A0A077ZHG9_TRITR Loading...

DUF2184 and DUF2612 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZHG9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 2,222 aa.

						>A0A077ZHG9_TRITR|A0A077ZHG9
MIAEGNAVRAGGFCFAGTNKEVQVKGSDAAATEVAGLVVFDRYQAPIAELNGTLVNEGAEVAVVLRGFCYVVSTTEATKGQKVLVDKNTGAISTSSEDAAGDNIDTGWVVVTGGAANQTCEICRIYDNKELFARVQNKGIIGFDRVSNAAPANFITQPNINAPFGALAYIRPQAVEVLTAPMVADKLAAPVKNGVWGDELVQIKIKEYMGKTSPDDGLSSDGFQSTTNYSTETRGAYYYKSENYRADQAEAAMRSLAIDRNNFFFSGVEYKGLQAKVNGLLNDPSLGAYTAVAAEGANQAWAQKSPEAIANDITSAYAKLNAQSNGLVANGVKAAFPIKGKEIVIKAGGVINSVTDEEYTEIMKSYGPFIENRRLSEKNPSGYFIIQGDRKRAKDMNKEVGEIVLPLENQTRGVYLATAHQAYLILNPNLVDFDLSGVKKLKDGLIKELKSVKGARAGYFKNQKYPDGTPIAAVALRNEYGDIVQVTPELRKKFESVGMPLKKGVTTLRIPPRPFLRKALGRQEEWAKYVKENFDANLDGTISMKEIAHNVALMIETAIKDAIDSNIPPANSPRTIALKKSSHTLIDTERQVAVDDDKGTVTAEYDIQRIYSIQIDFYGDKACENAGLFNQTLMQNLQDEENDKVSLKYIGDVENRVFLAENKQYQKRYGFDIDLEFKQTLKGVKIMSLPWSAIVPASGVVESPAFATEKKHIILAVNNDLIPSSLPYIEVKGSDGVVAYGKEYGQSGFDYISLNKYFSFLSKDGNSPVKAIVARWFKDETAAFIKGVKPNESATAIIAKGKVGFNIAVDGAAKDVVFDLSTIEDDTPSYSDIAEVIDVEVKSAIGANASFVYSSVTGGFVLTGSTKGKTATLSQASNPVASDYADGSVLLGLSSAVVSNGVNAETFAEFCDRIYNANSGGFAITPCYGVVVTDEEKHAAIEWLQTVNDGQTYNTAAKLIFTFNDLQTLQAFQKEQGDMTGYVCVYSGHAPTYVNILDAAIGASVDYTIENGSINFNFQPADAYADDVVTNNGTVIDYQAGQTNSAMVNALNDSKASFVYELGFGSQKKTLYGFGYMNGNFGTEDVQLNESALEQNIQATVVNALVSLNKVKLRGADAKQFVSTLLSTPLNLFKTNGVIADGGDLTDLERVSITQATGNSAAADSVATNGYYILVRDITEEDIAKRQVRVLIVYLAAGVVNRYKTNRIYTDGFASDGIQWDDVEPASVDVGADGLPSVNMKPVVYTGTFTLKPNSNCRNMLDTIVQVATPAWNKDLVDYELTLTEINRTTGTMTVYSGGVLTTVNSGNTVDENSRQYLEYKDFGVSNGIGNILDDKVSLKDLKTMDLADYYIMQVVLIVRRQNEFVTENAVRQIDTFTSKFNQTMDALSNSAVGKFGRVAAAVGSAFSIKGYMDKVKEVRDINDIFRDLPLAQISDFINKIKLLGGTEEEATGFLKNMQSALAQFNAGKGGVLANVMNNLGLGVGDIKDAPELIERLQKALSSGKLTEKGFQVIMSDLGLSNVASLNRYMRLTSDEMDVLNNKSKRMGIVTQEDVNLVNDYQQSLVLLNGVFERLGQTLMRIGLKPIIDGITKGMEWFINQNESTQQAILGITAAFLFLPKVLGFVAGAFGGVAKGVVGVISAFNSLVGLLFSPIGLLVILGVLIAGVATNFGGMHDALDEAIDDFNKWLDTLGNGNPIIEGLKQSLIDLVDVISHPIKAFNQLMEVYDALEKSDPSDTFIGKLKNLHSAYMITDFSKNRGDNPQAKNMDDVTQADFSEVIGGNYTIDTSKIIGAPIPDATGCSVAIRMDTAIIGGMPITLKSERFKALNGSDYFVGSFYHTGETKDTSLTIKDDSVKIKASKVELEADTVNIAGGGAGVARIGDTVDVNKGIITGGSSKVFAGLEIKTGLQALAQDTRTRLSMCKGENPYDKDEGIDYDNDMLGKMGGIAFNRRQHNSHGDNRMNECQQVVLDNLQRQFGYTNLSDLIVKKSEVWDKFFGNFSERFVEDILDFKTCVPAALDYYWGRLYGITRTFLGPNDEVITLDDNIFREIIAIKAFGCRWNGTAKEANEFFGELFKDRGVLYMSDSGTGVLRYDFIFQLTDLEVYLFTHKDILPREAGIGFELHVLDVKNTFGFYGTELQPWSQANATGTYLASINEGYPEVTMTPADEGGVPPAGGDLNGMFYLLSQFYYFNQNGGAYTFNQKISEAIGGYPKDAVL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24	Very low	40.3	Very low	173 Å²	173	92.2 Å²	92.2	85%	0.852	51%	0.511	S	S	*	.				0	116.4	0	-64.2	155.9	172.6	0	0	105.7	Q23	M1-Q23 VanDerWaalsContact CB-OE1 3.28Å; M1-Q23 VanDerWaalsContact N-CD 3.26Å
2	I	29.9	Very low	41.8	Very low	134 Å²	134	85.7 Å²	85.7	69%	0.687	48%	0.481	S	S	*	.			trans	-78.6	153	173.5	-64.7	168.2	0	0	0	106.6	E4	I2-E4 PolarHBondContact O-N 2.83Å
3	A	34.1	Very low	43.8	Very low	30 Å²	30	80.2 Å²	80.2	25%	0.248	45%	0.449	C	S	.	.			trans	-76.1	81.1	167.7	0	0	0	0	0	109.4
4	E	30.9	Very low	45.1	Very low	139 Å²	139	75.6 Å²	75.6	65%	0.65	42%	0.424	S	S	*	.			trans	-65.6	139.9	175.5	-74.1	143.4	-153.1	0	0	111.1	I2	I2-E4 PolarHBondContact O-N 2.83Å
5	G	40.8	Very low	46	Very low	36 Å²	36	70.8 Å²	70.8	37%	0.371	40%	0.397	S	S	.	.	S	Bend	trans	84.3	-151	175.8	0	0	0	0	0	116	A7 V8	G5-A7 PolarHBondContact O-N 3.38Å; G5-V8 PolarHBondContact O-N 3.29Å
6	N	42.9	Very low	46.5	Very low	137 Å²	137	68.5 Å²	68.5	73%	0.733	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	5.1	-152.8	-58.9	-6.4	0	0	0	117.4
7	A	45	Very low	46.5	Very low	55 Å²	55	65.8 Å²	65.8	46%	0.455	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-20.9	179.6	0	0	0	0	0	113.6	G5	G5-A7 PolarHBondContact O-N 3.38Å
8	V	44.2	Very low	46.1	Very low	49 Å²	49	70.8 Å²	70.8	30%	0.297	41%	0.412	S	S	.	.			trans	-87	122	-178.1	-170.2	0	0	0	0	110.4	G5 V38 F40	G5-V8 PolarHBondContact O-N 3.29Å; V8-V38 HydrophobicContact CG1-CG1 4.07Å; V8-F40 HydrophobicContact CG1-CE1 4.33Å; V8-F40 HydrophobicContact CG1-CZ 3.81Å
9	R	49.1	Very low	45.7	Very low	192 Å²	192	72.1 Å²	72.1	73%	0.725	42%	0.418	S	S	*	.			trans	-111.1	144.2	174.4	-66.8	-172.8	177.1	-161.1	0.6	111.1	G12	R9-G12 PolarHBondContact O-N 3.49Å
10	A	49.6	Very low	45.3	Very low	50 Å²	50	78.5 Å²	78.5	41%	0.413	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	133.3	177.4	0	0	0	0	0	111.2	G12 F40	A10-G12 PolarHBondContact O-N 3.18Å; A10-F40 HydrophobicContact CB-CD2 3.78Å; A10-F40 HydrophobicContact CB-CE2 3.72Å
11	G	52.6	Low	44.9	Very low	19 Å²	19	83.3 Å²	83.3	20%	0.196	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	11.1	179.4	0	0	0	0	0	114.8	L37 V38 I92	G11-L37 WeakPolarHBondContact O-CD1 3.16Å; G11-V38 WeakPolarHBondContact CA-O 3.3Å; G11-V38 PolarHBondContact N-O 3.13Å; G11-I92 VanDerWaalsContact O-CD1 3.22Å; G11-I92 WeakPolarHBondContact O-CD1 3.31Å
12	G	58.8	Low	45.6	Very low	14 Å²	14	79.5 Å²	79.5	14%	0.144	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-80.8	155.7	175.9	0	0	0	0	0	112.9	R9 A10 V38	R9-G12 PolarHBondContact O-N 3.49Å; A10-G12 PolarHBondContact O-N 3.18Å; G12-V38 PolarHBondContact O-N 3.2Å
13	F	67.2	Low	46	Very low	15 Å²	15	77.8 Å²	77.8	7%	0.066	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	145.3	170.2	-71	-81.9	0	0	0	111.8	V34 L37 V83 V85 I92 T106 W108 I122	F13-V34 HydrophobicContact CB-CG1 3.92Å; F13-V34 HydrophobicContact CB-CG2 4.44Å; F13-V34 HydrophobicContact CD1-CG1 3.7Å; F13-V34 HydrophobicContact CG-CG1 4.15Å; F13-L37 HydrophobicContact CD1-CB 4.09Å; F13-L37 HydrophobicContact CD1-CD1 3.93Å; F13-L37 HydrophobicContact CD2-CD1 4.28Å; F13-L37 HydrophobicContact CE1-CB 3.95Å; F13-L37 HydrophobicContact CE1-CD1 3.79Å; F13-L37 HydrophobicContact CE1-CG 4.43Å; F13-L37 HydrophobicContact CE2-CD1 4.15Å; F13-L37 HydrophobicContact CG-CD1 4.18Å; F13-L37 HydrophobicContact CZ-CD1 3.92Å; F13-V83 HydrophobicContact CE2-CG1 3.7Å; F13-V83 HydrophobicContact CZ-CG1 3.86Å; F13-V85 HydrophobicContact CB-CB 4.38Å; F13-V85 HydrophobicContact CB-CG1 4.07Å; F13-V85 HydrophobicContact CB-CG2 4.27Å; F13-V85 HydrophobicContact CD2-CB 3.99Å; F13-V85 HydrophobicContact CD2-CG1 4.35Å; F13-V85 HydrophobicContact CD2-CG2 4.25Å; F13-V85 HydrophobicContact CG-CG1 4.42Å; F13-I92 HydrophobicContact CD2-CD1 3.75Å; F13-I92 HydrophobicContact CD2-CG1 3.87Å; F13-I92 HydrophobicContact CE2-CD1 3.67Å; F13-I92 HydrophobicContact CE2-CG1 3.98Å; F13-I92 HydrophobicContact CE2-CG2 4.5Å; F13-T106 HydrophobicContact CD1-CG2 3.97Å; F13-T106 HydrophobicContact CD2-CG2 3.72Å; F13-T106 HydrophobicContact CE1-CG2 3.91Å; F13-T106 HydrophobicContact CE2-CG2 3.67Å; F13-T106 HydrophobicContact CG-CG2 3.86Å; F13-T106 HydrophobicContact CZ-CG2 3.76Å; F13-W108 AromaticContact CE1-CD1 3.73Å; F13-W108 HydrophobicContact CE1-CG 4.28Å; F13-W108 AromaticContact CE1-NE1 3.76Å; F13-W108 HydrophobicContact CZ-CG 4.41Å; F13-I122 HydrophobicContact CZ-CD1 3.84Å
14	C	62.3	Low	46.3	Very low	15 Å²	15	80.4 Å²	80.4	10%	0.101	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.4	179	164.5	0	0	0	0	110.1	V24 V34 A35 G36 V38	C14-V24 WeakPolarHBondContact SG-CG1 3.18Å; C14-V34 CarbonylContact O-C 3.56Å; C14-V34 WeakPolarHBondContact O-CA 3.31Å; C14-A35 PolarHBondContact O-N 3.49Å; C14-G36 PolarHBondContact N-O 2.83Å; C14-V38 HydrophobicContact CB-CG2 3.7Å
15	F	58.7	Low	46.9	Very low	4 Å²	4	79 Å²	79	2%	0.018	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	149.9	-177.1	-59.4	-81.8	0	0	0	112.8	G17 A31 E33 V34 V85 K87 I104	F15-G17 PolarHBondContact O-N 2.84Å; F15-A31 HydrophobicContact CB-CB 3.63Å; F15-A31 HydrophobicContact CG-CB 4.38Å; F15-E33 WeakPolarHBondContact CA-O 3.35Å; F15-V34 HydrophobicContact CD1-CG2 3.86Å; F15-V34 HydrophobicContact CE1-CG2 3.74Å; F15-V85 HydrophobicContact CE1-CG1 3.65Å; F15-V85 HydrophobicContact CZ-CB 4.4Å; F15-V85 HydrophobicContact CZ-CG1 3.64Å; F15-V85 HydrophobicContact CZ-CG2 3.9Å; F15-K87 HydrophobicContact CE1-CB 4.14Å; F15-K87 HydrophobicContact CZ-CB 4.27Å; F15-I104 HydrophobicContact CD1-CD1 4.11Å; F15-I104 HydrophobicContact CE1-CD1 3.95Å
16	A	53.6	Low	47.3	Very low	34 Å²	34	78.5 Å²	78.5	28%	0.281	43%	0.434	S	S	.	.			trans	-81.5	114.2	-177.4	0	0	0	0	0	112.2	E33 A35	A16-E33 HydrophobicContact CB-CB 4.18Å; A16-E33 PolarHBondContact N-O 3.1Å; A16-A35 HydrophobicContact CB-CB 4.39Å
17	G	46.4	Very low	47.6	Very low	22 Å²	22	75 Å²	75	23%	0.227	42%	0.421	C	S	.	.			trans	-70.1	155.6	163.9	0	0	0	0	0	111.8	F15 N19	F15-G17 PolarHBondContact O-N 2.84Å; G17-N19 PolarHBondContact O-N 2.95Å
18	T	39.6	Very low	48	Very low	156 Å²	156	75 Å²	75	96%	0.957	41%	0.412	S	S	*	.	S	Bend	trans	-73.6	26.2	-166.6	37.9	0	0	0	0	116.9
19	N	38.9	Very low	48.8	Very low	96 Å²	96	75.6 Å²	75.6	51%	0.513	42%	0.423	S	S	.	.			trans	-144.4	126.3	163.7	-169	-14.6	0	0	0	111	G17 E21	G17-N19 PolarHBondContact O-N 2.95Å; N19-E21 VanDerWaalsContact C-N 3.32Å; N19-E21 PolarHBondContact O-N 3Å; N19-E21 PolarHBondContact OD1-N 3.48Å
20	K	37.1	Very low	49.3	Very low	200 Å²	200	70.2 Å²	70.2	87%	0.87	42%	0.419	S	S	*	.	S	Bend	trans	-72.9	-20.2	-174.5	-69	-173	175	-176.7	0	114.3
21	E	37.9	Very low	49.7	Very low	179 Å²	179	68.2 Å²	68.2	84%	0.836	40%	0.403	S	S	*	.	S	Bend	trans	-98.1	-20.4	-175.1	-63.6	-174.5	156.3	0	0	113.5	N19	N19-E21 VanDerWaalsContact C-N 3.32Å; N19-E21 PolarHBondContact O-N 3Å; N19-E21 PolarHBondContact OD1-N 3.48Å
22	V	39	Very low	50.2	Low	93 Å²	93	72.9 Å²	72.9	56%	0.564	43%	0.428	S	S	*	.	S	Bend	trans	-149.4	132.4	-178.3	-144.1	0	0	0	0	112.7
23	Q	37	Very low	50.4	Low	99 Å²	99	77.8 Å²	77.8	46%	0.463	45%	0.447	S	S	.	.			trans	78	89.4	166.7	-38.9	-162.5	29.8	0	0	117	M1	M1-Q23 VanDerWaalsContact CB-OE1 3.28Å; M1-Q23 VanDerWaalsContact N-CD 3.26Å
24	V	41.1	Very low	50.3	Low	85 Å²	85	78.1 Å²	78.1	52%	0.515	45%	0.45	S	S	.	.			trans	-66.6	129.7	157.4	173.5	0	0	0	0	109.4	C14	C14-V24 WeakPolarHBondContact SG-CG1 3.18Å
25	K	43.2	Very low	50.3	Low	108 Å²	108	79.5 Å²	79.5	47%	0.47	46%	0.463	S	S	.	.			trans	-100.2	160.1	169.1	-68.4	-175.1	-178.4	179.8	0	110.4	D28	K25-D28 WeakPolarHBondContact CD-OD2 3.43Å; K25-D28 IonicContact NZ-OD2 2.73Å; K25-D28 PolarHBondContact NZ-OD2 3.33Å; K25-D28 VanDerWaalsContact NZ-OD2 3.15Å
26	G	48.6	Very low	50.6	Low	26 Å²	26	79.4 Å²	79.4	27%	0.268	46%	0.463	S	S	.	.	S	Bend	trans	-67.8	-170.4	164.7	0	0	0	0	0	111.9	D28	G26-D28 PolarHBondContact O-N 2.78Å
27	S	50.5	Low	51.3	Low	65 Å²	65	77.9 Å²	77.9	46%	0.455	45%	0.45	S	S	.	.	S	Bend	trans	-50.8	98.6	-179.7	55	0	0	0	0	112.7
28	D	53.3	Low	52.1	Low	53 Å²	53	77.6 Å²	77.6	28%	0.283	44%	0.444	S	S	.	.			trans	-109	117.5	179	-171.2	-26.3	0	0	0	106.7	K25 G26 A30 A31	K25-D28 WeakPolarHBondContact CD-OD2 3.43Å; K25-D28 IonicContact NZ-OD2 2.73Å; K25-D28 PolarHBondContact NZ-OD2 3.33Å; K25-D28 VanDerWaalsContact NZ-OD2 3.15Å; G26-D28 PolarHBondContact O-N 2.78Å; D28-A30 PolarHBondContact O-N 2.74Å; D28-A30 WeakPolarHBondContact OD1-CB 3.3Å; D28-A30 PolarHBondContact OD1-N 2.83Å; D28-A31 HydrophobicContact CB-CB 4.46Å; D28-A31 WeakPolarHBondContact O-CB 3.09Å; D28-A31 PolarHBondContact O-N 2.86Å
29	A	59.4	Low	53.2	Low	62 Å²	62	72.9 Å²	72.9	51%	0.512	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.2	-176.4	0	0	0	0	0	113.4
30	A	60.9	Low	54	Low	79 Å²	79	70.3 Å²	70.3	65%	0.653	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.3	173	0	0	0	0	0	114.3	D28	D28-A30 PolarHBondContact O-N 2.74Å; D28-A30 WeakPolarHBondContact OD1-CB 3.3Å; D28-A30 PolarHBondContact OD1-N 2.83Å
31	A	57.3	Low	54.5	Low	9 Å²	9	65 Å²	65	7%	0.074	38%	0.38	C	S	.	.			trans	-78.1	137.9	-179.2	0	0	0	0	0	111.9	F15 D28 I104	F15-A31 HydrophobicContact CB-CB 3.63Å; F15-A31 HydrophobicContact CG-CB 4.38Å; D28-A31 HydrophobicContact CB-CB 4.46Å; D28-A31 WeakPolarHBondContact O-CB 3.09Å; D28-A31 PolarHBondContact O-N 2.86Å; A31-I104 WeakPolarHBondContact O-CD1 3.26Å
32	T	64.1	Low	55.1	Low	116 Å²	116	65.7 Å²	65.7	71%	0.712	38%	0.375	S	S	*	.			trans	-115.7	-7.3	-172.9	56.3	0	0	0	0	114.4
33	E	62.4	Low	55.4	Low	118 Å²	118	67.9 Å²	67.9	55%	0.551	37%	0.374	S	S	*	.	S	Bend	trans	-133.3	143.2	-179.6	-67.5	-176.2	173.1	0	0	110.5	F15 A16	F15-E33 WeakPolarHBondContact CA-O 3.35Å; A16-E33 HydrophobicContact CB-CB 4.18Å; A16-E33 PolarHBondContact N-O 3.1Å
34	V	66	Low	55.6	Low	22 Å²	22	72.4 Å²	72.4	13%	0.133	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	120.7	170.3	169	0	0	0	0	109	F13 C14 F15 V85 I104 T106	F13-V34 HydrophobicContact CB-CG1 3.92Å; F13-V34 HydrophobicContact CB-CG2 4.44Å; F13-V34 HydrophobicContact CD1-CG1 3.7Å; F13-V34 HydrophobicContact CG-CG1 4.15Å; C14-V34 CarbonylContact O-C 3.56Å; C14-V34 WeakPolarHBondContact O-CA 3.31Å; F15-V34 HydrophobicContact CD1-CG2 3.86Å; F15-V34 HydrophobicContact CE1-CG2 3.74Å; V34-V85 HydrophobicContact CG2-CG1 3.71Å; V34-I104 HydrophobicContact CG2-CG2 3.97Å; V34-T106 HydrophobicContact CG2-CG2 4.33Å
35	A	61.7	Low	55.7	Low	44 Å²	44	70.6 Å²	70.6	36%	0.364	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-30.4	179.4	0	0	0	0	0	113	C14 A16 L65	C14-A35 PolarHBondContact O-N 3.49Å; A16-A35 HydrophobicContact CB-CB 4.39Å; A35-L65 WeakPolarHBondContact O-CD2 3.16Å
36	G	65.7	Low	55.7	Low	2 Å²	2	70.1 Å²	70.1	2%	0.021	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.9	177.3	178.9	0	0	0	0	0	113.2	C14	C14-G36 PolarHBondContact N-O 2.83Å
37	L	68.2	Low	55.4	Low	2 Å²	2	74.2 Å²	74.2	1%	0.01	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	138.1	169.2	-177.8	68.7	0	0	0	109.2	G11 F13 V39 V63 V64 C69 V71 W108	G11-L37 WeakPolarHBondContact O-CD1 3.16Å; F13-L37 HydrophobicContact CD1-CB 4.09Å; F13-L37 HydrophobicContact CD1-CD1 3.93Å; F13-L37 HydrophobicContact CD2-CD1 4.28Å; F13-L37 HydrophobicContact CE1-CB 3.95Å; F13-L37 HydrophobicContact CE1-CD1 3.79Å; F13-L37 HydrophobicContact CE1-CG 4.43Å; F13-L37 HydrophobicContact CE2-CD1 4.15Å; F13-L37 HydrophobicContact CG-CD1 4.18Å; F13-L37 HydrophobicContact CZ-CD1 3.92Å; L37-V39 HydrophobicContact CD2-CG2 4.28Å; L37-V39 HydrophobicContact CG-CG2 4.28Å; L37-V63 CarbonylContact O-C 3.48Å; L37-V63 WeakPolarHBondContact O-CA 3.48Å; L37-V64 PolarHBondContact N-O 3.34Å; L37-V64 PolarHBondContact O-N 2.78Å; L37-C69 HydrophobicContact CD2-CB 3.52Å; L37-V71 HydrophobicContact CD1-CG1 4.09Å; L37-V71 HydrophobicContact CD2-CG1 4.25Å; L37-W108 HydrophobicContact CB-CZ2 4.35Å
38	V	63.3	Low	55.1	Low	16 Å²	16	75.4 Å²	75.4	10%	0.097	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.5	177.1	152.6	0	0	0	0	110.9	V8 G11 G12 C14 V61 V63	V8-V38 HydrophobicContact CG1-CG1 4.07Å; G11-V38 WeakPolarHBondContact CA-O 3.3Å; G11-V38 PolarHBondContact N-O 3.13Å; G12-V38 PolarHBondContact O-N 3.2Å; C14-V38 HydrophobicContact CB-CG2 3.7Å; V38-V61 HydrophobicContact CB-CG1 4.47Å; V38-V61 HydrophobicContact CG1-CG1 3.52Å; V38-V61 HydrophobicContact CG2-CG1 4.33Å; V38-V63 HydrophobicContact CG2-CG2 4.13Å
39	V	61.5	Low	54.7	Low	57 Å²	57	80.8 Å²	80.8	35%	0.345	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	138.2	-180	-163	0	0	0	0	108.5	L37 A62 V64	L37-V39 HydrophobicContact CD2-CG2 4.28Å; L37-V39 HydrophobicContact CG-CG2 4.28Å; V39-A62 PolarHBondContact N-O 2.92Å; V39-A62 PolarHBondContact O-N 2.97Å; V39-V64 HydrophobicContact CB-CG2 4.44Å; V39-V64 HydrophobicContact CG2-CB 4.38Å; V39-V64 HydrophobicContact CG2-CG2 3.68Å
40	F	57.1	Low	54	Low	41 Å²	41	80.6 Å²	80.6	18%	0.18	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129	174.4	-71.4	-65.7	0	0	0	110	V8 A10 V55 V61	V8-F40 HydrophobicContact CG1-CE1 4.33Å; V8-F40 HydrophobicContact CG1-CZ 3.81Å; A10-F40 HydrophobicContact CB-CD2 3.78Å; A10-F40 HydrophobicContact CB-CE2 3.72Å; F40-V55 HydrophobicContact CE1-CG1 3.73Å; F40-V55 HydrophobicContact CE1-CG2 3.89Å; F40-V55 HydrophobicContact CE2-CG2 4.12Å; F40-V55 HydrophobicContact CZ-CB 4.46Å; F40-V55 HydrophobicContact CZ-CG1 4.16Å; F40-V55 HydrophobicContact CZ-CG2 3.43Å; F40-V55 VanDerWaalsContact CZ-CG2 3.43Å; F40-V61 HydrophobicContact CD1-CG2 3.92Å; F40-V61 HydrophobicContact CE1-CG2 3.76Å
41	D	46.4	Very low	53.1	Low	89 Å²	89	83.9 Å²	83.9	48%	0.476	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	149.8	179.2	-147.3	-36.3	0	0	0	110.1	Y43 E60	D41-Y43 PolarHBondContact O-N 3.39Å; D41-E60 HydrophobicContact CB-CB 3.95Å; D41-E60 PolarHBondContact N-O 3.37Å; D41-E60 VanDerWaalsContact N-O 3.09Å
42	R	50	Low	52.4	Low	193 Å²	193	86.9 Å²	86.9	73%	0.728	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	3.6	176.6	-38.4	-179.2	-164.5	-147.1	3.6	117.3	Q44 E60	R42-Q44 PolarHBondContact O-N 3.28Å; R42-E60 IonicContact CZ-OE2 2.68Å; R42-E60 IonicContact NE-OE2 2.6Å; R42-E60 PolarHBondContact NE-OE2 3.04Å; R42-E60 IonicContact NH2-OE1 3.15Å; R42-E60 PolarHBondContact NH2-OE1 3.06Å; R42-E60 IonicContact NH2-OE2 3.21Å; R42-E60 PolarHBondContact NH2-OE2 2.87Å
43	Y	45.1	Very low	51.2	Low	140 Å²	140	86 Å²	86	55%	0.549	47%	0.471	S	S	.	.			trans	-86.3	92.9	-179.2	-140.2	-90.3	0	0	0	113	D41 A45 L50	D41-Y43 PolarHBondContact O-N 3.39Å; Y43-A45 HydrophobicContact CD1-CB 4.22Å; Y43-A45 HydrophobicContact CE1-CB 3.83Å; Y43-L50 HydrophobicContact CD1-CD1 4.19Å; Y43-L50 HydrophobicContact CE1-CD1 3.87Å; Y43-L50 HydrophobicContact CE1-CD2 3.81Å; Y43-L50 HydrophobicContact CE1-CG 4.12Å
44	Q	41.6	Very low	50.2	Low	194 Å²	194	86.1 Å²	86.1	91%	0.907	48%	0.475	S	S	*	.			trans	-89	-4.5	-178.8	-73.8	-172.7	-28.9	0	0	115.6	R42	R42-Q44 PolarHBondContact O-N 3.28Å
45	A	44.4	Very low	49	Very low	47 Å²	47	87.7 Å²	87.7	39%	0.388	49%	0.485	S	S	.	.	S	Bend	trans	-76.2	145.4	-178	0	0	0	0	0	112.2	Y43 I47	Y43-A45 HydrophobicContact CD1-CB 4.22Å; Y43-A45 HydrophobicContact CE1-CB 3.83Å; A45-I47 PolarHBondContact O-N 2.82Å
46	P	42.1	Very low	48.2	Very low	97 Å²	97	91.9 Å²	91.9	63%	0.63	50%	0.501	S	S	*	.			trans	-57.7	127.4	176.5	-24.8	34.8	0	0	0	112.6	A48 E49	P46-A48 PolarHBondContact O-N 3Å; P46-E49 PolarHBondContact O-N 3.33Å
47	I	43.6	Very low	47	Very low	112 Å²	112	100.1 Å²	100.1	57%	0.574	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-55.6	-23	-174.1	-79.1	173.8	0	0	0	114	A45 E49 L50	A45-I47 PolarHBondContact O-N 2.82Å; I47-E49 PolarHBondContact O-N 2.73Å; I47-E49 VanDerWaalsContact O-N 3.09Å; I47-L50 PolarHBondContact O-N 3.17Å
48	A	44.2	Very low	45.7	Very low	90 Å²	90	103.8 Å²	103.8	74%	0.744	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-57.7	-22.3	-179.1	0	0	0	0	0	115	P46	P46-A48 PolarHBondContact O-N 3Å
49	E	44	Very low	44.8	Very low	166 Å²	166	105.5 Å²	105.5	78%	0.776	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-93.9	-7	-177.8	-60.8	-167.4	162.9	0	0	114.3	P46 I47 N51	P46-E49 PolarHBondContact O-N 3.33Å; I47-E49 PolarHBondContact O-N 2.73Å; I47-E49 VanDerWaalsContact O-N 3.09Å; E49-N51 PolarHBondContact O-N 2.91Å
50	L	44.7	Very low	44	Very low	58 Å²	58	107.8 Å²	107.8	30%	0.304	60%	0.6	S	S	.	*			trans	-77.7	51.2	-175.2	-76.8	170	0	0	0	114.5	Y43 I47 G52 T53	Y43-L50 HydrophobicContact CD1-CD1 4.19Å; Y43-L50 HydrophobicContact CE1-CD1 3.87Å; Y43-L50 HydrophobicContact CE1-CD2 3.81Å; Y43-L50 HydrophobicContact CE1-CG 4.12Å; I47-L50 PolarHBondContact O-N 3.17Å; L50-G52 PolarHBondContact O-N 3.17Å; L50-T53 WeakPolarHBondContact CD2-OG1 3.43Å
51	N	42.2	Very low	43.7	Very low	149 Å²	149	109 Å²	109	80%	0.797	61%	0.612	S	S	*	*	S	Bend	trans	-76.2	91.3	174.4	-87.7	-64	0	0	0	112.1	E49	E49-N51 PolarHBondContact O-N 2.91Å
52	G	42.6	Very low	44.1	Very low	71 Å²	71	106.4 Å²	106.4	73%	0.732	60%	0.602	S	S	*	*	S	Bend	trans	82.7	12	161.3	0	0	0	0	0	116.8	L50 L54	L50-G52 PolarHBondContact O-N 3.17Å; G52-L54 PolarHBondContact O-N 3.17Å
53	T	37.5	Very low	44.6	Very low	97 Å²	97	100.8 Å²	100.8	60%	0.595	59%	0.589	S	S	*	*			trans	-69.6	122.5	172.3	44.6	0	0	0	0	111.3	L50	L50-T53 WeakPolarHBondContact CD2-OG1 3.43Å
54	L	42.7	Very low	45.4	Very low	121 Å²	121	95.9 Å²	95.9	63%	0.634	57%	0.574	S	S	*	*			trans	-67.2	142.1	176	-66.2	87	0	0	0	110.8	G52 N56	G52-L54 PolarHBondContact O-N 3.17Å; L54-N56 PolarHBondContact O-N 3.08Å
55	V	41.4	Very low	46.3	Very low	55 Å²	55	90.8 Å²	90.8	33%	0.333	55%	0.552	S	S	.	*			trans	-72.9	115.8	167.7	-176.6	0	0	0	0	107.7	F40 A59	F40-V55 HydrophobicContact CE1-CG1 3.73Å; F40-V55 HydrophobicContact CE1-CG2 3.89Å; F40-V55 HydrophobicContact CE2-CG2 4.12Å; F40-V55 HydrophobicContact CZ-CB 4.46Å; F40-V55 HydrophobicContact CZ-CG1 4.16Å; F40-V55 HydrophobicContact CZ-CG2 3.43Å; F40-V55 VanDerWaalsContact CZ-CG2 3.43Å; V55-A59 HydrophobicContact CG1-CB 4.02Å
56	N	42.9	Very low	47.1	Very low	132 Å²	132	93.5 Å²	93.5	71%	0.706	55%	0.552	S	S	*	*			trans	-68.4	143.5	176.4	-69.6	-42.7	0	0	0	110.9	L54 G58 A59	L54-N56 PolarHBondContact O-N 3.08Å; N56-G58 PolarHBondContact O-N 3.41Å; N56-A59 WeakPolarHBondContact O-CB 3.36Å; N56-A59 PolarHBondContact O-N 3.41Å
57	E	40.6	Very low	48.2	Very low	175 Å²	175	90.8 Å²	90.8	82%	0.818	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	125.3	172.9	-163.9	-178.9	144.7	0	0	110
58	G	42.9	Very low	49.5	Very low	80 Å²	80	91.8 Å²	91.8	83%	0.825	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	4.4	-177	0	0	0	0	0	116.8	N56	N56-G58 PolarHBondContact O-N 3.41Å
59	A	43.7	Very low	50.8	Low	52 Å²	52	88.2 Å²	88.2	43%	0.43	51%	0.512	S	S	.	.			trans	-65.8	139.2	168.4	0	0	0	0	0	111.8	V55 N56	V55-A59 HydrophobicContact CG1-CB 4.02Å; N56-A59 WeakPolarHBondContact O-CB 3.36Å; N56-A59 PolarHBondContact O-N 3.41Å
60	E	44.6	Very low	52.3	Low	104 Å²	104	87.8 Å²	87.8	49%	0.486	50%	0.504	S	S	.	.			trans	-75.5	133.6	178.9	-72	175.3	152.4	0	0	111.8	D41 R42	D41-E60 HydrophobicContact CB-CB 3.95Å; D41-E60 PolarHBondContact N-O 3.37Å; D41-E60 VanDerWaalsContact N-O 3.09Å; R42-E60 IonicContact CZ-OE2 2.68Å; R42-E60 IonicContact NE-OE2 2.6Å; R42-E60 PolarHBondContact NE-OE2 3.04Å; R42-E60 IonicContact NH2-OE1 3.15Å; R42-E60 PolarHBondContact NH2-OE1 3.06Å; R42-E60 IonicContact NH2-OE2 3.21Å; R42-E60 PolarHBondContact NH2-OE2 2.87Å
61	V	49.8	Very low	53.9	Low	68 Å²	68	85.3 Å²	85.3	41%	0.412	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	117.5	-175.4	-172	0	0	0	0	109.4	V38 F40	V38-V61 HydrophobicContact CB-CG1 4.47Å; V38-V61 HydrophobicContact CG1-CG1 3.52Å; V38-V61 HydrophobicContact CG2-CG1 4.33Å; F40-V61 HydrophobicContact CD1-CG2 3.92Å; F40-V61 HydrophobicContact CE1-CG2 3.76Å
62	A	55.3	Low	55.6	Low	34 Å²	34	81.2 Å²	81.2	28%	0.281	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.8	179.3	0	0	0	0	0	110.9	V39	V39-A62 PolarHBondContact N-O 2.92Å; V39-A62 PolarHBondContact O-N 2.97Å
63	V	60.8	Low	57.5	Low	74 Å²	74	77.9 Å²	77.9	45%	0.448	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	105.5	171.8	-176.6	0	0	0	0	109.1	L37 V38 L65	L37-V63 CarbonylContact O-C 3.48Å; L37-V63 WeakPolarHBondContact O-CA 3.48Å; V38-V63 HydrophobicContact CG2-CG2 4.13Å; V63-L65 HydrophobicContact CG1-CD2 3.88Å
64	V	62.4	Low	59.7	Low	38 Å²	38	76.4 Å²	76.4	23%	0.23	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	117.3	177.5	-176.6	0	0	0	0	109.6	L37 V39 R66 W108	L37-V64 PolarHBondContact N-O 3.34Å; L37-V64 PolarHBondContact O-N 2.78Å; V39-V64 HydrophobicContact CB-CG2 4.44Å; V39-V64 HydrophobicContact CG2-CB 4.38Å; V39-V64 HydrophobicContact CG2-CG2 3.68Å; V64-R66 WeakPolarHBondContact CG1-O 3.45Å; V64-W108 HydrophobicContact CG1-CH2 4.18Å
65	L	60.9	Low	61.8	Low	86 Å²	86	73.4 Å²	73.4	45%	0.45	42%	0.415	S	S	.	.			trans	-98.9	-19	-178.1	-59.6	176.7	0	0	0	113.3	A35 V63 R124	A35-L65 WeakPolarHBondContact O-CD2 3.16Å; V63-L65 HydrophobicContact CG1-CD2 3.88Å; L65-R124 WeakPolarHBondContact O-CD 3.3Å
66	R	59.6	Low	64	Low	105 Å²	105	77.1 Å²	77.1	40%	0.396	43%	0.429	S	S	.	.	S	Bend	trans	-156.6	156.6	-171.2	-61.4	-172.8	169.4	-173.3	-11.9	110	V64 Y126	V64-R66 WeakPolarHBondContact CG1-O 3.45Å; R66-Y126 HydrophobicContact CG-CE2 3.95Å; R66-Y126 PolarHBondContact NE-OH 3.28Å; R66-Y126 VanDerWaalsContact NE-OH 3.11Å
67	G	65.4	Low	66.2	Low	39 Å²	39	71 Å²	71	40%	0.402	40%	0.396	S	S	.	.	S	Bend	trans	118.2	-172.3	177.7	0	0	0	0	0	112.4	W108 C123	G67-W108 VanDerWaalsContact O-CZ3 3.29Å; G67-W108 WeakPolarHBondContact O-CZ3 2.99Å; G67-C123 WeakPolarHBondContact O-CA 3.42Å; G67-C123 VanDerWaalsContact O-CB 3.32Å; G67-C123 WeakPolarHBondContact O-CB 3.36Å
68	F	71.2	Confident	68.5	Low	133 Å²	133	66.1 Å²	66.1	58%	0.583	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	140.9	165	-62.1	-92.8	0	0	0	108.7	V111 E121 I122 C123	F68-V111 HydrophobicContact CD1-CG1 4.41Å; F68-V111 HydrophobicContact CD1-CG2 4.09Å; F68-V111 HydrophobicContact CE1-CG1 4.05Å; F68-V111 HydrophobicContact CE1-CG2 3.95Å; F68-E121 HydrophobicContact CD1-CG 4.5Å; F68-E121 WeakPolarHBondContact CD1-OE1 3.46Å; F68-I122 CarbonylContact C-O 3.58Å; F68-I122 WeakPolarHBondContact CA-O 3.46Å; F68-C123 HydrophobicContact CD1-CB 3.63Å; F68-C123 HydrophobicContact CE1-CB 3.86Å; F68-C123 HydrophobicContact CG-CB 4.15Å
69	C	72.2	Confident	70.6	Confident	16 Å²	16	70.1 Å²	70.1	11%	0.108	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	151.8	-178.8	-71.4	0	0	0	0	110.3	L37 W108 E121 I122	L37-C69 HydrophobicContact CD2-CB 3.52Å; C69-W108 HydrophobicContact CB-CH2 4.38Å; C69-W108 HydrophobicContact CB-CZ3 3.95Å; C69-E121 WeakPolarHBondContact O-CA 3.13Å; C69-I122 HydrophobicContact CB-CG1 4.07Å; C69-I122 PolarHBondContact N-O 2.85Å; C69-I122 WeakPolarHBondContact O-CG1 3.38Å; C69-I122 PolarHBondContact O-N 2.66Å
70	Y	75.5	Confident	72.3	Confident	157 Å²	157	70.3 Å²	70.3	62%	0.616	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.1	176	-66.2	-75.1	0	0	0	110	T119 C120 E121	Y70-T119 HydrophobicContact CD1-CG2 4.03Å; Y70-T119 HydrophobicContact CG-CG2 4.27Å; Y70-C120 WeakPolarHBondContact CA-O 3.27Å; Y70-E121 HydrophobicContact CD1-CB 4.04Å; Y70-E121 HydrophobicContact CD1-CG 4.25Å; Y70-E121 HydrophobicContact CE1-CB 3.8Å; Y70-E121 HydrophobicContact CE1-CG 3.82Å
71	V	77.6	Confident	74.4	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.03	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	158.9	177.8	-61.6	0	0	0	0	110.2	L37 I92 T119 C120 I122	L37-V71 HydrophobicContact CD1-CG1 4.09Å; L37-V71 HydrophobicContact CD2-CG1 4.25Å; V71-I92 HydrophobicContact CB-CD1 4.15Å; V71-I92 HydrophobicContact CG1-CD1 4.22Å; V71-I92 HydrophobicContact CG2-CG2 4.38Å; V71-T119 CarbonylContact O-C 3.57Å; V71-T119 WeakPolarHBondContact O-CA 3.43Å; V71-C120 PolarHBondContact N-O 3.21Å; V71-C120 PolarHBondContact O-N 3.46Å; V71-I122 HydrophobicContact CB-CD1 4.46Å; V71-I122 HydrophobicContact CG1-CD1 3.72Å; V71-I122 HydrophobicContact CG1-CG1 4.23Å; V71-I122 HydrophobicContact CG2-CD1 3.84Å; V71-I122 HydrophobicContact CG2-CG1 4.04Å; V71-I122 HydrophobicContact CG2-CG2 3.74Å
72	V	78.3	Confident	76.1	Confident	63 Å²	63	66 Å²	66	38%	0.382	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.4	173.5	178.9	0	0	0	0	108.6
73	S	82	Confident	77.6	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.007	34%	0.341	C	S	.	.			trans	-86.7	137.5	175.4	-171.4	0	0	0	0	110.6	T75 S93 T94 N117	S73-T75 VanDerWaalsContact CB-O 3.3Å; S73-T75 WeakPolarHBondContact CB-O 3.3Å; S73-T75 PolarHBondContact O-N 3.42Å; S73-T75 PolarHBondContact OG-N 2.88Å; S73-T75 PolarHBondContact OG-O 2.83Å; S73-T75 VanDerWaalsContact OG-O 3.09Å; S73-T75 PolarHBondContact OG-OG1 3.26Å; S73-S93 WeakPolarHBondContact OG-CA 3.44Å; S73-T94 WeakPolarHBondContact OG-CG2 3.28Å; S73-T94 PolarHBondContact OG-N 3.43Å; S73-T94 PolarHBondContact OG-OG1 2.77Å; S73-N117 VanDerWaalsContact O-CA 3.28Å; S73-N117 WeakPolarHBondContact O-CA 3.3Å; S73-N117 PolarHBondContact O-N 3.36Å
74	T	83.5	Confident	78.8	Confident	67 Å²	67	61 Å²	61	41%	0.411	32%	0.321	S	S	.	.	S	Bend	trans	-71.9	-17.6	172.2	53.9	0	0	0	0	112.9	A91 I92	T74-A91 HydrophobicContact CG2-CB 4.4Å; T74-I92 WeakPolarHBondContact CB-O 2.97Å; T74-I92 WeakPolarHBondContact CG2-O 3.5Å; T74-I92 PolarHBondContact N-O 2.94Å; T74-I92 PolarHBondContact OG1-O 2.97Å
75	T	86.7	Confident	79.7	Confident	58 Å²	58	59.2 Å²	59.2	36%	0.356	31%	0.31	S	S	.	.	S	Bend	trans	-110	163.8	174.8	52.9	0	0	0	0	110.7	S73 A77 T94	S73-T75 VanDerWaalsContact CB-O 3.3Å; S73-T75 WeakPolarHBondContact CB-O 3.3Å; S73-T75 PolarHBondContact O-N 3.42Å; S73-T75 PolarHBondContact OG-N 2.88Å; S73-T75 PolarHBondContact OG-O 2.83Å; S73-T75 VanDerWaalsContact OG-O 3.09Å; S73-T75 PolarHBondContact OG-OG1 3.26Å; T75-A77 PolarHBondContact O-N 2.94Å; T75-T94 PolarHBondContact OG1-N 3.49Å; T75-T94 PolarHBondContact OG1-O 3.27Å; T75-T94 PolarHBondContact OG1-OG1 3.36Å
