-N 3.27Å; G1292-A1294 PolarHBondContact O-N 3.12Å; G1292-T1295 WeakPolarHBondContact O-CB 2.94Å; G1292-T1295 PolarHBondContact O-N 2.77Å; G1292-L1296 PolarHBondContact O-N 3.31Å
1293	A	89.2	Confident	87.9	Confident	82 Å²	82	46.2 Å²	46.2	68%	0.678	32%	0.317	S	S	*	.	H	α-helix	trans	-66.3	-35.5	177	0	0	0	0	0	113.2	V1291 A1297	V1291-A1293 PolarHBondContact O-N 2.94Å; A1293-A1297 WeakPolarHBondContact O-CB 3.26Å; A1293-A1297 PolarHBondContact O-N 3.04Å
1294	A	90.6	Very high	87.7	Confident	19 Å²	19	44.1 Å²	44.1	16%	0.157	32%	0.315	C	S	.	.	H	α-helix	trans	-74.2	-33.9	175.8	0	0	0	0	0	111.9	T1284 V1291 G1292 A1298	T1284-A1294 HydrophobicContact CG2-CB 3.82Å; V1291-A1294 HydrophobicContact CG2-CB 3.95Å; V1291-A1294 PolarHBondContact O-N 2.94Å; V1291-A1294 VanDerWaalsContact O-N 3.16Å; G1292-A1294 PolarHBondContact O-N 3.12Å; A1294-A1298 PolarHBondContact O-N 3.39Å; A1294-A1298 VanDerWaalsContact O-N 3.1Å
1295	T	93.4	Very high	87.6	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-54	170.3	-67.2	0	0	0	0	110.2	R1276 V1291 G1292 A1297 A1298 E1299	R1276-T1295 PolarHBondContact N-OG1 3.37Å; R1276-T1295 VanDerWaalsContact N-OG1 3.13Å; V1291-T1295 WeakPolarHBondContact O-CB 3.42Å; V1291-T1295 PolarHBondContact O-N 2.91Å; V1291-T1295 PolarHBondContact O-OG1 2.94Å; G1292-T1295 WeakPolarHBondContact O-CB 2.94Å; G1292-T1295 PolarHBondContact O-N 2.77Å; T1295-A1297 VanDerWaalsContact C-N 3.31Å; T1295-A1297 PolarHBondContact O-N 2.98Å; T1295-A1298 PolarHBondContact O-N 3.39Å; T1295-A1298 VanDerWaalsContact O-N 3.1Å; T1295-E1299 HydrophobicContact CG2-CG 4.27Å; T1295-E1299 WeakPolarHBondContact CG2-OE1 3.39Å; T1295-E1299 WeakPolarHBondContact O-CG 3.38Å; T1295-E1299 PolarHBondContact O-N 3.07Å
1296	L	93.9	Very high	87.5	Confident	43 Å²	43	41 Å²	41	23%	0.225	29%	0.294	C	S	.	.	H	α-helix	trans	-58.2	-41.3	177.6	179.5	60.7	0	0	0	112.4	G1292 A1298 E1299 L1300 P1317 L1318	G1292-L1296 PolarHBondContact O-N 3.31Å; L1296-A1298 VanDerWaalsContact C-N 3.34Å; L1296-A1298 PolarHBondContact O-N 3.42Å; L1296-E1299 PolarHBondContact O-N 3.36Å; L1296-L1300 HydrophobicContact CD1-CD1 3.87Å; L1296-L1300 HydrophobicContact CD1-CD2 4.38Å; L1296-L1300 HydrophobicContact CD1-CG 3.86Å; L1296-L1300 HydrophobicContact CG-CD1 3.87Å; L1296-L1300 HydrophobicContact CG-CG 4.28Å; L1296-L1300 WeakPolarHBondContact O-CB 3.48Å; L1296-L1300 VanDerWaalsContact O-CG 3.27Å; L1296-L1300 WeakPolarHBondContact O-CG 3.48Å; L1296-L1300 PolarHBondContact O-N 2.99Å; L1296-P1317 HydrophobicContact CD1-CB 4.32Å; L1296-P1317 VanDerWaalsContact CD1-O 3.29Å; L1296-P1317 WeakPolarHBondContact CD1-O 3.29Å; L1296-P1317 HydrophobicContact CD2-CB 4.16Å; L1296-L1318 HydrophobicContact CD1-CB 4.4Å; L1296-L1318 HydrophobicContact CD1-CD1 4.41Å
1297	A	92.2	Very high	87.8	Confident	63 Å²	63	34.5 Å²	34.5	52%	0.521	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-42	176	0	0	0	0	0	112.4	A1293 T1295 A1301	A1293-A1297 WeakPolarHBondContact O-CB 3.26Å; A1293-A1297 PolarHBondContact O-N 3.04Å; T1295-A1297 VanDerWaalsContact C-N 3.31Å; T1295-A1297 PolarHBondContact O-N 2.98Å; A1297-A1301 WeakPolarHBondContact O-CB 3.26Å; A1297-A1301 PolarHBondContact O-N 3.29Å; A1297-A1301 VanDerWaalsContact O-N 3.08Å
1298	A	93.9	Very high	88.4	Confident	7 Å²	7	33.8 Å²	33.8	6%	0.058	26%	0.26	C	S	.	.	H	α-helix	trans	-70.8	-35.9	176.1	0	0	0	0	0	112.9	L1256 V1274 L1280 A1294 T1295 L1296 A1301 A1302	L1256-A1298 HydrophobicContact CD2-CB 3.93Å; V1274-A1298 HydrophobicContact CB-CB 4.25Å; V1274-A1298 HydrophobicContact CG2-CB 3.83Å; L1280-A1298 HydrophobicContact CD1-CB 4.07Å; L1280-A1298 HydrophobicContact CD2-CB 4.01Å; A1294-A1298 PolarHBondContact O-N 3.39Å; A1294-A1298 VanDerWaalsContact O-N 3.1Å; T1295-A1298 PolarHBondContact O-N 3.39Å; T1295-A1298 VanDerWaalsContact O-N 3.1Å; L1296-A1298 VanDerWaalsContact C-N 3.34Å; L1296-A1298 PolarHBondContact O-N 3.42Å; A1298-A1301 PolarHBondContact O-N 3.22Å; A1298-A1302 WeakPolarHBondContact O-CB 3.37Å; A1298-A1302 PolarHBondContact O-N 2.86Å
1299	E	95.2	Very high	89.5	Confident	2 Å²	2	32 Å²	32	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-70.7	-38.1	176.8	-68.1	173.2	177.6	0	0	111.9	V1274 S1275 T1295 L1296 A1302 A1303 I1310 T1312 L1318	V1274-E1299 HydrophobicContact CG2-CG 3.47Å; V1274-E1299 VanDerWaalsContact CG2-CG 3.47Å; S1275-E1299 WeakPolarHBondContact CB-OE1 3.08Å; S1275-E1299 PolarHBondContact OG-OE1 3.11Å; T1295-E1299 HydrophobicContact CG2-CG 4.27Å; T1295-E1299 WeakPolarHBondContact CG2-OE1 3.39Å; T1295-E1299 WeakPolarHBondContact O-CG 3.38Å; T1295-E1299 PolarHBondContact O-N 3.07Å; L1296-E1299 PolarHBondContact O-N 3.36Å; E1299-A1302 PolarHBondContact O-N 3.22Å; E1299-A1303 WeakPolarHBondContact O-CB 3.38Å; E1299-A1303 PolarHBondContact O-N 3.47Å; E1299-I1310 HydrophobicContact CB-CD1 4.32Å; E1299-I1310 HydrophobicContact CB-CG2 4.26Å; E1299-I1310 HydrophobicContact CG-CG2 3.91Å; E1299-I1310 WeakPolarHBondContact O-CD1 3.43Å; E1299-T1312 WeakPolarHBondContact OE1-CB 3.29Å; E1299-T1312 PolarHBondContact OE1-OG1 2.98Å; E1299-T1312 PolarHBondContact OE2-OG1 2.92Å; E1299-L1318 HydrophobicContact CB-CD1 3.76Å; E1299-L1318 HydrophobicContact CB-CD2 4.3Å
1300	L	93.3	Very high	90.5	Very high	38 Å²	38	29 Å²	29	20%	0.199	22%	0.216	C	C	.	.	H	α-helix	trans	-69.8	-33.1	173	-67.1	173	0	0	0	112.1	L1296 A1303 A1304 L1318 L1322 L1325	L1296-L1300 HydrophobicContact CD1-CD1 3.87Å; L1296-L1300 HydrophobicContact CD1-CD2 4.38Å; L1296-L1300 HydrophobicContact CD1-CG 3.86Å; L1296-L1300 HydrophobicContact CG-CD1 3.87Å; L1296-L1300 HydrophobicContact CG-CG 4.28Å; L1296-L1300 WeakPolarHBondContact O-CB 3.48Å; L1296-L1300 VanDerWaalsContact O-CG 3.27Å; L1296-L1300 WeakPolarHBondContact O-CG 3.48Å; L1296-L1300 PolarHBondContact O-N 2.99Å; L1300-A1303 PolarHBondContact O-N 2.91Å; L1300-A1304 WeakPolarHBondContact O-CB 3.43Å; L1300-A1304 PolarHBondContact O-N 3.42Å; L1300-L1318 HydrophobicContact CD2-CD1 4.04Å; L1300-L1322 HydrophobicContact CD2-CD2 4.26Å; L1300-L1322 HydrophobicContact CD2-CG 4.16Å; L1300-L1325 HydrophobicContact CB-CD1 4.29Å; L1300-L1325 HydrophobicContact CD2-CD1 3.8Å
1301	A	90.6	Very high	91.1	Very high	51 Å²	51	25.1 Å²	25.1	42%	0.421	19%	0.193	S	C	.	.	H	α-helix	trans	-65.6	-45.6	170.7	0	0	0	0	0	111.8	A1297 A1298 A1303 A1304 G1305	A1297-A1301 WeakPolarHBondContact O-CB 3.26Å; A1297-A1301 PolarHBondContact O-N 3.29Å; A1297-A1301 VanDerWaalsContact O-N 3.08Å; A1298-A1301 PolarHBondContact O-N 3.22Å; A1301-A1303 VanDerWaalsContact C-N 3.33Å; A1301-A1303 PolarHBondContact O-N 3.24Å; A1301-A1304 PolarHBondContact O-N 3.47Å; A1301-A1304 VanDerWaalsContact O-N 3.14Å; A1301-G1305 PolarHBondContact O-N 3.47Å
1302	A	91.6	Very high	91.5	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-58.4	-41.4	173.3	0	0	0	0	0	112.7	L1256 F1259 L1272 A1298 E1299 G1306 A1307 I1310	L1256-A1302 HydrophobicContact CD1-CB 4.15Å; F1259-A1302 WeakPolarHBondContact CZ-O 3.46Å; L1272-A1302 HydrophobicContact CB-CB 4.42Å; L1272-A1302 HydrophobicContact CD1-CB 3.6Å; A1298-A1302 WeakPolarHBondContact O-CB 3.37Å; A1298-A1302 PolarHBondContact O-N 2.86Å; E1299-A1302 PolarHBondContact O-N 3.22Å; A1302-G1306 PolarHBondContact O-N 3.4Å; A1302-A1307 WeakPolarHBondContact O-CB 3.18Å; A1302-A1307 PolarHBondContact O-N 3.25Å; A1302-I1310 HydrophobicContact CB-CD1 3.75Å; A1302-I1310 HydrophobicContact CB-CG1 4.34Å
1303	A	90.3	Very high	91.6	Very high	22 Å²	22	25.8 Å²	25.8	18%	0.182	19%	0.193	C	C	.	.	H	α-helix	trans	-71	-30.4	175.8	0	0	0	0	0	113	L1069 E1299 L1300 A1301 G1306 I1310 L1322	L1069-A1303 HydrophobicContact CD2-CB 4.23Å; E1299-A1303 WeakPolarHBondContact O-CB 3.38Å; E1299-A1303 PolarHBondContact O-N 3.47Å; L1300-A1303 PolarHBondContact O-N 2.91Å; A1301-A1303 VanDerWaalsContact C-N 3.33Å; A1301-A1303 PolarHBondContact O-N 3.24Å; A1303-G1306 PolarHBondContact O-N 3.1Å; A1303-I1310 HydrophobicContact CB-CD1 4.05Å; A1303-L1322 HydrophobicContact CB-CD2 3.65Å
1304	A	86	Confident	91.7	Very high	62 Å²	62	24 Å²	24	51%	0.512	17%	0.171	S	C	.	.	H	α-helix	trans	-71	-44	174.5	0	0	0	0	0	112	L1300 A1301 G1306	L1300-A1304 WeakPolarHBondContact O-CB 3.43Å; L1300-A1304 PolarHBondContact O-N 3.42Å; A1301-A1304 PolarHBondContact O-N 3.47Å; A1301-A1304 VanDerWaalsContact O-N 3.14Å; A1304-G1306 PolarHBondContact O-N 2.82Å; A1304-G1306 VanDerWaalsContact O-N 3.15Å
1305	G	84.8	Confident	91.8	Very high	36 Å²	36	23.1 Å²	23.1	37%	0.371	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	2.6	173.7	0	0	0	0	0	114.8	F1259 A1301	F1259-G1305 WeakPolarHBondContact CZ-O 3.4Å; A1301-G1305 PolarHBondContact O-N 3.47Å
1306	G	86.2	Confident	91.8	Very high	27 Å²	27	29.8 Å²	29.8	28%	0.278	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	40.6	171.2	0	0	0	0	0	115.1	R1263 A1302 A1303 A1304	R1263-G1306 PolarHBondContact NH1-O 2.95Å; A1302-G1306 PolarHBondContact O-N 3.4Å; A1303-G1306 PolarHBondContact O-N 3.1Å; A1304-G1306 PolarHBondContact O-N 2.82Å; A1304-G1306 VanDerWaalsContact O-N 3.15Å
1307	A	90.3	Very high	91.8	Very high	8 Å²	8	30.1 Å²	30.1	7%	0.066	19%	0.193	C	C	.	.			trans	-62.9	142	160.7	0	0	0	0	0	110.8	L1069 F1259 L1272 A1302 I1310	L1069-A1307 WeakPolarHBondContact CD1-O 3.18Å; F1259-A1307 HydrophobicContact CE2-CB 4.05Å; F1259-A1307 HydrophobicContact CZ-CB 4.36Å; L1272-A1307 HydrophobicContact CD1-CB 4.14Å; L1272-A1307 HydrophobicContact CG-CB 4.43Å; A1302-A1307 WeakPolarHBondContact O-CB 3.18Å; A1302-A1307 PolarHBondContact O-N 3.25Å; A1307-I1310 HydrophobicContact CB-CG1 4.38Å
1308	D	92.6	Very high	91.9	Very high	16 Å²	16	27.1 Å²	27.1	9%	0.086	17%	0.168	C	C	.	.	S	Bend	trans	-85.7	-25.8	173.1	-58.5	-110.6	0	0	0	111.3	K1067 I1070 R1263 P1269 V1270	K1067-D1308 IonicContact NZ-OD1 3.57Å; K1067-D1308 PolarHBondContact NZ-OD1 3.17Å; I1070-D1308 PolarHBondContact N-O 2.56Å; R1263-D1308 IonicContact CZ-OD1 2.7Å; R1263-D1308 IonicContact CZ-OD2 2.72Å; R1263-D1308 VanDerWaalsContact CZ-OD2 3.26Å; R1263-D1308 VanDerWaalsContact NH1-CG 3.32Å; R1263-D1308 IonicContact NH1-OD1 3.73Å; R1263-D1308 IonicContact NH1-OD2 2.66Å; R1263-D1308 PolarHBondContact NH1-OD2 3.3Å; R1263-D1308 IonicContact NH2-OD1 3.22Å; R1263-D1308 PolarHBondContact NH2-OD1 2.72Å; R1263-D1308 IonicContact NH2-OD2 3.65Å; R1263-D1308 PolarHBondContact NH2-OD2 3.21Å; R1263-D1308 VanDerWaalsContact NH2-OD2 3.17Å; P1269-D1308 WeakPolarHBondContact CA-OD2 3.49Å; P1269-D1308 HydrophobicContact CB-CB 3.67Å; P1269-D1308 WeakPolarHBondContact CB-OD2 3.46Å; V1270-D1308 PolarHBondContact N-OD2 3.49Å; V1270-D1308 PolarHBondContact O-N 3.07Å
1309	F	94.6	Very high	91.8	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	143.2	179.4	-54.4	-94	0	0	0	112.5	I1070 F1072 Y1166 V1236 P1269 V1270 L1271 L1272	I1070-F1309 HydrophobicContact CB-CD1 3.54Å; I1070-F1309 HydrophobicContact CB-CE1 3.81Å; I1070-F1309 HydrophobicContact CB-CG 4.48Å; I1070-F1309 HydrophobicContact CD1-CD1 4.3Å; I1070-F1309 HydrophobicContact CD1-CE1 3.66Å; I1070-F1309 HydrophobicContact CD1-CZ 4.24Å; I1070-F1309 HydrophobicContact CG1-CD1 4.45Å; I1070-F1309 HydrophobicContact CG1-CE1 4.29Å; I1070-F1309 HydrophobicContact CG2-CD1 3.66Å; I1070-F1309 HydrophobicContact CG2-CE1 3.8Å; I1070-F1309 VanDerWaalsContact O-CA 3.26Å; I1070-F1309 WeakPolarHBondContact O-CA 2.79Å; F1072-F1309 HydrophobicContact CD2-CD1 4.15Å; F1072-F1309 AromaticContact CE2-CD1 3.49Å; F1072-F1309 HydrophobicContact CE2-CD1 3.49Å; F1072-F1309 VanDerWaalsContact CE2-CD1 3.49Å; F1072-F1309 AromaticContact CE2-CE1 3.93Å; F1072-F1309 HydrophobicContact CE2-CE1 3.93Å; F1072-F1309 HydrophobicContact CE2-CG 4.45Å; F1072-F1309 HydrophobicContact CZ-CD1 4.21Å; F1072-F1309 HydrophobicContact CZ-CE1 4.44Å; Y1166-F1309 AromaticContact CE1-CE1 3.81Å; Y1166-F1309 HydrophobicContact CE1-CE1 3.81Å; Y1166-F1309 AromaticContact CE1-CZ 3.98Å; Y1166-F1309 HydrophobicContact CE1-CZ 3.98Å; Y1166-F1309 AromaticContact CZ-CE1 3.95Å; V1236-F1309 HydrophobicContact CB-CE2 4.31Å; V1236-F1309 HydrophobicContact CG1-CD2 3.52Å; V1236-F1309 HydrophobicContact CG1-CE2 3.56Å; V1236-F1309 HydrophobicContact CG1-CG 4.48Å; V1236-F1309 HydrophobicContact CG2-CD2 4.48Å; V1236-F1309 HydrophobicContact CG2-CE2 3.7Å; V1236-F1309 HydrophobicContact CG2-CZ 4.08Å; P1269-F1309 HydrophobicContact CB-CD2 4.44Å; P1269-F1309 HydrophobicContact CB-CE2 3.91Å; P1269-F1309 HydrophobicContact CG-CE2 4.18Å; V1270-F1309 PolarHBondContact O-N 3.02Å; L1271-F1309 WeakPolarHBondContact CA-O 3.24Å; L1271-F1309 HydrophobicContact CB-CB 3.77Å; L1271-F1309 HydrophobicContact CB-CD2 4.38Å; L1271-F1309 HydrophobicContact CB-CG 4.42Å; L1271-F1309 HydrophobicContact CD1-CB 3.71Å; L1271-F1309 HydrophobicContact CD1-CG 4.24Å; L1271-F1309 HydrophobicContact CG-CB 3.67Å; L1272-F1309 PolarHBondContact N-O 3.2Å
1310	I	95.7	Very high	91.6	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	133.4	168.9	-71.5	177.4	0	0	0	110.4	L1069 I1070 I1071 F1072 L1272 E1299 A1302 A1303 A1307 L1318	L1069-I1310 HydrophobicContact CD1-CD1 4.29Å; L1069-I1310 HydrophobicContact CD1-CG1 4.07Å; L1069-I1310 HydrophobicContact CD2-CB 4.41Å; L1069-I1310 HydrophobicContact CD2-CD1 3.99Å; L1069-I1310 HydrophobicContact CD2-CG1 4.31Å; I1070-I1310 PolarHBondContact O-N 3.26Å; I1070-I1310 VanDerWaalsContact O-N 3.13Å; I1071-I1310 WeakPolarHBondContact CA-O 3.37Å; F1072-I1310 PolarHBondContact N-O 3.01Å; L1272-I1310 WeakPolarHBondContact O-CA 3.41Å; E1299-I1310 HydrophobicContact CB-CD1 4.32Å; E1299-I1310 HydrophobicContact CB-CG2 4.26Å; E1299-I1310 HydrophobicContact CG-CG2 3.91Å; E1299-I1310 WeakPolarHBondContact O-CD1 3.43Å; A1302-I1310 HydrophobicContact CB-CD1 3.75Å; A1302-I1310 HydrophobicContact CB-CG1 4.34Å; A1303-I1310 HydrophobicContact CB-CD1 4.05Å; A1307-I1310 HydrophobicContact CB-CG1 4.38Å; I1310-L1318 HydrophobicContact CB-CD2 4.1Å; I1310-L1318 HydrophobicContact CD1-CD2 4.47Å; I1310-L1318 HydrophobicContact CG2-CD2 3.6Å
1311	R	94.9	Very high	91.5	Very high	29 Å²	29	33.3 Å²	33.3	11%	0.109	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	114	-179.8	-172.6	-168.9	-176.9	-140	1.1	111	F1072 I1074 D1110 D1149 L1271 L1272	F1072-R1311 HydrophobicContact CB-CB 4.1Å; F1072-R1311 HydrophobicContact CB-CG 4.08Å; F1072-R1311 WeakPolarHBondContact O-CA 3.03Å; I1074-R1311 HydrophobicContact CD1-CG 3.92Å; I1074-R1311 HydrophobicContact CG1-CG 3.64Å; D1110-R1311 IonicContact OD2-CZ 3.77Å; D1110-R1311 IonicContact OD2-NE 3.23Å; D1110-R1311 PolarHBondContact OD2-NE 2.91Å; D1110-R1311 IonicContact OD2-NH2 3.77Å; D1110-R1311 PolarHBondContact OD2-NH2 2.97Å; D1149-R1311 IonicContact OD2-CZ 3.06Å; D1149-R1311 VanDerWaalsContact OD2-CZ 3.24Å; D1149-R1311 IonicContact OD2-NH1 3.93Å; D1149-R1311 PolarHBondContact OD2-NH1 2.93Å; D1149-R1311 IonicContact OD2-NH2 2.74Å; D1149-R1311 PolarHBondContact OD2-NH2 3.42Å; L1271-R1311 HydrophobicContact CD2-CB 4.17Å; L1272-R1311 PolarHBondContact O-N 2.96Å
1312	T	93.7	Very high	91.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	154.2	-171.4	-169.1	0	0	0	0	115	I1071 F1072 I1074 S1275 E1299 E1314 P1315 L1318	I1071-T1312 HydrophobicContact CG2-CG2 3.87Å; F1072-T1312 PolarHBondContact O-N 3.18Å; I1074-T1312 WeakPolarHBondContact CG1-O 3.5Å; I1074-T1312 PolarHBondContact N-O 3.31Å; S1275-T1312 PolarHBondContact OG-OG1 3.03Å; S1275-T1312 VanDerWaalsContact OG-OG1 3.13Å; E1299-T1312 WeakPolarHBondContact OE1-CB 3.29Å; E1299-T1312 PolarHBondContact OE1-OG1 2.98Å; E1299-T1312 PolarHBondContact OE2-OG1 2.92Å; T1312-E1314 PolarHBondContact OG1-N 2.72Å; T1312-E1314 VanDerWaalsContact OG1-N 3.16Å; T1312-P1315 HydrophobicContact CG2-CB 4.28Å; T1312-L1318 HydrophobicContact CG2-CD2 4.12Å
1313	H	91.1	Very high	91.2	Very high	27 Å²	27	35.5 Å²	35.5	13%	0.125	21%	0.211	C	C	.	.	S	Bend	trans	-81.5	-16.4	169.2	-53.3	89.1	0	0	0	112.4	S1275	S1275-H1313 WeakPolarHBondContact CB-ND1 3.23Å; S1275-H1313 PolarHBondContact OG-N 2.89Å; S1275-H1313 PolarHBondContact OG-ND1 3.03Å
1314	E	90.6	Very high	90.8	Very high	46 Å²	46	38.6 Å²	38.6	22%	0.215	23%	0.227	C	C	.	.			trans	-131.2	65.6	-166.4	-72.9	169.3	-156.3	0	0	111	R1276 T1312 R1316 P1317	R1276-E1314 IonicContact CZ-OE1 3.21Å; R1276-E1314 IonicContact NE-OE1 2.66Å; R1276-E1314 PolarHBondContact NE-OE1 2.83Å; R1276-E1314 IonicContact NH2-OE1 2.8Å; R1276-E1314 PolarHBondContact NH2-OE1 2.9Å; T1312-E1314 PolarHBondContact OG1-N 2.72Å; T1312-E1314 VanDerWaalsContact OG1-N 3.16Å; E1314-R1316 VanDerWaalsContact C-N 3.27Å; E1314-R1316 PolarHBondContact O-N 2.7Å; E1314-P1317 HydrophobicContact CB-CG 4.19Å; E1314-P1317 WeakPolarHBondContact O-CD 3.39Å
1315	P	93.7	Very high	90.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-28.5	-173.6	26.6	-35.4	0	0	0	113.2	I1071 L1101 E1104 A1106 T1312 L1318 R1319	I1071-P1315 HydrophobicContact CG2-CB 3.84Å; L1101-P1315 HydrophobicContact CB-CG 4.38Å; L1101-P1315 VanDerWaalsContact CD2-CD 3.4Å; L1101-P1315 HydrophobicContact CD2-CG 3.63Å; E1104-P1315 HydrophobicContact CB-CG 3.98Å; E1104-P1315 CarbonylContact O-C 3.59Å; A1106-P1315 HydrophobicContact CB-CB 4.26Å; A1106-P1315 HydrophobicContact CB-CG 4.38Å; T1312-P1315 HydrophobicContact CG2-CB 4.28Å; P1315-L1318 PolarHBondContact O-N 2.91Å; P1315-R1319 WeakPolarHBondContact O-CG 3.44Å; P1315-R1319 PolarHBondContact O-N 3.5Å
1316	R	93.2	Very high	90.4	Very high	141 Å²	141	39.4 Å²	39.4	53%	0.532	22%	0.222	S	C	.	.	H	α-helix	trans	-66.8	-55.5	179.9	170.1	175	-176.3	174.8	3.9	113	E1104 E1314 L1318 R1319 D1320	E1104-R1316 HydrophobicContact CB-CB 3.82Å; E1104-R1316 HydrophobicContact CG-CB 4.08Å; E1104-R1316 VanDerWaalsContact O-CA 3.3Å; E1104-R1316 WeakPolarHBondContact O-CA 3.35Å; E1104-R1316 PolarHBondContact O-N 2.76Å; E1314-R1316 VanDerWaalsContact C-N 3.27Å; E1314-R1316 PolarHBondContact O-N 2.7Å; R1316-L1318 PolarHBondContact O-N 2.85Å; R1316-R1319 PolarHBondContact O-N 3.27Å; R1316-D1320 WeakPolarHBondContact CG-OD2 3.44Å; R1316-D1320 IonicContact NE-OD2 2.75Å; R1316-D1320 WeakPolarHBondContact O-CB 3.44Å; R1316-D1320 PolarHBondContact O-N 2.7Å
1317	P	92.9	Very high	89.9	Confident	49 Å²	49	40.8 Å²	40.8	32%	0.318	23%	0.231	S	C	.	.	H	α-helix	trans	-49.5	-39.6	170.7	-31.9	36.1	0	0	0	113.7	L1296 E1314 G1321	L1296-P1317 HydrophobicContact CD1-CB 4.32Å; L1296-P1317 VanDerWaalsContact CD1-O 3.29Å; L1296-P1317 WeakPolarHBondContact CD1-O 3.29Å; L1296-P1317 HydrophobicContact CD2-CB 4.16Å; E1314-P1317 HydrophobicContact CB-CG 4.19Å; E1314-P1317 WeakPolarHBondContact O-CD 3.39Å; P1317-G1321 PolarHBondContact O-N 3.34Å
1318	L	94.3	Very high	89.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.1	-46.7	175.9	-178.3	54	0	0	0	112.3	I1071 L1296 E1299 L1300 I1310 T1312 P1315 R1316 G1321 L1322	I1071-L1318 HydrophobicContact CD1-CB 4.47Å; I1071-L1318 HydrophobicContact CD1-CD2 3.88Å; I1071-L1318 HydrophobicContact CD1-CG 3.95Å; I1071-L1318 HydrophobicContact CG1-CD2 4.16Å; I1071-L1318 HydrophobicContact CG2-CD2 4.33Å; L1296-L1318 HydrophobicContact CD1-CB 4.4Å; L1296-L1318 HydrophobicContact CD1-CD1 4.41Å; E1299-L1318 HydrophobicContact CB-CD1 3.76Å; E1299-L1318 HydrophobicContact CB-CD2 4.3Å; L1300-L1318 HydrophobicContact CD2-CD1 4.04Å; I1310-L1318 HydrophobicContact CB-CD2 4.1Å; I1310-L1318 HydrophobicContact CD1-CD2 4.47Å; I1310-L1318 HydrophobicContact CG2-CD2 3.6Å; T1312-L1318 HydrophobicContact CG2-CD2 4.12Å; P1315-L1318 PolarHBondContact O-N 2.91Å; R1316-L1318 PolarHBondContact O-N 2.85Å; L1318-G1321 PolarHBondContact O-N 3.42Å; L1318-L1322 HydrophobicContact CD1-CD1 3.92Å; L1318-L1322 HydrophobicContact CD1-CG 4.07Å; L1318-L1322 HydrophobicContact CG-CD1 3.86Å; L1318-L1322 HydrophobicContact CG-CG 4.48Å; L1318-L1322 WeakPolarHBondContact O-CB 3.49Å; L1318-L1322 WeakPolarHBondContact O-CD1 3.45Å; L1318-L1322 WeakPolarHBondContact O-CG 3.46Å; L1318-L1322 PolarHBondContact O-N 2.84Å
1319	R	93.1	Very high	88.2	Confident	76 Å²	76	51 Å²	51	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-61.1	-43.4	174.3	-74.3	-66.7	-162.1	-158	2.9	112.5	I1071 G1105 D1107 P1315 R1316 L1322 A1323	I1071-R1319 HydrophobicContact CD1-CG 3.81Å; G1105-R1319 PolarHBondContact O-NE 3.11Å; G1105-R1319 PolarHBondContact O-NH2 2.81Å; D1107-R1319 IonicContact OD1-CZ 3.43Å; D1107-R1319 IonicContact OD1-NH2 3.3Å; D1107-R1319 PolarHBondContact OD1-NH2 3.33Å; D1107-R1319 IonicContact OD2-CZ 2.7Å; D1107-R1319 IonicContact OD2-NH1 3.05Å; D1107-R1319 IonicContact OD2-NH2 2.71Å; D1107-R1319 PolarHBondContact OD2-NH2 3.35Å; P1315-R1319 WeakPolarHBondContact O-CG 3.44Å; P1315-R1319 PolarHBondContact O-N 3.5Å; R1316-R1319 PolarHBondContact O-N 3.27Å; R1319-L1322 PolarHBondContact O-N 3.46Å; R1319-A1323 WeakPolarHBondContact O-CB 3.39Å; R1319-A1323 PolarHBondContact O-N 3.33Å
1320	D	90.8	Very high	86.8	Confident	89 Å²	89	55.2 Å²	55.2	48%	0.476	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-44.8	177.9	-69.7	-28.6	0	0	0	110.3	R1316 A1323 V1324	R1316-D1320 WeakPolarHBondContact CG-OD2 3.44Å; R1316-D1320 IonicContact NE-OD2 2.75Å; R1316-D1320 WeakPolarHBondContact O-CB 3.44Å; R1316-D1320 PolarHBondContact O-N 2.7Å; D1320-A1323 PolarHBondContact O-N 3.09Å; D1320-V1324 WeakPolarHBondContact O-CG2 3.45Å; D1320-V1324 PolarHBondContact O-N 2.6Å; D1320-V1324 VanDerWaalsContact O-N 3.13Å
1321	G	89.8	Confident	85.3	Confident	13 Å²	13	59.4 Å²	59.4	13%	0.134	32%	0.323	C	S	.	.	H	α-helix	trans	-65.3	-39.5	174.7	0	0	0	0	0	113.9	P1317 L1318 V1324 L1325	P1317-G1321 PolarHBondContact O-N 3.34Å; L1318-G1321 PolarHBondContact O-N 3.42Å; G1321-V1324 PolarHBondContact O-N 2.89Å; G1321-L1325 WeakPolarHBondContact O-CG 3.42Å; G1321-L1325 PolarHBondContact O-N 2.82Å
1322	L	90.7	Very high	83.1	Confident	37 Å²	37	60.3 Å²	60.3	19%	0.194	34%	0.336	C	S	.	.	H	α-helix	trans	-66.6	-36.7	175.2	-72.4	165.6	0	0	0	112.2	L1069 I1071 L1300 A1303 L1318 R1319 V1324 L1325 A1326	L1069-L1322 HydrophobicContact CD2-CD1 3.64Å; L1069-L1322 HydrophobicContact CD2-CD2 4.41Å; I1071-L1322 HydrophobicContact CD1-CD1 4.15Å; L1300-L1322 HydrophobicContact CD2-CD2 4.26Å; L1300-L1322 HydrophobicContact CD2-CG 4.16Å; A1303-L1322 HydrophobicContact CB-CD2 3.65Å; L1318-L1322 HydrophobicContact CD1-CD1 3.92Å; L1318-L1322 HydrophobicContact CD1-CG 4.07Å; L1318-L1322 HydrophobicContact CG-CD1 3.86Å; L1318-L1322 HydrophobicContact CG-CG 4.48Å; L1318-L1322 WeakPolarHBondContact O-CB 3.49Å; L1318-L1322 WeakPolarHBondContact O-CD1 3.45Å; L1318-L1322 WeakPolarHBondContact O-CG 3.46Å; L1318-L1322 PolarHBondContact O-N 2.84Å; R1319-L1322 PolarHBondContact O-N 3.46Å; L1322-V1324 VanDerWaalsContact C-N 3.35Å; L1322-L1325 PolarHBondContact O-N 3.17Å; L1322-A1326 WeakPolarHBondContact O-CB 3.36Å; L1322-A1326 PolarHBondContact O-N 2.94Å
1323	A	85.6	Confident	80.9	Confident	61 Å²	61	68.6 Å²	68.6	50%	0.504	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-40.2	173.8	0	0	0	0	0	111.5	R1319 D1320 A1326 A1327	R1319-A1323 WeakPolarHBondContact O-CB 3.39Å; R1319-A1323 PolarHBondContact O-N 3.33Å; D1320-A1323 PolarHBondContact O-N 3.09Å; A1323-A1326 PolarHBondContact O-N 2.77Å; A1323-A1327 WeakPolarHBondContact O-CB 3.47Å; A1323-A1327 PolarHBondContact O-N 3.05Å
1324	V	81.7	Confident	78.9	Confident	87 Å²	87	73.7 Å²	73.7	53%	0.527	39%	0.394	S	S	.	.	H	α-helix	trans	-63.7	-45.8	172.3	173	0	0	0	0	111.3	D1320 G1321 L1322 A1326 A1327 L1328	D1320-V1324 WeakPolarHBondContact O-CG2 3.45Å; D1320-V1324 PolarHBondContact O-N 2.6Å; D1320-V1324 VanDerWaalsContact O-N 3.13Å; G1321-V1324 PolarHBondContact O-N 2.89Å; L1322-V1324 VanDerWaalsContact C-N 3.35Å; V1324-A1326 VanDerWaalsContact C-N 3.32Å; V1324-A1326 PolarHBondContact O-N 2.84Å; V1324-A1327 PolarHBondContact O-N 2.7Å; V1324-L1328 HydrophobicContact CG1-CD1 3.94Å; V1324-L1328 HydrophobicContact CG1-CG 4.4Å; V1324-L1328 WeakPolarHBondContact O-CB 3.35Å; V1324-L1328 VanDerWaalsContact O-CG 3.3Å; V1324-L1328 WeakPolarHBondContact O-CG 3.4Å; V1324-L1328 PolarHBondContact O-N 3.37Å
1325	L	82.7	Confident	76.5	Confident	56 Å²	56	81.8 Å²	81.8	29%	0.293	42%	0.423	S	S	.	.	H	α-helix	trans	-62	-37.3	176.1	-72.1	-178.8	0	0	0	112.8	L1300 G1321 L1322 K1329	L1300-L1325 HydrophobicContact CB-CD1 4.29Å; L1300-L1325 HydrophobicContact CD2-CD1 3.8Å; G1321-L1325 WeakPolarHBondContact O-CG 3.42Å; G1321-L1325 PolarHBondContact O-N 2.82Å; L1322-L1325 PolarHBondContact O-N 3.17Å; L1325-K1329 WeakPolarHBondContact O-CB 3.3Å; L1325-K1329 WeakPolarHBondContact O-CG 3.38Å; L1325-K1329 PolarHBondContact O-N 3.02Å
1326	A	80.6	Confident	73.8	Confident	59 Å²	59	86.7 Å²	86.7	49%	0.488	44%	0.442	S	S	.	.	H	α-helix	trans	-66.3	-46.5	175.1	0	0	0	0	0	111.6	L1322 A1323 V1324 L1328 K1329 E1330	L1322-A1326 WeakPolarHBondContact O-CB 3.36Å; L1322-A1326 PolarHBondContact O-N 2.94Å; A1323-A1326 PolarHBondContact O-N 2.77Å; V1324-A1326 VanDerWaalsContact C-N 3.32Å; V1324-A1326 PolarHBondContact O-N 2.84Å; A1326-L1328 VanDerWaalsContact C-N 3.33Å; A1326-L1328 PolarHBondContact O-N 3.3Å; A1326-K1329 PolarHBondContact O-N 2.69Å; A1326-E1330 PolarHBondContact O-N 3.03Å
1327	A	75.3	Confident	71.1	Confident	56 Å²	56	86 Å²	86	46%	0.463	46%	0.455	S	S	.	.	H	α-helix	trans	-61.6	-39	176.6	0	0	0	0	0	112.4	A1323 V1324 T1331	A1323-A1327 WeakPolarHBondContact O-CB 3.47Å; A1323-A1327 PolarHBondContact O-N 3.05Å; V1324-A1327 PolarHBondContact O-N 2.7Å; A1327-T1331 VanDerWaalsContact O-CB 3.31Å; A1327-T1331 WeakPolarHBondContact O-CB 3.34Å; A1327-T1331 PolarHBondContact O-N 3.35Å; A1327-T1331 PolarHBondContact O-OG1 3.4Å
1328	L	74	Confident	68.9	Low	106 Å²	106	89.8 Å²	89.8	56%	0.555	47%	0.473	S	S	*	.	H	α-helix	trans	-65.2	-44.6	173.9	-72	170.4	0	0	0	112	V1324 A1326 E1330 T1331 A1332	V1324-L1328 HydrophobicContact CG1-CD1 3.94Å; V1324-L1328 HydrophobicContact CG1-CG 4.4Å; V1324-L1328 WeakPolarHBondContact O-CB 3.35Å; V1324-L1328 VanDerWaalsContact O-CG 3.3Å; V1324-L1328 WeakPolarHBondContact O-CG 3.4Å; V1324-L1328 PolarHBondContact O-N 3.37Å; A1326-L1328 VanDerWaalsContact C-N 3.33Å; A1326-L1328 PolarHBondContact O-N 3.3Å; L1328-E1330 VanDerWaalsContact C-N 3.34Å; L1328-E1330 PolarHBondContact O-N 2.82Å; L1328-T1331 PolarHBondContact O-N 2.87Å; L1328-A1332 WeakPolarHBondContact O-CB 3.33Å; L1328-A1332 PolarHBondContact O-N 3.13Å
1329	K	72.3	Confident	66.5	Low	132 Å²	132	93.6 Å²	93.6	57%	0.574	49%	0.493	S	S	*	.	H	α-helix	trans	-62.7	-39.1	176.8	-77.8	177.7	176.8	-178.1	0	112.2	L1325 A1326 A1332 R1333	L1325-K1329 WeakPolarHBondContact O-CB 3.3Å; L1325-K1329 WeakPolarHBondContact O-CG 3.38Å; L1325-K1329 PolarHBondContact O-N 3.02Å; A1326-K1329 PolarHBondContact O-N 2.69Å; K1329-A1332 PolarHBondContact O-N 3.26Å; K1329-R1333 WeakPolarHBondContact O-CG 3.26Å; K1329-R1333 PolarHBondContact O-N 2.91Å; K1329-R1333 VanDerWaalsContact O-N 3.11Å
1330	E	66	Low	63.9	Low	94 Å²	94	101.6 Å²	101.6	44%	0.439	52%	0.523	S	S	.	.	H	α-helix	trans	-73.9	-39.4	178.1	-158.8	62.8	-167.3	0	0	112	A1326 L1328 A1332 R1333 I1334	A1326-E1330 PolarHBondContact O-N 3.03Å; L1328-E1330 VanDerWaalsContact C-N 3.34Å; L1328-E1330 PolarHBondContact O-N 2.82Å; E1330-A1332 VanDerWaalsContact C-N 3.26Å; E1330-A1332 PolarHBondContact O-N 2.79Å; E1330-R1333 WeakPolarHBondContact O-CB 3.23Å; E1330-R1333 PolarHBondContact O-N 2.81Å; E1330-R1333 WeakPolarHBondContact OE2-CD 3.3Å; E1330-R1333 IonicContact OE2-CZ 2.94Å; E1330-R1333 IonicContact OE2-NE 2.72Å; E1330-R1333 IonicContact OE2-NH1 3.85Å; E1330-R1333 PolarHBondContact OE2-NH1 2.78Å; E1330-I1334 WeakPolarHBondContact O-CG1 3.43Å; E1330-I1334 PolarHBondContact O-N 2.89Å; E1330-I1334 VanDerWaalsContact O-N 3.15Å
1331	T	63.8	Low	61.6	Low	90 Å²	90	103.7 Å²	103.7	55%	0.552	53%	0.533	S	S	*	.	H	α-helix	trans	-61.4	-34.9	173.2	-55.7	0	0	0	0	112	A1327 L1328	A1327-T1331 VanDerWaalsContact O-CB 3.31Å; A1327-T1331 WeakPolarHBondContact O-CB 3.34Å; A1327-T1331 PolarHBondContact O-N 3.35Å; A1327-T1331 PolarHBondContact O-OG1 3.4Å; L1328-T1331 PolarHBondContact O-N 2.87Å
1332	A	49	Very low	59.2	Low	47 Å²	47	106.5 Å²	106.5	39%	0.388	54%	0.544	S	S	.	.	H	α-helix	trans	-68.6	-44.7	173.9	0	0	0	0	0	112.4	L1328 K1329 E1330 I1334 R1335 R1336	L1328-A1332 WeakPolarHBondContact O-CB 3.33Å; L1328-A1332 PolarHBondContact O-N 3.13Å; K1329-A1332 PolarHBondContact O-N 3.26Å; E1330-A1332 VanDerWaalsContact C-N 3.26Å; E1330-A1332 PolarHBondContact O-N 2.79Å; A1332-I1334 PolarHBondContact O-N 2.96Å; A1332-R1335 PolarHBondContact O-N 3.15Å; A1332-R1336 PolarHBondContact O-N 2.77Å