76	E	88.8	Confident	80.6	Confident	133 Å²	133	56.8 Å²	56.8	62%	0.621	30%	0.297	S	S	*	.			trans	-64.2	129.8	171.6	-175	168	-175.3	0	0	110.1	Q81 T94	E76-Q81 PolarHBondContact O-OE1 2.91Å; E76-T94 PolarHBondContact O-OG1 2.88Å; E76-T94 VanDerWaalsContact O-OG1 3.08Å
77	A	89	Confident	81	Confident	4 Å²	4	53.8 Å²	53.8	3%	0.033	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-106.1	119.7	-173.2	0	0	0	0	0	110.3	T75 T94 V110 G113 G114 C120	T75-A77 PolarHBondContact O-N 2.94Å; A77-T94 WeakPolarHBondContact CA-OG1 3.34Å; A77-T94 HydrophobicContact CB-CG2 3.95Å; A77-V110 HydrophobicContact CB-CG1 4.33Å; A77-V110 HydrophobicContact CB-CG2 4.33Å; A77-G113 CarbonylContact O-C 3.45Å; A77-G113 WeakPolarHBondContact O-CA 3.23Å; A77-G114 PolarHBondContact N-O 3.4Å; A77-G114 PolarHBondContact O-N 3.21Å; A77-C120 HydrophobicContact CB-CB 3.79Å
78	T	88.2	Confident	81.3	Confident	71 Å²	71	55.6 Å²	55.6	44%	0.436	29%	0.287	S	S	.	.			trans	-115.9	149.8	174	49.3	0	0	0	0	111.4	G80 Q81 V110	T78-G80 PolarHBondContact O-N 3.4Å; T78-Q81 WeakPolarHBondContact O-CB 3.41Å; T78-Q81 WeakPolarHBondContact O-CG 3.33Å; T78-Q81 PolarHBondContact O-N 2.76Å; T78-Q81 VanDerWaalsContact O-N 3.15Å; T78-Q81 WeakPolarHBondContact OG1-CG 3.16Å; T78-Q81 PolarHBondContact OG1-NE2 3.3Å; T78-Q81 PolarHBondContact OG1-OE1 3.12Å; T78-V110 WeakPolarHBondContact O-CB 3.33Å
79	K	87.5	Confident	81.2	Confident	165 Å²	165	53.1 Å²	53.1	72%	0.717	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	131	-175.3	-178.1	170.4	-170.1	161.9	0	111.5	V111	K79-V111 WeakPolarHBondContact CD-O 3.08Å; K79-V111 WeakPolarHBondContact CE-O 3.31Å; K79-V111 VanDerWaalsContact CG-O 3.3Å; K79-V111 WeakPolarHBondContact CG-O 3.48Å
80	G	80	Confident	81	Confident	55 Å²	55	53.6 Å²	53.6	57%	0.567	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.1	-9.3	-177.6	0	0	0	0	0	115.2	T78 V110	T78-G80 PolarHBondContact O-N 3.4Å; G80-V110 PolarHBondContact N-O 2.8Å
81	Q	88.8	Confident	81	Confident	23 Å²	23	47.8 Å²	47.8	11%	0.107	28%	0.276	C	S	.	.			trans	-65.2	146.4	174	-74.7	-174.4	-40	0	0	112.3	E76 T78 T94 S95 S96 V109 V110	E76-Q81 PolarHBondContact O-OE1 2.91Å; T78-Q81 WeakPolarHBondContact O-CB 3.41Å; T78-Q81 WeakPolarHBondContact O-CG 3.33Å; T78-Q81 PolarHBondContact O-N 2.76Å; T78-Q81 VanDerWaalsContact O-N 3.15Å; T78-Q81 WeakPolarHBondContact OG1-CG 3.16Å; T78-Q81 PolarHBondContact OG1-NE2 3.3Å; T78-Q81 PolarHBondContact OG1-OE1 3.12Å; Q81-T94 PolarHBondContact OE1-OG1 2.88Å; Q81-S95 CarbonylContact C-O 3.22Å; Q81-S95 WeakPolarHBondContact CA-O 3.09Å; Q81-S95 WeakPolarHBondContact CB-O 3.32Å; Q81-S96 PolarHBondContact NE2-OG 3.47Å; Q81-V109 CarbonylContact O-C 3.54Å; Q81-V109 VanDerWaalsContact O-CA 3.27Å; Q81-V109 WeakPolarHBondContact O-CA 3.41Å; Q81-V110 HydrophobicContact CB-CG2 4.14Å; Q81-V110 PolarHBondContact O-N 2.64Å
82	K	85.5	Confident	81.2	Confident	58 Å²	58	48.2 Å²	48.2	25%	0.252	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	138.9	169.4	-67	-177.1	163.1	-152.5	0	110.2	L84 T94 S95 D98 D105	K82-L84 HydrophobicContact CB-CD2 4.17Å; K82-T94 WeakPolarHBondContact O-CA 3.42Å; K82-S95 PolarHBondContact N-O 3.07Å; K82-S95 PolarHBondContact O-N 3.15Å; K82-D98 IonicContact NZ-OD1 3.15Å; K82-D98 PolarHBondContact NZ-OD1 2.73Å; K82-D105 WeakPolarHBondContact CD-OD2 3.34Å; K82-D105 WeakPolarHBondContact CE-OD2 3.43Å; K82-D105 IonicContact NZ-OD2 2.92Å; K82-D105 PolarHBondContact NZ-OD2 2.92Å
83	V	86.8	Confident	81.6	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	115.5	171.2	-175.4	0	0	0	0	108.3	F13 I92 T106 W108 V110 I122	F13-V83 HydrophobicContact CE2-CG1 3.7Å; F13-V83 HydrophobicContact CZ-CG1 3.86Å; V83-I92 HydrophobicContact CG1-CG2 3.84Å; V83-T106 HydrophobicContact CG1-CG2 4.44Å; V83-T106 WeakPolarHBondContact O-CB 3.46Å; V83-T106 VanDerWaalsContact O-CG2 3.27Å; V83-T106 WeakPolarHBondContact O-CG2 3.4Å; V83-T106 PolarHBondContact O-N 3.16Å; V83-T106 VanDerWaalsContact O-N 3.14Å; V83-T106 PolarHBondContact O-OG1 2.75Å; V83-W108 HydrophobicContact CB-CB 4.07Å; V83-W108 HydrophobicContact CG2-CB 4.04Å; V83-W108 WeakPolarHBondContact CG2-O 3.33Å; V83-W108 PolarHBondContact N-O 3.1Å; V83-V110 HydrophobicContact CG2-CG2 4.21Å; V83-I122 HydrophobicContact CG1-CD1 4.35Å; V83-I122 HydrophobicContact CG2-CB 3.96Å; V83-I122 HydrophobicContact CG2-CD1 4.32Å; V83-I122 HydrophobicContact CG2-CG2 3.43Å; V83-I122 VanDerWaalsContact CG2-CG2 3.43Å
84	L	85.7	Confident	82	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	149.9	179.8	-56.1	-173.1	0	0	0	110	K82 I92 S93 A99 N103 I104 D105	K82-L84 HydrophobicContact CB-CD2 4.17Å; L84-I92 WeakPolarHBondContact O-CA 3.36Å; L84-S93 PolarHBondContact N-O 2.84Å; L84-S93 PolarHBondContact O-N 3.47Å; L84-A99 HydrophobicContact CD1-CB 4.47Å; L84-A99 HydrophobicContact CD2-CB 3.87Å; L84-N103 HydrophobicContact CB-CB 4.32Å; L84-N103 HydrophobicContact CD1-CB 4.37Å; L84-I104 WeakPolarHBondContact CA-O 3.31Å; L84-D105 HydrophobicContact CD2-CB 4.14Å
85	V	81.6	Confident	82	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	130.4	171.3	65.9	0	0	0	0	111.2	F13 F15 V34 K87 A91 I92 N103 I104 T106	F13-V85 HydrophobicContact CB-CB 4.38Å; F13-V85 HydrophobicContact CB-CG1 4.07Å; F13-V85 HydrophobicContact CB-CG2 4.27Å; F13-V85 HydrophobicContact CD2-CB 3.99Å; F13-V85 HydrophobicContact CD2-CG1 4.35Å; F13-V85 HydrophobicContact CD2-CG2 4.25Å; F13-V85 HydrophobicContact CG-CG1 4.42Å; F15-V85 HydrophobicContact CE1-CG1 3.65Å; F15-V85 HydrophobicContact CZ-CB 4.4Å; F15-V85 HydrophobicContact CZ-CG1 3.64Å; F15-V85 HydrophobicContact CZ-CG2 3.9Å; V34-V85 HydrophobicContact CG2-CG1 3.71Å; V85-K87 PolarHBondContact O-N 3.29Å; V85-A91 WeakPolarHBondContact CA-O 3.44Å; V85-I92 HydrophobicContact CG2-CG1 4.39Å; V85-N103 CarbonylContact O-C 3.54Å; V85-N103 WeakPolarHBondContact O-CA 3.49Å; V85-I104 HydrophobicContact CG1-CB 4.49Å; V85-I104 PolarHBondContact N-O 2.83Å; V85-I104 PolarHBondContact O-N 3.45Å; V85-T106 HydrophobicContact CB-CG2 4.09Å; V85-T106 HydrophobicContact CG1-CG2 3.71Å
86	D	77.9	Confident	81.8	Confident	34 Å²	34	46.7 Å²	46.7	18%	0.182	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	119.1	172	174.8	-12.9	0	0	0	109.4	N88 T89 G90 A91 N103	D86-N88 VanDerWaalsContact C-N 3.26Å; D86-N88 PolarHBondContact O-N 2.87Å; D86-N88 WeakPolarHBondContact OD1-CA 3.39Å; D86-N88 VanDerWaalsContact OD1-CB 3.3Å; D86-N88 WeakPolarHBondContact OD1-CB 3.31Å; D86-N88 PolarHBondContact OD1-N 3.19Å; D86-T89 WeakPolarHBondContact CB-OG1 3.42Å; D86-T89 PolarHBondContact OD1-N 2.63Å; D86-T89 VanDerWaalsContact OD1-N 3.12Å; D86-T89 WeakPolarHBondContact OD2-CB 3.3Å; D86-T89 WeakPolarHBondContact OD2-CG2 3.49Å; D86-T89 PolarHBondContact OD2-OG1 3.1Å; D86-G90 VanDerWaalsContact O-CA 3.23Å; D86-G90 WeakPolarHBondContact O-CA 3.23Å; D86-G90 PolarHBondContact O-N 2.89Å; D86-A91 HydrophobicContact CB-CB 4.38Å; D86-A91 PolarHBondContact N-O 2.64Å; D86-N103 PolarHBondContact N-OD1 3.25Å
87	K	70.1	Confident	81.3	Confident	43 Å²	43	47.5 Å²	47.5	19%	0.187	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-21.4	-178.3	79.6	-161.3	-180	-149.8	0	113.9	F15 V85 D102 I104	F15-K87 HydrophobicContact CE1-CB 4.14Å; F15-K87 HydrophobicContact CZ-CB 4.27Å; V85-K87 PolarHBondContact O-N 3.29Å; K87-D102 HydrophobicContact CD-CB 4.44Å; K87-D102 WeakPolarHBondContact CE-OD1 3.43Å; K87-D102 HydrophobicContact CG-CB 4.38Å; K87-D102 WeakPolarHBondContact CG-O 3.47Å; K87-D102 PolarHBondContact N-O 3.43Å; K87-D102 IonicContact NZ-OD1 2.64Å; K87-D102 PolarHBondContact NZ-OD1 3.03Å; K87-I104 HydrophobicContact CB-CD1 3.77Å; K87-I104 HydrophobicContact CB-CG1 4.25Å; K87-I104 HydrophobicContact CD-CD1 4.21Å
88	N	71.2	Confident	80.5	Confident	76 Å²	76	53 Å²	53	41%	0.406	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-40.1	-179.2	-58.2	-31.5	0	0	0	111.7	D86 D102	D86-N88 VanDerWaalsContact C-N 3.26Å; D86-N88 PolarHBondContact O-N 2.87Å; D86-N88 WeakPolarHBondContact OD1-CA 3.39Å; D86-N88 VanDerWaalsContact OD1-CB 3.3Å; D86-N88 WeakPolarHBondContact OD1-CB 3.31Å; D86-N88 PolarHBondContact OD1-N 3.19Å; N88-D102 WeakPolarHBondContact ND2-CB 3.32Å; N88-D102 PolarHBondContact ND2-OD2 3.31Å
89	T	69	Low	79.6	Confident	81 Å²	81	51.4 Å²	51.4	50%	0.497	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-16.6	-175.2	70	0	0	0	0	114.6	D86 A91	D86-T89 WeakPolarHBondContact CB-OG1 3.42Å; D86-T89 PolarHBondContact OD1-N 2.63Å; D86-T89 VanDerWaalsContact OD1-N 3.12Å; D86-T89 WeakPolarHBondContact OD2-CB 3.3Å; D86-T89 WeakPolarHBondContact OD2-CG2 3.49Å; D86-T89 PolarHBondContact OD2-OG1 3.1Å; T89-A91 PolarHBondContact O-N 3.11Å; T89-A91 VanDerWaalsContact OG1-CB 3.29Å; T89-A91 WeakPolarHBondContact OG1-CB 3.39Å; T89-A91 PolarHBondContact OG1-N 3.11Å
90	G	67.5	Low	78.7	Confident	27 Å²	27	46.8 Å²	46.8	28%	0.278	29%	0.294	S	S	.	.			trans	71.2	9.1	-171.5	0	0	0	0	0	114.2	D86	D86-G90 VanDerWaalsContact O-CA 3.23Å; D86-G90 WeakPolarHBondContact O-CA 3.23Å; D86-G90 PolarHBondContact O-N 2.89Å
91	A	75.7	Confident	78.6	Confident	35 Å²	35	47.8 Å²	47.8	29%	0.289	30%	0.304	S	S	.	.			trans	-70.8	133.4	-179.7	0	0	0	0	0	111.5	T74 V85 D86 T89	T74-A91 HydrophobicContact CG2-CB 4.4Å; V85-A91 WeakPolarHBondContact CA-O 3.44Å; D86-A91 HydrophobicContact CB-CB 4.38Å; D86-A91 PolarHBondContact N-O 2.64Å; T89-A91 PolarHBondContact O-N 3.11Å; T89-A91 VanDerWaalsContact OG1-CB 3.29Å; T89-A91 WeakPolarHBondContact OG1-CB 3.39Å; T89-A91 PolarHBondContact OG1-N 3.11Å
92	I	81	Confident	77.9	Confident	13 Å²	13	50.1 Å²	50.1	7%	0.067	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.8	176.1	-63.6	174.7	0	0	0	109.3	G11 F13 V71 T74 V83 L84 V85	G11-I92 VanDerWaalsContact O-CD1 3.22Å; G11-I92 WeakPolarHBondContact O-CD1 3.31Å; F13-I92 HydrophobicContact CD2-CD1 3.75Å; F13-I92 HydrophobicContact CD2-CG1 3.87Å; F13-I92 HydrophobicContact CE2-CD1 3.67Å; F13-I92 HydrophobicContact CE2-CG1 3.98Å; F13-I92 HydrophobicContact CE2-CG2 4.5Å; V71-I92 HydrophobicContact CB-CD1 4.15Å; V71-I92 HydrophobicContact CG1-CD1 4.22Å; V71-I92 HydrophobicContact CG2-CG2 4.38Å; T74-I92 WeakPolarHBondContact CB-O 2.97Å; T74-I92 WeakPolarHBondContact CG2-O 3.5Å; T74-I92 PolarHBondContact N-O 2.94Å; T74-I92 PolarHBondContact OG1-O 2.97Å; V83-I92 HydrophobicContact CG1-CG2 3.84Å; L84-I92 WeakPolarHBondContact O-CA 3.36Å; V85-I92 HydrophobicContact CG2-CG1 4.39Å
93	S	87.5	Confident	77.7	Confident	18 Å²	18	49.8 Å²	49.8	13%	0.126	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	168.7	172.9	57.8	0	0	0	0	110.6	S73 L84	S73-S93 WeakPolarHBondContact OG-CA 3.44Å; L84-S93 PolarHBondContact N-O 2.84Å; L84-S93 PolarHBondContact O-N 3.47Å
94	T	89.6	Confident	77.2	Confident	9 Å²	9	50.8 Å²	50.8	6%	0.055	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.6	-177.1	46.3	0	0	0	0	110	S73 T75 E76 A77 Q81 K82 V110	S73-T94 WeakPolarHBondContact OG-CG2 3.28Å; S73-T94 PolarHBondContact OG-N 3.43Å; S73-T94 PolarHBondContact OG-OG1 2.77Å; T75-T94 PolarHBondContact OG1-N 3.49Å; T75-T94 PolarHBondContact OG1-O 3.27Å; T75-T94 PolarHBondContact OG1-OG1 3.36Å; E76-T94 PolarHBondContact O-OG1 2.88Å; E76-T94 VanDerWaalsContact O-OG1 3.08Å; A77-T94 WeakPolarHBondContact CA-OG1 3.34Å; A77-T94 HydrophobicContact CB-CG2 3.95Å; Q81-T94 PolarHBondContact OE1-OG1 2.88Å; K82-T94 WeakPolarHBondContact O-CA 3.42Å; T94-V110 HydrophobicContact CG2-CG2 3.51Å
95	S	84.4	Confident	77	Confident	32 Å²	32	53.2 Å²	53.2	22%	0.224	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	152	-176.3	-170.4	0	0	0	0	112	Q81 K82 E97	Q81-S95 CarbonylContact C-O 3.22Å; Q81-S95 WeakPolarHBondContact CA-O 3.09Å; Q81-S95 WeakPolarHBondContact CB-O 3.32Å; K82-S95 PolarHBondContact N-O 3.07Å; K82-S95 PolarHBondContact O-N 3.15Å; S95-E97 PolarHBondContact OG-N 2.55Å; S95-E97 PolarHBondContact OG-O 3.04Å
96	S	82.1	Confident	77	Confident	99 Å²	99	53.3 Å²	53.3	69%	0.692	34%	0.337	S	S	*	.	S	Bend	trans	-88	-12.9	167.2	-49.4	0	0	0	0	112.2	Q81	Q81-S96 PolarHBondContact NE2-OG 3.47Å
97	E	77.7	Confident	77	Confident	150 Å²	150	53.1 Å²	53.1	70%	0.701	34%	0.343	S	S	*	.	S	Bend	trans	-100.8	162.6	178.8	-61.2	-176.2	176.7	0	0	111.4	S95	S95-E97 PolarHBondContact OG-N 2.55Å; S95-E97 PolarHBondContact OG-O 3.04Å
98	D	72.6	Confident	77.6	Confident	118 Å²	118	51.1 Å²	51.1	63%	0.631	33%	0.334	S	S	*	.			trans	-64.2	159.9	174.3	-73.5	-48.3	0	0	0	112.9	K82 A100	K82-D98 IonicContact NZ-OD1 3.15Å; K82-D98 PolarHBondContact NZ-OD1 2.73Å; D98-A100 PolarHBondContact O-N 2.88Å
99	A	69.8	Low	78.2	Confident	38 Å²	38	49.2 Å²	49.2	31%	0.314	33%	0.325	S	S	.	.			trans	-64.6	107.2	-173.9	0	0	0	0	0	112.6	L84 N103 D105	L84-A99 HydrophobicContact CD1-CB 4.47Å; L84-A99 HydrophobicContact CD2-CB 3.87Å; A99-N103 HydrophobicContact CB-CB 4.32Å; A99-D105 HydrophobicContact CB-CB 4.16Å
100	A	68.3	Low	79.1	Confident	69 Å²	69	45.5 Å²	45.5	57%	0.57	30%	0.303	S	S	*	.			trans	-95.4	142.5	178.1	0	0	0	0	0	112.7	D98 N103	D98-A100 PolarHBondContact O-N 2.88Å; A100-N103 PolarHBondContact O-ND2 2.7Å
101	G	76.9	Confident	79.9	Confident	75 Å²	75	45.7 Å²	45.7	77%	0.773	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	-124.9	174.6	0	0	0	0	0	113.3
102	D	75.1	Confident	80.4	Confident	73 Å²	73	47.5 Å²	47.5	39%	0.39	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	4.9	180	-70.5	-40.3	0	0	0	113.8	K87 N88	K87-D102 HydrophobicContact CD-CB 4.44Å; K87-D102 WeakPolarHBondContact CE-OD1 3.43Å; K87-D102 HydrophobicContact CG-CB 4.38Å; K87-D102 WeakPolarHBondContact CG-O 3.47Å; K87-D102 PolarHBondContact N-O 3.43Å; K87-D102 IonicContact NZ-OD1 2.64Å; K87-D102 PolarHBondContact NZ-OD1 3.03Å; N88-D102 WeakPolarHBondContact ND2-CB 3.32Å; N88-D102 PolarHBondContact ND2-OD2 3.31Å
103	N	81.1	Confident	80.7	Confident	50 Å²	50	48.8 Å²	48.8	27%	0.267	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	144.3	170.2	-69.7	-45.6	0	0	0	111.6	L84 V85 D86 A99 A100	L84-N103 HydrophobicContact CB-CB 4.32Å; L84-N103 HydrophobicContact CD1-CB 4.37Å; V85-N103 CarbonylContact O-C 3.54Å; V85-N103 WeakPolarHBondContact O-CA 3.49Å; D86-N103 PolarHBondContact N-OD1 3.25Å; A99-N103 HydrophobicContact CB-CB 4.32Å; A100-N103 PolarHBondContact O-ND2 2.7Å
104	I	76.6	Confident	80.5	Confident	22 Å²	22	48.7 Å²	48.7	11%	0.113	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132	171.3	-62.3	179.7	0	0	0	108.3	F15 A31 V34 L84 V85 K87 T106	F15-I104 HydrophobicContact CD1-CD1 4.11Å; F15-I104 HydrophobicContact CE1-CD1 3.95Å; A31-I104 WeakPolarHBondContact O-CD1 3.26Å; V34-I104 HydrophobicContact CG2-CG2 3.97Å; L84-I104 WeakPolarHBondContact CA-O 3.31Å; V85-I104 HydrophobicContact CG1-CB 4.49Å; V85-I104 PolarHBondContact N-O 2.83Å; V85-I104 PolarHBondContact O-N 3.45Å; K87-I104 HydrophobicContact CB-CD1 3.77Å; K87-I104 HydrophobicContact CB-CG1 4.25Å; K87-I104 HydrophobicContact CD-CD1 4.21Å; I104-T106 PolarHBondContact O-N 3.34Å
105	D	82.5	Confident	80.3	Confident	55 Å²	55	50.4 Å²	50.4	29%	0.294	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	116.9	169.9	-172.4	-18.6	0	0	0	108.9	K82 L84 A99 G107	K82-D105 WeakPolarHBondContact CD-OD2 3.34Å; K82-D105 WeakPolarHBondContact CE-OD2 3.43Å; K82-D105 IonicContact NZ-OD2 2.92Å; K82-D105 PolarHBondContact NZ-OD2 2.92Å; L84-D105 HydrophobicContact CD2-CB 4.14Å; A99-D105 HydrophobicContact CB-CB 4.16Å; D105-G107 PolarHBondContact O-N 2.83Å; D105-G107 PolarHBondContact OD1-N 2.72Å
106	T	80.8	Confident	80.3	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-17.8	-178	66.7	0	0	0	0	112	F13 V34 V83 V85 I104 W108 R124	F13-T106 HydrophobicContact CD1-CG2 3.97Å; F13-T106 HydrophobicContact CD2-CG2 3.72Å; F13-T106 HydrophobicContact CE1-CG2 3.91Å; F13-T106 HydrophobicContact CE2-CG2 3.67Å; F13-T106 HydrophobicContact CG-CG2 3.86Å; F13-T106 HydrophobicContact CZ-CG2 3.76Å; V34-T106 HydrophobicContact CG2-CG2 4.33Å; V83-T106 HydrophobicContact CG1-CG2 4.44Å; V83-T106 WeakPolarHBondContact O-CB 3.46Å; V83-T106 VanDerWaalsContact O-CG2 3.27Å; V83-T106 WeakPolarHBondContact O-CG2 3.4Å; V83-T106 PolarHBondContact O-N 3.16Å; V83-T106 VanDerWaalsContact O-N 3.14Å; V83-T106 PolarHBondContact O-OG1 2.75Å; V85-T106 HydrophobicContact CB-CG2 4.09Å; V85-T106 HydrophobicContact CG1-CG2 3.71Å; I104-T106 PolarHBondContact O-N 3.34Å; T106-W108 VanDerWaalsContact C-N 3.3Å; T106-W108 PolarHBondContact OG1-N 3.08Å; T106-W108 VanDerWaalsContact OG1-N 3.16Å; T106-R124 VanDerWaalsContact O-CZ 3.31Å; T106-R124 PolarHBondContact O-NH1 3.27Å; T106-R124 PolarHBondContact O-NH2 3.32Å; T106-R124 VanDerWaalsContact O-NH2 3.09Å
107	G	76.7	Confident	80.2	Confident	30 Å²	30	51.7 Å²	51.7	31%	0.309	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	73.2	17.1	-167.5	0	0	0	0	0	114.2	D105 R124	D105-G107 PolarHBondContact O-N 2.83Å; D105-G107 PolarHBondContact OD1-N 2.72Å; G107-R124 VanDerWaalsContact O-CG 3.28Å; G107-R124 WeakPolarHBondContact O-CG 3.46Å
108	W	83.5	Confident	80.3	Confident	1 Å²	1	50 Å²	50	0%	0.004	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	152.7	169.7	-65.6	70.9	0	0	0	110.3	F13 L37 V64 G67 C69 V83 T106 I122 C123 R124	F13-W108 AromaticContact CE1-CD1 3.73Å; F13-W108 HydrophobicContact CE1-CG 4.28Å; F13-W108 AromaticContact CE1-NE1 3.76Å; F13-W108 HydrophobicContact CZ-CG 4.41Å; L37-W108 HydrophobicContact CB-CZ2 4.35Å; V64-W108 HydrophobicContact CG1-CH2 4.18Å; G67-W108 VanDerWaalsContact O-CZ3 3.29Å; G67-W108 WeakPolarHBondContact O-CZ3 2.99Å; C69-W108 HydrophobicContact CB-CH2 4.38Å; C69-W108 HydrophobicContact CB-CZ3 3.95Å; V83-W108 HydrophobicContact CB-CB 4.07Å; V83-W108 HydrophobicContact CG2-CB 4.04Å; V83-W108 WeakPolarHBondContact CG2-O 3.33Å; V83-W108 PolarHBondContact N-O 3.1Å; T106-W108 VanDerWaalsContact C-N 3.3Å; T106-W108 PolarHBondContact OG1-N 3.08Å; T106-W108 VanDerWaalsContact OG1-N 3.16Å; W108-I122 HydrophobicContact CB-CD1 4.19Å; W108-I122 HydrophobicContact CD2-CD1 4.07Å; W108-I122 HydrophobicContact CE3-CB 4.32Å; W108-I122 HydrophobicContact CE3-CD1 3.72Å; W108-I122 HydrophobicContact CE3-CG1 3.82Å; W108-I122 HydrophobicContact CG-CD1 4.29Å; W108-I122 HydrophobicContact CZ3-CD1 4.42Å; W108-I122 HydrophobicContact CZ3-CG1 4.33Å; W108-C123 WeakPolarHBondContact CA-O 3.44Å; W108-C123 VanDerWaalsContact CE3-CA 3.47Å; W108-R124 HydrophobicContact CD2-CB 3.81Å; W108-R124 HydrophobicContact CD2-CG 4.4Å; W108-R124 HydrophobicContact CE3-CB 4.13Å; W108-R124 HydrophobicContact CG-CB 4.23Å; W108-R124 HydrophobicContact CG-CG 4.38Å; W108-R124 HydrophobicContact CH2-CB 4.43Å; W108-R124 HydrophobicContact CZ2-CB 4.16Å; W108-R124 HydrophobicContact CZ3-CB 4.43Å; W108-R124 VanDerWaalsContact NE1-NH1 3.11Å
109	V	84.7	Confident	80.4	Confident	37 Å²	37	48.4 Å²	48.4	22%	0.224	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.7	177.4	-66.7	0	0	0	0	112	Q81 I122 C123 I125	Q81-V109 CarbonylContact O-C 3.54Å; Q81-V109 VanDerWaalsContact O-CA 3.27Å; Q81-V109 WeakPolarHBondContact O-CA 3.41Å; V109-I122 CarbonylContact O-C 3.57Å; V109-I122 VanDerWaalsContact O-CA 3.25Å; V109-I122 WeakPolarHBondContact O-CA 3.23Å; V109-C123 PolarHBondContact N-O 3.02Å; V109-C123 PolarHBondContact O-N 2.79Å; V109-I125 HydrophobicContact CG2-CD1 3.65Å; V109-I125 HydrophobicContact CG2-CG1 3.82Å
110	V	86.7	Confident	80.8	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	125.2	177.3	-179.4	0	0	0	0	110.6	A77 T78 G80 Q81 V83 T94 E121 I122	A77-V110 HydrophobicContact CB-CG1 4.33Å; A77-V110 HydrophobicContact CB-CG2 4.33Å; T78-V110 WeakPolarHBondContact O-CB 3.33Å; G80-V110 PolarHBondContact N-O 2.8Å; Q81-V110 HydrophobicContact CB-CG2 4.14Å; Q81-V110 PolarHBondContact O-N 2.64Å; V83-V110 HydrophobicContact CG2-CG2 4.21Å; T94-V110 HydrophobicContact CG2-CG2 3.51Å; V110-E121 CarbonylContact C-O 3.59Å; V110-I122 HydrophobicContact CG2-CG2 4.31Å
111	V	84.3	Confident	81.5	Confident	30 Å²	30	45 Å²	45	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-45.5	176.5	179.7	0	0	0	0	110.8	F68 K79 E121 C123	F68-V111 HydrophobicContact CD1-CG1 4.41Å; F68-V111 HydrophobicContact CD1-CG2 4.09Å; F68-V111 HydrophobicContact CE1-CG1 4.05Å; F68-V111 HydrophobicContact CE1-CG2 3.95Å; K79-V111 WeakPolarHBondContact CD-O 3.08Å; K79-V111 WeakPolarHBondContact CE-O 3.31Å; K79-V111 VanDerWaalsContact CG-O 3.3Å; K79-V111 WeakPolarHBondContact CG-O 3.48Å; V111-E121 HydrophobicContact CB-CG 4.43Å; V111-E121 PolarHBondContact N-O 2.78Å; V111-C123 HydrophobicContact CG2-CB 3.85Å
112	T	86.3	Confident	81.9	Confident	74 Å²	74	41.5 Å²	41.5	45%	0.454	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	120.6	178.6	-54.9	0	0	0	0	108.5	C120 E121	T112-C120 WeakPolarHBondContact O-CB 3.41Å; T112-E121 WeakPolarHBondContact CB-OE2 3.28Å; T112-E121 PolarHBondContact N-O 2.82Å; T112-E121 PolarHBondContact O-N 3.29Å; T112-E121 PolarHBondContact OG1-OE2 3.44Å
113	G	86.9	Confident	81.9	Confident	39 Å²	39	38.7 Å²	38.7	40%	0.402	25%	0.245	S	C	.	.			trans	-77.4	173.2	-173.8	0	0	0	0	0	114.5	A77	A77-G113 CarbonylContact O-C 3.45Å; A77-G113 WeakPolarHBondContact O-CA 3.23Å
114	G	83.4	Confident	81.3	Confident	16 Å²	16	39.5 Å²	39.5	17%	0.165	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-168.5	157.2	179.5	0	0	0	0	0	111.9	A77	A77-G114 PolarHBondContact N-O 3.4Å; A77-G114 PolarHBondContact O-N 3.21Å
115	A	84.9	Confident	80.3	Confident	45 Å²	45	44.1 Å²	44.1	37%	0.372	27%	0.267	S	S	.	.			trans	-66.4	162.8	177.5	0	0	0	0	0	111.8	N117 Q118	A115-N117 PolarHBondContact O-N 2.9Å; A115-Q118 HydrophobicContact CB-CG 4.17Å; A115-Q118 WeakPolarHBondContact O-CB 3.48Å; A115-Q118 PolarHBondContact O-N 3.39Å
116	A	85	Confident	78.7	Confident	48 Å²	48	43.3 Å²	43.3	40%	0.397	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	127.7	177.9	0	0	0	0	0	111.8	Q118	A116-Q118 VanDerWaalsContact C-N 3.31Å
117	N	80.4	Confident	77.1	Confident	110 Å²	110	48.1 Å²	48.1	59%	0.588	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	18.6	-172.2	-46.3	-84.8	0	0	0	115.5	S73 A115	S73-N117 VanDerWaalsContact O-CA 3.28Å; S73-N117 WeakPolarHBondContact O-CA 3.3Å; S73-N117 PolarHBondContact O-N 3.36Å; A115-N117 PolarHBondContact O-N 2.9Å
118	Q	79.1	Confident	75.4	Confident	116 Å²	116	53.4 Å²	53.4	54%	0.542	31%	0.307	S	S	.	.	S	Bend	trans	-99.2	162.8	162.4	-65.8	-169.5	-32.4	0	0	111.8	A115 A116	A115-Q118 HydrophobicContact CB-CG 4.17Å; A115-Q118 WeakPolarHBondContact O-CB 3.48Å; A115-Q118 PolarHBondContact O-N 3.39Å; A116-Q118 VanDerWaalsContact C-N 3.31Å
119	T	75.5	Confident	73.7	Confident	84 Å²	84	61 Å²	61	52%	0.515	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	128.4	172.7	-47.1	0	0	0	0	110.6	Y70 V71	Y70-T119 HydrophobicContact CD1-CG2 4.03Å; Y70-T119 HydrophobicContact CG-CG2 4.27Å; V71-T119 CarbonylContact O-C 3.57Å; V71-T119 WeakPolarHBondContact O-CA 3.43Å
120	C	77.6	Confident	71.9	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.02	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	158.8	167.6	63.9	0	0	0	0	110.4	Y70 V71 A77 T112	Y70-C120 WeakPolarHBondContact CA-O 3.27Å; V71-C120 PolarHBondContact N-O 3.21Å; V71-C120 PolarHBondContact O-N 3.46Å; A77-C120 HydrophobicContact CB-CB 3.79Å; T112-C120 WeakPolarHBondContact O-CB 3.41Å
121	E	83.5	Confident	69.9	Low	33 Å²	33	66.2 Å²	66.2	15%	0.154	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133.1	177.7	-169.1	-172.6	-173.7	0	0	109.8	F68 C69 Y70 V110 V111 T112	F68-E121 HydrophobicContact CD1-CG 4.5Å; F68-E121 WeakPolarHBondContact CD1-OE1 3.46Å; C69-E121 WeakPolarHBondContact O-CA 3.13Å; Y70-E121 HydrophobicContact CD1-CB 4.04Å; Y70-E121 HydrophobicContact CD1-CG 4.25Å; Y70-E121 HydrophobicContact CE1-CB 3.8Å; Y70-E121 HydrophobicContact CE1-CG 3.82Å; V110-E121 CarbonylContact C-O 3.59Å; V111-E121 HydrophobicContact CB-CG 4.43Å; V111-E121 PolarHBondContact N-O 2.78Å; T112-E121 WeakPolarHBondContact CB-OE2 3.28Å; T112-E121 PolarHBondContact N-O 2.82Å; T112-E121 PolarHBondContact O-N 3.29Å; T112-E121 PolarHBondContact OG1-OE2 3.44Å
122	I	85	Confident	67.9	Low	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	149.2	-177.2	64.4	161.5	0	0	0	110.7	F13 F68 C69 V71 V83 W108 V109 V110	F13-I122 HydrophobicContact CZ-CD1 3.84Å; F68-I122 CarbonylContact C-O 3.58Å; F68-I122 WeakPolarHBondContact CA-O 3.46Å; C69-I122 HydrophobicContact CB-CG1 4.07Å; C69-I122 PolarHBondContact N-O 2.85Å; C69-I122 WeakPolarHBondContact O-CG1 3.38Å; C69-I122 PolarHBondContact O-N 2.66Å; V71-I122 HydrophobicContact CB-CD1 4.46Å; V71-I122 HydrophobicContact CG1-CD1 3.72Å; V71-I122 HydrophobicContact CG1-CG1 4.23Å; V71-I122 HydrophobicContact CG2-CD1 3.84Å; V71-I122 HydrophobicContact CG2-CG1 4.04Å; V71-I122 HydrophobicContact CG2-CG2 3.74Å; V83-I122 HydrophobicContact CG1-CD1 4.35Å; V83-I122 HydrophobicContact CG2-CB 3.96Å; V83-I122 HydrophobicContact CG2-CD1 4.32Å; V83-I122 HydrophobicContact CG2-CG2 3.43Å; V83-I122 VanDerWaalsContact CG2-CG2 3.43Å; W108-I122 HydrophobicContact CB-CD1 4.19Å; W108-I122 HydrophobicContact CD2-CD1 4.07Å; W108-I122 HydrophobicContact CE3-CB 4.32Å; W108-I122 HydrophobicContact CE3-CD1 3.72Å; W108-I122 HydrophobicContact CE3-CG1 3.82Å; W108-I122 HydrophobicContact CG-CD1 4.29Å; W108-I122 HydrophobicContact CZ3-CD1 4.42Å; W108-I122 HydrophobicContact CZ3-CG1 4.33Å; V109-I122 CarbonylContact O-C 3.57Å; V109-I122 VanDerWaalsContact O-CA 3.25Å; V109-I122 WeakPolarHBondContact O-CA 3.23Å; V110-I122 HydrophobicContact CG2-CG2 4.31Å
123	C	76	Confident	66.1	Low	15 Å²	15	68.7 Å²	68.7	10%	0.101	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	157.8	169.2	90.4	0	0	0	0	112.6	G67 F68 W108 V109 V111 I125	G67-C123 WeakPolarHBondContact O-CA 3.42Å; G67-C123 VanDerWaalsContact O-CB 3.32Å; G67-C123 WeakPolarHBondContact O-CB 3.36Å; F68-C123 HydrophobicContact CD1-CB 3.63Å; F68-C123 HydrophobicContact CE1-CB 3.86Å; F68-C123 HydrophobicContact CG-CB 4.15Å; W108-C123 WeakPolarHBondContact CA-O 3.44Å; W108-C123 VanDerWaalsContact CE3-CA 3.47Å; V109-C123 PolarHBondContact N-O 3.02Å; V109-C123 PolarHBondContact O-N 2.79Å; V111-C123 HydrophobicContact CG2-CB 3.85Å; C123-I125 PolarHBondContact O-N 3.01Å; C123-I125 VanDerWaalsContact SG-CG1 3.6Å
124	R	68.4	Low	63.9	Low	66 Å²	66	72.1 Å²	72.1	25%	0.249	37%	0.374	C	S	.	.			trans	-94	90.4	176.9	-157.6	-169.6	-172	81.6	7.8	111	L65 T106 G107 W108 Y126	L65-R124 WeakPolarHBondContact O-CD 3.3Å; T106-R124 VanDerWaalsContact O-CZ 3.31Å; T106-R124 PolarHBondContact O-NH1 3.27Å; T106-R124 PolarHBondContact O-NH2 3.32Å; T106-R124 VanDerWaalsContact O-NH2 3.09Å; G107-R124 VanDerWaalsContact O-CG 3.28Å; G107-R124 WeakPolarHBondContact O-CG 3.46Å; W108-R124 HydrophobicContact CD2-CB 3.81Å; W108-R124 HydrophobicContact CD2-CG 4.4Å; W108-R124 HydrophobicContact CE3-CB 4.13Å; W108-R124 HydrophobicContact CG-CB 4.23Å; W108-R124 HydrophobicContact CG-CG 4.38Å; W108-R124 HydrophobicContact CH2-CB 4.43Å; W108-R124 HydrophobicContact CZ2-CB 4.16Å; W108-R124 HydrophobicContact CZ3-CB 4.43Å; W108-R124 VanDerWaalsContact NE1-NH1 3.11Å; R124-Y126 PolarHBondContact O-N 3.35Å
125	I	55.2	Low	62	Low	119 Å²	119	72.7 Å²	72.7	61%	0.61	37%	0.374	S	S	*	.			trans	-75.1	115.7	170.8	-53.8	-176.4	0	0	0	108.5	V109 C123	V109-I125 HydrophobicContact CG2-CD1 3.65Å; V109-I125 HydrophobicContact CG2-CG1 3.82Å; C123-I125 PolarHBondContact O-N 3.01Å; C123-I125 VanDerWaalsContact SG-CG1 3.6Å
126	Y	48.3	Very low	59.9	Low	39 Å²	39	74.8 Å²	74.8	15%	0.153	38%	0.376	C	S	.	.			trans	-84.6	150.7	160.3	-62.4	-86.8	0	0	0	108.7	R66 R124 L131	R66-Y126 HydrophobicContact CG-CE2 3.95Å; R66-Y126 PolarHBondContact NE-OH 3.28Å; R66-Y126 VanDerWaalsContact NE-OH 3.11Å; R124-Y126 PolarHBondContact O-N 3.35Å; Y126-L131 HydrophobicContact CD2-CD1 4.3Å
127	D	46.7	Very low	57.9	Low	103 Å²	103	78.7 Å²	78.7	55%	0.551	39%	0.39	S	S	*	.			trans	-65.1	157.5	155.6	72.7	54.5	0	0	0	110.3	K129 E130 L131	D127-K129 PolarHBondContact O-N 3.47Å; D127-K129 VanDerWaalsContact O-N 3.16Å; D127-K129 VanDerWaalsContact OD1-CA 3.32Å; D127-K129 WeakPolarHBondContact OD1-CA 3.46Å; D127-K129 VanDerWaalsContact OD1-CB 3.23Å; D127-K129 WeakPolarHBondContact OD1-CB 3.42Å; D127-K129 PolarHBondContact OD1-N 3.22Å; D127-E130 PolarHBondContact OD1-N 2.8Å; D127-L131 WeakPolarHBondContact O-CB 3.4Å; D127-L131 PolarHBondContact O-N 3.19Å; D127-L131 VanDerWaalsContact O-N 3.08Å
128	N	42.9	Very low	56.3	Low	140 Å²	140	80.9 Å²	80.9	75%	0.749	40%	0.395	S	S	*	.	H	α-helix	trans	-63.4	-22.8	-176.7	-70.2	-11.6	0	0	0	113	F132	N128-F132 WeakPolarHBondContact O-CB 3.34Å; N128-F132 PolarHBondContact O-N 3.45Å; N128-F132 VanDerWaalsContact O-N 3.13Å
129	K	47.6	Very low	54.4	Low	162 Å²	162	77.9 Å²	77.9	70%	0.704	40%	0.395	S	S	*	.	H	α-helix	trans	-78.7	-45.5	-175.5	-169	170.3	-175	163.9	0	111	D127 F132 A133	D127-K129 PolarHBondContact O-N 3.47Å; D127-K129 VanDerWaalsContact O-N 3.16Å; D127-K129 VanDerWaalsContact OD1-CA 3.32Å; D127-K129 WeakPolarHBondContact OD1-CA 3.46Å; D127-K129 VanDerWaalsContact OD1-CB 3.23Å; D127-K129 WeakPolarHBondContact OD1-CB 3.42Å; D127-K129 PolarHBondContact OD1-N 3.22Å; K129-F132 PolarHBondContact O-N 3.43Å; K129-A133 PolarHBondContact O-N 2.86Å; K129-A133 VanDerWaalsContact O-N 3.09Å
130	E	45.5	Very low	52.8	Low	84 Å²	84	79.6 Å²	79.6	39%	0.393	40%	0.4	S	S	.	.	H	α-helix	trans	-76.1	-28.6	174.7	-171.5	165.4	-150.4	0	0	112.4	D127 R134	D127-E130 PolarHBondContact OD1-N 2.8Å; E130-R134 VanDerWaalsContact CD-NE 3.27Å; E130-R134 HydrophobicContact CG-CG 4.03Å; E130-R134 WeakPolarHBondContact O-CB 3.39Å; E130-R134 WeakPolarHBondContact O-CG 3.21Å; E130-R134 PolarHBondContact O-N 2.9Å; E130-R134 IonicContact OE1-CZ 2.74Å; E130-R134 IonicContact OE1-NE 3.96Å; E130-R134 PolarHBondContact OE1-NE 2.65Å; E130-R134 IonicContact OE1-NH2 2.84Å; E130-R134 PolarHBondContact OE1-NH2 3.42Å; E130-R134 IonicContact OE2-NE 3.18Å; E130-R134 IonicContact OE2-NH2 2.61Å
131	L	46	Very low	50.9	Low	65 Å²	65	82.9 Å²	82.9	34%	0.34	42%	0.416	S	S	.	.	H	α-helix	trans	-57	-52.8	167.8	-176.8	60.6	0	0	0	110.6	Y126 D127 R134 V135	Y126-L131 HydrophobicContact CD2-CD1 4.3Å; D127-L131 WeakPolarHBondContact O-CB 3.4Å; D127-L131 PolarHBondContact O-N 3.19Å; D127-L131 VanDerWaalsContact O-N 3.08Å; L131-R134 PolarHBondContact O-N 3.5Å; L131-V135 HydrophobicContact CD1-CG2 4.24Å; L131-V135 WeakPolarHBondContact O-CB 3.38Å; L131-V135 VanDerWaalsContact O-CG2 3.25Å; L131-V135 WeakPolarHBondContact O-CG2 3.32Å; L131-V135 PolarHBondContact O-N 2.85Å
132	F	42.3	Very low	48.4	Very low	117 Å²	117	84.3 Å²	84.3	51%	0.513	44%	0.44	S	S	.	.	H	α-helix	trans	-58	-51.5	179.5	-171.2	-95.4	0	0	0	112.2	N128 K129 R134 V135 Q136 I141	N128-F132 WeakPolarHBondContact O-CB 3.34Å; N128-F132 PolarHBondContact O-N 3.45Å; N128-F132 VanDerWaalsContact O-N 3.13Å; K129-F132 PolarHBondContact O-N 3.43Å; F132-R134 VanDerWaalsContact C-N 3.31Å; F132-R134 PolarHBondContact O-N 2.99Å; F132-V135 PolarHBondContact O-N 3.06Å; F132-V135 VanDerWaalsContact O-N 3.15Å; F132-Q136 HydrophobicContact CE1-CG 4.31Å; F132-Q136 PolarHBondContact O-N 3.21Å; F132-I141 HydrophobicContact CE2-CD1 4.42Å
133	A	47.4	Very low	46.2	Very low	39 Å²	39	89.2 Å²	89.2	32%	0.322	46%	0.462	S	S	.	.	H	α-helix	trans	-62.5	-33	-179.9	0	0	0	0	0	113.6	K129 N137	K129-A133 PolarHBondContact O-N 2.86Å; K129-A133 VanDerWaalsContact O-N 3.09Å; A133-N137 WeakPolarHBondContact O-CB 3.5Å; A133-N137 PolarHBondContact O-N 2.95Å; A133-N137 VanDerWaalsContact O-N 3.13Å; A133-N137 PolarHBondContact O-ND2 2.89Å
134	R	42.2	Very low	44.2	Very low	111 Å²	111	95.2 Å²	95.2	42%	0.419	49%	0.493	S	S	.	.	H	α-helix	trans	-81.3	-24.2	176.1	-69.3	-176.9	-178.4	-141	13.1	113.3	E130 L131 F132 K138	E130-R134 VanDerWaalsContact CD-NE 3.27Å; E130-R134 HydrophobicContact CG-CG 4.03Å; E130-R134 WeakPolarHBondContact O-CB 3.39Å; E130-R134 WeakPolarHBondContact O-CG 3.21Å; E130-R134 PolarHBondContact O-N 2.9Å; E130-R134 IonicContact OE1-CZ 2.74Å; E130-R134 IonicContact OE1-NE 3.96Å; E130-R134 PolarHBondContact OE1-NE 2.65Å; E130-R134 IonicContact OE1-NH2 2.84Å; E130-R134 PolarHBondContact OE1-NH2 3.42Å; E130-R134 IonicContact OE2-NE 3.18Å; E130-R134 IonicContact OE2-NH2 2.61Å; L131-R134 PolarHBondContact O-N 3.5Å; F132-R134 VanDerWaalsContact C-N 3.31Å; F132-R134 PolarHBondContact O-N 2.99Å; R134-K138 PolarHBondContact O-N 2.93Å
135	V	41.8	Very low	42.5	Very low	27 Å²	27	101.9 Å²	101.9	16%	0.164	52%	0.518	C	S	.	.	H	α-helix	trans	-73.1	-40.7	171.9	169.3	0	0	0	0	110.7	L131 F132 K138 G139 I140 I141	L131-V135 HydrophobicContact CD1-CG2 4.24Å; L131-V135 WeakPolarHBondContact O-CB 3.38Å; L131-V135 VanDerWaalsContact O-CG2 3.25Å; L131-V135 WeakPolarHBondContact O-CG2 3.32Å; L131-V135 PolarHBondContact O-N 2.85Å; F132-V135 PolarHBondContact O-N 3.06Å; F132-V135 VanDerWaalsContact O-N 3.15Å; V135-K138 PolarHBondContact O-N 2.81Å; V135-G139 PolarHBondContact O-N 2.95Å; V135-I140 HydrophobicContact CG1-CB 3.98Å; V135-I140 HydrophobicContact CG1-CG2 4.09Å; V135-I140 PolarHBondContact O-N 3.09Å; V135-I141 HydrophobicContact CG1-CB 4.32Å; V135-I141 HydrophobicContact CG1-CD1 3.58Å; V135-I141 HydrophobicContact CG1-CG1 3.64Å
136	Q	41	Very low	41.5	Very low	89 Å²	89	101.4 Å²	101.4	42%	0.416	52%	0.52	S	S	.	.	H	α-helix	trans	-59.6	-52.7	169.2	-74.1	-175.1	-37.4	0	0	112	F132 K138 G139	F132-Q136 HydrophobicContact CE1-CG 4.31Å; F132-Q136 PolarHBondContact O-N 3.21Å; Q136-K138 PolarHBondContact O-N 3.04Å; Q136-K138 VanDerWaalsContact O-N 3.07Å; Q136-G139 PolarHBondContact O-N 3.39Å
137	N	44.2	Very low	40.8	Very low	130 Å²	130	104.4 Å²	104.4	70%	0.695	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-8.7	-178.2	-80.2	-55.4	0	0	0	114.8	A133	A133-N137 WeakPolarHBondContact O-CB 3.5Å; A133-N137 PolarHBondContact O-N 2.95Å; A133-N137 VanDerWaalsContact O-N 3.13Å; A133-N137 PolarHBondContact O-ND2 2.89Å
138	K	45.8	Very low	40	Very low	156 Å²	156	107.5 Å²	107.5	68%	0.678	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	2.8	169.5	-77.9	-154.4	170	-160.9	0	114.1	R134 V135 Q136 I140	R134-K138 PolarHBondContact O-N 2.93Å; V135-K138 PolarHBondContact O-N 2.81Å; Q136-K138 PolarHBondContact O-N 3.04Å; Q136-K138 VanDerWaalsContact O-N 3.07Å; K138-I140 HydrophobicContact CB-CD1 3.94Å; K138-I140 HydrophobicContact CB-CG1 4.05Å; K138-I140 PolarHBondContact O-N 3.3Å
139	G	38.7	Very low	39.3	Very low	53 Å²	53	104.9 Å²	104.9	55%	0.546	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	66.7	15.1	-179	0	0	0	0	0	114.5	V135 Q136	V135-G139 PolarHBondContact O-N 2.95Å; Q136-G139 PolarHBondContact O-N 3.39Å
140	I	42.4	Very low	38.4	Very low	121 Å²	121	101.2 Å²	101.2	62%	0.621	56%	0.561	S	S	*	*	S	Bend	trans	-75.1	-34.1	-179.5	-64.1	170.1	0	0	0	110.2	V135 K138	V135-I140 HydrophobicContact CG1-CB 3.98Å; V135-I140 HydrophobicContact CG1-CG2 4.09Å; V135-I140 PolarHBondContact O-N 3.09Å; K138-I140 HydrophobicContact CB-CD1 3.94Å; K138-I140 HydrophobicContact CB-CG1 4.05Å; K138-I140 PolarHBondContact O-N 3.3Å
141	I	37.2	Very low	37.7	Very low	71 Å²	71	102.4 Å²	102.4	36%	0.364	58%	0.576	S	S	.	*	S	Bend	trans	-94.5	102.3	157.1	-67.7	166.1	0	0	0	106	F132 V135 F143	F132-I141 HydrophobicContact CE2-CD1 4.42Å; V135-I141 HydrophobicContact CG1-CB 4.32Å; V135-I141 HydrophobicContact CG1-CD1 3.58Å; V135-I141 HydrophobicContact CG1-CG1 3.64Å; I141-F143 HydrophobicContact CG2-CD2 4.43Å; I141-F143 HydrophobicContact CG2-CE2 4.29Å; I141-F143 PolarHBondContact O-N 3.34Å
142	G	32.8	Very low	36.8	Very low	63 Å²	63	103.8 Å²	103.8	65%	0.649	60%	0.597	S	S	*	*			trans	-84.6	99.6	-176.3	0	0	0	0	0	112.5
143	F	38.7	Very low	36.4	Very low	104 Å²	104	105.4 Å²	105.4	46%	0.456	61%	0.611	S	S	.	*			trans	-97.9	118.8	151.5	-71.8	-61.6	0	0	0	108.1	I141 R145 Y244	I141-F143 HydrophobicContact CG2-CD2 4.43Å; I141-F143 HydrophobicContact CG2-CE2 4.29Å; I141-F143 PolarHBondContact O-N 3.34Å; F143-R145 PolarHBondContact O-N 3.44Å; F143-Y244 AromaticContact CD1-CE1 3.85Å; F143-Y244 HydrophobicContact CD1-CE1 3.85Å; F143-Y244 AromaticContact CD1-CZ 3.96Å; F143-Y244 VanDerWaalsContact CD1-OH 3.27Å; F143-Y244 WeakPolarHBondContact CD1-OH 3.35Å; F143-Y244 AromaticContact CE1-CE1 3.52Å; F143-Y244 HydrophobicContact CE1-CE1 3.52Å; F143-Y244 HydrophobicContact CG-CE1 4.49Å; F143-Y244 VanDerWaalsContact CG-OH 3.3Å; F143-Y244 WeakPolarHBondContact CG-OH 3.47Å; F143-Y244 AromaticContact CZ-CE1 3.88Å; F143-Y244 HydrophobicContact CZ-CE1 3.88Å
144	D	34.1	Very low	35.4	Very low	141 Å²	141	112 Å²	112	75%	0.754	63%	0.633	S	S	*	*			trans	-68.3	105.5	-170	-171.9	4.8	0	0	0	111.6	V146	D144-V146 HydrophobicContact CB-CG2 4.45Å; D144-V146 VanDerWaalsContact CG-CG2 3.49Å; D144-V146 PolarHBondContact O-N 3.34Å; D144-V146 PolarHBondContact OD1-N 2.98Å; D144-V146 VanDerWaalsContact OD2-CG2 3.28Å; D144-V146 WeakPolarHBondContact OD2-CG2 3.42Å
145	R	31.9	Very low	34.8	Very low	205 Å²	205	113.2 Å²	113.2	77%	0.774	65%	0.646	S	S	*	*			trans	-82.7	67.3	172.1	-74.9	-174.4	168	176	-2	110.1	F143 S147	F143-R145 PolarHBondContact O-N 3.44Å; R145-S147 PolarHBondContact O-N 3.28Å
146	V	33.6	Very low	34.1	Very low	110 Å²	110	117.8 Å²	117.8	67%	0.667	67%	0.674	S	S	*	*			trans	-55.5	110.1	168.4	-176.5	0	0	0	0	108.4	D144 N148	D144-V146 HydrophobicContact CB-CG2 4.45Å; D144-V146 VanDerWaalsContact CG-CG2 3.49Å; D144-V146 PolarHBondContact O-N 3.34Å; D144-V146 PolarHBondContact OD1-N 2.98Å; D144-V146 VanDerWaalsContact OD2-CG2 3.28Å; D144-V146 WeakPolarHBondContact OD2-CG2 3.42Å; V146-N148 PolarHBondContact O-N 3.49Å
147	S	33.6	Very low	33.5	Very low	102 Å²	102	120.4 Å²	120.4	71%	0.713	69%	0.686	S	S	*	*			trans	-88.4	113.6	-164.6	49	0	0	0	0	112.5	R145 A149	R145-S147 PolarHBondContact O-N 3.28Å; S147-A149 VanDerWaalsContact C-N 3.26Å; S147-A149 PolarHBondContact O-N 3.39Å
148	N	29.5	Very low	32.9	Very low	167 Å²	167	120.8 Å²	120.8	89%	0.893	70%	0.696	S	S	*	*			trans	53.9	26.2	157.5	-63.6	-17.3	0	0	0	117.7	V146 A150	V146-N148 PolarHBondContact O-N 3.49Å; N148-A150 PolarHBondContact O-N 3.49Å
149	A	28.9	Very low	32.5	Very low	86 Å²	86	118.2 Å²	118.2	71%	0.711	69%	0.69	S	S	*	*	S	Bend	trans	-78.9	84.2	171.5	0	0	0	0	0	111.2	S147	S147-A149 VanDerWaalsContact C-N 3.26Å; S147-A149 PolarHBondContact O-N 3.39Å
150	A	29	Very low	32.4	Very low	84 Å²	84	123.5 Å²	123.5	69%	0.694	70%	0.703	S	S	*	*			trans	63	115.4	177.2	0	0	0	0	0	116.4	N148 A152	N148-A150 PolarHBondContact O-N 3.49Å; A150-A152 PolarHBondContact O-N 2.91Å; A150-A152 VanDerWaalsContact O-N 3.11Å
151	P	30.3	Very low	31.9	Very low	110 Å²	110	123.7 Å²	123.7	71%	0.714	71%	0.706	S	S	*	*			trans	-69.2	110.2	170	28.8	-32.4	0	0	0	110	N153 F154	P151-N153 PolarHBondContact O-N 3.03Å; P151-F154 HydrophobicContact CB-CE2 4.32Å
152	A	28.3	Very low	31.9	Very low	93 Å²	93	122.9 Å²	122.9	77%	0.769	71%	0.709	S	S	*	*			trans	-59.6	130.8	172.6	0	0	0	0	0	110.1	A150 F154	A150-A152 PolarHBondContact O-N 2.91Å; A150-A152 VanDerWaalsContact O-N 3.11Å; A152-F154 PolarHBondContact O-N 3.3Å
153	N	33.2	Very low	32	Very low	151 Å²	151	124.8 Å²	124.8	81%	0.807	71%	0.711	S	S	*	*			trans	-34.6	111.6	-168.2	-63.1	-31.3	0	0	0	115.3	P151 I155	P151-N153 PolarHBondContact O-N 3.03Å; N153-I155 PolarHBondContact O-N 2.58Å; N153-I155 VanDerWaalsContact O-N 3.08Å
154	F	26.6	Very low	32	Very low	179 Å²	179	129 Å²	129	79%	0.785	73%	0.729	S	S	*	*			trans	-62.6	108.5	162.7	-72.2	-85	0	0	0	109.2	P151 A152 T156	P151-F154 HydrophobicContact CB-CE2 4.32Å; A152-F154 PolarHBondContact O-N 3.3Å; F154-T156 PolarHBondContact O-N 3.41Å; F154-T156 VanDerWaalsContact O-N 3.13Å
155	I	29.9	Very low	32.3	Very low	136 Å²	136	123.9 Å²	123.9	70%	0.697	71%	0.71	S	S	*	*			trans	-77.8	98.9	176	-60	179.7	0	0	0	108.3	N153 Q157	N153-I155 PolarHBondContact O-N 2.58Å; N153-I155 VanDerWaalsContact O-N 3.08Å; I155-Q157 PolarHBondContact O-N 3.36Å; I155-Q157 VanDerWaalsContact O-N 3.15Å
156	T	26.6	Very low	32.8	Very low	122 Å²	122	116.9 Å²	116.9	75%	0.748	70%	0.696	S	S	*	*			trans	-85.2	32.5	-176.6	50.8	0	0	0	0	113.4	F154	F154-T156 PolarHBondContact O-N 3.41Å; F154-T156 VanDerWaalsContact O-N 3.13Å
157	Q	27.8	Very low	33.3	Very low	145 Å²	145	117.8 Å²	117.8	68%	0.678	70%	0.696	S	S	*	*	S	Bend	trans	-138.4	138.7	179.6	-74	-66.5	-80	0	0	110.2	I155 N159	I155-Q157 PolarHBondContact O-N 3.36Å; I155-Q157 VanDerWaalsContact O-N 3.15Å; Q157-N159 PolarHBondContact O-N 2.92Å
158	P	33.1	Very low	33.9	Very low	137 Å²	137	116.5 Å²	116.5	89%	0.89	69%	0.692	S	S	*	*			trans	-67	99.5	175.3	-17.4	31.5	0	0	0	111
159	N	37.2	Very low	34.5	Very low	103 Å²	103	115.3 Å²	115.3	55%	0.551	68%	0.676	S	S	*	*			trans	-117.9	131.1	167.7	-178	-20.2	0	0	0	107.1	Q157 N161	Q157-N159 PolarHBondContact O-N 2.92Å; N159-N161 PolarHBondContact O-N 3.41Å; N159-N161 VanDerWaalsContact O-N 3.1Å; N159-N161 WeakPolarHBondContact OD1-CB 3.5Å; N159-N161 PolarHBondContact OD1-N 2.82Å
160	I	35.2	Very low	35.5	Very low	163 Å²	163	116.2 Å²	116.2	84%	0.836	67%	0.668	S	S	*	*	S	Bend	trans	-69.4	-9.6	-171.8	-147.1	158.2	0	0	0	113.2	A162	I160-A162 PolarHBondContact O-N 3.25Å
161	N	33	Very low	36.4	Very low	126 Å²	126	116.6 Å²	116.6	67%	0.674	65%	0.651	S	S	*	*			trans	-75.3	62.6	179	-64.4	-8.3	0	0	0	113	N159	N159-N161 PolarHBondContact O-N 3.41Å; N159-N161 VanDerWaalsContact O-N 3.1Å; N159-N161 WeakPolarHBondContact OD1-CB 3.5Å; N159-N161 PolarHBondContact OD1-N 2.82Å
162	A	37.8	Very low	37.5	Very low	53 Å²	53	116.6 Å²	116.6	44%	0.438	65%	0.651	S	S	.	*			trans	-57.2	133.7	147.6	0	0	0	0	0	107.7	I160 F164	I160-A162 PolarHBondContact O-N 3.25Å; A162-F164 PolarHBondContact O-N 2.95Å
163	P	34.9	Very low	38.6	Very low	104 Å²	104	117.7 Å²	117.7	68%	0.675	64%	0.64	S	S	*	*			trans	-60.3	125.6	-175.5	23.7	-33.2	0	0	0	109.9	G165 A166	P163-G165 PolarHBondContact O-N 3.29Å; P163-A166 WeakPolarHBondContact O-CB 3.42Å; P163-A166 PolarHBondContact O-N 3.29Å
164	F	38.7	Very low	39.6	Very low	191 Å²	191	110.7 Å²	110.7	84%	0.838	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48	-37.5	-161	-171	-101	0	0	0	115	A162 A166 L167	A162-F164 PolarHBondContact O-N 2.95Å; F164-A166 VanDerWaalsContact C-N 3.3Å; F164-A166 PolarHBondContact O-N 3.32Å; F164-L167 PolarHBondContact O-N 2.7Å
165	G	39.8	Very low	41.3	Very low	34 Å²	34	105.5 Å²	105.5	35%	0.351	59%	0.586	S	S	.	*	H	α-helix	trans	-59.6	-32.2	176.6	0	0	0	0	0	114.8	P163 L167 A168 Y169	P163-G165 PolarHBondContact O-N 3.29Å; G165-L167 VanDerWaalsContact C-N 3.31Å; G165-L167 PolarHBondContact O-N 3.25Å; G165-A168 PolarHBondContact O-N 3Å; G165-A168 VanDerWaalsContact O-N 3.09Å; G165-Y169 WeakPolarHBondContact O-CD2 3.25Å; G165-Y169 PolarHBondContact O-N 2.92Å
166	A	42	Very low	42.5	Very low	58 Å²	58	105.3 Å²	105.3	48%	0.479	58%	0.582	S	S	.	*	H	α-helix	trans	-64.5	-33.7	-176.4	0	0	0	0	0	113.2	P163 F164	P163-A166 WeakPolarHBondContact O-CB 3.42Å; P163-A166 PolarHBondContact O-N 3.29Å; F164-A166 VanDerWaalsContact C-N 3.3Å; F164-A166 PolarHBondContact O-N 3.32Å
167	L	44.5	Very low	44.1	Very low	130 Å²	130	101 Å²	101	68%	0.681	56%	0.556	S	S	*	*	H	α-helix	trans	-79.9	-22.5	175.4	-69.5	171.9	0	0	0	112.5	F164 G165	F164-L167 PolarHBondContact O-N 2.7Å; G165-L167 VanDerWaalsContact C-N 3.31Å; G165-L167 PolarHBondContact O-N 3.25Å
168	A	44.9	Very low	45.6	Very low	75 Å²	75	97.2 Å²	97.2	62%	0.62	54%	0.54	S	S	*	.	H	α-helix	trans	-77.2	-20.3	178.1	0	0	0	0	0	113.9	G165	G165-A168 PolarHBondContact O-N 3Å; G165-A168 VanDerWaalsContact O-N 3.09Å
169	Y	42.8	Very low	47.1	Very low	142 Å²	142	95.6 Å²	95.6	56%	0.557	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.6	-172.9	-77.3	-57.1	0	0	0	116.3	G165 R171	G165-Y169 WeakPolarHBondContact O-CD2 3.25Å; G165-Y169 PolarHBondContact O-N 2.92Å; Y169-R171 PolarHBondContact O-N 2.82Å
170	I	50.6	Low	48.2	Very low	105 Å²	105	92.7 Å²	92.7	54%	0.538	52%	0.518	S	S	.	.			trans	-90.8	99.6	175.1	-56.1	-179.7	0	0	0	109.6	V175	I170-V175 HydrophobicContact CG2-CG2 3.83Å
171	R	46.6	Very low	49.4	Very low	92 Å²	92	89.1 Å²	89.1	35%	0.347	51%	0.506	S	S	.	.			trans	-60.4	137.8	171.7	-65.5	-175.2	-174.6	145.2	7.6	110.3	Y169 Q173 A174 D247	Y169-R171 PolarHBondContact O-N 2.82Å; R171-Q173 PolarHBondContact O-N 2.98Å; R171-A174 WeakPolarHBondContact O-CB 3.37Å; R171-A174 PolarHBondContact O-N 3.47Å; R171-D247 IonicContact CZ-OD1 3.66Å; R171-D247 IonicContact NH1-OD1 3.13Å; R171-D247 PolarHBondContact NH1-OD1 2.97Å; R171-D247 IonicContact NH2-OD1 3.65Å; R171-D247 PolarHBondContact NH2-OD1 2.94Å; R171-D247 IonicContact NH2-OD2 2.75Å; R171-D247 PolarHBondContact NH2-OD2 3.24Å; R171-D247 VanDerWaalsContact NH2-OD2 3.08Å
172	P	54.4	Low	51	Low	110 Å²	110	85.4 Å²	85.4	71%	0.714	49%	0.485	S	S	*	.	H	α-helix	trans	-53.4	-39.3	173.8	-28.9	36.1	0	0	0	113.6	A174 V175 E176	P172-A174 PolarHBondContact O-N 3.35Å; P172-V175 WeakPolarHBondContact O-CA 3.42Å; P172-V175 WeakPolarHBondContact O-CB 3.41Å; P172-V175 PolarHBondContact O-N 2.98Å; P172-E176 PolarHBondContact O-N 3.47Å
173	Q	51.5	Low	52.3	Low	115 Å²	115	86.7 Å²	86.7	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-58.1	-30.7	175.9	-72.8	174.8	-40.8	0	0	113.7	R171 V175 E176 V177	R171-Q173 PolarHBondContact O-N 2.98Å; Q173-V175 VanDerWaalsContact C-N 3.34Å; Q173-E176 WeakPolarHBondContact O-CB 3.43Å; Q173-E176 PolarHBondContact O-N 3.34Å; Q173-V177 WeakPolarHBondContact O-CB 3.12Å; Q173-V177 WeakPolarHBondContact O-CG2 3.34Å; Q173-V177 PolarHBondContact O-N 2.81Å
174	A	54.8	Low	53.9	Low	4 Å²	4	82 Å²	82	3%	0.033	46%	0.456	C	S	.	.	H	α-helix	trans	-69.9	-34.6	176.5	0	0	0	0	0	111.5	R171 P172 L178 M253	R171-A174 WeakPolarHBondContact O-CB 3.37Å; R171-A174 PolarHBondContact O-N 3.47Å; P172-A174 PolarHBondContact O-N 3.35Å; A174-L178 PolarHBondContact O-N 3.48Å; A174-M253 HydrophobicContact CB-CE 3.93Å; A174-M253 HydrophobicContact CB-CG 4.25Å
175	V	60.4	Low	55.2	Low	71 Å²	71	74.7 Å²	74.7	43%	0.43	43%	0.426	S	S	.	.	H	α-helix	trans	-70.4	-41.3	172.3	-174	0	0	0	0	110.5	I170 P172 Q173 L178 T179	I170-V175 HydrophobicContact CG2-CG2 3.83Å; P172-V175 WeakPolarHBondContact O-CA 3.42Å; P172-V175 WeakPolarHBondContact O-CB 3.41Å; P172-V175 PolarHBondContact O-N 2.98Å; Q173-V175 VanDerWaalsContact C-N 3.34Å; V175-L178 PolarHBondContact O-N 2.99Å; V175-T179 HydrophobicContact CG1-CG2 4.29Å; V175-T179 WeakPolarHBondContact O-CB 3.48Å; V175-T179 WeakPolarHBondContact O-CG2 3.29Å; V175-T179 PolarHBondContact O-N 2.95Å; V175-T179 PolarHBondContact O-OG1 3.16Å
176	E	55	Low	56.4	Low	131 Å²	131	80.9 Å²	80.9	61%	0.612	44%	0.443	S	S	*	.	H	α-helix	trans	-60.2	-45.8	177	-161.8	171.1	-138.9	0	0	111.7	P172 Q173 L178 T179 A180	P172-E176 PolarHBondContact O-N 3.47Å; Q173-E176 WeakPolarHBondContact O-CB 3.43Å; Q173-E176 PolarHBondContact O-N 3.34Å; E176-L178 PolarHBondContact O-N 3.48Å; E176-T179 WeakPolarHBondContact CA-OG1 3.27Å; E176-T179 PolarHBondContact O-N 3.3Å; E176-T179 PolarHBondContact O-OG1 2.89Å; E176-A180 WeakPolarHBondContact O-CB 3.1Å; E176-A180 PolarHBondContact O-N 3.04Å
177	V	61.8	Low	57.5	Low	31 Å²	31	79.9 Å²	79.9	19%	0.188	43%	0.43	C	S	.	.	H	α-helix	trans	-58.9	-43.3	173	163.9	0	0	0	0	112.4	Q173 M253 R254	Q173-V177 WeakPolarHBondContact O-CB 3.12Å; Q173-V177 WeakPolarHBondContact O-CG2 3.34Å; Q173-V177 PolarHBondContact O-N 2.81Å; V177-M253 HydrophobicContact CG1-CB 3.99Å; V177-R254 HydrophobicContact CG1-CB 4.36Å; V177-R254 HydrophobicContact CG1-CG 3.61Å; V177-R254 HydrophobicContact CG2-CG 4.48Å
178	L	58.2	Low	58.5	Low	66 Å²	66	75.3 Å²	75.3	35%	0.346	41%	0.411	S	S	.	.	H	α-helix	trans	-71.8	-34.9	-178.2	-164.2	74.8	0	0	0	112.3	A174 V175 E176 M253 L256 R260	A174-L178 PolarHBondContact O-N 3.48Å; V175-L178 PolarHBondContact O-N 2.99Å; E176-L178 PolarHBondContact O-N 3.48Å; L178-M253 HydrophobicContact CB-SD 3.72Å; L178-M253 HydrophobicContact CD1-CB 4.42Å; L178-M253 HydrophobicContact CD1-SD 3.78Å; L178-M253 HydrophobicContact CD2-SD 3.74Å; L178-M253 HydrophobicContact CG-SD 3.93Å; L178-L256 HydrophobicContact CD1-CB 4.11Å; L178-R260 PolarHBondContact O-NH1 3.4Å
179	T	64.6	Low	59.3	Low	103 Å²	103	75.7 Å²	75.7	63%	0.632	41%	0.414	S	S	*	.	H	α-helix	trans	-84.7	-14.7	-178.9	53	0	0	0	0	114	V175 E176	V175-T179 HydrophobicContact CG1-CG2 4.29Å; V175-T179 WeakPolarHBondContact O-CB 3.48Å; V175-T179 WeakPolarHBondContact O-CG2 3.29Å; V175-T179 PolarHBondContact O-N 2.95Å; V175-T179 PolarHBondContact O-OG1 3.16Å; E176-T179 WeakPolarHBondContact CA-OG1 3.27Å; E176-T179 PolarHBondContact O-N 3.3Å; E176-T179 PolarHBondContact O-OG1 2.89Å
180	A	60.8	Low	60.3	Low	43 Å²	43	73.7 Å²	73.7	36%	0.355	42%	0.419	S	S	.	.	S	Bend	trans	-58.2	137.1	176.3	0	0	0	0	0	112.9	E176 M182 R260	E176-A180 WeakPolarHBondContact O-CB 3.1Å; E176-A180 PolarHBondContact O-N 3.04Å; A180-M182 PolarHBondContact O-N 3.45Å; A180-R260 PolarHBondContact O-NH2 2.8Å
181	P	60.2	Low	60.8	Low	88 Å²	88	74.1 Å²	74.1	57%	0.571	43%	0.426	S	S	*	.			trans	-79.4	120.2	-179.3	30	-33.9	0	0	0	112.6	D185	P181-D185 HydrophobicContact CB-CB 4.37Å
182	M	66.1	Low	61.3	Low	48 Å²	48	79.6 Å²	79.6	24%	0.236	45%	0.452	C	S	.	.			trans	-86.6	178.2	-179.7	-67.3	-67.1	-83.9	0	0	111.9	A180 A184 D185 K186 A257 N261	A180-M182 PolarHBondContact O-N 3.45Å; M182-A184 VanDerWaalsContact C-N 3.28Å; M182-A184 PolarHBondContact O-N 3.31Å; M182-D185 WeakPolarHBondContact CA-OD2 3.15Å; M182-D185 WeakPolarHBondContact CB-OD2 3.28Å; M182-D185 PolarHBondContact N-OD2 2.86Å; M182-D185 PolarHBondContact O-N 3.29Å; M182-K186 WeakPolarHBondContact O-CG 3.24Å; M182-K186 PolarHBondContact O-N 3.16Å; M182-K186 VanDerWaalsContact O-N 3.13Å; M182-A257 HydrophobicContact CE-CB 4.24Å; M182-A257 WeakPolarHBondContact CE-O 3.33Å; M182-A257 HydrophobicContact CG-CB 4.32Å; M182-A257 HydrophobicContact SD-CB 4.27Å; M182-N261 HydrophobicContact CE-CB 4.21Å
183	V	65.8	Low	61.7	Low	80 Å²	80	78.2 Å²	78.2	49%	0.485	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-35.8	-179	-176.2	0	0	0	0	111.6	K186 L187 N261 F265	V183-K186 PolarHBondContact O-N 2.82Å; V183-L187 HydrophobicContact CG1-CD1 4.44Å; V183-L187 PolarHBondContact O-N 3.13Å; V183-N261 PolarHBondContact N-OD1 3.24Å; V183-F265 HydrophobicContact CG1-CZ 4.29Å
184	A	68.7	Low	62.2	Low	4 Å²	4	75.1 Å²	75.1	3%	0.033	44%	0.437	C	S	.	.	H	α-helix	trans	-56.4	-51.3	170.3	0	0	0	0	0	112.4	M182 K186 L187 A188 N261 F264	M182-A184 VanDerWaalsContact C-N 3.28Å; M182-A184 PolarHBondContact O-N 3.31Å; A184-K186 PolarHBondContact O-N 3.38Å; A184-L187 WeakPolarHBondContact O-CA 3.22Å; A184-L187 WeakPolarHBondContact O-CB 3.34Å; A184-L187 PolarHBondContact O-N 3.16Å; A184-A188 PolarHBondContact O-N 3.3Å; A184-N261 WeakPolarHBondContact CB-OD1 3.19Å; A184-N261 PolarHBondContact N-OD1 3.03Å; A184-F264 HydrophobicContact CB-CB 3.48Å; A184-F264 VanDerWaalsContact CB-CB 3.48Å; A184-F264 HydrophobicContact CB-CD1 3.63Å; A184-F264 HydrophobicContact CB-CD2 4.17Å; A184-F264 HydrophobicContact CB-CE1 4.41Å; A184-F264 HydrophobicContact CB-CG 3.49Å; A184-F264 VanDerWaalsContact CB-CG 3.49Å
185	D	66.6	Low	62.3	Low	38 Å²	38	80.2 Å²	80.2	20%	0.203	47%	0.468	C	S	.	.	H	α-helix	trans	-65.7	-25.6	-177.9	-48.5	-69.4	0	0	0	112.3	P181 M182 R260	P181-D185 HydrophobicContact CB-CB 4.37Å; M182-D185 WeakPolarHBondContact CA-OD2 3.15Å; M182-D185 WeakPolarHBondContact CB-OD2 3.28Å; M182-D185 PolarHBondContact N-OD2 2.86Å; M182-D185 PolarHBondContact O-N 3.29Å; D185-R260 IonicContact OD1-NE 3.88Å; D185-R260 IonicContact OD1-NH2 2.67Å; D185-R260 IonicContact OD2-CZ 3.32Å; D185-R260 IonicContact OD2-NE 2.68Å; D185-R260 PolarHBondContact OD2-NE 2.82Å; D185-R260 IonicContact OD2-NH2 3.51Å; D185-R260 PolarHBondContact OD2-NH2 3.43Å
186	K	64.1	Low	61.5	Low	164 Å²	164	88.2 Å²	88.2	71%	0.713	49%	0.491	S	S	*	.	H	α-helix	trans	-77.6	-19.4	172.3	-67.4	175.7	-175.4	-178.1	0	113.7	M182 V183 A184	M182-K186 WeakPolarHBondContact O-CG 3.24Å; M182-K186 PolarHBondContact O-N 3.16Å; M182-K186 VanDerWaalsContact O-N 3.13Å; V183-K186 PolarHBondContact O-N 2.82Å; A184-K186 PolarHBondContact O-N 3.38Å
187	L	64.7	Low	61.4	Low	37 Å²	37	84.9 Å²	84.9	19%	0.194	49%	0.492	C	S	.	.	H	α-helix	trans	-91.5	-41.2	176.5	-100.2	153.7	0	0	0	111.8	V183 A184 F264 F265 L327	V183-L187 HydrophobicContact CG1-CD1 4.44Å; V183-L187 PolarHBondContact O-N 3.13Å; A184-L187 WeakPolarHBondContact O-CA 3.22Å; A184-L187 WeakPolarHBondContact O-CB 3.34Å; A184-L187 PolarHBondContact O-N 3.16Å; L187-F264 HydrophobicContact CB-CE1 3.87Å; L187-F264 HydrophobicContact CB-CZ 4.05Å; L187-F264 HydrophobicContact CD1-CE1 4.37Å; L187-F265 HydrophobicContact CD1-CE1 3.69Å; L187-F265 HydrophobicContact CD1-CZ 3.58Å; L187-L327 HydrophobicContact CD2-CB 4.48Å; L187-L327 WeakPolarHBondContact CD2-O 3.24Å
188	A	66.5	Low	61.1	Low	35 Å²	35	86.5 Å²	86.5	29%	0.289	50%	0.499	S	S	.	.	S	Bend	trans	-151.8	137.8	171.6	0	0	0	0	0	111.4	A184 F264	A184-A188 PolarHBondContact O-N 3.3Å; A188-F264 HydrophobicContact CB-CE2 3.93Å; A188-F264 HydrophobicContact CB-CZ 3.93Å
189	A	60.7	Low	61	Low	82 Å²	82	89.1 Å²	89.1	68%	0.678	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-70.2	135.3	178.1	0	0	0	0	0	111.5	V191	A189-V191 PolarHBondContact O-N 2.83Å
190	P	63.5	Low	60.7	Low	101 Å²	101	87.3 Å²	87.3	66%	0.656	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-71.7	125.1	-177.8	27.2	-34.2	0	0	0	112.5
191	V	61	Low	60.8	Low	113 Å²	113	86.3 Å²	86.3	69%	0.685	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-100.8	122.8	176.8	-175	0	0	0	0	110.4	A189 N193	A189-V191 PolarHBondContact O-N 2.83Å; V191-N193 WeakPolarHBondContact CG1-ND2 3.35Å; V191-N193 PolarHBondContact O-N 3.45Å; V191-N193 PolarHBondContact O-ND2 2.84Å
192	K	58	Low	61.1	Low	208 Å²	208	88.6 Å²	88.6	90%	0.904	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-75	117	174.6	-65.9	-179.4	179.6	178.1	0	110.1
193	N	62.1	Low	61.1	Low	80 Å²	80	88.8 Å²	88.8	43%	0.428	49%	0.49	S	S	.	.			trans	-129.9	141.6	174.3	-63.1	-79.2	0	0	0	109.2	V191 V201 I203	V191-N193 WeakPolarHBondContact CG1-ND2 3.35Å; V191-N193 PolarHBondContact O-N 3.45Å; V191-N193 PolarHBondContact O-ND2 2.84Å; N193-V201 HydrophobicContact CB-CG1 3.74Å; N193-I203 HydrophobicContact CB-CD1 4.49Å; N193-I203 HydrophobicContact CB-CG1 4.33Å
194	G	62.4	Low	60.8	Low	50 Å²	50	92.2 Å²	92.2	52%	0.515	50%	0.498	S	S	.	.	S	Bend	trans	83.8	171.3	-176.3	0	0	0	0	0	114.3
195	V	57.5	Low	60.3	Low	111 Å²	111	95.8 Å²	95.8	67%	0.673	52%	0.516	S	S	*	.			trans	-112.8	152.4	178	-171.6	0	0	0	0	109.4	G197 D198	V195-G197 PolarHBondContact O-N 2.92Å; V195-D198 PolarHBondContact N-OD2 3.35Å; V195-D198 PolarHBondContact O-N 3.08Å
196	W	43.8	Very low	59.5	Low	240 Å²	240	98.2 Å²	98.2	91%	0.909	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	104.7	-178.8	-160.4	58.7	0	0	0	110.6	Y238	W196-Y238 AromaticContact CD1-CE1 3.74Å; W196-Y238 AromaticContact NE1-CE1 3.96Å
197	G	53.1	Low	58.6	Low	61 Å²	61	95.2 Å²	95.2	63%	0.629	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	132.1	-20	-171.3	0	0	0	0	0	114	V195 E199 Y238	V195-G197 PolarHBondContact O-N 2.92Å; G197-E199 PolarHBondContact O-N 2.85Å; G197-Y238 WeakPolarHBondContact CA-OH 3.46Å; G197-Y238 PolarHBondContact N-OH 2.82Å
198	D	54.7	Low	57.8	Low	65 Å²	65	101.3 Å²	101.3	35%	0.348	54%	0.535	S	S	.	.			trans	-68.9	125.8	175.9	-65.9	-27.4	0	0	0	110.8	V195 V201 A236 Y238	V195-D198 PolarHBondContact N-OD2 3.35Å; V195-D198 PolarHBondContact O-N 3.08Å; D198-V201 HydrophobicContact CB-CG2 4.4Å; D198-A236 WeakPolarHBondContact O-CB 3.22Å; D198-Y238 PolarHBondContact N-OH 3.01Å; D198-Y238 VanDerWaalsContact N-OH 3.17Å; D198-Y238 PolarHBondContact O-OH 2.87Å
199	E	55.9	Low	56.6	Low	120 Å²	120	105.4 Å²	105.4	56%	0.561	55%	0.549	S	S	*	.	S	Bend	trans	-79.4	-24.7	170.4	-67.5	-167.9	163.4	0	0	112.6	G197 A236 Q274	G197-E199 PolarHBondContact O-N 2.85Å; E199-A236 PolarHBondContact O-N 3.33Å; E199-Q274 PolarHBondContact OE2-NE2 3.16Å
200	L	58.6	Low	55.7	Low	66 Å²	66	104.2 Å²	104.2	35%	0.346	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	129.4	-175.9	-70.3	171.9	0	0	0	109.5	T233 Q274 A275	L200-T233 HydrophobicContact CB-CG2 4.39Å; L200-T233 HydrophobicContact CD2-CG2 4.27Å; L200-Q274 HydrophobicContact CD1-CB 4.14Å; L200-Q274 HydrophobicContact CD2-CB 3.96Å; L200-Q274 HydrophobicContact CG-CB 4.17Å; L200-A275 HydrophobicContact CD2-CB 3.56Å
201	V	63.1	Low	54.9	Low	22 Å²	22	109.1 Å²	109.1	13%	0.133	56%	0.556	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.6	126.3	179	-178.6	0	0	0	0	109.4	N193 D198 I203 R234	N193-V201 HydrophobicContact CB-CG1 3.74Å; D198-V201 HydrophobicContact CB-CG2 4.4Å; V201-I203 HydrophobicContact CG1-CG1 4.17Å; V201-R234 PolarHBondContact N-O 3.49Å; V201-R234 PolarHBondContact O-N 3.13Å
202	Q	65.8	Low	53.9	Low	136 Å²	136	110.9 Å²	110.9	64%	0.636	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.3	115.7	173.4	-68.8	-165.3	-16.9	0	0	110.8	T231 E232 T233	Q202-T231 HydrophobicContact CB-CG2 4.1Å; Q202-E232 CarbonylContact C-O 3.52Å; Q202-E232 WeakPolarHBondContact CA-O 3.25Å; Q202-T233 HydrophobicContact CG-CG2 4.24Å