1333	R	48.3	Very low	56.6	Low	175 Å²	175	112.4 Å²	112.4	66%	0.66	58%	0.576	S	S	*	*	H	α-helix	trans	-57	-34.3	176.2	-78	167.7	165.4	-178.9	-5.6	113.3	K1329 E1330 R1335	K1329-R1333 WeakPolarHBondContact O-CG 3.26Å; K1329-R1333 PolarHBondContact O-N 2.91Å; K1329-R1333 VanDerWaalsContact O-N 3.11Å; E1330-R1333 WeakPolarHBondContact O-CB 3.23Å; E1330-R1333 PolarHBondContact O-N 2.81Å; E1330-R1333 WeakPolarHBondContact OE2-CD 3.3Å; E1330-R1333 IonicContact OE2-CZ 2.94Å; E1330-R1333 IonicContact OE2-NE 2.72Å; E1330-R1333 IonicContact OE2-NH1 3.85Å; E1330-R1333 PolarHBondContact OE2-NH1 2.78Å; R1333-R1335 PolarHBondContact O-N 2.77Å
1334	I	47.9	Very low	54.3	Low	133 Å²	133	115.6 Å²	115.6	68%	0.682	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-10.2	177	-67.9	164.9	0	0	0	112.4	E1330 A1332	E1330-I1334 WeakPolarHBondContact O-CG1 3.43Å; E1330-I1334 PolarHBondContact O-N 2.89Å; E1330-I1334 VanDerWaalsContact O-N 3.15Å; A1332-I1334 PolarHBondContact O-N 2.96Å
1335	R	41	Very low	51.9	Low	216 Å²	216	115 Å²	115	82%	0.815	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	-12.2	-174.6	-90.9	-173.9	170.2	-171.3	-2.5	118.4	A1332 R1333	A1332-R1335 PolarHBondContact O-N 3.15Å; R1333-R1335 PolarHBondContact O-N 2.77Å
1336	R	37.1	Very low	49.8	Very low	104 Å²	104	119.7 Å²	119.7	39%	0.392	61%	0.607	S	S	.	*			trans	-164.5	142.4	173.2	-100.7	127.6	-165.2	-102.4	-3.6	114.3	A1332 D1339 E1361	A1332-R1336 PolarHBondContact O-N 2.77Å; R1336-D1339 VanDerWaalsContact CB-OD2 3.24Å; R1336-D1339 WeakPolarHBondContact CB-OD2 3.25Å; R1336-E1361 IonicContact CZ-OE1 3.58Å; R1336-E1361 IonicContact CZ-OE2 3.87Å; R1336-E1361 IonicContact NH1-OE1 2.88Å; R1336-E1361 PolarHBondContact NH1-OE1 3.44Å; R1336-E1361 IonicContact NH1-OE2 3.61Å; R1336-E1361 PolarHBondContact NH1-OE2 3.25Å; R1336-E1361 IonicContact NH2-OE1 3.65Å; R1336-E1361 PolarHBondContact NH2-OE1 2.97Å; R1336-E1361 IonicContact NH2-OE2 2.8Å
1337	P	36.1	Very low	47.9	Very low	126 Å²	126	127.8 Å²	127.8	82%	0.818	63%	0.625	S	S	*	*	S	Bend	trans	-72.8	-21.3	166.1	-21.1	35.1	0	0	0	115.5
1338	D	45.8	Very low	46.5	Very low	128 Å²	128	128.7 Å²	128.7	68%	0.684	62%	0.618	S	S	*	*			trans	-96.8	-4.6	-160.7	-57.2	-51.9	0	0	0	116.3	R1340	D1338-R1340 VanDerWaalsContact C-N 3.26Å; D1338-R1340 PolarHBondContact O-N 2.85Å
1339	D	45	Very low	45.4	Very low	80 Å²	80	127.9 Å²	127.9	43%	0.428	61%	0.608	S	S	.	*			trans	-78.8	31.9	-161.7	-84.4	-41.4	0	0	0	116.5	R1336 I1341 I1342	R1336-D1339 VanDerWaalsContact CB-OD2 3.24Å; R1336-D1339 WeakPolarHBondContact CB-OD2 3.25Å; D1339-I1341 VanDerWaalsContact C-N 3.26Å; D1339-I1341 PolarHBondContact O-N 2.73Å; D1339-I1342 HydrophobicContact CB-CD1 4.16Å; D1339-I1342 WeakPolarHBondContact O-CD1 3.38Å; D1339-I1342 WeakPolarHBondContact O-CG1 3.43Å
1340	R	37.8	Very low	44.1	Very low	245 Å²	245	128.6 Å²	128.6	93%	0.925	61%	0.612	S	S	*	*			trans	-72.3	-6.9	179.9	-74.2	-165.7	-176.4	-168.6	4.5	115.6	D1338 I1342	D1338-R1340 VanDerWaalsContact C-N 3.26Å; D1338-R1340 PolarHBondContact O-N 2.85Å; R1340-I1342 VanDerWaalsContact C-N 3.3Å; R1340-I1342 PolarHBondContact O-N 3.41Å
1341	I	43.2	Very low	43.4	Very low	132 Å²	132	125.8 Å²	125.8	68%	0.677	61%	0.608	S	S	*	*			trans	-93.1	25.7	-168.4	-53.4	175.5	0	0	0	111.9	D1339 L1344	D1339-I1341 VanDerWaalsContact C-N 3.26Å; D1339-I1341 PolarHBondContact O-N 2.73Å; I1341-L1344 HydrophobicContact CG2-CD1 4.37Å
1342	I	39.7	Very low	42.6	Very low	73 Å²	73	127.9 Å²	127.9	37%	0.374	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.3	-36.9	-160.8	-76.9	-178.9	0	0	0	115.7	D1339 R1340 L1344 M1345 K1348	D1339-I1342 HydrophobicContact CB-CD1 4.16Å; D1339-I1342 WeakPolarHBondContact O-CD1 3.38Å; D1339-I1342 WeakPolarHBondContact O-CG1 3.43Å; R1340-I1342 VanDerWaalsContact C-N 3.3Å; R1340-I1342 PolarHBondContact O-N 3.41Å; I1342-L1344 PolarHBondContact O-N 3.5Å; I1342-M1345 HydrophobicContact CG2-CG 4.27Å; I1342-M1345 HydrophobicContact CG2-SD 4.05Å; I1342-M1345 WeakPolarHBondContact O-CG 3.22Å; I1342-K1348 WeakPolarHBondContact O-CE 3.34Å; I1342-K1348 PolarHBondContact O-NZ 3.34Å
1343	D	35.5	Very low	42.8	Very low	161 Å²	161	131.1 Å²	131.1	86%	0.861	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-5.4	-166.9	-78.4	-50.6	0	0	0	117.1	M1345	D1343-M1345 PolarHBondContact O-N 3.19Å
1344	L	37	Very low	43.6	Very low	128 Å²	128	124.1 Å²	124.1	67%	0.67	61%	0.614	S	S	*	*			trans	-69.9	18.3	171.9	-70.1	162.1	0	0	0	114	I1341 I1342 V1346 R1347 K1348	I1341-L1344 HydrophobicContact CG2-CD1 4.37Å; I1342-L1344 PolarHBondContact O-N 3.5Å; L1344-V1346 PolarHBondContact O-N 3.13Å; L1344-R1347 PolarHBondContact O-N 3.43Å; L1344-K1348 PolarHBondContact O-N 2.94Å
1345	M	32.8	Very low	44.7	Very low	75 Å²	75	120 Å²	120	37%	0.369	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-62.8	-33.2	-162.2	-67	-138.4	60.5	0	0	115.5	I1342 D1343 R1347 K1348 Y1349	I1342-M1345 HydrophobicContact CG2-CG 4.27Å; I1342-M1345 HydrophobicContact CG2-SD 4.05Å; I1342-M1345 WeakPolarHBondContact O-CG 3.22Å; D1343-M1345 PolarHBondContact O-N 3.19Å; M1345-R1347 PolarHBondContact O-N 2.86Å; M1345-R1347 VanDerWaalsContact O-N 3.09Å; M1345-K1348 HydrophobicContact CB-CD 4.41Å; M1345-K1348 HydrophobicContact CE-CD 3.78Å; M1345-K1348 HydrophobicContact CG-CD 3.85Å; M1345-K1348 PolarHBondContact O-N 3.48Å; M1345-K1348 HydrophobicContact SD-CD 4.34Å; M1345-Y1349 HydrophobicContact CE-CE1 4.29Å; M1345-Y1349 HydrophobicContact CE-CE2 4.15Å; M1345-Y1349 VanDerWaalsContact CE-OH 3.3Å; M1345-Y1349 WeakPolarHBondContact CE-OH 3.27Å
1346	V	37.5	Very low	45.8	Very low	153 Å²	153	116.2 Å²	116.2	93%	0.927	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-69.5	-9.3	-176.9	-172.1	0	0	0	0	112.6	L1344	L1344-V1346 PolarHBondContact O-N 3.13Å
1347	R	40.1	Very low	47.2	Very low	230 Å²	230	113.4 Å²	113.4	87%	0.868	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-118.9	3.1	167	-68.1	-173.8	179.1	176.9	1.6	114.4	L1344 M1345 Y1349	L1344-R1347 PolarHBondContact O-N 3.43Å; M1345-R1347 PolarHBondContact O-N 2.86Å; M1345-R1347 VanDerWaalsContact O-N 3.09Å; R1347-Y1349 PolarHBondContact O-N 3.03Å
1348	K	46.6	Very low	48.7	Very low	74 Å²	74	114.4 Å²	114.4	32%	0.322	57%	0.574	S	S	.	*	S	Bend	trans	-62.1	-38.1	-164.9	-111.2	-172.9	-173.6	163	0	115.7	I1342 L1344 M1345	I1342-K1348 WeakPolarHBondContact O-CE 3.34Å; I1342-K1348 PolarHBondContact O-NZ 3.34Å; L1344-K1348 PolarHBondContact O-N 2.94Å; M1345-K1348 HydrophobicContact CB-CD 4.41Å; M1345-K1348 HydrophobicContact CE-CD 3.78Å; M1345-K1348 HydrophobicContact CG-CD 3.85Å; M1345-K1348 PolarHBondContact O-N 3.48Å; M1345-K1348 HydrophobicContact SD-CD 4.34Å
1349	Y	50.2	Low	49.9	Very low	89 Å²	89	110 Å²	110	35%	0.349	56%	0.555	S	S	.	*	S	Bend	trans	-97	-40.3	-159	-64.5	-33.2	0	0	0	113.8	M1345 R1347 I1355 R1356 A1363	M1345-Y1349 HydrophobicContact CE-CE1 4.29Å; M1345-Y1349 HydrophobicContact CE-CE2 4.15Å; M1345-Y1349 VanDerWaalsContact CE-OH 3.3Å; M1345-Y1349 WeakPolarHBondContact CE-OH 3.27Å; R1347-Y1349 PolarHBondContact O-N 3.03Å; Y1349-I1355 CarbonylContact O-C 3.59Å; Y1349-I1355 WeakPolarHBondContact O-CA 3.46Å; Y1349-I1355 WeakPolarHBondContact O-CG2 3.03Å; Y1349-R1356 PolarHBondContact O-N 2.84Å; Y1349-A1363 HydrophobicContact CD1-CB 3.37Å; Y1349-A1363 HydrophobicContact CE1-CB 3.82Å; Y1349-A1363 HydrophobicContact CG-CB 4.33Å
1350	F	45.8	Very low	51.3	Low	148 Å²	148	111.7 Å²	111.7	65%	0.649	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.9	119.2	-178.8	-71.4	-92.4	0	0	0	111.7	I1355	F1350-I1355 HydrophobicContact CD1-CG1 3.83Å; F1350-I1355 HydrophobicContact CD2-CG1 4.46Å; F1350-I1355 HydrophobicContact CE1-CD1 4.12Å; F1350-I1355 HydrophobicContact CE1-CG1 3.45Å; F1350-I1355 VanDerWaalsContact CE1-CG1 3.45Å; F1350-I1355 HydrophobicContact CE2-CD1 4.39Å; F1350-I1355 HydrophobicContact CE2-CG1 4.13Å; F1350-I1355 HydrophobicContact CG-CG1 4.33Å; F1350-I1355 HydrophobicContact CZ-CD1 3.84Å; F1350-I1355 HydrophobicContact CZ-CG1 3.62Å
1351	G	51.2	Low	52.6	Low	35 Å²	35	102.8 Å²	102.8	36%	0.361	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-172.2	161	0	0	0	0	0	111.5	D1353 G1354	G1351-D1353 PolarHBondContact O-N 3.39Å; G1351-G1354 PolarHBondContact N-O 3.07Å
1352	T	47.9	Very low	53.7	Low	134 Å²	134	99.3 Å²	99.3	82%	0.822	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-26	-178.8	34.8	0	0	0	0	115.5
1353	D	53.3	Low	55	Low	115 Å²	115	96.3 Å²	96.3	62%	0.615	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.3	11.9	-165.5	-28.3	-87.1	0	0	0	113	G1351 R1356	G1351-D1353 PolarHBondContact O-N 3.39Å; D1353-R1356 IonicContact OD2-CZ 3.07Å; D1353-R1356 IonicContact OD2-NE 3.4Å; D1353-R1356 IonicContact OD2-NH2 3.52Å; D1353-R1356 PolarHBondContact OD2-NH2 2.98Å
1354	G	64.3	Low	57	Low	28 Å²	28	89.7 Å²	89.7	29%	0.289	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	139.1	-173	-178.3	0	0	0	0	0	114	G1351	G1351-G1354 PolarHBondContact N-O 3.07Å
1355	I	69.9	Low	59.2	Low	47 Å²	47	84.8 Å²	84.8	24%	0.241	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	137.2	178.2	-55.5	179	0	0	0	109.5	Y1349 F1350 A1363 M1364 V1372	Y1349-I1355 CarbonylContact O-C 3.59Å; Y1349-I1355 WeakPolarHBondContact O-CA 3.46Å; Y1349-I1355 WeakPolarHBondContact O-CG2 3.03Å; F1350-I1355 HydrophobicContact CD1-CG1 3.83Å; F1350-I1355 HydrophobicContact CD2-CG1 4.46Å; F1350-I1355 HydrophobicContact CE1-CD1 4.12Å; F1350-I1355 HydrophobicContact CE1-CG1 3.45Å; F1350-I1355 VanDerWaalsContact CE1-CG1 3.45Å; F1350-I1355 HydrophobicContact CE2-CD1 4.39Å; F1350-I1355 HydrophobicContact CE2-CG1 4.13Å; F1350-I1355 HydrophobicContact CG-CG1 4.33Å; F1350-I1355 HydrophobicContact CZ-CD1 3.84Å; F1350-I1355 HydrophobicContact CZ-CG1 3.62Å; I1355-A1363 HydrophobicContact CG2-CB 4.22Å; I1355-M1364 HydrophobicContact CB-CE 4.05Å; I1355-M1364 HydrophobicContact CG2-CE 3.71Å; I1355-M1364 HydrophobicContact CG2-SD 4.41Å; I1355-M1364 WeakPolarHBondContact O-CE 3.18Å; I1355-V1372 HydrophobicContact CD1-CG1 4.22Å; I1355-V1372 HydrophobicContact CD1-CG2 3.73Å
1356	R	65.3	Low	61.7	Low	135 Å²	135	82.8 Å²	82.8	51%	0.509	45%	0.451	S	S	.	.			trans	-133.9	140.7	177.1	-62.7	-169.6	-175.7	-83.2	8.1	111.7	Y1349 D1353 A1363	Y1349-R1356 PolarHBondContact O-N 2.84Å; D1353-R1356 IonicContact OD2-CZ 3.07Å; D1353-R1356 IonicContact OD2-NE 3.4Å; D1353-R1356 IonicContact OD2-NH2 3.52Å; D1353-R1356 PolarHBondContact OD2-NH2 2.98Å; R1356-A1363 WeakPolarHBondContact O-CB 3.45Å
1357	G	67	Low	64	Low	45 Å²	45	80.6 Å²	80.6	46%	0.464	43%	0.431	S	S	.	.			trans	176.8	169	178.5	0	0	0	0	0	111.7
1358	K	66.4	Low	66.1	Low	148 Å²	148	71.2 Å²	71.2	64%	0.643	40%	0.399	S	S	*	.			trans	-69.3	139.4	169.9	-85.6	179.3	174.3	-176.6	0	109.9	N1360 E1361 M1364	K1358-N1360 PolarHBondContact O-N 2.79Å; K1358-E1361 HydrophobicContact CB-CB 3.9Å; K1358-E1361 HydrophobicContact CB-CG 4.11Å; K1358-E1361 WeakPolarHBondContact CD-OE2 2.96Å; K1358-E1361 IonicContact NZ-OE2 3.54Å; K1358-E1361 PolarHBondContact O-N 2.83Å; K1358-E1361 VanDerWaalsContact O-O 3.05Å; K1358-M1364 WeakPolarHBondContact O-CB 3.2Å
1359	A	72.2	Confident	68.1	Low	35 Å²	35	68 Å²	68	29%	0.289	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-55.6	131.5	177.8	0	0	0	0	0	111.4	T727 E1361	T727-A1359 HydrophobicContact CG2-CB 4.34Å; A1359-E1361 PolarHBondContact O-N 3.41Å
1360	N	73.5	Confident	70	Confident	115 Å²	115	66.8 Å²	66.8	62%	0.615	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	18.3	-176.9	-141.8	8.5	0	0	0	115.2	K1358 M1364 M1401	K1358-N1360 PolarHBondContact O-N 2.79Å; N1360-M1364 WeakPolarHBondContact CA-O 3.24Å; N1360-M1364 PolarHBondContact N-O 3.17Å; N1360-M1401 HydrophobicContact CB-SD 3.83Å
1361	E	65.2	Low	72	Confident	58 Å²	58	66.8 Å²	66.8	27%	0.271	38%	0.381	S	S	.	.	S	Bend	trans	-131.5	141.4	176.9	-53.4	-171.3	179.8	0	0	112	R1336 K1358 A1359 A1363 M1364	R1336-E1361 IonicContact CZ-OE1 3.58Å; R1336-E1361 IonicContact CZ-OE2 3.87Å; R1336-E1361 IonicContact NH1-OE1 2.88Å; R1336-E1361 PolarHBondContact NH1-OE1 3.44Å; R1336-E1361 IonicContact NH1-OE2 3.61Å; R1336-E1361 PolarHBondContact NH1-OE2 3.25Å; R1336-E1361 IonicContact NH2-OE1 3.65Å; R1336-E1361 PolarHBondContact NH2-OE1 2.97Å; R1336-E1361 IonicContact NH2-OE2 2.8Å; K1358-E1361 HydrophobicContact CB-CB 3.9Å; K1358-E1361 HydrophobicContact CB-CG 4.11Å; K1358-E1361 WeakPolarHBondContact CD-OE2 2.96Å; K1358-E1361 IonicContact NZ-OE2 3.54Å; K1358-E1361 PolarHBondContact O-N 2.83Å; K1358-E1361 VanDerWaalsContact O-O 3.05Å; A1359-E1361 PolarHBondContact O-N 3.41Å; E1361-A1363 PolarHBondContact O-N 3.43Å; E1361-M1364 PolarHBondContact O-N 2.89Å
1362	G	66.3	Low	73.7	Confident	60 Å²	60	67.5 Å²	67.5	62%	0.619	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	-101.4	170.9	0	0	0	0	0	114.5
1363	A	67.3	Low	75.7	Confident	9 Å²	9	61.1 Å²	61.1	7%	0.074	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-28.1	-178.2	0	0	0	0	0	114	Y1349 I1355 R1356 E1361 T1368	Y1349-A1363 HydrophobicContact CD1-CB 3.37Å; Y1349-A1363 HydrophobicContact CE1-CB 3.82Å; Y1349-A1363 HydrophobicContact CG-CB 4.33Å; I1355-A1363 HydrophobicContact CG2-CB 4.22Å; R1356-A1363 WeakPolarHBondContact O-CB 3.45Å; E1361-A1363 PolarHBondContact O-N 3.43Å; A1363-T1368 VanDerWaalsContact O-CG2 3.31Å; A1363-T1368 WeakPolarHBondContact O-CG2 3.07Å
1364	M	76.8	Confident	77.5	Confident	22 Å²	22	59.3 Å²	59.3	11%	0.108	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-120.4	54.4	-156.7	-159.4	63.9	78	0	0	111.1	I1355 K1358 N1360 E1361 M1401 L1402	I1355-M1364 HydrophobicContact CB-CE 4.05Å; I1355-M1364 HydrophobicContact CG2-CE 3.71Å; I1355-M1364 HydrophobicContact CG2-SD 4.41Å; I1355-M1364 WeakPolarHBondContact O-CE 3.18Å; K1358-M1364 WeakPolarHBondContact O-CB 3.2Å; N1360-M1364 WeakPolarHBondContact CA-O 3.24Å; N1360-M1364 PolarHBondContact N-O 3.17Å; E1361-M1364 PolarHBondContact O-N 2.89Å; M1364-M1401 WeakPolarHBondContact O-CE 3.22Å; M1364-L1402 HydrophobicContact CG-CD1 3.95Å; M1364-L1402 HydrophobicContact CG-CD2 3.95Å; M1364-L1402 HydrophobicContact CG-CG 4.43Å; M1364-L1402 HydrophobicContact SD-CD1 3.47Å; M1364-L1402 WeakPolarHBondContact SD-CD1 3.43Å; M1364-L1402 HydrophobicContact SD-CD2 3.54Å; M1364-L1402 VanDerWaalsContact SD-CD2 3.54Å; M1364-L1402 HydrophobicContact SD-CG 4.14Å
1365	T	83.3	Confident	78.5	Confident	25 Å²	25	60.7 Å²	60.7	15%	0.153	34%	0.337	C	S	.	.			trans	-101.9	157.6	175.7	63.4	0	0	0	0	111	E1367 T1368 A1369	T1365-E1367 VanDerWaalsContact C-N 3.27Å; T1365-E1367 PolarHBondContact O-N 3.15Å; T1365-T1368 PolarHBondContact O-N 3.03Å; T1365-T1368 VanDerWaalsContact O-N 3.16Å; T1365-T1368 PolarHBondContact OG1-N 3.17Å; T1365-T1368 PolarHBondContact OG1-OG1 2.97Å; T1365-A1369 PolarHBondContact O-N 2.99Å
1366	A	85.8	Confident	79.2	Confident	34 Å²	34	59.5 Å²	59.5	28%	0.281	33%	0.334	S	S	.	.	H	α-helix	trans	-55.4	-41.7	173	0	0	0	0	0	112.2	T1368 A1369 L1370 M1401 A1405	A1366-T1368 VanDerWaalsContact C-N 3.34Å; A1366-T1368 PolarHBondContact O-N 3.01Å; A1366-A1369 PolarHBondContact O-N 2.66Å; A1366-L1370 WeakPolarHBondContact O-CB 3.23Å; A1366-L1370 PolarHBondContact O-N 2.71Å; A1366-M1401 HydrophobicContact CB-CG 3.84Å; A1366-M1401 HydrophobicContact CB-SD 4.44Å; A1366-A1405 HydrophobicContact CB-CB 4.25Å; A1366-A1405 WeakPolarHBondContact O-CB 3.41Å
1367	E	85	Confident	80.2	Confident	107 Å²	107	53 Å²	53	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-60.3	-40.3	177	-171.5	-173.5	171.7	0	0	112.6	T1365 R1371	T1365-E1367 VanDerWaalsContact C-N 3.27Å; T1365-E1367 PolarHBondContact O-N 3.15Å; E1367-R1371 WeakPolarHBondContact O-CG 3.3Å; E1367-R1371 PolarHBondContact O-N 3.33Å; E1367-R1371 IonicContact OE1-CZ 2.77Å; E1367-R1371 IonicContact OE1-NH1 2.82Å; E1367-R1371 PolarHBondContact OE1-NH1 3.37Å; E1367-R1371 IonicContact OE1-NH2 2.81Å; E1367-R1371 PolarHBondContact OE1-NH2 3.19Å
1368	T	84.2	Confident	80.9	Confident	32 Å²	32	60.4 Å²	60.4	20%	0.196	32%	0.323	C	S	.	.	H	α-helix	trans	-71.1	-42.8	176.5	-57.9	0	0	0	0	111.1	A1363 T1365 A1366 L1370 R1371 V1372	A1363-T1368 VanDerWaalsContact O-CG2 3.31Å; A1363-T1368 WeakPolarHBondContact O-CG2 3.07Å; T1365-T1368 PolarHBondContact O-N 3.03Å; T1365-T1368 VanDerWaalsContact O-N 3.16Å; T1365-T1368 PolarHBondContact OG1-N 3.17Å; T1365-T1368 PolarHBondContact OG1-OG1 2.97Å; A1366-T1368 VanDerWaalsContact C-N 3.34Å; A1366-T1368 PolarHBondContact O-N 3.01Å; T1368-L1370 VanDerWaalsContact C-N 3.35Å; T1368-L1370 PolarHBondContact O-N 2.96Å; T1368-R1371 PolarHBondContact O-N 3.38Å; T1368-V1372 HydrophobicContact CG2-CG2 4.3Å; T1368-V1372 WeakPolarHBondContact O-CB 3.43Å; T1368-V1372 VanDerWaalsContact O-CG2 3.23Å; T1368-V1372 WeakPolarHBondContact O-CG2 3.32Å; T1368-V1372 PolarHBondContact O-N 2.93Å
1369	A	88.6	Confident	81.6	Confident	8 Å²	8	57.6 Å²	57.6	7%	0.066	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-40.6	176.1	0	0	0	0	0	112.6	T1365 A1366 V1372 G1373 L1402 A1405 L1406	T1365-A1369 PolarHBondContact O-N 2.99Å; A1366-A1369 PolarHBondContact O-N 2.66Å; A1369-V1372 PolarHBondContact O-N 3.12Å; A1369-G1373 PolarHBondContact O-N 3.42Å; A1369-L1402 HydrophobicContact CB-CD2 3.62Å; A1369-A1405 HydrophobicContact CB-CB 3.63Å; A1369-L1406 HydrophobicContact CB-CG 4.33Å; A1369-L1406 WeakPolarHBondContact O-CD2 3.28Å
1370	L	90.8	Very high	81.8	Confident	63 Å²	63	61.1 Å²	61.1	33%	0.33	33%	0.327	S	S	.	.	H	α-helix	trans	-58.7	-53.4	171.9	178.2	69.1	0	0	0	111	A1366 T1368 V1372 G1373 M1374 A1405 A1408	A1366-L1370 WeakPolarHBondContact O-CB 3.23Å; A1366-L1370 PolarHBondContact O-N 2.71Å; T1368-L1370 VanDerWaalsContact C-N 3.35Å; T1368-L1370 PolarHBondContact O-N 2.96Å; L1370-V1372 VanDerWaalsContact C-N 3.29Å; L1370-V1372 PolarHBondContact O-N 3.25Å; L1370-G1373 PolarHBondContact O-N 3.39Å; L1370-M1374 HydrophobicContact CG-SD 4.37Å; L1370-M1374 WeakPolarHBondContact O-CG 3.44Å; L1370-M1374 PolarHBondContact O-N 2.87Å; L1370-A1405 WeakPolarHBondContact CA-O 3.4Å; L1370-A1405 HydrophobicContact CB-CB 4.43Å; L1370-A1408 HydrophobicContact CD1-CB 3.69Å
1371	R	87.4	Confident	81.5	Confident	148 Å²	148	62.4 Å²	62.4	56%	0.558	32%	0.324	S	S	*	.	H	α-helix	trans	-61.4	-35.7	178	-75.3	-177.3	179	129	12.7	112.9	E1367 T1368 M1374 A1375	E1367-R1371 WeakPolarHBondContact O-CG 3.3Å; E1367-R1371 PolarHBondContact O-N 3.33Å; E1367-R1371 IonicContact OE1-CZ 2.77Å; E1367-R1371 IonicContact OE1-NH1 2.82Å; E1367-R1371 PolarHBondContact OE1-NH1 3.37Å; E1367-R1371 IonicContact OE1-NH2 2.81Å; E1367-R1371 PolarHBondContact OE1-NH2 3.19Å; T1368-R1371 PolarHBondContact O-N 3.38Å; R1371-M1374 PolarHBondContact O-N 3.43Å; R1371-A1375 VanDerWaalsContact O-CB 3.25Å; R1371-A1375 WeakPolarHBondContact O-CB 3.36Å; R1371-A1375 PolarHBondContact O-N 2.87Å
1372	V	87.1	Confident	81.3	Confident	49 Å²	49	69.3 Å²	69.3	30%	0.297	35%	0.347	S	S	.	.	H	α-helix	trans	-66.2	-45	174.8	167	0	0	0	0	110.8	I1355 T1368 A1369 L1370 M1374 A1375 A1376 L1406	I1355-V1372 HydrophobicContact CD1-CG1 4.22Å; I1355-V1372 HydrophobicContact CD1-CG2 3.73Å; T1368-V1372 HydrophobicContact CG2-CG2 4.3Å; T1368-V1372 WeakPolarHBondContact O-CB 3.43Å; T1368-V1372 VanDerWaalsContact O-CG2 3.23Å; T1368-V1372 WeakPolarHBondContact O-CG2 3.32Å; T1368-V1372 PolarHBondContact O-N 2.93Å; A1369-V1372 PolarHBondContact O-N 3.12Å; L1370-V1372 VanDerWaalsContact C-N 3.29Å; L1370-V1372 PolarHBondContact O-N 3.25Å; V1372-M1374 PolarHBondContact O-N 3.04Å; V1372-A1375 PolarHBondContact O-N 3.11Å; V1372-A1376 WeakPolarHBondContact O-CB 3.17Å; V1372-A1376 PolarHBondContact O-N 3.03Å; V1372-L1406 HydrophobicContact CG1-CD2 4.15Å
1373	G	89.5	Confident	81.2	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61	-42.4	174	0	0	0	0	0	112.5	A1369 L1370 G1377 G1409 F1410	A1369-G1373 PolarHBondContact O-N 3.42Å; L1370-G1373 PolarHBondContact O-N 3.39Å; G1373-G1377 PolarHBondContact O-N 3.05Å; G1373-G1409 VanDerWaalsContact C-C 3.41Å; G1373-G1409 CarbonylContact C-O 3.45Å; G1373-F1410 WeakPolarHBondContact O-CD1 3.46Å
1374	M	91	Very high	80.9	Confident	77 Å²	77	77.3 Å²	77.3	38%	0.379	39%	0.387	S	S	.	.	H	α-helix	trans	-64.6	-45.3	175.6	-65.6	-180	84.6	0	0	112.3	L1370 R1371 V1372 R1378 G1409 M1413	L1370-M1374 HydrophobicContact CG-SD 4.37Å; L1370-M1374 WeakPolarHBondContact O-CG 3.44Å; L1370-M1374 PolarHBondContact O-N 2.87Å; R1371-M1374 PolarHBondContact O-N 3.43Å; V1372-M1374 PolarHBondContact O-N 3.04Å; M1374-R1378 WeakPolarHBondContact O-CB 3.3Å; M1374-R1378 PolarHBondContact O-N 3.25Å; M1374-G1409 WeakPolarHBondContact CA-O 3.41Å; M1374-G1409 PolarHBondContact N-O 3.3Å; M1374-M1413 HydrophobicContact CB-CG 4.32Å; M1374-M1413 HydrophobicContact CB-SD 4.36Å; M1374-M1413 WeakPolarHBondContact O-CG 3.28Å
1375	A	86.2	Confident	80.5	Confident	57 Å²	57	82 Å²	82	47%	0.471	41%	0.408	S	S	.	.	H	α-helix	trans	-66.3	-44.6	179.2	0	0	0	0	0	111.7	R1371 V1372 R1378 V1379	R1371-A1375 VanDerWaalsContact O-CB 3.25Å; R1371-A1375 WeakPolarHBondContact O-CB 3.36Å; R1371-A1375 PolarHBondContact O-N 2.87Å; V1372-A1375 PolarHBondContact O-N 3.11Å; A1375-R1378 WeakPolarHBondContact O-CB 3.49Å; A1375-R1378 PolarHBondContact O-N 3.38Å; A1375-V1379 WeakPolarHBondContact O-CG2 3.4Å; A1375-V1379 PolarHBondContact O-N 3.27Å; A1375-V1379 VanDerWaalsContact O-N 3.12Å
1376	A	85.4	Confident	79.6	Confident	22 Å²	22	89.3 Å²	89.3	18%	0.182	43%	0.433	C	S	.	.	H	α-helix	trans	-63	-46.2	175.9	0	0	0	0	0	111.1	V1372 R1378 V1379 F1380 F1410	V1372-A1376 WeakPolarHBondContact O-CB 3.17Å; V1372-A1376 PolarHBondContact O-N 3.03Å; A1376-R1378 VanDerWaalsContact C-N 3.28Å; A1376-R1378 PolarHBondContact O-N 3.3Å; A1376-V1379 PolarHBondContact O-N 3.34Å; A1376-F1380 HydrophobicContact CB-CD2 4.16Å; A1376-F1380 HydrophobicContact CB-CE2 3.78Å; A1376-F1380 HydrophobicContact CB-CZ 4.39Å; A1376-F1380 WeakPolarHBondContact O-CB 3.38Å; A1376-F1380 VanDerWaalsContact O-CD2 3.26Å; A1376-F1380 WeakPolarHBondContact O-CD2 3.24Å; A1376-F1380 VanDerWaalsContact O-CG 3.25Å; A1376-F1380 WeakPolarHBondContact O-CG 3.47Å; A1376-F1380 PolarHBondContact O-N 3.47Å; A1376-F1410 HydrophobicContact CB-CE1 3.6Å; A1376-F1410 HydrophobicContact CB-CZ 4.03Å
1377	G	85.3	Confident	79.3	Confident	0 Å²	0	88.9 Å²	88.9	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-61.8	-33.2	175.6	0	0	0	0	0	113.9	G1373 V1379 R1381 M1415	G1373-G1377 PolarHBondContact O-N 3.05Å; G1377-V1379 VanDerWaalsContact C-N 3.35Å; G1377-R1381 PolarHBondContact O-N 3.37Å; G1377-M1415 VanDerWaalsContact CA-SD 3.5Å
1378	R	82.8	Confident	79.3	Confident	199 Å²	199	92.7 Å²	92.7	75%	0.751	44%	0.435	S	S	*	.	H	α-helix	trans	-67.2	-32.1	171.9	-168.9	173.4	-179.8	153	1.6	113.3	M1374 A1375 A1376 M1413	M1374-R1378 WeakPolarHBondContact O-CB 3.3Å; M1374-R1378 PolarHBondContact O-N 3.25Å; A1375-R1378 WeakPolarHBondContact O-CB 3.49Å; A1375-R1378 PolarHBondContact O-N 3.38Å; A1376-R1378 VanDerWaalsContact C-N 3.28Å; A1376-R1378 PolarHBondContact O-N 3.3Å; R1378-M1413 HydrophobicContact CB-CE 3.73Å; R1378-M1413 HydrophobicContact CG-CE 4.16Å
1379	V	79.9	Confident	79.3	Confident	90 Å²	90	92 Å²	92	55%	0.545	43%	0.431	S	S	.	.	H	α-helix	trans	-84.8	-35.9	179.5	171.5	0	0	0	0	112.1	A1375 A1376 G1377	A1375-V1379 WeakPolarHBondContact O-CG2 3.4Å; A1375-V1379 PolarHBondContact O-N 3.27Å; A1375-V1379 VanDerWaalsContact O-N 3.12Å; A1376-V1379 PolarHBondContact O-N 3.34Å; G1377-V1379 VanDerWaalsContact C-N 3.35Å
1380	F	75.9	Confident	79.2	Confident	108 Å²	108	94.4 Å²	94.4	47%	0.474	45%	0.445	S	S	.	.	H	α-helix	trans	-76.6	-24.5	-179.1	-64.1	-33.1	0	0	0	113.5	A1376 R1382 H1387 F1410 M1415	A1376-F1380 HydrophobicContact CB-CD2 4.16Å; A1376-F1380 HydrophobicContact CB-CE2 3.78Å; A1376-F1380 HydrophobicContact CB-CZ 4.39Å; A1376-F1380 WeakPolarHBondContact O-CB 3.38Å; A1376-F1380 VanDerWaalsContact O-CD2 3.26Å; A1376-F1380 WeakPolarHBondContact O-CD2 3.24Å; A1376-F1380 VanDerWaalsContact O-CG 3.25Å; A1376-F1380 WeakPolarHBondContact O-CG 3.47Å; A1376-F1380 PolarHBondContact O-N 3.47Å; F1380-R1382 PolarHBondContact O-N 3.35Å; F1380-H1387 PolarHBondContact O-CE1 2.99Å; F1380-H1387 PolarHBondContact O-ND1 2.81Å; F1380-H1387 PolarHBondContact O-NE2 3.38Å; F1380-F1410 HydrophobicContact CD2-CE1 4.13Å; F1380-F1410 HydrophobicContact CE2-CE1 4.09Å; F1380-M1415 HydrophobicContact CB-CE 3.68Å; F1380-M1415 HydrophobicContact CB-SD 4.32Å; F1380-M1415 HydrophobicContact CD2-CE 4Å; F1380-M1415 HydrophobicContact CD2-SD 4.45Å; F1380-M1415 HydrophobicContact CG-CE 4.31Å
1381	R	67.4	Low	78.9	Confident	143 Å²	143	92.2 Å²	92.2	54%	0.54	43%	0.433	S	S	.	.			trans	-62.4	96.4	170	-92.7	-171.6	156.1	-167.8	-0.9	111.6	G1377 H1387 M1413 G1414	G1377-R1381 PolarHBondContact O-N 3.37Å; R1381-H1387 WeakPolarHBondContact CA-NE2 3.35Å; R1381-M1413 WeakPolarHBondContact CD-O 3.48Å; R1381-M1413 PolarHBondContact NE-O 3.05Å; R1381-G1414 PolarHBondContact NH2-O 3.3Å
1382	R	61.3	Low	78.6	Confident	202 Å²	202	86.4 Å²	86.4	76%	0.762	42%	0.419	S	S	*	.			trans	-138.5	93.8	176.6	-70.1	-172.2	176.9	-160.4	-3.2	109.7	F1380 H1387	F1380-R1382 PolarHBondContact O-N 3.35Å; R1382-H1387 PolarHBondContact N-NE2 2.82Å; R1382-H1387 PolarHBondContact O-CE1 3.06Å
1383	G	63.4	Low	78.3	Confident	53 Å²	53	85 Å²	85	55%	0.546	41%	0.409	S	S	.	.	S	Bend	trans	103.4	172	-178.2	0	0	0	0	0	113.3	H1385	G1383-H1385 VanDerWaalsContact C-N 3.25Å; G1383-H1385 PolarHBondContact O-N 3.21Å
1384	D	62	Low	77.5	Confident	184 Å²	184	87.9 Å²	87.9	98%	0.984	42%	0.424	S	S	*	.	S	Bend	trans	-85.2	17.6	-166.3	-53.8	-57.1	0	0	0	114.9
1385	H	67.5	Low	76.5	Confident	120 Å²	120	89.4 Å²	89.4	56%	0.556	44%	0.438	S	S	*	.	S	Bend	trans	-101.4	149.5	-179.6	65.1	-78.6	0	0	0	111.9	G1383 H1387	G1383-H1385 VanDerWaalsContact C-N 3.25Å; G1383-H1385 PolarHBondContact O-N 3.21Å; H1385-H1387 AromaticContact CD2-CE1 3.98Å; H1385-H1387 AromaticContact CD2-ND1 3.83Å; H1385-H1387 AromaticContact CE1-CE1 3.22Å; H1385-H1387 PolarHBondContact CE1-CE1 3.11Å; H1385-H1387 AromaticContact CE1-ND1 3.72Å; H1385-H1387 AromaticContact CE1-NE2 3.87Å; H1385-H1387 AromaticContact ND1-CE1 3.98Å; H1385-H1387 AromaticContact NE2-CE1 3.2Å; H1385-H1387 PolarHBondContact NE2-CE1 3.37Å; H1385-H1387 AromaticContact NE2-ND1 3.18Å; H1385-H1387 PolarHBondContact NE2-ND1 2.92Å; H1385-H1387 VanDerWaalsContact NE2-ND1 3.18Å; H1385-H1387 PolarHBondContact O-CD2 2.88Å; H1385-H1387 PolarHBondContact O-N 3.18Å
1386	R	66.1	Low	75.8	Confident	179 Å²	179	93.8 Å²	93.8	68%	0.675	44%	0.442	S	S	*	.			trans	-69.9	102.4	168.4	-72.7	-159.7	-179.8	-160.4	2.8	109.6	D1416	R1386-D1416 WeakPolarHBondContact CB-OD2 3.42Å; R1386-D1416 VanDerWaalsContact CD-OD1 3.3Å; R1386-D1416 WeakPolarHBondContact CD-OD1 3.28Å; R1386-D1416 WeakPolarHBondContact CD-OD2 3.17Å; R1386-D1416 IonicContact CZ-OD1 3.56Å; R1386-D1416 IonicContact NE-OD1 3.2Å; R1386-D1416 IonicContact NH1-OD1 3.95Å; R1386-D1416 PolarHBondContact NH1-OD1 3.09Å
1387	H	79.1	Confident	75.2	Confident	26 Å²	26	96.4 Å²	96.4	12%	0.12	45%	0.453	C	S	.	.			trans	-63.4	136.5	170.4	-59.4	-87.5	0	0	0	110	F1380 R1381 R1382 H1385 M1415 D1416	F1380-H1387 PolarHBondContact O-CE1 2.99Å; F1380-H1387 PolarHBondContact O-ND1 2.81Å; F1380-H1387 PolarHBondContact O-NE2 3.38Å; R1381-H1387 WeakPolarHBondContact CA-NE2 3.35Å; R1382-H1387 PolarHBondContact N-NE2 2.82Å; R1382-H1387 PolarHBondContact O-CE1 3.06Å; H1385-H1387 AromaticContact CD2-CE1 3.98Å; H1385-H1387 AromaticContact CD2-ND1 3.83Å; H1385-H1387 AromaticContact CE1-CE1 3.22Å; H1385-H1387 PolarHBondContact CE1-CE1 3.11Å; H1385-H1387 AromaticContact CE1-ND1 3.72Å; H1385-H1387 AromaticContact CE1-NE2 3.87Å; H1385-H1387 AromaticContact ND1-CE1 3.98Å; H1385-H1387 AromaticContact NE2-CE1 3.2Å; H1385-H1387 PolarHBondContact NE2-CE1 3.37Å; H1385-H1387 AromaticContact NE2-ND1 3.18Å; H1385-H1387 PolarHBondContact NE2-ND1 2.92Å; H1385-H1387 VanDerWaalsContact NE2-ND1 3.18Å; H1385-H1387 PolarHBondContact O-CD2 2.88Å; H1385-H1387 PolarHBondContact O-N 3.18Å; H1387-M1415 HydrophobicContact CB-CE 3.39Å; H1387-M1415 HydrophobicContact CB-CG 4.38Å; H1387-M1415 WeakPolarHBondContact O-CA 3.42Å; H1387-M1415 WeakPolarHBondContact O-CB 3.41Å; H1387-D1416 PolarHBondContact O-N 3.47Å