203	I	67.4	Low	53.2	Low	52 Å²	52	104.9 Å²	104.9	27%	0.267	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102	115.4	-178.6	-56.3	176.8	0	0	0	108.5	N193 V201 I205 T231 E232	N193-I203 HydrophobicContact CB-CD1 4.49Å; N193-I203 HydrophobicContact CB-CG1 4.33Å; V201-I203 HydrophobicContact CG1-CG1 4.17Å; I203-I205 HydrophobicContact CG2-CG1 4.39Å; I203-I205 PolarHBondContact O-N 2.82Å; I203-T231 WeakPolarHBondContact O-CA 3.34Å; I203-E232 PolarHBondContact N-O 3.48Å; I203-E232 PolarHBondContact O-N 2.89Å
204	K	59.1	Low	52.1	Low	151 Å²	151	107 Å²	107	66%	0.657	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87	103.3	174.9	-71.4	-174.5	177.4	178.6	0	110.5	S230 T231	K204-S230 CarbonylContact C-O 3.51Å; K204-S230 WeakPolarHBondContact CA-O 3.04Å; K204-T231 HydrophobicContact CG-CG2 4.12Å
205	I	58.6	Low	51.2	Low	79 Å²	79	111.8 Å²	111.8	41%	0.405	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.2	125.7	175.3	-58.5	176.7	0	0	0	108.2	I203 E207 Y229 S230 E232	I203-I205 HydrophobicContact CG2-CG1 4.39Å; I203-I205 PolarHBondContact O-N 2.82Å; I205-E207 HydrophobicContact CG2-CG 4.44Å; I205-Y229 CarbonylContact O-C 3.52Å; I205-Y229 WeakPolarHBondContact O-CA 3.13Å; I205-S230 PolarHBondContact N-O 2.81Å; I205-S230 PolarHBondContact O-N 3.44Å; I205-E232 HydrophobicContact CD1-CG 3.83Å
206	K	50	Low	50.7	Low	90 Å²	90	111.4 Å²	111.4	39%	0.391	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113	111.4	-174.3	-174.6	-176.3	-173.3	-172.5	0	110.3	Y208 T227 Y229	K206-Y208 HydrophobicContact CD-CE1 4.2Å; K206-Y208 HydrophobicContact CD-CE2 4.3Å; K206-Y208 VanDerWaalsContact CE-CE1 3.41Å; K206-Y208 VanDerWaalsContact CE-CZ 3.44Å; K206-Y208 VanDerWaalsContact CE-OH 3.26Å; K206-Y208 WeakPolarHBondContact CE-OH 3.36Å; K206-Y208 HydrophobicContact CG-CE2 4.49Å; K206-Y208 PolarHBondContact NZ-OH 2.75Å; K206-T227 HydrophobicContact CD-CG2 4.06Å; K206-T227 HydrophobicContact CG-CG2 3.43Å; K206-T227 VanDerWaalsContact CG-CG2 3.43Å; K206-Y229 HydrophobicContact CB-CD1 4.08Å; K206-Y229 HydrophobicContact CB-CE1 3.99Å; K206-Y229 HydrophobicContact CD-CE1 3.75Å; K206-Y229 VanDerWaalsContact CE-OH 3.26Å; K206-Y229 WeakPolarHBondContact CE-OH 3.15Å; K206-Y229 HydrophobicContact CG-CD1 4.02Å; K206-Y229 HydrophobicContact CG-CE1 3.57Å
207	E	44.4	Very low	50.9	Low	100 Å²	100	102.8 Å²	102.8	47%	0.467	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108	122.1	180	-59.9	-179.3	130.7	0	0	110.5	I205 M209 T227 N228	I205-E207 HydrophobicContact CG2-CG 4.44Å; E207-M209 PolarHBondContact O-N 3.14Å; E207-T227 CarbonylContact O-C 3.51Å; E207-T227 VanDerWaalsContact O-CA 3.31Å; E207-T227 WeakPolarHBondContact O-CA 3.2Å; E207-N228 HydrophobicContact CB-CB 4.33Å; E207-N228 PolarHBondContact N-O 2.93Å; E207-N228 PolarHBondContact O-N 3.32Å; E207-N228 PolarHBondContact OE2-ND2 3.15Å
208	Y	47.2	Very low	50.3	Low	166 Å²	166	107.9 Å²	107.9	65%	0.651	58%	0.575	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88	105.7	178.8	-61.9	-82.2	0	0	0	111	K206 G210 T226 T227	K206-Y208 HydrophobicContact CD-CE1 4.2Å; K206-Y208 HydrophobicContact CD-CE2 4.3Å; K206-Y208 VanDerWaalsContact CE-CE1 3.41Å; K206-Y208 VanDerWaalsContact CE-CZ 3.44Å; K206-Y208 VanDerWaalsContact CE-OH 3.26Å; K206-Y208 WeakPolarHBondContact CE-OH 3.36Å; K206-Y208 HydrophobicContact CG-CE2 4.49Å; K206-Y208 PolarHBondContact NZ-OH 2.75Å; Y208-G210 PolarHBondContact O-N 2.83Å; Y208-T226 CarbonylContact C-O 3.46Å; Y208-T226 WeakPolarHBondContact CA-O 3.33Å; Y208-T227 HydrophobicContact CD1-CG2 4.34Å; Y208-T227 HydrophobicContact CE1-CG2 4.45Å
209	M	42.1	Very low	49.4	Very low	120 Å²	120	108.1 Å²	108.1	59%	0.591	58%	0.581	S	S	*	*			trans	-94.8	69.5	174.1	-67	-164.6	73.6	0	0	110.6	E207 T226	E207-M209 PolarHBondContact O-N 3.14Å; M209-T226 CarbonylContact C-O 3.56Å; M209-T226 PolarHBondContact N-O 2.77Å
210	G	41.7	Very low	48.4	Very low	58 Å²	58	108.2 Å²	108.2	60%	0.598	60%	0.595	S	S	*	*			trans	-108.6	128.2	176.1	0	0	0	0	0	112.6	Y208	Y208-G210 PolarHBondContact O-N 2.83Å
211	K	46	Very low	47.6	Very low	204 Å²	204	110.5 Å²	110.5	89%	0.887	61%	0.608	S	S	*	*			trans	-115.3	133.5	155.3	-74.1	-174.4	178.9	179.6	0	107.9	S213	K211-S213 PolarHBondContact O-N 3.4Å
212	T	40.5	Very low	46.4	Very low	149 Å²	149	112.1 Å²	112.1	91%	0.914	63%	0.629	S	S	*	*			trans	-80.1	101.8	179.3	51.6	0	0	0	0	110.7
213	S	43.1	Very low	45.2	Very low	82 Å²	82	112.9 Å²	112.9	57%	0.573	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-75.5	150.9	156.3	34.1	0	0	0	0	109.9	K211	K211-S213 PolarHBondContact O-N 3.4Å
214	P	40.3	Very low	43.7	Very low	124 Å²	124	119 Å²	119	81%	0.805	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-65.5	133.9	162.3	-16.2	31.2	0	0	0	109.6	D216	P214-D216 PolarHBondContact O-N 3.33Å
215	D	42.2	Very low	43	Very low	152 Å²	152	116 Å²	116	81%	0.813	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-68.2	118.2	177.3	-175.6	5.7	0	0	0	110.6	G217	D215-G217 WeakPolarHBondContact OD1-CA 3.45Å; D215-G217 PolarHBondContact OD1-N 2.78Å
216	D	48.2	Very low	42.3	Very low	103 Å²	103	116.2 Å²	116.2	55%	0.551	66%	0.661	S	S	*	*			trans	-92.9	-4.5	174.4	81.6	11.5	0	0	0	113.4	P214 L218 S219	P214-D216 PolarHBondContact O-N 3.33Å; D216-L218 PolarHBondContact O-N 2.86Å; D216-L218 PolarHBondContact OD1-N 3.5Å; D216-S219 PolarHBondContact OD1-N 2.79Å; D216-S219 PolarHBondContact OD1-OG 3.44Å; D216-S219 PolarHBondContact OD2-OG 3.45Å; D216-S219 VanDerWaalsContact OD2-OG 3.07Å
217	G	46.6	Very low	41.8	Very low	58 Å²	58	112.9 Å²	112.9	60%	0.598	65%	0.649	S	S	*	*	S	Bend	trans	64.7	0.5	175.8	0	0	0	0	0	116.1	D215	D215-G217 WeakPolarHBondContact OD1-CA 3.45Å; D215-G217 PolarHBondContact OD1-N 2.78Å
218	L	41.7	Very low	42.2	Very low	169 Å²	169	111.9 Å²	111.9	89%	0.885	65%	0.646	S	S	*	*	S	Bend	trans	-138.7	-5.7	-164.8	-72	176.6	0	0	0	115.4	D216	D216-L218 PolarHBondContact O-N 2.86Å; D216-L218 PolarHBondContact OD1-N 3.5Å
219	S	35.9	Very low	42.4	Very low	69 Å²	69	110.1 Å²	110.1	48%	0.483	64%	0.64	S	S	.	*			trans	-122.3	126	172.4	69.3	0	0	0	0	113.9	D216 D221	D216-S219 PolarHBondContact OD1-N 2.79Å; D216-S219 PolarHBondContact OD1-OG 3.44Å; D216-S219 PolarHBondContact OD2-OG 3.45Å; D216-S219 VanDerWaalsContact OD2-OG 3.07Å; S219-D221 VanDerWaalsContact C-N 3.26Å; S219-D221 PolarHBondContact O-N 2.8Å
220	S	35	Very low	43.2	Very low	122 Å²	122	107 Å²	107	85%	0.853	63%	0.63	S	S	*	*			trans	-77.8	78.4	167.8	163.6	0	0	0	0	108.6	G222	S220-G222 PolarHBondContact O-N 3.45Å
221	D	39.9	Very low	44	Very low	114 Å²	114	107.3 Å²	107.3	61%	0.61	62%	0.62	S	S	*	*			trans	-69.9	13.4	-170.8	76.2	-19.7	0	0	0	115.9	S219 F223	S219-D221 VanDerWaalsContact C-N 3.26Å; S219-D221 PolarHBondContact O-N 2.8Å; D221-F223 PolarHBondContact O-N 3.09Å; D221-F223 VanDerWaalsContact O-N 3.09Å
222	G	38	Very low	44.7	Very low	56 Å²	56	101 Å²	101	58%	0.577	59%	0.593	S	S	*	*			trans	75.4	0.9	157.2	0	0	0	0	0	116.2	S220 Q224	S220-G222 PolarHBondContact O-N 3.45Å; G222-Q224 PolarHBondContact O-N 3.41Å
223	F	41	Very low	45.9	Very low	153 Å²	153	97 Å²	97	67%	0.671	57%	0.569	S	S	*	*			trans	-79	59.9	-176.3	-139.4	-88.7	0	0	0	112.8	D221	D221-F223 PolarHBondContact O-N 3.09Å; D221-F223 VanDerWaalsContact O-N 3.09Å
224	Q	37.3	Very low	46.7	Very low	180 Å²	180	95.6 Å²	95.6	84%	0.841	55%	0.551	S	S	*	*			trans	-68	138.9	-178.2	-63.6	-153.5	-14.5	0	0	112	G222	G222-Q224 PolarHBondContact O-N 3.41Å
225	S	44.1	Very low	47.7	Very low	88 Å²	88	90.2 Å²	90.2	62%	0.615	52%	0.518	S	S	*	.			trans	71.4	76.5	-173.7	-148.5	0	0	0	0	115.3	T227	S225-T227 PolarHBondContact O-N 3.03Å; S225-T227 VanDerWaalsContact O-N 3.1Å; S225-T227 PolarHBondContact OG-O 3.36Å
226	T	42.9	Very low	48.5	Very low	84 Å²	84	84 Å²	84	52%	0.515	49%	0.488	S	S	.	.	S	Bend	trans	-65.1	-1.8	164.1	56.1	0	0	0	0	113.9	Y208 M209	Y208-T226 CarbonylContact C-O 3.46Å; Y208-T226 WeakPolarHBondContact CA-O 3.33Å; M209-T226 CarbonylContact C-O 3.56Å; M209-T226 PolarHBondContact N-O 2.77Å
227	T	40.4	Very low	48.9	Very low	20 Å²	20	83.7 Å²	83.7	12%	0.123	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	112.6	-176	-55.9	0	0	0	0	109.9	K206 E207 Y208 S225 Y229	K206-T227 HydrophobicContact CD-CG2 4.06Å; K206-T227 HydrophobicContact CG-CG2 3.43Å; K206-T227 VanDerWaalsContact CG-CG2 3.43Å; E207-T227 CarbonylContact O-C 3.51Å; E207-T227 VanDerWaalsContact O-CA 3.31Å; E207-T227 WeakPolarHBondContact O-CA 3.2Å; Y208-T227 HydrophobicContact CD1-CG2 4.34Å; Y208-T227 HydrophobicContact CE1-CG2 4.45Å; S225-T227 PolarHBondContact O-N 3.03Å; S225-T227 VanDerWaalsContact O-N 3.1Å; S225-T227 PolarHBondContact OG-O 3.36Å; T227-Y229 HydrophobicContact CG2-CD2 3.99Å; T227-Y229 HydrophobicContact CG2-CE1 4.34Å; T227-Y229 HydrophobicContact CG2-CE2 3.51Å
228	N	52.3	Low	49.3	Very low	78 Å²	78	85.3 Å²	85.3	42%	0.417	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	146.1	168.8	-171.9	30.1	0	0	0	109.9	E207	E207-N228 HydrophobicContact CB-CB 4.33Å; E207-N228 PolarHBondContact N-O 2.93Å; E207-N228 PolarHBondContact O-N 3.32Å; E207-N228 PolarHBondContact OE2-ND2 3.15Å
229	Y	51.6	Low	49.5	Very low	130 Å²	130	82.5 Å²	82.5	51%	0.51	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	105.9	176.7	-71.6	-88.2	0	0	0	110	I205 K206 T227	I205-Y229 CarbonylContact O-C 3.52Å; I205-Y229 WeakPolarHBondContact O-CA 3.13Å; K206-Y229 HydrophobicContact CB-CD1 4.08Å; K206-Y229 HydrophobicContact CB-CE1 3.99Å; K206-Y229 HydrophobicContact CD-CE1 3.75Å; K206-Y229 VanDerWaalsContact CE-OH 3.26Å; K206-Y229 WeakPolarHBondContact CE-OH 3.15Å; K206-Y229 HydrophobicContact CG-CD1 4.02Å; K206-Y229 HydrophobicContact CG-CE1 3.57Å; T227-Y229 HydrophobicContact CG2-CD2 3.99Å; T227-Y229 HydrophobicContact CG2-CE1 4.34Å; T227-Y229 HydrophobicContact CG2-CE2 3.51Å
230	S	59.1	Low	49.8	Very low	55 Å²	55	88.6 Å²	88.6	39%	0.385	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	152.9	166.9	-171.8	0	0	0	0	110.1	K204 I205	K204-S230 CarbonylContact C-O 3.51Å; K204-S230 WeakPolarHBondContact CA-O 3.04Å; I205-S230 PolarHBondContact N-O 2.81Å; I205-S230 PolarHBondContact O-N 3.44Å
231	T	57.8	Low	49.8	Very low	63 Å²	63	88.2 Å²	88.2	39%	0.387	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	101.7	176.9	-52	0	0	0	0	110.1	Q202 I203 K204	Q202-T231 HydrophobicContact CB-CG2 4.1Å; I203-T231 WeakPolarHBondContact O-CA 3.34Å; K204-T231 HydrophobicContact CG-CG2 4.12Å
232	E	60.8	Low	49.5	Very low	72 Å²	72	89.1 Å²	89.1	34%	0.336	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	142.8	173.9	-79.1	-84.4	111.5	0	0	109.9	Q202 I203 I205 R234	Q202-E232 CarbonylContact C-O 3.52Å; Q202-E232 WeakPolarHBondContact CA-O 3.25Å; I203-E232 PolarHBondContact N-O 3.48Å; I203-E232 PolarHBondContact O-N 2.89Å; I205-E232 HydrophobicContact CD1-CG 3.83Å; E232-R234 IonicContact OE2-CZ 2.66Å; E232-R234 IonicContact OE2-NE 2.73Å; E232-R234 PolarHBondContact OE2-NE 3.16Å; E232-R234 IonicContact OE2-NH2 3.94Å; E232-R234 PolarHBondContact OE2-NH2 2.92Å
233	T	65.4	Low	49.5	Very low	64 Å²	64	94 Å²	94	39%	0.393	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.2	171.9	-55.4	0	0	0	0	109.4	L200 Q202	L200-T233 HydrophobicContact CB-CG2 4.39Å; L200-T233 HydrophobicContact CD2-CG2 4.27Å; Q202-T233 HydrophobicContact CG-CG2 4.24Å
234	R	59.9	Low	49.3	Very low	54 Å²	54	92.3 Å²	92.3	20%	0.204	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.5	178.2	-61.4	-169.4	-179.3	-141.9	-5.7	110.7	V201 E232 D283	V201-R234 PolarHBondContact N-O 3.49Å; V201-R234 PolarHBondContact O-N 3.13Å; E232-R234 IonicContact OE2-CZ 2.66Å; E232-R234 IonicContact OE2-NE 2.73Å; E232-R234 PolarHBondContact OE2-NE 3.16Å; E232-R234 IonicContact OE2-NH2 3.94Å; E232-R234 PolarHBondContact OE2-NH2 2.92Å; R234-D283 IonicContact CZ-OD2 2.78Å; R234-D283 VanDerWaalsContact CZ-OD2 3.25Å; R234-D283 IonicContact NH1-OD2 3.45Å; R234-D283 PolarHBondContact NH1-OD2 2.64Å; R234-D283 IonicContact NH2-OD2 3.96Å; R234-D283 PolarHBondContact NH2-OD2 3.3Å
235	G	61.6	Low	49.6	Very low	10 Å²	10	92.9 Å²	92.9	10%	0.103	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	156	178.6	0	0	0	0	0	113.2	V277	G235-V277 VanDerWaalsContact O-CG2 3.26Å; G235-V277 WeakPolarHBondContact O-CG2 3.44Å
236	A	59.1	Low	49.6	Very low	22 Å²	22	89.4 Å²	89.4	18%	0.182	44%	0.437	C	S	.	.			trans	-98	147.3	171.3	0	0	0	0	0	111.5	D198 E199 Y238 L273	D198-A236 WeakPolarHBondContact O-CB 3.22Å; E199-A236 PolarHBondContact O-N 3.33Å; A236-Y238 HydrophobicContact CB-CE2 3.72Å; A236-L273 WeakPolarHBondContact O-CD2 3.49Å
237	Y	57.1	Low	49.8	Very low	97 Å²	97	90.4 Å²	90.4	38%	0.38	44%	0.438	S	S	.	.			trans	-121.7	138.1	177.1	-175.3	-110.9	0	0	0	111.1	Y239 V268 Y270	Y237-Y239 HydrophobicContact CD1-CE2 4.32Å; Y237-Y239 HydrophobicContact CE1-CD1 4.43Å; Y237-Y239 HydrophobicContact CE1-CE1 4.08Å; Y237-Y239 HydrophobicContact CE1-CE2 4.29Å; Y237-V268 HydrophobicContact CD2-CG1 4.3Å; Y237-V268 HydrophobicContact CE2-CG1 4.43Å; Y237-Y270 HydrophobicContact CD2-CE1 4.02Å; Y237-Y270 AromaticContact CE2-CE1 4Å; Y237-Y270 HydrophobicContact CE2-CE1 4Å
238	Y	54.4	Low	50	Low	92 Å²	92	94.4 Å²	94.4	36%	0.361	46%	0.456	S	S	.	.			trans	-127.3	126.3	-170.2	-68.2	-87.1	0	0	0	111.4	W196 G197 D198 A236	W196-Y238 AromaticContact CD1-CE1 3.74Å; W196-Y238 AromaticContact NE1-CE1 3.96Å; G197-Y238 WeakPolarHBondContact CA-OH 3.46Å; G197-Y238 PolarHBondContact N-OH 2.82Å; D198-Y238 PolarHBondContact N-OH 3.01Å; D198-Y238 VanDerWaalsContact N-OH 3.17Å; D198-Y238 PolarHBondContact O-OH 2.87Å; A236-Y238 HydrophobicContact CB-CE2 3.72Å
239	Y	46.6	Very low	49.9	Very low	109 Å²	109	92.4 Å²	92.4	43%	0.427	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-83.1	130.4	168.2	-63.8	-87.9	0	0	0	109.8	Y237 L256	Y237-Y239 HydrophobicContact CD1-CE2 4.32Å; Y237-Y239 HydrophobicContact CE1-CD1 4.43Å; Y237-Y239 HydrophobicContact CE1-CE1 4.08Å; Y237-Y239 HydrophobicContact CE1-CE2 4.29Å; Y239-L256 HydrophobicContact CD1-CD2 3.77Å; Y239-L256 HydrophobicContact CD1-CG 4.38Å; Y239-L256 HydrophobicContact CD2-CD2 3.77Å; Y239-L256 HydrophobicContact CE1-CD2 3.69Å; Y239-L256 HydrophobicContact CE1-CG 4.34Å; Y239-L256 HydrophobicContact CE2-CD2 3.7Å; Y239-L256 HydrophobicContact CG-CD2 3.8Å
240	K	42.3	Very low	50	Low	197 Å²	197	87.8 Å²	87.8	86%	0.857	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-85.8	129.9	169.1	-83.7	-169.1	171.8	-172	0	110.3
241	S	35.1	Very low	49.8	Very low	115 Å²	115	87.7 Å²	87.7	80%	0.804	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-90.7	130.9	169.7	-174.5	0	0	0	0	110
242	E	33.8	Very low	49.8	Very low	132 Å²	132	87.1 Å²	87.1	62%	0.617	44%	0.437	S	S	*	.			trans	-125.9	149.1	167.9	-69	-172	169.9	0	0	109	Y244	E242-Y244 PolarHBondContact O-N 3.44Å
243	N	36	Very low	50	Low	160 Å²	160	85.5 Å²	85.5	86%	0.856	43%	0.43	S	S	*	.			trans	-75.1	106	-161	-55.5	-39.5	0	0	0	113.6
244	Y	38	Very low	50.1	Low	117 Å²	117	89 Å²	89	46%	0.459	44%	0.436	S	S	.	.			trans	-137.3	163.6	179.8	-80.8	-79.6	0	0	0	115.5	F143 E242	F143-Y244 AromaticContact CD1-CE1 3.85Å; F143-Y244 HydrophobicContact CD1-CE1 3.85Å; F143-Y244 AromaticContact CD1-CZ 3.96Å; F143-Y244 VanDerWaalsContact CD1-OH 3.27Å; F143-Y244 WeakPolarHBondContact CD1-OH 3.35Å; F143-Y244 AromaticContact CE1-CE1 3.52Å; F143-Y244 HydrophobicContact CE1-CE1 3.52Å; F143-Y244 HydrophobicContact CG-CE1 4.49Å; F143-Y244 VanDerWaalsContact CG-OH 3.3Å; F143-Y244 WeakPolarHBondContact CG-OH 3.47Å; F143-Y244 AromaticContact CZ-CE1 3.88Å; F143-Y244 HydrophobicContact CZ-CE1 3.88Å; E242-Y244 PolarHBondContact O-N 3.44Å
245	R	42.8	Very low	50.5	Low	191 Å²	191	89.6 Å²	89.6	72%	0.721	45%	0.448	S	S	*	.			trans	-83.3	163.5	-168.2	-55.8	178.4	85.5	-170	4	113	D247 Q248 A249	R245-D247 PolarHBondContact O-N 2.92Å; R245-Q248 PolarHBondContact O-N 3.06Å; R245-Q248 VanDerWaalsContact O-N 3.13Å; R245-A249 PolarHBondContact O-N 3.34Å
246	A	44.4	Very low	50.7	Low	16 Å²	16	91.9 Å²	91.9	13%	0.132	46%	0.458	C	S	.	.	H	α-helix	trans	-51.5	-45.8	-161.9	0	0	0	0	0	116.9	Q248 A249 E250	A246-Q248 PolarHBondContact O-N 3.38Å; A246-A249 WeakPolarHBondContact O-CA 3.38Å; A246-A249 VanDerWaalsContact O-CB 3.25Å; A246-A249 WeakPolarHBondContact O-CB 2.12Å; A246-A249 PolarHBondContact O-N 2.84Å; A246-E250 PolarHBondContact O-N 2.87Å; A246-E250 VanDerWaalsContact O-N 3.13Å
247	D	47	Very low	51	Low	104 Å²	104	91.1 Å²	91.1	56%	0.556	45%	0.452	S	S	*	.	H	α-helix	trans	-68.2	-35.8	-178.2	-61.8	-81.9	0	0	0	112.8	R171 R245 A249 E250 A251	R171-D247 IonicContact CZ-OD1 3.66Å; R171-D247 IonicContact NH1-OD1 3.13Å; R171-D247 PolarHBondContact NH1-OD1 2.97Å; R171-D247 IonicContact NH2-OD1 3.65Å; R171-D247 PolarHBondContact NH2-OD1 2.94Å; R171-D247 IonicContact NH2-OD2 2.75Å; R171-D247 PolarHBondContact NH2-OD2 3.24Å; R171-D247 VanDerWaalsContact NH2-OD2 3.08Å; R245-D247 PolarHBondContact O-N 2.92Å; D247-A249 VanDerWaalsContact C-N 3.3Å; D247-E250 PolarHBondContact O-N 2.81Å; D247-A251 PolarHBondContact O-N 3.12Å; D247-A251 VanDerWaalsContact O-N 3.15Å
248	Q	44	Very low	51.6	Low	105 Å²	105	91.1 Å²	91.1	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-72.5	-25.2	171.1	-70.6	-175.3	-7.4	0	0	112	R245 A246 A251 A252	R245-Q248 PolarHBondContact O-N 3.06Å; R245-Q248 VanDerWaalsContact O-N 3.13Å; A246-Q248 PolarHBondContact O-N 3.38Å; Q248-A251 PolarHBondContact O-N 3.13Å; Q248-A252 WeakPolarHBondContact O-CB 3.22Å; Q248-A252 PolarHBondContact O-N 3.19Å
249	A	50.1	Low	52.5	Low	35 Å²	35	89.9 Å²	89.9	29%	0.289	46%	0.457	S	S	.	.	H	α-helix	trans	-64.2	-44.9	170.7	0	0	0	0	0	111	R245 A246 D247 A252 M253	R245-A249 PolarHBondContact O-N 3.34Å; A246-A249 WeakPolarHBondContact O-CA 3.38Å; A246-A249 VanDerWaalsContact O-CB 3.25Å; A246-A249 WeakPolarHBondContact O-CB 2.12Å; A246-A249 PolarHBondContact O-N 2.84Å; D247-A249 VanDerWaalsContact C-N 3.3Å; A249-A252 PolarHBondContact O-N 2.88Å; A249-M253 WeakPolarHBondContact O-CG 3.19Å; A249-M253 PolarHBondContact O-N 2.79Å
250	E	53.9	Low	53.6	Low	34 Å²	34	88 Å²	88	16%	0.159	45%	0.449	C	S	.	.	H	α-helix	trans	-63.7	-44.4	175	-162.1	-163.6	132.6	0	0	111.9	A246 D247 A252 M253 R254	A246-E250 PolarHBondContact O-N 2.87Å; A246-E250 VanDerWaalsContact O-N 3.13Å; D247-E250 PolarHBondContact O-N 2.81Å; E250-A252 VanDerWaalsContact C-N 3.3Å; E250-A252 PolarHBondContact O-N 2.88Å; E250-M253 PolarHBondContact O-N 3.3Å; E250-R254 WeakPolarHBondContact O-CG 3.4Å; E250-R254 PolarHBondContact O-N 3.11Å; E250-R254 IonicContact OE1-CZ 3.41Å; E250-R254 IonicContact OE1-NE 2.78Å; E250-R254 PolarHBondContact OE1-NE 3.18Å; E250-R254 IonicContact OE1-NH2 3.23Å; E250-R254 PolarHBondContact OE1-NH2 2.7Å
251	A	56.8	Low	54.9	Low	53 Å²	53	80.1 Å²	80.1	44%	0.438	42%	0.416	S	S	.	.	H	α-helix	trans	-60.2	-38.8	176.3	0	0	0	0	0	112.6	D247 Q248 S255	D247-A251 PolarHBondContact O-N 3.12Å; D247-A251 VanDerWaalsContact O-N 3.15Å; Q248-A251 PolarHBondContact O-N 3.13Å; A251-S255 WeakPolarHBondContact O-CB 3.48Å; A251-S255 PolarHBondContact O-N 2.84Å; A251-S255 PolarHBondContact O-OG 3.27Å
252	A	57.7	Low	56.8	Low	50 Å²	50	78.6 Å²	78.6	41%	0.413	40%	0.399	S	S	.	.	H	α-helix	trans	-67.1	-42	173.9	0	0	0	0	0	112	Q248 A249 E250 R254 S255 L256	Q248-A252 WeakPolarHBondContact O-CB 3.22Å; Q248-A252 PolarHBondContact O-N 3.19Å; A249-A252 PolarHBondContact O-N 2.88Å; E250-A252 VanDerWaalsContact C-N 3.3Å; E250-A252 PolarHBondContact O-N 2.88Å; A252-R254 PolarHBondContact O-N 3.07Å; A252-S255 PolarHBondContact O-N 3.35Å; A252-L256 WeakPolarHBondContact O-CB 3.29Å; A252-L256 PolarHBondContact O-N 2.9Å
253	M	64.1	Low	58.7	Low	38 Å²	38	76.1 Å²	76.1	19%	0.187	39%	0.386	C	S	.	.	H	α-helix	trans	-61.7	-42.4	175.3	-61.4	-90.2	-147.6	0	0	111.3	A174 V177 L178 A249 E250 L256 A257	A174-M253 HydrophobicContact CB-CE 3.93Å; A174-M253 HydrophobicContact CB-CG 4.25Å; V177-M253 HydrophobicContact CG1-CB 3.99Å; L178-M253 HydrophobicContact CB-SD 3.72Å; L178-M253 HydrophobicContact CD1-CB 4.42Å; L178-M253 HydrophobicContact CD1-SD 3.78Å; L178-M253 HydrophobicContact CD2-SD 3.74Å; L178-M253 HydrophobicContact CG-SD 3.93Å; A249-M253 WeakPolarHBondContact O-CG 3.19Å; A249-M253 PolarHBondContact O-N 2.79Å; E250-M253 PolarHBondContact O-N 3.3Å; M253-L256 WeakPolarHBondContact O-CB 3.25Å; M253-L256 PolarHBondContact O-N 3.27Å; M253-A257 PolarHBondContact O-N 2.82Å
254	R	67.4	Low	60.5	Low	138 Å²	138	70.9 Å²	70.9	52%	0.521	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-42.9	173.6	-69.8	-178.9	-177.5	-105	2.7	111.8	V177 E250 A252 A257 I258	V177-R254 HydrophobicContact CG1-CB 4.36Å; V177-R254 HydrophobicContact CG1-CG 3.61Å; V177-R254 HydrophobicContact CG2-CG 4.48Å; E250-R254 WeakPolarHBondContact O-CG 3.4Å; E250-R254 PolarHBondContact O-N 3.11Å; E250-R254 IonicContact OE1-CZ 3.41Å; E250-R254 IonicContact OE1-NE 2.78Å; E250-R254 PolarHBondContact OE1-NE 3.18Å; E250-R254 IonicContact OE1-NH2 3.23Å; E250-R254 PolarHBondContact OE1-NH2 2.7Å; A252-R254 PolarHBondContact O-N 3.07Å; R254-A257 PolarHBondContact O-N 3.27Å; R254-I258 WeakPolarHBondContact O-CG1 3.34Å; R254-I258 PolarHBondContact O-N 3.22Å; R254-I258 VanDerWaalsContact O-N 3.11Å
255	S	67.3	Low	62.3	Low	66 Å²	66	67.7 Å²	67.7	46%	0.462	35%	0.345	S	S	.	.	H	α-helix	trans	-65.1	-42.1	177	-58.1	0	0	0	0	112	A251 A252 A257 I258 D259	A251-S255 WeakPolarHBondContact O-CB 3.48Å; A251-S255 PolarHBondContact O-N 2.84Å; A251-S255 PolarHBondContact O-OG 3.27Å; A252-S255 PolarHBondContact O-N 3.35Å; S255-A257 VanDerWaalsContact C-N 3.32Å; S255-A257 PolarHBondContact O-N 2.74Å; S255-I258 PolarHBondContact O-N 2.98Å; S255-D259 PolarHBondContact O-N 2.76Å
256	L	65.9	Low	63.7	Low	58 Å²	58	61.8 Å²	61.8	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-40.9	172.6	-101.5	148.5	0	0	0	112.3	L178 Y239 A252 M253 R260	L178-L256 HydrophobicContact CD1-CB 4.11Å; Y239-L256 HydrophobicContact CD1-CD2 3.77Å; Y239-L256 HydrophobicContact CD1-CG 4.38Å; Y239-L256 HydrophobicContact CD2-CD2 3.77Å; Y239-L256 HydrophobicContact CE1-CD2 3.69Å; Y239-L256 HydrophobicContact CE1-CG 4.34Å; Y239-L256 HydrophobicContact CE2-CD2 3.7Å; Y239-L256 HydrophobicContact CG-CD2 3.8Å; A252-L256 WeakPolarHBondContact O-CB 3.29Å; A252-L256 PolarHBondContact O-N 2.9Å; M253-L256 WeakPolarHBondContact O-CB 3.25Å; M253-L256 PolarHBondContact O-N 3.27Å; L256-R260 WeakPolarHBondContact O-CB 3.26Å; L256-R260 PolarHBondContact O-N 3.25Å
257	A	66.8	Low	65.3	Low	6 Å²	6	61.6 Å²	61.6	5%	0.05	33%	0.332	C	S	.	.	H	α-helix	trans	-66	-39.6	175.6	0	0	0	0	0	112.4	M182 M253 R254 S255 R260 N261	M182-A257 HydrophobicContact CE-CB 4.24Å; M182-A257 WeakPolarHBondContact CE-O 3.33Å; M182-A257 HydrophobicContact CG-CB 4.32Å; M182-A257 HydrophobicContact SD-CB 4.27Å; M253-A257 PolarHBondContact O-N 2.82Å; R254-A257 PolarHBondContact O-N 3.27Å; S255-A257 VanDerWaalsContact C-N 3.32Å; S255-A257 PolarHBondContact O-N 2.74Å; A257-R260 PolarHBondContact O-N 2.77Å; A257-N261 PolarHBondContact O-N 3.27Å
258	I	70.2	Confident	66.4	Low	98 Å²	98	58.3 Å²	58.3	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-65.3	-46.5	175.6	-67.8	167.4	0	0	0	110.7	R254 S255 R260 N261 N262	R254-I258 WeakPolarHBondContact O-CG1 3.34Å; R254-I258 PolarHBondContact O-N 3.22Å; R254-I258 VanDerWaalsContact O-N 3.11Å; S255-I258 PolarHBondContact O-N 2.98Å; I258-R260 VanDerWaalsContact C-N 3.35Å; I258-R260 PolarHBondContact O-N 3.5Å; I258-N261 WeakPolarHBondContact O-CA 3.24Å; I258-N261 VanDerWaalsContact O-CB 3.22Å; I258-N261 WeakPolarHBondContact O-CB 3.3Å; I258-N261 PolarHBondContact O-N 3.11Å; I258-N261 VanDerWaalsContact O-N 3.09Å; I258-N262 PolarHBondContact O-N 2.83Å
259	D	71.5	Confident	67.4	Low	65 Å²	65	60 Å²	60	35%	0.348	32%	0.323	S	S	.	.	H	α-helix	trans	-68.8	-30.4	178.7	-84.9	-16.4	0	0	0	112.9	S255 N261 N262 F263	S255-D259 PolarHBondContact O-N 2.76Å; D259-N261 VanDerWaalsContact C-N 3.25Å; D259-N261 PolarHBondContact O-N 2.73Å; D259-N262 PolarHBondContact O-N 3.06Å; D259-N262 PolarHBondContact OD1-ND2 3.49Å; D259-F263 VanDerWaalsContact O-CB 3.25Å; D259-F263 WeakPolarHBondContact O-CB 3.14Å; D259-F263 PolarHBondContact O-N 3.33Å
260	R	71.5	Confident	68	Low	71 Å²	71	64.2 Å²	64.2	27%	0.268	33%	0.333	S	S	.	.	H	α-helix	trans	-57.4	-40	168	-174.8	170.8	92.2	-139.4	6.5	111.6	L178 A180 D185 L256 A257 I258 F264	L178-R260 PolarHBondContact O-NH1 3.4Å; A180-R260 PolarHBondContact O-NH2 2.8Å; D185-R260 IonicContact OD1-NE 3.88Å; D185-R260 IonicContact OD1-NH2 2.67Å; D185-R260 IonicContact OD2-CZ 3.32Å; D185-R260 IonicContact OD2-NE 2.68Å; D185-R260 PolarHBondContact OD2-NE 2.82Å; D185-R260 IonicContact OD2-NH2 3.51Å; D185-R260 PolarHBondContact OD2-NH2 3.43Å; L256-R260 WeakPolarHBondContact O-CB 3.26Å; L256-R260 PolarHBondContact O-N 3.25Å; A257-R260 PolarHBondContact O-N 2.77Å; I258-R260 VanDerWaalsContact C-N 3.35Å; I258-R260 PolarHBondContact O-N 3.5Å; R260-F264 PolarHBondContact O-N 3.25Å
261	N	69.5	Low	68.2	Low	30 Å²	30	73.3 Å²	73.3	16%	0.16	37%	0.372	C	S	.	.	H	α-helix	trans	-68.6	-45.6	177.1	-137.4	35.1	0	0	0	111	M182 V183 A184 A257 I258 D259 F264 F265	M182-N261 HydrophobicContact CE-CB 4.21Å; V183-N261 PolarHBondContact N-OD1 3.24Å; A184-N261 WeakPolarHBondContact CB-OD1 3.19Å; A184-N261 PolarHBondContact N-OD1 3.03Å; A257-N261 PolarHBondContact O-N 3.27Å; I258-N261 WeakPolarHBondContact O-CA 3.24Å; I258-N261 VanDerWaalsContact O-CB 3.22Å; I258-N261 WeakPolarHBondContact O-CB 3.3Å; I258-N261 PolarHBondContact O-N 3.11Å; I258-N261 VanDerWaalsContact O-N 3.09Å; D259-N261 VanDerWaalsContact C-N 3.25Å; D259-N261 PolarHBondContact O-N 2.73Å; N261-F264 PolarHBondContact O-N 3.01Å; N261-F265 VanDerWaalsContact O-CD2 3.26Å; N261-F265 WeakPolarHBondContact O-CD2 3.45Å; N261-F265 PolarHBondContact O-N 2.87Å
262	N	73.7	Confident	68.2	Low	84 Å²	84	73.3 Å²	73.3	45%	0.449	38%	0.377	S	S	.	.	H	α-helix	trans	-62.5	-43.7	177.4	-69.5	-32.2	0	0	0	112.5	I258 D259 F264 F265 S266	I258-N262 PolarHBondContact O-N 2.83Å; D259-N262 PolarHBondContact O-N 3.06Å; D259-N262 PolarHBondContact OD1-ND2 3.49Å; N262-F264 VanDerWaalsContact C-N 3.29Å; N262-F264 PolarHBondContact O-N 3.27Å; N262-F265 PolarHBondContact O-N 2.97Å; N262-S266 WeakPolarHBondContact O-CB 3.2Å; N262-S266 PolarHBondContact O-N 2.91Å
263	F	74.2	Confident	68.2	Low	80 Å²	80	72.3 Å²	72.3	35%	0.351	36%	0.364	S	S	.	.	H	α-helix	trans	-56.2	-41.7	177.5	176.2	-87.7	0	0	0	112	D259 G267 V268 V277	D259-F263 VanDerWaalsContact O-CB 3.25Å; D259-F263 WeakPolarHBondContact O-CB 3.14Å; D259-F263 PolarHBondContact O-N 3.33Å; F263-G267 VanDerWaalsContact O-CA 3.25Å; F263-G267 WeakPolarHBondContact O-CA 3.39Å; F263-G267 PolarHBondContact O-N 3.49Å; F263-V268 HydrophobicContact CD2-CG2 3.7Å; F263-V268 HydrophobicContact CE2-CG2 4.26Å; F263-V277 HydrophobicContact CE2-CG1 3.83Å; F263-V277 HydrophobicContact CZ-CG1 3.64Å
264	F	74.9	Confident	67.9	Low	49 Å²	49	77.2 Å²	77.2	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-65	-44.6	179.8	179.5	-100.5	0	0	0	113.4	A184 L187 A188 R260 N261 N262 G279 L280	A184-F264 HydrophobicContact CB-CB 3.48Å; A184-F264 VanDerWaalsContact CB-CB 3.48Å; A184-F264 HydrophobicContact CB-CD1 3.63Å; A184-F264 HydrophobicContact CB-CD2 4.17Å; A184-F264 HydrophobicContact CB-CE1 4.41Å; A184-F264 HydrophobicContact CB-CG 3.49Å; A184-F264 VanDerWaalsContact CB-CG 3.49Å; L187-F264 HydrophobicContact CB-CE1 3.87Å; L187-F264 HydrophobicContact CB-CZ 4.05Å; L187-F264 HydrophobicContact CD1-CE1 4.37Å; A188-F264 HydrophobicContact CB-CE2 3.93Å; A188-F264 HydrophobicContact CB-CZ 3.93Å; R260-F264 PolarHBondContact O-N 3.25Å; N261-F264 PolarHBondContact O-N 3.01Å; N262-F264 VanDerWaalsContact C-N 3.29Å; N262-F264 PolarHBondContact O-N 3.27Å; F264-G279 CarbonylContact O-C 3.58Å; F264-G279 VanDerWaalsContact O-CA 3.25Å; F264-G279 WeakPolarHBondContact O-CA 3.38Å; F264-L280 HydrophobicContact CE1-CB 4.5Å; F264-L280 HydrophobicContact CE1-CD2 4.04Å; F264-L280 HydrophobicContact CZ-CD2 4.45Å; F264-L280 PolarHBondContact O-N 2.78Å
265	F	73.8	Confident	67.7	Low	51 Å²	51	71.8 Å²	71.8	22%	0.224	37%	0.372	C	S	.	.	H	α-helix	trans	-79.3	-43	-178.6	-69.2	-69.7	0	0	0	112.8	V183 L187 N261 N262 G279 L280 L281	V183-F265 HydrophobicContact CG1-CZ 4.29Å; L187-F265 HydrophobicContact CD1-CE1 3.69Å; L187-F265 HydrophobicContact CD1-CZ 3.58Å; N261-F265 VanDerWaalsContact O-CD2 3.26Å; N261-F265 WeakPolarHBondContact O-CD2 3.45Å; N261-F265 PolarHBondContact O-N 2.87Å; N262-F265 PolarHBondContact O-N 2.97Å; F265-G279 CarbonylContact O-C 3.59Å; F265-L280 HydrophobicContact CD1-CD2 4.43Å; F265-L280 HydrophobicContact CE1-CD2 4.42Å; F265-L280 PolarHBondContact O-N 2.8Å; F265-L281 HydrophobicContact CB-CD1 4.16Å; F265-L281 HydrophobicContact CB-CG 4.45Å; F265-L281 WeakPolarHBondContact O-CB 3.09Å; F265-L281 PolarHBondContact O-N 2.88Å