1388	R	84.2	Confident	74.9	Confident	187 Å²	187	97.4 Å²	97.4	71%	0.706	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	144.2	178.1	-60.2	-177.2	178.4	169.9	0.7	110.3	D1416 F1418	R1388-D1416 CarbonylContact C-O 3.56Å; R1388-D1416 VanDerWaalsContact CA-O 3.3Å; R1388-D1416 WeakPolarHBondContact CA-O 3.02Å; R1388-D1416 HydrophobicContact CG-CB 4.42Å; R1388-F1418 HydrophobicContact CB-CD2 4.3Å; R1388-F1418 HydrophobicContact CB-CE2 3.97Å; R1388-F1418 HydrophobicContact CG-CE2 3.85Å
1389	V	85.3	Confident	74.9	Confident	17 Å²	17	88.2 Å²	88.2	10%	0.103	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.5	175	-175.7	0	0	0	0	108.9	I1391 F1410 M1415 D1416 V1417 F1418	V1389-I1391 HydrophobicContact CG1-CG1 4.13Å; V1389-F1410 HydrophobicContact CG1-CD2 3.9Å; V1389-F1410 HydrophobicContact CG1-CE1 4.44Å; V1389-F1410 HydrophobicContact CG1-CE2 3.78Å; V1389-F1410 HydrophobicContact CG1-CG 4.3Å; V1389-F1410 HydrophobicContact CG1-CZ 4.07Å; V1389-F1410 HydrophobicContact CG2-CB 4.41Å; V1389-F1410 HydrophobicContact CG2-CD1 3.91Å; V1389-F1410 HydrophobicContact CG2-CD2 4.46Å; V1389-F1410 HydrophobicContact CG2-CE1 4.22Å; V1389-F1410 HydrophobicContact CG2-CG 4.03Å; V1389-M1415 HydrophobicContact CG2-CB 4.18Å; V1389-M1415 HydrophobicContact CG2-CE 3.37Å; V1389-M1415 HydrophobicContact CG2-SD 3.78Å; V1389-D1416 PolarHBondContact N-O 2.76Å; V1389-V1417 HydrophobicContact CB-CG2 4.46Å; V1389-V1417 WeakPolarHBondContact O-CA 3.43Å; V1389-F1418 PolarHBondContact O-N 3.35Å
1390	V	84.7	Confident	74.9	Confident	59 Å²	59	85.9 Å²	85.9	36%	0.358	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.9	169.9	174.8	0	0	0	0	108.6	F1418 F1420 V1428	V1390-F1418 WeakPolarHBondContact CA-O 3.29Å; V1390-F1418 HydrophobicContact CG2-CB 4.43Å; V1390-F1420 HydrophobicContact CB-CE2 4.4Å; V1390-F1420 HydrophobicContact CG1-CD2 3.4Å; V1390-F1420 VanDerWaalsContact CG1-CD2 3.4Å; V1390-F1420 HydrophobicContact CG1-CE2 3.33Å; V1390-F1420 HydrophobicContact CG1-CG 4.09Å; V1390-F1420 HydrophobicContact CG1-CZ 3.96Å; V1390-F1420 HydrophobicContact CG2-CE2 4.14Å; V1390-F1420 HydrophobicContact CG2-CZ 4.11Å; V1390-V1428 HydrophobicContact CG1-CG1 4.44Å
1391	I	86.1	Confident	75.4	Confident	17 Å²	17	81.4 Å²	81.4	9%	0.087	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	123.1	172.8	-53	179.8	0	0	0	108.6	V1389 E1403 L1406 F1410 V1417 F1418 L1419 F1420	V1389-I1391 HydrophobicContact CG1-CG1 4.13Å; I1391-E1403 HydrophobicContact CG2-CG 4.19Å; I1391-L1406 HydrophobicContact CD1-CB 3.97Å; I1391-F1410 HydrophobicContact CD1-CD2 4.19Å; I1391-F1410 HydrophobicContact CD1-CE2 4.4Å; I1391-V1417 HydrophobicContact CD1-CG1 3.65Å; I1391-V1417 HydrophobicContact CG1-CG1 4.03Å; I1391-F1418 PolarHBondContact N-O 3.2Å; I1391-L1419 HydrophobicContact CB-CD2 3.87Å; I1391-L1419 HydrophobicContact CD1-CD2 4.12Å; I1391-L1419 HydrophobicContact CG1-CD2 4.35Å; I1391-L1419 HydrophobicContact CG2-CD2 4.47Å; I1391-F1420 PolarHBondContact O-N 3.41Å
1392	G	79.9	Confident	76.5	Confident	25 Å²	25	76 Å²	76	26%	0.258	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	147	165.4	0	0	0	0	0	109.3	G1421	G1392-G1421 WeakPolarHBondContact CA-O 3.37Å
1393	K	81.5	Confident	77.8	Confident	21 Å²	21	67.4 Å²	67.4	9%	0.091	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	151.5	-178.1	55.7	-175.4	171.7	-167.3	0	110.6	Y1400 E1403 G1421 P1422 L1423	K1393-Y1400 VanDerWaalsContact NZ-CD1 3.28Å; K1393-E1403 WeakPolarHBondContact CD-OE2 3.31Å; K1393-E1403 WeakPolarHBondContact CE-OE1 3.44Å; K1393-E1403 VanDerWaalsContact CE-OE2 3.28Å; K1393-E1403 WeakPolarHBondContact CE-OE2 3.35Å; K1393-E1403 IonicContact NZ-OE1 3.7Å; K1393-E1403 PolarHBondContact NZ-OE1 2.75Å; K1393-E1403 IonicContact NZ-OE2 2.7Å; K1393-G1421 PolarHBondContact N-O 3.22Å; K1393-P1422 CarbonylContact O-C 3.55Å; K1393-P1422 VanDerWaalsContact O-CA 3.3Å; K1393-P1422 WeakPolarHBondContact O-CA 3.45Å; K1393-L1423 PolarHBondContact O-N 3.29Å; K1393-L1423 VanDerWaalsContact O-O 3.09Å
1394	D	72.6	Confident	79.1	Confident	59 Å²	59	67.1 Å²	67.1	32%	0.316	33%	0.328	S	S	.	.			trans	-77.2	174.9	164.8	67.4	-14.7	0	0	0	110.3	R1396	D1394-R1396 PolarHBondContact O-N 2.91Å; D1394-R1396 WeakPolarHBondContact OD1-CB 3.35Å; D1394-R1396 PolarHBondContact OD1-N 3.34Å; D1394-R1396 WeakPolarHBondContact OD2-CD 3.23Å; D1394-R1396 VanDerWaalsContact OD2-CG 3.26Å; D1394-R1396 WeakPolarHBondContact OD2-CG 3.43Å; D1394-R1396 IonicContact OD2-CZ 2.71Å; D1394-R1396 IonicContact OD2-NE 3.14Å; D1394-R1396 PolarHBondContact OD2-NE 3.31Å
1395	T	70.5	Confident	80.5	Confident	110 Å²	110	59 Å²	59	68%	0.675	29%	0.286	S	S	*	.	S	Bend	trans	-75.9	28.1	176.5	63.5	0	0	0	0	112.3	D728	D728-T1395 VanDerWaalsContact CG-C 3.45Å; D728-T1395 WeakPolarHBondContact OD2-CA 3.49Å
1396	R	71	Confident	81.7	Confident	148 Å²	148	55.2 Å²	55.2	56%	0.558	27%	0.27	S	S	*	.	S	Bend	trans	-96.4	118.6	171	-66.3	176.4	-160.2	-117.9	-8.5	108.9	D1394 S1398 G1399	D1394-R1396 PolarHBondContact O-N 2.91Å; D1394-R1396 WeakPolarHBondContact OD1-CB 3.35Å; D1394-R1396 PolarHBondContact OD1-N 3.34Å; D1394-R1396 WeakPolarHBondContact OD2-CD 3.23Å; D1394-R1396 VanDerWaalsContact OD2-CG 3.26Å; D1394-R1396 WeakPolarHBondContact OD2-CG 3.43Å; D1394-R1396 IonicContact OD2-CZ 2.71Å; D1394-R1396 IonicContact OD2-NE 3.14Å; D1394-R1396 PolarHBondContact OD2-NE 3.31Å; R1396-S1398 PolarHBondContact O-N 2.97Å; R1396-G1399 PolarHBondContact O-N 3.23Å
1397	L	73.1	Confident	83	Confident	77 Å²	77	48 Å²	48	40%	0.403	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn		35.7	-101.2	122.8	-62.7	164.8	0	0	0	113	T727 D728 A729 G1399 Y1400	T727-L1397 WeakPolarHBondContact CA-O 3.34Å; T727-L1397 VanDerWaalsContact CB-C 3.48Å; T727-L1397 VanDerWaalsContact CB-CD2 3.44Å; T727-L1397 HydrophobicContact CG2-CB 4.21Å; T727-L1397 WeakPolarHBondContact OG1-CD2 3.39Å; D728-L1397 PolarHBondContact OD1-N 3.15Å; A729-L1397 HydrophobicContact CB-CD2 3.75Å; A729-L1397 VanDerWaalsContact N-CD2 3.32Å; L1397-G1399 PolarHBondContact O-N 3.11Å; L1397-Y1400 PolarHBondContact O-N 3.31Å
1398	S	78.7	Confident	83.6	Confident	22 Å²	22	48.9 Å²	48.9	15%	0.154	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-36.8	-35.8	176	37.2	0	0	0	0	117.6	R1396 Y1400 M1401 L1402	R1396-S1398 PolarHBondContact O-N 2.97Å; S1398-Y1400 VanDerWaalsContact C-N 3.33Å; S1398-Y1400 PolarHBondContact O-N 3.18Å; S1398-M1401 PolarHBondContact O-N 2.92Å; S1398-M1401 VanDerWaalsContact O-N 3.11Å; S1398-L1402 VanDerWaalsContact O-CG 3.27Å; S1398-L1402 WeakPolarHBondContact O-CG 2.96Å; S1398-L1402 PolarHBondContact O-N 3.32Å
1399	G	81.9	Confident	84	Confident	6 Å²	6	40 Å²	40	6%	0.062	22%	0.224	C	C	.	.	H	α-helix	trans	-53.5	-39.2	-174.5	0	0	0	0	0	115.1	R1396 L1397 M1401 L1402 E1403	R1396-G1399 PolarHBondContact O-N 3.23Å; L1397-G1399 PolarHBondContact O-N 3.11Å; G1399-M1401 VanDerWaalsContact C-N 3.28Å; G1399-M1401 PolarHBondContact O-N 2.97Å; G1399-L1402 PolarHBondContact O-N 3.04Å; G1399-E1403 WeakPolarHBondContact O-CB 3.18Å; G1399-E1403 PolarHBondContact O-N 3.2Å
1400	Y	81.5	Confident	84.3	Confident	40 Å²	40	40 Å²	40	16%	0.157	22%	0.223	C	C	.	.	H	α-helix	trans	-69.7	-21	-179.8	-77.7	-85.9	0	0	0	114.3	L724 D728 T731 K1393 L1397 S1398 P1404	L724-Y1400 VanDerWaalsContact O-CD1 3.29Å; L724-Y1400 WeakPolarHBondContact O-CD1 3.34Å; D728-Y1400 HydrophobicContact CB-CE2 4.37Å; D728-Y1400 WeakPolarHBondContact OD1-CD2 3.37Å; D728-Y1400 WeakPolarHBondContact OD1-CE2 3.15Å; T731-Y1400 HydrophobicContact CG2-CD1 4.39Å; T731-Y1400 HydrophobicContact CG2-CD2 4.44Å; T731-Y1400 HydrophobicContact CG2-CG 4.09Å; T731-Y1400 WeakPolarHBondContact OG1-CD2 3.25Å; T731-Y1400 WeakPolarHBondContact OG1-CE2 3.36Å; K1393-Y1400 VanDerWaalsContact NZ-CD1 3.28Å; L1397-Y1400 PolarHBondContact O-N 3.31Å; S1398-Y1400 VanDerWaalsContact C-N 3.33Å; S1398-Y1400 PolarHBondContact O-N 3.18Å; Y1400-P1404 WeakPolarHBondContact O-CD 3.29Å; Y1400-P1404 WeakPolarHBondContact O-CG 3.39Å
1401	M	86.5	Confident	84.6	Confident	15 Å²	15	40.6 Å²	40.6	7%	0.074	23%	0.227	C	C	.	.	H	α-helix	trans	-92.5	-30.5	171.5	171.9	-153.3	70.9	0	0	111.7	G726 N1360 M1364 A1366 S1398 G1399 A1405	G726-M1401 PolarHBondContact O-N 2.83Å; N1360-M1401 HydrophobicContact CB-SD 3.83Å; M1364-M1401 WeakPolarHBondContact O-CE 3.22Å; A1366-M1401 HydrophobicContact CB-CG 3.84Å; A1366-M1401 HydrophobicContact CB-SD 4.44Å; S1398-M1401 PolarHBondContact O-N 2.92Å; S1398-M1401 VanDerWaalsContact O-N 3.11Å; G1399-M1401 VanDerWaalsContact C-N 3.28Å; G1399-M1401 PolarHBondContact O-N 2.97Å; M1401-A1405 WeakPolarHBondContact O-CB 3.3Å
1402	L	88.7	Confident	84.8	Confident	28 Å²	28	43.2 Å²	43.2	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-79.8	-36.8	-178.6	-63.5	173	0	0	0	113.3	M1364 A1369 S1398 G1399 A1405 L1406	M1364-L1402 HydrophobicContact CG-CD1 3.95Å; M1364-L1402 HydrophobicContact CG-CD2 3.95Å; M1364-L1402 HydrophobicContact CG-CG 4.43Å; M1364-L1402 HydrophobicContact SD-CD1 3.47Å; M1364-L1402 WeakPolarHBondContact SD-CD1 3.43Å; M1364-L1402 HydrophobicContact SD-CD2 3.54Å; M1364-L1402 VanDerWaalsContact SD-CD2 3.54Å; M1364-L1402 HydrophobicContact SD-CG 4.14Å; A1369-L1402 HydrophobicContact CB-CD2 3.62Å; S1398-L1402 VanDerWaalsContact O-CG 3.27Å; S1398-L1402 WeakPolarHBondContact O-CG 2.96Å; S1398-L1402 PolarHBondContact O-N 3.32Å; G1399-L1402 PolarHBondContact O-N 3.04Å; L1402-A1405 PolarHBondContact O-N 3.29Å; L1402-L1406 WeakPolarHBondContact O-CB 3.49Å; L1402-L1406 WeakPolarHBondContact O-CG 3.29Å; L1402-L1406 PolarHBondContact O-N 2.86Å
1403	E	90.3	Very high	85.2	Confident	23 Å²	23	44 Å²	44	11%	0.107	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-48.1	-176.9	176.5	-174.7	72.8	0	0	112.4	I1391 K1393 G1399 A1405 T1407 L1419	I1391-E1403 HydrophobicContact CG2-CG 4.19Å; K1393-E1403 WeakPolarHBondContact CD-OE2 3.31Å; K1393-E1403 WeakPolarHBondContact CE-OE1 3.44Å; K1393-E1403 VanDerWaalsContact CE-OE2 3.28Å; K1393-E1403 WeakPolarHBondContact CE-OE2 3.35Å; K1393-E1403 IonicContact NZ-OE1 3.7Å; K1393-E1403 PolarHBondContact NZ-OE1 2.75Å; K1393-E1403 IonicContact NZ-OE2 2.7Å; G1399-E1403 WeakPolarHBondContact O-CB 3.18Å; G1399-E1403 PolarHBondContact O-N 3.2Å; E1403-A1405 PolarHBondContact O-N 3.33Å; E1403-T1407 VanDerWaalsContact O-CB 3.29Å; E1403-T1407 WeakPolarHBondContact O-CB 3.34Å; E1403-T1407 PolarHBondContact O-N 3.26Å; E1403-T1407 PolarHBondContact O-OG1 3.35Å; E1403-L1419 HydrophobicContact CG-CD1 4.44Å; E1403-L1419 HydrophobicContact CG-CD2 3.96Å
1404	P	89.3	Confident	85.3	Confident	47 Å²	47	44.4 Å²	44.4	31%	0.305	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-41.1	173.9	-22.2	34.9	0	0	0	112.4	E725 Y1400 T1407 A1408	E725-P1404 HydrophobicContact CG-CG 4.29Å; Y1400-P1404 WeakPolarHBondContact O-CD 3.29Å; Y1400-P1404 WeakPolarHBondContact O-CG 3.39Å; P1404-T1407 WeakPolarHBondContact O-CB 3.11Å; P1404-T1407 PolarHBondContact O-N 3.36Å; P1404-A1408 WeakPolarHBondContact O-CB 3.46Å; P1404-A1408 PolarHBondContact O-N 2.57Å
1405	A	91.5	Very high	86	Confident	12 Å²	12	42 Å²	42	10%	0.099	24%	0.241	C	C	.	.	H	α-helix	trans	-65.6	-46.4	-179.1	0	0	0	0	0	112.7	A1366 A1369 L1370 M1401 L1402 E1403 T1407 A1408 G1409	A1366-A1405 HydrophobicContact CB-CB 4.25Å; A1366-A1405 WeakPolarHBondContact O-CB 3.41Å; A1369-A1405 HydrophobicContact CB-CB 3.63Å; L1370-A1405 WeakPolarHBondContact CA-O 3.4Å; L1370-A1405 HydrophobicContact CB-CB 4.43Å; M1401-A1405 WeakPolarHBondContact O-CB 3.3Å; L1402-A1405 PolarHBondContact O-N 3.29Å; E1403-A1405 PolarHBondContact O-N 3.33Å; A1405-T1407 VanDerWaalsContact C-N 3.32Å; A1405-T1407 PolarHBondContact O-N 3.49Å; A1405-A1408 PolarHBondContact O-N 2.89Å; A1405-G1409 PolarHBondContact O-N 2.75Å
1406	L	92.1	Very high	86.7	Confident	41 Å²	41	38.9 Å²	38.9	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-41.9	172.1	-76.8	167	0	0	0	111	A1369 V1372 I1391 L1402 G1409 F1410	A1369-L1406 HydrophobicContact CB-CG 4.33Å; A1369-L1406 WeakPolarHBondContact O-CD2 3.28Å; V1372-L1406 HydrophobicContact CG1-CD2 4.15Å; I1391-L1406 HydrophobicContact CD1-CB 3.97Å; L1402-L1406 WeakPolarHBondContact O-CB 3.49Å; L1402-L1406 WeakPolarHBondContact O-CG 3.29Å; L1402-L1406 PolarHBondContact O-N 2.86Å; L1406-G1409 WeakPolarHBondContact O-CA 3.48Å; L1406-G1409 PolarHBondContact O-N 3.01Å; L1406-G1409 VanDerWaalsContact O-N 3.13Å; L1406-F1410 HydrophobicContact CB-CD2 4.37Å; L1406-F1410 HydrophobicContact CB-CE2 4.24Å; L1406-F1410 HydrophobicContact CD2-CE2 4.13Å; L1406-F1410 WeakPolarHBondContact O-CD2 3.45Å; L1406-F1410 PolarHBondContact O-N 3.31Å
1407	T	93.5	Very high	87.6	Confident	29 Å²	29	33.4 Å²	33.4	18%	0.178	20%	0.203	C	C	.	.	H	α-helix	trans	-60.5	-47.5	177.9	-59	0	0	0	0	111.7	E1403 P1404 A1405 G1409 F1410 T1411 V1417	E1403-T1407 VanDerWaalsContact O-CB 3.29Å; E1403-T1407 WeakPolarHBondContact O-CB 3.34Å; E1403-T1407 PolarHBondContact O-N 3.26Å; E1403-T1407 PolarHBondContact O-OG1 3.35Å; P1404-T1407 WeakPolarHBondContact O-CB 3.11Å; P1404-T1407 PolarHBondContact O-N 3.36Å; A1405-T1407 VanDerWaalsContact C-N 3.32Å; A1405-T1407 PolarHBondContact O-N 3.49Å; T1407-G1409 VanDerWaalsContact C-N 3.29Å; T1407-G1409 PolarHBondContact O-N 3.16Å; T1407-F1410 PolarHBondContact O-N 2.66Å; T1407-T1411 HydrophobicContact CG2-CG2 4.28Å; T1407-T1411 WeakPolarHBondContact O-CB 3.44Å; T1407-T1411 VanDerWaalsContact O-CG2 3.32Å; T1407-T1411 WeakPolarHBondContact O-CG2 3.27Å; T1407-T1411 PolarHBondContact O-N 2.93Å; T1407-T1411 PolarHBondContact O-OG1 3.17Å; T1407-V1417 HydrophobicContact CG2-CB 4.28Å; T1407-V1417 HydrophobicContact CG2-CG1 4.11Å
1408	A	92.6	Very high	88.2	Confident	44 Å²	44	33.9 Å²	33.9	36%	0.364	20%	0.202	S	C	.	.	H	α-helix	trans	-61.8	-37.4	173.7	0	0	0	0	0	111.8	L1370 P1404 A1405 T1411 S1412	L1370-A1408 HydrophobicContact CD1-CB 3.69Å; P1404-A1408 WeakPolarHBondContact O-CB 3.46Å; P1404-A1408 PolarHBondContact O-N 2.57Å; A1405-A1408 PolarHBondContact O-N 2.89Å; A1408-T1411 WeakPolarHBondContact CA-OG1 3.43Å; A1408-T1411 PolarHBondContact O-OG1 2.87Å; A1408-S1412 WeakPolarHBondContact O-CB 3.37Å; A1408-S1412 PolarHBondContact O-N 3.12Å; A1408-S1412 PolarHBondContact O-OG 3.14Å
1409	G	92.6	Very high	88.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-44.8	176.9	0	0	0	0	0	113.2	G1373 M1374 A1405 L1406 T1407 S1412 M1413	G1373-G1409 VanDerWaalsContact C-C 3.41Å; G1373-G1409 CarbonylContact C-O 3.45Å; M1374-G1409 WeakPolarHBondContact CA-O 3.41Å; M1374-G1409 PolarHBondContact N-O 3.3Å; A1405-G1409 PolarHBondContact O-N 2.75Å; L1406-G1409 WeakPolarHBondContact O-CA 3.48Å; L1406-G1409 PolarHBondContact O-N 3.01Å; L1406-G1409 VanDerWaalsContact O-N 3.13Å; T1407-G1409 VanDerWaalsContact C-N 3.29Å; T1407-G1409 PolarHBondContact O-N 3.16Å; G1409-S1412 PolarHBondContact O-OG 3.24Å; G1409-S1412 VanDerWaalsContact O-OG 3.06Å; G1409-M1413 WeakPolarHBondContact O-CG 3.39Å
1410	F	92.5	Very high	88.5	Confident	17 Å²	17	41 Å²	41	8%	0.075	23%	0.232	C	C	.	.	H	α-helix	trans	-74.3	-40.7	177.9	-71.1	-61.2	0	0	0	113	G1373 A1376 F1380 V1389 I1391 L1406 T1407 M1413 G1414 M1415 V1417	G1373-F1410 WeakPolarHBondContact O-CD1 3.46Å; A1376-F1410 HydrophobicContact CB-CE1 3.6Å; A1376-F1410 HydrophobicContact CB-CZ 4.03Å; F1380-F1410 HydrophobicContact CD2-CE1 4.13Å; F1380-F1410 HydrophobicContact CE2-CE1 4.09Å; V1389-F1410 HydrophobicContact CG1-CD2 3.9Å; V1389-F1410 HydrophobicContact CG1-CE1 4.44Å; V1389-F1410 HydrophobicContact CG1-CE2 3.78Å; V1389-F1410 HydrophobicContact CG1-CG 4.3Å; V1389-F1410 HydrophobicContact CG1-CZ 4.07Å; V1389-F1410 HydrophobicContact CG2-CB 4.41Å; V1389-F1410 HydrophobicContact CG2-CD1 3.91Å; V1389-F1410 HydrophobicContact CG2-CD2 4.46Å; V1389-F1410 HydrophobicContact CG2-CE1 4.22Å; V1389-F1410 HydrophobicContact CG2-CG 4.03Å; I1391-F1410 HydrophobicContact CD1-CD2 4.19Å; I1391-F1410 HydrophobicContact CD1-CE2 4.4Å; L1406-F1410 HydrophobicContact CB-CD2 4.37Å; L1406-F1410 HydrophobicContact CB-CE2 4.24Å; L1406-F1410 HydrophobicContact CD2-CE2 4.13Å; L1406-F1410 WeakPolarHBondContact O-CD2 3.45Å; L1406-F1410 PolarHBondContact O-N 3.31Å; T1407-F1410 PolarHBondContact O-N 2.66Å; F1410-M1413 PolarHBondContact O-N 3.49Å; F1410-G1414 PolarHBondContact O-N 2.93Å; F1410-M1415 HydrophobicContact CB-CB 4.44Å; F1410-M1415 HydrophobicContact CD1-SD 3.67Å; F1410-M1415 HydrophobicContact CE1-SD 4.36Å; F1410-M1415 PolarHBondContact O-N 2.89Å; F1410-V1417 HydrophobicContact CB-CG2 3.6Å
1411	T	89.7	Confident	88.3	Confident	71 Å²	71	39.7 Å²	39.7	44%	0.436	23%	0.231	S	C	.	.	H	α-helix	trans	-69.6	-37.1	179.8	52.4	0	0	0	0	112.5	T1407 A1408 M1413 G1414 V1417	T1407-T1411 HydrophobicContact CG2-CG2 4.28Å; T1407-T1411 WeakPolarHBondContact O-CB 3.44Å; T1407-T1411 VanDerWaalsContact O-CG2 3.32Å; T1407-T1411 WeakPolarHBondContact O-CG2 3.27Å; T1407-T1411 PolarHBondContact O-N 2.93Å; T1407-T1411 PolarHBondContact O-OG1 3.17Å; A1408-T1411 WeakPolarHBondContact CA-OG1 3.43Å; A1408-T1411 PolarHBondContact O-OG1 2.87Å; T1411-M1413 PolarHBondContact O-N 3.24Å; T1411-G1414 WeakPolarHBondContact O-CA 3.47Å; T1411-G1414 PolarHBondContact O-N 3.39Å; T1411-V1417 HydrophobicContact CG2-CB 4.4Å; T1411-V1417 HydrophobicContact CG2-CG2 3.78Å
1412	S	89.8	Confident	87.9	Confident	73 Å²	73	42.7 Å²	42.7	51%	0.51	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-21.6	172.9	59.5	0	0	0	0	113.6	A1408 G1409	A1408-S1412 WeakPolarHBondContact O-CB 3.37Å; A1408-S1412 PolarHBondContact O-N 3.12Å; A1408-S1412 PolarHBondContact O-OG 3.14Å; G1409-S1412 PolarHBondContact O-OG 3.24Å; G1409-S1412 VanDerWaalsContact O-OG 3.06Å
1413	M	88.7	Confident	86.8	Confident	42 Å²	42	43.2 Å²	43.2	21%	0.207	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	1.3	171.3	-60.3	-57	-51.8	0	0	113.6	M1374 R1378 R1381 G1409 F1410 T1411	M1374-M1413 HydrophobicContact CB-CG 4.32Å; M1374-M1413 HydrophobicContact CB-SD 4.36Å; M1374-M1413 WeakPolarHBondContact O-CG 3.28Å; R1378-M1413 HydrophobicContact CB-CE 3.73Å; R1378-M1413 HydrophobicContact CG-CE 4.16Å; R1381-M1413 WeakPolarHBondContact CD-O 3.48Å; R1381-M1413 PolarHBondContact NE-O 3.05Å; G1409-M1413 WeakPolarHBondContact O-CG 3.39Å; F1410-M1413 PolarHBondContact O-N 3.49Å; T1411-M1413 PolarHBondContact O-N 3.24Å
1414	G	83.8	Confident	85.4	Confident	28 Å²	28	45.7 Å²	45.7	29%	0.289	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	41.7	176.7	0	0	0	0	0	114.6	R1381 F1410 T1411	R1381-G1414 PolarHBondContact NH2-O 3.3Å; F1410-G1414 PolarHBondContact O-N 2.93Å; T1411-G1414 WeakPolarHBondContact O-CA 3.47Å; T1411-G1414 PolarHBondContact O-N 3.39Å
1415	M	87.4	Confident	83.9	Confident	8 Å²	8	48.9 Å²	48.9	4%	0.039	29%	0.292	C	S	.	.			trans	-105.5	150.3	168.2	-58.5	-179.4	84.1	0	0	111	G1377 F1380 H1387 V1389 F1410	G1377-M1415 VanDerWaalsContact CA-SD 3.5Å; F1380-M1415 HydrophobicContact CB-CE 3.68Å; F1380-M1415 HydrophobicContact CB-SD 4.32Å; F1380-M1415 HydrophobicContact CD2-CE 4Å; F1380-M1415 HydrophobicContact CD2-SD 4.45Å; F1380-M1415 HydrophobicContact CG-CE 4.31Å; H1387-M1415 HydrophobicContact CB-CE 3.39Å; H1387-M1415 HydrophobicContact CB-CG 4.38Å; H1387-M1415 WeakPolarHBondContact O-CA 3.42Å; H1387-M1415 WeakPolarHBondContact O-CB 3.41Å; V1389-M1415 HydrophobicContact CG2-CB 4.18Å; V1389-M1415 HydrophobicContact CG2-CE 3.37Å; V1389-M1415 HydrophobicContact CG2-SD 3.78Å; F1410-M1415 HydrophobicContact CB-CB 4.44Å; F1410-M1415 HydrophobicContact CD1-SD 3.67Å; F1410-M1415 HydrophobicContact CE1-SD 4.36Å; F1410-M1415 PolarHBondContact O-N 2.89Å
1416	D	86.1	Confident	82.3	Confident	45 Å²	45	53.1 Å²	53.1	24%	0.241	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.1	175.2	-62.6	-34.3	0	0	0	109.7	R1386 H1387 R1388 V1389 F1418	R1386-D1416 WeakPolarHBondContact CB-OD2 3.42Å; R1386-D1416 VanDerWaalsContact CD-OD1 3.3Å; R1386-D1416 WeakPolarHBondContact CD-OD1 3.28Å; R1386-D1416 WeakPolarHBondContact CD-OD2 3.17Å; R1386-D1416 IonicContact CZ-OD1 3.56Å; R1386-D1416 IonicContact NE-OD1 3.2Å; R1386-D1416 IonicContact NH1-OD1 3.95Å; R1386-D1416 PolarHBondContact NH1-OD1 3.09Å; H1387-D1416 PolarHBondContact O-N 3.47Å; R1388-D1416 CarbonylContact C-O 3.56Å; R1388-D1416 VanDerWaalsContact CA-O 3.3Å; R1388-D1416 WeakPolarHBondContact CA-O 3.02Å; R1388-D1416 HydrophobicContact CG-CB 4.42Å; V1389-D1416 PolarHBondContact N-O 2.76Å; D1416-F1418 HydrophobicContact CB-CE2 4.12Å
1417	V	88.7	Confident	80.7	Confident	33 Å²	33	54.6 Å²	54.6	20%	0.2	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.1	-174.9	-175.5	0	0	0	0	111.3	V1389 I1391 T1407 F1410 T1411 L1419	V1389-V1417 HydrophobicContact CB-CG2 4.46Å; V1389-V1417 WeakPolarHBondContact O-CA 3.43Å; I1391-V1417 HydrophobicContact CD1-CG1 3.65Å; I1391-V1417 HydrophobicContact CG1-CG1 4.03Å; T1407-V1417 HydrophobicContact CG2-CB 4.28Å; T1407-V1417 HydrophobicContact CG2-CG1 4.11Å; F1410-V1417 HydrophobicContact CB-CG2 3.6Å; T1411-V1417 HydrophobicContact CG2-CB 4.4Å; T1411-V1417 HydrophobicContact CG2-CG2 3.78Å; V1417-L1419 HydrophobicContact CG1-CD2 3.91Å
1418	F	86.5	Confident	79.2	Confident	87 Å²	87	55 Å²	55	38%	0.382	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.9	177.3	-65.8	-98	0	0	0	109.1	R1388 V1389 V1390 I1391 D1416 F1420	R1388-F1418 HydrophobicContact CB-CD2 4.3Å; R1388-F1418 HydrophobicContact CB-CE2 3.97Å; R1388-F1418 HydrophobicContact CG-CE2 3.85Å; V1389-F1418 PolarHBondContact O-N 3.35Å; V1390-F1418 WeakPolarHBondContact CA-O 3.29Å; V1390-F1418 HydrophobicContact CG2-CB 4.43Å; I1391-F1418 PolarHBondContact N-O 3.2Å; D1416-F1418 HydrophobicContact CB-CE2 4.12Å; F1418-F1420 HydrophobicContact CB-CE1 4.06Å
1419	L	87.1	Confident	77.6	Confident	91 Å²	91	57.3 Å²	57.3	48%	0.476	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.1	177.4	-57.3	-174.4	0	0	0	109.7	I1391 E1403 V1417	I1391-L1419 HydrophobicContact CB-CD2 3.87Å; I1391-L1419 HydrophobicContact CD1-CD2 4.12Å; I1391-L1419 HydrophobicContact CG1-CD2 4.35Å; I1391-L1419 HydrophobicContact CG2-CD2 4.47Å; E1403-L1419 HydrophobicContact CG-CD1 4.44Å; E1403-L1419 HydrophobicContact CG-CD2 3.96Å; V1417-L1419 HydrophobicContact CG1-CD2 3.91Å
1420	F	78.7	Confident	75.9	Confident	87 Å²	87	64.1 Å²	64.1	38%	0.382	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-5	175.3	-62	-15.5	0	0	0	113.3	V1390 I1391 F1418 L1423 T1431	V1390-F1420 HydrophobicContact CB-CE2 4.4Å; V1390-F1420 HydrophobicContact CG1-CD2 3.4Å; V1390-F1420 VanDerWaalsContact CG1-CD2 3.4Å; V1390-F1420 HydrophobicContact CG1-CE2 3.33Å; V1390-F1420 HydrophobicContact CG1-CG 4.09Å; V1390-F1420 HydrophobicContact CG1-CZ 3.96Å; V1390-F1420 HydrophobicContact CG2-CE2 4.14Å; V1390-F1420 HydrophobicContact CG2-CZ 4.11Å; I1391-F1420 PolarHBondContact O-N 3.41Å; F1418-F1420 HydrophobicContact CB-CE1 4.06Å; F1420-L1423 HydrophobicContact CB-CD1 3.39Å; F1420-L1423 HydrophobicContact CD2-CD1 4.28Å; F1420-L1423 HydrophobicContact CG-CD1 4.3Å; F1420-T1431 HydrophobicContact CD2-CG2 4.28Å; F1420-T1431 HydrophobicContact CE2-CG2 3.85Å
1421	G	78.2	Confident	74.1	Confident	13 Å²	13	65.5 Å²	65.5	13%	0.134	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	71.4	-148.9	174.5	0	0	0	0	0	113.9	G1392 K1393 L1423	G1392-G1421 WeakPolarHBondContact CA-O 3.37Å; K1393-G1421 PolarHBondContact N-O 3.22Å; G1421-L1423 PolarHBondContact O-N 2.96Å
1422	P	78.4	Confident	72.1	Confident	78 Å²	78	67.1 Å²	67.1	51%	0.506	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	101.7	-176.7	-22	34.8	0	0	0	113.1	K1393	K1393-P1422 CarbonylContact O-C 3.55Å; K1393-P1422 VanDerWaalsContact O-CA 3.3Å; K1393-P1422 WeakPolarHBondContact O-CA 3.45Å
1423	L	65.9	Low	69.9	Low	39 Å²	39	69.2 Å²	69.2	20%	0.204	40%	0.399	C	S	.	.			trans	-141.3	131.4	179.5	-86.4	159.2	0	0	0	110.3	K1393 F1420 G1421 L1427 V1428	K1393-L1423 PolarHBondContact O-N 3.29Å; K1393-L1423 VanDerWaalsContact O-O 3.09Å; F1420-L1423 HydrophobicContact CB-CD1 3.39Å; F1420-L1423 HydrophobicContact CD2-CD1 4.28Å; F1420-L1423 HydrophobicContact CG-CD1 4.3Å; G1421-L1423 PolarHBondContact O-N 2.96Å; L1423-L1427 HydrophobicContact CD2-CB 4.06Å; L1423-L1427 HydrophobicContact CD2-CD1 3.85Å; L1423-L1427 HydrophobicContact CD2-CD2 4.06Å; L1423-L1427 HydrophobicContact CD2-CG 4.2Å; L1423-V1428 HydrophobicContact CB-CG2 3.95Å
1424	P	60.5	Low	67.7	Low	74 Å²	74	70.6 Å²	70.6	48%	0.481	42%	0.424	S	S	.	.			trans	-62.6	146.4	175.4	26.8	-32.6	0	0	0	110.4	T1426 L1427 V1428	P1424-T1426 PolarHBondContact O-N 2.9Å; P1424-L1427 HydrophobicContact CG-CB 4.19Å; P1424-L1427 PolarHBondContact O-N 3.07Å; P1424-V1428 PolarHBondContact O-N 3.44Å
1425	T	58.4	Low	65.5	Low	115 Å²	115	72.6 Å²	72.6	71%	0.706	44%	0.438	S	S	*	.	H	α-helix	trans	-54.3	-30.5	-172.2	-41.8	0	0	0	0	113.5	L1427 S1429	T1425-L1427 VanDerWaalsContact C-N 3.31Å; T1425-L1427 PolarHBondContact O-N 3.19Å; T1425-S1429 PolarHBondContact O-N 2.92Å; T1425-S1429 PolarHBondContact O-OG 3.28Å
1426	T	56.8	Low	62.8	Low	100 Å²	100	76.5 Å²	76.5	61%	0.613	47%	0.471	S	S	*	.	H	α-helix	trans	-67.2	-24.7	175.9	44.7	0	0	0	0	114.5	P1424 S1429 Q1430	P1424-T1426 PolarHBondContact O-N 2.9Å; T1426-S1429 PolarHBondContact O-OG 3.45Å; T1426-Q1430 WeakPolarHBondContact O-CG 3.47Å
1427	L	58.4	Low	60.2	Low	72 Å²	72	82.1 Å²	82.1	38%	0.377	50%	0.496	S	S	.	.	H	α-helix	trans	-92.1	-35.2	180	-138.5	166	0	0	0	110.7	L1423 P1424 T1425 S1429 Q1430	L1423-L1427 HydrophobicContact CD2-CB 4.06Å; L1423-L1427 HydrophobicContact CD2-CD1 3.85Å; L1423-L1427 HydrophobicContact CD2-CD2 4.06Å; L1423-L1427 HydrophobicContact CD2-CG 4.2Å; P1424-L1427 HydrophobicContact CG-CB 4.19Å; P1424-L1427 PolarHBondContact O-N 3.07Å; T1425-L1427 VanDerWaalsContact C-N 3.31Å; T1425-L1427 PolarHBondContact O-N 3.19Å; L1427-S1429 PolarHBondContact O-N 3.01Å; L1427-Q1430 WeakPolarHBondContact O-CB 3.44Å; L1427-Q1430 PolarHBondContact O-N 3.28Å
1428	V	62.3	Low	57.3	Low	37 Å²	37	86.3 Å²	86.3	22%	0.224	52%	0.524	C	S	.	.	H	α-helix	trans	-56.9	-38.3	169.1	-175.5	0	0	0	0	111.2	V1390 L1423 P1424 Q1430 T1431	V1390-V1428 HydrophobicContact CG1-CG1 4.44Å; L1423-V1428 HydrophobicContact CB-CG2 3.95Å; P1424-V1428 PolarHBondContact O-N 3.44Å; V1428-Q1430 PolarHBondContact O-N 3.37Å; V1428-T1431 PolarHBondContact O-N 3.24Å; V1428-T1431 PolarHBondContact O-OG1 3.13Å
1429	S	60.1	Low	54.6	Low	93 Å²	93	87.3 Å²	87.3	65%	0.65	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-8.7	174.9	56.1	0	0	0	0	115.3	T1425 T1426 L1427	T1425-S1429 PolarHBondContact O-N 2.92Å; T1425-S1429 PolarHBondContact O-OG 3.28Å; T1426-S1429 PolarHBondContact O-OG 3.45Å; L1427-S1429 PolarHBondContact O-N 3.01Å
1430	Q	56.5	Low	51.9	Low	144 Å²	144	84.9 Å²	84.9	67%	0.673	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-7.3	177.9	-71.5	174.8	-4.1	0	0	113.2	T1426 L1427 V1428	T1426-Q1430 WeakPolarHBondContact O-CG 3.47Å; L1427-Q1430 WeakPolarHBondContact O-CB 3.44Å; L1427-Q1430 PolarHBondContact O-N 3.28Å; V1428-Q1430 PolarHBondContact O-N 3.37Å
1431	T	53.7	Low	49.4	Very low	45 Å²	45	85.7 Å²	85.7	28%	0.276	54%	0.544	S	S	.	.			trans	-95	13.9	-172.1	56	0	0	0	0	115.2	F1420 V1428 P1433	F1420-T1431 HydrophobicContact CD2-CG2 4.28Å; F1420-T1431 HydrophobicContact CE2-CG2 3.85Å; V1428-T1431 PolarHBondContact O-N 3.24Å; V1428-T1431 PolarHBondContact O-OG1 3.13Å; T1431-P1433 VanDerWaalsContact O-CD 3.28Å; T1431-P1433 WeakPolarHBondContact O-CD 3.35Å
1432	D	48.2	Very low	47.1	Very low	105 Å²	105	88.7 Å²	88.7	56%	0.561	58%	0.575	S	S	*	*			trans	-69.5	116.8	173.7	-176.8	-7.5	0	0	0	110.6	G1434 A1435	D1432-G1434 PolarHBondContact O-N 3.37Å; D1432-G1434 VanDerWaalsContact O-N 3.11Å; D1432-G1434 PolarHBondContact OD1-N 3.04Å; D1432-A1435 HydrophobicContact CB-CB 4.46Å; D1432-A1435 WeakPolarHBondContact O-CB 3.35Å; D1432-A1435 PolarHBondContact O-N 3.29Å
1433	P	43.2	Very low	44.6	Very low	118 Å²	118	93.1 Å²	93.1	77%	0.766	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-61.8	-18	178.1	-21.8	34.8	0	0	0	114.1	T1431 A1435	T1431-P1433 VanDerWaalsContact O-CD 3.28Å; T1431-P1433 WeakPolarHBondContact O-CD 3.35Å; P1433-A1435 VanDerWaalsContact C-N 3.29Å
1434	G	42.4	Very low	42.6	Very low	70 Å²	70	101.7 Å²	101.7	72%	0.722	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-72.8	-15.9	173.7	0	0	0	0	0	114.4	D1432 A1436	D1432-G1434 PolarHBondContact O-N 3.37Å; D1432-G1434 VanDerWaalsContact O-N 3.11Å; D1432-G1434 PolarHBondContact OD1-N 3.04Å; G1434-A1436 PolarHBondContact O-N 3.12Å
1435	A	38.3	Very low	41.1	Very low	70 Å²	70	104.7 Å²	104.7	58%	0.579	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-84.2	17.8	-176.3	0	0	0	0	0	114.4	D1432 P1433 Q1437	D1432-A1435 HydrophobicContact CB-CB 4.46Å; D1432-A1435 WeakPolarHBondContact O-CB 3.35Å; D1432-A1435 PolarHBondContact O-N 3.29Å; P1433-A1435 VanDerWaalsContact C-N 3.29Å; A1435-Q1437 VanDerWaalsContact C-N 3.32Å; A1435-Q1437 PolarHBondContact O-N 3.3Å
1436	A	30.3	Very low	39.6	Very low	90 Å²	90	103.1 Å²	103.1	74%	0.744	62%	0.623	S	S	*	*			trans	-75.2	66.2	-168.4	0	0	0	0	0	115.2	G1434	G1434-A1436 PolarHBondContact O-N 3.12Å
1437	Q	30.8	Very low	38.3	Very low	163 Å²	163	103.3 Å²	103.3	76%	0.762	63%	0.626	S	S	*	*	S	Bend	trans	-130.1	139.3	158.5	-73.2	-168.7	-12.3	0	0	110.7	A1435 V1439	A1435-Q1437 VanDerWaalsContact C-N 3.32Å; A1435-Q1437 PolarHBondContact O-N 3.3Å; Q1437-V1439 PolarHBondContact O-N 3.32Å
1438	P	29.1	Very low	37.1	Very low	121 Å²	121	107.2 Å²	107.2	79%	0.786	64%	0.636	S	S	*	*			trans	-76	84.4	-174.8	31.1	-35.5	0	0	0	111.8	A1440	P1438-A1440 PolarHBondContact O-N 3.03Å
1439	V	30.1	Very low	35.7	Very low	108 Å²	108	108.6 Å²	108.6	66%	0.655	65%	0.647	S	S	*	*			trans	-73.3	115	174.6	176.7	0	0	0	0	109.6	Q1437 F1443	Q1437-V1439 PolarHBondContact O-N 3.32Å; V1439-F1443 HydrophobicContact CG1-CB 3.39Å; V1439-F1443 HydrophobicContact CG1-CG 4.08Å
1440	A	29.1	Very low	34.2	Very low	40 Å²	40	114.3 Å²	114.3	33%	0.331	65%	0.654	S	S	.	*			trans	-60.3	149.2	-172	0	0	0	0	0	113.9	P1438 G1442 F1443	P1438-A1440 PolarHBondContact O-N 3.03Å; A1440-G1442 PolarHBondContact O-N 3.38Å; A1440-F1443 PolarHBondContact O-N 3.15Å
1441	P	27.1	Very low	32.9	Very low	105 Å²	105	116 Å²	116	68%	0.682	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	99.1	-179.3	27	-34.8	0	0	0	111	S399	S399-P1441 WeakPolarHBondContact OG-CG 3.45Å
1442	G	29.2	Very low	31.8	Very low	76 Å²	76	117.5 Å²	117.5	78%	0.784	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.3	-12	-173.8	0	0	0	0	0	114.6	A1440	A1440-G1442 PolarHBondContact O-N 3.38Å
1443	F	25.5	Very low	30.9	Very low	171 Å²	171	121.9 Å²	121.9	75%	0.75	67%	0.666	S	S	*	*			trans	-80.1	146.1	-179.9	-102.5	-98.3	0	0	0	114.4	V1439 A1440	V1439-F1443 HydrophobicContact CG1-CB 3.39Å; V1439-F1443 HydrophobicContact CG1-CG 4.08Å; A1440-F1443 PolarHBondContact O-N 3.15Å
1444	R	25.4	Very low	30.5	Very low	219 Å²	219	122 Å²	122	83%	0.826	66%	0.66	S	S	*	*			trans	-85.2	131.5	-168.2	-62.2	169.6	176.1	162.9	-2.7	112.1	T1446	R1444-T1446 PolarHBondContact O-N 3.32Å
1445	V	28	Very low	30.4	Very low	136 Å²	136	120 Å²	120	82%	0.824	63%	0.634	S	S	*	*			trans	-74.6	109	159.8	-179.7	0	0	0	0	109.1
1446	T	27.5	Very low	31.1	Very low	83 Å²	83	117.8 Å²	117.8	51%	0.509	62%	0.617	S	S	.	*			trans	-131.9	120.1	165	50.1	0	0	0	0	110	R1444	R1444-T1446 PolarHBondContact O-N 3.32Å
1447	P	30.2	Very low	32.4	Very low	103 Å²	103	116.6 Å²	116.6	67%	0.669	60%	0.602	S	S	*	*	S	Bend		-118.9	3.2	115.3	34	-34.7	0	0	0	114.2
1448	W	32.8	Very low	34	Very low	155 Å²	155	113.1 Å²	113.1	59%	0.587	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-13.5	-173.6	-73.6	87.1	0	0	0	116	R1450 W1451 F1452	W1448-R1450 PolarHBondContact O-N 3.45Å; W1448-R1450 VanDerWaalsContact O-N 3.17Å; W1448-W1451 PolarHBondContact O-N 3.38Å; W1448-F1452 HydrophobicContact CB-CD2 3.78Å; W1448-F1452 HydrophobicContact CB-CE2 3.85Å; W1448-F1452 HydrophobicContact CE3-CE2 4.17Å; W1448-F1452 HydrophobicContact CG-CE2 4.42Å; W1448-F1452 WeakPolarHBondContact O-CD2 3.35Å; W1448-F1452 PolarHBondContact O-N 2.73Å
1449	S	32.8	Very low	35.8	Very low	65 Å²	65	111.9 Å²	111.9	46%	0.455	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.5	-11.3	-174.3	56.5	0	0	0	0	115.3
1450	R	27.6	Very low	37.9	Very low	213 Å²	213	108.7 Å²	108.7	80%	0.804	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-33.9	172.7	-144.9	173.6	-171	174.9	2	112.3	W1448	W1448-R1450 PolarHBondContact O-N 3.45Å; W1448-R1450 VanDerWaalsContact O-N 3.17Å
1451	W	29.2	Very low	40.1	Very low	180 Å²	180	109.7 Å²	109.7	68%	0.682	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-43.7	173.8	-95.4	86.6	0	0	0	112.8	W1448 R1453 L1454 C1455	W1448-W1451 PolarHBondContact O-N 3.38Å; W1451-R1453 PolarHBondContact O-N 3.42Å; W1451-L1454 PolarHBondContact O-N 3.14Å; W1451-C1455 PolarHBondContact O-N 2.57Å; W1451-C1455 PolarHBondContact O-SG 2.82Å
1452	F	31	Very low	42.5	Very low	77 Å²	77	111.5 Å²	111.5	34%	0.338	56%	0.556	S	S	.	*	H	α-helix	trans	-60.2	-16.7	-179.4	-90.4	-64.1	0	0	0	115	W1448 L1454 C1455	W1448-F1452 HydrophobicContact CB-CD2 3.78Å; W1448-F1452 HydrophobicContact CB-CE2 3.85Å; W1448-F1452 HydrophobicContact CE3-CE2 4.17Å; W1448-F1452 HydrophobicContact CG-CE2 4.42Å; W1448-F1452 WeakPolarHBondContact O-CD2 3.35Å; W1448-F1452 PolarHBondContact O-N 2.73Å; F1452-L1454 VanDerWaalsContact C-N 3.26Å; F1452-C1455 HydrophobicContact CD1-CB 4.26Å
1453	R	30.1	Very low	45.1	Very low	197 Å²	197	109.6 Å²	109.6	74%	0.743	53%	0.525	S	S	*	.	H	α-helix	trans	-74.7	-15.4	173.7	-125.2	-178.3	-67.3	-162.3	-0.3	113.5	W1451	W1451-R1453 PolarHBondContact O-N 3.42Å
1454	L	33.6	Very low	47.8	Very low	119 Å²	119	106.2 Å²	106.2	62%	0.623	51%	0.514	S	S	*	.	H	α-helix	trans	-102.1	-27.7	172.1	-74.2	152.6	0	0	0	111.9	W1451 F1452 V1458	W1451-L1454 PolarHBondContact O-N 3.14Å; F1452-L1454 VanDerWaalsContact C-N 3.26Å; L1454-V1458 VanDerWaalsContact O-CG2 3.27Å; L1454-V1458 WeakPolarHBondContact O-CG2 3.37Å
1455	C	41.4	Very low	50.5	Low	28 Å²	28	105 Å²	105	19%	0.189	52%	0.515	C	S	.	.	H	α-helix	trans	-70.3	-35.1	-170.4	-62.7	0	0	0	0	115.5	W1451 F1452 S1457 V1458 Q1459	W1451-C1455 PolarHBondContact O-N 2.57Å; W1451-C1455 PolarHBondContact O-SG 2.82Å; F1452-C1455 HydrophobicContact CD1-CB 4.26Å; C1455-S1457 PolarHBondContact O-N 3.14Å; C1455-V1458 CarbonylContact O-C 3.52Å; C1455-V1458 PolarHBondContact O-N 2.57Å; C1455-Q1459 WeakPolarHBondContact O-CB 3.15Å; C1455-Q1459 VanDerWaalsContact O-CG 3.25Å; C1455-Q1459 WeakPolarHBondContact O-CG 3.38Å; C1455-Q1459 PolarHBondContact O-N 2.72Å; C1455-Q1459 PolarHBondContact O-OE1 3.36Å
1456	A	51.3	Low	53	Low	25 Å²	25	101.8 Å²	101.8	21%	0.207	49%	0.491	C	S	.	.	H	α-helix	trans	-65.3	-46	-167.8	0	0	0	0	0	113.5	Q1459 I1460 V1554	A1456-Q1459 PolarHBondContact O-N 2.95Å; A1456-I1460 WeakPolarHBondContact O-CG1 3.25Å; A1456-I1460 PolarHBondContact O-N 3.09Å; A1456-V1554 HydrophobicContact CB-CB 4.06Å; A1456-V1554 HydrophobicContact CB-CG1 4.35Å; A1456-V1554 HydrophobicContact CB-CG2 3.93Å
1457	S	59.2	Low	55.8	Low	64 Å²	64	98.7 Å²	98.7	45%	0.448	48%	0.475	S	S	.	.	H	α-helix	trans	-68	-38.1	173.8	50.1	0	0	0	0	112.2	C1455 Q1459 I1460 A1461	C1455-S1457 PolarHBondContact O-N 3.14Å; S1457-Q1459 VanDerWaalsContact C-N 3.31Å; S1457-Q1459 PolarHBondContact O-N 3.41Å; S1457-I1460 PolarHBondContact O-N 3.4Å; S1457-A1461 WeakPolarHBondContact O-CB 3.04Å; S1457-A1461 PolarHBondContact O-N 2.97Å
1458	V	63.5	Low	58.5	Low	91 Å²	91	95 Å²	95	55%	0.552	45%	0.448	S	S	*	.	H	α-helix	trans	-63.4	-35.1	174.8	172.6	0	0	0	0	111.8	L1454 C1455 R1462	L1454-V1458 VanDerWaalsContact O-CG2 3.27Å; L1454-V1458 WeakPolarHBondContact O-CG2 3.37Å; C1455-V1458 CarbonylContact O-C 3.52Å; C1455-V1458 PolarHBondContact O-N 2.57Å; V1458-R1462 WeakPolarHBondContact O-CB 3.5Å; V1458-R1462 PolarHBondContact O-N 3.19Å
1459	Q	66.3	Low	60.9	Low	95 Å²	95	88.4 Å²	88.4	44%	0.444	43%	0.427	S	S	.	.	H	α-helix	trans	-67.4	-43	174.6	-76.9	170.8	-58.4	0	0	111.8	C1455 A1456 S1457 R1462 R1463	C1455-Q1459 WeakPolarHBondContact O-CB 3.15Å; C1455-Q1459 VanDerWaalsContact O-CG 3.25Å; C1455-Q1459 WeakPolarHBondContact O-CG 3.38Å; C1455-Q1459 PolarHBondContact O-N 2.72Å; C1455-Q1459 PolarHBondContact O-OE1 3.36Å; A1456-Q1459 PolarHBondContact O-N 2.95Å; S1457-Q1459 VanDerWaalsContact C-N 3.31Å; S1457-Q1459 PolarHBondContact O-N 3.41Å; Q1459-R1462 PolarHBondContact O-N 3.15Å; Q1459-R1463 WeakPolarHBondContact O-CG 3.46Å; Q1459-R1463 PolarHBondContact O-N 3.15Å
1460	I	74.7	Confident	63.6	Low	41 Å²	41	90.8 Å²	90.8	21%	0.21	43%	0.432	C	S	.	.	H	α-helix	trans	-62.7	-50.6	175.3	-65.3	165.8	0	0	0	110.3	A1456 S1457 R1462 R1463 I1464 W1479 V1554 V1557	A1456-I1460 WeakPolarHBondContact O-CG1 3.25Å; A1456-I1460 PolarHBondContact O-N 3.09Å; S1457-I1460 PolarHBondContact O-N 3.4Å; I1460-R1462 VanDerWaalsContact C-N 3.29Å; I1460-R1462 PolarHBondContact O-N 3.18Å; I1460-R1463 PolarHBondContact O-N 3.19Å; I1460-R1463 VanDerWaalsContact O-N 3.15Å; I1460-I1464 HydrophobicContact CG2-CD1 3.99Å; I1460-I1464 WeakPolarHBondContact O-CG1 3.26Å; I1460-I1464 PolarHBondContact O-N 2.77Å; I1460-W1479 HydrophobicContact CG2-CH2 4.24Å; I1460-W1479 HydrophobicContact CG2-CZ2 4.39Å; I1460-V1554 HydrophobicContact CD1-CG1 4.03Å; I1460-V1557 HydrophobicContact CD1-CG2 4.05Å; I1460-V1557 HydrophobicContact CG1-CG2 4.15Å; I1460-V1557 HydrophobicContact CG2-CG2 4.06Å
1461	A	75.3	Confident	66.4	Low	60 Å²	60	82.2 Å²	82.2	50%	0.496	41%	0.409	S	S	.	.	H	α-helix	trans	-60.6	-36.9	177.5	0	0	0	0	0	112.7	S1457 K1465	S1457-A1461 WeakPolarHBondContact O-CB 3.04Å; S1457-A1461 PolarHBondContact O-N 2.97Å; A1461-K1465 WeakPolarHBondContact O-CB 3.44Å; A1461-K1465 PolarHBondContact O-N 2.9Å
1462	R	78.3	Confident	69.3	Low	143 Å²	143	78.8 Å²	78.8	54%	0.54	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-44.5	173.6	177.6	-175.9	153.7	-150.5	-20	111.9	V1458 Q1459 I1460 I1464 K1465 E1466	V1458-R1462 WeakPolarHBondContact O-CB 3.5Å; V1458-R1462 PolarHBondContact O-N 3.19Å; Q1459-R1462 PolarHBondContact O-N 3.15Å; I1460-R1462 VanDerWaalsContact C-N 3.29Å; I1460-R1462 PolarHBondContact O-N 3.18Å; R1462-I1464 VanDerWaalsContact C-N 3.35Å; R1462-I1464 PolarHBondContact O-N 3.35Å; R1462-K1465 CarbonylContact O-C 3.49Å; R1462-K1465 PolarHBondContact O-N 3.42Å; R1462-K1465 VanDerWaalsContact O-N 3.16Å; R1462-E1466 HydrophobicContact CG-CG 4.48Å; R1462-E1466 IonicContact CZ-OE1 2.73Å; R1462-E1466 IonicContact NE-OE1 2.69Å; R1462-E1466 PolarHBondContact NE-OE1 3.27Å; R1462-E1466 IonicContact NH2-OE1 2.73Å; R1462-E1466 PolarHBondContact NH2-OE1 3.49Å; R1462-E1466 IonicContact NH2-OE2 3.72Å; R1462-E1466 WeakPolarHBondContact O-CG 3.23Å; R1462-E1466 PolarHBondContact O-N 3.48Å
1463	R	83.2	Confident	72	Confident	37 Å²	37	76 Å²	76	14%	0.14	39%	0.393	C	S	.	.	H	α-helix	trans	-63.8	-38.9	177.8	-75.4	-174.7	179.9	164.4	-0.4	112.5	Q1459 I1460 K1465 E1466 G1467 R1468 W1479 L1480 E1484	Q1459-R1463 WeakPolarHBondContact O-CG 3.46Å; Q1459-R1463 PolarHBondContact O-N 3.15Å; I1460-R1463 PolarHBondContact O-N 3.19Å; I1460-R1463 VanDerWaalsContact O-N 3.15Å; R1463-K1465 VanDerWaalsContact C-N 3.33Å; R1463-K1465 PolarHBondContact O-N 3.48Å; R1463-E1466 CarbonylContact O-C 3.52Å; R1463-E1466 PolarHBondContact O-N 3.42Å; R1463-E1466 VanDerWaalsContact O-N 3.17Å; R1463-G1467 PolarHBondContact O-N 3.4Å; R1463-R1468 HydrophobicContact CB-CB 4.28Å; R1463-R1468 HydrophobicContact CB-CG 4.22Å; R1463-R1468 HydrophobicContact CG-CG 4.5Å; R1463-R1468 WeakPolarHBondContact O-CB 3.4Å; R1463-R1468 WeakPolarHBondContact O-CG 3.37Å; R1463-R1468 PolarHBondContact O-N 3.44Å; R1463-R1468 VanDerWaalsContact O-N 3.07Å; R1463-W1479 HydrophobicContact CB-CE3 4.15Å; R1463-W1479 HydrophobicContact CB-CH2 3.65Å; R1463-W1479 HydrophobicContact CB-CZ2 4.33Å; R1463-W1479 HydrophobicContact CB-CZ3 3.56Å; R1463-W1479 PolarHBondContact NE-O 3.27Å; R1463-L1480 VanDerWaalsContact NH1-CD2 3.28Å; R1463-E1484 IonicContact CZ-OE1 3.22Å; R1463-E1484 IonicContact NE-OE1 2.82Å; R1463-E1484 PolarHBondContact NE-OE1 2.95Å; R1463-E1484 VanDerWaalsContact NE-OE1 3.16Å; R1463-E1484 VanDerWaalsContact NH2-CD 3.32Å; R1463-E1484 IonicContact NH2-OE1 3.48Å; R1463-E1484 PolarHBondContact NH2-OE1 2.7Å; R1463-E1484 IonicContact NH2-OE2 3.65Å
1464	I	82.5	Confident	74.7	Confident	100 Å²	100	73.4 Å²	73.4	51%	0.513	39%	0.387	S	S	.	.	H	α-helix	trans	-61.2	-43.4	172.2	-65.6	165.7	0	0	0	110.2	I1460 R1462 E1466 G1467 W1479	I1460-I1464 HydrophobicContact CG2-CD1 3.99Å; I1460-I1464 WeakPolarHBondContact O-CG1 3.26Å; I1460-I1464 PolarHBondContact O-N 2.77Å; R1462-I1464 VanDerWaalsContact C-N 3.35Å; R1462-I1464 PolarHBondContact O-N 3.35Å; I1464-E1466 VanDerWaalsContact C-N 3.3Å; I1464-E1466 PolarHBondContact O-N 2.73Å; I1464-G1467 PolarHBondContact O-N 3.18Å; I1464-G1467 VanDerWaalsContact O-N 3.12Å; I1464-W1479 HydrophobicContact CG1-CH2 4.17Å; I1464-W1479 HydrophobicContact CG1-CZ3 4.29Å
1465	K	81	Confident	77.4	Confident	192 Å²	192	72.8 Å²	72.8	84%	0.835	39%	0.385	S	S	*	.	H	α-helix	trans	-69.3	-23.1	175	-174.5	168.8	-179.8	172.9	0	114.2	A1461 R1462 R1463 G1467	A1461-K1465 WeakPolarHBondContact O-CB 3.44Å; A1461-K1465 PolarHBondContact O-N 2.9Å; R1462-K1465 CarbonylContact O-C 3.49Å; R1462-K1465 PolarHBondContact O-N 3.42Å; R1462-K1465 VanDerWaalsContact O-N 3.16Å; R1463-K1465 VanDerWaalsContact C-N 3.33Å; R1463-K1465 PolarHBondContact O-N 3.48Å; K1465-G1467 VanDerWaalsContact C-N 3.26Å
1466	E	82.3	Confident	79.8	Confident	70 Å²	70	71.9 Å²	71.9	33%	0.327	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.6	171	-76.2	175.7	-174.3	0	0	113	R1462 R1463 I1464 R1468	R1462-E1466 HydrophobicContact CG-CG 4.48Å; R1462-E1466 IonicContact CZ-OE1 2.73Å; R1462-E1466 IonicContact NE-OE1 2.69Å; R1462-E1466 PolarHBondContact NE-OE1 3.27Å; R1462-E1466 IonicContact NH2-OE1 2.73Å; R1462-E1466 PolarHBondContact NH2-OE1 3.49Å; R1462-E1466 IonicContact NH2-OE2 3.72Å; R1462-E1466 WeakPolarHBondContact O-CG 3.23Å; R1462-E1466 PolarHBondContact O-N 3.48Å; R1463-E1466 CarbonylContact O-C 3.52Å; R1463-E1466 PolarHBondContact O-N 3.42Å; R1463-E1466 VanDerWaalsContact O-N 3.17Å; I1464-E1466 VanDerWaalsContact C-N 3.3Å; I1464-E1466 PolarHBondContact O-N 2.73Å; E1466-R1468 VanDerWaalsContact C-N 3.34Å; E1466-R1468 HydrophobicContact CB-CG 3.95Å; E1466-R1468 IonicContact OE2-CZ 2.68Å; E1466-R1468 VanDerWaalsContact OE2-CZ 3.27Å; E1466-R1468 IonicContact OE2-NE 3.28Å; E1466-R1468 PolarHBondContact OE2-NE 2.96Å; E1466-R1468 IonicContact OE2-NH2 2.69Å; E1466-R1468 PolarHBondContact OE2-NH2 2.76Å
1467	G	85.3	Confident	81.7	Confident	17 Å²	17	74.2 Å²	74.2	18%	0.175	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	19.4	-178.8	0	0	0	0	0	114.2	R1463 I1464 K1465 Q1470	R1463-G1467 PolarHBondContact O-N 3.4Å; I1464-G1467 PolarHBondContact O-N 3.18Å; I1464-G1467 VanDerWaalsContact O-N 3.12Å; K1465-G1467 VanDerWaalsContact C-N 3.26Å; G1467-Q1470 VanDerWaalsContact O-CB 3.29Å; G1467-Q1470 WeakPolarHBondContact O-CB 3.47Å; G1467-Q1470 PolarHBondContact O-N 2.99Å
1468	R	86.3	Confident	83.3	Confident	27 Å²	27	71.6 Å²	71.6	10%	0.102	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	140.2	-175.4	-56.9	-154.6	-169.4	-168.1	6.5	113	R1463 E1466 Q1470 I1477 P1478 W1479 E1484	R1463-R1468 HydrophobicContact CB-CB 4.28Å; R1463-R1468 HydrophobicContact CB-CG 4.22Å; R1463-R1468 HydrophobicContact CG-CG 4.5Å; R1463-R1468 WeakPolarHBondContact O-CB 3.4Å; R1463-R1468 WeakPolarHBondContact O-CG 3.37Å; R1463-R1468 PolarHBondContact O-N 3.44Å; R1463-R1468 VanDerWaalsContact O-N 3.07Å; E1466-R1468 VanDerWaalsContact C-N 3.34Å; E1466-R1468 HydrophobicContact CB-CG 3.95Å; E1466-R1468 IonicContact OE2-CZ 2.68Å; E1466-R1468 VanDerWaalsContact OE2-CZ 3.27Å; E1466-R1468 IonicContact OE2-NE 3.28Å; E1466-R1468 PolarHBondContact OE2-NE 2.96Å; E1466-R1468 IonicContact OE2-NH2 2.69Å; E1466-R1468 PolarHBondContact OE2-NH2 2.76Å; R1468-Q1470 VanDerWaalsContact C-N 3.29Å; R1468-I1477 HydrophobicContact CB-CG2 4.5Å; R1468-I1477 HydrophobicContact CG-CG2 3.9Å; R1468-P1478 WeakPolarHBondContact CD-O 3.44Å; R1468-W1479 HydrophobicContact CB-CE3 3.77Å; R1468-W1479 HydrophobicContact CB-CZ3 4.2Å; R1468-W1479 PolarHBondContact NH1-O 3.43Å; R1468-E1484 IonicContact CZ-OE1 2.95Å; R1468-E1484 IonicContact CZ-OE2 3.87Å; R1468-E1484 IonicContact NH1-OE1 3.5Å; R1468-E1484 PolarHBondContact NH1-OE1 2.9Å; R1468-E1484 IonicContact NH1-OE2 3.65Å; R1468-E1484 PolarHBondContact NH1-OE2 3.36Å; R1468-E1484 IonicContact NH2-OE1 2.74Å; R1468-E1484 PolarHBondContact NH2-OE1 3.36Å; R1468-E1484 IonicContact NH2-OE2 2.6Å
1469	G	84.7	Confident	84.6	Confident	15 Å²	15	67.9 Å²	67.9	16%	0.155	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	9	-169.7	0	0	0	0	0	113.8	I1477	G1469-I1477 PolarHBondContact N-O 3Å
1470	Q	88	Confident	85.6	Confident	116 Å²	116	64.8 Å²	64.8	54%	0.542	33%	0.329	S	S	.	.			trans	-119.6	159.9	-179	-50	179.2	-4.1	0	0	110.2	G1467 R1468 Y1476 I1477	G1467-Q1470 VanDerWaalsContact O-CB 3.29Å; G1467-Q1470 WeakPolarHBondContact O-CB 3.47Å; G1467-Q1470 PolarHBondContact O-N 2.99Å; R1468-Q1470 VanDerWaalsContact C-N 3.29Å; Q1470-Y1476 WeakPolarHBondContact O-CA 3.4Å; Q1470-Y1476 WeakPolarHBondContact O-CD2 3.28Å; Q1470-I1477 PolarHBondContact O-N 2.91Å; Q1470-I1477 VanDerWaalsContact O-N 3.15Å
1471	G	87.6	Confident	86.2	Confident	32 Å²	32	64.1 Å²	64.1	33%	0.33	33%	0.327	S	S	.	.			trans	95.9	176.3	-176.5	0	0	0	0	0	113.6	Y1476	G1471-Y1476 WeakPolarHBondContact O-CD2 3.11Å
1472	H	89.9	Confident	86.6	Confident	109 Å²	109	62.6 Å²	62.6	51%	0.505	31%	0.312	S	S	.	.			trans	-144.6	152	178.5	-79.5	-86	0	0	0	109.8	K1474 D1475 D1525 R1527 D1565	H1472-K1474 PolarHBondContact O-N 2.87Å; H1472-D1475 PolarHBondContact O-N 2.78Å; H1472-D1525 WeakPolarHBondContact CA-OD2 3.16Å; H1472-D1525 IonicContact CG-OD2 2.76Å; H1472-D1525 IonicContact ND1-OD2 3.18Å; H1472-D1525 PolarHBondContact ND1-OD2 3.44Å; H1472-R1527 VanDerWaalsContact CE1-CZ 3.41Å; H1472-R1527 PolarHBondContact ND1-NE 2.94Å; H1472-D1565 IonicContact ND1-OD2 3.89Å
1473	G	87.4	Confident	86.2	Confident	17 Å²	17	63.8 Å²	63.8	18%	0.175	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	51.7	-123.4	-179.5	0	0	0	0	0	111.4	D1475 Y1476 T1499 R1501 D1525	G1473-D1475 PolarHBondContact O-N 3.11Å; G1473-Y1476 PolarHBondContact O-N 2.88Å; G1473-T1499 CarbonylContact C-O 3.55Å; G1473-R1501 WeakPolarHBondContact O-CD 3.37Å; G1473-R1501 PolarHBondContact O-NE 3.16Å; G1473-D1525 VanDerWaalsContact CA-OD1 3.26Å; G1473-D1525 WeakPolarHBondContact CA-OD1 3.49Å; G1473-D1525 PolarHBondContact N-OD1 2.86Å; G1473-D1525 VanDerWaalsContact N-OD1 3.07Å; G1473-D1525 PolarHBondContact N-OD2 3.28Å
1474	K	87.3	Confident	85.5	Confident	144 Å²	144	65.4 Å²	65.4	63%	0.626	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-60.5	-27.7	179	76.3	-174	-176.1	-178.8	0	114.1	H1472 T1499	H1472-K1474 PolarHBondContact O-N 2.87Å; K1474-T1499 WeakPolarHBondContact CA-O 3.29Å; K1474-T1499 WeakPolarHBondContact CB-O 3.41Å; K1474-T1499 PolarHBondContact N-O 3.28Å
1475	D	89.4	Confident	84.7	Confident	106 Å²	106	62.9 Å²	62.9	57%	0.567	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-95.4	-1.3	-169.9	-62.2	-51.9	0	0	0	112.3	H1472 G1473	H1472-D1475 PolarHBondContact O-N 2.78Å; G1473-D1475 PolarHBondContact O-N 3.11Å
1476	Y	93.1	Very high	83.1	Confident	8 Å²	8	59.9 Å²	59.9	3%	0.031	32%	0.322	C	S	.	.			trans	-76.2	137.2	176.8	177	-97	0	0	0	113	Q1470 G1471 G1473 P1478 R1527 E1528 F1530	Q1470-Y1476 WeakPolarHBondContact O-CA 3.4Å; Q1470-Y1476 WeakPolarHBondContact O-CD2 3.28Å; G1471-Y1476 WeakPolarHBondContact O-CD2 3.11Å; G1473-Y1476 PolarHBondContact O-N 2.88Å; Y1476-P1478 HydrophobicContact CE1-CB 3.98Å; Y1476-R1527 HydrophobicContact CD1-CB 4.25Å; Y1476-R1527 HydrophobicContact CD1-CG 4.25Å; Y1476-R1527 HydrophobicContact CD2-CB 4.15Å; Y1476-R1527 HydrophobicContact CD2-CG 3.89Å; Y1476-R1527 HydrophobicContact CE1-CB 4.01Å; Y1476-R1527 HydrophobicContact CE2-CB 3.94Å; Y1476-R1527 HydrophobicContact CE2-CG 4.2Å; Y1476-R1527 HydrophobicContact CG-CB 4.29Å; Y1476-R1527 HydrophobicContact CG-CG 3.91Å; Y1476-E1528 WeakPolarHBondContact CE1-O 3.32Å; Y1476-E1528 PolarHBondContact OH-O 2.9Å; Y1476-F1530 AromaticContact CE2-CD2 3.97Å; Y1476-F1530 HydrophobicContact CE2-CD2 3.97Å; Y1476-F1530 HydrophobicContact CE2-CE2 4.32Å; Y1476-F1530 WeakPolarHBondContact OH-CA 3.39Å
1477	I	90.1	Very high	81.4	Confident	75 Å²	75	59.7 Å²	59.7	39%	0.385	33%	0.328	S	S	.	.			trans	-118.1	114.1	177.3	-52.9	176.2	0	0	0	109.9	R1468 G1469 Q1470	R1468-I1477 HydrophobicContact CB-CG2 4.5Å; R1468-I1477 HydrophobicContact CG-CG2 3.9Å; G1469-I1477 PolarHBondContact N-O 3Å; Q1470-I1477 PolarHBondContact O-N 2.91Å; Q1470-I1477 VanDerWaalsContact O-N 3.15Å
1478	P	92.1	Very high	79.8	Confident	9 Å²	9	63.7 Å²	63.7	6%	0.058	35%	0.354	C	S	.	.			trans	-66.7	150	-176.3	27.7	-36.7	0	0	0	113.3	R1468 Y1476 L1480 T1481 H1504 E1528 Q1529	R1468-P1478 WeakPolarHBondContact CD-O 3.44Å; Y1476-P1478 HydrophobicContact CE1-CB 3.98Å; P1478-L1480 PolarHBondContact O-N 3Å; P1478-T1481 HydrophobicContact CG-CG2 4.5Å; P1478-H1504 HydrophobicContact CG-CB 4.37Å; P1478-E1528 HydrophobicContact CB-CG 4.11Å; P1478-E1528 WeakPolarHBondContact CB-O 3.41Å; P1478-E1528 WeakPolarHBondContact CG-OE1 3.25Å; P1478-Q1529 HydrophobicContact CB-CB 4.48Å
1479	W	91.9	Very high	78.7	Confident	12 Å²	12	64.7 Å²	64.7	5%	0.045	37%	0.372	C	S	.	.	S	Bend	trans	-65.4	-40.5	-178.4	-174.4	-117.1	0	0	0	112.9	I1460 R1463 I1464 R1468 Q1529 P1531 V1557	I1460-W1479 HydrophobicContact CG2-CH2 4.24Å; I1460-W1479 HydrophobicContact CG2-CZ2 4.39Å; R1463-W1479 HydrophobicContact CB-CE3 4.15Å; R1463-W1479 HydrophobicContact CB-CH2 3.65Å; R1463-W1479 HydrophobicContact CB-CZ2 4.33Å; R1463-W1479 HydrophobicContact CB-CZ3 3.56Å; R1463-W1479 PolarHBondContact NE-O 3.27Å; I1464-W1479 HydrophobicContact CG1-CH2 4.17Å; I1464-W1479 HydrophobicContact CG1-CZ3 4.29Å; R1468-W1479 HydrophobicContact CB-CE3 3.77Å; R1468-W1479 HydrophobicContact CB-CZ3 4.2Å; R1468-W1479 PolarHBondContact NH1-O 3.43Å; W1479-Q1529 WeakPolarHBondContact CB-O 3.32Å; W1479-Q1529 PolarHBondContact N-O 2.8Å; W1479-P1531 HydrophobicContact CB-CB 3.96Å; W1479-P1531 HydrophobicContact CB-CG 4.06Å; W1479-P1531 HydrophobicContact CD2-CB 3.82Å; W1479-P1531 HydrophobicContact CD2-CG 4.24Å; W1479-P1531 HydrophobicContact CE3-CB 4.08Å; W1479-P1531 HydrophobicContact CE3-CG 4.07Å; W1479-P1531 HydrophobicContact CG-CB 3.76Å; W1479-P1531 HydrophobicContact CG-CG 4.25Å; W1479-V1557 HydrophobicContact CH2-CG2 4.46Å; W1479-V1557 HydrophobicContact CZ2-CB 3.75Å; W1479-V1557 HydrophobicContact CZ2-CG1 3.82Å; W1479-V1557 HydrophobicContact CZ2-CG2 3.66Å
1480	L	87.7	Confident	78.1	Confident	31 Å²	31	71.7 Å²	71.7	16%	0.162	39%	0.394	C	S	.	.	S	Bend	trans	-113.9	133.3	176.4	-62.6	177	0	0	0	109.6	R1463 P1478 V1485 L1506 Q1529	R1463-L1480 VanDerWaalsContact NH1-CD2 3.28Å; P1478-L1480 PolarHBondContact O-N 3Å; L1480-V1485 HydrophobicContact CB-CG2 4.26Å; L1480-V1485 HydrophobicContact CD1-CG2 4.2Å; L1480-V1485 HydrophobicContact CD2-CG2 4.47Å; L1480-L1506 HydrophobicContact CD1-CD1 4.42Å; L1480-Q1529 HydrophobicContact CB-CB 4.26Å; L1480-Q1529 HydrophobicContact CB-CG 4.35Å
1481	T	87.6	Confident	77.9	Confident	26 Å²	26	68 Å²	68	16%	0.16	38%	0.381	C	S	.	.			trans	-105.3	155	166.1	66.8	0	0	0	0	110.5	P1478 Q1483 E1484	P1478-T1481 HydrophobicContact CG-CG2 4.5Å; T1481-Q1483 PolarHBondContact O-N 3.25Å; T1481-E1484 WeakPolarHBondContact CB-OE2 3.36Å; T1481-E1484 PolarHBondContact N-OE2 2.95Å; T1481-E1484 PolarHBondContact O-N 3.45Å; T1481-E1484 PolarHBondContact OG1-OE2 3.17Å
1482	V	81.9	Confident	77.8	Confident	28 Å²	28	68.5 Å²	68.5	17%	0.17	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-24.3	174	172.6	0	0	0	0	113.8	S1491 H1492 R1493 H1504 L1506	V1482-S1491 WeakPolarHBondContact CG1-OG 3.3Å; V1482-H1492 WeakPolarHBondContact CG2-O 3.45Å; V1482-R1493 HydrophobicContact CB-CG 4.39Å; V1482-R1493 HydrophobicContact CG2-CG 4.11Å; V1482-H1504 HydrophobicContact CG2-CB 4.05Å; V1482-H1504 PolarHBondContact N-ND1 3.37Å; V1482-L1506 HydrophobicContact CG2-CD2 4.33Å
1483	Q	70.4	Confident	77.7	Confident	169 Å²	169	70.5 Å²	70.5	79%	0.79	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-10.2	178.3	-63	-175	5.4	0	0	114.3	T1481	T1481-Q1483 PolarHBondContact O-N 3.25Å
1484	E	68.8	Low	77.7	Confident	70 Å²	70	71 Å²	71	33%	0.327	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-11	-174.7	-67	166.3	101.8	0	0	113.6	R1463 R1468 T1481	R1463-E1484 IonicContact CZ-OE1 3.22Å; R1463-E1484 IonicContact NE-OE1 2.82Å; R1463-E1484 PolarHBondContact NE-OE1 2.95Å; R1463-E1484 VanDerWaalsContact NE-OE1 3.16Å; R1463-E1484 VanDerWaalsContact NH2-CD 3.32Å; R1463-E1484 IonicContact NH2-OE1 3.48Å; R1463-E1484 PolarHBondContact NH2-OE1 2.7Å; R1463-E1484 IonicContact NH2-OE2 3.65Å; R1468-E1484 IonicContact CZ-OE1 2.95Å; R1468-E1484 IonicContact CZ-OE2 3.87Å; R1468-E1484 IonicContact NH1-OE1 3.5Å; R1468-E1484 PolarHBondContact NH1-OE1 2.9Å; R1468-E1484 IonicContact NH1-OE2 3.65Å; R1468-E1484 PolarHBondContact NH1-OE2 3.36Å; R1468-E1484 IonicContact NH2-OE1 2.74Å; R1468-E1484 PolarHBondContact NH2-OE1 3.36Å; R1468-E1484 IonicContact NH2-OE2 2.6Å; T1481-E1484 WeakPolarHBondContact CB-OE2 3.36Å; T1481-E1484 PolarHBondContact N-OE2 2.95Å; T1481-E1484 PolarHBondContact O-N 3.45Å; T1481-E1484 PolarHBondContact OG1-OE2 3.17Å
1485	V	65.7	Low	77.6	Confident	48 Å²	48	70.1 Å²	70.1	29%	0.291	37%	0.369	S	S	.	.	S	Bend	trans	-110.8	119.9	-179.3	-174.5	0	0	0	0	108.9	L1480 S1487 L1506	L1480-V1485 HydrophobicContact CB-CG2 4.26Å; L1480-V1485 HydrophobicContact CD1-CG2 4.2Å; L1480-V1485 HydrophobicContact CD2-CG2 4.47Å; V1485-S1487 PolarHBondContact O-N 3.22Å; V1485-L1506 HydrophobicContact CB-CD2 4.16Å; V1485-L1506 HydrophobicContact CG1-CD1 4.49Å; V1485-L1506 HydrophobicContact CG2-CD1 4.03Å; V1485-L1506 HydrophobicContact CG2-CD2 4Å
1486	P	47.3	Very low	77.5	Confident	129 Å²	129	65 Å²	65	84%	0.838	34%	0.342	S	S	*	.			trans	-75.1	96	178.3	30	-33.2	0	0	0	110.2
1487	S	47.5	Very low	76.9	Confident	65 Å²	65	69.1 Å²	69.1	46%	0.455	36%	0.361	S	S	.	.			trans	-71.3	138	-178	74.1	0	0	0	0	112.5	V1485 G1489	V1485-S1487 PolarHBondContact O-N 3.22Å; S1487-G1489 WeakPolarHBondContact CB-O 3.39Å; S1487-G1489 PolarHBondContact OG-O 3.37Å
1488	S	51.3	Low	76.6	Confident	102 Å²	102	69 Å²	69	71%	0.713	36%	0.358	S	S	*	.	S	Bend	trans	-89.1	-17.3	163.4	46.6	0	0	0	0	112.5
1489	G	62.2	Low	76.4	Confident	47 Å²	47	68.9 Å²	68.9	49%	0.485	36%	0.357	S	S	.	.	S	Bend	trans	-117	-167.6	176.1	0	0	0	0	0	113.3	S1487	S1487-G1489 WeakPolarHBondContact CB-O 3.39Å; S1487-G1489 PolarHBondContact OG-O 3.37Å
1490	R	73.7	Confident	76	Confident	163 Å²	163	70 Å²	70	62%	0.615	37%	0.372	S	S	*	.			trans	-70.1	150.8	168.8	-71.3	-174.2	-66.6	-164.6	-2.3	110.4	S1507 D1508	R1490-S1507 WeakPolarHBondContact O-CA 3.45Å; R1490-D1508 VanDerWaalsContact CB-OD1 3.26Å; R1490-D1508 WeakPolarHBondContact CB-OD1 3.37Å; R1490-D1508 IonicContact CZ-OD1 2.68Å; R1490-D1508 IonicContact CZ-OD2 2.75Å; R1490-D1508 VanDerWaalsContact CZ-OD2 3.22Å; R1490-D1508 VanDerWaalsContact NE-CG 3.26Å; R1490-D1508 IonicContact NE-OD1 3.73Å; R1490-D1508 PolarHBondContact NE-OD1 3.47Å; R1490-D1508 IonicContact NE-OD2 3.53Å; R1490-D1508 PolarHBondContact NE-OD2 3.45Å; R1490-D1508 VanDerWaalsContact NH2-CG 3.27Å; R1490-D1508 IonicContact NH2-OD1 2.75Å; R1490-D1508 IonicContact NH2-OD2 2.71Å; R1490-D1508 PolarHBondContact NH2-OD2 2.97Å
1491	S	82.9	Confident	76.2	Confident	38 Å²	38	69.5 Å²	69.5	27%	0.266	37%	0.368	S	S	.	.			trans	-146.9	145.6	177	49.7	0	0	0	0	108.4	V1482 L1505	V1482-S1491 WeakPolarHBondContact CG1-OG 3.3Å; S1491-L1505 CarbonylContact C-O 3.54Å; S1491-L1505 WeakPolarHBondContact CA-O 3.45Å; S1491-L1505 WeakPolarHBondContact CB-O 3.38Å
1492	H	85.8	Confident	76.3	Confident	43 Å²	43	70.8 Å²	70.8	20%	0.199	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	150.6	-159.5	-60.9	-74.2	0	0	0	112.9	V1482 L1505 D1508	V1482-H1492 WeakPolarHBondContact CG2-O 3.45Å; H1492-L1505 HydrophobicContact CB-CB 4.28Å; H1492-L1505 PolarHBondContact N-O 3.07Å; H1492-L1505 PolarHBondContact O-N 3.36Å; H1492-D1508 IonicContact CD2-OD1 3.39Å; H1492-D1508 IonicContact CE1-OD1 3.44Å; H1492-D1508 IonicContact NE2-OD1 2.71Å; H1492-D1508 PolarHBondContact NE2-OD1 3.1Å
1493	R	88.4	Confident	76.8	Confident	150 Å²	150	69.5 Å²	69.5	57%	0.566	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	94.2	174.3	-73.2	-174.6	65.4	-127.3	-3.1	108.6	V1482 V1502 H1503 H1504	V1482-R1493 HydrophobicContact CB-CG 4.39Å; V1482-R1493 HydrophobicContact CG2-CG 4.11Å; R1493-V1502 HydrophobicContact CB-CG1 3.95Å; R1493-H1503 WeakPolarHBondContact CA-O 3.22Å; R1493-H1504 PolarHBondContact NE-CE1 2.83Å; R1493-H1504 VanDerWaalsContact NE-CE1 3.28Å