266	S	74.1	Confident	67.7	Low	67 Å²	67	72.4 Å²	72.4	47%	0.469	37%	0.366	S	S	.	.	H	α-helix	trans	-109.6	-11.4	-166.1	-57	0	0	0	0	114.5	N262 N282	N262-S266 WeakPolarHBondContact O-CB 3.2Å; N262-S266 PolarHBondContact O-N 2.91Å; S266-N282 PolarHBondContact O-ND2 2.74Å
267	G	76.1	Confident	67.9	Low	11 Å²	11	70.2 Å²	70.2	11%	0.113	36%	0.355	C	S	.	.			trans	65	-166.1	-173.2	0	0	0	0	0	113.4	F263 V277	F263-G267 VanDerWaalsContact O-CA 3.25Å; F263-G267 WeakPolarHBondContact O-CA 3.39Å; F263-G267 PolarHBondContact O-N 3.49Å; G267-V277 CarbonylContact C-O 3.55Å; G267-V277 WeakPolarHBondContact CA-O 3.24Å
268	V	70.6	Confident	68.2	Low	36 Å²	36	71.3 Å²	71.3	22%	0.218	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-140.3	132.4	175.5	172.7	0	0	0	0	110.3	Y237 F263 Y270 L273 V277	Y237-V268 HydrophobicContact CD2-CG1 4.3Å; Y237-V268 HydrophobicContact CE2-CG1 4.43Å; F263-V268 HydrophobicContact CD2-CG2 3.7Å; F263-V268 HydrophobicContact CE2-CG2 4.26Å; V268-Y270 HydrophobicContact CG1-CD1 3.93Å; V268-Y270 HydrophobicContact CG1-CE1 4.36Å; V268-L273 HydrophobicContact CG1-CD1 3.96Å; V268-V277 PolarHBondContact N-O 2.73Å; V268-V277 PolarHBondContact O-N 3.27Å; V268-V277 VanDerWaalsContact O-N 3.16Å
269	E	65.1	Low	68.4	Low	139 Å²	139	67.1 Å²	67.1	65%	0.65	34%	0.341	S	S	*	.			trans	-135.3	123.4	172.9	-174.9	172.9	-178.3	0	0	109.4	K276	E269-K276 HydrophobicContact CB-CD 4.31Å; E269-K276 HydrophobicContact CB-CG 4.2Å; E269-K276 HydrophobicContact CG-CD 4.27Å; E269-K276 HydrophobicContact CG-CG 4.36Å; E269-K276 WeakPolarHBondContact OE2-CD 3.31Å; E269-K276 WeakPolarHBondContact OE2-CE 3.2Å; E269-K276 IonicContact OE2-NZ 2.75Å; E269-K276 PolarHBondContact OE2-NZ 3.09Å
270	Y	63.7	Low	68.4	Low	124 Å²	124	65.7 Å²	65.7	49%	0.486	33%	0.333	S	S	.	.			trans	-149.6	159.2	167.8	70.8	-90.8	0	0	0	110	Y237 V268 G272 L273	Y237-Y270 HydrophobicContact CD2-CE1 4.02Å; Y237-Y270 AromaticContact CE2-CE1 4Å; Y237-Y270 HydrophobicContact CE2-CE1 4Å; V268-Y270 HydrophobicContact CG1-CD1 3.93Å; V268-Y270 HydrophobicContact CG1-CE1 4.36Å; Y270-G272 VanDerWaalsContact CD2-N 3.33Å; Y270-G272 PolarHBondContact O-N 3.18Å; Y270-L273 HydrophobicContact CD1-CD1 3.71Å; Y270-L273 HydrophobicContact CD1-CG 4.13Å; Y270-L273 HydrophobicContact CE1-CB 4.5Å; Y270-L273 HydrophobicContact CE1-CD1 3.52Å; Y270-L273 HydrophobicContact CE1-CG 3.6Å; Y270-L273 PolarHBondContact O-N 3.09Å; Y270-L273 VanDerWaalsContact O-N 3.16Å
271	K	57.7	Low	68.4	Low	226 Å²	226	67 Å²	67	98%	0.983	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	5.5	-171.3	-87.6	-173.1	175	178	0	117.5
272	G	57.6	Low	68.2	Low	53 Å²	53	68.2 Å²	68.2	55%	0.546	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-0.1	178.9	0	0	0	0	0	115.3	Y270	Y270-G272 VanDerWaalsContact CD2-N 3.33Å; Y270-G272 PolarHBondContact O-N 3.18Å
273	L	56.2	Low	68	Low	28 Å²	28	65.8 Å²	65.8	15%	0.147	34%	0.338	C	S	.	.			trans	-78.9	126.5	170.7	-96.3	162.1	0	0	0	109.8	A236 V268 Y270 A275 V277	A236-L273 WeakPolarHBondContact O-CD2 3.49Å; V268-L273 HydrophobicContact CG1-CD1 3.96Å; Y270-L273 HydrophobicContact CD1-CD1 3.71Å; Y270-L273 HydrophobicContact CD1-CG 4.13Å; Y270-L273 HydrophobicContact CE1-CB 4.5Å; Y270-L273 HydrophobicContact CE1-CD1 3.52Å; Y270-L273 HydrophobicContact CE1-CG 3.6Å; Y270-L273 PolarHBondContact O-N 3.09Å; Y270-L273 VanDerWaalsContact O-N 3.16Å; L273-A275 VanDerWaalsContact C-N 3.26Å; L273-A275 PolarHBondContact O-N 3.48Å; L273-V277 HydrophobicContact CD1-CG2 4.17Å; L273-V277 HydrophobicContact CD2-CG2 4.2Å
274	Q	58.3	Low	67.5	Low	141 Å²	141	66.9 Å²	66.9	66%	0.659	35%	0.353	S	S	*	.	S	Bend	trans	-67.7	-26.3	177.3	-66.4	-150.9	42	0	0	113.2	E199 L200	E199-Q274 PolarHBondContact OE2-NE2 3.16Å; L200-Q274 HydrophobicContact CD1-CB 4.14Å; L200-Q274 HydrophobicContact CD2-CB 3.96Å; L200-Q274 HydrophobicContact CG-CB 4.17Å
275	A	64	Low	67	Low	25 Å²	25	69.1 Å²	69.1	21%	0.207	38%	0.375	C	S	.	.	S	Bend	trans	-139.7	138.8	169.4	0	0	0	0	0	109.7	L200 L273	L200-A275 HydrophobicContact CD2-CB 3.56Å; L273-A275 VanDerWaalsContact C-N 3.26Å; L273-A275 PolarHBondContact O-N 3.48Å
276	K	66.7	Low	66.2	Low	79 Å²	79	69.1 Å²	69.1	34%	0.343	38%	0.377	S	S	.	.			trans	-61.2	141	177.9	-179.4	174.6	174.7	161.8	0	111	E269 N278	E269-K276 HydrophobicContact CB-CD 4.31Å; E269-K276 HydrophobicContact CB-CG 4.2Å; E269-K276 HydrophobicContact CG-CD 4.27Å; E269-K276 HydrophobicContact CG-CG 4.36Å; E269-K276 WeakPolarHBondContact OE2-CD 3.31Å; E269-K276 WeakPolarHBondContact OE2-CE 3.2Å; E269-K276 IonicContact OE2-NZ 2.75Å; E269-K276 PolarHBondContact OE2-NZ 3.09Å; K276-N278 WeakPolarHBondContact CD-OD1 3.5Å; K276-N278 WeakPolarHBondContact CE-OD1 3.45Å; K276-N278 WeakPolarHBondContact CG-OD1 3.25Å
277	V	70.8	Confident	65.5	Low	12 Å²	12	68.1 Å²	68.1	7%	0.073	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-98	107.6	171.8	-170.7	0	0	0	0	108	G235 F263 G267 V268 L273	G235-V277 VanDerWaalsContact O-CG2 3.26Å; G235-V277 WeakPolarHBondContact O-CG2 3.44Å; F263-V277 HydrophobicContact CE2-CG1 3.83Å; F263-V277 HydrophobicContact CZ-CG1 3.64Å; G267-V277 CarbonylContact C-O 3.55Å; G267-V277 WeakPolarHBondContact CA-O 3.24Å; V268-V277 PolarHBondContact N-O 2.73Å; V268-V277 PolarHBondContact O-N 3.27Å; V268-V277 VanDerWaalsContact O-N 3.16Å; L273-V277 HydrophobicContact CD1-CG2 4.17Å; L273-V277 HydrophobicContact CD2-CG2 4.2Å
278	N	71.4	Confident	64.5	Low	29 Å²	29	71.8 Å²	71.8	16%	0.155	41%	0.406	C	S	.	.			trans	-91.7	137.8	179.3	-46.7	-66	0	0	0	110.7	K276 N282 P284	K276-N278 WeakPolarHBondContact CD-OD1 3.5Å; K276-N278 WeakPolarHBondContact CE-OD1 3.45Å; K276-N278 WeakPolarHBondContact CG-OD1 3.25Å; N278-N282 WeakPolarHBondContact CA-OD1 3.48Å; N278-P284 WeakPolarHBondContact ND2-CD 3.45Å
279	G	74.3	Confident	63.6	Low	9 Å²	9	78.6 Å²	78.6	9%	0.093	43%	0.429	C	S	.	.			trans	-100.4	-177.3	171.2	0	0	0	0	0	112	F264 F265 L281 N282 D283	F264-G279 CarbonylContact O-C 3.58Å; F264-G279 VanDerWaalsContact O-CA 3.25Å; F264-G279 WeakPolarHBondContact O-CA 3.38Å; F265-G279 CarbonylContact O-C 3.59Å; G279-L281 PolarHBondContact O-N 2.86Å; G279-L281 VanDerWaalsContact O-N 3.1Å; G279-N282 PolarHBondContact N-OD1 2.68Å; G279-N282 PolarHBondContact O-N 2.89Å; G279-N282 VanDerWaalsContact O-N 3.14Å; G279-N282 PolarHBondContact O-OD1 3.16Å; G279-D283 PolarHBondContact O-N 2.8Å; G279-D283 VanDerWaalsContact O-N 3.15Å
280	L	72.6	Confident	63.1	Low	35 Å²	35	75.8 Å²	75.8	18%	0.183	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.9	-171.3	-174.5	62.5	0	0	0	114.5	F264 F265 L327 V328	F264-L280 HydrophobicContact CE1-CB 4.5Å; F264-L280 HydrophobicContact CE1-CD2 4.04Å; F264-L280 HydrophobicContact CZ-CD2 4.45Å; F264-L280 PolarHBondContact O-N 2.78Å; F265-L280 HydrophobicContact CD1-CD2 4.43Å; F265-L280 HydrophobicContact CE1-CD2 4.42Å; F265-L280 PolarHBondContact O-N 2.8Å; L280-L327 HydrophobicContact CD1-CD1 4.11Å; L280-V328 HydrophobicContact CD2-CG2 4.5Å
281	L	70.3	Confident	62.6	Low	98 Å²	98	74.4 Å²	74.4	51%	0.513	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-3.6	-175.8	-56.2	179.1	0	0	0	114.1	F265 G279	F265-L281 HydrophobicContact CB-CD1 4.16Å; F265-L281 HydrophobicContact CB-CG 4.45Å; F265-L281 WeakPolarHBondContact O-CB 3.09Å; F265-L281 PolarHBondContact O-N 2.88Å; G279-L281 PolarHBondContact O-N 2.86Å; G279-L281 VanDerWaalsContact O-N 3.1Å
282	N	66.9	Low	62.8	Low	56 Å²	56	65.7 Å²	65.7	30%	0.299	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	22.7	179.8	70.9	-1.4	0	0	0	114.6	S266 N278 G279	S266-N282 PolarHBondContact O-ND2 2.74Å; N278-N282 WeakPolarHBondContact CA-OD1 3.48Å; G279-N282 PolarHBondContact N-OD1 2.68Å; G279-N282 PolarHBondContact O-N 2.89Å; G279-N282 VanDerWaalsContact O-N 3.14Å; G279-N282 PolarHBondContact O-OD1 3.16Å
283	D	69.6	Low	63.1	Low	33 Å²	33	66.6 Å²	66.6	18%	0.176	40%	0.404	C	S	.	.			trans	-61.8	137.4	172.5	-166.6	-85.4	0	0	0	111.7	R234 G279 S285 L286	R234-D283 IonicContact CZ-OD2 2.78Å; R234-D283 VanDerWaalsContact CZ-OD2 3.25Å; R234-D283 IonicContact NH1-OD2 3.45Å; R234-D283 PolarHBondContact NH1-OD2 2.64Å; R234-D283 IonicContact NH2-OD2 3.96Å; R234-D283 PolarHBondContact NH2-OD2 3.3Å; G279-D283 PolarHBondContact O-N 2.8Å; G279-D283 VanDerWaalsContact O-N 3.15Å; D283-S285 PolarHBondContact O-N 2.93Å; D283-S285 VanDerWaalsContact O-N 3.1Å; D283-S285 WeakPolarHBondContact OD1-CB 3.45Å; D283-S285 PolarHBondContact OD1-N 2.71Å; D283-S285 PolarHBondContact OD1-OG 2.71Å; D283-L286 WeakPolarHBondContact O-CB 3.16Å; D283-L286 PolarHBondContact O-N 3.4Å
284	P	63.7	Low	63.5	Low	103 Å²	103	67.8 Å²	67.8	67%	0.669	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.2	-178.3	-24.8	35.4	0	0	0	114.8	N278 L286	N278-P284 WeakPolarHBondContact ND2-CD 3.45Å; P284-L286 VanDerWaalsContact C-N 3.27Å
285	S	64.3	Low	63.6	Low	96 Å²	96	64.6 Å²	64.6	67%	0.671	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-13.5	172.3	65.1	0	0	0	0	113.6	D283 G287	D283-S285 PolarHBondContact O-N 2.93Å; D283-S285 VanDerWaalsContact O-N 3.1Å; D283-S285 WeakPolarHBondContact OD1-CB 3.45Å; D283-S285 PolarHBondContact OD1-N 2.71Å; D283-S285 PolarHBondContact OD1-OG 2.71Å; S285-G287 VanDerWaalsContact C-N 3.33Å; S285-G287 PolarHBondContact O-N 3.19Å
286	L	56.4	Low	63.8	Low	52 Å²	52	66.9 Å²	66.9	27%	0.272	43%	0.429	S	S	.	.	S	Bend	trans	-73.5	83.1	179.9	-156.3	82.2	0	0	0	110.5	D283 P284 A288 Q323	D283-L286 WeakPolarHBondContact O-CB 3.16Å; D283-L286 PolarHBondContact O-N 3.4Å; P284-L286 VanDerWaalsContact C-N 3.27Å; L286-A288 PolarHBondContact O-N 3.32Å; L286-Q323 HydrophobicContact CD1-CB 3.87Å
287	G	58.3	Low	63.6	Low	45 Å²	45	67.2 Å²	67.2	46%	0.464	45%	0.447	S	S	.	.			trans	-48.3	137.3	-177.8	0	0	0	0	0	114	S285 Q323	S285-G287 VanDerWaalsContact C-N 3.33Å; S285-G287 PolarHBondContact O-N 3.19Å; G287-Q323 PolarHBondContact O-NE2 2.66Å
288	A	56.9	Low	63.1	Low	88 Å²	88	69.5 Å²	69.5	73%	0.727	46%	0.459	S	S	*	.			trans	-48.3	141.4	-167.1	0	0	0	0	0	114.7	L286 T290	L286-A288 PolarHBondContact O-N 3.32Å; A288-T290 PolarHBondContact O-N 2.81Å
289	Y	51.4	Low	62.6	Low	179 Å²	179	74.7 Å²	74.7	70%	0.702	48%	0.482	S	S	*	.			trans	-52.6	113.9	178.6	-175.3	-93.4	0	0	0	110.5	V292	Y289-V292 HydrophobicContact CE1-CG2 4.32Å
290	T	53.3	Low	62.3	Low	80 Å²	80	76.7 Å²	76.7	49%	0.491	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-82.4	134.4	-170.7	13.2	0	0	0	0	110.6	A288 V292 K319	A288-T290 PolarHBondContact O-N 2.81Å; T290-V292 PolarHBondContact O-N 3.2Å; T290-K319 PolarHBondContact OG1-NZ 2.7Å
291	A	54.1	Low	61.7	Low	95 Å²	95	80 Å²	80	79%	0.785	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-51	136.1	-178.8	0	0	0	0	0	112.1	A293	A291-A293 PolarHBondContact O-N 3.25Å
292	V	60.9	Low	61.6	Low	44 Å²	44	80.3 Å²	80.3	27%	0.267	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-68	126.7	-171.6	-161.2	0	0	0	0	109.7	Y289 T290 A294 K304 D312	Y289-V292 HydrophobicContact CE1-CG2 4.32Å; T290-V292 PolarHBondContact O-N 3.2Å; V292-A294 PolarHBondContact O-N 2.71Å; V292-K304 VanDerWaalsContact CG1-NZ 3.33Å; V292-D312 HydrophobicContact CG1-CB 3.79Å; V292-D312 VanDerWaalsContact CG1-OD1 3.31Å; V292-D312 WeakPolarHBondContact CG1-OD1 3.41Å; V292-D312 WeakPolarHBondContact CG1-OD2 2.95Å
293	A	65.4	Low	61.3	Low	72 Å²	72	83.4 Å²	83.4	60%	0.595	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-65.3	120.8	-165.4	0	0	0	0	0	112.2	A291 E295 K304	A291-A293 PolarHBondContact O-N 3.25Å; A293-E295 PolarHBondContact O-N 2.7Å; A293-K304 WeakPolarHBondContact O-CE 3.15Å; A293-K304 PolarHBondContact O-NZ 2.93Å
294	A	63.3	Low	61.2	Low	52 Å²	52	82.5 Å²	82.5	43%	0.43	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-63	131	-170	0	0	0	0	0	113.3	V292 G296 Q299	V292-A294 PolarHBondContact O-N 2.71Å; A294-G296 PolarHBondContact O-N 3.42Å; A294-G296 VanDerWaalsContact O-N 3.15Å; A294-Q299 HydrophobicContact CB-CG 3.95Å
295	E	60	Low	61.2	Low	74 Å²	74	79.3 Å²	79.3	35%	0.346	51%	0.512	S	S	.	.	B	Isolated β-bridge	trans	-85.5	83	169.5	-171.3	178.1	-145.4	0	0	108.1	A293 A297 N298 K304 S305 A308	A293-E295 PolarHBondContact O-N 2.7Å; E295-A297 PolarHBondContact O-N 2.97Å; E295-A297 VanDerWaalsContact O-N 3.08Å; E295-N298 HydrophobicContact CB-CB 4.4Å; E295-N298 PolarHBondContact N-O 3.21Å; E295-N298 PolarHBondContact O-N 2.94Å; E295-K304 HydrophobicContact CB-CG 3.99Å; E295-K304 VanDerWaalsContact OE2-CA 3.25Å; E295-K304 WeakPolarHBondContact OE2-CA 3.44Å; E295-S305 VanDerWaalsContact OE1-CB 3.31Å; E295-S305 WeakPolarHBondContact OE1-CB 3.42Å; E295-S305 PolarHBondContact OE1-OG 3.2Å; E295-S305 PolarHBondContact OE2-N 3.01Å; E295-S305 PolarHBondContact OE2-OG 2.73Å; E295-A308 HydrophobicContact CB-CB 4.28Å; E295-A308 HydrophobicContact CG-CB 4.26Å
296	G	68.6	Low	60.7	Low	74 Å²	74	78.8 Å²	78.8	76%	0.763	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	-107.6	-168	0	0	0	0	0	110.7	A294	A294-G296 PolarHBondContact O-N 3.42Å; A294-G296 VanDerWaalsContact O-N 3.15Å
297	A	62.8	Low	60.3	Low	86 Å²	86	81.2 Å²	81.2	71%	0.711	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-15.5	174.6	0	0	0	0	0	113.5	E295 Q299	E295-A297 PolarHBondContact O-N 2.97Å; E295-A297 VanDerWaalsContact O-N 3.08Å; A297-Q299 PolarHBondContact O-N 2.73Å
298	N	60.1	Low	60.7	Low	60 Å²	60	79.7 Å²	79.7	32%	0.321	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-86.3	105.5	-168.3	-61.7	-4.1	0	0	0	110.3	E295 Q303 K304	E295-N298 HydrophobicContact CB-CB 4.4Å; E295-N298 PolarHBondContact N-O 3.21Å; E295-N298 PolarHBondContact O-N 2.94Å; N298-Q303 HydrophobicContact CB-CB 3.86Å; N298-Q303 PolarHBondContact ND2-O 3.19Å; N298-K304 HydrophobicContact CB-CG 4.29Å; N298-K304 VanDerWaalsContact O-CE 3.26Å; N298-K304 WeakPolarHBondContact O-CE 3.46Å
299	Q	61.9	Low	61	Low	137 Å²	137	77.2 Å²	77.2	64%	0.64	47%	0.473	S	S	*	.			trans	-95.1	-36.3	-178.7	-60.6	-166.9	6.8	0	0	112.9	A294 A297	A294-Q299 HydrophobicContact CB-CG 3.95Å; A297-Q299 PolarHBondContact O-N 2.73Å
300	A	66.7	Low	61.1	Low	51 Å²	51	70 Å²	70	42%	0.421	45%	0.45	S	S	.	.	S	Bend	trans	-77.9	140.5	178.2	0	0	0	0	0	111.9	A302 Q303 K304	A300-A302 PolarHBondContact O-N 2.9Å; A300-Q303 PolarHBondContact O-N 2.69Å; A300-K304 PolarHBondContact O-N 2.74Å
301	W	60.3	Low	61.8	Low	104 Å²	104	70.8 Å²	70.8	39%	0.394	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-54.5	-35.9	174.4	-80.7	-13.5	0	0	0	113.1	Q303 K304 I309 D312 I313	W301-Q303 PolarHBondContact O-N 2.91Å; W301-Q303 VanDerWaalsContact O-N 3.09Å; W301-K304 PolarHBondContact O-N 2.68Å; W301-K304 VanDerWaalsContact O-N 3.08Å; W301-I309 HydrophobicContact CB-CD1 4.33Å; W301-I309 HydrophobicContact CB-CG1 4.14Å; W301-I309 HydrophobicContact CD2-CG2 3.99Å; W301-I309 HydrophobicContact CE3-CG2 4.46Å; W301-I309 HydrophobicContact CG-CG1 4.12Å; W301-I309 HydrophobicContact CG-CG2 4.07Å; W301-I309 VanDerWaalsContact O-CD1 3.29Å; W301-I309 WeakPolarHBondContact O-CD1 3.46Å; W301-D312 VanDerWaalsContact CD1-OD2 3.24Å; W301-D312 HydrophobicContact CZ2-CB 4.05Å; W301-D312 VanDerWaalsContact NE1-CB 3.33Å; W301-D312 PolarHBondContact NE1-OD2 3.2Å; W301-I313 HydrophobicContact CH2-CD1 4.35Å; W301-I313 HydrophobicContact CH2-CG1 3.72Å; W301-I313 HydrophobicContact CZ2-CG1 3.72Å
302	A	68.4	Low	62.6	Low	106 Å²	106	67.1 Å²	67.1	88%	0.876	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-62.3	-15.8	176.7	0	0	0	0	0	114.9	A300	A300-A302 PolarHBondContact O-N 2.9Å
303	Q	61.3	Low	62.8	Low	121 Å²	121	67.5 Å²	67.5	57%	0.565	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-106.1	-6.9	177	-65.4	-179.9	-37.4	0	0	113.1	N298 A300 W301	N298-Q303 HydrophobicContact CB-CB 3.86Å; N298-Q303 PolarHBondContact ND2-O 3.19Å; A300-Q303 PolarHBondContact O-N 2.69Å; W301-Q303 PolarHBondContact O-N 2.91Å; W301-Q303 VanDerWaalsContact O-N 3.09Å
304	K	66.6	Low	62.7	Low	14 Å²	14	67.2 Å²	67.2	6%	0.061	41%	0.41	C	S	.	.	S	Bend	trans	-89.4	154.6	-174.2	-83.3	173	157.7	-174.8	0	112.2	V292 A293 E295 N298 A300 W301 A308 I309 D312	V292-K304 VanDerWaalsContact CG1-NZ 3.33Å; A293-K304 WeakPolarHBondContact O-CE 3.15Å; A293-K304 PolarHBondContact O-NZ 2.93Å; E295-K304 HydrophobicContact CB-CG 3.99Å; E295-K304 VanDerWaalsContact OE2-CA 3.25Å; E295-K304 WeakPolarHBondContact OE2-CA 3.44Å; N298-K304 HydrophobicContact CB-CG 4.29Å; N298-K304 VanDerWaalsContact O-CE 3.26Å; N298-K304 WeakPolarHBondContact O-CE 3.46Å; A300-K304 PolarHBondContact O-N 2.74Å; W301-K304 PolarHBondContact O-N 2.68Å; W301-K304 VanDerWaalsContact O-N 3.08Å; K304-A308 HydrophobicContact CB-CB 4.07Å; K304-A308 HydrophobicContact CD-CB 4.33Å; K304-A308 HydrophobicContact CG-CB 4.25Å; K304-I309 HydrophobicContact CB-CD1 4.5Å; K304-I309 HydrophobicContact CB-CG1 3.84Å; K304-D312 WeakPolarHBondContact CD-OD2 3.27Å; K304-D312 VanDerWaalsContact NZ-CG 3.33Å; K304-D312 IonicContact NZ-OD1 2.75Å; K304-D312 PolarHBondContact NZ-OD1 3.27Å; K304-D312 IonicContact NZ-OD2 2.71Å; K304-D312 PolarHBondContact NZ-OD2 3.08Å
305	S	64.3	Low	62.9	Low	36 Å²	36	67.8 Å²	67.8	25%	0.252	41%	0.411	S	S	.	.			trans	-60.5	147.4	166.2	69.5	0	0	0	0	110.1	E295 E307 A308 I309	E295-S305 VanDerWaalsContact OE1-CB 3.31Å; E295-S305 WeakPolarHBondContact OE1-CB 3.42Å; E295-S305 PolarHBondContact OE1-OG 3.2Å; E295-S305 PolarHBondContact OE2-N 3.01Å; E295-S305 PolarHBondContact OE2-OG 2.73Å; S305-E307 PolarHBondContact O-N 3.27Å; S305-E307 VanDerWaalsContact O-N 3.11Å; S305-A308 PolarHBondContact O-N 2.82Å; S305-A308 WeakPolarHBondContact OG-CB 3.46Å; S305-A308 PolarHBondContact OG-N 3Å; S305-I309 WeakPolarHBondContact O-CG1 3.42Å; S305-I309 PolarHBondContact O-N 2.83Å
306	P	54.3	Low	63.2	Low	84 Å²	84	66.1 Å²	66.1	55%	0.545	41%	0.409	S	S	.	.	H	α-helix	trans	-55.8	-28.8	174.6	-27.7	36.1	0	0	0	113.2	A310	P306-A310 VanDerWaalsContact O-CB 3.3Å; P306-A310 WeakPolarHBondContact O-CB 3.32Å; P306-A310 PolarHBondContact O-N 3.14Å
307	E	46.8	Very low	62.9	Low	103 Å²	103	65.6 Å²	65.6	48%	0.481	39%	0.385	S	S	.	.	H	α-helix	trans	-71.5	-39.2	174.4	-62	-172.7	92.5	0	0	112.5	S305 A310 N311 K341	S305-E307 PolarHBondContact O-N 3.27Å; S305-E307 VanDerWaalsContact O-N 3.11Å; E307-A310 PolarHBondContact O-N 2.87Å; E307-N311 WeakPolarHBondContact O-CB 3.48Å; E307-N311 PolarHBondContact O-N 3.38Å; E307-N311 PolarHBondContact O-ND2 3.35Å; E307-N311 VanDerWaalsContact O-ND2 3.14Å; E307-K341 WeakPolarHBondContact OE1-CE 3.44Å; E307-K341 IonicContact OE1-NZ 2.65Å; E307-K341 PolarHBondContact OE1-NZ 3.01Å
308	A	67	Low	63	Low	13 Å²	13	64.1 Å²	64.1	11%	0.107	37%	0.373	C	S	.	.	H	α-helix	trans	-65.1	-42.2	172.2	0	0	0	0	0	111.8	E295 K304 S305 A310 N311 D312	E295-A308 HydrophobicContact CB-CB 4.28Å; E295-A308 HydrophobicContact CG-CB 4.26Å; K304-A308 HydrophobicContact CB-CB 4.07Å; K304-A308 HydrophobicContact CD-CB 4.33Å; K304-A308 HydrophobicContact CG-CB 4.25Å; S305-A308 PolarHBondContact O-N 2.82Å; S305-A308 WeakPolarHBondContact OG-CB 3.46Å; S305-A308 PolarHBondContact OG-N 3Å; A308-A310 VanDerWaalsContact C-N 3.35Å; A308-A310 PolarHBondContact O-N 2.9Å; A308-N311 PolarHBondContact O-N 3.47Å; A308-D312 PolarHBondContact O-N 3.19Å
309	I	63.9	Low	63.4	Low	37 Å²	37	65.9 Å²	65.9	19%	0.19	38%	0.377	C	S	.	.	H	α-helix	trans	-60.5	-44.5	173.5	-56.8	169	0	0	0	110.6	W301 K304 S305 N311 D312 I313	W301-I309 HydrophobicContact CB-CD1 4.33Å; W301-I309 HydrophobicContact CB-CG1 4.14Å; W301-I309 HydrophobicContact CD2-CG2 3.99Å; W301-I309 HydrophobicContact CE3-CG2 4.46Å; W301-I309 HydrophobicContact CG-CG1 4.12Å; W301-I309 HydrophobicContact CG-CG2 4.07Å; W301-I309 VanDerWaalsContact O-CD1 3.29Å; W301-I309 WeakPolarHBondContact O-CD1 3.46Å; K304-I309 HydrophobicContact CB-CD1 4.5Å; K304-I309 HydrophobicContact CB-CG1 3.84Å; S305-I309 WeakPolarHBondContact O-CG1 3.42Å; S305-I309 PolarHBondContact O-N 2.83Å; I309-N311 PolarHBondContact O-N 3.33Å; I309-D312 WeakPolarHBondContact O-CB 3.48Å; I309-D312 PolarHBondContact O-N 2.81Å; I309-I313 HydrophobicContact CG2-CD1 3.98Å; I309-I313 WeakPolarHBondContact O-CG1 3.36Å; I309-I313 PolarHBondContact O-N 3.49Å
310	A	53.2	Low	63.4	Low	26 Å²	26	62 Å²	62	22%	0.215	36%	0.361	C	S	.	.	H	α-helix	trans	-63.8	-38.9	177.2	0	0	0	0	0	112.6	P306 E307 A308 T314 I338	P306-A310 VanDerWaalsContact O-CB 3.3Å; P306-A310 WeakPolarHBondContact O-CB 3.32Å; P306-A310 PolarHBondContact O-N 3.14Å; E307-A310 PolarHBondContact O-N 2.87Å; A308-A310 VanDerWaalsContact C-N 3.35Å; A308-A310 PolarHBondContact O-N 2.9Å; A310-T314 WeakPolarHBondContact O-CB 3.46Å; A310-T314 PolarHBondContact O-N 3.26Å; A310-T314 PolarHBondContact O-OG1 3.49Å; A310-I338 HydrophobicContact CB-CD1 4.36Å; A310-I338 HydrophobicContact CB-CG2 4.06Å
311	N	67.1	Low	63.4	Low	98 Å²	98	61.7 Å²	61.7	52%	0.524	35%	0.352	S	S	.	.	H	α-helix	trans	-66.7	-37.7	174	-70.4	-27	0	0	0	112	E307 A308 I309 T314 S315	E307-N311 WeakPolarHBondContact O-CB 3.48Å; E307-N311 PolarHBondContact O-N 3.38Å; E307-N311 PolarHBondContact O-ND2 3.35Å; E307-N311 VanDerWaalsContact O-ND2 3.14Å; A308-N311 PolarHBondContact O-N 3.47Å; I309-N311 PolarHBondContact O-N 3.33Å; N311-T314 PolarHBondContact O-N 3.04Å; N311-S315 VanDerWaalsContact O-CB 3.3Å; N311-S315 WeakPolarHBondContact O-CB 3.37Å; N311-S315 PolarHBondContact O-N 3.18Å; N311-S315 PolarHBondContact O-OG 2.88Å
312	D	72	Confident	63.7	Low	17 Å²	17	60 Å²	60	9%	0.091	36%	0.36	C	S	.	.	H	α-helix	trans	-63.7	-47.8	174.8	-68.2	-41.4	0	0	0	111.2	V292 W301 K304 A308 I309 T314 S315 A316	V292-D312 HydrophobicContact CG1-CB 3.79Å; V292-D312 VanDerWaalsContact CG1-OD1 3.31Å; V292-D312 WeakPolarHBondContact CG1-OD1 3.41Å; V292-D312 WeakPolarHBondContact CG1-OD2 2.95Å; W301-D312 VanDerWaalsContact CD1-OD2 3.24Å; W301-D312 HydrophobicContact CZ2-CB 4.05Å; W301-D312 VanDerWaalsContact NE1-CB 3.33Å; W301-D312 PolarHBondContact NE1-OD2 3.2Å; K304-D312 WeakPolarHBondContact CD-OD2 3.27Å; K304-D312 VanDerWaalsContact NZ-CG 3.33Å; K304-D312 IonicContact NZ-OD1 2.75Å; K304-D312 PolarHBondContact NZ-OD1 3.27Å; K304-D312 IonicContact NZ-OD2 2.71Å; K304-D312 PolarHBondContact NZ-OD2 3.08Å; A308-D312 PolarHBondContact O-N 3.19Å; I309-D312 WeakPolarHBondContact O-CB 3.48Å; I309-D312 PolarHBondContact O-N 2.81Å; D312-T314 VanDerWaalsContact C-N 3.35Å; D312-T314 PolarHBondContact O-N 2.77Å; D312-S315 WeakPolarHBondContact O-CB 3.04Å; D312-S315 PolarHBondContact O-N 2.85Å; D312-A316 WeakPolarHBondContact O-CB 3.31Å; D312-A316 PolarHBondContact O-N 3.31Å
313	I	64.4	Low	63.4	Low	53 Å²	53	58.8 Å²	58.8	27%	0.272	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-43.7	176.9	-65	165.6	0	0	0	110.4	W301 I309 S315 A316 Y317 I338	W301-I313 HydrophobicContact CH2-CD1 4.35Å; W301-I313 HydrophobicContact CH2-CG1 3.72Å; W301-I313 HydrophobicContact CZ2-CG1 3.72Å; I309-I313 HydrophobicContact CG2-CD1 3.98Å; I309-I313 WeakPolarHBondContact O-CG1 3.36Å; I309-I313 PolarHBondContact O-N 3.49Å; I313-S315 VanDerWaalsContact C-N 3.29Å; I313-S315 PolarHBondContact O-N 3.42Å; I313-A316 PolarHBondContact O-N 2.72Å; I313-Y317 WeakPolarHBondContact O-CB 3.33Å; I313-Y317 PolarHBondContact O-N 2.98Å; I313-I338 HydrophobicContact CB-CD1 3.76Å; I313-I338 HydrophobicContact CD1-CD1 4.31Å; I313-I338 HydrophobicContact CG2-CD1 3.58Å
314	T	63.8	Low	63.5	Low	66 Å²	66	53.4 Å²	53.4	41%	0.405	31%	0.312	S	S	.	.	H	α-helix	trans	-60.5	-40.4	175.9	-56.5	0	0	0	0	111.3	A310 N311 D312 A318	A310-T314 WeakPolarHBondContact O-CB 3.46Å; A310-T314 PolarHBondContact O-N 3.26Å; A310-T314 PolarHBondContact O-OG1 3.49Å; N311-T314 PolarHBondContact O-N 3.04Å; D312-T314 VanDerWaalsContact C-N 3.35Å; D312-T314 PolarHBondContact O-N 2.77Å; T314-A318 WeakPolarHBondContact O-CB 3.35Å; T314-A318 PolarHBondContact O-N 3.45Å
315	S	67.3	Low	63.3	Low	64 Å²	64	60.4 Å²	60.4	45%	0.448	35%	0.35	S	S	.	.	H	α-helix	trans	-69.8	-37.8	177.1	-59.3	0	0	0	0	112.7	N311 D312 I313 K319	N311-S315 VanDerWaalsContact O-CB 3.3Å; N311-S315 WeakPolarHBondContact O-CB 3.37Å; N311-S315 PolarHBondContact O-N 3.18Å; N311-S315 PolarHBondContact O-OG 2.88Å; D312-S315 WeakPolarHBondContact O-CB 3.04Å; D312-S315 PolarHBondContact O-N 2.85Å; I313-S315 VanDerWaalsContact C-N 3.29Å; I313-S315 PolarHBondContact O-N 3.42Å; S315-K319 WeakPolarHBondContact O-CB 3.2Å; S315-K319 WeakPolarHBondContact O-CG 3.29Å; S315-K319 PolarHBondContact O-N 3.09Å
316	A	65.7	Low	63.2	Low	38 Å²	38	60.3 Å²	60.3	31%	0.314	36%	0.355	S	S	.	.	H	α-helix	trans	-67.4	-44.2	175.5	0	0	0	0	0	111.3	D312 I313 K319 L320	D312-A316 WeakPolarHBondContact O-CB 3.31Å; D312-A316 PolarHBondContact O-N 3.31Å; I313-A316 PolarHBondContact O-N 2.72Å; A316-K319 PolarHBondContact O-N 2.81Å; A316-L320 WeakPolarHBondContact O-CB 3.3Å; A316-L320 PolarHBondContact O-N 3.34Å
317	Y	62.5	Low	63.6	Low	64 Å²	64	59.6 Å²	59.6	25%	0.251	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-44.9	173.9	172.7	-100.6	0	0	0	111.9	I313 K319 L320 N321 V332	I313-Y317 WeakPolarHBondContact O-CB 3.33Å; I313-Y317 PolarHBondContact O-N 2.98Å; Y317-K319 VanDerWaalsContact C-N 3.33Å; Y317-K319 PolarHBondContact O-N 3.16Å; Y317-L320 PolarHBondContact O-N 2.63Å; Y317-N321 VanDerWaalsContact O-CB 3.28Å; Y317-N321 WeakPolarHBondContact O-CB 3.44Å; Y317-N321 PolarHBondContact O-N 3.01Å; Y317-V332 HydrophobicContact CD2-CB 4.41Å; Y317-V332 HydrophobicContact CD2-CG1 3.88Å; Y317-V332 HydrophobicContact CE2-CB 3.99Å; Y317-V332 HydrophobicContact CE2-CG1 3.9Å
318	A	66	Low	64.1	Low	55 Å²	55	55.2 Å²	55.2	46%	0.455	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-40.4	176.4	0	0	0	0	0	112.4	T314 A322	T314-A318 WeakPolarHBondContact O-CB 3.35Å; T314-A318 PolarHBondContact O-N 3.45Å; A318-A322 PolarHBondContact O-N 2.87Å; A318-A322 VanDerWaalsContact O-N 3.11Å
319	K	66.9	Low	63.6	Low	96 Å²	96	55.6 Å²	55.6	42%	0.417	33%	0.33	S	S	.	.	H	α-helix	trans	-65.7	-50.3	173.5	-76.7	173.7	178	175.4	0	112.3	T290 S315 A316 Y317 N321 A322 Q323	T290-K319 PolarHBondContact OG1-NZ 2.7Å; S315-K319 WeakPolarHBondContact O-CB 3.2Å; S315-K319 WeakPolarHBondContact O-CG 3.29Å; S315-K319 PolarHBondContact O-N 3.09Å; A316-K319 PolarHBondContact O-N 2.81Å; Y317-K319 VanDerWaalsContact C-N 3.33Å; Y317-K319 PolarHBondContact O-N 3.16Å; K319-N321 VanDerWaalsContact C-N 3.26Å; K319-N321 PolarHBondContact O-N 2.89Å; K319-A322 PolarHBondContact O-N 3.46Å; K319-A322 VanDerWaalsContact O-N 3.09Å; K319-Q323 WeakPolarHBondContact O-CB 3.26Å; K319-Q323 VanDerWaalsContact O-CG 3.31Å; K319-Q323 WeakPolarHBondContact O-CG 3.43Å; K319-Q323 PolarHBondContact O-N 3.29Å
320	L	63.8	Low	62.8	Low	55 Å²	55	61.1 Å²	61.1	29%	0.288	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-38.1	179.3	179.6	60.6	0	0	0	111.7	A316 Y317 S324 V328	A316-L320 WeakPolarHBondContact O-CB 3.3Å; A316-L320 PolarHBondContact O-N 3.34Å; Y317-L320 PolarHBondContact O-N 2.63Å; L320-S324 VanDerWaalsContact O-CB 3.29Å; L320-S324 WeakPolarHBondContact O-CB 3.27Å; L320-S324 PolarHBondContact O-N 2.67Å; L320-S324 PolarHBondContact O-OG 3.49Å; L320-V328 HydrophobicContact CD1-CG2 4.49Å; L320-V328 HydrophobicContact CD2-CG1 3.91Å; L320-V328 HydrophobicContact CG-CB 4.35Å; L320-V328 HydrophobicContact CG-CG1 4.02Å; L320-V328 HydrophobicContact CG-CG2 4.17Å
321	N	65.3	Low	62.2	Low	45 Å²	45	61.5 Å²	61.5	24%	0.241	37%	0.367	C	S	.	.	H	α-helix	trans	-64.8	-43.4	174.4	-171.9	40.1	0	0	0	112.4	Y317 K319 S324 G326 A329	Y317-N321 VanDerWaalsContact O-CB 3.28Å; Y317-N321 WeakPolarHBondContact O-CB 3.44Å; Y317-N321 PolarHBondContact O-N 3.01Å; K319-N321 VanDerWaalsContact C-N 3.26Å; K319-N321 PolarHBondContact O-N 2.89Å; N321-S324 PolarHBondContact O-OG 3.47Å; N321-G326 PolarHBondContact O-N 3.29Å; N321-G326 WeakPolarHBondContact OD1-CA 3.3Å; N321-A329 VanDerWaalsContact OD1-CB 3.23Å; N321-A329 WeakPolarHBondContact OD1-CB 3.32Å; N321-A329 PolarHBondContact OD1-N 2.7Å; N321-A329 VanDerWaalsContact OD1-N 3.12Å
322	A	66.5	Low	61	Low	69 Å²	69	59.1 Å²	59.1	57%	0.57	36%	0.355	S	S	*	.	H	α-helix	trans	-67.1	-44.2	175.6	0	0	0	0	0	112.4	A318 K319 S324 N325	A318-A322 PolarHBondContact O-N 2.87Å; A318-A322 VanDerWaalsContact O-N 3.11Å; K319-A322 PolarHBondContact O-N 3.46Å; K319-A322 VanDerWaalsContact O-N 3.09Å; A322-S324 VanDerWaalsContact C-N 3.29Å; A322-S324 PolarHBondContact O-N 2.84Å; A322-N325 PolarHBondContact O-N 3.47Å