1494	I	86.4	Confident	77.8	Confident	28 Å²	28	62.7 Å²	62.7	14%	0.144	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.8	-167.7	-168.1	163.1	0	0	0	110.1	V1502 H1503 L1505 L1511 F1514 L1515 Y1627	I1494-V1502 CarbonylContact O-C 3.57Å; I1494-V1502 VanDerWaalsContact O-CA 3.31Å; I1494-V1502 WeakPolarHBondContact O-CA 3.4Å; I1494-H1503 HydrophobicContact CG2-CB 4.14Å; I1494-H1503 PolarHBondContact N-O 3.03Å; I1494-H1503 PolarHBondContact O-N 3.36Å; I1494-L1505 HydrophobicContact CG2-CD1 3.9Å; I1494-L1505 HydrophobicContact CG2-CG 4.48Å; I1494-L1511 HydrophobicContact CD1-CD1 3.62Å; I1494-F1514 HydrophobicContact CB-CE1 4.4Å; I1494-F1514 HydrophobicContact CD1-CD1 4.34Å; I1494-F1514 HydrophobicContact CD1-CE1 3.98Å; I1494-F1514 HydrophobicContact CG1-CE1 4.11Å; I1494-F1514 HydrophobicContact CG2-CD1 3.75Å; I1494-F1514 HydrophobicContact CG2-CE1 3.45Å; I1494-F1514 VanDerWaalsContact CG2-CE1 3.45Å; I1494-F1514 HydrophobicContact CG2-CG 4.49Å; I1494-F1514 HydrophobicContact CG2-CZ 3.96Å; I1494-L1515 HydrophobicContact CD1-CD2 3.93Å; I1494-Y1627 HydrophobicContact CD1-CD1 4.12Å; I1494-Y1627 HydrophobicContact CD1-CE1 3.6Å; I1494-Y1627 HydrophobicContact CD1-CE2 4.31Å; I1494-Y1627 HydrophobicContact CG1-CD1 4.38Å; I1494-Y1627 HydrophobicContact CG1-CE1 3.5Å; I1494-Y1627 VanDerWaalsContact CG1-CE1 3.5Å
1495	Y	86	Confident	78.9	Confident	125 Å²	125	59.3 Å²	59.3	49%	0.49	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	108.2	-175	176.3	-90.9	0	0	0	110.4	H1497 V1502 Y1627	Y1495-H1497 PolarHBondContact O-CD2 2.93Å; Y1495-H1497 PolarHBondContact O-N 2.86Å; Y1495-V1502 HydrophobicContact CD2-CG2 4.25Å; Y1495-Y1627 PolarHBondContact O-OH 2.83Å
1496	S	86.7	Confident	80	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.315	C	S	.	.			trans	-70.2	127.8	177	168.1	0	0	0	0	110.6	T1499 G1500 R1501 H1503 E1518	S1496-T1499 WeakPolarHBondContact CB-OG1 3.26Å; S1496-T1499 PolarHBondContact OG-N 2.95Å; S1496-T1499 PolarHBondContact OG-OG1 2.84Å; S1496-G1500 WeakPolarHBondContact O-CA 3.45Å; S1496-G1500 PolarHBondContact O-N 3.3Å; S1496-R1501 PolarHBondContact N-O 3.1Å; S1496-H1503 WeakPolarHBondContact CB-CD2 3.42Å; S1496-H1503 WeakPolarHBondContact CB-NE2 3.38Å; S1496-E1518 WeakPolarHBondContact CB-OE2 3.46Å; S1496-E1518 VanDerWaalsContact OG-CD 3.3Å; S1496-E1518 PolarHBondContact OG-OE1 3.28Å; S1496-E1518 PolarHBondContact OG-OE2 3.16Å
1497	H	79.9	Confident	81.9	Confident	93 Å²	93	54.2 Å²	54.2	43%	0.431	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-37.8	173.8	-65.4	-106	0	0	0	110.8	Y1495 E1518	Y1495-H1497 PolarHBondContact O-CD2 2.93Å; Y1495-H1497 PolarHBondContact O-N 2.86Å; H1497-E1518 WeakPolarHBondContact CA-OE1 3.1Å; H1497-E1518 WeakPolarHBondContact CB-OE1 3.37Å; H1497-E1518 PolarHBondContact N-OE1 3.44Å
1498	K	83.7	Confident	83.7	Confident	72 Å²	72	53.2 Å²	53.2	31%	0.313	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-53	173	-75.7	-178.3	177.1	-78.8	0	112.4	L1517 E1518 E1520 V1523	K1498-L1517 VanDerWaalsContact CE-O 3.31Å; K1498-L1517 WeakPolarHBondContact CE-O 3.33Å; K1498-E1518 WeakPolarHBondContact CE-O 3.23Å; K1498-E1518 PolarHBondContact N-OE1 3.41Å; K1498-E1520 VanDerWaalsContact CE-O 3.23Å; K1498-E1520 WeakPolarHBondContact CE-O 3.11Å; K1498-E1520 PolarHBondContact NZ-O 3.45Å; K1498-V1523 HydrophobicContact CD-CG1 4.26Å; K1498-V1523 PolarHBondContact NZ-O 2.96Å
1499	T	88	Confident	85.4	Confident	8 Å²	8	49.7 Å²	49.7	5%	0.049	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-13.3	-172.2	64	0	0	0	0	113.9	G1473 K1474 S1496 R1501 H1503 D1525 I1526	G1473-T1499 CarbonylContact C-O 3.55Å; K1474-T1499 WeakPolarHBondContact CA-O 3.29Å; K1474-T1499 WeakPolarHBondContact CB-O 3.41Å; K1474-T1499 PolarHBondContact N-O 3.28Å; S1496-T1499 WeakPolarHBondContact CB-OG1 3.26Å; S1496-T1499 PolarHBondContact OG-N 2.95Å; S1496-T1499 PolarHBondContact OG-OG1 2.84Å; T1499-R1501 VanDerWaalsContact C-N 3.32Å; T1499-R1501 PolarHBondContact O-N 2.89Å; T1499-H1503 PolarHBondContact OG1-NE2 3.06Å; T1499-D1525 WeakPolarHBondContact CG2-OD1 3.01Å; T1499-I1526 HydrophobicContact CG2-CB 4.46Å
1500	G	83.9	Confident	86.8	Confident	34 Å²	34	48 Å²	48	35%	0.351	23%	0.229	S	C	.	.	S	Bend	trans	71	21.4	176.3	0	0	0	0	0	115	S1496	S1496-G1500 WeakPolarHBondContact O-CA 3.45Å; S1496-G1500 PolarHBondContact O-N 3.3Å
1501	R	91.9	Very high	87.5	Confident	21 Å²	21	40.8 Å²	40.8	8%	0.079	20%	0.203	C	C	.	.	S	Bend	trans	-140.1	167.8	-177.9	63.6	168.3	-176.3	92.1	4.3	112.7	G1473 S1496 T1499 H1503 I1526 E1528	G1473-R1501 WeakPolarHBondContact O-CD 3.37Å; G1473-R1501 PolarHBondContact O-NE 3.16Å; S1496-R1501 PolarHBondContact N-O 3.1Å; T1499-R1501 VanDerWaalsContact C-N 3.32Å; T1499-R1501 PolarHBondContact O-N 2.89Å; R1501-H1503 PolarHBondContact NH2-CE1 3.38Å; R1501-H1503 PolarHBondContact NH2-NE2 2.97Å; R1501-I1526 PolarHBondContact NH2-O 3.17Å; R1501-E1528 IonicContact CZ-OE2 3.28Å; R1501-E1528 VanDerWaalsContact NH1-CD 3.31Å; R1501-E1528 IonicContact NH1-OE1 2.72Å; R1501-E1528 PolarHBondContact NH1-OE1 2.99Å; R1501-E1528 IonicContact NH1-OE2 2.74Å; R1501-E1528 PolarHBondContact NH1-OE2 3.23Å; R1501-E1528 IonicContact NH2-OE2 2.9Å; R1501-E1528 PolarHBondContact NH2-OE2 3.15Å
1502	V	89	Confident	87.6	Confident	54 Å²	54	39.1 Å²	39.1	33%	0.327	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	123.4	174.5	179.9	0	0	0	0	110.2	R1493 I1494 Y1495	R1493-V1502 HydrophobicContact CB-CG1 3.95Å; I1494-V1502 CarbonylContact O-C 3.57Å; I1494-V1502 VanDerWaalsContact O-CA 3.31Å; I1494-V1502 WeakPolarHBondContact O-CA 3.4Å; Y1495-V1502 HydrophobicContact CD2-CG2 4.25Å
1503	H	92.7	Very high	87.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	147	173.2	-77.3	-113.7	0	0	0	111.5	R1493 I1494 S1496 T1499 R1501 L1505 F1514 I1526 E1528	R1493-H1503 WeakPolarHBondContact CA-O 3.22Å; I1494-H1503 HydrophobicContact CG2-CB 4.14Å; I1494-H1503 PolarHBondContact N-O 3.03Å; I1494-H1503 PolarHBondContact O-N 3.36Å; S1496-H1503 WeakPolarHBondContact CB-CD2 3.42Å; S1496-H1503 WeakPolarHBondContact CB-NE2 3.38Å; T1499-H1503 PolarHBondContact OG1-NE2 3.06Å; R1501-H1503 PolarHBondContact NH2-CE1 3.38Å; R1501-H1503 PolarHBondContact NH2-NE2 2.97Å; H1503-L1505 HydrophobicContact CB-CD2 4.21Å; H1503-L1505 HydrophobicContact CB-CG 4.47Å; H1503-F1514 HydrophobicContact CB-CD2 4.48Å; H1503-F1514 HydrophobicContact CB-CE2 4.16Å; H1503-F1514 AromaticContact CD2-CE2 3.86Å; H1503-F1514 AromaticContact CE1-CE2 3.85Å; H1503-F1514 AromaticContact CG-CE2 3.61Å; H1503-F1514 AromaticContact ND1-CD2 3.89Å; H1503-F1514 AromaticContact ND1-CE2 3.64Å; H1503-F1514 AromaticContact NE2-CE2 4Å; H1503-I1526 PolarHBondContact CE1-O 3.17Å; H1503-I1526 VanDerWaalsContact CE1-O 3.28Å; H1503-E1528 VanDerWaalsContact CA-OE1 3.27Å; H1503-E1528 WeakPolarHBondContact CA-OE1 3.33Å; H1503-E1528 IonicContact CE1-OE2 2.72Å; H1503-E1528 IonicContact ND1-OE2 3.22Å
1504	H	92.4	Very high	87.8	Confident	26 Å²	26	30.1 Å²	30.1	12%	0.12	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	92.7	-177.6	-82.1	-86.4	0	0	0	112.3	P1478 V1482 R1493 E1528	P1478-H1504 HydrophobicContact CG-CB 4.37Å; V1482-H1504 HydrophobicContact CG2-CB 4.05Å; V1482-H1504 PolarHBondContact N-ND1 3.37Å; R1493-H1504 PolarHBondContact NE-CE1 2.83Å; R1493-H1504 VanDerWaalsContact NE-CE1 3.28Å; H1504-E1528 PolarHBondContact N-OE1 3.12Å
1505	L	92.2	Very high	87.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.5	-172.8	-46.1	-178.9	0	0	0	110.7	S1491 H1492 I1494 H1503 E1510 L1511 F1514 E1528 F1562	S1491-L1505 CarbonylContact C-O 3.54Å; S1491-L1505 WeakPolarHBondContact CA-O 3.45Å; S1491-L1505 WeakPolarHBondContact CB-O 3.38Å; H1492-L1505 HydrophobicContact CB-CB 4.28Å; H1492-L1505 PolarHBondContact N-O 3.07Å; H1492-L1505 PolarHBondContact O-N 3.36Å; I1494-L1505 HydrophobicContact CG2-CD1 3.9Å; I1494-L1505 HydrophobicContact CG2-CG 4.48Å; H1503-L1505 HydrophobicContact CB-CD2 4.21Å; H1503-L1505 HydrophobicContact CB-CG 4.47Å; L1505-E1510 HydrophobicContact CB-CB 4.05Å; L1505-L1511 HydrophobicContact CD1-CB 4.31Å; L1505-L1511 HydrophobicContact CD1-CD1 4.16Å; L1505-F1514 HydrophobicContact CD1-CB 3.58Å; L1505-F1514 HydrophobicContact CD1-CD1 4.02Å; L1505-F1514 HydrophobicContact CD1-CG 3.76Å; L1505-F1514 HydrophobicContact CD2-CB 4.44Å; L1505-E1528 HydrophobicContact CD2-CB 4.35Å; L1505-E1528 HydrophobicContact CD2-CG 4.38Å; L1505-F1562 HydrophobicContact CD2-CE1 3.72Å; L1505-F1562 HydrophobicContact CD2-CZ 3.79Å
1506	L	88.3	Confident	87.4	Confident	34 Å²	34	23.8 Å²	23.8	18%	0.178	13%	0.132	C	C	.	.			trans	-95.1	-8.1	-168.8	-54.5	-179.8	0	0	0	114	L1480 V1482 V1485 E1510 Q1529	L1480-L1506 HydrophobicContact CD1-CD1 4.42Å; V1482-L1506 HydrophobicContact CG2-CD2 4.33Å; V1485-L1506 HydrophobicContact CB-CD2 4.16Å; V1485-L1506 HydrophobicContact CG1-CD1 4.49Å; V1485-L1506 HydrophobicContact CG2-CD1 4.03Å; V1485-L1506 HydrophobicContact CG2-CD2 4Å; L1506-E1510 WeakPolarHBondContact CB-OE1 3.24Å; L1506-E1510 WeakPolarHBondContact CB-OE2 3.45Å; L1506-E1510 PolarHBondContact N-OE1 2.97Å; L1506-E1510 PolarHBondContact N-OE2 3.3Å; L1506-Q1529 HydrophobicContact CD1-CG 4.24Å
1507	S	87.5	Confident	87.4	Confident	35 Å²	35	23.8 Å²	23.8	25%	0.245	13%	0.132	C	C	.	.	S	Bend	trans	-148.9	165.3	-179.4	67.5	0	0	0	0	114	R1490 L1509 E1510 L1511	R1490-S1507 WeakPolarHBondContact O-CA 3.45Å; S1507-L1509 PolarHBondContact O-N 3.44Å; S1507-E1510 VanDerWaalsContact CB-OE1 3.22Å; S1507-E1510 WeakPolarHBondContact CB-OE1 3.06Å; S1507-E1510 PolarHBondContact N-OE1 3.19Å; S1507-E1510 WeakPolarHBondContact OG-CG 3.34Å; S1507-E1510 PolarHBondContact OG-N 2.98Å; S1507-E1510 VanDerWaalsContact OG-N 3.14Å; S1507-E1510 PolarHBondContact OG-OE1 2.66Å; S1507-L1511 PolarHBondContact O-N 3.32Å
1508	D	85.6	Confident	87.5	Confident	45 Å²	45	19.9 Å²	19.9	24%	0.241	11%	0.114	C	C	.	.	H	α-helix	trans	-66.4	-18.1	172	-70.4	-33.4	0	0	0	113.9	R1490 H1492 K1620	R1490-D1508 VanDerWaalsContact CB-OD1 3.26Å; R1490-D1508 WeakPolarHBondContact CB-OD1 3.37Å; R1490-D1508 IonicContact CZ-OD1 2.68Å; R1490-D1508 IonicContact CZ-OD2 2.75Å; R1490-D1508 VanDerWaalsContact CZ-OD2 3.22Å; R1490-D1508 VanDerWaalsContact NE-CG 3.26Å; R1490-D1508 IonicContact NE-OD1 3.73Å; R1490-D1508 PolarHBondContact NE-OD1 3.47Å; R1490-D1508 IonicContact NE-OD2 3.53Å; R1490-D1508 PolarHBondContact NE-OD2 3.45Å; R1490-D1508 VanDerWaalsContact NH2-CG 3.27Å; R1490-D1508 IonicContact NH2-OD1 2.75Å; R1490-D1508 IonicContact NH2-OD2 2.71Å; R1490-D1508 PolarHBondContact NH2-OD2 2.97Å; H1492-D1508 IonicContact CD2-OD1 3.39Å; H1492-D1508 IonicContact CE1-OD1 3.44Å; H1492-D1508 IonicContact NE2-OD1 2.71Å; H1492-D1508 PolarHBondContact NE2-OD1 3.1Å; D1508-K1620 PolarHBondContact O-NZ 3.4Å
1509	L	86.6	Confident	87.1	Confident	28 Å²	28	18.6 Å²	18.6	15%	0.147	11%	0.108	C	C	.	.	H	α-helix	trans	-86.4	-41.8	179.2	-168.1	68.1	0	0	0	110.5	S1507 L1511 A1512 V1513 V1578 P1580 D1612 I1615	S1507-L1509 PolarHBondContact O-N 3.44Å; L1509-L1511 VanDerWaalsContact C-N 3.26Å; L1509-L1511 PolarHBondContact O-N 3.45Å; L1509-A1512 PolarHBondContact O-N 3.23Å; L1509-A1512 VanDerWaalsContact O-N 3.11Å; L1509-V1513 PolarHBondContact O-N 3.17Å; L1509-V1513 VanDerWaalsContact O-N 3.07Å; L1509-V1578 HydrophobicContact CB-CG1 3.95Å; L1509-V1578 HydrophobicContact CD2-CG1 3.63Å; L1509-V1578 HydrophobicContact CG-CG1 3.53Å; L1509-P1580 HydrophobicContact CD2-CG 4.34Å; L1509-D1612 HydrophobicContact CD1-CB 4.2Å; L1509-I1615 HydrophobicContact CD1-CD1 3.72Å; L1509-I1615 HydrophobicContact CG-CD1 4.42Å
1510	E	91.1	Very high	86.5	Confident	10 Å²	10	19 Å²	19	5%	0.047	11%	0.109	C	C	.	.	H	α-helix	trans	-58.3	-38	169.1	-74.9	156.7	-96.5	0	0	111.8	L1505 L1506 S1507 A1512 V1513 F1514 Q1529 D1561 F1562 V1578	L1505-E1510 HydrophobicContact CB-CB 4.05Å; L1506-E1510 WeakPolarHBondContact CB-OE1 3.24Å; L1506-E1510 WeakPolarHBondContact CB-OE2 3.45Å; L1506-E1510 PolarHBondContact N-OE1 2.97Å; L1506-E1510 PolarHBondContact N-OE2 3.3Å; S1507-E1510 VanDerWaalsContact CB-OE1 3.22Å; S1507-E1510 WeakPolarHBondContact CB-OE1 3.06Å; S1507-E1510 PolarHBondContact N-OE1 3.19Å; S1507-E1510 WeakPolarHBondContact OG-CG 3.34Å; S1507-E1510 PolarHBondContact OG-N 2.98Å; S1507-E1510 VanDerWaalsContact OG-N 3.14Å; S1507-E1510 PolarHBondContact OG-OE1 2.66Å; E1510-A1512 VanDerWaalsContact C-N 3.33Å; E1510-A1512 PolarHBondContact O-N 3.47Å; E1510-V1513 PolarHBondContact O-N 3.01Å; E1510-F1514 VanDerWaalsContact O-CB 3.26Å; E1510-F1514 WeakPolarHBondContact O-CB 3.44Å; E1510-F1514 PolarHBondContact O-N 3.42Å; E1510-Q1529 PolarHBondContact OE2-NE2 3.02Å; E1510-D1561 HydrophobicContact CG-CB 4.48Å; E1510-F1562 HydrophobicContact CB-CE2 4.29Å; E1510-F1562 HydrophobicContact CB-CZ 4.21Å; E1510-F1562 HydrophobicContact CG-CE2 4.37Å; E1510-F1562 WeakPolarHBondContact O-CZ 3.35Å; E1510-V1578 HydrophobicContact CG-CB 4.05Å; E1510-V1578 HydrophobicContact CG-CG1 4.14Å; E1510-V1578 HydrophobicContact CG-CG2 4.43Å
1511	L	89.4	Confident	86	Confident	12 Å²	12	22.6 Å²	22.6	6%	0.063	13%	0.129	C	C	.	.	H	α-helix	trans	-57.8	-45.2	173	176.9	61.5	0	0	0	112	I1494 L1505 S1507 L1509 F1514 L1515 E1624	I1494-L1511 HydrophobicContact CD1-CD1 3.62Å; L1505-L1511 HydrophobicContact CD1-CB 4.31Å; L1505-L1511 HydrophobicContact CD1-CD1 4.16Å; S1507-L1511 PolarHBondContact O-N 3.32Å; L1509-L1511 VanDerWaalsContact C-N 3.26Å; L1509-L1511 PolarHBondContact O-N 3.45Å; L1511-F1514 PolarHBondContact O-N 3.42Å; L1511-L1515 HydrophobicContact CD1-CD1 3.93Å; L1511-L1515 HydrophobicContact CD1-CG 4.01Å; L1511-L1515 HydrophobicContact CG-CD1 3.96Å; L1511-L1515 HydrophobicContact CG-CG 4.43Å; L1511-L1515 WeakPolarHBondContact O-CB 3.29Å; L1511-L1515 VanDerWaalsContact O-CG 3.24Å; L1511-L1515 WeakPolarHBondContact O-CG 3.31Å; L1511-L1515 PolarHBondContact O-N 2.9Å; L1511-E1624 VanDerWaalsContact CD2-OE1 3.28Å; L1511-E1624 WeakPolarHBondContact CD2-OE1 3.48Å
1512	A	84.7	Confident	85.3	Confident	4 Å²	4	22.9 Å²	22.9	3%	0.033	13%	0.134	C	C	.	.	H	α-helix	trans	-68.9	-38.6	-177.8	0	0	0	0	0	112.8	L1509 E1510 S1516 I1615 K1620	L1509-A1512 PolarHBondContact O-N 3.23Å; L1509-A1512 VanDerWaalsContact O-N 3.11Å; E1510-A1512 VanDerWaalsContact C-N 3.33Å; E1510-A1512 PolarHBondContact O-N 3.47Å; A1512-S1516 PolarHBondContact O-N 2.93Å; A1512-S1516 PolarHBondContact O-OG 2.98Å; A1512-I1615 HydrophobicContact CB-CD1 3.73Å; A1512-I1615 HydrophobicContact CB-CG2 3.95Å; A1512-K1620 HydrophobicContact CB-CD 3.69Å; A1512-K1620 HydrophobicContact CB-CG 3.93Å
1513	V	86.6	Confident	85.2	Confident	3 Å²	3	20.5 Å²	20.5	2%	0.018	12%	0.12	C	C	.	.	H	α-helix	trans	-65.1	-46.1	172.4	176.8	0	0	0	0	111	L1509 E1510 L1515 S1516 L1517 F1562 I1576 V1578 F1610 I1615	L1509-V1513 PolarHBondContact O-N 3.17Å; L1509-V1513 VanDerWaalsContact O-N 3.07Å; E1510-V1513 PolarHBondContact O-N 3.01Å; V1513-L1515 VanDerWaalsContact C-N 3.34Å; V1513-L1515 PolarHBondContact O-N 3.29Å; V1513-S1516 PolarHBondContact O-N 3.44Å; V1513-L1517 HydrophobicContact CG1-CD1 4.04Å; V1513-L1517 WeakPolarHBondContact O-CG 3.24Å; V1513-L1517 PolarHBondContact O-N 3.26Å; V1513-F1562 HydrophobicContact CB-CE2 4Å; V1513-F1562 HydrophobicContact CG1-CD2 3.93Å; V1513-F1562 HydrophobicContact CG1-CE2 3.8Å; V1513-I1576 HydrophobicContact CG1-CD1 4.33Å; V1513-I1576 HydrophobicContact CG1-CG2 4.23Å; V1513-V1578 HydrophobicContact CB-CG2 4.22Å; V1513-V1578 HydrophobicContact CG1-CG2 4.22Å; V1513-V1578 HydrophobicContact CG2-CG1 4.14Å; V1513-V1578 HydrophobicContact CG2-CG2 3.88Å; V1513-F1610 HydrophobicContact CG2-CB 4.08Å; V1513-F1610 HydrophobicContact CG2-CD1 4.14Å; V1513-F1610 HydrophobicContact CG2-CG 4.38Å; V1513-I1615 HydrophobicContact CG2-CD1 3.61Å
1514	F	90.6	Very high	84.9	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-57.3	-45.5	175.8	167.5	-95.1	0	0	0	111.9	I1494 H1503 L1505 E1510 L1511 S1516 L1517 E1518 I1526 F1562	I1494-F1514 HydrophobicContact CB-CE1 4.4Å; I1494-F1514 HydrophobicContact CD1-CD1 4.34Å; I1494-F1514 HydrophobicContact CD1-CE1 3.98Å; I1494-F1514 HydrophobicContact CG1-CE1 4.11Å; I1494-F1514 HydrophobicContact CG2-CD1 3.75Å; I1494-F1514 HydrophobicContact CG2-CE1 3.45Å; I1494-F1514 VanDerWaalsContact CG2-CE1 3.45Å; I1494-F1514 HydrophobicContact CG2-CG 4.49Å; I1494-F1514 HydrophobicContact CG2-CZ 3.96Å; H1503-F1514 HydrophobicContact CB-CD2 4.48Å; H1503-F1514 HydrophobicContact CB-CE2 4.16Å; H1503-F1514 AromaticContact CD2-CE2 3.86Å; H1503-F1514 AromaticContact CE1-CE2 3.85Å; H1503-F1514 AromaticContact CG-CE2 3.61Å; H1503-F1514 AromaticContact ND1-CD2 3.89Å; H1503-F1514 AromaticContact ND1-CE2 3.64Å; H1503-F1514 AromaticContact NE2-CE2 4Å; L1505-F1514 HydrophobicContact CD1-CB 3.58Å; L1505-F1514 HydrophobicContact CD1-CD1 4.02Å; L1505-F1514 HydrophobicContact CD1-CG 3.76Å; L1505-F1514 HydrophobicContact CD2-CB 4.44Å; E1510-F1514 VanDerWaalsContact O-CB 3.26Å; E1510-F1514 WeakPolarHBondContact O-CB 3.44Å; E1510-F1514 PolarHBondContact O-N 3.42Å; L1511-F1514 PolarHBondContact O-N 3.42Å; F1514-S1516 VanDerWaalsContact C-N 3.3Å; F1514-S1516 PolarHBondContact O-N 3.46Å; F1514-L1517 PolarHBondContact O-N 2.76Å; F1514-L1517 VanDerWaalsContact O-N 3.14Å; F1514-E1518 HydrophobicContact CE1-CB 4.13Å; F1514-E1518 HydrophobicContact CE1-CG 4.22Å; F1514-E1518 HydrophobicContact CE2-CB 4.43Å; F1514-E1518 HydrophobicContact CZ-CB 4.02Å; F1514-E1518 HydrophobicContact CZ-CG 3.96Å; F1514-E1518 WeakPolarHBondContact CZ-OE2 3.22Å; F1514-E1518 VanDerWaalsContact O-CB 3.29Å; F1514-E1518 WeakPolarHBondContact O-CB 3.43Å; F1514-E1518 PolarHBondContact O-N 3.19Å; F1514-I1526 HydrophobicContact CD2-CG2 4.46Å; F1514-I1526 HydrophobicContact CE2-CD1 4.35Å; F1514-F1562 HydrophobicContact CB-CE1 4.07Å; F1514-F1562 HydrophobicContact CB-CZ 3.83Å; F1514-F1562 HydrophobicContact CD2-CE1 4.41Å
1515	L	85.1	Confident	84.9	Confident	3 Å²	3	24.7 Å²	24.7	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-33.8	-179.6	-74.5	173.9	0	0	0	112.8	I1494 L1511 V1513 W1519 I1623 E1624 Y1627	I1494-L1515 HydrophobicContact CD1-CD2 3.93Å; L1511-L1515 HydrophobicContact CD1-CD1 3.93Å; L1511-L1515 HydrophobicContact CD1-CG 4.01Å; L1511-L1515 HydrophobicContact CG-CD1 3.96Å; L1511-L1515 HydrophobicContact CG-CG 4.43Å; L1511-L1515 WeakPolarHBondContact O-CB 3.29Å; L1511-L1515 VanDerWaalsContact O-CG 3.24Å; L1511-L1515 WeakPolarHBondContact O-CG 3.31Å; L1511-L1515 PolarHBondContact O-N 2.9Å; V1513-L1515 VanDerWaalsContact C-N 3.34Å; V1513-L1515 PolarHBondContact O-N 3.29Å; L1515-W1519 PolarHBondContact O-N 3.32Å; L1515-I1623 HydrophobicContact CB-CG2 3.83Å; L1515-I1623 HydrophobicContact CD2-CG2 4.12Å; L1515-I1623 HydrophobicContact CG-CG2 4.37Å; L1515-E1624 HydrophobicContact CD1-CG 3.37Å; L1515-Y1627 HydrophobicContact CD2-CD2 3.39Å; L1515-Y1627 HydrophobicContact CD2-CE2 3.44Å; L1515-Y1627 VanDerWaalsContact CD2-CE2 3.44Å; L1515-Y1627 HydrophobicContact CD2-CG 4.15Å
1516	S	80.2	Confident	85	Confident	18 Å²	18	24.7 Å²	24.7	13%	0.126	14%	0.142	C	C	.	.	H	α-helix	trans	-67	-43.5	171.6	-61.3	0	0	0	0	111.9	A1512 V1513 F1514 E1520	A1512-S1516 PolarHBondContact O-N 2.93Å; A1512-S1516 PolarHBondContact O-OG 2.98Å; V1513-S1516 PolarHBondContact O-N 3.44Å; F1514-S1516 VanDerWaalsContact C-N 3.3Å; F1514-S1516 PolarHBondContact O-N 3.46Å; S1516-E1520 WeakPolarHBondContact O-CB 3.31Å; S1516-E1520 PolarHBondContact O-N 2.91Å
1517	L	85.1	Confident	85.3	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.1	-34.2	177.3	-69	166.5	0	0	0	113	K1498 V1513 F1514 W1519 E1520 V1523 I1526 F1562 V1564 F1574 I1576 L1645	K1498-L1517 VanDerWaalsContact CE-O 3.31Å; K1498-L1517 WeakPolarHBondContact CE-O 3.33Å; V1513-L1517 HydrophobicContact CG1-CD1 4.04Å; V1513-L1517 WeakPolarHBondContact O-CG 3.24Å; V1513-L1517 PolarHBondContact O-N 3.26Å; F1514-L1517 PolarHBondContact O-N 2.76Å; F1514-L1517 VanDerWaalsContact O-N 3.14Å; L1517-W1519 VanDerWaalsContact C-N 3.32Å; L1517-W1519 PolarHBondContact O-N 2.93Å; L1517-E1520 PolarHBondContact O-N 2.85Å; L1517-V1523 HydrophobicContact CD2-CG2 4.15Å; L1517-I1526 HydrophobicContact CB-CD1 3.68Å; L1517-I1526 HydrophobicContact CB-CG1 4.32Å; L1517-F1562 HydrophobicContact CD1-CD1 4.45Å; L1517-F1562 HydrophobicContact CD1-CG 4.25Å; L1517-V1564 HydrophobicContact CD1-CG2 3.92Å; L1517-V1564 HydrophobicContact CD2-CG1 4.05Å; L1517-V1564 HydrophobicContact CD2-CG2 3.91Å; L1517-F1574 HydrophobicContact CD2-CZ 4.47Å; L1517-I1576 HydrophobicContact CD1-CD1 4.4Å; L1517-I1576 HydrophobicContact CD2-CD1 4.41Å; L1517-L1645 HydrophobicContact CD2-CD1 3.71Å; L1517-L1645 HydrophobicContact CG-CD1 4.1Å
1518	E	83.5	Confident	85.6	Confident	11 Å²	11	22 Å²	22	5%	0.051	13%	0.125	C	C	.	.	H	α-helix	trans	-71.7	-24.4	-177.1	-175.2	60.8	-152.7	0	0	112.9	S1496 H1497 K1498 F1514 Y1627	S1496-E1518 WeakPolarHBondContact CB-OE2 3.46Å; S1496-E1518 VanDerWaalsContact OG-CD 3.3Å; S1496-E1518 PolarHBondContact OG-OE1 3.28Å; S1496-E1518 PolarHBondContact OG-OE2 3.16Å; H1497-E1518 WeakPolarHBondContact CA-OE1 3.1Å; H1497-E1518 WeakPolarHBondContact CB-OE1 3.37Å; H1497-E1518 PolarHBondContact N-OE1 3.44Å; K1498-E1518 WeakPolarHBondContact CE-O 3.23Å; K1498-E1518 PolarHBondContact N-OE1 3.41Å; F1514-E1518 HydrophobicContact CE1-CB 4.13Å; F1514-E1518 HydrophobicContact CE1-CG 4.22Å; F1514-E1518 HydrophobicContact CE2-CB 4.43Å; F1514-E1518 HydrophobicContact CZ-CB 4.02Å; F1514-E1518 HydrophobicContact CZ-CG 3.96Å; F1514-E1518 WeakPolarHBondContact CZ-OE2 3.22Å; F1514-E1518 VanDerWaalsContact O-CB 3.29Å; F1514-E1518 WeakPolarHBondContact O-CB 3.43Å; F1514-E1518 PolarHBondContact O-N 3.19Å; E1518-Y1627 HydrophobicContact CG-CE2 3.95Å
1519	W	75.7	Confident	85.9	Confident	45 Å²	45	20 Å²	20	17%	0.17	11%	0.114	C	C	.	.	H	α-helix	trans	-100.2	-16	174.2	-77	90.8	0	0	0	114.2	L1515 L1517 S1521 I1623 L1626 T1631 V1634 L1639	L1515-W1519 PolarHBondContact O-N 3.32Å; L1517-W1519 VanDerWaalsContact C-N 3.32Å; L1517-W1519 PolarHBondContact O-N 2.93Å; W1519-S1521 PolarHBondContact O-N 3.24Å; W1519-I1623 VanDerWaalsContact CD1-CG2 3.43Å; W1519-I1623 HydrophobicContact CG-CG2 4.43Å; W1519-L1626 HydrophobicContact CZ2-CB 4.4Å; W1519-T1631 HydrophobicContact CH2-CG2 3.67Å; W1519-T1631 HydrophobicContact CZ2-CG2 4.32Å; W1519-T1631 HydrophobicContact CZ3-CG2 4.42Å; W1519-V1634 HydrophobicContact CH2-CG2 4.41Å; W1519-V1634 HydrophobicContact CZ3-CG1 4.42Å; W1519-L1639 HydrophobicContact CE3-CD2 3.53Å; W1519-L1639 HydrophobicContact CZ3-CD2 3.74Å
1520	E	75.1	Confident	86.3	Confident	15 Å²	15	20.2 Å²	20.2	7%	0.07	11%	0.114	C	C	.	.			trans	-65.6	118.7	179.5	175.1	43.1	-120.8	0	0	112	K1498 S1516 L1517 S1522 V1523 S1643 L1645	K1498-E1520 VanDerWaalsContact CE-O 3.23Å; K1498-E1520 WeakPolarHBondContact CE-O 3.11Å; K1498-E1520 PolarHBondContact NZ-O 3.45Å; S1516-E1520 WeakPolarHBondContact O-CB 3.31Å; S1516-E1520 PolarHBondContact O-N 2.91Å; L1517-E1520 PolarHBondContact O-N 2.85Å; E1520-S1522 VanDerWaalsContact C-N 3.27Å; E1520-S1522 WeakPolarHBondContact CG-OG 3.3Å; E1520-S1522 PolarHBondContact O-N 2.95Å; E1520-S1522 WeakPolarHBondContact OE1-CB 3.22Å; E1520-S1522 PolarHBondContact OE1-N 3.16Å; E1520-S1522 PolarHBondContact OE1-OG 3.47Å; E1520-V1523 HydrophobicContact CB-CG2 4.06Å; E1520-V1523 HydrophobicContact CG-CG2 3.89Å; E1520-V1523 PolarHBondContact O-N 2.87Å; E1520-S1643 WeakPolarHBondContact OE2-CB 3.29Å; E1520-S1643 PolarHBondContact OE2-OG 2.99Å; E1520-L1645 HydrophobicContact CB-CD1 3.93Å; E1520-L1645 HydrophobicContact CG-CB 4.39Å; E1520-L1645 HydrophobicContact CG-CD1 4.23Å
1521	S	73.2	Confident	86.4	Confident	110 Å²	110	20.8 Å²	20.8	77%	0.769	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-34.4	-173.6	68.1	0	0	0	0	114.6	W1519	W1519-S1521 PolarHBondContact O-N 3.24Å
1522	S	77.6	Confident	86.5	Confident	27 Å²	27	20.3 Å²	20.3	19%	0.189	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-16.7	-174.6	55.1	0	0	0	0	114.8	E1520 C1566 K1567	E1520-S1522 VanDerWaalsContact C-N 3.27Å; E1520-S1522 WeakPolarHBondContact CG-OG 3.3Å; E1520-S1522 PolarHBondContact O-N 2.95Å; E1520-S1522 WeakPolarHBondContact OE1-CB 3.22Å; E1520-S1522 PolarHBondContact OE1-N 3.16Å; E1520-S1522 PolarHBondContact OE1-OG 3.47Å; S1522-C1566 CarbonylContact O-C 3.59Å; S1522-C1566 VanDerWaalsContact O-CA 3.3Å; S1522-C1566 WeakPolarHBondContact O-CA 3.46Å; S1522-K1567 PolarHBondContact O-N 2.85Å
1523	V	85.6	Confident	86.6	Confident	5 Å²	5	24.1 Å²	24.1	3%	0.03	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	128.7	-178.1	173	0	0	0	0	111.7	K1498 L1517 E1520 I1526 V1564	K1498-V1523 HydrophobicContact CD-CG1 4.26Å; K1498-V1523 PolarHBondContact NZ-O 2.96Å; L1517-V1523 HydrophobicContact CD2-CG2 4.15Å; E1520-V1523 HydrophobicContact CB-CG2 4.06Å; E1520-V1523 HydrophobicContact CG-CG2 3.89Å; E1520-V1523 PolarHBondContact O-N 2.87Å; V1523-I1526 HydrophobicContact CG1-CD1 4.07Å; V1523-I1526 HydrophobicContact CG1-CG1 3.64Å; V1523-V1564 HydrophobicContact CB-CG1 4.46Å; V1523-V1564 HydrophobicContact CG1-CG1 3.85Å; V1523-V1564 HydrophobicContact CG2-CG1 3.86Å
1524	L	87.8	Confident	86.4	Confident	103 Å²	103	26.5 Å²	26.5	54%	0.539	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-47	177.1	-67.7	176.9	0	0	0	113.1	D1565 K1567	L1524-D1565 PolarHBondContact N-O 3.26Å; L1524-K1567 HydrophobicContact CD1-CB 3.77Å; L1524-K1567 HydrophobicContact CD1-CG 4.26Å; L1524-K1567 HydrophobicContact CD2-CB 4.02Å; L1524-K1567 HydrophobicContact CD2-CD 4.39Å; L1524-K1567 HydrophobicContact CG-CB 3.85Å
1525	D	91.7	Very high	86.2	Confident	11 Å²	11	30.1 Å²	30.1	6%	0.059	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.1	-177.1	-168.9	17.2	0	0	0	110.5	H1472 G1473 T1499 R1527 D1565	H1472-D1525 WeakPolarHBondContact CA-OD2 3.16Å; H1472-D1525 IonicContact CG-OD2 2.76Å; H1472-D1525 IonicContact ND1-OD2 3.18Å; H1472-D1525 PolarHBondContact ND1-OD2 3.44Å; G1473-D1525 VanDerWaalsContact CA-OD1 3.26Å; G1473-D1525 WeakPolarHBondContact CA-OD1 3.49Å; G1473-D1525 PolarHBondContact N-OD1 2.86Å; G1473-D1525 VanDerWaalsContact N-OD1 3.07Å; G1473-D1525 PolarHBondContact N-OD2 3.28Å; T1499-D1525 WeakPolarHBondContact CG2-OD1 3.01Å; D1525-R1527 WeakPolarHBondContact OD2-CD 3.42Å; D1525-R1527 IonicContact OD2-NE 2.7Å; D1525-D1565 HydrophobicContact CB-CB 4.1Å; D1525-D1565 PolarHBondContact N-O 3.04Å; D1525-D1565 PolarHBondContact O-N 3.49Å
1526	I	93.2	Very high	86.4	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	120.3	-179.4	-58	167.9	0	0	0	105.7	T1499 R1501 H1503 F1514 L1517 V1523 F1562	T1499-I1526 HydrophobicContact CG2-CB 4.46Å; R1501-I1526 PolarHBondContact NH2-O 3.17Å; H1503-I1526 PolarHBondContact CE1-O 3.17Å; H1503-I1526 VanDerWaalsContact CE1-O 3.28Å; F1514-I1526 HydrophobicContact CD2-CG2 4.46Å; F1514-I1526 HydrophobicContact CE2-CD1 4.35Å; L1517-I1526 HydrophobicContact CB-CD1 3.68Å; L1517-I1526 HydrophobicContact CB-CG1 4.32Å; V1523-I1526 HydrophobicContact CG1-CD1 4.07Å; V1523-I1526 HydrophobicContact CG1-CG1 3.64Å; I1526-F1562 HydrophobicContact CG2-CD1 3.78Å; I1526-F1562 HydrophobicContact CG2-CE1 4.3Å
1527	R	95.1	Very high	86.9	Confident	13 Å²	13	30.6 Å²	30.6	5%	0.049	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	98.2	-175.2	-68	-179.7	-78.1	136.9	4.4	108.8	H1472 Y1476 D1525 F1530 L1563 D1565	H1472-R1527 VanDerWaalsContact CE1-CZ 3.41Å; H1472-R1527 PolarHBondContact ND1-NE 2.94Å; Y1476-R1527 HydrophobicContact CD1-CB 4.25Å; Y1476-R1527 HydrophobicContact CD1-CG 4.25Å; Y1476-R1527 HydrophobicContact CD2-CB 4.15Å; Y1476-R1527 HydrophobicContact CD2-CG 3.89Å; Y1476-R1527 HydrophobicContact CE1-CB 4.01Å; Y1476-R1527 HydrophobicContact CE2-CB 3.94Å; Y1476-R1527 HydrophobicContact CE2-CG 4.2Å; Y1476-R1527 HydrophobicContact CG-CB 4.29Å; Y1476-R1527 HydrophobicContact CG-CG 3.91Å; D1525-R1527 WeakPolarHBondContact OD2-CD 3.42Å; D1525-R1527 IonicContact OD2-NE 2.7Å; R1527-F1530 HydrophobicContact CB-CD2 4.37Å; R1527-L1563 HydrophobicContact CB-CB 4.39Å; R1527-L1563 PolarHBondContact N-O 3.06Å; R1527-L1563 PolarHBondContact O-N 3.38Å; R1527-D1565 IonicContact CZ-OD1 2.94Å; R1527-D1565 IonicContact CZ-OD2 2.67Å; R1527-D1565 IonicContact NE-OD2 3.94Å; R1527-D1565 PolarHBondContact NE-OD2 2.97Å; R1527-D1565 IonicContact NH2-OD1 3.74Å; R1527-D1565 PolarHBondContact NH2-OD1 2.86Å; R1527-D1565 IonicContact NH2-OD2 2.79Å; R1527-D1565 PolarHBondContact NH2-OD2 3.02Å
1528	E	94.1	Very high	87.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	152.4	-173.1	85.9	-74.5	-158.9	0	0	112.7	Y1476 P1478 R1501 H1503 H1504 L1505 F1530 D1561 F1562	Y1476-E1528 WeakPolarHBondContact CE1-O 3.32Å; Y1476-E1528 PolarHBondContact OH-O 2.9Å; P1478-E1528 HydrophobicContact CB-CG 4.11Å; P1478-E1528 WeakPolarHBondContact CB-O 3.41Å; P1478-E1528 WeakPolarHBondContact CG-OE1 3.25Å; R1501-E1528 IonicContact CZ-OE2 3.28Å; R1501-E1528 VanDerWaalsContact NH1-CD 3.31Å; R1501-E1528 IonicContact NH1-OE1 2.72Å; R1501-E1528 PolarHBondContact NH1-OE1 2.99Å; R1501-E1528 IonicContact NH1-OE2 2.74Å; R1501-E1528 PolarHBondContact NH1-OE2 3.23Å; R1501-E1528 IonicContact NH2-OE2 2.9Å; R1501-E1528 PolarHBondContact NH2-OE2 3.15Å; H1503-E1528 VanDerWaalsContact CA-OE1 3.27Å; H1503-E1528 WeakPolarHBondContact CA-OE1 3.33Å; H1503-E1528 IonicContact CE1-OE2 2.72Å; H1503-E1528 IonicContact ND1-OE2 3.22Å; H1504-E1528 PolarHBondContact N-OE1 3.12Å; L1505-E1528 HydrophobicContact CD2-CB 4.35Å; L1505-E1528 HydrophobicContact CD2-CG 4.38Å; E1528-F1530 VanDerWaalsContact C-N 3.27Å; E1528-F1530 PolarHBondContact O-N 2.9Å; E1528-D1561 CarbonylContact C-O 3.53Å; E1528-D1561 VanDerWaalsContact CA-O 3.24Å; E1528-D1561 WeakPolarHBondContact CA-O 3.41Å; E1528-F1562 HydrophobicContact CB-CD1 3.98Å; E1528-F1562 HydrophobicContact CB-CE1 4Å
1529	Q	92.4	Very high	87.3	Confident	3 Å²	3	40.8 Å²	40.8	1%	0.014	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	47.6	50.9	-179.7	-64.9	-61.2	-35.1	0	0	111.7	P1478 W1479 L1480 L1506 E1510 S1559 T1560 D1561	P1478-Q1529 HydrophobicContact CB-CB 4.48Å; W1479-Q1529 WeakPolarHBondContact CB-O 3.32Å; W1479-Q1529 PolarHBondContact N-O 2.8Å; L1480-Q1529 HydrophobicContact CB-CB 4.26Å; L1480-Q1529 HydrophobicContact CB-CG 4.35Å; L1506-Q1529 HydrophobicContact CD1-CG 4.24Å; E1510-Q1529 PolarHBondContact OE2-NE2 3.02Å; Q1529-S1559 PolarHBondContact OE1-OG 3.46Å; Q1529-T1560 CarbonylContact C-O 3.52Å; Q1529-T1560 VanDerWaalsContact CA-O 3.29Å; Q1529-T1560 WeakPolarHBondContact CA-O 3.47Å; Q1529-T1560 PolarHBondContact N-O 2.72Å; Q1529-D1561 PolarHBondContact N-O 2.93Å; Q1529-D1561 PolarHBondContact NE2-OD1 3.43Å
1530	F	93.8	Very high	88.1	Confident	32 Å²	32	39.3 Å²	39.3	14%	0.14	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124.8	-174.1	-171.3	-90.1	0	0	0	111	Y1476 R1527 E1528 S1559 T1560 L1563 W1600	Y1476-F1530 AromaticContact CE2-CD2 3.97Å; Y1476-F1530 HydrophobicContact CE2-CD2 3.97Å; Y1476-F1530 HydrophobicContact CE2-CE2 4.32Å; Y1476-F1530 WeakPolarHBondContact OH-CA 3.39Å; R1527-F1530 HydrophobicContact CB-CD2 4.37Å; E1528-F1530 VanDerWaalsContact C-N 3.27Å; E1528-F1530 PolarHBondContact O-N 2.9Å; F1530-S1559 CarbonylContact O-C 3.59Å; F1530-S1559 WeakPolarHBondContact O-CA 3.4Å; F1530-S1559 WeakPolarHBondContact O-CB 3.22Å; F1530-T1560 PolarHBondContact N-O 3.46Å; F1530-T1560 PolarHBondContact O-N 3.1Å; F1530-L1563 HydrophobicContact CB-CB 4.09Å; F1530-L1563 HydrophobicContact CD1-CD2 3.95Å; F1530-L1563 HydrophobicContact CD2-CB 4.33Å; F1530-L1563 HydrophobicContact CD2-CD2 3.76Å; F1530-L1563 HydrophobicContact CE1-CD2 3.93Å; F1530-L1563 HydrophobicContact CE2-CD2 3.74Å; F1530-L1563 HydrophobicContact CG-CB 4.09Å; F1530-L1563 HydrophobicContact CG-CD2 3.87Å; F1530-L1563 HydrophobicContact CZ-CD2 3.82Å; F1530-W1600 AromaticContact CD1-CH2 3.87Å; F1530-W1600 HydrophobicContact CD1-CH2 3.87Å; F1530-W1600 HydrophobicContact CD1-CZ2 4.14Å; F1530-W1600 AromaticContact CE1-CH2 3.98Å; F1530-W1600 HydrophobicContact CE1-CH2 3.98Å
1531	P	93.3	Very high	88.8	Confident	21 Å²	21	39 Å²	39	14%	0.136	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	136.1	-172.6	30	-30.9	0	0	0	112.9	W1479 V1557 M1558	W1479-P1531 HydrophobicContact CB-CB 3.96Å; W1479-P1531 HydrophobicContact CB-CG 4.06Å; W1479-P1531 HydrophobicContact CD2-CB 3.82Å; W1479-P1531 HydrophobicContact CD2-CG 4.24Å; W1479-P1531 HydrophobicContact CE3-CB 4.08Å; W1479-P1531 HydrophobicContact CE3-CG 4.07Å; W1479-P1531 HydrophobicContact CG-CB 3.76Å; W1479-P1531 HydrophobicContact CG-CG 4.25Å; P1531-V1557 HydrophobicContact CB-CG1 3.95Å; P1531-M1558 WeakPolarHBondContact CA-O 3.41Å
1532	L	92.1	Very high	89.5	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-87.9	143.8	175.3	-44.8	-175.2	0	0	0	110.4	P1534 T1537 M1558 E1596 Y1599 W1600	L1532-P1534 WeakPolarHBondContact O-CD 3.38Å; L1532-T1537 HydrophobicContact CB-CG2 3.63Å; L1532-T1537 HydrophobicContact CD1-CG2 4.04Å; L1532-M1558 HydrophobicContact CB-CB 4.36Å; L1532-M1558 HydrophobicContact CD1-CB 3.87Å; L1532-M1558 HydrophobicContact CD1-CE 4.34Å; L1532-M1558 HydrophobicContact CG-CB 4.17Å; L1532-M1558 PolarHBondContact N-O 2.67Å; L1532-E1596 HydrophobicContact CD1-CB 4.34Å; L1532-E1596 HydrophobicContact CD1-CG 4Å; L1532-Y1599 HydrophobicContact CB-CD1 4.4Å; L1532-Y1599 HydrophobicContact CB-CD2 4.42Å; L1532-Y1599 HydrophobicContact CB-CE1 4.2Å; L1532-Y1599 HydrophobicContact CB-CE2 4.21Å; L1532-Y1599 HydrophobicContact CB-CG 4.5Å; L1532-Y1599 HydrophobicContact CD1-CD1 4.33Å; L1532-Y1599 HydrophobicContact CD1-CG 4.43Å; L1532-Y1599 HydrophobicContact CD2-CD1 3.82Å; L1532-Y1599 HydrophobicContact CD2-CE1 3.64Å; L1532-Y1599 HydrophobicContact CG-CD1 4.39Å; L1532-Y1599 HydrophobicContact CG-CE1 4.4Å; L1532-W1600 HydrophobicContact CD2-CZ2 3.63Å
1533	L	86.9	Confident	90	Very high	84 Å²	84	42.8 Å²	42.8	44%	0.44	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-61.5	124.1	-179.6	-78.8	161.4	0	0	0	111.3	S1535 D1536 T1537 Y1599	L1533-S1535 VanDerWaalsContact C-N 3.28Å; L1533-S1535 PolarHBondContact O-N 2.86Å; L1533-D1536 HydrophobicContact CB-CB 4.08Å; L1533-D1536 WeakPolarHBondContact CD1-OD2 3.42Å; L1533-D1536 PolarHBondContact O-N 2.99Å; L1533-T1537 PolarHBondContact O-N 3.31Å; L1533-T1537 PolarHBondContact O-OG1 3.21Å; L1533-Y1599 HydrophobicContact CB-CE2 4.11Å; L1533-Y1599 PolarHBondContact N-OH 3.43Å
1534	P	83.3	Confident	90.1	Very high	54 Å²	54	44 Å²	44	35%	0.351	23%	0.231	S	C	.	.	H	α-helix	trans	-67.3	-24.8	-178.5	-25.6	37.3	0	0	0	114.3	L1532 R1538 V1557	L1532-P1534 WeakPolarHBondContact O-CD 3.38Å; P1534-R1538 WeakPolarHBondContact O-CB 3.44Å; P1534-R1538 PolarHBondContact O-N 3.36Å; P1534-V1557 HydrophobicContact CG-CB 4.44Å; P1534-V1557 HydrophobicContact CG-CG1 4.23Å; P1534-V1557 HydrophobicContact CG-CG2 3.8Å
1535	S	84.5	Confident	90	Very high	76 Å²	76	42.4 Å²	42.4	53%	0.531	24%	0.24	S	C	.	.	H	α-helix	trans	-61.5	-52.5	170.3	38.3	0	0	0	0	111.1	L1533 R1538 Q1539	L1533-S1535 VanDerWaalsContact C-N 3.28Å; L1533-S1535 PolarHBondContact O-N 2.86Å; S1535-R1538 PolarHBondContact O-N 3.24Å; S1535-Q1539 PolarHBondContact O-N 3.14Å
1536	D	90.3	Very high	89.8	Confident	30 Å²	30	43.2 Å²	43.2	16%	0.16	24%	0.244	C	C	.	.	H	α-helix	trans	-74.4	-49.1	-167.5	-53.7	20.9	0	0	0	109.6	L1533 R1538 Q1539 I1540 Y1599 K1603	L1533-D1536 HydrophobicContact CB-CB 4.08Å; L1533-D1536 WeakPolarHBondContact CD1-OD2 3.42Å; L1533-D1536 PolarHBondContact O-N 2.99Å; D1536-R1538 PolarHBondContact O-N 3.44Å; D1536-Q1539 PolarHBondContact O-N 3.42Å; D1536-Q1539 VanDerWaalsContact O-N 3.13Å; D1536-I1540 WeakPolarHBondContact O-CB 3.49Å; D1536-I1540 WeakPolarHBondContact O-CD1 3.43Å; D1536-I1540 VanDerWaalsContact O-CG1 3.31Å; D1536-I1540 WeakPolarHBondContact O-CG1 3.36Å; D1536-I1540 PolarHBondContact O-N 3.49Å; D1536-Y1599 HydrophobicContact CB-CD2 3.9Å; D1536-Y1599 HydrophobicContact CB-CE2 3.78Å; D1536-K1603 IonicContact OD2-NZ 2.85Å; D1536-K1603 PolarHBondContact OD2-NZ 2.96Å
1537	T	91.2	Very high	89.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.4	-31.6	175.5	53.3	0	0	0	0	112.7	L1532 L1533 A1541 H1548 M1558 Y1599	L1532-T1537 HydrophobicContact CB-CG2 3.63Å; L1532-T1537 HydrophobicContact CD1-CG2 4.04Å; L1533-T1537 PolarHBondContact O-N 3.31Å; L1533-T1537 PolarHBondContact O-OG1 3.21Å; T1537-A1541 VanDerWaalsContact O-CB 3.32Å; T1537-A1541 WeakPolarHBondContact O-CB 3.44Å; T1537-A1541 PolarHBondContact O-N 3.04Å; T1537-H1548 WeakPolarHBondContact CB-NE2 3.27Å; T1537-H1548 PolarHBondContact O-CD2 3.4Å; T1537-H1548 PolarHBondContact OG1-NE2 2.8Å; T1537-M1558 HydrophobicContact CG2-SD 4.38Å; T1537-Y1599 HydrophobicContact CG2-CD2 3.92Å; T1537-Y1599 HydrophobicContact CG2-CE2 4.5Å; T1537-Y1599 HydrophobicContact CG2-CG 4.4Å
1538	R	88.4	Confident	89.3	Confident	130 Å²	130	50.9 Å²	50.9	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-75.6	-36.3	175	179.8	170.3	166	158.9	-5.5	112.6	P1534 S1535 D1536 A1541 I1542 D1555	P1534-R1538 WeakPolarHBondContact O-CB 3.44Å; P1534-R1538 PolarHBondContact O-N 3.36Å; S1535-R1538 PolarHBondContact O-N 3.24Å; D1536-R1538 PolarHBondContact O-N 3.44Å; R1538-A1541 PolarHBondContact O-N 3.43Å; R1538-I1542 HydrophobicContact CG-CD1 4.5Å; R1538-I1542 WeakPolarHBondContact O-CG1 3.46Å; R1538-I1542 PolarHBondContact O-N 3.19Å; R1538-I1542 VanDerWaalsContact O-N 3.14Å; R1538-D1555 IonicContact CZ-OD2 2.71Å; R1538-D1555 IonicContact NE-OD2 3.14Å; R1538-D1555 IonicContact NH1-OD2 3.32Å; R1538-D1555 PolarHBondContact NH1-OD2 3.11Å
1539	Q	89	Confident	88.9	Confident	96 Å²	96	51.3 Å²	51.3	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-65.1	-48.4	172.5	-174.2	56.1	49.2	0	0	110.5	S1535 D1536 A1541 I1542 D1543	S1535-Q1539 PolarHBondContact O-N 3.14Å; D1536-Q1539 PolarHBondContact O-N 3.42Å; D1536-Q1539 VanDerWaalsContact O-N 3.13Å; Q1539-A1541 VanDerWaalsContact C-N 3.26Å; Q1539-A1541 PolarHBondContact O-N 3.01Å; Q1539-I1542 WeakPolarHBondContact O-CA 3.34Å; Q1539-I1542 WeakPolarHBondContact O-CB 3.35Å; Q1539-I1542 PolarHBondContact O-N 2.8Å; Q1539-D1543 WeakPolarHBondContact CG-OD2 3.29Å; Q1539-D1543 PolarHBondContact NE2-OD1 3.36Å; Q1539-D1543 PolarHBondContact NE2-OD2 3.3Å; Q1539-D1543 VanDerWaalsContact O-CG 3.31Å; Q1539-D1543 PolarHBondContact O-N 3.44Å
1540	I	90.9	Very high	88.3	Confident	14 Å²	14	54.7 Å²	54.7	7%	0.072	30%	0.301	C	S	.	.	H	α-helix	trans	-55.9	-39.1	174.1	-69.9	159.6	0	0	0	111.8	D1536 D1543 S1544 L1595 R1598 Y1599	D1536-I1540 WeakPolarHBondContact O-CB 3.49Å; D1536-I1540 WeakPolarHBondContact O-CD1 3.43Å; D1536-I1540 VanDerWaalsContact O-CG1 3.31Å; D1536-I1540 WeakPolarHBondContact O-CG1 3.36Å; D1536-I1540 PolarHBondContact O-N 3.49Å; I1540-D1543 PolarHBondContact O-N 3.06Å; I1540-S1544 VanDerWaalsContact O-CB 3.25Å; I1540-S1544 WeakPolarHBondContact O-CB 3.32Å; I1540-S1544 PolarHBondContact O-N 3.37Å; I1540-S1544 PolarHBondContact O-OG 2.96Å; I1540-L1595 HydrophobicContact CG2-CD2 3.93Å; I1540-R1598 HydrophobicContact CG2-CB 3.56Å; I1540-R1598 HydrophobicContact CG2-CG 4.36Å; I1540-Y1599 HydrophobicContact CD1-CD2 4.27Å
1541	A	90.4	Very high	86.9	Confident	7 Å²	7	57.5 Å²	57.5	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-64.8	-37.5	175.1	0	0	0	0	0	113.3	T1537 R1538 Q1539 S1544 G1545 I1546 H1548 L1595	T1537-A1541 VanDerWaalsContact O-CB 3.32Å; T1537-A1541 WeakPolarHBondContact O-CB 3.44Å; T1537-A1541 PolarHBondContact O-N 3.04Å; R1538-A1541 PolarHBondContact O-N 3.43Å; Q1539-A1541 VanDerWaalsContact C-N 3.26Å; Q1539-A1541 PolarHBondContact O-N 3.01Å; A1541-S1544 PolarHBondContact O-OG 3.42Å; A1541-G1545 CarbonylContact O-C 3.58Å; A1541-G1545 PolarHBondContact O-N 3.45Å; A1541-I1546 WeakPolarHBondContact CB-O 2.91Å; A1541-I1546 PolarHBondContact O-N 3.06Å; A1541-I1546 VanDerWaalsContact O-O 3.08Å; A1541-H1548 HydrophobicContact CB-CB 3.85Å; A1541-L1595 HydrophobicContact CB-CD2 3.78Å
1542	I	88.5	Confident	85.1	Confident	108 Å²	108	65 Å²	65	55%	0.554	34%	0.342	S	S	*	.	H	α-helix	trans	-67.5	-47.9	173.7	-67.5	162.9	0	0	0	110.1	R1538 Q1539 S1544 G1545	R1538-I1542 HydrophobicContact CG-CD1 4.5Å; R1538-I1542 WeakPolarHBondContact O-CG1 3.46Å; R1538-I1542 PolarHBondContact O-N 3.19Å; R1538-I1542 VanDerWaalsContact O-N 3.14Å; Q1539-I1542 WeakPolarHBondContact O-CA 3.34Å; Q1539-I1542 WeakPolarHBondContact O-CB 3.35Å; Q1539-I1542 PolarHBondContact O-N 2.8Å; I1542-S1544 VanDerWaalsContact C-N 3.3Å; I1542-S1544 PolarHBondContact O-N 3.09Å; I1542-G1545 PolarHBondContact O-N 2.92Å
1543	D	88.7	Confident	83.9	Confident	109 Å²	109	68 Å²	68	58%	0.583	37%	0.374	S	S	*	.	H	α-helix	trans	-73.7	-19.2	-174.1	-60.3	-29.6	0	0	0	113.8	Q1539 I1540	Q1539-D1543 WeakPolarHBondContact CG-OD2 3.29Å; Q1539-D1543 PolarHBondContact NE2-OD1 3.36Å; Q1539-D1543 PolarHBondContact NE2-OD2 3.3Å; Q1539-D1543 VanDerWaalsContact O-CG 3.31Å; Q1539-D1543 PolarHBondContact O-N 3.44Å; I1540-D1543 PolarHBondContact O-N 3.06Å
1544	S	87.2	Confident	82.9	Confident	30 Å²	30	66 Å²	66	21%	0.21	37%	0.366	C	S	.	.	H	α-helix	trans	-96.4	-13.1	173.6	59	0	0	0	0	114	I1540 A1541 I1542 I1546	I1540-S1544 VanDerWaalsContact O-CB 3.25Å; I1540-S1544 WeakPolarHBondContact O-CB 3.32Å; I1540-S1544 PolarHBondContact O-N 3.37Å; I1540-S1544 PolarHBondContact O-OG 2.96Å; A1541-S1544 PolarHBondContact O-OG 3.42Å; I1542-S1544 VanDerWaalsContact C-N 3.3Å; I1542-S1544 PolarHBondContact O-N 3.09Å; S1544-I1546 PolarHBondContact O-N 3.11Å; S1544-I1546 WeakPolarHBondContact OG-CB 3.44Å; S1544-I1546 PolarHBondContact OG-N 2.79Å
1545	G	85.9	Confident	82.7	Confident	71 Å²	71	65.8 Å²	65.8	73%	0.732	36%	0.361	S	S	*	.			trans	71.4	-0.9	-168.9	0	0	0	0	0	114.8	A1541 I1542	A1541-G1545 CarbonylContact O-C 3.58Å; A1541-G1545 PolarHBondContact O-N 3.45Å; I1542-G1545 PolarHBondContact O-N 2.92Å
1546	I	87.6	Confident	82.6	Confident	27 Å²	27	66.1 Å²	66.1	14%	0.138	35%	0.354	C	S	.	.			trans	-77	135.8	-178.1	-62.1	172	0	0	0	110.2	A1541 S1544 H1548 E1591 E1594 L1595	A1541-I1546 WeakPolarHBondContact CB-O 2.91Å; A1541-I1546 PolarHBondContact O-N 3.06Å; A1541-I1546 VanDerWaalsContact O-O 3.08Å; S1544-I1546 PolarHBondContact O-N 3.11Å; S1544-I1546 WeakPolarHBondContact OG-CB 3.44Å; S1544-I1546 PolarHBondContact OG-N 2.79Å; I1546-H1548 PolarHBondContact O-N 3.41Å; I1546-E1591 HydrophobicContact CG2-CB 3.76Å; I1546-E1591 HydrophobicContact CG2-CG 3.96Å; I1546-E1594 HydrophobicContact CD1-CB 3.96Å; I1546-E1594 HydrophobicContact CD1-CG 3.6Å; I1546-L1595 HydrophobicContact CB-CD2 3.94Å; I1546-L1595 HydrophobicContact CB-CG 4.31Å; I1546-L1595 HydrophobicContact CD1-CD2 4.47Å; I1546-L1595 HydrophobicContact CG2-CD1 3.99Å; I1546-L1595 HydrophobicContact CG2-CD2 4.04Å; I1546-L1595 HydrophobicContact CG2-CG 3.86Å
1547	K	88.2	Confident	82.4	Confident	156 Å²	156	65.3 Å²	65.3	68%	0.678	35%	0.35	S	S	*	.			trans	-72.7	114	-177.5	-174.7	174.6	-176.8	174	0	111.7	R1588	K1547-R1588 VanDerWaalsContact O-CZ 3.26Å; K1547-R1588 PolarHBondContact O-NH1 2.81Å; K1547-R1588 PolarHBondContact O-NH2 3.44Å
1548	H	89.4	Confident	82.4	Confident	19 Å²	19	66 Å²	66	9%	0.088	35%	0.354	C	S	.	.			trans	-53.9	142.5	174.3	-164.7	-87	0	0	0	112.3	T1537 A1541 I1546 V1550 Q1556	T1537-H1548 WeakPolarHBondContact CB-NE2 3.27Å; T1537-H1548 PolarHBondContact O-CD2 3.4Å; T1537-H1548 PolarHBondContact OG1-NE2 2.8Å; A1541-H1548 HydrophobicContact CB-CB 3.85Å; I1546-H1548 PolarHBondContact O-N 3.41Å; H1548-V1550 PolarHBondContact O-N 2.72Å; H1548-Q1556 PolarHBondContact CE1-N 3.39Å; H1548-Q1556 VanDerWaalsContact CE1-N 3.3Å; H1548-Q1556 PolarHBondContact CE1-O 3.1Å
1549	P	84.3	Confident	82.5	Confident	8 Å²	8	60.8 Å²	60.8	5%	0.052	34%	0.337	C	S	.	.			trans	-67.7	118	177.9	26.5	-34.9	0	0	0	112.6	Q1556 M1558	P1549-Q1556 HydrophobicContact CB-CB 4.21Å; P1549-Q1556 HydrophobicContact CG-CB 4.35Å; P1549-Q1556 VanDerWaalsContact O-CB 3.24Å; P1549-Q1556 WeakPolarHBondContact O-CB 3.01Å; P1549-Q1556 PolarHBondContact O-N 3.47Å; P1549-M1558 HydrophobicContact CG-CG 3.68Å; P1549-M1558 HydrophobicContact CG-SD 3.81Å
1550	V	79.9	Confident	82.7	Confident	74 Å²	74	56.2 Å²	56.2	45%	0.448	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.2	-179.5	174.3	0	0	0	0	110.6	H1548	H1548-V1550 PolarHBondContact O-N 2.72Å
1551	I	66	Low	82.8	Confident	91 Å²	91	56 Å²	56	47%	0.467	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.1	172.6	-64.6	-177.8	0	0	0	109.1	G1553 V1554 Q1556	I1551-G1553 PolarHBondContact O-N 3.28Å; I1551-G1553 VanDerWaalsContact O-N 3.09Å; I1551-V1554 PolarHBondContact N-O 3.06Å; I1551-V1554 PolarHBondContact O-N 2.74Å; I1551-V1554 VanDerWaalsContact O-N 3.1Å; I1551-Q1556 HydrophobicContact CD1-CG 4.34Å; I1551-Q1556 VanDerWaalsContact CD1-OE1 3.26Å
1552	R	54.4	Low	83	Confident	178 Å²	178	55.6 Å²	55.6	67%	0.672	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	25.7	175.6	-61.2	179.4	175.7	167.9	0.1	115.3
1553	G	67.2	Low	83.3	Confident	67 Å²	67	50.6 Å²	50.6	69%	0.691	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.4	10.8	179.1	0	0	0	0	0	114.9	I1551	I1551-G1553 PolarHBondContact O-N 3.28Å; I1551-G1553 VanDerWaalsContact O-N 3.09Å
1554	V	66.4	Low	83.4	Confident	42 Å²	42	45.4 Å²	45.4	26%	0.255	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133.7	168.5	-179.8	0	0	0	0	108.7	A1456 I1460 I1551 Q1556	A1456-V1554 HydrophobicContact CB-CB 4.06Å; A1456-V1554 HydrophobicContact CB-CG1 4.35Å; A1456-V1554 HydrophobicContact CB-CG2 3.93Å; I1460-V1554 HydrophobicContact CD1-CG1 4.03Å; I1551-V1554 PolarHBondContact N-O 3.06Å; I1551-V1554 PolarHBondContact O-N 2.74Å; I1551-V1554 VanDerWaalsContact O-N 3.1Å; V1554-Q1556 PolarHBondContact O-N 2.75Å
1555	D	79.1	Confident	83.6	Confident	49 Å²	49	45 Å²	45	26%	0.262	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	130.4	175.6	-58.8	-14.6	0	0	0	109.6	R1538	R1538-D1555 IonicContact CZ-OD2 2.71Å; R1538-D1555 IonicContact NE-OD2 3.14Å; R1538-D1555 IonicContact NH1-OD2 3.32Å; R1538-D1555 PolarHBondContact NH1-OD2 3.11Å
1556	Q	81.3	Confident	83.7	Confident	82 Å²	82	42.3 Å²	42.3	38%	0.383	22%	0.224	S	C	.	.			trans	-84.7	125.4	-178.5	-177	179.7	-11.2	0	0	109.8	H1548 P1549 I1551 V1554 M1558	H1548-Q1556 PolarHBondContact CE1-N 3.39Å; H1548-Q1556 VanDerWaalsContact CE1-N 3.3Å; H1548-Q1556 PolarHBondContact CE1-O 3.1Å; P1549-Q1556 HydrophobicContact CB-CB 4.21Å; P1549-Q1556 HydrophobicContact CG-CB 4.35Å; P1549-Q1556 VanDerWaalsContact O-CB 3.24Å; P1549-Q1556 WeakPolarHBondContact O-CB 3.01Å; P1549-Q1556 PolarHBondContact O-N 3.47Å; I1551-Q1556 HydrophobicContact CD1-CG 4.34Å; I1551-Q1556 VanDerWaalsContact CD1-OE1 3.26Å; V1554-Q1556 PolarHBondContact O-N 2.75Å; Q1556-M1558 PolarHBondContact O-N 2.92Å; Q1556-M1558 VanDerWaalsContact O-N 3.12Å
1557	V	87.1	Confident	83.3	Confident	13 Å²	13	47.3 Å²	47.3	8%	0.079	25%	0.245	C	C	.	.			trans	-63.8	113.4	166	-172.2	0	0	0	0	108.1	I1460 W1479 P1531 P1534	I1460-V1557 HydrophobicContact CD1-CG2 4.05Å; I1460-V1557 HydrophobicContact CG1-CG2 4.15Å; I1460-V1557 HydrophobicContact CG2-CG2 4.06Å; W1479-V1557 HydrophobicContact CH2-CG2 4.46Å; W1479-V1557 HydrophobicContact CZ2-CB 3.75Å; W1479-V1557 HydrophobicContact CZ2-CG1 3.82Å; W1479-V1557 HydrophobicContact CZ2-CG2 3.66Å; P1531-V1557 HydrophobicContact CB-CG1 3.95Å; P1534-V1557 HydrophobicContact CG-CB 4.44Å; P1534-V1557 HydrophobicContact CG-CG1 4.23Å; P1534-V1557 HydrophobicContact CG-CG2 3.8Å
1558	M	90.9	Very high	82.3	Confident	14 Å²	14	45.5 Å²	45.5	7%	0.069	24%	0.242	C	C	.	.			trans	-73	155.6	175.6	-69.3	174.6	60.4	0	0	110.4	P1531 L1532 T1537 P1549 Q1556 K1592 L1595 E1596	P1531-M1558 WeakPolarHBondContact CA-O 3.41Å; L1532-M1558 HydrophobicContact CB-CB 4.36Å; L1532-M1558 HydrophobicContact CD1-CB 3.87Å; L1532-M1558 HydrophobicContact CD1-CE 4.34Å; L1532-M1558 HydrophobicContact CG-CB 4.17Å; L1532-M1558 PolarHBondContact N-O 2.67Å; T1537-M1558 HydrophobicContact CG2-SD 4.38Å; P1549-M1558 HydrophobicContact CG-CG 3.68Å; P1549-M1558 HydrophobicContact CG-SD 3.81Å; Q1556-M1558 PolarHBondContact O-N 2.92Å; Q1556-M1558 VanDerWaalsContact O-N 3.12Å; M1558-K1592 WeakPolarHBondContact CE-O 3.45Å; M1558-L1595 HydrophobicContact CE-CB 4.08Å; M1558-L1595 HydrophobicContact SD-CB 4.42Å; M1558-L1595 HydrophobicContact SD-CD1 4.27Å; M1558-E1596 HydrophobicContact CE-CB 4.18Å
1559	S	90.3	Very high	81.1	Confident	21 Å²	21	46.1 Å²	46.1	15%	0.147	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	145.9	171.2	49.2	0	0	0	0	111.5	Q1529 F1530 Q1577	Q1529-S1559 PolarHBondContact OE1-OG 3.46Å; F1530-S1559 CarbonylContact O-C 3.59Å; F1530-S1559 WeakPolarHBondContact O-CA 3.4Å; F1530-S1559 WeakPolarHBondContact O-CB 3.22Å; S1559-Q1577 PolarHBondContact O-NE2 3.43Å
1560	T	93.9	Very high	80.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	139.2	164.6	-67.1	0	0	0	0	108.3	Q1529 F1530 F1562 A1575 I1576 E1596 W1600	Q1529-T1560 CarbonylContact C-O 3.52Å; Q1529-T1560 VanDerWaalsContact CA-O 3.29Å; Q1529-T1560 WeakPolarHBondContact CA-O 3.47Å; Q1529-T1560 PolarHBondContact N-O 2.72Å; F1530-T1560 PolarHBondContact N-O 3.46Å; F1530-T1560 PolarHBondContact O-N 3.1Å; T1560-F1562 WeakPolarHBondContact CG2-O 3.46Å; T1560-F1562 PolarHBondContact O-N 2.81Å; T1560-A1575 HydrophobicContact CG2-CB 4.18Å; T1560-I1576 WeakPolarHBondContact CG2-O 3.43Å; T1560-E1596 WeakPolarHBondContact CB-OE1 3.42Å; T1560-E1596 WeakPolarHBondContact CG2-OE1 3.47Å; T1560-E1596 PolarHBondContact OG1-OE1 3.31Å; T1560-W1600 PolarHBondContact OG1-NE1 3.05Å
1561	D	92.7	Very high	79.9	Confident	9 Å²	9	49.4 Å²	49.4	5%	0.048	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	-39.8	-173.1	-64.9	-38.5	0	0	0	112.1	E1510 E1528 Q1529 Q1577 V1578 K1579	E1510-D1561 HydrophobicContact CG-CB 4.48Å; E1528-D1561 CarbonylContact C-O 3.53Å; E1528-D1561 VanDerWaalsContact CA-O 3.24Å; E1528-D1561 WeakPolarHBondContact CA-O 3.41Å; Q1529-D1561 PolarHBondContact N-O 2.93Å; Q1529-D1561 PolarHBondContact NE2-OD1 3.43Å; D1561-Q1577 PolarHBondContact OD1-OE1 3.12Å; D1561-Q1577 PolarHBondContact OD2-OE1 2.98Å; D1561-V1578 HydrophobicContact CB-CB 4.35Å; D1561-V1578 HydrophobicContact CB-CG2 4.17Å; D1561-V1578 WeakPolarHBondContact OD2-CA 3.3Å; D1561-V1578 WeakPolarHBondContact OD2-CB 3.36Å; D1561-V1578 PolarHBondContact OD2-N 3.35Å; D1561-K1579 IonicContact OD1-NZ 2.85Å; D1561-K1579 IonicContact OD2-NZ 3.7Å; D1561-K1579 PolarHBondContact OD2-NZ 2.91Å
1562	F	93.8	Very high	80.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.3	171.4	-57.6	-79.1	0	0	0	113.6	L1505 E1510 V1513 F1514 L1517 I1526 E1528 T1560 V1564 I1576 V1578	L1505-F1562 HydrophobicContact CD2-CE1 3.72Å; L1505-F1562 HydrophobicContact CD2-CZ 3.79Å; E1510-F1562 HydrophobicContact CB-CE2 4.29Å; E1510-F1562 HydrophobicContact CB-CZ 4.21Å; E1510-F1562 HydrophobicContact CG-CE2 4.37Å; E1510-F1562 WeakPolarHBondContact O-CZ 3.35Å; V1513-F1562 HydrophobicContact CB-CE2 4Å; V1513-F1562 HydrophobicContact CG1-CD2 3.93Å; V1513-F1562 HydrophobicContact CG1-CE2 3.8Å; F1514-F1562 HydrophobicContact CB-CE1 4.07Å; F1514-F1562 HydrophobicContact CB-CZ 3.83Å; F1514-F1562 HydrophobicContact CD2-CE1 4.41Å; L1517-F1562 HydrophobicContact CD1-CD1 4.45Å; L1517-F1562 HydrophobicContact CD1-CG 4.25Å; I1526-F1562 HydrophobicContact CG2-CD1 3.78Å; I1526-F1562 HydrophobicContact CG2-CE1 4.3Å; E1528-F1562 HydrophobicContact CB-CD1 3.98Å; E1528-F1562 HydrophobicContact CB-CE1 4Å; T1560-F1562 WeakPolarHBondContact CG2-O 3.46Å; T1560-F1562 PolarHBondContact O-N 2.81Å; F1562-V1564 HydrophobicContact CB-CG2 4.27Å; F1562-I1576 HydrophobicContact CB-CB 4.39Å; F1562-I1576 PolarHBondContact N-O 3.32Å; F1562-I1576 PolarHBondContact O-N 2.84Å; F1562-V1578 HydrophobicContact CD2-CG2 4.02Å; F1562-V1578 HydrophobicContact CE2-CG2 3.92Å
1563	L	94.4	Very high	82.5	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.7	159.1	-178.2	65	0	0	0	108.1	R1527 F1530 Q1573 A1575 W1600	R1527-L1563 HydrophobicContact CB-CB 4.39Å; R1527-L1563 PolarHBondContact N-O 3.06Å; R1527-L1563 PolarHBondContact O-N 3.38Å; F1530-L1563 HydrophobicContact CB-CB 4.09Å; F1530-L1563 HydrophobicContact CD1-CD2 3.95Å; F1530-L1563 HydrophobicContact CD2-CB 4.33Å; F1530-L1563 HydrophobicContact CD2-CD2 3.76Å; F1530-L1563 HydrophobicContact CE1-CD2 3.93Å; F1530-L1563 HydrophobicContact CE2-CD2 3.74Å; F1530-L1563 HydrophobicContact CG-CB 4.09Å; F1530-L1563 HydrophobicContact CG-CD2 3.87Å; F1530-L1563 HydrophobicContact CZ-CD2 3.82Å; L1563-Q1573 HydrophobicContact CD1-CG 3.76Å; L1563-Q1573 HydrophobicContact CG-CG 4.34Å; L1563-A1575 HydrophobicContact CD1-CB 4.33Å; L1563-W1600 HydrophobicContact CD1-CH2 3.77Å; L1563-W1600 HydrophobicContact CD1-CZ2 4.44Å; L1563-W1600 HydrophobicContact CD1-CZ3 3.98Å; L1563-W1600 HydrophobicContact CD2-CH2 4.07Å; L1563-W1600 HydrophobicContact CG-CH2 4.45Å
1564	V	91.9	Very high	83.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.4	-169.5	-174.5	0	0	0	0	110	L1517 V1523 F1562 Q1573 F1574	L1517-V1564 HydrophobicContact CD1-CG2 3.92Å; L1517-V1564 HydrophobicContact CD2-CG1 4.05Å; L1517-V1564 HydrophobicContact CD2-CG2 3.91Å; V1523-V1564 HydrophobicContact CB-CG1 4.46Å; V1523-V1564 HydrophobicContact CG1-CG1 3.85Å; V1523-V1564 HydrophobicContact CG2-CG1 3.86Å; F1562-V1564 HydrophobicContact CB-CG2 4.27Å; V1564-Q1573 VanDerWaalsContact O-CA 3.29Å; V1564-Q1573 WeakPolarHBondContact O-CA 3.47Å; V1564-Q1573 WeakPolarHBondContact O-CG 3.31Å; V1564-F1574 HydrophobicContact CB-CD2 4.14Å; V1564-F1574 HydrophobicContact CB-CE1 4.35Å; V1564-F1574 HydrophobicContact CB-CE2 3.73Å; V1564-F1574 HydrophobicContact CB-CZ 3.86Å; V1564-F1574 HydrophobicContact CG1-CE1 4.17Å; V1564-F1574 HydrophobicContact CG1-CE2 4.08Å; V1564-F1574 HydrophobicContact CG1-CZ 3.7Å; V1564-F1574 HydrophobicContact CG2-CD2 4.4Å; V1564-F1574 HydrophobicContact CG2-CE2 3.86Å; V1564-F1574 HydrophobicContact CG2-CZ 4.34Å; V1564-F1574 PolarHBondContact N-O 3.36Å; V1564-F1574 PolarHBondContact O-N 2.97Å
1565	D	91.1	Very high	84.7	Confident	23 Å²	23	42.8 Å²	42.8	12%	0.123	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.9	175	-58	-60.3	0	0	0	109.9	H1472 L1524 D1525 R1527 Q1573	H1472-D1565 IonicContact ND1-OD2 3.89Å; L1524-D1565 PolarHBondContact N-O 3.26Å; D1525-D1565 HydrophobicContact CB-CB 4.1Å; D1525-D1565 PolarHBondContact N-O 3.04Å; D1525-D1565 PolarHBondContact O-N 3.49Å; R1527-D1565 IonicContact CZ-OD1 2.94Å; R1527-D1565 IonicContact CZ-OD2 2.67Å; R1527-D1565 IonicContact NE-OD2 3.94Å; R1527-D1565 PolarHBondContact NE-OD2 2.97Å; R1527-D1565 IonicContact NH2-OD1 3.74Å; R1527-D1565 PolarHBondContact NH2-OD1 2.86Å; R1527-D1565 IonicContact NH2-OD2 2.79Å; R1527-D1565 PolarHBondContact NH2-OD2 3.02Å; D1565-Q1573 PolarHBondContact OD1-NE2 2.87Å
1566	C	87.3	Confident	85.2	Confident	13 Å²	13	40.4 Å²	40.4	9%	0.088	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	153.9	-176.3	-76.5	0	0	0	0	112.7	S1522 E1572	S1522-C1566 CarbonylContact O-C 3.59Å; S1522-C1566 VanDerWaalsContact O-CA 3.3Å; S1522-C1566 WeakPolarHBondContact O-CA 3.46Å; C1566-E1572 PolarHBondContact N-O 3.45Å
1567	K	78.8	Confident	85.7	Confident	133 Å²	133	37.1 Å²	37.1	58%	0.578	20%	0.195	S	C	*	.	S	Bend	trans	-92	-46.8	-179.1	-165.5	-178.3	152.5	-66.3	0	113.8	S1522 L1524	S1522-K1567 PolarHBondContact O-N 2.85Å; L1524-K1567 HydrophobicContact CD1-CB 3.77Å; L1524-K1567 HydrophobicContact CD1-CG 4.26Å; L1524-K1567 HydrophobicContact CD2-CB 4.02Å; L1524-K1567 HydrophobicContact CD2-CD 4.39Å; L1524-K1567 HydrophobicContact CG-CB 3.85Å
1568	D	68.8	Low	85.8	Confident	118 Å²	118	36.7 Å²	36.7	63%	0.631	19%	0.193	S	C	*	.	S	Bend	trans	-136.8	32.1	-168.8	-48	-77.4	0	0	0	111.3
1569	G	63.3	Low	85.7	Confident	32 Å²	32	38.2 Å²	38.2	33%	0.33	20%	0.199	S	C	.	.	S	Bend	trans	-93.1	177.6	179.3	0	0	0	0	0	113.8	F1571	G1569-F1571 PolarHBondContact O-N 3.36Å
1570	P	64.8	Low	85.5	Confident	80 Å²	80	40.4 Å²	40.4	52%	0.519	21%	0.213	S	C	.	.	S	Bend	trans	-65	-16.4	175.3	27.1	-34.4	0	0	0	113.6
1571	F	74.7	Confident	85.1	Confident	71 Å²	71	41.3 Å²	41.3	31%	0.311	22%	0.221	S	C	.	.	S	Bend	trans	-139.8	140.7	177.2	-46.2	-70.8	0	0	0	109.3	G1569 Q1573 P1606 F1608	G1569-F1571 PolarHBondContact O-N 3.36Å; F1571-Q1573 VanDerWaalsContact C-N 3.32Å; F1571-P1606 HydrophobicContact CB-CG 4.16Å; F1571-P1606 HydrophobicContact CD1-CG 3.49Å; F1571-P1606 VanDerWaalsContact CD1-CG 3.49Å; F1571-P1606 HydrophobicContact CD2-CB 4.4Å; F1571-P1606 HydrophobicContact CD2-CG 3.98Å; F1571-P1606 HydrophobicContact CE1-CG 3.76Å; F1571-P1606 HydrophobicContact CE2-CB 4.43Å; F1571-P1606 HydrophobicContact CE2-CG 4.24Å; F1571-P1606 HydrophobicContact CG-CB 4.49Å; F1571-P1606 HydrophobicContact CG-CG 3.61Å; F1571-P1606 HydrophobicContact CZ-CG 4.13Å; F1571-F1608 HydrophobicContact CE2-CE2 4.42Å; F1571-F1608 AromaticContact CE2-CZ 3.89Å; F1571-F1608 HydrophobicContact CE2-CZ 3.89Å