323	Q	63.7	Low	59.3	Low	81 Å²	81	63.2 Å²	63.2	38%	0.379	37%	0.372	S	S	.	.	H	α-helix	trans	-66.3	-29.4	179.6	-70.6	176.6	-71.4	0	0	112.8	L286 G287 K319 N325	L286-Q323 HydrophobicContact CD1-CB 3.87Å; G287-Q323 PolarHBondContact O-NE2 2.66Å; K319-Q323 WeakPolarHBondContact O-CB 3.26Å; K319-Q323 VanDerWaalsContact O-CG 3.31Å; K319-Q323 WeakPolarHBondContact O-CG 3.43Å; K319-Q323 PolarHBondContact O-N 3.29Å; Q323-N325 VanDerWaalsContact C-N 3.31Å
324	S	62.6	Low	57.9	Low	8 Å²	8	65.5 Å²	65.5	6%	0.056	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	15	175.1	62	0	0	0	0	114	L320 N321 A322 G326 L327 V328	L320-S324 VanDerWaalsContact O-CB 3.29Å; L320-S324 WeakPolarHBondContact O-CB 3.27Å; L320-S324 PolarHBondContact O-N 2.67Å; L320-S324 PolarHBondContact O-OG 3.49Å; N321-S324 PolarHBondContact O-OG 3.47Å; A322-S324 VanDerWaalsContact C-N 3.29Å; A322-S324 PolarHBondContact O-N 2.84Å; S324-G326 PolarHBondContact O-N 2.75Å; S324-G326 VanDerWaalsContact O-N 3.09Å; S324-L327 WeakPolarHBondContact O-CB 3.35Å; S324-L327 VanDerWaalsContact O-CG 3.27Å; S324-L327 WeakPolarHBondContact O-CG 3.44Å; S324-L327 PolarHBondContact O-N 3.41Å; S324-V328 WeakPolarHBondContact OG-CB 3.05Å; S324-V328 VanDerWaalsContact OG-CG2 3.31Å; S324-V328 WeakPolarHBondContact OG-CG2 3.44Å; S324-V328 PolarHBondContact OG-N 2.97Å
325	N	62.5	Low	56.5	Low	160 Å²	160	65.1 Å²	65.1	86%	0.856	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	33.7	-176.3	-84.2	-22.2	0	0	0	113.9	A322 Q323	A322-N325 PolarHBondContact O-N 3.47Å; Q323-N325 VanDerWaalsContact C-N 3.31Å
326	G	62.9	Low	54.8	Low	34 Å²	34	69 Å²	69	35%	0.351	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-7.9	179.3	0	0	0	0	0	115.9	N321 S324 V328 A329	N321-G326 PolarHBondContact O-N 3.29Å; N321-G326 WeakPolarHBondContact OD1-CA 3.3Å; S324-G326 PolarHBondContact O-N 2.75Å; S324-G326 VanDerWaalsContact O-N 3.09Å; G326-V328 VanDerWaalsContact C-N 3.28Å; G326-V328 PolarHBondContact O-N 3.11Å; G326-A329 WeakPolarHBondContact O-CB 2.97Å; G326-A329 PolarHBondContact O-N 3.32Å
327	L	61.3	Low	53	Low	70 Å²	70	73 Å²	73	37%	0.366	44%	0.435	S	S	.	.	H	α-helix	trans	-57.8	-40.2	-178.1	-67.4	169.7	0	0	0	112.2	L187 L280 S324 A329	L187-L327 HydrophobicContact CD2-CB 4.48Å; L187-L327 WeakPolarHBondContact CD2-O 3.24Å; L280-L327 HydrophobicContact CD1-CD1 4.11Å; S324-L327 WeakPolarHBondContact O-CB 3.35Å; S324-L327 VanDerWaalsContact O-CG 3.27Å; S324-L327 WeakPolarHBondContact O-CG 3.44Å; S324-L327 PolarHBondContact O-N 3.41Å; L327-A329 VanDerWaalsContact C-N 3.33Å; L327-A329 PolarHBondContact O-N 3.43Å
328	V	57.8	Low	51.3	Low	10 Å²	10	73.5 Å²	73.5	6%	0.061	44%	0.441	C	S	.	.	H	α-helix	trans	-74.8	-18.9	-176.5	175.2	0	0	0	0	113.2	L280 L320 S324 G326 N330 G331 V332	L280-V328 HydrophobicContact CD2-CG2 4.5Å; L320-V328 HydrophobicContact CD1-CG2 4.49Å; L320-V328 HydrophobicContact CD2-CG1 3.91Å; L320-V328 HydrophobicContact CG-CB 4.35Å; L320-V328 HydrophobicContact CG-CG1 4.02Å; L320-V328 HydrophobicContact CG-CG2 4.17Å; S324-V328 WeakPolarHBondContact OG-CB 3.05Å; S324-V328 VanDerWaalsContact OG-CG2 3.31Å; S324-V328 WeakPolarHBondContact OG-CG2 3.44Å; S324-V328 PolarHBondContact OG-N 2.97Å; G326-V328 VanDerWaalsContact C-N 3.28Å; G326-V328 PolarHBondContact O-N 3.11Å; V328-N330 VanDerWaalsContact C-N 3.31Å; V328-N330 PolarHBondContact O-N 2.78Å; V328-G331 PolarHBondContact O-N 2.97Å; V328-V332 HydrophobicContact CG1-CB 3.87Å; V328-V332 HydrophobicContact CG1-CG2 3.63Å; V328-V332 PolarHBondContact O-N 2.84Å; V328-V332 VanDerWaalsContact O-N 3.1Å
329	A	55.5	Low	49.6	Very low	22 Å²	22	79.8 Å²	79.8	18%	0.182	46%	0.458	C	S	.	.	H	α-helix	trans	-55.6	-44.2	177.6	0	0	0	0	0	113	N321 G326 L327	N321-A329 VanDerWaalsContact OD1-CB 3.23Å; N321-A329 WeakPolarHBondContact OD1-CB 3.32Å; N321-A329 PolarHBondContact OD1-N 2.7Å; N321-A329 VanDerWaalsContact OD1-N 3.12Å; G326-A329 WeakPolarHBondContact O-CB 2.97Å; G326-A329 PolarHBondContact O-N 3.32Å; L327-A329 VanDerWaalsContact C-N 3.33Å; L327-A329 PolarHBondContact O-N 3.43Å
330	N	47.6	Very low	47.7	Very low	152 Å²	152	78.6 Å²	78.6	81%	0.813	47%	0.473	S	S	*	.	H	α-helix	trans	-75.2	-26.6	-178.5	-83.6	-4.4	0	0	0	112.8	V328	V328-N330 VanDerWaalsContact C-N 3.31Å; V328-N330 PolarHBondContact O-N 2.78Å
331	G	40.5	Very low	45.9	Very low	35 Å²	35	83.3 Å²	83.3	36%	0.361	49%	0.491	S	S	.	.	H	α-helix	trans	-85.8	-46.8	-175.9	0	0	0	0	0	114.2	V328	V328-G331 PolarHBondContact O-N 2.97Å
332	V	41.5	Very low	43.9	Very low	48 Å²	48	89.4 Å²	89.4	29%	0.291	52%	0.518	S	S	.	.	H	α-helix	trans	-95	-10.7	-160.4	168.7	0	0	0	0	114.6	Y317 V328 A334 A335 F336	Y317-V332 HydrophobicContact CD2-CB 4.41Å; Y317-V332 HydrophobicContact CD2-CG1 3.88Å; Y317-V332 HydrophobicContact CE2-CB 3.99Å; Y317-V332 HydrophobicContact CE2-CG1 3.9Å; V328-V332 HydrophobicContact CG1-CB 3.87Å; V328-V332 HydrophobicContact CG1-CG2 3.63Å; V328-V332 PolarHBondContact O-N 2.84Å; V328-V332 VanDerWaalsContact O-N 3.1Å; V332-A334 PolarHBondContact O-N 3.38Å; V332-A335 PolarHBondContact O-N 3Å; V332-F336 HydrophobicContact CG1-CD2 4.16Å; V332-F336 PolarHBondContact O-N 2.88Å
333	K	36.4	Very low	41.8	Very low	102 Å²	102	93.1 Å²	93.1	44%	0.443	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-24.4	170.9	-77.8	-173.9	-170.3	169.6	0	113.9	A335 D1535	K333-A335 VanDerWaalsContact C-N 3.26Å; K333-A335 PolarHBondContact O-N 2.98Å; K333-D1535 HydrophobicContact CD-CB 4.19Å; K333-D1535 WeakPolarHBondContact CD-OD1 3.45Å; K333-D1535 IonicContact NZ-OD1 2.67Å; K333-D1535 PolarHBondContact NZ-OD1 3.43Å; K333-D1535 IonicContact NZ-OD2 3.64Å; K333-D1535 PolarHBondContact NZ-OD2 3.25Å
334	A	36.5	Very low	39.9	Very low	101 Å²	101	94.1 Å²	94.1	84%	0.835	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-16.5	173.1	0	0	0	0	0	113.8	V332	V332-A334 PolarHBondContact O-N 3.38Å
335	A	34.4	Very low	38	Very low	58 Å²	58	99.4 Å²	99.4	48%	0.479	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.2	-32.3	-169.5	0	0	0	0	0	114.9	V332 K333	V332-A335 PolarHBondContact O-N 3Å; K333-A335 VanDerWaalsContact C-N 3.26Å; K333-A335 PolarHBondContact O-N 2.98Å
336	F	30.6	Very low	36.1	Very low	145 Å²	145	100.7 Å²	100.7	64%	0.636	56%	0.562	S	S	*	*			trans	-134.9	88.7	-173.4	-69.5	-76	0	0	0	113.4	V332 I338	V332-F336 HydrophobicContact CG1-CD2 4.16Å; V332-F336 PolarHBondContact O-N 2.88Å; F336-I338 PolarHBondContact O-N 3.41Å
337	P	28.3	Very low	34.3	Very low	123 Å²	123	103.3 Å²	103.3	80%	0.799	58%	0.581	S	S	*	*			trans	-78.5	106.5	176.7	30.6	-33.3	0	0	0	111.9
338	I	27.5	Very low	32.5	Very low	74 Å²	74	104.1 Å²	104.1	38%	0.379	61%	0.606	S	S	.	*			trans	-122.3	99.1	167.9	-57.3	-178.5	0	0	0	108.9	A310 I313 F336	A310-I338 HydrophobicContact CB-CD1 4.36Å; A310-I338 HydrophobicContact CB-CG2 4.06Å; I313-I338 HydrophobicContact CB-CD1 3.76Å; I313-I338 HydrophobicContact CD1-CD1 4.31Å; I313-I338 HydrophobicContact CG2-CD1 3.58Å; F336-I338 PolarHBondContact O-N 3.41Å
339	K	28.8	Very low	31	Very low	188 Å²	188	106 Å²	106	82%	0.817	63%	0.628	S	S	*	*			trans	-158.5	128.2	177.1	-134.6	179.6	-176.5	-177.2	0	110.9
340	G	28	Very low	29.7	Very low	70 Å²	70	111 Å²	111	72%	0.722	66%	0.655	S	S	*	*			trans	60	92.6	170.5	0	0	0	0	0	115
341	K	25.1	Very low	28.6	Very low	154 Å²	154	109.2 Å²	109.2	67%	0.67	64%	0.644	S	S	*	*				39.9	82.1	66.6	-67	-143	177.3	-159.7	0	113.6	E307 I343	E307-K341 WeakPolarHBondContact OE1-CE 3.44Å; E307-K341 IonicContact OE1-NZ 2.65Å; E307-K341 PolarHBondContact OE1-NZ 3.01Å; K341-I343 PolarHBondContact O-N 3.06Å
342	E	24.3	Very low	28	Very low	173 Å²	173	113.5 Å²	113.5	81%	0.808	66%	0.659	S	S	*	*			trans	-62.5	120.3	151	-179.7	176.6	-146.8	0	0	108.5	V344	E342-V344 VanDerWaalsContact C-N 3.33Å; E342-V344 HydrophobicContact CG-CG2 4.05Å; E342-V344 PolarHBondContact O-N 3.31Å
343	I	21.7	Very low	27.7	Very low	148 Å²	148	116.2 Å²	116.2	76%	0.759	68%	0.68	S	S	*	*			trans	-80.3	89.1	171.9	-59	179.6	0	0	0	107.2	K341 I345	K341-I343 PolarHBondContact O-N 3.06Å; I343-I345 VanDerWaalsContact C-N 3.27Å; I343-I345 HydrophobicContact CG2-CG1 4.17Å; I343-I345 PolarHBondContact O-N 3.16Å
344	V	24.1	Very low	27.6	Very low	101 Å²	101	114.7 Å²	114.7	61%	0.612	68%	0.679	S	S	*	*			trans	-66.7	90.2	169.9	-178.1	0	0	0	0	108.4	E342 K346	E342-V344 VanDerWaalsContact C-N 3.33Å; E342-V344 HydrophobicContact CG-CG2 4.05Å; E342-V344 PolarHBondContact O-N 3.31Å; V344-K346 PolarHBondContact O-N 3.11Å
345	I	23.3	Very low	27.6	Very low	119 Å²	119	112.9 Å²	112.9	61%	0.61	66%	0.658	S	S	*	*			trans	-61.4	108.3	170.8	-61.2	177.6	0	0	0	106.8	I343 A347 I351	I343-I345 VanDerWaalsContact C-N 3.27Å; I343-I345 HydrophobicContact CG2-CG1 4.17Å; I343-I345 PolarHBondContact O-N 3.16Å; I345-A347 VanDerWaalsContact C-N 3.28Å; I345-A347 PolarHBondContact O-N 3.25Å; I345-I351 HydrophobicContact CG2-CD1 3.94Å
346	K	23.2	Very low	27.6	Very low	188 Å²	188	116.7 Å²	116.7	82%	0.817	67%	0.67	S	S	*	*			trans	-71.4	83.9	-178.9	-68.2	-176.6	-180	178.1	0	110.1	V344 G348	V344-K346 PolarHBondContact O-N 3.11Å; K346-G348 PolarHBondContact O-N 3.47Å
347	A	24.9	Very low	27.8	Very low	89 Å²	89	117.3 Å²	117.3	74%	0.736	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	45.4	177.4	0	0	0	0	0	113.6	I345	I345-A347 VanDerWaalsContact C-N 3.28Å; I345-A347 PolarHBondContact O-N 3.25Å
348	G	23.7	Very low	28.1	Very low	86 Å²	86	116.2 Å²	116.2	89%	0.887	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-1.3	165.7	0	0	0	0	0	113.2	K346	K346-G348 PolarHBondContact O-N 3.47Å
349	G	25.4	Very low	28.6	Very low	51 Å²	51	118.7 Å²	118.7	53%	0.526	67%	0.665	S	S	.	*	S	Bend	trans	-123.3	142.6	173.2	0	0	0	0	0	110.6	I351	G349-I351 PolarHBondContact O-N 3.03Å
350	V	27.1	Very low	28.8	Very low	125 Å²	125	112.8 Å²	112.8	76%	0.758	65%	0.645	S	S	*	*			trans	-68.4	110.9	-179.1	-176.2	0	0	0	0	109.6	N352	V350-N352 HydrophobicContact CG1-CB 4.48Å; V350-N352 PolarHBondContact O-N 3.03Å
351	I	25.4	Very low	29.2	Very low	115 Å²	115	115.7 Å²	115.7	59%	0.59	64%	0.64	S	S	*	*			trans	-78.5	69.5	172.3	-50.2	-178.8	0	0	0	109	I345 G349 V354	I345-I351 HydrophobicContact CG2-CD1 3.94Å; G349-I351 PolarHBondContact O-N 3.03Å; I351-V354 HydrophobicContact CG2-CG2 4.14Å
352	N	29	Very low	29.8	Very low	125 Å²	125	112 Å²	112	67%	0.668	63%	0.626	S	S	*	*			trans	-76.2	148.3	154.2	-74.9	-27.3	0	0	0	108.1	V350	V350-N352 HydrophobicContact CG1-CB 4.48Å; V350-N352 PolarHBondContact O-N 3.03Å
353	S	34.3	Very low	30.4	Very low	105 Å²	105	106.7 Å²	106.7	73%	0.734	60%	0.602	S	S	*	*			trans	48.3	81.4	-177.9	60.5	0	0	0	0	114.8
354	V	34.9	Very low	31.1	Very low	70 Å²	70	107.1 Å²	107.1	42%	0.424	60%	0.599	S	S	.	*			trans	-68.7	126.2	130.9	-178.4	0	0	0	0	105.3	I351 E358 I362	I351-V354 HydrophobicContact CG2-CG2 4.14Å; V354-E358 HydrophobicContact CG1-CB 3.67Å; V354-I362 HydrophobicContact CG1-CD1 4.18Å
355	T	36.2	Very low	31.6	Very low	63 Å²	63	105.7 Å²	105.7	39%	0.387	59%	0.593	S	S	.	*			trans	-70.1	157.7	177.1	58.2	0	0	0	0	111.1	E357 E358 Y359	T355-E357 PolarHBondContact O-N 3.42Å; T355-E357 VanDerWaalsContact O-N 3.15Å; T355-E358 WeakPolarHBondContact CB-OE2 2.12Å; T355-E358 WeakPolarHBondContact CG2-OE2 2.12Å; T355-E358 PolarHBondContact N-OE2 2.86Å; T355-E358 PolarHBondContact O-N 2.86Å; T355-E358 WeakPolarHBondContact OG1-CB 3.34Å; T355-E358 VanDerWaalsContact OG1-CG 3.26Å; T355-E358 WeakPolarHBondContact OG1-CG 2.13Å; T355-E358 PolarHBondContact OG1-N 2.97Å; T355-E358 VanDerWaalsContact OG1-N 3.17Å; T355-E358 PolarHBondContact OG1-OE2 3.28Å; T355-Y359 WeakPolarHBondContact O-CB 2.13Å; T355-Y359 PolarHBondContact O-N 3.47Å
356	D	34.2	Very low	32	Very low	138 Å²	138	107 Å²	107	74%	0.738	59%	0.591	S	S	*	*	H	α-helix	trans	-59.7	-26.1	176	-70.7	-37.7	0	0	0	112.2	T360	D356-T360 WeakPolarHBondContact O-CB 2.13Å; D356-T360 PolarHBondContact O-N 2.89Å; D356-T360 PolarHBondContact O-OG1 2.86Å
357	E	35.3	Very low	32.5	Very low	159 Å²	159	98.7 Å²	98.7	74%	0.743	56%	0.56	S	S	*	*	H	α-helix	trans	-75.3	-46.4	175.5	-64.5	-176.8	131.5	0	0	111.8	T355 T360 E361	T355-E357 PolarHBondContact O-N 3.42Å; T355-E357 VanDerWaalsContact O-N 3.15Å; E357-T360 CarbonylContact O-C 3.5Å; E357-T360 WeakPolarHBondContact O-CB 3.46Å; E357-T360 PolarHBondContact O-N 2.89Å; E357-T360 VanDerWaalsContact O-N 3.16Å; E357-E361 WeakPolarHBondContact O-CG 3.24Å; E357-E361 PolarHBondContact O-N 2.87Å
358	E	34.4	Very low	33	Very low	100 Å²	100	99.3 Å²	99.3	47%	0.467	56%	0.556	S	S	.	*	H	α-helix	trans	-62.9	-40.6	171.8	-71.4	163.5	122.7	0	0	111.8	V354 T355 T360 E361 I362	V354-E358 HydrophobicContact CG1-CB 3.67Å; T355-E358 WeakPolarHBondContact CB-OE2 2.12Å; T355-E358 WeakPolarHBondContact CG2-OE2 2.12Å; T355-E358 PolarHBondContact N-OE2 2.86Å; T355-E358 PolarHBondContact O-N 2.86Å; T355-E358 WeakPolarHBondContact OG1-CB 3.34Å; T355-E358 VanDerWaalsContact OG1-CG 3.26Å; T355-E358 WeakPolarHBondContact OG1-CG 2.13Å; T355-E358 PolarHBondContact OG1-N 2.97Å; T355-E358 VanDerWaalsContact OG1-N 3.17Å; T355-E358 PolarHBondContact OG1-OE2 3.28Å; E358-T360 VanDerWaalsContact C-N 3.3Å; E358-T360 PolarHBondContact O-N 3.43Å; E358-E361 PolarHBondContact O-N 3.45Å; E358-I362 WeakPolarHBondContact O-CB 3.46Å; E358-I362 WeakPolarHBondContact O-CD1 3.28Å; E358-I362 WeakPolarHBondContact O-CG1 3.1Å; E358-I362 PolarHBondContact O-N 2.91Å
359	Y	36.5	Very low	33.3	Very low	125 Å²	125	102.6 Å²	102.6	49%	0.49	55%	0.546	S	S	.	.	H	α-helix	trans	-63.6	-38.2	173.2	-177.4	-105.5	0	0	0	110.8	T355 I362 M363	T355-Y359 WeakPolarHBondContact O-CB 2.13Å; T355-Y359 PolarHBondContact O-N 3.47Å; Y359-I362 PolarHBondContact O-N 3.22Å; Y359-M363 HydrophobicContact CD1-CG 4.07Å; Y359-M363 HydrophobicContact CD2-CG 4.18Å; Y359-M363 HydrophobicContact CE1-CG 3.7Å; Y359-M363 HydrophobicContact CE2-CG 3.81Å; Y359-M363 HydrophobicContact CE2-SD 4.06Å; Y359-M363 HydrophobicContact CG-CG 4.3Å; Y359-M363 VanDerWaalsContact O-CB 3.29Å; Y359-M363 WeakPolarHBondContact O-CB 3.26Å; Y359-M363 WeakPolarHBondContact O-CG 3.27Å; Y359-M363 PolarHBondContact O-N 3.29Å
360	T	34.2	Very low	33.5	Very low	65 Å²	65	104.8 Å²	104.8	40%	0.399	55%	0.545	S	S	.	.	H	α-helix	trans	-66.7	-37.7	174	-65.1	0	0	0	0	112.2	D356 E357 E358 K364	D356-T360 WeakPolarHBondContact O-CB 2.13Å; D356-T360 PolarHBondContact O-N 2.89Å; D356-T360 PolarHBondContact O-OG1 2.86Å; E357-T360 CarbonylContact O-C 3.5Å; E357-T360 WeakPolarHBondContact O-CB 3.46Å; E357-T360 PolarHBondContact O-N 2.89Å; E357-T360 VanDerWaalsContact O-N 3.16Å; E358-T360 VanDerWaalsContact C-N 3.3Å; E358-T360 PolarHBondContact O-N 3.43Å; T360-K364 HydrophobicContact CG2-CD 4.18Å; T360-K364 HydrophobicContact CG2-CG 4.49Å; T360-K364 VanDerWaalsContact O-CB 3.3Å; T360-K364 WeakPolarHBondContact O-CB 3.19Å; T360-K364 VanDerWaalsContact O-CG 3.22Å; T360-K364 WeakPolarHBondContact O-CG 3.15Å; T360-K364 PolarHBondContact O-N 2.77Å
361	E	36.8	Very low	33.5	Very low	131 Å²	131	105.8 Å²	105.8	61%	0.612	54%	0.541	S	S	*	.	H	α-helix	trans	-69	-41.8	173.4	-68.1	-126.8	126.6	0	0	112	E357 E358 M363 K364 S365	E357-E361 WeakPolarHBondContact O-CG 3.24Å; E357-E361 PolarHBondContact O-N 2.87Å; E358-E361 PolarHBondContact O-N 3.45Å; E361-M363 VanDerWaalsContact C-N 3.35Å; E361-M363 PolarHBondContact O-N 2.73Å; E361-K364 PolarHBondContact O-N 2.73Å; E361-S365 VanDerWaalsContact O-CB 3.24Å; E361-S365 WeakPolarHBondContact O-CB 3.26Å; E361-S365 PolarHBondContact O-N 3.1Å; E361-S365 PolarHBondContact O-OG 3.42Å
362	I	37.4	Very low	33.6	Very low	75 Å²	75	108.4 Å²	108.4	39%	0.385	56%	0.556	S	S	.	*	H	α-helix	trans	-62.4	-41.6	174.1	-70.2	164.2	0	0	0	110.3	V354 E358 Y359 S365 Y366 G367	V354-I362 HydrophobicContact CG1-CD1 4.18Å; E358-I362 WeakPolarHBondContact O-CB 3.46Å; E358-I362 WeakPolarHBondContact O-CD1 3.28Å; E358-I362 WeakPolarHBondContact O-CG1 3.1Å; E358-I362 PolarHBondContact O-N 2.91Å; Y359-I362 PolarHBondContact O-N 3.22Å; I362-S365 PolarHBondContact O-N 3.17Å; I362-Y366 HydrophobicContact CG2-CD2 4.4Å; I362-Y366 WeakPolarHBondContact O-CA 3.32Å; I362-Y366 WeakPolarHBondContact O-CB 3.44Å; I362-Y366 PolarHBondContact O-N 2.98Å; I362-G367 PolarHBondContact O-N 3.05Å
363	M	35.7	Very low	33.7	Very low	62 Å²	62	112.3 Å²	112.3	31%	0.305	56%	0.562	S	S	.	*	H	α-helix	trans	-76.1	-29.5	178	-67	-63.1	-82	0	0	112.9	Y359 E361 G367 I370	Y359-M363 HydrophobicContact CD1-CG 4.07Å; Y359-M363 HydrophobicContact CD2-CG 4.18Å; Y359-M363 HydrophobicContact CE1-CG 3.7Å; Y359-M363 HydrophobicContact CE2-CG 3.81Å; Y359-M363 HydrophobicContact CE2-SD 4.06Å; Y359-M363 HydrophobicContact CG-CG 4.3Å; Y359-M363 VanDerWaalsContact O-CB 3.29Å; Y359-M363 WeakPolarHBondContact O-CB 3.26Å; Y359-M363 WeakPolarHBondContact O-CG 3.27Å; Y359-M363 PolarHBondContact O-N 3.29Å; E361-M363 VanDerWaalsContact C-N 3.35Å; E361-M363 PolarHBondContact O-N 2.73Å; M363-G367 WeakPolarHBondContact O-CA 3.15Å; M363-G367 PolarHBondContact O-N 2.94Å; M363-I370 HydrophobicContact SD-CD1 3.97Å
364	K	36.8	Very low	33.4	Very low	157 Å²	157	118.4 Å²	118.4	68%	0.683	57%	0.569	S	S	*	*	H	α-helix	trans	-66.7	-37.9	167.9	-80	170.7	179.7	171.3	0	112.4	T360 E361	T360-K364 HydrophobicContact CG2-CD 4.18Å; T360-K364 HydrophobicContact CG2-CG 4.49Å; T360-K364 VanDerWaalsContact O-CB 3.3Å; T360-K364 WeakPolarHBondContact O-CB 3.19Å; T360-K364 VanDerWaalsContact O-CG 3.22Å; T360-K364 WeakPolarHBondContact O-CG 3.15Å; T360-K364 PolarHBondContact O-N 2.77Å; E361-K364 PolarHBondContact O-N 2.73Å
365	S	34.3	Very low	33.1	Very low	71 Å²	71	122.3 Å²	122.3	50%	0.497	59%	0.587	S	S	.	*	H	α-helix	trans	-85.3	-37.7	-175.4	-54.7	0	0	0	0	113	E361 I362	E361-S365 VanDerWaalsContact O-CB 3.24Å; E361-S365 WeakPolarHBondContact O-CB 3.26Å; E361-S365 PolarHBondContact O-N 3.1Å; E361-S365 PolarHBondContact O-OG 3.42Å; I362-S365 PolarHBondContact O-N 3.17Å
366	Y	33.4	Very low	33	Very low	146 Å²	146	123 Å²	123	57%	0.573	59%	0.594	S	S	*	*	H	α-helix	trans	-134.9	-5.8	-167.9	-51.8	-71.3	0	0	0	114.6	I362 P368 F369	I362-Y366 HydrophobicContact CG2-CD2 4.4Å; I362-Y366 WeakPolarHBondContact O-CA 3.32Å; I362-Y366 WeakPolarHBondContact O-CB 3.44Å; I362-Y366 PolarHBondContact O-N 2.98Å; Y366-P368 VanDerWaalsContact C-N 3.28Å; Y366-F369 WeakPolarHBondContact O-CB 3.44Å; Y366-F369 PolarHBondContact O-N 3.32Å
367	G	32.6	Very low	32.9	Very low	15 Å²	15	125.6 Å²	125.6	16%	0.155	60%	0.601	C	S	.	*	G	3₁₀ helix	trans	-52.7	-33.8	178.5	0	0	0	0	0	115.3	I362 M363 F369 I370	I362-G367 PolarHBondContact O-N 3.05Å; M363-G367 WeakPolarHBondContact O-CA 3.15Å; M363-G367 PolarHBondContact O-N 2.94Å; G367-F369 PolarHBondContact O-N 3.17Å; G367-F369 VanDerWaalsContact O-N 3.08Å; G367-I370 PolarHBondContact O-N 3.17Å; G367-I370 VanDerWaalsContact O-N 3.11Å
368	P	35.2	Very low	32.8	Very low	101 Å²	101	127.6 Å²	127.6	66%	0.656	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-61.6	-10.6	171.8	-26.5	36.8	0	0	0	115.9	Y366	Y366-P368 VanDerWaalsContact C-N 3.28Å
369	F	30.6	Very low	32.5	Very low	155 Å²	155	125.8 Å²	125.8	68%	0.68	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-102.2	6.3	176.6	-58.8	-76.3	0	0	0	113.4	Y366 G367	Y366-F369 WeakPolarHBondContact O-CB 3.44Å; Y366-F369 PolarHBondContact O-N 3.32Å; G367-F369 PolarHBondContact O-N 3.17Å; G367-F369 VanDerWaalsContact O-N 3.08Å
370	I	30	Very low	32.2	Very low	97 Å²	97	125.2 Å²	125.2	50%	0.497	61%	0.613	S	S	.	*			trans	-118.4	97.3	-176	-56	179.8	0	0	0	110	M363 G367	M363-I370 HydrophobicContact SD-CD1 3.97Å; G367-I370 PolarHBondContact O-N 3.17Å; G367-I370 VanDerWaalsContact O-N 3.11Å
371	E	26.9	Very low	32	Very low	146 Å²	146	125.8 Å²	125.8	68%	0.682	62%	0.619	S	S	*	*			trans	-69.1	135	175.1	-70.8	-171.6	167.1	0	0	112.7	R373	E371-R373 VanDerWaalsContact C-N 3.28Å; E371-R373 PolarHBondContact O-N 3.02Å; E371-R373 IonicContact OE2-CZ 2.65Å; E371-R373 IonicContact OE2-NE 2.64Å; E371-R373 IonicContact OE2-NH2 2.69Å; E371-R373 PolarHBondContact OE2-NH2 3.11Å
372	N	27.2	Very low	31.5	Very low	170 Å²	170	121.9 Å²	121.9	91%	0.909	62%	0.615	S	S	*	*			trans	-69.6	72.6	173.6	-87.3	-55.3	0	0	0	113	R374	N372-R374 PolarHBondContact O-N 3.03Å
373	R	31	Very low	31.1	Very low	208 Å²	208	127 Å²	127	79%	0.785	63%	0.63	S	S	*	*			trans	-84.7	101.5	175.1	-155.6	160.9	-64.3	-137.6	1.9	111	E371	E371-R373 VanDerWaalsContact C-N 3.28Å; E371-R373 PolarHBondContact O-N 3.02Å; E371-R373 IonicContact OE2-CZ 2.65Å; E371-R373 IonicContact OE2-NE 2.64Å; E371-R373 IonicContact OE2-NH2 2.69Å; E371-R373 PolarHBondContact OE2-NH2 3.11Å
374	R	28.6	Very low	30.9	Very low	233 Å²	233	133.8 Å²	133.8	88%	0.879	66%	0.659	S	S	*	*			trans	-41.6	133.5	-174.8	-75.3	175.9	162.9	173	-6.4	114.5	N372 S376	N372-R374 PolarHBondContact O-N 3.03Å; R374-S376 PolarHBondContact O-N 3.41Å
375	L	27.5	Very low	30.4	Very low	152 Å²	152	131.8 Å²	131.8	80%	0.796	65%	0.654	S	S	*	*			trans	-49.3	126.7	157.1	-68.6	163.5	0	0	0	109.4
376	S	33.5	Very low	30.2	Very low	77 Å²	77	134.7 Å²	134.7	54%	0.538	66%	0.663	S	S	.	*			trans	-113.9	145.2	170.5	78.5	0	0	0	0	109.2	R374 K378 N379	R374-S376 PolarHBondContact O-N 3.41Å; S376-K378 PolarHBondContact O-N 3.38Å; S376-N379 PolarHBondContact O-N 3.18Å
377	E	33.2	Very low	29.9	Very low	192 Å²	192	136.3 Å²	136.3	90%	0.897	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-18.7	-172.8	-59.6	174.2	154.3	0	0	114
378	K	32.4	Very low	29.8	Very low	201 Å²	201	138 Å²	138	87%	0.874	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-2.8	178.9	-64.3	-171.5	176.8	-176.4	0	115	S376	S376-K378 PolarHBondContact O-N 3.38Å
379	N	29.4	Very low	29.6	Very low	63 Å²	63	137.6 Å²	137.6	34%	0.337	69%	0.686	S	S	.	*			trans	-143.6	81.7	165.8	-173.9	6.8	0	0	0	111.4	S376 S381	S376-N379 PolarHBondContact O-N 3.18Å; N379-S381 PolarHBondContact O-N 3.02Å; N379-S381 PolarHBondContact OD1-N 2.91Å
380	P	29.8	Very low	29.8	Very low	113 Å²	113	139 Å²	139	73%	0.734	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-14.2	178.5	-21.6	34.6	0	0	0	114.9
381	S	29.4	Very low	30.1	Very low	76 Å²	76	141.6 Å²	141.6	53%	0.531	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.2	3.4	-165.1	-49.9	0	0	0	0	115.1	N379 Y383	N379-S381 PolarHBondContact O-N 3.02Å; N379-S381 PolarHBondContact OD1-N 2.91Å; S381-Y383 VanDerWaalsContact C-N 3.29Å; S381-Y383 WeakPolarHBondContact O-CD2 3.45Å; S381-Y383 PolarHBondContact O-N 3.23Å
382	G	26.4	Very low	30.5	Very low	50 Å²	50	142.6 Å²	142.6	52%	0.515	69%	0.692	S	S	.	*			trans	68.2	8.6	162.2	0	0	0	0	0	118.2
383	Y	29.2	Very low	30.8	Very low	181 Å²	181	135 Å²	135	71%	0.71	65%	0.653	S	S	*	*			trans	-73.2	136.4	-177.8	-60.5	-63.7	0	0	0	113.7	S381 I385	S381-Y383 VanDerWaalsContact C-N 3.29Å; S381-Y383 WeakPolarHBondContact O-CD2 3.45Å; S381-Y383 PolarHBondContact O-N 3.23Å; Y383-I385 PolarHBondContact O-N 2.94Å
384	F	31.1	Very low	31	Very low	206 Å²	206	133.2 Å²	133.2	90%	0.904	65%	0.651	S	S	*	*			trans	-70.8	117.5	174.6	-69.2	-92.8	0	0	0	110.9
385	I	27.4	Very low	31.4	Very low	114 Å²	114	127.6 Å²	127.6	59%	0.585	64%	0.638	S	S	*	*			trans	-101.2	107.3	175.9	-57.9	175.8	0	0	0	108.9	Y383	Y383-I385 PolarHBondContact O-N 2.94Å
386	I	28.8	Very low	31.9	Very low	132 Å²	132	125.3 Å²	125.3	68%	0.677	62%	0.624	S	S	*	*			trans	-68.8	129.5	169.8	-56.9	177	0	0	0	107.9	G388	I386-G388 VanDerWaalsContact C-N 3.25Å; I386-G388 PolarHBondContact O-N 2.93Å
387	Q	27.1	Very low	32.2	Very low	180 Å²	180	128.9 Å²	128.9	84%	0.841	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-15.9	-167.2	-69.8	-168.6	-5.9	0	0	115.1
388	G	30.1	Very low	31.9	Very low	52 Å²	52	125.2 Å²	125.2	54%	0.536	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.5	-43.5	-178.3	0	0	0	0	0	114.1	I386 R390 K391	I386-G388 VanDerWaalsContact C-N 3.25Å; I386-G388 PolarHBondContact O-N 2.93Å; G388-R390 VanDerWaalsContact C-N 3.26Å; G388-R390 PolarHBondContact O-N 3.13Å; G388-K391 PolarHBondContact O-N 3.41Å
389	D	31.6	Very low	32	Very low	92 Å²	92	124.2 Å²	124.2	49%	0.492	62%	0.617	S	S	.	*	H	α-helix	trans	-75.4	-10.7	-168.3	-65.4	-58.5	0	0	0	114.6	K391 R392 A393	D389-K391 PolarHBondContact O-N 3.16Å; D389-R392 PolarHBondContact O-N 3.24Å; D389-A393 WeakPolarHBondContact O-CB 3.49Å; D389-A393 PolarHBondContact O-N 3.04Å
390	R	34.2	Very low	32.1	Very low	184 Å²	184	127.1 Å²	127.1	69%	0.694	64%	0.637	S	S	*	*	H	α-helix	trans	-59.8	-32.9	169.8	-91.6	-169.4	178.6	179.1	2	112.9	G388 K394	G388-R390 VanDerWaalsContact C-N 3.26Å; G388-R390 PolarHBondContact O-N 3.13Å; R390-K394 PolarHBondContact O-N 3.36Å
391	K	37.4	Very low	32.1	Very low	152 Å²	152	125 Å²	125	66%	0.661	64%	0.636	S	S	*	*	H	α-helix	trans	-73.4	-53.5	176.7	-157.5	-173.2	172.8	-175	0	109.3	G388 D389 A393 K394 D395	G388-K391 PolarHBondContact O-N 3.41Å; D389-K391 PolarHBondContact O-N 3.16Å; K391-A393 VanDerWaalsContact C-N 3.33Å; K391-A393 PolarHBondContact O-N 3.29Å; K391-K394 WeakPolarHBondContact O-CA 3.48Å; K391-K394 VanDerWaalsContact O-CB 3.31Å; K391-K394 WeakPolarHBondContact O-CB 3.46Å; K391-K394 PolarHBondContact O-N 3.3Å; K391-D395 PolarHBondContact O-N 3.32Å
392	R	35	Very low	31.9	Very low	167 Å²	167	128 Å²	128	63%	0.63	64%	0.641	S	S	*	*	H	α-helix	trans	-59.2	-36.1	-178.5	-158.6	174.9	-171.1	163.2	4.9	114.3	D389 M396	D389-R392 PolarHBondContact O-N 3.24Å; R392-M396 HydrophobicContact CG-CE 4.19Å; R392-M396 WeakPolarHBondContact O-CG 3.47Å; R392-M396 PolarHBondContact O-N 2.81Å; R392-M396 VanDerWaalsContact O-N 3.15Å
393	A	33.6	Very low	32	Very low	11 Å²	11	131 Å²	131	9%	0.091	64%	0.644	C	S	.	*	H	α-helix	trans	-68.3	-38.9	174	0	0	0	0	0	112.7	D389 K391 N397 K398 V400	D389-A393 WeakPolarHBondContact O-CB 3.49Å; D389-A393 PolarHBondContact O-N 3.04Å; K391-A393 VanDerWaalsContact C-N 3.33Å; K391-A393 PolarHBondContact O-N 3.29Å; A393-N397 PolarHBondContact O-N 3.1Å; A393-N397 VanDerWaalsContact O-N 3.16Å; A393-K398 PolarHBondContact O-N 2.88Å; A393-V400 HydrophobicContact CB-CG2 4.1Å
394	K	36.3	Very low	31.7	Very low	170 Å²	170	128 Å²	128	74%	0.739	64%	0.644	S	S	*	*	H	α-helix	trans	-64.4	-45.8	171.8	-101.8	-167.8	169.6	-165.4	0	111.9	R390 K391 M396 N397	R390-K394 PolarHBondContact O-N 3.36Å; K391-K394 WeakPolarHBondContact O-CA 3.48Å; K391-K394 VanDerWaalsContact O-CB 3.31Å; K391-K394 WeakPolarHBondContact O-CB 3.46Å; K391-K394 PolarHBondContact O-N 3.3Å; K394-M396 PolarHBondContact O-N 3.14Å; K394-N397 WeakPolarHBondContact O-CA 3.3Å; K394-N397 PolarHBondContact O-N 3.43Å
395	D	36.3	Very low	31.3	Very low	114 Å²	114	125.5 Å²	125.5	61%	0.61	64%	0.64	S	S	*	*	H	α-helix	trans	-66.4	-28.4	-175.9	-57.9	-24.2	0	0	0	111.8	K391	K391-D395 PolarHBondContact O-N 3.32Å
396	M	37.7	Very low	31.1	Very low	104 Å²	104	125.5 Å²	125.5	51%	0.512	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	6.3	170.8	-60.9	-171.5	-56.1	0	0	113.8	R392 K394 K398 I403	R392-M396 HydrophobicContact CG-CE 4.19Å; R392-M396 WeakPolarHBondContact O-CG 3.47Å; R392-M396 PolarHBondContact O-N 2.81Å; R392-M396 VanDerWaalsContact O-N 3.15Å; K394-M396 PolarHBondContact O-N 3.14Å; M396-K398 PolarHBondContact O-N 3.32Å; M396-K398 VanDerWaalsContact O-N 3.11Å; M396-I403 HydrophobicContact CE-CD1 3.54Å
397	N	39.5	Very low	30.8	Very low	153 Å²	153	127.8 Å²	127.8	82%	0.818	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.6	39.4	177	-154.6	26.6	0	0	0	114.9	A393 K394	A393-N397 PolarHBondContact O-N 3.1Å; A393-N397 VanDerWaalsContact O-N 3.16Å; K394-N397 WeakPolarHBondContact O-CA 3.3Å; K394-N397 PolarHBondContact O-N 3.43Å
398	K	28.2	Very low	30.5	Very low	115 Å²	115	127 Å²	127	50%	0.5	66%	0.656	S	S	.	*			trans	-119.8	144.4	176.4	-90.1	-155.5	167.6	-153.5	0	111.2	A393 M396 E402	A393-K398 PolarHBondContact O-N 2.88Å; M396-K398 PolarHBondContact O-N 3.32Å; M396-K398 VanDerWaalsContact O-N 3.11Å; K398-E402 IonicContact NZ-OE2 2.66Å; K398-E402 PolarHBondContact NZ-OE2 2.86Å
399	E	33.7	Very low	30.1	Very low	180 Å²	180	130.6 Å²	130.6	84%	0.841	66%	0.663	S	S	*	*			trans	-69.5	151.5	174.9	-61.5	-164.7	157.4	0	0	111.8	G401	E399-G401 PolarHBondContact O-N 3.48Å
400	V	30.4	Very low	29.8	Very low	124 Å²	124	133.6 Å²	133.6	75%	0.752	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	34.6	-159.1	-160.2	0	0	0	0	113.3	A393	A393-V400 HydrophobicContact CB-CG2 4.1Å
401	G	30.6	Very low	29.2	Very low	69 Å²	69	129.9 Å²	129.9	71%	0.711	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	-18.3	-174.9	0	0	0	0	0	116.4	E399	E399-G401 PolarHBondContact O-N 3.48Å
402	E	26.3	Very low	28.5	Very low	139 Å²	139	134.5 Å²	134.5	65%	0.65	69%	0.685	S	S	*	*			trans	-103.1	-5.5	-166.3	-78	-160.3	144.2	0	0	116.8	K398 V404	K398-E402 IonicContact NZ-OE2 2.66Å; K398-E402 PolarHBondContact NZ-OE2 2.86Å; E402-V404 VanDerWaalsContact C-N 3.27Å; E402-V404 PolarHBondContact O-N 2.61Å
403	I	26.9	Very low	27.8	Very low	111 Å²	111	130.3 Å²	130.3	57%	0.569	69%	0.694	S	S	*	*			trans	-82.3	76.1	-176.4	-51.6	-176.7	0	0	0	110.6	M396	M396-I403 HydrophobicContact CE-CD1 3.54Å
404	V	24.3	Very low	27.2	Very low	119 Å²	119	136.3 Å²	136.3	72%	0.721	73%	0.729	S	S	*	*			trans	-113.1	102.2	166.2	-179.2	0	0	0	0	108	E402	E402-V404 VanDerWaalsContact C-N 3.27Å; E402-V404 PolarHBondContact O-N 2.61Å
405	L	22	Very low	26.6	Very low	153 Å²	153	138.6 Å²	138.6	80%	0.801	73%	0.734	S	S	*	*			trans	-109.4	114.4	172.4	-70.4	178.2	0	0	0	109.4
406	P	23.7	Very low	25.9	Very low	114 Å²	114	139.3 Å²	139.3	74%	0.74	74%	0.738	S	S	*	*			trans	-66.3	143.3	-178.9	-22.7	34.3	0	0	0	113.5
407	L	22.6	Very low	25.1	Very low	180 Å²	180	139.1 Å²	139.1	94%	0.942	75%	0.753	S	S	*	*			trans	-91.2	106.2	171.3	-74.6	165.5	0	0	0	110.1
408	E	20.9	Very low	24.5	Very low	164 Å²	164	136.4 Å²	136.4	77%	0.766	74%	0.742	S	S	*	*			trans	-136.1	136.8	170.8	-82.6	-157.2	179	0	0	114.1
409	N	21.9	Very low	24.3	Very low	128 Å²	128	134.5 Å²	134.5	68%	0.684	75%	0.748	S	S	*	*			trans	81.4	141.2	147.7	-81.2	-56.2	0	0	0	122.4
410	Q	25.1	Very low	23.9	Very low	155 Å²	155	134.6 Å²	134.6	72%	0.724	75%	0.748	S	S	*	*			trans	82.1	80.3	162.4	-54.1	-63.4	-49.7	0	0	121.7
411	T	21.8	Very low	23.6	Very low	105 Å²	105	136.2 Å²	136.2	64%	0.644	75%	0.747	S	S	*	*				53	120.3	122.8	55.8	0	0	0	0	124.5
412	R	21.5	Very low	23.3	Very low	250 Å²	250	135 Å²	135	94%	0.943	73%	0.73	S	S	*	*				53.2	118.1	129.1	-62.8	178.4	171.3	-178.7	-3.4	120.4
413	G	20.2	Very low	23.2	Very low	79 Å²	79	136.1 Å²	136.1	81%	0.814	73%	0.73	S	S	*	*			trans	-177.6	118	156.4	0	0	0	0	0	113.4
414	V	22.4	Very low	23.3	Very low	136 Å²	136	138.1 Å²	138.1	82%	0.824	74%	0.741	S	S	*	*			trans	-70.7	128.5	177.5	172	0	0	0	0	110.7
415	Y	23.7	Very low	23.5	Very low	218 Å²	218	138.6 Å²	138.6	86%	0.855	74%	0.738	S	S	*	*			trans	-158.1	114.3	141.9	-100	-68.1	0	0	0	111.4
416	L	21.1	Very low	23.6	Very low	130 Å²	130	138.1 Å²	138.1	68%	0.681	74%	0.736	S	S	*	*			trans	-95	169.5	160	-115.6	69.3	0	0	0	108.9
417	A	21.5	Very low	23.7	Very low	100 Å²	100	136.5 Å²	136.5	83%	0.826	72%	0.721	S	S	*	*	S	Bend	trans	72.1	48.6	172.3	0	0	0	0	0	118.1
418	T	24.9	Very low	23.8	Very low	96 Å²	96	132.8 Å²	132.8	59%	0.589	71%	0.707	S	S	*	*			trans	-148.3	-1	155.7	-18.2	0	0	0	0	115.1	H420 Q421 A422	T418-H420 PolarHBondContact O-N 3.07Å; T418-Q421 PolarHBondContact O-N 2.91Å; T418-A422 PolarHBondContact O-N 3.21Å
419	A	24.3	Very low	24.4	Very low	75 Å²	75	130.8 Å²	130.8	62%	0.62	70%	0.702	S	S	*	*	H	α-helix	trans	-62.2	-32.3	-165	0	0	0	0	0	115.6	Q421 A422 Y423	A419-Q421 VanDerWaalsContact C-N 3.32Å; A419-Q421 PolarHBondContact O-N 3.21Å; A419-A422 PolarHBondContact O-N 3.47Å; A419-Y423 PolarHBondContact O-N 2.92Å
420	H	25.2	Very low	24.6	Very low	182 Å²	182	130.3 Å²	130.3	84%	0.843	70%	0.699	S	S	*	*	H	α-helix	trans	-72.1	-22.6	-175.1	-137.6	143.3	0	0	0	113.6	T418	T418-H420 PolarHBondContact O-N 3.07Å
421	Q	24.6	Very low	25	Very low	158 Å²	158	127.7 Å²	127.7	74%	0.738	69%	0.693	S	S	*	*	H	α-helix	trans	-93.7	-24	171.1	-75.3	-177.9	-29.2	0	0	112.6	T418 A419 I425	T418-Q421 PolarHBondContact O-N 2.91Å; A419-Q421 VanDerWaalsContact C-N 3.32Å; A419-Q421 PolarHBondContact O-N 3.21Å; Q421-I425 WeakPolarHBondContact O-CD1 3.34Å
422	A	24.2	Very low	25.4	Very low	44 Å²	44	129.4 Å²	129.4	36%	0.364	70%	0.698	S	S	.	*	H	α-helix	trans	-77.5	-32.3	178.2	0	0	0	0	0	114	T418 A419 L424 I425 L426	T418-A422 PolarHBondContact O-N 3.21Å; A419-A422 PolarHBondContact O-N 3.47Å; A422-L424 VanDerWaalsContact C-N 3.33Å; A422-L424 PolarHBondContact O-N 3.18Å; A422-I425 PolarHBondContact O-N 3.22Å; A422-L426 PolarHBondContact O-N 3.11Å
423	Y	25.3	Very low	26	Very low	161 Å²	161	125.2 Å²	125.2	63%	0.631	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-25.4	-171.4	-147.6	-87.4	0	0	0	114.2	A419	A419-Y423 PolarHBondContact O-N 2.92Å
424	L	27.5	Very low	27	Very low	153 Å²	153	126.8 Å²	126.8	80%	0.801	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-21.8	170.8	-101.6	77.7	0	0	0	113.4	A422	A422-L424 VanDerWaalsContact C-N 3.33Å; A422-L424 PolarHBondContact O-N 3.18Å
425	I	28.8	Very low	27.7	Very low	130 Å²	130	124.9 Å²	124.9	67%	0.667	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-25.1	-169.5	-64.3	178.4	0	0	0	112.3	Q421 A422	Q421-I425 WeakPolarHBondContact O-CD1 3.34Å; A422-I425 PolarHBondContact O-N 3.22Å
426	L	24.9	Very low	28.6	Very low	143 Å²	143	116.7 Å²	116.7	75%	0.749	64%	0.636	S	S	*	*	S	Bend	trans	-115.2	17.8	-174.7	-67	177.2	0	0	0	115.2	A422	A422-L426 PolarHBondContact O-N 3.11Å
427	N	24.6	Very low	29.5	Very low	80 Å²	80	112 Å²	112	43%	0.428	62%	0.62	S	S	.	*			trans	-145.8	62.2	168.9	-111	-34	0	0	0	113.2	N429 L430	N427-N429 PolarHBondContact O-N 2.72Å; N427-L430 HydrophobicContact CB-CD1 4.43Å; N427-L430 PolarHBondContact O-N 3.22Å
428	P	26.4	Very low	30.8	Very low	101 Å²	101	109.6 Å²	109.6	66%	0.656	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-8.4	177.2	27.1	-34.5	0	0	0	114.6
429	N	32.2	Very low	32.2	Very low	123 Å²	123	111.6 Å²	111.6	66%	0.658	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	12	-175.5	-62	28.3	0	0	0	113.6	N427	N427-N429 PolarHBondContact O-N 2.72Å
430	L	27.7	Very low	33.3	Very low	118 Å²	118	113.3 Å²	113.3	62%	0.618	59%	0.588	S	S	*	*	S	Bend	trans	-96	103.2	169.9	-82.1	169.9	0	0	0	109.5	N427	N427-L430 HydrophobicContact CB-CD1 4.43Å; N427-L430 PolarHBondContact O-N 3.22Å
431	V	31.5	Very low	34.4	Very low	100 Å²	100	109.7 Å²	109.7	61%	0.606	58%	0.575	S	S	*	*			trans	71.9	75.9	-167.7	-161.2	0	0	0	0	112.8	F433	V431-F433 VanDerWaalsContact C-N 3.28Å; V431-F433 HydrophobicContact CB-CD2 4.32Å; V431-F433 HydrophobicContact CB-CE2 4.13Å; V431-F433 HydrophobicContact CG1-CD1 4.19Å; V431-F433 HydrophobicContact CG1-CD2 3.61Å; V431-F433 HydrophobicContact CG1-CE1 4.13Å; V431-F433 HydrophobicContact CG1-CE2 3.54Å; V431-F433 HydrophobicContact CG1-CG 3.95Å; V431-F433 HydrophobicContact CG1-CZ 3.82Å; V431-F433 PolarHBondContact O-N 3.41Å
432	D	31.6	Very low	36.2	Very low	141 Å²	141	103.1 Å²	103.1	75%	0.754	54%	0.544	S	S	*	.			trans	-54.3	99.3	143.5	-83.3	-49.6	0	0	0	107.7	D434	D432-D434 PolarHBondContact O-N 3.06Å
433	F	34.5	Very low	38.3	Very low	161 Å²	161	105.2 Å²	105.2	71%	0.706	55%	0.549	S	S	*	.			trans	-67.3	122.2	165	-78.6	-87.6	0	0	0	107.7	V431 L435	V431-F433 VanDerWaalsContact C-N 3.28Å; V431-F433 HydrophobicContact CB-CD2 4.32Å; V431-F433 HydrophobicContact CB-CE2 4.13Å; V431-F433 HydrophobicContact CG1-CD1 4.19Å; V431-F433 HydrophobicContact CG1-CD2 3.61Å; V431-F433 HydrophobicContact CG1-CE1 4.13Å; V431-F433 HydrophobicContact CG1-CE2 3.54Å; V431-F433 HydrophobicContact CG1-CG 3.95Å; V431-F433 HydrophobicContact CG1-CZ 3.82Å; V431-F433 PolarHBondContact O-N 3.41Å; F433-L435 HydrophobicContact CB-CG 4.39Å; F433-L435 PolarHBondContact O-N 3.29Å
434	D	39.6	Very low	40.1	Very low	113 Å²	113	99 Å²	99	60%	0.604	53%	0.533	S	S	*	.			trans	-72.1	79.7	177.9	-172.8	-4.4	0	0	0	110.8	D432 S436	D432-D434 PolarHBondContact O-N 3.06Å; D434-S436 PolarHBondContact O-N 2.71Å; D434-S436 VanDerWaalsContact O-N 3.1Å; D434-S436 WeakPolarHBondContact OD1-CB 3.33Å; D434-S436 PolarHBondContact OD1-N 3.22Å; D434-S436 PolarHBondContact OD1-OG 3.25Å
435	L	38.3	Very low	41.6	Very low	95 Å²	95	95 Å²	95	50%	0.497	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	9.9	174.9	-65.2	171.6	0	0	0	112.4	F433 G437 V438 K439	F433-L435 HydrophobicContact CB-CG 4.39Å; F433-L435 PolarHBondContact O-N 3.29Å; L435-G437 VanDerWaalsContact C-N 3.27Å; L435-G437 PolarHBondContact O-N 3.03Å; L435-V438 HydrophobicContact CB-CB 4.36Å; L435-V438 HydrophobicContact CD2-CB 4.17Å; L435-V438 HydrophobicContact CD2-CG1 4.46Å; L435-V438 HydrophobicContact CD2-CG2 3.86Å; L435-V438 WeakPolarHBondContact O-CB 3.48Å; L435-V438 PolarHBondContact O-N 3.32Å; L435-K439 WeakPolarHBondContact O-CB 3.43Å; L435-K439 PolarHBondContact O-N 3.3Å
436	S	41.9	Very low	43.6	Very low	47 Å²	47	89.9 Å²	89.9	33%	0.329	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-31.7	176.7	72.7	0	0	0	0	112.6	D434 K440	D434-S436 PolarHBondContact O-N 2.71Å; D434-S436 VanDerWaalsContact O-N 3.1Å; D434-S436 WeakPolarHBondContact OD1-CB 3.33Å; D434-S436 PolarHBondContact OD1-N 3.22Å; D434-S436 PolarHBondContact OD1-OG 3.25Å; S436-K440 WeakPolarHBondContact O-CB 3.42Å; S436-K440 WeakPolarHBondContact O-CD 3.07Å; S436-K440 WeakPolarHBondContact O-CG 3.5Å; S436-K440 PolarHBondContact O-N 3.24Å
437	G	39.8	Very low	45.6	Very low	32 Å²	32	88.4 Å²	88.4	33%	0.33	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-43.9	171.3	0	0	0	0	0	112.5	L435 K440 L441	L435-G437 VanDerWaalsContact C-N 3.27Å; L435-G437 PolarHBondContact O-N 3.03Å; G437-K440 PolarHBondContact O-N 3.18Å; G437-L441 PolarHBondContact O-N 2.75Å
438	V	48.3	Very low	47.1	Very low	48 Å²	48	86.8 Å²	86.8	29%	0.291	46%	0.463	S	S	.	.	H	α-helix	trans	-63.2	-44.6	175.9	173	0	0	0	0	111	L435 L441 K442 F534 L538	L435-V438 HydrophobicContact CB-CB 4.36Å; L435-V438 HydrophobicContact CD2-CB 4.17Å; L435-V438 HydrophobicContact CD2-CG1 4.46Å; L435-V438 HydrophobicContact CD2-CG2 3.86Å; L435-V438 WeakPolarHBondContact O-CB 3.48Å; L435-V438 PolarHBondContact O-N 3.32Å; V438-L441 WeakPolarHBondContact O-CB 3.35Å; V438-L441 PolarHBondContact O-N 3Å; V438-L441 VanDerWaalsContact O-N 3.15Å; V438-K442 PolarHBondContact O-N 2.88Å; V438-F534 HydrophobicContact CG1-CE1 3.75Å; V438-F534 HydrophobicContact CG1-CZ 4.47Å; V438-L538 HydrophobicContact CG1-CD1 3.57Å; V438-L538 HydrophobicContact CG1-CD2 3.52Å; V438-L538 HydrophobicContact CG1-CG 4.16Å
439	K	55.2	Low	48.9	Very low	139 Å²	139	83.1 Å²	83.1	60%	0.604	44%	0.438	S	S	*	.	H	α-helix	trans	-64.4	-40.5	177.1	-159.5	168.2	-172.6	170.8	0	112.1	L435 L441 K442 D443	L435-K439 WeakPolarHBondContact O-CB 3.43Å; L435-K439 PolarHBondContact O-N 3.3Å; K439-L441 VanDerWaalsContact C-N 3.34Å; K439-L441 PolarHBondContact O-N 3.2Å; K439-K442 PolarHBondContact O-N 2.85Å; K439-D443 WeakPolarHBondContact O-CB 3.37Å; K439-D443 VanDerWaalsContact O-CG 3.32Å; K439-D443 PolarHBondContact O-N 3.03Å
440	K	47.5	Very low	50.7	Low	111 Å²	111	81.8 Å²	81.8	48%	0.483	43%	0.427	S	S	.	.	H	α-helix	trans	-61.6	-37.5	170.7	-75.8	165.5	-176.2	166.8	0	112.6	S436 G437 G444	S436-K440 WeakPolarHBondContact O-CB 3.42Å; S436-K440 WeakPolarHBondContact O-CD 3.07Å; S436-K440 WeakPolarHBondContact O-CG 3.5Å; S436-K440 PolarHBondContact O-N 3.24Å; G437-K440 PolarHBondContact O-N 3.18Å; K440-G444 PolarHBondContact O-N 3.15Å
441	L	47.3	Very low	52.4	Low	106 Å²	106	78.4 Å²	78.4	56%	0.555	41%	0.413	S	S	*	.	H	α-helix	trans	-64.5	-46.6	176.1	-158.7	86.3	0	0	0	110.6	G437 V438 K439 G444 L445 F534	G437-L441 PolarHBondContact O-N 2.75Å; V438-L441 WeakPolarHBondContact O-CB 3.35Å; V438-L441 PolarHBondContact O-N 3Å; V438-L441 VanDerWaalsContact O-N 3.15Å; K439-L441 VanDerWaalsContact C-N 3.34Å; K439-L441 PolarHBondContact O-N 3.2Å; L441-G444 PolarHBondContact O-N 3.15Å; L441-L445 PolarHBondContact O-N 3.37Å; L441-F534 HydrophobicContact CB-CZ 4.21Å; L441-F534 HydrophobicContact CD2-CE2 4.2Å; L441-F534 HydrophobicContact CD2-CZ 3.98Å
442	K	63	Low	53.6	Low	20 Å²	20	76 Å²	76	9%	0.087	40%	0.398	C	S	.	.	H	α-helix	trans	-56.4	-57.6	173.7	177.9	157.2	99.2	167.8	0	111.7	V438 K439 G444 L445 I446 K531 F534 D535	V438-K442 PolarHBondContact O-N 2.88Å; K439-K442 PolarHBondContact O-N 2.85Å; K442-G444 PolarHBondContact O-N 2.98Å; K442-L445 PolarHBondContact O-N 3.34Å; K442-L445 VanDerWaalsContact O-N 3.16Å; K442-I446 HydrophobicContact CD-CD1 4.41Å; K442-I446 HydrophobicContact CG-CD1 3.58Å; K442-I446 HydrophobicContact CG-CG1 4.38Å; K442-I446 WeakPolarHBondContact O-CD1 3.3Å; K442-I446 WeakPolarHBondContact O-CG1 3.05Å; K442-I446 PolarHBondContact O-N 3.49Å; K442-K531 PolarHBondContact NZ-O 2.85Å; K442-F534 HydrophobicContact CB-CD1 3.76Å; K442-F534 HydrophobicContact CB-CD2 4.23Å; K442-F534 HydrophobicContact CB-CE1 3.8Å; K442-F534 HydrophobicContact CB-CE2 4.26Å; K442-F534 HydrophobicContact CB-CG 3.99Å; K442-F534 HydrophobicContact CB-CZ 4.06Å; K442-F534 HydrophobicContact CD-CB 3.6Å; K442-F534 HydrophobicContact CD-CD1 3.72Å; K442-F534 HydrophobicContact CD-CG 3.77Å; K442-F534 HydrophobicContact CG-CB 4.22Å; K442-F534 HydrophobicContact CG-CD1 4.13Å; K442-F534 HydrophobicContact CG-CD2 4.48Å; K442-F534 HydrophobicContact CG-CG 4.04Å; K442-D535 IonicContact NZ-OD1 3.71Å; K442-D535 PolarHBondContact NZ-OD1 3.44Å; K442-D535 IonicContact NZ-OD2 2.68Å; K442-D535 PolarHBondContact NZ-OD2 3.42Å
443	D	69.7	Low	54.9	Low	88 Å²	88	78.4 Å²	78.4	47%	0.471	40%	0.402	S	S	.	.	H	α-helix	trans	-61.2	-33.8	-178.1	-68.1	-25.1	0	0	0	111.9	K439 K447	K439-D443 WeakPolarHBondContact O-CB 3.37Å; K439-D443 VanDerWaalsContact O-CG 3.32Å; K439-D443 PolarHBondContact O-N 3.03Å; D443-K447 WeakPolarHBondContact O-CB 3.5Å; D443-K447 PolarHBondContact O-N 3.29Å
444	G	61.1	Low	55.9	Low	29 Å²	29	73 Å²	73	30%	0.299	39%	0.391	S	S	.	.	H	α-helix	trans	-64	-51.1	172.1	0	0	0	0	0	113.1	K440 L441 K442 I446 K447 E448	K440-G444 PolarHBondContact O-N 3.15Å; L441-G444 PolarHBondContact O-N 3.15Å; K442-G444 PolarHBondContact O-N 2.98Å; G444-I446 PolarHBondContact O-N 3.21Å; G444-K447 PolarHBondContact O-N 3.35Å; G444-E448 WeakPolarHBondContact O-CG 3.48Å; G444-E448 PolarHBondContact O-N 3.19Å
445	L	59.2	Low	56.5	Low	71 Å²	71	69 Å²	69	37%	0.372	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-42.1	-179.2	-137.2	79.3	0	0	0	111.9	L441 K442 E448 L449 V530 M544	L441-L445 PolarHBondContact O-N 3.37Å; K442-L445 PolarHBondContact O-N 3.34Å; K442-L445 VanDerWaalsContact O-N 3.16Å; L445-E448 PolarHBondContact O-N 2.9Å; L445-L449 WeakPolarHBondContact O-CG 3.39Å; L445-L449 PolarHBondContact O-N 3.45Å; L445-L449 VanDerWaalsContact O-N 3.09Å; L445-V530 HydrophobicContact CB-CG1 4.23Å; L445-V530 HydrophobicContact CD2-CG1 3.91Å; L445-V530 HydrophobicContact CD2-CG2 4.49Å; L445-M544 HydrophobicContact CD2-CE 4.17Å
446	I	70.6	Confident	57.2	Low	21 Å²	21	75.9 Å²	75.9	11%	0.108	39%	0.394	C	S	.	.	H	α-helix	trans	-58	-49.3	173.4	-64.5	163.2	0	0	0	110.2	K442 G444 E448 L449 K450 A527 V530 K531	K442-I446 HydrophobicContact CD-CD1 4.41Å; K442-I446 HydrophobicContact CG-CD1 3.58Å; K442-I446 HydrophobicContact CG-CG1 4.38Å; K442-I446 WeakPolarHBondContact O-CD1 3.3Å; K442-I446 WeakPolarHBondContact O-CG1 3.05Å; K442-I446 PolarHBondContact O-N 3.49Å; G444-I446 PolarHBondContact O-N 3.21Å; I446-E448 VanDerWaalsContact C-N 3.34Å; I446-E448 PolarHBondContact O-N 3.16Å; I446-L449 PolarHBondContact O-N 3.48Å; I446-K450 WeakPolarHBondContact O-CG 3.25Å; I446-K450 PolarHBondContact O-N 3.45Å; I446-A527 HydrophobicContact CG2-CB 4.02Å; I446-A527 WeakPolarHBondContact O-CB 3.37Å; I446-V530 HydrophobicContact CG1-CG1 4.35Å; I446-K531 HydrophobicContact CD1-CB 3.46Å; I446-K531 VanDerWaalsContact CD1-CB 3.46Å; I446-K531 HydrophobicContact CD1-CD 4.42Å; I446-K531 HydrophobicContact CD1-CG 3.64Å; I446-K531 HydrophobicContact CG1-CB 3.94Å
447	K	67.3	Low	57.5	Low	112 Å²	112	74.2 Å²	74.2	49%	0.487	38%	0.383	S	S	.	.	H	α-helix	trans	-65.2	-37.9	-176.8	-173.1	176.8	-177.9	-177.2	0	112.1	D443 G444 K450 S451	D443-K447 WeakPolarHBondContact O-CB 3.5Å; D443-K447 PolarHBondContact O-N 3.29Å; G444-K447 PolarHBondContact O-N 3.35Å; K447-K450 PolarHBondContact O-N 3.17Å; K447-S451 WeakPolarHBondContact O-CB 3.35Å; K447-S451 PolarHBondContact O-N 2.96Å
448	E	56.4	Low	58.1	Low	46 Å²	46	75.1 Å²	75.1	22%	0.215	39%	0.392	C	S	.	.	H	α-helix	trans	-65.9	-46.4	175.7	-75.4	-60	112.5	0	0	112	G444 L445 I446 K450 S451 F1618 K1621	G444-E448 WeakPolarHBondContact O-CG 3.48Å; G444-E448 PolarHBondContact O-N 3.19Å; L445-E448 PolarHBondContact O-N 2.9Å; I446-E448 VanDerWaalsContact C-N 3.34Å; I446-E448 PolarHBondContact O-N 3.16Å; E448-K450 VanDerWaalsContact C-N 3.28Å; E448-K450 PolarHBondContact O-N 2.97Å; E448-S451 WeakPolarHBondContact O-CB 3.37Å; E448-S451 PolarHBondContact O-N 2.95Å; E448-S451 PolarHBondContact O-OG 2.98Å; E448-F1618 VanDerWaalsContact CD-CZ 3.43Å; E448-F1618 HydrophobicContact CG-CE1 3.55Å; E448-F1618 HydrophobicContact CG-CE2 4.49Å; E448-F1618 HydrophobicContact CG-CZ 3.43Å; E448-F1618 VanDerWaalsContact CG-CZ 3.43Å; E448-F1618 WeakPolarHBondContact OE2-CE1 3.5Å; E448-K1621 IonicContact OE2-NZ 2.64Å; E448-K1621 PolarHBondContact OE2-NZ 2.92Å
449	L	65.1	Low	58.8	Low	25 Å²	25	77.2 Å²	77.2	13%	0.131	40%	0.395	C	S	.	.	H	α-helix	trans	-59.4	-38.4	175.6	-75.1	167.5	0	0	0	111.9	L445 I446 S451 Q523 W526 A527 V530 V551	L445-L449 WeakPolarHBondContact O-CG 3.39Å; L445-L449 PolarHBondContact O-N 3.45Å; L445-L449 VanDerWaalsContact O-N 3.09Å; I446-L449 PolarHBondContact O-N 3.48Å; L449-S451 VanDerWaalsContact C-N 3.27Å; L449-S451 PolarHBondContact O-N 3.26Å; L449-Q523 WeakPolarHBondContact O-CB 3.06Å; L449-Q523 VanDerWaalsContact O-CG 3.26Å; L449-Q523 WeakPolarHBondContact O-CG 3.44Å; L449-Q523 PolarHBondContact O-OE1 3.46Å; L449-W526 HydrophobicContact CD1-CB 4.48Å; L449-W526 HydrophobicContact CD2-CB 4.32Å; L449-W526 HydrophobicContact CD2-CE3 4.48Å; L449-A527 HydrophobicContact CB-CB 3.81Å; L449-V530 HydrophobicContact CD1-CB 4.38Å; L449-V530 HydrophobicContact CD1-CG2 3.56Å; L449-V551 HydrophobicContact CD1-CG1 4.27Å; L449-V551 HydrophobicContact CD2-CG1 3.94Å
450	K	70.2	Confident	59	Low	95 Å²	95	71.1 Å²	71.1	41%	0.413	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-5.1	173	-66	-164	176.7	-154.9	0	115.6	I446 K447 E448 E524 A527	I446-K450 WeakPolarHBondContact O-CG 3.25Å; I446-K450 PolarHBondContact O-N 3.45Å; K447-K450 PolarHBondContact O-N 3.17Å; E448-K450 VanDerWaalsContact C-N 3.28Å; E448-K450 PolarHBondContact O-N 2.97Å; K450-E524 WeakPolarHBondContact CE-OE1 3.3Å; K450-E524 IonicContact NZ-OE1 3.76Å; K450-E524 PolarHBondContact NZ-OE1 2.89Å; K450-A527 HydrophobicContact CD-CB 4.21Å; K450-A527 HydrophobicContact CG-CB 3.45Å; K450-A527 VanDerWaalsContact CG-CB 3.45Å
451	S	62	Low	59.5	Low	47 Å²	47	73.1 Å²	73.1	33%	0.329	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-4.5	-174.9	76.6	0	0	0	0	115	K447 E448 L449 K453	K447-S451 WeakPolarHBondContact O-CB 3.35Å; K447-S451 PolarHBondContact O-N 2.96Å; E448-S451 WeakPolarHBondContact O-CB 3.37Å; E448-S451 PolarHBondContact O-N 2.95Å; E448-S451 PolarHBondContact O-OG 2.98Å; L449-S451 VanDerWaalsContact C-N 3.27Å; L449-S451 PolarHBondContact O-N 3.26Å; S451-K453 PolarHBondContact O-N 2.75Å
452	V	58	Low	60.1	Low	49 Å²	49	75.1 Å²	75.1	30%	0.297	39%	0.389	S	S	.	.			trans	-72.9	88.4	-168.8	-174.8	0	0	0	0	110.8	G454 L520 Q523	V452-G454 VanDerWaalsContact C-N 3.26Å; V452-G454 PolarHBondContact O-N 2.6Å; V452-L520 HydrophobicContact CG1-CD2 3.95Å; V452-Q523 HydrophobicContact CB-CG 4.42Å; V452-Q523 VanDerWaalsContact O-CD 3.3Å; V452-Q523 PolarHBondContact O-NE2 3.48Å; V452-Q523 PolarHBondContact O-OE1 3.17Å
453	K	57.5	Low	60.1	Low	192 Å²	192	78.7 Å²	78.7	84%	0.835	41%	0.406	S	S	*	.			trans	-83.7	13.5	-176.3	-68.4	-173.4	178.3	-176.9	0	115.6	S451	S451-K453 PolarHBondContact O-N 2.75Å
454	G	55.6	Low	60	Low	47 Å²	47	80 Å²	80	49%	0.485	41%	0.407	S	S	.	.			trans	-168.2	141.1	175.6	0	0	0	0	0	113.6	V452	V452-G454 VanDerWaalsContact C-N 3.26Å; V452-G454 PolarHBondContact O-N 2.6Å
455	A	53	Low	60.2	Low	30 Å²	30	79.7 Å²	79.7	25%	0.248	40%	0.397	C	S	.	.			trans	-109.3	137	172	0	0	0	0	0	109.1	L516 L520	A455-L516 HydrophobicContact CB-CB 4.3Å; A455-L520 HydrophobicContact CB-CD1 4.23Å; A455-L520 HydrophobicContact CB-CD2 3.9Å; A455-L520 HydrophobicContact CB-CG 4.05Å
456	R	52.2	Low	59.9	Low	238 Å²	238	82 Å²	82	90%	0.898	42%	0.417	S	S	*	.			trans	-98.3	147.2	174.3	-67.7	-179	174.3	-171.9	-3.4	109.1	G458	R456-G458 PolarHBondContact O-N 3.04Å
457	A	48.9	Very low	59.6	Low	13 Å²	13	85.9 Å²	85.9	11%	0.107	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-70.9	29.1	-175.7	0	0	0	0	0	115	Y459 F460 L476 L516	A457-Y459 PolarHBondContact O-N 2.81Å; A457-F460 HydrophobicContact CB-CD2 4.35Å; A457-F460 PolarHBondContact O-N 2.99Å; A457-F460 VanDerWaalsContact O-N 3.1Å; A457-L476 HydrophobicContact CB-CD1 4.31Å; A457-L476 HydrophobicContact CB-CD2 4.36Å; A457-L476 HydrophobicContact CB-CG 4.04Å; A457-L516 HydrophobicContact CB-CD1 4.33Å
458	G	52.7	Low	59.4	Low	51 Å²	51	82.3 Å²	82.3	53%	0.526	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-63.2	-23.9	-178.5	0	0	0	0	0	114.1	R456 F460 K461	R456-G458 PolarHBondContact O-N 3.04Å; G458-F460 PolarHBondContact O-N 2.84Å; G458-K461 WeakPolarHBondContact O-CB 3.37Å; G458-K461 PolarHBondContact O-N 3.44Å
459	Y	62	Low	60.1	Low	91 Å²	91	82.3 Å²	82.3	36%	0.357	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-56.7	-36.1	171	179	-93.8	0	0	0	112.8	A457 K461 E556 I559 K560 I563	A457-Y459 PolarHBondContact O-N 2.81Å; Y459-K461 VanDerWaalsContact C-N 3.34Å; Y459-E556 HydrophobicContact CD2-CG 4.44Å; Y459-E556 HydrophobicContact CE2-CG 3.91Å; Y459-I559 HydrophobicContact CD1-CG2 4.31Å; Y459-I559 HydrophobicContact CG-CG2 4.26Å; Y459-K560 WeakPolarHBondContact OH-CE 3.17Å; Y459-I563 HydrophobicContact CE1-CD1 4.47Å
460	F	59.2	Low	60.2	Low	11 Å²	11	84.2 Å²	84.2	5%	0.048	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-91.8	10.6	177.7	-57.5	-74.9	0	0	0	113.3	A457 G458 N462 Q463 I471 A472 A475 F515 I563 L585	A457-F460 HydrophobicContact CB-CD2 4.35Å; A457-F460 PolarHBondContact O-N 2.99Å; A457-F460 VanDerWaalsContact O-N 3.1Å; G458-F460 PolarHBondContact O-N 2.84Å; F460-N462 PolarHBondContact O-N 2.83Å; F460-Q463 PolarHBondContact O-N 3.46Å; F460-I471 HydrophobicContact CB-CG2 4.46Å; F460-I471 HydrophobicContact CD1-CB 4.45Å; F460-I471 HydrophobicContact CD1-CG2 3.6Å; F460-I471 HydrophobicContact CE1-CG2 4.01Å; F460-I471 HydrophobicContact CG-CG2 4.19Å; F460-A472 HydrophobicContact CB-CB 3.81Å; F460-A475 HydrophobicContact CD2-CB 3.83Å; F460-A475 HydrophobicContact CE2-CB 3.75Å; F460-A475 HydrophobicContact CG-CB 4.46Å; F460-A475 HydrophobicContact CZ-CB 4.32Å; F460-F515 HydrophobicContact CE2-CE2 4.03Å; F460-F515 HydrophobicContact CZ-CE2 4.39Å; F460-I563 HydrophobicContact CE1-CD1 4.2Å; F460-I563 HydrophobicContact CE2-CD1 4.32Å; F460-I563 HydrophobicContact CZ-CD1 3.5Å; F460-I563 VanDerWaalsContact CZ-CD1 3.5Å; F460-I563 HydrophobicContact CZ-CG1 4.19Å; F460-L585 HydrophobicContact CE1-CD1 4.44Å; F460-L585 HydrophobicContact CZ-CD1 3.9Å
461	K	58.7	Low	60.5	Low	153 Å²	153	80.8 Å²	80.8	67%	0.665	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	135.1	-178	-170.9	-177.4	177.2	-168.9	0	109.1	G458 Y459 Q463	G458-K461 WeakPolarHBondContact O-CB 3.37Å; G458-K461 PolarHBondContact O-N 3.44Å; Y459-K461 VanDerWaalsContact C-N 3.34Å; K461-Q463 PolarHBondContact O-N 2.86Å; K461-Q463 VanDerWaalsContact O-N 3.13Å
462	N	60	Low	60.9	Low	148 Å²	148	79.7 Å²	79.7	79%	0.791	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	-11.6	-174.6	-53.1	-6.8	0	0	0	116.6	F460	F460-N462 PolarHBondContact O-N 2.83Å
463	Q	63.2	Low	61.6	Low	96 Å²	96	79.1 Å²	79.1	45%	0.449	43%	0.43	S	S	.	.			trans	-73.8	136.8	176.6	-67.7	-168.7	-21.7	0	0	112.2	F460 K461 I471	F460-Q463 PolarHBondContact O-N 3.46Å; K461-Q463 PolarHBondContact O-N 2.86Å; K461-Q463 VanDerWaalsContact O-N 3.13Å; Q463-I471 HydrophobicContact CB-CB 4.3Å; Q463-I471 HydrophobicContact CB-CD1 4.1Å; Q463-I471 HydrophobicContact CB-CG1 4.33Å; Q463-I471 PolarHBondContact O-N 2.65Å
464	K	67.2	Low	62.6	Low	114 Å²	114	71.5 Å²	71.5	50%	0.496	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-130.3	156.7	-179.6	-66.2	173.1	177.9	175	0	110.7	G468 T469	K464-G468 WeakPolarHBondContact CD-O 3.05Å; K464-G468 WeakPolarHBondContact CG-O 3.11Å; K464-T469 CarbonylContact C-O 3.59Å; K464-T469 WeakPolarHBondContact CA-O 3.28Å
465	Y	64.7	Low	63.7	Low	23 Å²	23	69.2 Å²	69.2	9%	0.09	38%	0.376	C	S	.	.			trans	-77.8	167.2	162.3	-66.3	-67.8	0	0	0	110.7	D467 G468 T469 I471 V474 L585 D587	Y465-D467 VanDerWaalsContact CB-OD1 3.28Å; Y465-D467 WeakPolarHBondContact CB-OD1 3.32Å; Y465-D467 PolarHBondContact O-N 3.42Å; Y465-D467 VanDerWaalsContact O-N 3.12Å; Y465-G468 WeakPolarHBondContact O-CA 3.25Å; Y465-G468 PolarHBondContact O-N 2.77Å; Y465-T469 HydrophobicContact CD2-CG2 4.13Å; Y465-T469 WeakPolarHBondContact CD2-O 3.47Å; Y465-T469 PolarHBondContact N-O 3.43Å; Y465-I471 HydrophobicContact CD1-CD1 4.23Å; Y465-I471 HydrophobicContact CD1-CG1 4.23Å; Y465-I471 HydrophobicContact CD2-CG1 3.97Å; Y465-I471 HydrophobicContact CE1-CD1 4.06Å; Y465-I471 HydrophobicContact CE1-CG1 4.09Å; Y465-I471 HydrophobicContact CE2-CB 4.4Å; Y465-I471 HydrophobicContact CE2-CG1 3.83Å; Y465-I471 HydrophobicContact CG-CG1 4.16Å; Y465-V474 HydrophobicContact CE2-CB 4.04Å; Y465-V474 HydrophobicContact CE2-CG1 4.2Å; Y465-V474 HydrophobicContact CE2-CG2 3.93Å; Y465-L585 VanDerWaalsContact CE1-O 3.25Å; Y465-L585 WeakPolarHBondContact CE1-O 3.16Å; Y465-L585 PolarHBondContact OH-O 3.49Å; Y465-D587 HydrophobicContact CD1-CB 3.76Å; Y465-D587 HydrophobicContact CE1-CB 3.89Å
466	P	54.4	Low	64.6	Low	119 Å²	119	71.6 Å²	71.6	77%	0.773	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.5	179.3	-26.6	36.4	0	0	0	115.5	G468	P466-G468 PolarHBondContact O-N 2.88Å
467	D	62.9	Low	65.8	Low	104 Å²	104	66 Å²	66	56%	0.556	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-0.1	172.6	75.8	-27.3	0	0	0	113.5	Y465 T469	Y465-D467 VanDerWaalsContact CB-OD1 3.28Å; Y465-D467 WeakPolarHBondContact CB-OD1 3.32Å; Y465-D467 PolarHBondContact O-N 3.42Å; Y465-D467 VanDerWaalsContact O-N 3.12Å; D467-T469 VanDerWaalsContact CG-OG1 3.27Å; D467-T469 WeakPolarHBondContact OD1-CB 3.41Å; D467-T469 PolarHBondContact OD1-N 2.78Å; D467-T469 PolarHBondContact OD1-OG1 3.04Å; D467-T469 WeakPolarHBondContact OD2-CB 3.46Å; D467-T469 PolarHBondContact OD2-OG1 3.09Å
468	G	64.5	Low	67.2	Low	36 Å²	36	66.1 Å²	66.1	37%	0.371	36%	0.362	S	S	.	.	S	Bend	trans	85.9	-5	-174.7	0	0	0	0	0	115.2	K464 Y465 P466 P470	K464-G468 WeakPolarHBondContact CD-O 3.05Å; K464-G468 WeakPolarHBondContact CG-O 3.11Å; Y465-G468 WeakPolarHBondContact O-CA 3.25Å; Y465-G468 PolarHBondContact O-N 2.77Å; P466-G468 PolarHBondContact O-N 2.88Å; G468-P470 WeakPolarHBondContact O-CD 3.45Å
469	T	69.7	Low	68.5	Low	47 Å²	47	63.7 Å²	63.7	29%	0.288	34%	0.337	S	S	.	.			trans	-65.5	123	-177.3	-71	0	0	0	0	111.1	K464 Y465 D467 I471 V474	K464-T469 CarbonylContact C-O 3.59Å; K464-T469 WeakPolarHBondContact CA-O 3.28Å; Y465-T469 HydrophobicContact CD2-CG2 4.13Å; Y465-T469 WeakPolarHBondContact CD2-O 3.47Å; Y465-T469 PolarHBondContact N-O 3.43Å; D467-T469 VanDerWaalsContact CG-OG1 3.27Å; D467-T469 WeakPolarHBondContact OD1-CB 3.41Å; D467-T469 PolarHBondContact OD1-N 2.78Å; D467-T469 PolarHBondContact OD1-OG1 3.04Å; D467-T469 WeakPolarHBondContact OD2-CB 3.46Å; D467-T469 PolarHBondContact OD2-OG1 3.09Å; T469-I471 PolarHBondContact O-N 3.3Å; T469-V474 HydrophobicContact CG2-CG2 3.64Å
470	P	68.3	Low	69.3	Low	65 Å²	65	65.8 Å²	65.8	42%	0.422	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-65.3	122.7	-179.3	-23.9	34.9	0	0	0	113.2	G468 A472 A473 V474	G468-P470 WeakPolarHBondContact O-CD 3.45Å; P470-A472 VanDerWaalsContact C-N 3.27Å; P470-A472 PolarHBondContact O-N 2.98Å; P470-A473 HydrophobicContact CB-CB 4.39Å; P470-A473 PolarHBondContact O-N 2.93Å; P470-V474 PolarHBondContact O-N 3.46Å
471	I	76.5	Confident	70.1	Confident	23 Å²	23	66.2 Å²	66.2	12%	0.118	35%	0.352	C	S	.	.	H	α-helix	trans	-60.4	-38.8	-178.2	-59.2	-172.3	0	0	0	110.4	F460 Q463 Y465 T469 A473 V474 A475	F460-I471 HydrophobicContact CB-CG2 4.46Å; F460-I471 HydrophobicContact CD1-CB 4.45Å; F460-I471 HydrophobicContact CD1-CG2 3.6Å; F460-I471 HydrophobicContact CE1-CG2 4.01Å; F460-I471 HydrophobicContact CG-CG2 4.19Å; Q463-I471 HydrophobicContact CB-CB 4.3Å; Q463-I471 HydrophobicContact CB-CD1 4.1Å; Q463-I471 HydrophobicContact CB-CG1 4.33Å; Q463-I471 PolarHBondContact O-N 2.65Å; Y465-I471 HydrophobicContact CD1-CD1 4.23Å; Y465-I471 HydrophobicContact CD1-CG1 4.23Å; Y465-I471 HydrophobicContact CD2-CG1 3.97Å; Y465-I471 HydrophobicContact CE1-CD1 4.06Å; Y465-I471 HydrophobicContact CE1-CG1 4.09Å; Y465-I471 HydrophobicContact CE2-CB 4.4Å; Y465-I471 HydrophobicContact CE2-CG1 3.83Å; Y465-I471 HydrophobicContact CG-CG1 4.16Å; T469-I471 PolarHBondContact O-N 3.3Å; I471-A473 VanDerWaalsContact C-N 3.26Å; I471-A473 PolarHBondContact O-N 2.82Å; I471-V474 PolarHBondContact O-N 3.18Å; I471-V474 VanDerWaalsContact O-N 3.08Å; I471-A475 VanDerWaalsContact O-CB 3.29Å; I471-A475 WeakPolarHBondContact O-CB 3.1Å; I471-A475 PolarHBondContact O-N 3.1Å