1572	E	84	Confident	84.6	Confident	175 Å²	175	44.5 Å²	44.5	82%	0.818	25%	0.248	S	C	*	.	S	Bend	trans	-66.5	-34.3	175.8	-64	-175.2	154.3	0	0	112.3	C1566	C1566-E1572 PolarHBondContact N-O 3.45Å
1573	Q	89.8	Confident	84	Confident	57 Å²	57	46 Å²	46	27%	0.266	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	141.3	179.8	-177.9	175.2	101.4	0	0	109.5	L1563 V1564 D1565 F1571 I1605	L1563-Q1573 HydrophobicContact CD1-CG 3.76Å; L1563-Q1573 HydrophobicContact CG-CG 4.34Å; V1564-Q1573 VanDerWaalsContact O-CA 3.29Å; V1564-Q1573 WeakPolarHBondContact O-CA 3.47Å; V1564-Q1573 WeakPolarHBondContact O-CG 3.31Å; D1565-Q1573 PolarHBondContact OD1-NE2 2.87Å; F1571-Q1573 VanDerWaalsContact C-N 3.32Å; Q1573-I1605 VanDerWaalsContact OE1-CD1 3.22Å
1574	F	89.2	Confident	83.4	Confident	6 Å²	6	48 Å²	48	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	160.9	173.5	60.5	-96.2	0	0	0	112.3	L1517 V1564 I1576 P1606 F1608 L1649	L1517-F1574 HydrophobicContact CD2-CZ 4.47Å; V1564-F1574 HydrophobicContact CB-CD2 4.14Å; V1564-F1574 HydrophobicContact CB-CE1 4.35Å; V1564-F1574 HydrophobicContact CB-CE2 3.73Å; V1564-F1574 HydrophobicContact CB-CZ 3.86Å; V1564-F1574 HydrophobicContact CG1-CE1 4.17Å; V1564-F1574 HydrophobicContact CG1-CE2 4.08Å; V1564-F1574 HydrophobicContact CG1-CZ 3.7Å; V1564-F1574 HydrophobicContact CG2-CD2 4.4Å; V1564-F1574 HydrophobicContact CG2-CE2 3.86Å; V1564-F1574 HydrophobicContact CG2-CZ 4.34Å; V1564-F1574 PolarHBondContact N-O 3.36Å; V1564-F1574 PolarHBondContact O-N 2.97Å; F1574-I1576 HydrophobicContact CD2-CD1 4.32Å; F1574-I1576 HydrophobicContact CD2-CG1 4.16Å; F1574-I1576 HydrophobicContact CE2-CD1 3.79Å; F1574-I1576 HydrophobicContact CE2-CG1 4.14Å; F1574-P1606 HydrophobicContact CB-CB 4.21Å; F1574-F1608 HydrophobicContact CB-CD2 4.46Å; F1574-F1608 HydrophobicContact CB-CE2 4.02Å; F1574-F1608 HydrophobicContact CD2-CD2 4.28Å; F1574-F1608 HydrophobicContact CD2-CE2 4.36Å; F1574-F1608 HydrophobicContact CG-CE2 4.3Å; F1574-L1649 HydrophobicContact CE1-CD1 4.32Å; F1574-L1649 HydrophobicContact CZ-CD1 4.16Å
1575	A	91.1	Very high	82.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.2	-176.7	0	0	0	0	0	111.4	T1560 L1563 W1600 P1606 W1607 F1608	T1560-A1575 HydrophobicContact CG2-CB 4.18Å; L1563-A1575 HydrophobicContact CD1-CB 4.33Å; A1575-W1600 HydrophobicContact CB-CD2 3.87Å; A1575-W1600 HydrophobicContact CB-CE3 4.43Å; A1575-W1600 HydrophobicContact CB-CG 4.08Å; A1575-W1600 HydrophobicContact CB-CZ2 4.21Å; A1575-P1606 PolarHBondContact N-O 2.79Å; A1575-W1607 HydrophobicContact CB-CB 4.34Å; A1575-W1607 HydrophobicContact CB-CG 4.44Å; A1575-W1607 WeakPolarHBondContact O-CA 3.44Å; A1575-F1608 PolarHBondContact O-N 3.25Å
1576	I	90.4	Very high	82.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	132.6	175	-65.6	169.7	0	0	0	110	V1513 L1517 T1560 F1562 F1574 V1578 F1608 F1610	V1513-I1576 HydrophobicContact CG1-CD1 4.33Å; V1513-I1576 HydrophobicContact CG1-CG2 4.23Å; L1517-I1576 HydrophobicContact CD1-CD1 4.4Å; L1517-I1576 HydrophobicContact CD2-CD1 4.41Å; T1560-I1576 WeakPolarHBondContact CG2-O 3.43Å; F1562-I1576 HydrophobicContact CB-CB 4.39Å; F1562-I1576 PolarHBondContact N-O 3.32Å; F1562-I1576 PolarHBondContact O-N 2.84Å; F1574-I1576 HydrophobicContact CD2-CD1 4.32Å; F1574-I1576 HydrophobicContact CD2-CG1 4.16Å; F1574-I1576 HydrophobicContact CE2-CD1 3.79Å; F1574-I1576 HydrophobicContact CE2-CG1 4.14Å; I1576-V1578 HydrophobicContact CG2-CG2 3.8Å; I1576-F1608 WeakPolarHBondContact CA-O 3.41Å; I1576-F1608 HydrophobicContact CG1-CB 4.5Å; I1576-F1610 HydrophobicContact CB-CD2 4.49Å; I1576-F1610 HydrophobicContact CD1-CD2 4.26Å; I1576-F1610 HydrophobicContact CD1-CE2 3.88Å; I1576-F1610 HydrophobicContact CD1-CZ 4.28Å; I1576-F1610 HydrophobicContact CG1-CD2 4.16Å; I1576-F1610 HydrophobicContact CG1-CE2 4Å; I1576-F1610 HydrophobicContact CG2-CB 4.12Å; I1576-F1610 HydrophobicContact CG2-CD2 3.56Å; I1576-F1610 HydrophobicContact CG2-CE2 4.25Å; I1576-F1610 HydrophobicContact CG2-CG 4.01Å
1577	Q	92.1	Very high	82.4	Confident	12 Å²	12	65.4 Å²	65.4	6%	0.056	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128.9	169.8	-168.9	66.7	-41.5	0	0	110.4	S1559 D1561 L1593 E1596 W1607 F1608 I1609 F1610	S1559-Q1577 PolarHBondContact O-NE2 3.43Å; D1561-Q1577 PolarHBondContact OD1-OE1 3.12Å; D1561-Q1577 PolarHBondContact OD2-OE1 2.98Å; Q1577-L1593 HydrophobicContact CB-CD2 4.49Å; Q1577-L1593 HydrophobicContact CG-CD2 3.65Å; Q1577-E1596 WeakPolarHBondContact CB-OE1 3.28Å; Q1577-E1596 VanDerWaalsContact CD-OE2 3.25Å; Q1577-E1596 WeakPolarHBondContact CG-OE1 3.29Å; Q1577-E1596 WeakPolarHBondContact CG-OE2 3.44Å; Q1577-E1596 PolarHBondContact NE2-OE1 2.87Å; Q1577-E1596 PolarHBondContact NE2-OE2 2.83Å; Q1577-W1607 HydrophobicContact CB-CZ2 3.77Å; Q1577-W1607 HydrophobicContact CG-CZ2 4.18Å; Q1577-F1608 PolarHBondContact N-O 3.38Å; Q1577-I1609 WeakPolarHBondContact O-CA 3.39Å; Q1577-F1610 PolarHBondContact O-N 2.86Å
1578	V	89.6	Confident	82.9	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.03	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	114.4	-167	-177.8	0	0	0	0	110.7	L1509 E1510 V1513 D1561 F1562 I1576 F1610	L1509-V1578 HydrophobicContact CB-CG1 3.95Å; L1509-V1578 HydrophobicContact CD2-CG1 3.63Å; L1509-V1578 HydrophobicContact CG-CG1 3.53Å; E1510-V1578 HydrophobicContact CG-CB 4.05Å; E1510-V1578 HydrophobicContact CG-CG1 4.14Å; E1510-V1578 HydrophobicContact CG-CG2 4.43Å; V1513-V1578 HydrophobicContact CB-CG2 4.22Å; V1513-V1578 HydrophobicContact CG1-CG2 4.22Å; V1513-V1578 HydrophobicContact CG2-CG1 4.14Å; V1513-V1578 HydrophobicContact CG2-CG2 3.88Å; D1561-V1578 HydrophobicContact CB-CB 4.35Å; D1561-V1578 HydrophobicContact CB-CG2 4.17Å; D1561-V1578 WeakPolarHBondContact OD2-CA 3.3Å; D1561-V1578 WeakPolarHBondContact OD2-CB 3.36Å; D1561-V1578 PolarHBondContact OD2-N 3.35Å; F1562-V1578 HydrophobicContact CD2-CG2 4.02Å; F1562-V1578 HydrophobicContact CE2-CG2 3.92Å; I1576-V1578 HydrophobicContact CG2-CG2 3.8Å; V1578-F1610 WeakPolarHBondContact CA-O 3.18Å; V1578-F1610 HydrophobicContact CG2-CB 4.5Å
1579	K	87.4	Confident	83.7	Confident	45 Å²	45	57.9 Å²	57.9	20%	0.196	31%	0.314	C	S	.	.			trans	-144.1	133.4	-175.8	-58.6	-67.9	163	-88.4	0	110.7	D1561 L1593 F1610 T1611	D1561-K1579 IonicContact OD1-NZ 2.85Å; D1561-K1579 IonicContact OD2-NZ 3.7Å; D1561-K1579 PolarHBondContact OD2-NZ 2.91Å; K1579-L1593 HydrophobicContact CG-CD2 4.44Å; K1579-F1610 PolarHBondContact N-O 3Å; K1579-T1611 VanDerWaalsContact O-CA 3.29Å; K1579-T1611 WeakPolarHBondContact O-CA 3.28Å; K1579-T1611 WeakPolarHBondContact O-CB 3.34Å; K1579-T1611 WeakPolarHBondContact O-CG2 3.43Å
1580	P	86.7	Confident	84.8	Confident	67 Å²	67	58.3 Å²	58.3	44%	0.435	31%	0.309	S	S	.	.			trans	-57.5	143.6	172.5	-23.3	33.4	0	0	0	111.3	L1509 A1582 A1583 D1612	L1509-P1580 HydrophobicContact CD2-CG 4.34Å; P1580-A1582 PolarHBondContact O-N 3.08Å; P1580-A1582 VanDerWaalsContact O-N 3.1Å; P1580-A1583 WeakPolarHBondContact O-CA 3.25Å; P1580-A1583 VanDerWaalsContact O-CB 3.29Å; P1580-A1583 WeakPolarHBondContact O-CB 3.41Å; P1580-A1583 PolarHBondContact O-N 3.32Å; P1580-D1612 VanDerWaalsContact CA-OD1 3.23Å; P1580-D1612 WeakPolarHBondContact CA-OD1 3.42Å
1581	A	84.3	Confident	85.9	Confident	20 Å²	20	57.2 Å²	57.2	17%	0.165	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-58.8	-28.8	-177	0	0	0	0	0	112.7	A1583 L1584 T1611 D1612 K1613	A1581-A1583 VanDerWaalsContact C-N 3.32Å; A1581-A1583 PolarHBondContact O-N 2.89Å; A1581-L1584 PolarHBondContact O-N 3.43Å; A1581-T1611 HydrophobicContact CB-CG2 4.49Å; A1581-D1612 PolarHBondContact N-OD1 3.11Å; A1581-K1613 HydrophobicContact CB-CD 4.36Å
1582	A	83	Confident	86.6	Confident	75 Å²	75	57.2 Å²	57.2	62%	0.62	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-66.2	-28.8	172.5	0	0	0	0	0	113.6	P1580 L1584 Q1585	P1580-A1582 PolarHBondContact O-N 3.08Å; P1580-A1582 VanDerWaalsContact O-N 3.1Å; A1582-L1584 VanDerWaalsContact C-N 3.28Å; A1582-L1584 PolarHBondContact O-N 3.24Å; A1582-Q1585 WeakPolarHBondContact O-CB 3.04Å; A1582-Q1585 PolarHBondContact O-N 2.83Å
1583	A	81.6	Confident	86.9	Confident	32 Å²	32	49.2 Å²	49.2	26%	0.264	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-73.6	-19.6	178.4	0	0	0	0	0	112.9	P1580 A1581 Q1585 D1586	P1580-A1583 WeakPolarHBondContact O-CA 3.25Å; P1580-A1583 VanDerWaalsContact O-CB 3.29Å; P1580-A1583 WeakPolarHBondContact O-CB 3.41Å; P1580-A1583 PolarHBondContact O-N 3.32Å; A1581-A1583 VanDerWaalsContact C-N 3.32Å; A1581-A1583 PolarHBondContact O-N 2.89Å; A1583-Q1585 PolarHBondContact O-N 2.92Å; A1583-D1586 PolarHBondContact O-N 3.43Å
1584	L	82.6	Confident	86.9	Confident	44 Å²	44	47.9 Å²	47.9	23%	0.23	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-72	-5.4	173.8	-56.5	179.9	0	0	0	113	A1581 A1582 L1590 L1593 T1611 I1658	A1581-L1584 PolarHBondContact O-N 3.43Å; A1582-L1584 VanDerWaalsContact C-N 3.28Å; A1582-L1584 PolarHBondContact O-N 3.24Å; L1584-L1590 HydrophobicContact CB-CD2 4.47Å; L1584-L1590 HydrophobicContact CD2-CD2 4.44Å; L1584-L1593 HydrophobicContact CD2-CD1 3.61Å; L1584-T1611 HydrophobicContact CD1-CG2 3.97Å; L1584-I1658 HydrophobicContact CD2-CD1 4.3Å
1585	Q	81.3	Confident	86.9	Confident	174 Å²	174	47.6 Å²	47.6	81%	0.813	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-84.4	-9.3	170.4	-58.4	-174.1	2	0	0	113.3	A1582 A1583	A1582-Q1585 WeakPolarHBondContact O-CB 3.04Å; A1582-Q1585 PolarHBondContact O-N 2.83Å; A1583-Q1585 PolarHBondContact O-N 2.92Å
1586	D	83.7	Confident	87	Confident	71 Å²	71	47.7 Å²	47.7	38%	0.38	25%	0.252	S	S	.	.			trans	-86.1	110.2	173.4	171.1	36.2	0	0	0	110.5	A1583 R1588 T1589 L1590	A1583-D1586 PolarHBondContact O-N 3.43Å; D1586-R1588 PolarHBondContact O-N 2.81Å; D1586-R1588 WeakPolarHBondContact OD1-CB 3.44Å; D1586-R1588 PolarHBondContact OD1-N 2.89Å; D1586-T1589 WeakPolarHBondContact O-CA 3.49Å; D1586-T1589 WeakPolarHBondContact O-CB 3.44Å; D1586-T1589 PolarHBondContact O-N 2.86Å; D1586-T1589 VanDerWaalsContact OD2-CB 3.31Å; D1586-T1589 WeakPolarHBondContact OD2-CB 3.34Å; D1586-T1589 PolarHBondContact OD2-N 3.4Å; D1586-T1589 PolarHBondContact OD2-OG1 3.09Å; D1586-L1590 PolarHBondContact O-N 3.15Å
1587	E	83.9	Confident	87	Confident	157 Å²	157	51.1 Å²	51.1	73%	0.734	27%	0.265	S	S	*	.	H	α-helix	trans	-47.2	-42.2	171.5	-177.4	-177.7	-157.9	0	0	111.7	T1589 L1590 E1591	E1587-T1589 PolarHBondContact O-N 2.83Å; E1587-L1590 PolarHBondContact O-N 3.08Å; E1587-E1591 PolarHBondContact O-N 3.05Å
1588	R	88.1	Confident	86.9	Confident	69 Å²	69	54.8 Å²	54.8	26%	0.26	28%	0.279	S	S	.	.	H	α-helix	trans	-74.4	-8.6	179.8	-174.1	50.3	-173	167.3	7.8	112.8	K1547 D1586 E1591 K1592	K1547-R1588 VanDerWaalsContact O-CZ 3.26Å; K1547-R1588 PolarHBondContact O-NH1 2.81Å; K1547-R1588 PolarHBondContact O-NH2 3.44Å; D1586-R1588 PolarHBondContact O-N 2.81Å; D1586-R1588 WeakPolarHBondContact OD1-CB 3.44Å; D1586-R1588 PolarHBondContact OD1-N 2.89Å; R1588-E1591 WeakPolarHBondContact CD-OE2 3.44Å; R1588-E1591 IonicContact CZ-OE2 2.78Å; R1588-E1591 IonicContact NE-OE2 3.75Å; R1588-E1591 IonicContact NH1-OE1 2.73Å; R1588-E1591 PolarHBondContact NH1-OE1 3.05Å; R1588-E1591 IonicContact NH1-OE2 3.42Å; R1588-E1591 PolarHBondContact NH1-OE2 2.85Å; R1588-K1592 VanDerWaalsContact O-CE 3.24Å; R1588-K1592 WeakPolarHBondContact O-CE 3.27Å; R1588-K1592 WeakPolarHBondContact O-CG 3.37Å; R1588-K1592 PolarHBondContact O-NZ 2.97Å
1589	T	85.2	Confident	87.1	Confident	23 Å²	23	55.1 Å²	55.1	14%	0.141	28%	0.279	C	S	.	.	H	α-helix	trans	-94.2	-40.7	170.9	-70.8	0	0	0	0	110.5	D1586 E1587 E1591 K1592 L1593	D1586-T1589 WeakPolarHBondContact O-CA 3.49Å; D1586-T1589 WeakPolarHBondContact O-CB 3.44Å; D1586-T1589 PolarHBondContact O-N 2.86Å; D1586-T1589 VanDerWaalsContact OD2-CB 3.31Å; D1586-T1589 WeakPolarHBondContact OD2-CB 3.34Å; D1586-T1589 PolarHBondContact OD2-N 3.4Å; D1586-T1589 PolarHBondContact OD2-OG1 3.09Å; E1587-T1589 PolarHBondContact O-N 2.83Å; T1589-E1591 VanDerWaalsContact C-N 3.34Å; T1589-E1591 PolarHBondContact O-N 3.43Å; T1589-K1592 PolarHBondContact O-N 3.26Å; T1589-K1592 VanDerWaalsContact O-N 3.07Å; T1589-K1592 PolarHBondContact OG1-NZ 3.12Å; T1589-L1593 HydrophobicContact CG2-CD1 4.08Å; T1589-L1593 HydrophobicContact CG2-CG 4.48Å; T1589-L1593 WeakPolarHBondContact O-CG 3.44Å; T1589-L1593 PolarHBondContact O-N 3.37Å
1590	L	86.9	Confident	87.4	Confident	41 Å²	41	53.2 Å²	53.2	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-45.3	169.6	-62.2	178.1	0	0	0	112.2	L1584 D1586 E1587 K1592 L1593 E1594 I1658	L1584-L1590 HydrophobicContact CB-CD2 4.47Å; L1584-L1590 HydrophobicContact CD2-CD2 4.44Å; D1586-L1590 PolarHBondContact O-N 3.15Å; E1587-L1590 PolarHBondContact O-N 3.08Å; L1590-K1592 VanDerWaalsContact C-N 3.26Å; L1590-K1592 PolarHBondContact O-N 3.35Å; L1590-L1593 HydrophobicContact CD2-CD1 4.48Å; L1590-L1593 PolarHBondContact O-N 2.82Å; L1590-E1594 PolarHBondContact O-N 3.4Å; L1590-I1658 HydrophobicContact CD2-CD1 3.84Å; L1590-I1658 HydrophobicContact CD2-CG2 4.4Å
1591	E	88.7	Confident	87.5	Confident	58 Å²	58	55.9 Å²	55.9	27%	0.271	28%	0.278	S	S	.	.	H	α-helix	trans	-51.8	-41.5	173.4	-84.7	-169.3	107.7	0	0	113.1	I1546 E1587 R1588 T1589 L1595	I1546-E1591 HydrophobicContact CG2-CB 3.76Å; I1546-E1591 HydrophobicContact CG2-CG 3.96Å; E1587-E1591 PolarHBondContact O-N 3.05Å; R1588-E1591 WeakPolarHBondContact CD-OE2 3.44Å; R1588-E1591 IonicContact CZ-OE2 2.78Å; R1588-E1591 IonicContact NE-OE2 3.75Å; R1588-E1591 IonicContact NH1-OE1 2.73Å; R1588-E1591 PolarHBondContact NH1-OE1 3.05Å; R1588-E1591 IonicContact NH1-OE2 3.42Å; R1588-E1591 PolarHBondContact NH1-OE2 2.85Å; T1589-E1591 VanDerWaalsContact C-N 3.34Å; T1589-E1591 PolarHBondContact O-N 3.43Å; E1591-L1595 WeakPolarHBondContact O-CG 3.47Å; E1591-L1595 PolarHBondContact O-N 2.86Å
1592	K	88.8	Confident	87.8	Confident	70 Å²	70	60.5 Å²	60.5	30%	0.304	30%	0.296	S	S	.	.	H	α-helix	trans	-75.2	-38	-178.1	-59.7	-179.7	-151.8	94.3	0	111.7	M1558 R1588 T1589 L1590 E1594 L1595 E1596	M1558-K1592 WeakPolarHBondContact CE-O 3.45Å; R1588-K1592 VanDerWaalsContact O-CE 3.24Å; R1588-K1592 WeakPolarHBondContact O-CE 3.27Å; R1588-K1592 WeakPolarHBondContact O-CG 3.37Å; R1588-K1592 PolarHBondContact O-NZ 2.97Å; T1589-K1592 PolarHBondContact O-N 3.26Å; T1589-K1592 VanDerWaalsContact O-N 3.07Å; T1589-K1592 PolarHBondContact OG1-NZ 3.12Å; L1590-K1592 VanDerWaalsContact C-N 3.26Å; L1590-K1592 PolarHBondContact O-N 3.35Å; K1592-E1594 VanDerWaalsContact C-N 3.31Å; K1592-L1595 PolarHBondContact O-N 2.9Å; K1592-E1596 PolarHBondContact O-N 3Å; K1592-E1596 VanDerWaalsContact O-N 3.14Å
1593	L	90.3	Very high	88.2	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-38.4	176.7	-70.2	170.8	0	0	0	110.8	Q1577 K1579 L1584 T1589 L1590 E1596 R1597 W1607 I1609	Q1577-L1593 HydrophobicContact CB-CD2 4.49Å; Q1577-L1593 HydrophobicContact CG-CD2 3.65Å; K1579-L1593 HydrophobicContact CG-CD2 4.44Å; L1584-L1593 HydrophobicContact CD2-CD1 3.61Å; T1589-L1593 HydrophobicContact CG2-CD1 4.08Å; T1589-L1593 HydrophobicContact CG2-CG 4.48Å; T1589-L1593 WeakPolarHBondContact O-CG 3.44Å; T1589-L1593 PolarHBondContact O-N 3.37Å; L1590-L1593 HydrophobicContact CD2-CD1 4.48Å; L1590-L1593 PolarHBondContact O-N 2.82Å; L1593-E1596 PolarHBondContact O-N 3.22Å; L1593-R1597 WeakPolarHBondContact O-CB 3.44Å; L1593-R1597 PolarHBondContact O-N 3.5Å; L1593-W1607 HydrophobicContact CB-CH2 4.04Å; L1593-W1607 HydrophobicContact CD2-CH2 3.97Å; L1593-W1607 HydrophobicContact CD2-CZ2 3.85Å; L1593-I1609 HydrophobicContact CD1-CD1 4.31Å
1594	E	88.9	Confident	88.5	Confident	28 Å²	28	67.6 Å²	67.6	13%	0.131	31%	0.309	C	S	.	.	H	α-helix	trans	-68.9	-36.9	176.1	177	60.9	-177.9	0	0	113.2	I1546 L1590 K1592 E1596 R1597 R1598	I1546-E1594 HydrophobicContact CD1-CB 3.96Å; I1546-E1594 HydrophobicContact CD1-CG 3.6Å; L1590-E1594 PolarHBondContact O-N 3.4Å; K1592-E1594 VanDerWaalsContact C-N 3.31Å; E1594-E1596 VanDerWaalsContact C-N 3.29Å; E1594-E1596 PolarHBondContact O-N 2.9Å; E1594-R1597 VanDerWaalsContact CD-NH2 3.26Å; E1594-R1597 IonicContact OE1-CZ 3.8Å; E1594-R1597 IonicContact OE1-NH2 3.54Å; E1594-R1597 PolarHBondContact OE1-NH2 3.22Å; E1594-R1597 IonicContact OE2-CZ 2.67Å; E1594-R1597 VanDerWaalsContact OE2-CZ 3.22Å; E1594-R1597 IonicContact OE2-NE 3.93Å; E1594-R1597 PolarHBondContact OE2-NE 3.36Å; E1594-R1597 IonicContact OE2-NH2 3.46Å; E1594-R1597 PolarHBondContact OE2-NH2 3.44Å; E1594-R1598 WeakPolarHBondContact O-CB 3.42Å; E1594-R1598 WeakPolarHBondContact O-CG 3.5Å; E1594-R1598 PolarHBondContact O-N 3.4Å; E1594-R1598 IonicContact OE1-CZ 2.98Å; E1594-R1598 IonicContact OE1-NE 3.1Å; E1594-R1598 PolarHBondContact OE1-NE 3.01Å; E1594-R1598 IonicContact OE1-NH2 3.51Å; E1594-R1598 PolarHBondContact OE1-NH2 3.49Å
1595	L	90.9	Very high	88.8	Confident	0 Å²	0	67 Å²	67	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-40.4	171.2	-70	177.3	0	0	0	112	I1540 A1541 I1546 M1558 E1591 K1592 Y1599	I1540-L1595 HydrophobicContact CG2-CD2 3.93Å; A1541-L1595 HydrophobicContact CB-CD2 3.78Å; I1546-L1595 HydrophobicContact CB-CD2 3.94Å; I1546-L1595 HydrophobicContact CB-CG 4.31Å; I1546-L1595 HydrophobicContact CD1-CD2 4.47Å; I1546-L1595 HydrophobicContact CG2-CD1 3.99Å; I1546-L1595 HydrophobicContact CG2-CD2 4.04Å; I1546-L1595 HydrophobicContact CG2-CG 3.86Å; M1558-L1595 HydrophobicContact CE-CB 4.08Å; M1558-L1595 HydrophobicContact SD-CB 4.42Å; M1558-L1595 HydrophobicContact SD-CD1 4.27Å; E1591-L1595 WeakPolarHBondContact O-CG 3.47Å; E1591-L1595 PolarHBondContact O-N 2.86Å; K1592-L1595 PolarHBondContact O-N 2.9Å; L1595-Y1599 PolarHBondContact O-N 3.14Å; L1595-Y1599 VanDerWaalsContact O-N 3.11Å
1596	E	91.8	Very high	89.1	Confident	3 Å²	3	60.3 Å²	60.3	1%	0.014	28%	0.278	C	S	.	.	H	α-helix	trans	-73	-45.6	-179.7	-178.5	-179.9	170.9	0	0	112.3	L1532 M1558 T1560 Q1577 K1592 L1593 E1594 R1598 Y1599 W1600 W1607	L1532-E1596 HydrophobicContact CD1-CB 4.34Å; L1532-E1596 HydrophobicContact CD1-CG 4Å; M1558-E1596 HydrophobicContact CE-CB 4.18Å; T1560-E1596 WeakPolarHBondContact CB-OE1 3.42Å; T1560-E1596 WeakPolarHBondContact CG2-OE1 3.47Å; T1560-E1596 PolarHBondContact OG1-OE1 3.31Å; Q1577-E1596 WeakPolarHBondContact CB-OE1 3.28Å; Q1577-E1596 VanDerWaalsContact CD-OE2 3.25Å; Q1577-E1596 WeakPolarHBondContact CG-OE1 3.29Å; Q1577-E1596 WeakPolarHBondContact CG-OE2 3.44Å; Q1577-E1596 PolarHBondContact NE2-OE1 2.87Å; Q1577-E1596 PolarHBondContact NE2-OE2 2.83Å; K1592-E1596 PolarHBondContact O-N 3Å; K1592-E1596 VanDerWaalsContact O-N 3.14Å; L1593-E1596 PolarHBondContact O-N 3.22Å; E1594-E1596 VanDerWaalsContact C-N 3.29Å; E1594-E1596 PolarHBondContact O-N 2.9Å; E1596-R1598 VanDerWaalsContact C-N 3.31Å; E1596-R1598 PolarHBondContact O-N 2.9Å; E1596-Y1599 WeakPolarHBondContact O-CB 3.11Å; E1596-Y1599 PolarHBondContact O-N 3.33Å; E1596-Y1599 VanDerWaalsContact O-N 3.08Å; E1596-W1600 VanDerWaalsContact O-CD1 3.26Å; E1596-W1600 PolarHBondContact O-N 3.09Å; E1596-W1607 HydrophobicContact CB-CZ2 4.35Å; E1596-W1607 VanDerWaalsContact CD-NE1 3.32Å; E1596-W1607 HydrophobicContact CG-CZ2 4.09Å; E1596-W1607 PolarHBondContact OE1-NE1 2.88Å
1597	R	90.6	Very high	89.3	Confident	71 Å²	71	58 Å²	58	27%	0.268	26%	0.264	S	S	.	.	H	α-helix	trans	-56.6	-44.7	173.9	-168.4	-166.9	65.9	66.1	7.4	111.2	L1593 E1594 Y1599 W1600 Q1601 W1607	L1593-R1597 WeakPolarHBondContact O-CB 3.44Å; L1593-R1597 PolarHBondContact O-N 3.5Å; E1594-R1597 VanDerWaalsContact CD-NH2 3.26Å; E1594-R1597 IonicContact OE1-CZ 3.8Å; E1594-R1597 IonicContact OE1-NH2 3.54Å; E1594-R1597 PolarHBondContact OE1-NH2 3.22Å; E1594-R1597 IonicContact OE2-CZ 2.67Å; E1594-R1597 VanDerWaalsContact OE2-CZ 3.22Å; E1594-R1597 IonicContact OE2-NE 3.93Å; E1594-R1597 PolarHBondContact OE2-NE 3.36Å; E1594-R1597 IonicContact OE2-NH2 3.46Å; E1594-R1597 PolarHBondContact OE2-NH2 3.44Å; R1597-Y1599 PolarHBondContact O-N 2.69Å; R1597-W1600 PolarHBondContact O-N 3.35Å; R1597-Q1601 VanDerWaalsContact O-CB 3.26Å; R1597-Q1601 WeakPolarHBondContact O-CB 3.25Å; R1597-Q1601 PolarHBondContact O-N 2.84Å; R1597-W1607 HydrophobicContact CB-CD2 4.29Å; R1597-W1607 HydrophobicContact CB-CE3 3.75Å; R1597-W1607 HydrophobicContact CB-CH2 4.17Å; R1597-W1607 HydrophobicContact CB-CZ3 3.69Å; R1597-W1607 HydrophobicContact CG-CD2 4.43Å; R1597-W1607 HydrophobicContact CG-CE3 3.62Å; R1597-W1607 HydrophobicContact CG-CZ3 3.8Å
1598	R	91.5	Very high	89.4	Confident	90 Å²	90	51.6 Å²	51.6	34%	0.34	23%	0.234	S	C	.	.	H	α-helix	trans	-64.4	-36	175.1	-75.3	-176.3	-167.6	-146.4	1.5	113	I1540 E1594 E1596 Q1602	I1540-R1598 HydrophobicContact CG2-CB 3.56Å; I1540-R1598 HydrophobicContact CG2-CG 4.36Å; E1594-R1598 WeakPolarHBondContact O-CB 3.42Å; E1594-R1598 WeakPolarHBondContact O-CG 3.5Å; E1594-R1598 PolarHBondContact O-N 3.4Å; E1594-R1598 IonicContact OE1-CZ 2.98Å; E1594-R1598 IonicContact OE1-NE 3.1Å; E1594-R1598 PolarHBondContact OE1-NE 3.01Å; E1594-R1598 IonicContact OE1-NH2 3.51Å; E1594-R1598 PolarHBondContact OE1-NH2 3.49Å; E1596-R1598 VanDerWaalsContact C-N 3.31Å; E1596-R1598 PolarHBondContact O-N 2.9Å; R1598-Q1602 WeakPolarHBondContact O-CB 3.31Å; R1598-Q1602 PolarHBondContact O-N 3.06Å
1599	Y	93.5	Very high	89.3	Confident	11 Å²	11	50.3 Å²	50.3	4%	0.043	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-51.3	175.1	176.3	-89.9	0	0	0	111.2	L1532 L1533 D1536 T1537 I1540 L1595 E1596 R1597 Q1602 K1603	L1532-Y1599 HydrophobicContact CB-CD1 4.4Å; L1532-Y1599 HydrophobicContact CB-CD2 4.42Å; L1532-Y1599 HydrophobicContact CB-CE1 4.2Å; L1532-Y1599 HydrophobicContact CB-CE2 4.21Å; L1532-Y1599 HydrophobicContact CB-CG 4.5Å; L1532-Y1599 HydrophobicContact CD1-CD1 4.33Å; L1532-Y1599 HydrophobicContact CD1-CG 4.43Å; L1532-Y1599 HydrophobicContact CD2-CD1 3.82Å; L1532-Y1599 HydrophobicContact CD2-CE1 3.64Å; L1532-Y1599 HydrophobicContact CG-CD1 4.39Å; L1532-Y1599 HydrophobicContact CG-CE1 4.4Å; L1533-Y1599 HydrophobicContact CB-CE2 4.11Å; L1533-Y1599 PolarHBondContact N-OH 3.43Å; D1536-Y1599 HydrophobicContact CB-CD2 3.9Å; D1536-Y1599 HydrophobicContact CB-CE2 3.78Å; T1537-Y1599 HydrophobicContact CG2-CD2 3.92Å; T1537-Y1599 HydrophobicContact CG2-CE2 4.5Å; T1537-Y1599 HydrophobicContact CG2-CG 4.4Å; I1540-Y1599 HydrophobicContact CD1-CD2 4.27Å; L1595-Y1599 PolarHBondContact O-N 3.14Å; L1595-Y1599 VanDerWaalsContact O-N 3.11Å; E1596-Y1599 WeakPolarHBondContact O-CB 3.11Å; E1596-Y1599 PolarHBondContact O-N 3.33Å; E1596-Y1599 VanDerWaalsContact O-N 3.08Å; R1597-Y1599 PolarHBondContact O-N 2.69Å; Y1599-Q1602 WeakPolarHBondContact O-CB 3.48Å; Y1599-Q1602 PolarHBondContact O-N 2.96Å; Y1599-K1603 HydrophobicContact CE1-CG 4.21Å; Y1599-K1603 WeakPolarHBondContact O-CG 3.17Å; Y1599-K1603 PolarHBondContact O-N 3.03Å; Y1599-K1603 VanDerWaalsContact O-N 3.13Å
1600	W	93.1	Very high	89.2	Confident	5 Å²	5	49.8 Å²	49.8	2%	0.019	23%	0.227	C	C	.	.	H	α-helix	trans	-69	-36.1	179.5	-66.2	113.4	0	0	0	112.8	F1530 L1532 T1560 L1563 A1575 E1596 R1597 Q1602 K1603 Q1604 I1605 W1607	F1530-W1600 AromaticContact CD1-CH2 3.87Å; F1530-W1600 HydrophobicContact CD1-CH2 3.87Å; F1530-W1600 HydrophobicContact CD1-CZ2 4.14Å; F1530-W1600 AromaticContact CE1-CH2 3.98Å; F1530-W1600 HydrophobicContact CE1-CH2 3.98Å; L1532-W1600 HydrophobicContact CD2-CZ2 3.63Å; T1560-W1600 PolarHBondContact OG1-NE1 3.05Å; L1563-W1600 HydrophobicContact CD1-CH2 3.77Å; L1563-W1600 HydrophobicContact CD1-CZ2 4.44Å; L1563-W1600 HydrophobicContact CD1-CZ3 3.98Å; L1563-W1600 HydrophobicContact CD2-CH2 4.07Å; L1563-W1600 HydrophobicContact CG-CH2 4.45Å; A1575-W1600 HydrophobicContact CB-CD2 3.87Å; A1575-W1600 HydrophobicContact CB-CE3 4.43Å; A1575-W1600 HydrophobicContact CB-CG 4.08Å; A1575-W1600 HydrophobicContact CB-CZ2 4.21Å; E1596-W1600 VanDerWaalsContact O-CD1 3.26Å; E1596-W1600 PolarHBondContact O-N 3.09Å; R1597-W1600 PolarHBondContact O-N 3.35Å; W1600-Q1602 VanDerWaalsContact C-N 3.29Å; W1600-Q1602 PolarHBondContact O-N 3.37Å; W1600-K1603 HydrophobicContact CE3-CB 4.45Å; W1600-K1603 HydrophobicContact CE3-CG 4.46Å; W1600-K1603 CarbonylContact O-C 3.59Å; W1600-K1603 WeakPolarHBondContact O-CA 3.41Å; W1600-K1603 PolarHBondContact O-N 3.18Å; W1600-Q1604 PolarHBondContact O-N 3.47Å; W1600-I1605 CarbonylContact C-O 3.5Å; W1600-I1605 HydrophobicContact CE3-CB 3.96Å; W1600-I1605 HydrophobicContact CE3-CD1 3.85Å; W1600-I1605 HydrophobicContact CE3-CG2 3.96Å; W1600-I1605 HydrophobicContact CZ3-CD1 3.74Å; W1600-I1605 HydrophobicContact CZ3-CG2 4.43Å; W1600-I1605 PolarHBondContact O-N 3.21Å; W1600-I1605 VanDerWaalsContact O-N 3.09Å; W1600-W1607 HydrophobicContact CB-CB 3.83Å; W1600-W1607 HydrophobicContact CB-CG 4.4Å; W1600-W1607 AromaticContact CD1-CD1 3.19Å; W1600-W1607 AromaticContact CD1-CG 3.81Å; W1600-W1607 AromaticContact CD1-NE1 3.86Å; W1600-W1607 HydrophobicContact CG-CB 4.17Å; W1600-W1607 HydrophobicContact CG-CG 4.35Å; W1600-W1607 AromaticContact NE1-CD1 3.71Å
1601	Q	89.4	Confident	89.1	Confident	124 Å²	124	48.2 Å²	48.2	58%	0.579	22%	0.22	S	C	*	.	H	α-helix	trans	-57.8	-39.8	169.6	-172.5	175.9	12.4	0	0	112.1	R1597 K1603 Q1604	R1597-Q1601 VanDerWaalsContact O-CB 3.26Å; R1597-Q1601 WeakPolarHBondContact O-CB 3.25Å; R1597-Q1601 PolarHBondContact O-N 2.84Å; Q1601-K1603 VanDerWaalsContact C-N 3.31Å; Q1601-K1603 PolarHBondContact O-N 3.45Å; Q1601-Q1604 PolarHBondContact O-N 2.74Å
1602	Q	90.5	Very high	88.7	Confident	116 Å²	116	49.7 Å²	49.7	54%	0.542	23%	0.229	S	C	.	.	H	α-helix	trans	-67.8	-28.6	174.6	-168.4	-173.5	15.4	0	0	112.7	R1598 Y1599 W1600 Q1604	R1598-Q1602 WeakPolarHBondContact O-CB 3.31Å; R1598-Q1602 PolarHBondContact O-N 3.06Å; Y1599-Q1602 WeakPolarHBondContact O-CB 3.48Å; Y1599-Q1602 PolarHBondContact O-N 2.96Å; W1600-Q1602 VanDerWaalsContact C-N 3.29Å; W1600-Q1602 PolarHBondContact O-N 3.37Å; Q1602-Q1604 VanDerWaalsContact C-N 3.33Å
1603	K	90.1	Very high	88.1	Confident	75 Å²	75	54 Å²	54	33%	0.326	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-1.8	174	-55.6	-53.2	176.4	-174.4	0	114	D1536 Y1599 W1600 Q1601 I1605	D1536-K1603 IonicContact OD2-NZ 2.85Å; D1536-K1603 PolarHBondContact OD2-NZ 2.96Å; Y1599-K1603 HydrophobicContact CE1-CG 4.21Å; Y1599-K1603 WeakPolarHBondContact O-CG 3.17Å; Y1599-K1603 PolarHBondContact O-N 3.03Å; Y1599-K1603 VanDerWaalsContact O-N 3.13Å; W1600-K1603 HydrophobicContact CE3-CB 4.45Å; W1600-K1603 HydrophobicContact CE3-CG 4.46Å; W1600-K1603 CarbonylContact O-C 3.59Å; W1600-K1603 WeakPolarHBondContact O-CA 3.41Å; W1600-K1603 PolarHBondContact O-N 3.18Å; Q1601-K1603 VanDerWaalsContact C-N 3.31Å; Q1601-K1603 PolarHBondContact O-N 3.45Å; K1603-I1605 HydrophobicContact CB-CD1 3.84Å; K1603-I1605 HydrophobicContact CB-CG1 4.25Å; K1603-I1605 PolarHBondContact O-N 3.08Å
1604	Q	89.8	Confident	87.2	Confident	181 Å²	181	56.9 Å²	56.9	85%	0.846	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	29.3	-173.5	-50.8	-172.8	-73.7	0	0	114	W1600 Q1601 Q1602	W1600-Q1604 PolarHBondContact O-N 3.47Å; Q1601-Q1604 PolarHBondContact O-N 2.74Å; Q1602-Q1604 VanDerWaalsContact C-N 3.33Å
1605	I	88.2	Confident	86.3	Confident	32 Å²	32	56.8 Å²	56.8	16%	0.164	26%	0.261	C	S	.	.			trans	-108.2	131.9	179.2	-67.5	162.2	0	0	0	108.7	Q1573 W1600 K1603	Q1573-I1605 VanDerWaalsContact OE1-CD1 3.22Å; W1600-I1605 CarbonylContact C-O 3.5Å; W1600-I1605 HydrophobicContact CE3-CB 3.96Å; W1600-I1605 HydrophobicContact CE3-CD1 3.85Å; W1600-I1605 HydrophobicContact CE3-CG2 3.96Å; W1600-I1605 HydrophobicContact CZ3-CD1 3.74Å; W1600-I1605 HydrophobicContact CZ3-CG2 4.43Å; W1600-I1605 PolarHBondContact O-N 3.21Å; W1600-I1605 VanDerWaalsContact O-N 3.09Å; K1603-I1605 HydrophobicContact CB-CD1 3.84Å; K1603-I1605 HydrophobicContact CB-CG1 4.25Å; K1603-I1605 PolarHBondContact O-N 3.08Å
1606	P	86.5	Confident	85.4	Confident	34 Å²	34	61 Å²	61	22%	0.221	28%	0.284	C	S	.	.			trans	-60.8	143.2	174	-21.1	31.9	0	0	0	112.2	F1571 F1574 A1575 F1608	F1571-P1606 HydrophobicContact CB-CG 4.16Å; F1571-P1606 HydrophobicContact CD1-CG 3.49Å; F1571-P1606 VanDerWaalsContact CD1-CG 3.49Å; F1571-P1606 HydrophobicContact CD2-CB 4.4Å; F1571-P1606 HydrophobicContact CD2-CG 3.98Å; F1571-P1606 HydrophobicContact CE1-CG 3.76Å; F1571-P1606 HydrophobicContact CE2-CB 4.43Å; F1571-P1606 HydrophobicContact CE2-CG 4.24Å; F1571-P1606 HydrophobicContact CG-CB 4.49Å; F1571-P1606 HydrophobicContact CG-CG 3.61Å; F1571-P1606 HydrophobicContact CZ-CG 4.13Å; F1574-P1606 HydrophobicContact CB-CB 4.21Å; A1575-P1606 PolarHBondContact N-O 2.79Å; P1606-F1608 HydrophobicContact CB-CE2 3.78Å; P1606-F1608 HydrophobicContact CB-CZ 3.88Å
1607	W	89.1	Confident	84.4	Confident	22 Å²	22	64.8 Å²	64.8	8%	0.083	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129.3	179.8	176	88.2	0	0	0	110.6	A1575 Q1577 L1593 E1596 R1597 W1600 I1609	A1575-W1607 HydrophobicContact CB-CB 4.34Å; A1575-W1607 HydrophobicContact CB-CG 4.44Å; A1575-W1607 WeakPolarHBondContact O-CA 3.44Å; Q1577-W1607 HydrophobicContact CB-CZ2 3.77Å; Q1577-W1607 HydrophobicContact CG-CZ2 4.18Å; L1593-W1607 HydrophobicContact CB-CH2 4.04Å; L1593-W1607 HydrophobicContact CD2-CH2 3.97Å; L1593-W1607 HydrophobicContact CD2-CZ2 3.85Å; E1596-W1607 HydrophobicContact CB-CZ2 4.35Å; E1596-W1607 VanDerWaalsContact CD-NE1 3.32Å; E1596-W1607 HydrophobicContact CG-CZ2 4.09Å; E1596-W1607 PolarHBondContact OE1-NE1 2.88Å; R1597-W1607 HydrophobicContact CB-CD2 4.29Å; R1597-W1607 HydrophobicContact CB-CE3 3.75Å; R1597-W1607 HydrophobicContact CB-CH2 4.17Å; R1597-W1607 HydrophobicContact CB-CZ3 3.69Å; R1597-W1607 HydrophobicContact CG-CD2 4.43Å; R1597-W1607 HydrophobicContact CG-CE3 3.62Å; R1597-W1607 HydrophobicContact CG-CZ3 3.8Å; W1600-W1607 HydrophobicContact CB-CB 3.83Å; W1600-W1607 HydrophobicContact CB-CG 4.4Å; W1600-W1607 AromaticContact CD1-CD1 3.19Å; W1600-W1607 AromaticContact CD1-CG 3.81Å; W1600-W1607 AromaticContact CD1-NE1 3.86Å; W1600-W1607 HydrophobicContact CG-CB 4.17Å; W1600-W1607 HydrophobicContact CG-CG 4.35Å; W1600-W1607 AromaticContact NE1-CD1 3.71Å; W1607-I1609 HydrophobicContact CE3-CG1 4.41Å; W1607-I1609 HydrophobicContact CH2-CD1 3.63Å; W1607-I1609 HydrophobicContact CH2-CG1 3.42Å; W1607-I1609 VanDerWaalsContact CH2-CG1 3.42Å; W1607-I1609 HydrophobicContact CZ2-CG1 4.08Å; W1607-I1609 HydrophobicContact CZ3-CD1 3.83Å; W1607-I1609 HydrophobicContact CZ3-CG1 3.6Å
1608	F	85.2	Confident	83.5	Confident	22 Å²	22	63.7 Å²	63.7	10%	0.096	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.7	-173.8	-56.7	-76.1	0	0	0	111.7	F1571 F1574 A1575 I1576 Q1577 P1606 F1610 L1649	F1571-F1608 HydrophobicContact CE2-CE2 4.42Å; F1571-F1608 AromaticContact CE2-CZ 3.89Å; F1571-F1608 HydrophobicContact CE2-CZ 3.89Å; F1574-F1608 HydrophobicContact CB-CD2 4.46Å; F1574-F1608 HydrophobicContact CB-CE2 4.02Å; F1574-F1608 HydrophobicContact CD2-CD2 4.28Å; F1574-F1608 HydrophobicContact CD2-CE2 4.36Å; F1574-F1608 HydrophobicContact CG-CE2 4.3Å; A1575-F1608 PolarHBondContact O-N 3.25Å; I1576-F1608 WeakPolarHBondContact CA-O 3.41Å; I1576-F1608 HydrophobicContact CG1-CB 4.5Å; Q1577-F1608 PolarHBondContact N-O 3.38Å; P1606-F1608 HydrophobicContact CB-CE2 3.78Å; P1606-F1608 HydrophobicContact CB-CZ 3.88Å; F1608-F1610 HydrophobicContact CB-CD2 4.3Å; F1608-F1610 HydrophobicContact CB-CE2 4.06Å; F1608-L1649 HydrophobicContact CD2-CD2 4.06Å; F1608-L1649 HydrophobicContact CE1-CD2 4.24Å; F1608-L1649 HydrophobicContact CE2-CD2 3.62Å; F1608-L1649 HydrophobicContact CZ-CD2 3.73Å
1609	I	85.8	Confident	82.3	Confident	42 Å²	42	60.8 Å²	60.8	22%	0.215	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	130.8	169.1	-59.7	174.9	0	0	0	108.6	Q1577 L1593 W1607 T1611 I1658	Q1577-I1609 WeakPolarHBondContact O-CA 3.39Å; L1593-I1609 HydrophobicContact CD1-CD1 4.31Å; W1607-I1609 HydrophobicContact CE3-CG1 4.41Å; W1607-I1609 HydrophobicContact CH2-CD1 3.63Å; W1607-I1609 HydrophobicContact CH2-CG1 3.42Å; W1607-I1609 VanDerWaalsContact CH2-CG1 3.42Å; W1607-I1609 HydrophobicContact CZ2-CG1 4.08Å; W1607-I1609 HydrophobicContact CZ3-CD1 3.83Å; W1607-I1609 HydrophobicContact CZ3-CG1 3.6Å; I1609-T1611 HydrophobicContact CG2-CG2 4.13Å; I1609-I1658 HydrophobicContact CD1-CD1 3.48Å; I1609-I1658 VanDerWaalsContact CD1-CD1 3.48Å; I1609-I1658 HydrophobicContact CD1-CG1 4.04Å
1610	F	83.8	Confident	81.2	Confident	13 Å²	13	62.3 Å²	62.3	6%	0.057	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.1	171	-85	-115.3	0	0	0	110.1	V1513 I1576 Q1577 V1578 K1579 F1608 E1614 L1645 I1648	V1513-F1610 HydrophobicContact CG2-CB 4.08Å; V1513-F1610 HydrophobicContact CG2-CD1 4.14Å; V1513-F1610 HydrophobicContact CG2-CG 4.38Å; I1576-F1610 HydrophobicContact CB-CD2 4.49Å; I1576-F1610 HydrophobicContact CD1-CD2 4.26Å; I1576-F1610 HydrophobicContact CD1-CE2 3.88Å; I1576-F1610 HydrophobicContact CD1-CZ 4.28Å; I1576-F1610 HydrophobicContact CG1-CD2 4.16Å; I1576-F1610 HydrophobicContact CG1-CE2 4Å; I1576-F1610 HydrophobicContact CG2-CB 4.12Å; I1576-F1610 HydrophobicContact CG2-CD2 3.56Å; I1576-F1610 HydrophobicContact CG2-CE2 4.25Å; I1576-F1610 HydrophobicContact CG2-CG 4.01Å; Q1577-F1610 PolarHBondContact O-N 2.86Å; V1578-F1610 WeakPolarHBondContact CA-O 3.18Å; V1578-F1610 HydrophobicContact CG2-CB 4.5Å; K1579-F1610 PolarHBondContact N-O 3Å; F1608-F1610 HydrophobicContact CB-CD2 4.3Å; F1608-F1610 HydrophobicContact CB-CE2 4.06Å; F1610-E1614 HydrophobicContact CD1-CB 4.37Å; F1610-L1645 HydrophobicContact CE1-CD2 4.31Å; F1610-L1645 HydrophobicContact CZ-CD2 3.96Å; F1610-I1648 HydrophobicContact CE1-CD1 4.44Å; F1610-I1648 HydrophobicContact CZ-CG2 4.24Å
1611	T	84.5	Confident	80.3	Confident	8 Å²	8	67.6 Å²	67.6	5%	0.049	33%	0.334	C	S	.	.			trans	-119.5	179.9	176.2	83.9	0	0	0	0	111.5	K1579 A1581 L1584 I1609 K1613 E1614	K1579-T1611 VanDerWaalsContact O-CA 3.29Å; K1579-T1611 WeakPolarHBondContact O-CA 3.28Å; K1579-T1611 WeakPolarHBondContact O-CB 3.34Å; K1579-T1611 WeakPolarHBondContact O-CG2 3.43Å; A1581-T1611 HydrophobicContact CB-CG2 4.49Å; L1584-T1611 HydrophobicContact CD1-CG2 3.97Å; I1609-T1611 HydrophobicContact CG2-CG2 4.13Å; T1611-K1613 PolarHBondContact O-N 2.79Å; T1611-K1613 VanDerWaalsContact O-N 3.14Å; T1611-K1613 PolarHBondContact OG1-N 2.83Å; T1611-K1613 VanDerWaalsContact OG1-N 3.14Å; T1611-E1614 VanDerWaalsContact CA-OE2 3.26Å; T1611-E1614 WeakPolarHBondContact CA-OE2 3.44Å; T1611-E1614 VanDerWaalsContact CB-OE2 3.23Å; T1611-E1614 WeakPolarHBondContact CB-OE2 3.27Å; T1611-E1614 PolarHBondContact N-OE2 2.78Å; T1611-E1614 PolarHBondContact O-N 3.37Å; T1611-E1614 PolarHBondContact OG1-OE2 2.89Å
1612	D	81.1	Confident	79.4	Confident	89 Å²	89	65.4 Å²	65.4	48%	0.476	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-7.2	171	47.5	-71	0	0	0	114.6	L1509 P1580 A1581	L1509-D1612 HydrophobicContact CD1-CB 4.2Å; P1580-D1612 VanDerWaalsContact CA-OD1 3.23Å; P1580-D1612 WeakPolarHBondContact CA-OD1 3.42Å; A1581-D1612 PolarHBondContact N-OD1 3.11Å
1613	K	76.1	Confident	78.4	Confident	161 Å²	161	60 Å²	60	70%	0.7	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-26	178.3	-62.1	178.9	-178.9	176.3	0	114.5	A1581 T1611	A1581-K1613 HydrophobicContact CB-CD 4.36Å; T1611-K1613 PolarHBondContact O-N 2.79Å; T1611-K1613 VanDerWaalsContact O-N 3.14Å; T1611-K1613 PolarHBondContact OG1-N 2.83Å; T1611-K1613 VanDerWaalsContact OG1-N 3.14Å
1614	E	71.7	Confident	77.5	Confident	68 Å²	68	60.2 Å²	60.2	32%	0.318	30%	0.303	S	S	.	.	S	Bend	trans	-87.8	-7.5	-176.5	-68.5	68.7	-137.8	0	0	112.7	F1610 T1611	F1610-E1614 HydrophobicContact CD1-CB 4.37Å; T1611-E1614 VanDerWaalsContact CA-OE2 3.26Å; T1611-E1614 WeakPolarHBondContact CA-OE2 3.44Å; T1611-E1614 VanDerWaalsContact CB-OE2 3.23Å; T1611-E1614 WeakPolarHBondContact CB-OE2 3.27Å; T1611-E1614 PolarHBondContact N-OE2 2.78Å; T1611-E1614 PolarHBondContact O-N 3.37Å; T1611-E1614 PolarHBondContact OG1-OE2 2.89Å
1615	I	69.7	Low	76.7	Confident	26 Å²	26	61.9 Å²	61.9	13%	0.133	30%	0.302	C	S	.	.	S	Bend	trans	-107.3	117.1	-176.5	-54.9	-175.9	0	0	0	109.8	L1509 A1512 V1513 P1617	L1509-I1615 HydrophobicContact CD1-CD1 3.72Å; L1509-I1615 HydrophobicContact CG-CD1 4.42Å; A1512-I1615 HydrophobicContact CB-CD1 3.73Å; A1512-I1615 HydrophobicContact CB-CG2 3.95Å; V1513-I1615 HydrophobicContact CG2-CD1 3.61Å; I1615-P1617 WeakPolarHBondContact O-CD 3.4Å
1616	N	72	Confident	75.7	Confident	87 Å²	87	62.1 Å²	62.1	47%	0.465	30%	0.303	S	S	.	.			trans	-69.8	119.6	171.6	-178	-21.7	0	0	0	109.9	V1618 V1619 K1620	N1616-V1618 VanDerWaalsContact C-N 3.31Å; N1616-V1618 PolarHBondContact O-N 3.36Å; N1616-V1618 WeakPolarHBondContact OD1-CB 3.07Å; N1616-V1618 PolarHBondContact OD1-N 3.07Å; N1616-V1619 HydrophobicContact CB-CB 4.13Å; N1616-V1619 HydrophobicContact CB-CG2 3.89Å; N1616-V1619 PolarHBondContact O-N 3.41Å; N1616-K1620 PolarHBondContact O-N 3.11Å; N1616-K1620 VanDerWaalsContact O-N 3.13Å
1617	P	71.2	Confident	74.9	Confident	83 Å²	83	62.4 Å²	62.4	54%	0.539	30%	0.3	S	S	.	.	H	α-helix	trans	-64.3	-33	-177.9	26	-34.3	0	0	0	113	I1615 K1620 E1621	I1615-P1617 WeakPolarHBondContact O-CD 3.4Å; P1617-K1620 WeakPolarHBondContact O-CB 3.33Å; P1617-K1620 PolarHBondContact O-N 2.92Å; P1617-E1621 WeakPolarHBondContact O-CG 3.42Å; P1617-E1621 PolarHBondContact O-N 2.72Å
1618	V	70.4	Confident	73.6	Confident	49 Å²	49	66.2 Å²	66.2	30%	0.297	33%	0.33	S	S	.	.	H	α-helix	trans	-66.4	-41.5	178	-179.9	0	0	0	0	110.9	T20 N1616 K1620 E1621 N1622	T20-V1618 HydrophobicContact CG2-CG1 4.18Å; T20-V1618 HydrophobicContact CG2-CG2 4.11Å; N1616-V1618 VanDerWaalsContact C-N 3.31Å; N1616-V1618 PolarHBondContact O-N 3.36Å; N1616-V1618 WeakPolarHBondContact OD1-CB 3.07Å; N1616-V1618 PolarHBondContact OD1-N 3.07Å; V1618-K1620 VanDerWaalsContact C-N 3.3Å; V1618-K1620 PolarHBondContact O-N 3.44Å; V1618-E1621 PolarHBondContact O-N 3.2Å; V1618-N1622 WeakPolarHBondContact O-CB 3.5Å; V1618-N1622 PolarHBondContact O-N 3.44Å; V1618-N1622 PolarHBondContact O-ND2 2.95Å
1619	V	67.6	Low	72.5	Confident	28 Å²	28	68.6 Å²	68.6	17%	0.17	35%	0.346	C	S	.	.	H	α-helix	trans	-63.9	-39.3	175.3	176.2	0	0	0	0	110.4	N1616 I1623 P1644	N1616-V1619 HydrophobicContact CB-CB 4.13Å; N1616-V1619 HydrophobicContact CB-CG2 3.89Å; N1616-V1619 PolarHBondContact O-N 3.41Å; V1619-I1623 HydrophobicContact CG1-CD1 3.74Å; V1619-I1623 HydrophobicContact CG1-CG1 4.48Å; V1619-I1623 WeakPolarHBondContact O-CB 3.43Å; V1619-I1623 VanDerWaalsContact O-CG1 3.25Å; V1619-I1623 WeakPolarHBondContact O-CG1 3.43Å; V1619-I1623 PolarHBondContact O-N 3.24Å; V1619-P1644 HydrophobicContact CG1-CG 4.43Å
1620	K	70.3	Confident	70.9	Confident	43 Å²	43	76 Å²	76	19%	0.187	38%	0.377	C	S	.	.	H	α-helix	trans	-61.1	-51.6	174.5	-175.7	-163	167.4	170.4	0	111.6	D1508 A1512 N1616 P1617 V1618 I1623 E1624	D1508-K1620 PolarHBondContact O-NZ 3.4Å; A1512-K1620 HydrophobicContact CB-CD 3.69Å; A1512-K1620 HydrophobicContact CB-CG 3.93Å; N1616-K1620 PolarHBondContact O-N 3.11Å; N1616-K1620 VanDerWaalsContact O-N 3.13Å; P1617-K1620 WeakPolarHBondContact O-CB 3.33Å; P1617-K1620 PolarHBondContact O-N 2.92Å; V1618-K1620 VanDerWaalsContact C-N 3.3Å; V1618-K1620 PolarHBondContact O-N 3.44Å; K1620-I1623 PolarHBondContact O-N 3.12Å; K1620-E1624 VanDerWaalsContact CE-CD 3.44Å; K1620-E1624 WeakPolarHBondContact CE-OE1 3.41Å; K1620-E1624 IonicContact NZ-OE1 2.84Å; K1620-E1624 PolarHBondContact NZ-OE1 3.02Å; K1620-E1624 PolarHBondContact O-N 3.31Å
1621	E	74.1	Confident	69.3	Low	116 Å²	116	78.4 Å²	78.4	54%	0.542	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-43.8	-177.5	-72.9	176	164	0	0	111.4	P1617 V1618 I1623 E1624 W1625	P1617-E1621 WeakPolarHBondContact O-CG 3.42Å; P1617-E1621 PolarHBondContact O-N 2.72Å; V1618-E1621 PolarHBondContact O-N 3.2Å; E1621-I1623 VanDerWaalsContact C-N 3.35Å; E1621-I1623 PolarHBondContact O-N 2.94Å; E1621-E1624 PolarHBondContact O-N 3.36Å; E1621-W1625 PolarHBondContact O-N 2.81Å
1622	N	70.5	Confident	67.6	Low	79 Å²	79	87.5 Å²	87.5	42%	0.422	44%	0.435	S	S	.	.	H	α-helix	trans	-58.9	-43.2	174.5	-70.9	-11.9	0	0	0	112.3	V1618 W1625 L1626	V1618-N1622 WeakPolarHBondContact O-CB 3.5Å; V1618-N1622 PolarHBondContact O-N 3.44Å; V1618-N1622 PolarHBondContact O-ND2 2.95Å; N1622-W1625 PolarHBondContact O-N 3.26Å; N1622-L1626 WeakPolarHBondContact O-CG 3.46Å; N1622-L1626 PolarHBondContact O-N 3.43Å
1623	I	69.4	Low	66.2	Low	1 Å²	1	92.2 Å²	92.2	1%	0.005	45%	0.454	C	S	.	.	H	α-helix	trans	-71	-39.6	178.1	-68.1	171.8	0	0	0	111.5	L1515 W1519 V1619 K1620 E1621 W1625 L1626 Y1627 L1642	L1515-I1623 HydrophobicContact CB-CG2 3.83Å; L1515-I1623 HydrophobicContact CD2-CG2 4.12Å; L1515-I1623 HydrophobicContact CG-CG2 4.37Å; W1519-I1623 VanDerWaalsContact CD1-CG2 3.43Å; W1519-I1623 HydrophobicContact CG-CG2 4.43Å; V1619-I1623 HydrophobicContact CG1-CD1 3.74Å; V1619-I1623 HydrophobicContact CG1-CG1 4.48Å; V1619-I1623 WeakPolarHBondContact O-CB 3.43Å; V1619-I1623 VanDerWaalsContact O-CG1 3.25Å; V1619-I1623 WeakPolarHBondContact O-CG1 3.43Å; V1619-I1623 PolarHBondContact O-N 3.24Å; K1620-I1623 PolarHBondContact O-N 3.12Å; E1621-I1623 VanDerWaalsContact C-N 3.35Å; E1621-I1623 PolarHBondContact O-N 2.94Å; I1623-W1625 PolarHBondContact O-N 3.36Å; I1623-L1626 PolarHBondContact O-N 3.09Å; I1623-Y1627 WeakPolarHBondContact O-CB 3.22Å; I1623-Y1627 PolarHBondContact O-N 3.26Å; I1623-L1642 HydrophobicContact CG1-CD2 4.41Å
1624	E	70.8	Confident	65.3	Low	81 Å²	81	86.7 Å²	86.7	38%	0.379	43%	0.434	S	S	.	.	H	α-helix	trans	-60.4	-34.5	173.9	-77.7	-172.4	175.2	0	0	111.8	L1511 L1515 K1620 E1621	L1511-E1624 VanDerWaalsContact CD2-OE1 3.28Å; L1511-E1624 WeakPolarHBondContact CD2-OE1 3.48Å; L1515-E1624 HydrophobicContact CD1-CG 3.37Å; K1620-E1624 VanDerWaalsContact CE-CD 3.44Å; K1620-E1624 WeakPolarHBondContact CE-OE1 3.41Å; K1620-E1624 IonicContact NZ-OE1 2.84Å; K1620-E1624 PolarHBondContact NZ-OE1 3.02Å; K1620-E1624 PolarHBondContact O-N 3.31Å; E1621-E1624 PolarHBondContact O-N 3.36Å
1625	W	72	Confident	64.6	Low	215 Å²	215	86.4 Å²	86.4	81%	0.814	44%	0.439	S	S	*	.	H	α-helix	trans	-68.4	-52.5	174.7	-144.2	79	0	0	0	112	E1621 N1622 I1623 Y1627 S1628	E1621-W1625 PolarHBondContact O-N 2.81Å; N1622-W1625 PolarHBondContact O-N 3.26Å; I1623-W1625 PolarHBondContact O-N 3.36Å; W1625-Y1627 VanDerWaalsContact C-N 3.26Å; W1625-Y1627 PolarHBondContact O-N 3.17Å; W1625-S1628 PolarHBondContact O-N 2.94Å; W1625-S1628 PolarHBondContact O-OG 2.91Å
1626	L	68.9	Low	64	Low	37 Å²	37	88.9 Å²	88.9	19%	0.194	46%	0.464	C	S	.	.	H	α-helix	trans	-64.5	-26.5	-179.7	-71.5	171	0	0	0	113.3	W1519 N1622 I1623 S1628 V1629 L1638 L1642	W1519-L1626 HydrophobicContact CZ2-CB 4.4Å; N1622-L1626 WeakPolarHBondContact O-CG 3.46Å; N1622-L1626 PolarHBondContact O-N 3.43Å; I1623-L1626 PolarHBondContact O-N 3.09Å; L1626-S1628 PolarHBondContact O-N 3.49Å; L1626-V1629 WeakPolarHBondContact O-CB 3.37Å; L1626-V1629 PolarHBondContact O-N 2.87Å; L1626-L1638 HydrophobicContact CD1-CD2 4.45Å; L1626-L1642 HydrophobicContact CD1-CD1 3.81Å
1627	Y	69.1	Low	63.3	Low	40 Å²	40	92.1 Å²	92.1	16%	0.157	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.5	-179.8	-149.9	-96.3	0	0	0	114.5	I1494 Y1495 L1515 E1518 I1623 W1625 V1629	I1494-Y1627 HydrophobicContact CD1-CD1 4.12Å; I1494-Y1627 HydrophobicContact CD1-CE1 3.6Å; I1494-Y1627 HydrophobicContact CD1-CE2 4.31Å; I1494-Y1627 HydrophobicContact CG1-CD1 4.38Å; I1494-Y1627 HydrophobicContact CG1-CE1 3.5Å; I1494-Y1627 VanDerWaalsContact CG1-CE1 3.5Å; Y1495-Y1627 PolarHBondContact O-OH 2.83Å; L1515-Y1627 HydrophobicContact CD2-CD2 3.39Å; L1515-Y1627 HydrophobicContact CD2-CE2 3.44Å; L1515-Y1627 VanDerWaalsContact CD2-CE2 3.44Å; L1515-Y1627 HydrophobicContact CD2-CG 4.15Å; E1518-Y1627 HydrophobicContact CG-CE2 3.95Å; I1623-Y1627 WeakPolarHBondContact O-CB 3.22Å; I1623-Y1627 PolarHBondContact O-N 3.26Å; W1625-Y1627 VanDerWaalsContact C-N 3.26Å; W1625-Y1627 PolarHBondContact O-N 3.17Å; Y1627-V1629 VanDerWaalsContact C-N 3.31Å
1628	S	61.6	Low	62.8	Low	103 Å²	103	91.4 Å²	91.4	72%	0.72	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-18.7	177.7	64.6	0	0	0	0	113.8	W1625 L1626	W1625-S1628 PolarHBondContact O-N 2.94Å; W1625-S1628 PolarHBondContact O-OG 2.91Å; L1626-S1628 PolarHBondContact O-N 3.49Å
1629	V	61.6	Low	62.1	Low	72 Å²	72	92.3 Å²	92.3	44%	0.436	47%	0.47	S	S	.	.	S	Bend	trans	-88.6	126.9	-173.5	-174.2	0	0	0	0	110.6	L1626 Y1627 T1631	L1626-V1629 WeakPolarHBondContact O-CB 3.37Å; L1626-V1629 PolarHBondContact O-N 2.87Å; Y1627-V1629 VanDerWaalsContact C-N 3.31Å; V1629-T1631 PolarHBondContact O-N 3.38Å
1630	K	53.1	Low	61.7	Low	196 Å²	196	94.6 Å²	94.6	85%	0.852	49%	0.492	S	S	*	.			trans	-73.4	111.1	172.9	-74.5	-176.9	175.3	-179.5	0	109.9	E1632	K1630-E1632 PolarHBondContact O-N 3.03Å; K1630-E1632 VanDerWaalsContact O-N 3.13Å
1631	T	50.4	Low	61.1	Low	65 Å²	65	100 Å²	100	40%	0.399	52%	0.518	S	S	.	.	S	Bend	trans	-75.6	95.8	-168.7	53.6	0	0	0	0	114.2	W1519 V1629 V1634	W1519-T1631 HydrophobicContact CH2-CG2 3.67Å; W1519-T1631 HydrophobicContact CZ2-CG2 4.32Å; W1519-T1631 HydrophobicContact CZ3-CG2 4.42Å; V1629-T1631 PolarHBondContact O-N 3.38Å; T1631-V1634 HydrophobicContact CG2-CG2 4.17Å
1632	E	47.5	Very low	60.3	Low	198 Å²	198	95.4 Å²	95.4	93%	0.925	50%	0.497	S	S	*	.	S	Bend	trans	-122.4	-8	149.3	-70.7	-170.3	155.6	0	0	112.9	K1630	K1630-E1632 PolarHBondContact O-N 3.03Å; K1630-E1632 VanDerWaalsContact O-N 3.13Å
1633	E	52.8	Low	59.6	Low	189 Å²	189	93.8 Å²	93.8	88%	0.883	49%	0.492	S	S	*	.	S	Bend	trans	-120.3	6.3	-167.7	-60.3	-174.1	140.2	0	0	115.9
1634	V	57.5	Low	59	Low	44 Å²	44	95.4 Å²	95.4	27%	0.267	50%	0.502	S	S	.	.			trans	-80.7	132.4	-177.8	-176.7	0	0	0	0	111.4	W1519 T1631 L1638 L1639	W1519-V1634 HydrophobicContact CH2-CG2 4.41Å; W1519-V1634 HydrophobicContact CZ3-CG1 4.42Å; T1631-V1634 HydrophobicContact CG2-CG2 4.17Å; V1634-L1638 HydrophobicContact CG1-CD2 4.22Å; V1634-L1639 HydrophobicContact CG1-CG 4.34Å
1635	S	55.8	Low	58.4	Low	63 Å²	63	91.8 Å²	91.8	44%	0.441	49%	0.486	S	S	.	.			trans	-76.3	147.3	-175.3	74.2	0	0	0	0	113.8	E1637 L1638 L1639	S1635-E1637 VanDerWaalsContact C-N 3.25Å; S1635-E1637 PolarHBondContact O-N 3.13Å; S1635-L1638 PolarHBondContact O-N 3.43Å; S1635-L1638 PolarHBondContact OG-N 3.16Å; S1635-L1639 PolarHBondContact O-N 3.39Å; S1635-L1639 VanDerWaalsContact O-N 3.12Å
1636	A	57.7	Low	57.7	Low	78 Å²	78	83.6 Å²	83.6	65%	0.645	46%	0.464	S	S	*	.	H	α-helix	trans	-64	-27.8	179	0	0	0	0	0	113.5	A1640	A1636-A1640 PolarHBondContact O-N 3.48Å
1637	E	57.1	Low	57.1	Low	155 Å²	155	87.5 Å²	87.5	72%	0.724	48%	0.481	S	S	*	.	H	α-helix	trans	-73.1	-39	177.4	-65.6	174.6	128.5	0	0	111.8	S1635 A1640 Q1641	S1635-E1637 VanDerWaalsContact C-N 3.25Å; S1635-E1637 PolarHBondContact O-N 3.13Å; E1637-A1640 PolarHBondContact O-N 2.77Å; E1637-Q1641 WeakPolarHBondContact O-CG 3.3Å; E1637-Q1641 PolarHBondContact O-N 3.01Å
1638	L	60.5	Low	56.6	Low	68 Å²	68	87.9 Å²	87.9	36%	0.356	49%	0.485	S	S	.	.	H	α-helix	trans	-67.4	-40.9	174.3	-168.3	73.2	0	0	0	110.8	L1626 V1634 S1635 A1640 Q1641 L1642	L1626-L1638 HydrophobicContact CD1-CD2 4.45Å; V1634-L1638 HydrophobicContact CG1-CD2 4.22Å; S1635-L1638 PolarHBondContact O-N 3.43Å; S1635-L1638 PolarHBondContact OG-N 3.16Å; L1638-A1640 VanDerWaalsContact C-N 3.32Å; L1638-A1640 PolarHBondContact O-N 2.78Å; L1638-Q1641 PolarHBondContact O-N 2.71Å; L1638-L1642 HydrophobicContact CG-CD1 4.21Å; L1638-L1642 WeakPolarHBondContact O-CG 3.27Å; L1638-L1642 PolarHBondContact O-N 3.05Å
1639	L	56.4	Low	56.5	Low	67 Å²	67	83.8 Å²	83.8	35%	0.351	46%	0.455	S	S	.	.	H	α-helix	trans	-55.7	-43.8	172.2	-84.6	160.3	0	0	0	112.5	W1519 V1634 S1635 Q1641 L1642	W1519-L1639 HydrophobicContact CE3-CD2 3.53Å; W1519-L1639 HydrophobicContact CZ3-CD2 3.74Å; V1634-L1639 HydrophobicContact CG1-CG 4.34Å; S1635-L1639 PolarHBondContact O-N 3.39Å; S1635-L1639 VanDerWaalsContact O-N 3.12Å; L1639-Q1641 VanDerWaalsContact C-N 3.28Å; L1639-Q1641 PolarHBondContact O-N 2.69Å; L1639-L1642 PolarHBondContact O-N 3.46Å; L1639-L1642 VanDerWaalsContact O-N 3.15Å
1640	A	58.3	Low	56.3	Low	76 Å²	76	87.5 Å²	87.5	63%	0.628	47%	0.467	S	S	*	.	H	α-helix	trans	-66.1	-28.2	179.1	0	0	0	0	0	113.4	A1636 E1637 L1638 L1642	A1636-A1640 PolarHBondContact O-N 3.48Å; E1637-A1640 PolarHBondContact O-N 2.77Å; L1638-A1640 VanDerWaalsContact C-N 3.32Å; L1638-A1640 PolarHBondContact O-N 2.78Å; A1640-L1642 VanDerWaalsContact C-N 3.28Å; A1640-L1642 PolarHBondContact O-N 2.88Å
1641	Q	59.1	Low	56.2	Low	156 Å²	156	85 Å²	85	73%	0.729	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.7	175.8	-66.8	174.7	12.3	0	0	113.4	E1637 L1638 L1639	E1637-Q1641 WeakPolarHBondContact O-CG 3.3Å; E1637-Q1641 PolarHBondContact O-N 3.01Å; L1638-Q1641 PolarHBondContact O-N 2.71Å; L1639-Q1641 VanDerWaalsContact C-N 3.28Å; L1639-Q1641 PolarHBondContact O-N 2.69Å
1642	L	55.4	Low	56.4	Low	20 Å²	20	87 Å²	87	11%	0.105	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	18.4	-172.8	-68.2	171.1	0	0	0	114.1	I1623 L1626 L1638 L1639 A1640 P1644	I1623-L1642 HydrophobicContact CG1-CD2 4.41Å; L1626-L1642 HydrophobicContact CD1-CD1 3.81Å; L1638-L1642 HydrophobicContact CG-CD1 4.21Å; L1638-L1642 WeakPolarHBondContact O-CG 3.27Å; L1638-L1642 PolarHBondContact O-N 3.05Å; L1639-L1642 PolarHBondContact O-N 3.46Å; L1639-L1642 VanDerWaalsContact O-N 3.15Å; A1640-L1642 VanDerWaalsContact C-N 3.28Å; A1640-L1642 PolarHBondContact O-N 2.88Å; L1642-P1644 WeakPolarHBondContact O-CD 3.41Å
1643	S	57.2	Low	56.3	Low	45 Å²	45	78.6 Å²	78.6	32%	0.315	43%	0.429	S	S	.	.			trans	-100.4	93.4	175.2	177.8	0	0	0	0	112.4	E1520	E1520-S1643 WeakPolarHBondContact OE2-CB 3.29Å; E1520-S1643 PolarHBondContact OE2-OG 2.99Å
1644	P	56.4	Low	56.1	Low	35 Å²	35	77.5 Å²	77.5	23%	0.227	43%	0.429	C	S	.	.			trans	-80.3	-23.1	172.6	32	-36.1	0	0	0	113.1	V1619 L1642 I1648	V1619-P1644 HydrophobicContact CG1-CG 4.43Å; L1642-P1644 WeakPolarHBondContact O-CD 3.41Å; P1644-I1648 WeakPolarHBondContact O-CG1 3.31Å
1645	L	58.5	Low	55.7	Low	6 Å²	6	80.8 Å²	80.8	3%	0.031	44%	0.441	C	S	.	.	H	α-helix	trans	-72.1	-36.6	-169.1	-86.5	158.7	0	0	0	113.5	L1517 E1520 F1610 H1647 I1648 L1649	L1517-L1645 HydrophobicContact CD2-CD1 3.71Å; L1517-L1645 HydrophobicContact CG-CD1 4.1Å; E1520-L1645 HydrophobicContact CB-CD1 3.93Å; E1520-L1645 HydrophobicContact CG-CB 4.39Å; E1520-L1645 HydrophobicContact CG-CD1 4.23Å; F1610-L1645 HydrophobicContact CE1-CD2 4.31Å; F1610-L1645 HydrophobicContact CZ-CD2 3.96Å; L1645-H1647 PolarHBondContact O-N 2.92Å; L1645-I1648 PolarHBondContact O-N 2.93Å; L1645-L1649 WeakPolarHBondContact O-CB 3.15Å; L1645-L1649 WeakPolarHBondContact O-CG 3.38Å; L1645-L1649 PolarHBondContact O-N 3.13Å
1646	A	56.5	Low	55.4	Low	43 Å²	43	81.9 Å²	81.9	36%	0.355	44%	0.443	S	S	.	.	H	α-helix	trans	-61.3	-43.2	-179.4	0	0	0	0	0	112.3	Q1650	A1646-Q1650 WeakPolarHBondContact O-CB 3.34Å; A1646-Q1650 WeakPolarHBondContact O-CG 3.35Å; A1646-Q1650 PolarHBondContact O-N 3.29Å
1647	H	56.8	Low	54.3	Low	119 Å²	119	84 Å²	84	55%	0.551	44%	0.442	S	S	*	.	H	α-helix	trans	-63.9	-47	179.6	-143.9	-65.2	0	0	0	111.4	L1645 Q1650 E1651	L1645-H1647 PolarHBondContact O-N 2.92Å; H1647-Q1650 PolarHBondContact O-N 3.24Å; H1647-E1651 IonicContact CE1-OE1 2.7Å; H1647-E1651 PolarHBondContact CE1-OE1 3.45Å; H1647-E1651 IonicContact CE1-OE2 3.9Å; H1647-E1651 PolarHBondContact CE1-OE2 3.29Å; H1647-E1651 VanDerWaalsContact ND1-CD 3.26Å; H1647-E1651 IonicContact ND1-OE1 3.27Å; H1647-E1651 IonicContact ND1-OE2 3.58Å; H1647-E1651 PolarHBondContact ND1-OE2 3.18Å; H1647-E1651 PolarHBondContact O-N 2.8Å
1648	I	58.3	Low	53.7	Low	47 Å²	47	79.5 Å²	79.5	24%	0.241	42%	0.422	C	S	.	.	H	α-helix	trans	-64	-43.9	-178.7	-64.2	169.5	0	0	0	111	F1610 P1644 L1645 K1652	F1610-I1648 HydrophobicContact CE1-CD1 4.44Å; F1610-I1648 HydrophobicContact CZ-CG2 4.24Å; P1644-I1648 WeakPolarHBondContact O-CG1 3.31Å; L1645-I1648 PolarHBondContact O-N 2.93Å; I1648-K1652 PolarHBondContact O-N 2.95Å
1649	L	60	Low	52.5	Low	17 Å²	17	84 Å²	84	9%	0.089	45%	0.446	C	S	.	.	H	α-helix	trans	-74.5	-25.9	-178.7	-68.9	171.2	0	0	0	113.6	F1574 F1608 L1645	F1574-L1649 HydrophobicContact CE1-CD1 4.32Å; F1574-L1649 HydrophobicContact CZ-CD1 4.16Å; F1608-L1649 HydrophobicContact CD2-CD2 4.06Å; F1608-L1649 HydrophobicContact CE1-CD2 4.24Å; F1608-L1649 HydrophobicContact CE2-CD2 3.62Å; F1608-L1649 HydrophobicContact CZ-CD2 3.73Å; L1645-L1649 WeakPolarHBondContact O-CB 3.15Å; L1645-L1649 WeakPolarHBondContact O-CG 3.38Å; L1645-L1649 PolarHBondContact O-N 3.13Å
1650	Q	56.4	Low	51.4	Low	150 Å²	150	88 Å²	88	70%	0.701	47%	0.474	S	S	*	.	H	α-helix	trans	-86.9	-43.4	178.7	-73.3	-175.5	-7.6	0	0	113.5	A1646 H1647	A1646-Q1650 WeakPolarHBondContact O-CB 3.34Å; A1646-Q1650 WeakPolarHBondContact O-CG 3.35Å; A1646-Q1650 PolarHBondContact O-N 3.29Å; H1647-Q1650 PolarHBondContact O-N 3.24Å
1651	E	52.5	Low	51.1	Low	145 Å²	145	88.7 Å²	88.7	68%	0.678	47%	0.466	S	S	*	.	H	α-helix	trans	-77.5	-29.9	-177.6	-71.8	-171	136.4	0	0	113.7	H1647	H1647-E1651 IonicContact CE1-OE1 2.7Å; H1647-E1651 PolarHBondContact CE1-OE1 3.45Å; H1647-E1651 IonicContact CE1-OE2 3.9Å; H1647-E1651 PolarHBondContact CE1-OE2 3.29Å; H1647-E1651 VanDerWaalsContact ND1-CD 3.26Å; H1647-E1651 IonicContact ND1-OE1 3.27Å; H1647-E1651 IonicContact ND1-OE2 3.58Å; H1647-E1651 PolarHBondContact ND1-OE2 3.18Å; H1647-E1651 PolarHBondContact O-N 2.8Å
1652	K	53.1	Low	50.7	Low	105 Å²	105	85.1 Å²	85.1	46%	0.457	45%	0.452	S	S	.	.	S	Bend	trans	-111	16.4	-173.5	-66	-167.8	171.8	-171.7	0	114.9	I1648 D1654 E1655	I1648-K1652 PolarHBondContact O-N 2.95Å; K1652-D1654 PolarHBondContact O-N 2.91Å; K1652-D1654 VanDerWaalsContact O-N 3.09Å; K1652-E1655 HydrophobicContact CB-CB 4.28Å; K1652-E1655 PolarHBondContact O-N 3.1Å
1653	G	47.1	Very low	50.4	Low	23 Å²	23	88.7 Å²	88.7	24%	0.237	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-35.2	-176	0	0	0	0	0	114.9	N1656	G1653-N1656 PolarHBondContact O-ND2 2.08Å; G1653-N1656 VanDerWaalsContact O-ND2 3.15Å
1654	D	47.8	Very low	50	Low	166 Å²	166	91.3 Å²	91.3	89%	0.888	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-15.4	176.4	-74.2	-39.3	0	0	0	114.2	K1652 N1656	K1652-D1654 PolarHBondContact O-N 2.91Å; K1652-D1654 VanDerWaalsContact O-N 3.09Å; D1654-N1656 PolarHBondContact O-N 2.71Å
1655	E	49.1	Very low	49.6	Very low	112 Å²	112	94.8 Å²	94.8	52%	0.523	50%	0.496	S	S	.	.			trans	-81.3	53.8	-178.6	-70.5	-155.6	143.2	0	0	112.9	K1652 I1657	K1652-E1655 HydrophobicContact CB-CB 4.28Å; K1652-E1655 PolarHBondContact O-N 3.1Å; E1655-I1657 HydrophobicContact CB-CD1 4.18Å; E1655-I1657 HydrophobicContact CB-CG1 4.25Å; E1655-I1657 HydrophobicContact CG-CD1 4.32Å; E1655-I1657 PolarHBondContact O-N 2.85Å
1656	N	48.3	Very low	49	Very low	87 Å²	87	100.7 Å²	100.7	47%	0.465	53%	0.527	S	S	.	.			trans	-75.6	56.6	173.5	-71.8	-69	0	0	0	111.9	G1653 D1654 I1658	G1653-N1656 PolarHBondContact O-ND2 2.08Å; G1653-N1656 VanDerWaalsContact O-ND2 3.15Å; D1654-N1656 PolarHBondContact O-N 2.71Å; N1656-I1658 PolarHBondContact O-N 3.04Å; N1656-I1658 VanDerWaalsContact O-N 3.09Å
1657	I	36.6	Very low	48.5	Very low	123 Å²	123	104.9 Å²	104.9	63%	0.631	54%	0.54	S	S	*	.			trans	-83.5	87.3	-170.5	-53.6	175.1	0	0	0	111.2	E1655	E1655-I1657 HydrophobicContact CB-CD1 4.18Å; E1655-I1657 HydrophobicContact CB-CG1 4.25Å; E1655-I1657 HydrophobicContact CG-CD1 4.32Å; E1655-I1657 PolarHBondContact O-N 2.85Å
1658	I	43.3	Very low	47.9	Very low	60 Å²	60	103.8 Å²	103.8	31%	0.308	54%	0.539	S	S	.	.				-127.9	99.9	124.4	-49.4	-176.4	0	0	0	107.6	L1584 L1590 I1609 N1656 V1660	L1584-I1658 HydrophobicContact CD2-CD1 4.3Å; L1590-I1658 HydrophobicContact CD2-CD1 3.84Å; L1590-I1658 HydrophobicContact CD2-CG2 4.4Å; I1609-I1658 HydrophobicContact CD1-CD1 3.48Å; I1609-I1658 VanDerWaalsContact CD1-CD1 3.48Å; I1609-I1658 HydrophobicContact CD1-CG1 4.04Å; N1656-I1658 PolarHBondContact O-N 3.04Å; N1656-I1658 VanDerWaalsContact O-N 3.09Å; I1658-V1660 HydrophobicContact CB-CG2 4.41Å; I1658-V1660 HydrophobicContact CG2-CG2 3.55Å; I1658-V1660 PolarHBondContact O-N 2.99Å
1659	N	36.4	Very low	47	Very low	162 Å²	162	108.5 Å²	108.5	87%	0.866	56%	0.564	S	S	*	*			trans	-86.4	98.3	167.6	-163.9	25.6	0	0	0	107.1
1660	V	33.2	Very low	45.8	Very low	152 Å²	152	116.8 Å²	116.8	92%	0.921	61%	0.607	S	S	*	*			trans	-81.8	0	-175	-175	0	0	0	0	111.1	I1658	I1658-V1660 HydrophobicContact CB-CG2 4.41Å; I1658-V1660 HydrophobicContact CG2-CG2 3.55Å; I1658-V1660 PolarHBondContact O-N 2.99Å

Retrieved 1,660 of 1,660 residues in 862.3 ms (Link to these results)

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