472	A	70.8	Confident	71.2	Confident	23 Å²	23	61.4 Å²	61.4	19%	0.19	33%	0.334	C	S	.	.	H	α-helix	trans	-54.7	-36.7	176	0	0	0	0	0	113.9	F460 P470 L476	F460-A472 HydrophobicContact CB-CB 3.81Å; P470-A472 VanDerWaalsContact C-N 3.27Å; P470-A472 PolarHBondContact O-N 2.98Å; A472-L476 WeakPolarHBondContact O-CG 3.3Å; A472-L476 PolarHBondContact O-N 3.27Å
473	A	72.4	Confident	72	Confident	38 Å²	38	59.4 Å²	59.4	31%	0.314	32%	0.322	S	S	.	.	H	α-helix	trans	-80.4	-21.4	-179.3	0	0	0	0	0	113.3	P470 I471 R477	P470-A473 HydrophobicContact CB-CB 4.39Å; P470-A473 PolarHBondContact O-N 2.93Å; I471-A473 VanDerWaalsContact C-N 3.26Å; I471-A473 PolarHBondContact O-N 2.82Å; A473-R477 PolarHBondContact O-NE 2.85Å; A473-R477 VanDerWaalsContact O-NE 3.11Å
474	V	77.5	Confident	72.7	Confident	31 Å²	31	57.1 Å²	57.1	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-84.4	-39.2	171.1	176.8	0	0	0	0	110.3	Y465 T469 P470 I471 R477 N478 L585	Y465-V474 HydrophobicContact CE2-CB 4.04Å; Y465-V474 HydrophobicContact CE2-CG1 4.2Å; Y465-V474 HydrophobicContact CE2-CG2 3.93Å; T469-V474 HydrophobicContact CG2-CG2 3.64Å; P470-V474 PolarHBondContact O-N 3.46Å; I471-V474 PolarHBondContact O-N 3.18Å; I471-V474 VanDerWaalsContact O-N 3.08Å; V474-R477 PolarHBondContact O-N 3.27Å; V474-N478 PolarHBondContact O-N 2.98Å; V474-N478 PolarHBondContact O-ND2 3.46Å; V474-L585 HydrophobicContact CG1-CD2 4.19Å
475	A	78	Confident	73.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57.1	-52.3	173	0	0	0	0	0	111.3	F460 I471 R477 N478 E479 F515 L585	F460-A475 HydrophobicContact CD2-CB 3.83Å; F460-A475 HydrophobicContact CE2-CB 3.75Å; F460-A475 HydrophobicContact CG-CB 4.46Å; F460-A475 HydrophobicContact CZ-CB 4.32Å; I471-A475 VanDerWaalsContact O-CB 3.29Å; I471-A475 WeakPolarHBondContact O-CB 3.1Å; I471-A475 PolarHBondContact O-N 3.1Å; A475-R477 PolarHBondContact O-N 3.12Å; A475-N478 PolarHBondContact O-N 2.71Å; A475-N478 VanDerWaalsContact O-N 3.17Å; A475-E479 WeakPolarHBondContact O-CB 3.37Å; A475-E479 PolarHBondContact O-N 3.1Å; A475-F515 HydrophobicContact CB-CE2 4.39Å; A475-F515 HydrophobicContact CB-CZ 3.88Å; A475-F515 WeakPolarHBondContact O-CZ 3.2Å; A475-L585 HydrophobicContact CB-CD1 4.2Å; A475-L585 HydrophobicContact CB-CD2 4.44Å
476	L	73	Confident	73.7	Confident	79 Å²	79	57.1 Å²	57.1	41%	0.414	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-40.8	178.8	-81.2	165.1	0	0	0	113.6	A457 A472 E479 Y480	A457-L476 HydrophobicContact CB-CD1 4.31Å; A457-L476 HydrophobicContact CB-CD2 4.36Å; A457-L476 HydrophobicContact CB-CG 4.04Å; A472-L476 WeakPolarHBondContact O-CG 3.3Å; A472-L476 PolarHBondContact O-N 3.27Å; L476-E479 PolarHBondContact O-N 3.25Å; L476-Y480 HydrophobicContact CD2-CD2 4.46Å; L476-Y480 HydrophobicContact CD2-CE2 4.12Å; L476-Y480 PolarHBondContact O-N 2.87Å
477	R	77	Confident	74.8	Confident	122 Å²	122	54.6 Å²	54.6	46%	0.46	30%	0.3	S	S	.	.	H	α-helix	trans	-70.6	-28.7	177.1	-82.1	-177.2	-78.2	-167.4	-2.3	113.4	A473 V474 A475 G481 D482	A473-R477 PolarHBondContact O-NE 2.85Å; A473-R477 VanDerWaalsContact O-NE 3.11Å; V474-R477 PolarHBondContact O-N 3.27Å; A475-R477 PolarHBondContact O-N 3.12Å; R477-G481 CarbonylContact O-C 3.51Å; R477-G481 VanDerWaalsContact O-CA 3.22Å; R477-G481 WeakPolarHBondContact O-CA 3.46Å; R477-G481 PolarHBondContact O-N 3.02Å; R477-D482 WeakPolarHBondContact CD-OD2 3.24Å; R477-D482 HydrophobicContact CG-CB 4.47Å
478	N	79.6	Confident	75.4	Confident	15 Å²	15	51.3 Å²	51.3	8%	0.08	29%	0.285	C	S	.	.	H	α-helix	trans	-74.9	-44.2	170	-79.4	-86.8	0	0	0	111.5	V474 A475 Y480 P512 R513 F515 T584 L585	V474-N478 PolarHBondContact O-N 2.98Å; V474-N478 PolarHBondContact O-ND2 3.46Å; A475-N478 PolarHBondContact O-N 2.71Å; A475-N478 VanDerWaalsContact O-N 3.17Å; N478-Y480 VanDerWaalsContact C-N 3.33Å; N478-Y480 PolarHBondContact O-N 3.36Å; N478-P512 CarbonylContact O-C 3.53Å; N478-P512 WeakPolarHBondContact O-CA 3.26Å; N478-R513 PolarHBondContact O-N 3.09Å; N478-R513 PolarHBondContact OD1-NH1 3.43Å; N478-F515 HydrophobicContact CB-CE1 4.22Å; N478-T584 HydrophobicContact CB-CG2 4.06Å; N478-T584 VanDerWaalsContact OD1-CG2 3.23Å; N478-T584 WeakPolarHBondContact OD1-CG2 3.33Å; N478-L585 HydrophobicContact CB-CD2 4.39Å
479	E	78.1	Confident	75.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-53.8	-46.6	-179	174.3	57.6	-137.4	0	0	112.4	A475 L476 R513 P514 F515 L516 R517	A475-E479 WeakPolarHBondContact O-CB 3.37Å; A475-E479 PolarHBondContact O-N 3.1Å; L476-E479 PolarHBondContact O-N 3.25Å; E479-R513 WeakPolarHBondContact CA-O 3.1Å; E479-P514 WeakPolarHBondContact OE1-CA 3.4Å; E479-P514 WeakPolarHBondContact OE2-CA 3.37Å; E479-F515 HydrophobicContact CB-CE1 4.19Å; E479-F515 HydrophobicContact CB-CZ 4.17Å; E479-F515 PolarHBondContact OE2-N 2.9Å; E479-L516 HydrophobicContact CG-CB 4.42Å; E479-L516 PolarHBondContact OE2-N 3.07Å; E479-R517 PolarHBondContact O-NH2 3.11Å; E479-R517 WeakPolarHBondContact OE1-CG 3.38Å; E479-R517 IonicContact OE1-CZ 3.21Å; E479-R517 IonicContact OE1-NE 2.76Å; E479-R517 PolarHBondContact OE1-NE 3.04Å; E479-R517 IonicContact OE1-NH2 2.76Å; E479-R517 PolarHBondContact OE1-NH2 2.95Å
480	Y	79	Confident	76	Confident	135 Å²	135	55.8 Å²	55.8	53%	0.529	29%	0.294	S	S	.	.	H	α-helix	trans	-102	-15.3	-175.5	-66.1	-78	0	0	0	114.9	L476 N478	L476-Y480 HydrophobicContact CD2-CD2 4.46Å; L476-Y480 HydrophobicContact CD2-CE2 4.12Å; L476-Y480 PolarHBondContact O-N 2.87Å; N478-Y480 VanDerWaalsContact C-N 3.33Å; N478-Y480 PolarHBondContact O-N 3.36Å
481	G	77.6	Confident	76.7	Confident	20 Å²	20	55 Å²	55	21%	0.206	28%	0.283	C	S	.	.			trans	76.7	168.7	-168	0	0	0	0	0	112.3	R477 I510	R477-G481 CarbonylContact O-C 3.51Å; R477-G481 VanDerWaalsContact O-CA 3.22Å; R477-G481 WeakPolarHBondContact O-CA 3.46Å; R477-G481 PolarHBondContact O-N 3.02Å; G481-I510 VanDerWaalsContact CA-O 3.32Å; G481-I510 WeakPolarHBondContact CA-O 3.38Å
482	D	81.7	Confident	76.7	Confident	51 Å²	51	60.8 Å²	60.8	27%	0.273	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	158.7	-174.5	-160.9	-4.7	0	0	0	111.2	R477 I510	R477-D482 WeakPolarHBondContact CD-OD2 3.24Å; R477-D482 HydrophobicContact CG-CB 4.47Å; D482-I510 HydrophobicContact CB-CB 4.02Å; D482-I510 HydrophobicContact CB-CD1 4.11Å; D482-I510 HydrophobicContact CB-CG1 4.26Å; D482-I510 PolarHBondContact N-O 3.45Å; D482-I510 PolarHBondContact O-N 3.45Å
483	I	76.9	Confident	76.6	Confident	106 Å²	106	67 Å²	67	54%	0.544	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	93.7	174.6	-56.2	-179.3	0	0	0	108.7	T507 R509	I483-T507 HydrophobicContact CG2-CG2 4.21Å; I483-R509 HydrophobicContact CG1-CG 4.37Å
484	V	76.4	Confident	76.6	Confident	48 Å²	48	68 Å²	68	29%	0.291	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	124.6	-177.6	-175.6	0	0	0	0	109.4	L490 L508 I510	V484-L490 HydrophobicContact CG1-CD2 3.9Å; V484-L508 PolarHBondContact N-O 2.85Å; V484-L508 PolarHBondContact O-N 3.42Å; V484-I510 HydrophobicContact CG2-CD1 4.25Å
485	Q	78.4	Confident	76.7	Confident	124 Å²	124	71.8 Å²	71.8	58%	0.579	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	135.3	169.9	-67.5	-68.2	-9.9	0	0	110	T487 T506 T507	Q485-T487 VanDerWaalsContact C-N 3.3Å; Q485-T487 PolarHBondContact O-N 2.83Å; Q485-T506 PolarHBondContact OE1-O 2.6Å; Q485-T507 VanDerWaalsContact OE1-CG2 3.28Å
486	V	74	Confident	76.2	Confident	13 Å²	13	76.4 Å²	76.4	8%	0.079	38%	0.375	C	S	.	.			trans	-77.2	83.4	176.7	-178.1	0	0	0	0	108.7	R491 L501 V505 T506 L508	V486-R491 HydrophobicContact CG1-CB 4.07Å; V486-L501 HydrophobicContact CG1-CD1 3.6Å; V486-L501 HydrophobicContact CG2-CD1 4.06Å; V486-V505 HydrophobicContact CG2-CG1 4.43Å; V486-T506 WeakPolarHBondContact CB-O 3.33Å; V486-T506 WeakPolarHBondContact CG2-O 3.44Å; V486-T506 PolarHBondContact N-O 2.86Å; V486-L508 HydrophobicContact CG2-CD1 3.96Å; V486-L508 HydrophobicContact CG2-CG 3.68Å
487	T	78.8	Confident	75.6	Confident	66 Å²	66	75.7 Å²	75.7	41%	0.405	37%	0.374	S	S	.	.			trans	-55.9	138	160.3	72.8	0	0	0	0	107.4	Q485 E489 L490 R491	Q485-T487 VanDerWaalsContact C-N 3.3Å; Q485-T487 PolarHBondContact O-N 2.83Å; T487-E489 PolarHBondContact O-N 3.17Å; T487-L490 WeakPolarHBondContact O-CA 3.44Å; T487-L490 WeakPolarHBondContact O-CB 3.27Å; T487-L490 PolarHBondContact O-N 3.31Å; T487-L490 WeakPolarHBondContact OG1-CB 3.11Å; T487-L490 PolarHBondContact OG1-N 3.27Å; T487-R491 PolarHBondContact O-N 3.17Å
488	P	74.9	Confident	75.1	Confident	36 Å²	36	71.6 Å²	71.6	23%	0.234	37%	0.37	C	S	.	.	H	α-helix	trans	-75.3	-0.6	-179.2	-20	34.7	0	0	0	113.8	R491 K492 K1336	P488-R491 HydrophobicContact CB-CB 4.34Å; P488-K492 PolarHBondContact O-N 3.15Å; P488-K492 VanDerWaalsContact O-N 3.12Å; P488-K1336 HydrophobicContact CB-CB 3.48Å; P488-K1336 VanDerWaalsContact CB-CB 3.48Å; P488-K1336 HydrophobicContact CB-CD 3.99Å; P488-K1336 HydrophobicContact CB-CG 3.68Å; P488-K1336 HydrophobicContact CG-CB 3.52Å; P488-K1336 HydrophobicContact CG-CD 4.34Å; P488-K1336 HydrophobicContact CG-CG 4.21Å
489	E	74.6	Confident	74.6	Confident	126 Å²	126	73.8 Å²	73.8	59%	0.589	38%	0.38	S	S	*	.	H	α-helix	trans	-64.9	-50.4	152.8	-75.1	-143.6	135.8	0	0	112.6	T487 R491 K492 K493	T487-E489 PolarHBondContact O-N 3.17Å; E489-R491 PolarHBondContact O-N 2.68Å; E489-K492 WeakPolarHBondContact O-CA 2.96Å; E489-K492 WeakPolarHBondContact O-CB 3.41Å; E489-K492 PolarHBondContact O-N 3.36Å; E489-K493 PolarHBondContact O-N 2.85Å
490	L	72	Confident	74.6	Confident	51 Å²	51	77.9 Å²	77.9	27%	0.267	41%	0.407	S	S	.	.	H	α-helix	trans	-57.1	-39.3	174.1	-162	71.7	0	0	0	110.1	V484 T487 K493 F494 L508	V484-L490 HydrophobicContact CG1-CD2 3.9Å; T487-L490 WeakPolarHBondContact O-CA 3.44Å; T487-L490 WeakPolarHBondContact O-CB 3.27Å; T487-L490 PolarHBondContact O-N 3.31Å; T487-L490 WeakPolarHBondContact OG1-CB 3.11Å; T487-L490 PolarHBondContact OG1-N 3.27Å; L490-K493 PolarHBondContact O-N 3.07Å; L490-F494 HydrophobicContact CD1-CE2 4.32Å; L490-F494 HydrophobicContact CD2-CE2 4.15Å; L490-F494 HydrophobicContact CG-CD2 3.96Å; L490-F494 HydrophobicContact CG-CE2 3.85Å; L490-F494 VanDerWaalsContact O-CD2 3.28Å; L490-F494 WeakPolarHBondContact O-CD2 3.4Å; L490-F494 PolarHBondContact O-N 3.13Å; L490-L508 HydrophobicContact CD2-CD1 3.9Å
491	R	82.9	Confident	74.4	Confident	47 Å²	47	72.9 Å²	72.9	18%	0.177	39%	0.389	C	S	.	.	H	α-helix	trans	-58.8	-47.2	171.5	-167.1	-178.9	-56.4	-90.9	-5	112.3	V486 T487 P488 E489 K493 F494 E495 L501 K502 V505	V486-R491 HydrophobicContact CG1-CB 4.07Å; T487-R491 PolarHBondContact O-N 3.17Å; P488-R491 HydrophobicContact CB-CB 4.34Å; E489-R491 PolarHBondContact O-N 2.68Å; R491-K493 PolarHBondContact O-N 3.44Å; R491-F494 PolarHBondContact O-N 2.67Å; R491-E495 VanDerWaalsContact O-CB 3.3Å; R491-E495 WeakPolarHBondContact O-CB 3.13Å; R491-E495 PolarHBondContact O-N 3.04Å; R491-L501 HydrophobicContact CG-CB 4.34Å; R491-L501 HydrophobicContact CG-CD1 4.49Å; R491-L501 PolarHBondContact NH1-O 2.75Å; R491-K502 PolarHBondContact NH1-O 2.77Å; R491-V505 PolarHBondContact NH2-O 3.28Å
492	K	76.9	Confident	74.4	Confident	145 Å²	145	80.3 Å²	80.3	63%	0.63	42%	0.416	S	S	*	.	H	α-helix	trans	-59.7	-43.3	174.6	-81.1	-171.4	176.8	-176.4	0	112	P488 E489 E495 S496	P488-K492 PolarHBondContact O-N 3.15Å; P488-K492 VanDerWaalsContact O-N 3.12Å; E489-K492 WeakPolarHBondContact O-CA 2.96Å; E489-K492 WeakPolarHBondContact O-CB 3.41Å; E489-K492 PolarHBondContact O-N 3.36Å; K492-E495 PolarHBondContact O-N 3.39Å; K492-S496 WeakPolarHBondContact O-CB 3.49Å; K492-S496 PolarHBondContact O-N 3.32Å; K492-S496 PolarHBondContact O-OG 3.43Å
493	K	68.6	Low	74	Confident	155 Å²	155	87.4 Å²	87.4	67%	0.674	44%	0.444	S	S	*	.	H	α-helix	trans	-61.8	-43.7	175.3	-87.1	-173.1	172.7	-179.8	0	112.3	E489 L490 R491 E495 S496 V497	E489-K493 PolarHBondContact O-N 2.85Å; L490-K493 PolarHBondContact O-N 3.07Å; R491-K493 PolarHBondContact O-N 3.44Å; K493-E495 VanDerWaalsContact C-N 3.33Å; K493-E495 PolarHBondContact O-N 3.12Å; K493-S496 PolarHBondContact O-N 3.05Å; K493-S496 PolarHBondContact O-OG 3.01Å; K493-V497 WeakPolarHBondContact O-CG2 3.14Å; K493-V497 PolarHBondContact O-N 3.07Å; K493-V497 VanDerWaalsContact O-N 3.13Å
494	F	73.6	Confident	74	Confident	59 Å²	59	85.7 Å²	85.7	26%	0.259	45%	0.452	S	S	.	.	H	α-helix	trans	-62.6	-39.6	173.9	-90.3	-71.6	0	0	0	112.1	L490 R491 V497 G498 M499 L501 L508	L490-F494 HydrophobicContact CD1-CE2 4.32Å; L490-F494 HydrophobicContact CD2-CE2 4.15Å; L490-F494 HydrophobicContact CG-CD2 3.96Å; L490-F494 HydrophobicContact CG-CE2 3.85Å; L490-F494 VanDerWaalsContact O-CD2 3.28Å; L490-F494 WeakPolarHBondContact O-CD2 3.4Å; L490-F494 PolarHBondContact O-N 3.13Å; R491-F494 PolarHBondContact O-N 2.67Å; F494-V497 WeakPolarHBondContact O-CG2 3.32Å; F494-G498 PolarHBondContact O-N 3.47Å; F494-M499 HydrophobicContact CD1-CB 4.05Å; F494-M499 CarbonylContact O-C 3.59Å; F494-M499 VanDerWaalsContact O-CA 3.31Å; F494-M499 WeakPolarHBondContact O-CA 3.43Å; F494-M499 WeakPolarHBondContact O-CB 3.37Å; F494-M499 PolarHBondContact O-N 3.03Å; F494-L501 HydrophobicContact CB-CD1 4.25Å; F494-L501 HydrophobicContact CB-CD2 4.47Å; F494-L501 HydrophobicContact CB-CG 3.98Å; F494-L501 HydrophobicContact CD1-CD2 4.4Å; F494-L501 HydrophobicContact CD2-CD1 3.87Å; F494-L501 HydrophobicContact CD2-CD2 4.5Å; F494-L501 HydrophobicContact CD2-CG 4.33Å; F494-L501 HydrophobicContact CG-CD1 4.17Å; F494-L501 HydrophobicContact CG-CD2 4.21Å; F494-L501 HydrophobicContact CG-CG 4.12Å; F494-L508 HydrophobicContact CD2-CD1 4.13Å; F494-L508 HydrophobicContact CE2-CD1 3.35Å; F494-L508 HydrophobicContact CZ-CD1 3.82Å
495	E	78.1	Confident	74	Confident	109 Å²	109	85.7 Å²	85.7	51%	0.509	45%	0.452	S	S	.	.	H	α-helix	trans	-69	-41.7	178.4	-165	153.7	-118.1	0	0	112.1	R491 K492 K493 V497 G498 P500	R491-E495 VanDerWaalsContact O-CB 3.3Å; R491-E495 WeakPolarHBondContact O-CB 3.13Å; R491-E495 PolarHBondContact O-N 3.04Å; K492-E495 PolarHBondContact O-N 3.39Å; K493-E495 VanDerWaalsContact C-N 3.33Å; K493-E495 PolarHBondContact O-N 3.12Å; E495-V497 PolarHBondContact O-N 2.94Å; E495-G498 WeakPolarHBondContact O-CA 3.27Å; E495-G498 PolarHBondContact O-N 3.46Å; E495-P500 HydrophobicContact CG-CB 4.29Å
496	S	67.2	Low	74	Confident	98 Å²	98	84.1 Å²	84.1	69%	0.685	45%	0.452	S	S	*	.	H	α-helix	trans	-68.3	-30.2	177	64.7	0	0	0	0	113.6	K492 K493 G498	K492-S496 WeakPolarHBondContact O-CB 3.49Å; K492-S496 PolarHBondContact O-N 3.32Å; K492-S496 PolarHBondContact O-OG 3.43Å; K493-S496 PolarHBondContact O-N 3.05Å; K493-S496 PolarHBondContact O-OG 3.01Å; S496-G498 PolarHBondContact O-N 3.17Å
497	V	61	Low	74	Confident	64 Å²	64	86.5 Å²	86.5	39%	0.388	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	12	169.3	-53.3	0	0	0	0	113.2	K493 F494 E495 M499 R574	K493-V497 WeakPolarHBondContact O-CG2 3.14Å; K493-V497 PolarHBondContact O-N 3.07Å; K493-V497 VanDerWaalsContact O-N 3.13Å; F494-V497 WeakPolarHBondContact O-CG2 3.32Å; E495-V497 PolarHBondContact O-N 2.94Å; V497-M499 HydrophobicContact CG2-CB 4.5Å; V497-M499 HydrophobicContact CG2-CG 4.41Å; V497-R574 PolarHBondContact O-NE 3.4Å; V497-R574 PolarHBondContact O-NH2 2.82Å
498	G	66.4	Low	73.8	Confident	36 Å²	36	85.4 Å²	85.4	37%	0.371	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	32.1	173.9	0	0	0	0	0	114.9	F494 E495 S496 P500 R574	F494-G498 PolarHBondContact O-N 3.47Å; E495-G498 WeakPolarHBondContact O-CA 3.27Å; E495-G498 PolarHBondContact O-N 3.46Å; S496-G498 PolarHBondContact O-N 3.17Å; G498-P500 VanDerWaalsContact C-CD 3.44Å; G498-R574 VanDerWaalsContact O-CZ 3.3Å; G498-R574 PolarHBondContact O-NH1 3.28Å; G498-R574 PolarHBondContact O-NH2 3.44Å
499	M	70.4	Confident	73.9	Confident	61 Å²	61	92.5 Å²	92.5	30%	0.3	48%	0.48	S	S	.	.			trans	-126.2	59.2	177.3	-64.3	-174.8	70	0	0	111.6	F494 V497 L501 R574	F494-M499 HydrophobicContact CD1-CB 4.05Å; F494-M499 CarbonylContact O-C 3.59Å; F494-M499 VanDerWaalsContact O-CA 3.31Å; F494-M499 WeakPolarHBondContact O-CA 3.43Å; F494-M499 WeakPolarHBondContact O-CB 3.37Å; F494-M499 PolarHBondContact O-N 3.03Å; V497-M499 HydrophobicContact CG2-CB 4.5Å; V497-M499 HydrophobicContact CG2-CG 4.41Å; M499-L501 PolarHBondContact O-N 3.25Å; M499-L501 VanDerWaalsContact O-N 3.1Å; M499-R574 HydrophobicContact CE-CB 4.32Å; M499-R574 VanDerWaalsContact CG-CD 3.49Å; M499-R574 HydrophobicContact CG-CG 4.26Å; M499-R574 HydrophobicContact SD-CB 4.07Å; M499-R574 VanDerWaalsContact SD-CD 3.58Å; M499-R574 HydrophobicContact SD-CG 3.67Å
500	P	77.5	Confident	73.9	Confident	85 Å²	85	89.3 Å²	89.3	55%	0.552	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-58.3	116.4	-174.9	24.3	-34.7	0	0	0	112.2	E495 G498 K502	E495-P500 HydrophobicContact CG-CB 4.29Å; G498-P500 VanDerWaalsContact C-CD 3.44Å; P500-K502 PolarHBondContact O-N 2.89Å
501	L	74.4	Confident	74.1	Confident	30 Å²	30	89 Å²	89	16%	0.157	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-69.6	124.4	178.7	-60.9	177.8	0	0	0	110.2	V486 R491 F494 M499 K503 L508	V486-L501 HydrophobicContact CG1-CD1 3.6Å; V486-L501 HydrophobicContact CG2-CD1 4.06Å; R491-L501 HydrophobicContact CG-CB 4.34Å; R491-L501 HydrophobicContact CG-CD1 4.49Å; R491-L501 PolarHBondContact NH1-O 2.75Å; F494-L501 HydrophobicContact CB-CD1 4.25Å; F494-L501 HydrophobicContact CB-CD2 4.47Å; F494-L501 HydrophobicContact CB-CG 3.98Å; F494-L501 HydrophobicContact CD1-CD2 4.4Å; F494-L501 HydrophobicContact CD2-CD1 3.87Å; F494-L501 HydrophobicContact CD2-CD2 4.5Å; F494-L501 HydrophobicContact CD2-CG 4.33Å; F494-L501 HydrophobicContact CG-CD1 4.17Å; F494-L501 HydrophobicContact CG-CD2 4.21Å; F494-L501 HydrophobicContact CG-CG 4.12Å; M499-L501 PolarHBondContact O-N 3.25Å; M499-L501 VanDerWaalsContact O-N 3.1Å; L501-K503 PolarHBondContact O-N 2.95Å; L501-L508 HydrophobicContact CD1-CD1 4.28Å; L501-L508 HydrophobicContact CD2-CD2 4.12Å
502	K	78.1	Confident	74	Confident	176 Å²	176	89.2 Å²	89.2	77%	0.765	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-48.4	136.8	176.1	-172.7	177.5	-177.5	-179.5	0	110.2	R491 P500 G504 V505	R491-K502 PolarHBondContact NH1-O 2.77Å; P500-K502 PolarHBondContact O-N 2.89Å; K502-G504 PolarHBondContact O-N 3.12Å; K502-V505 HydrophobicContact CB-CG2 4.12Å; K502-V505 WeakPolarHBondContact O-CB 3.35Å; K502-V505 PolarHBondContact O-N 2.96Å
503	K	73.3	Confident	74.1	Confident	201 Å²	201	83.4 Å²	83.4	87%	0.874	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-30.3	-162.8	-162.6	172.5	-177.3	178.6	0	115.3	L501	L501-K503 PolarHBondContact O-N 2.95Å
504	G	77.6	Confident	74.5	Confident	69 Å²	69	78.1 Å²	78.1	71%	0.711	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	3.8	177.7	0	0	0	0	0	116.6	K502 T506	K502-G504 PolarHBondContact O-N 3.12Å; G504-T506 PolarHBondContact O-N 2.8Å
505	V	74.4	Confident	74.6	Confident	48 Å²	48	75.8 Å²	75.8	29%	0.291	42%	0.42	S	S	.	.			trans	-80.2	112	175.2	178.6	0	0	0	0	108.9	V486 R491 K502 T507 L508	V486-V505 HydrophobicContact CG2-CG1 4.43Å; R491-V505 PolarHBondContact NH2-O 3.28Å; K502-V505 HydrophobicContact CB-CG2 4.12Å; K502-V505 WeakPolarHBondContact O-CB 3.35Å; K502-V505 PolarHBondContact O-N 2.96Å; V505-T507 WeakPolarHBondContact CG1-O 3.5Å; V505-L508 HydrophobicContact CG1-CD2 4.46Å
506	T	80.1	Confident	74.4	Confident	92 Å²	92	71 Å²	71	56%	0.564	40%	0.398	S	S	*	.			trans	-103.7	-22.1	178.3	50	0	0	0	0	113.5	Q485 V486 G504	Q485-T506 PolarHBondContact OE1-O 2.6Å; V486-T506 WeakPolarHBondContact CB-O 3.33Å; V486-T506 WeakPolarHBondContact CG2-O 3.44Å; V486-T506 PolarHBondContact N-O 2.86Å; G504-T506 PolarHBondContact O-N 2.8Å
507	T	73.8	Confident	74.8	Confident	62 Å²	62	72 Å²	72	38%	0.38	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147	177.6	48.2	0	0	0	0	111.8	I483 Q485 V505	I483-T507 HydrophobicContact CG2-CG2 4.21Å; Q485-T507 VanDerWaalsContact OE1-CG2 3.28Å; V505-T507 WeakPolarHBondContact CG1-O 3.5Å
508	L	73.2	Confident	75.6	Confident	44 Å²	44	74.2 Å²	74.2	23%	0.23	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.6	168.8	-69.5	167.9	0	0	0	108.6	V484 V486 L490 F494 L501 V505	V484-L508 PolarHBondContact N-O 2.85Å; V484-L508 PolarHBondContact O-N 3.42Å; V486-L508 HydrophobicContact CG2-CD1 3.96Å; V486-L508 HydrophobicContact CG2-CG 3.68Å; L490-L508 HydrophobicContact CD2-CD1 3.9Å; F494-L508 HydrophobicContact CD2-CD1 4.13Å; F494-L508 HydrophobicContact CE2-CD1 3.35Å; F494-L508 HydrophobicContact CZ-CD1 3.82Å; L501-L508 HydrophobicContact CD1-CD1 4.28Å; L501-L508 HydrophobicContact CD2-CD2 4.12Å; V505-L508 HydrophobicContact CG1-CD2 4.46Å
509	R	78.1	Confident	76.1	Confident	185 Å²	185	72.7 Å²	72.7	70%	0.698	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	113.7	-179.7	-174.9	171.7	-173.9	-105.3	1.6	110	I483	I483-R509 HydrophobicContact CG1-CG 4.37Å
510	I	75.4	Confident	76.3	Confident	58 Å²	58	70.8 Å²	70.8	30%	0.297	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	118.6	170.1	-56	-175	0	0	0	107.2	G481 D482 V484	G481-I510 VanDerWaalsContact CA-O 3.32Å; G481-I510 WeakPolarHBondContact CA-O 3.38Å; D482-I510 HydrophobicContact CB-CB 4.02Å; D482-I510 HydrophobicContact CB-CD1 4.11Å; D482-I510 HydrophobicContact CB-CG1 4.26Å; D482-I510 PolarHBondContact N-O 3.45Å; D482-I510 PolarHBondContact O-N 3.45Å; V484-I510 HydrophobicContact CG2-CD1 4.25Å
511	P	75.6	Confident	76.3	Confident	44 Å²	44	69.6 Å²	69.6	29%	0.286	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-72.1	144.8	179.5	29.9	-34.2	0	0	0	111.3	P569	P511-P569 HydrophobicContact CB-CG 3.67Å; P511-P569 HydrophobicContact CG-CG 3.37Å
512	P	80.2	Confident	76.7	Confident	53 Å²	53	70.9 Å²	70.9	34%	0.344	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-66.8	145	173.9	28	-34.6	0	0	0	112	N478	N478-P512 CarbonylContact O-C 3.53Å; N478-P512 WeakPolarHBondContact O-CA 3.26Å
513	R	78.2	Confident	76.5	Confident	23 Å²	23	63.6 Å²	63.6	9%	0.087	34%	0.34	C	S	.	.			trans	-137.2	88.3	178.4	-67.8	173.5	172.3	155.3	-22.4	108	N478 E479 F515 P569 N571 T584	N478-R513 PolarHBondContact O-N 3.09Å; N478-R513 PolarHBondContact OD1-NH1 3.43Å; E479-R513 WeakPolarHBondContact CA-O 3.1Å; R513-F515 WeakPolarHBondContact O-CD1 3.45Å; R513-F515 PolarHBondContact O-N 3.11Å; R513-F515 VanDerWaalsContact O-N 3.08Å; R513-P569 PolarHBondContact NE-O 3.36Å; R513-P569 PolarHBondContact NH2-O 3.46Å; R513-N571 PolarHBondContact NH1-OD1 2.93Å; R513-N571 PolarHBondContact NH2-OD1 2.95Å; R513-T584 WeakPolarHBondContact CD-OG1 3.3Å
514	P	76.9	Confident	76.8	Confident	44 Å²	44	59.8 Å²	59.8	29%	0.286	33%	0.326	S	S	.	.			trans	-85	79.9	-162.7	32.7	-37.1	0	0	0	113.8	E479 R517 K518 I567	E479-P514 WeakPolarHBondContact OE1-CA 3.4Å; E479-P514 WeakPolarHBondContact OE2-CA 3.37Å; P514-R517 HydrophobicContact CB-CB 4.2Å; P514-K518 WeakPolarHBondContact O-CB 3.38Å; P514-K518 PolarHBondContact O-N 3.32Å; P514-I567 VanDerWaalsContact O-CD1 3.23Å; P514-I567 WeakPolarHBondContact O-CD1 3.43Å
515	F	76.3	Confident	77.1	Confident	10 Å²	10	59.7 Å²	59.7	4%	0.044	31%	0.307	C	S	.	.	H	α-helix	trans	-83.5	-44.7	178.7	53.2	-88.3	0	0	0	112.9	F460 A475 N478 E479 R513 R517 K518 A519 A562 I563 I567 L585	F460-F515 HydrophobicContact CE2-CE2 4.03Å; F460-F515 HydrophobicContact CZ-CE2 4.39Å; A475-F515 HydrophobicContact CB-CE2 4.39Å; A475-F515 HydrophobicContact CB-CZ 3.88Å; A475-F515 WeakPolarHBondContact O-CZ 3.2Å; N478-F515 HydrophobicContact CB-CE1 4.22Å; E479-F515 HydrophobicContact CB-CE1 4.19Å; E479-F515 HydrophobicContact CB-CZ 4.17Å; E479-F515 PolarHBondContact OE2-N 2.9Å; R513-F515 WeakPolarHBondContact O-CD1 3.45Å; R513-F515 PolarHBondContact O-N 3.11Å; R513-F515 VanDerWaalsContact O-N 3.08Å; F515-R517 VanDerWaalsContact C-N 3.28Å; F515-R517 PolarHBondContact O-N 3.01Å; F515-K518 WeakPolarHBondContact O-CB 3.42Å; F515-K518 PolarHBondContact O-N 2.99Å; F515-A519 PolarHBondContact O-N 3.22Å; F515-A562 HydrophobicContact CB-CB 4.11Å; F515-A562 WeakPolarHBondContact CB-O 3.16Å; F515-A562 WeakPolarHBondContact O-CB 3.45Å; F515-I563 HydrophobicContact CB-CG1 4.48Å; F515-I563 HydrophobicContact CD2-CG1 3.73Å; F515-I563 HydrophobicContact CE2-CG1 4.35Å; F515-I563 HydrophobicContact CG-CG1 4.26Å; F515-I567 HydrophobicContact CB-CD1 4.21Å; F515-L585 HydrophobicContact CE1-CD1 4.08Å; F515-L585 HydrophobicContact CE2-CD1 4.15Å; F515-L585 HydrophobicContact CZ-CD1 3.81Å
516	L	74.4	Confident	77.5	Confident	7 Å²	7	58 Å²	58	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-38	176.4	-65.2	-176.9	0	0	0	111.2	A455 A457 E479 K518 A519 L520 I559	A455-L516 HydrophobicContact CB-CB 4.3Å; A457-L516 HydrophobicContact CB-CD1 4.33Å; E479-L516 HydrophobicContact CG-CB 4.42Å; E479-L516 PolarHBondContact OE2-N 3.07Å; L516-K518 VanDerWaalsContact C-N 3.33Å; L516-K518 PolarHBondContact O-N 2.95Å; L516-A519 PolarHBondContact O-N 3.37Å; L516-L520 WeakPolarHBondContact O-CG 3.24Å; L516-L520 PolarHBondContact O-N 3.3Å; L516-I559 HydrophobicContact CD2-CG2 4.36Å
517	R	75.7	Confident	77.4	Confident	120 Å²	120	53.6 Å²	53.6	45%	0.453	27%	0.268	S	S	.	.	H	α-helix	trans	-68.4	-27.7	173.4	-80	179	-73.1	172.6	-4.7	113.8	E479 P514 F515	E479-R517 PolarHBondContact O-NH2 3.11Å; E479-R517 WeakPolarHBondContact OE1-CG 3.38Å; E479-R517 IonicContact OE1-CZ 3.21Å; E479-R517 IonicContact OE1-NE 2.76Å; E479-R517 PolarHBondContact OE1-NE 3.04Å; E479-R517 IonicContact OE1-NH2 2.76Å; E479-R517 PolarHBondContact OE1-NH2 2.95Å; P514-R517 HydrophobicContact CB-CB 4.2Å; F515-R517 VanDerWaalsContact C-N 3.28Å; F515-R517 PolarHBondContact O-N 3.01Å
518	K	78.4	Confident	77.8	Confident	111 Å²	111	52.6 Å²	52.6	48%	0.483	26%	0.258	S	S	.	.	H	α-helix	trans	-72.2	-42.4	171.6	-179.7	178.6	175.9	-178.6	0	111.6	P514 F515 L516 L520 G521 A562 S565 I567	P514-K518 WeakPolarHBondContact O-CB 3.38Å; P514-K518 PolarHBondContact O-N 3.32Å; F515-K518 WeakPolarHBondContact O-CB 3.42Å; F515-K518 PolarHBondContact O-N 2.99Å; L516-K518 VanDerWaalsContact C-N 3.33Å; L516-K518 PolarHBondContact O-N 2.95Å; K518-L520 VanDerWaalsContact C-N 3.31Å; K518-L520 PolarHBondContact O-N 2.71Å; K518-G521 PolarHBondContact O-N 2.88Å; K518-A562 HydrophobicContact CB-CB 4.07Å; K518-A562 HydrophobicContact CD-CB 4.29Å; K518-A562 HydrophobicContact CG-CB 4.2Å; K518-S565 PolarHBondContact NZ-OG 2.79Å; K518-I567 HydrophobicContact CB-CD1 4.15Å; K518-I567 HydrophobicContact CD-CD1 3.74Å; K518-I567 HydrophobicContact CD-CG1 4.38Å
519	A	76.8	Confident	78.3	Confident	4 Å²	4	52.9 Å²	52.9	3%	0.033	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-41	176.7	0	0	0	0	0	112.6	F515 L516 G521 R522 A558 I559 A562	F515-A519 PolarHBondContact O-N 3.22Å; L516-A519 PolarHBondContact O-N 3.37Å; A519-G521 PolarHBondContact O-N 2.74Å; A519-G521 VanDerWaalsContact O-N 3.11Å; A519-R522 PolarHBondContact O-N 3.06Å; A519-A558 HydrophobicContact CB-CB 4.29Å; A519-A558 VanDerWaalsContact CB-O 3.24Å; A519-A558 WeakPolarHBondContact CB-O 3.47Å; A519-I559 HydrophobicContact CB-CB 4.47Å; A519-I559 HydrophobicContact CB-CG1 3.9Å; A519-A562 HydrophobicContact CB-CB 4.02Å
520	L	74.7	Confident	78.2	Confident	21 Å²	21	44.2 Å²	44.2	11%	0.11	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-58.1	-21	174.4	-71.7	171.8	0	0	0	113.7	V452 A455 L516 K518 R522 Q523	V452-L520 HydrophobicContact CG1-CD2 3.95Å; A455-L520 HydrophobicContact CB-CD1 4.23Å; A455-L520 HydrophobicContact CB-CD2 3.9Å; A455-L520 HydrophobicContact CB-CG 4.05Å; L516-L520 WeakPolarHBondContact O-CG 3.24Å; L516-L520 PolarHBondContact O-N 3.3Å; K518-L520 VanDerWaalsContact C-N 3.31Å; K518-L520 PolarHBondContact O-N 2.71Å; L520-R522 PolarHBondContact O-N 2.87Å; L520-Q523 VanDerWaalsContact O-CG 3.29Å; L520-Q523 WeakPolarHBondContact O-CG 3.15Å; L520-Q523 PolarHBondContact O-N 3.36Å; L520-Q523 PolarHBondContact O-NE2 2.87Å
521	G	77.7	Confident	78.4	Confident	60 Å²	60	46.6 Å²	46.6	62%	0.619	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-61.4	-23.2	177.9	0	0	0	0	0	114.3	K518 A519 Q523	K518-G521 PolarHBondContact O-N 2.88Å; A519-G521 PolarHBondContact O-N 2.74Å; A519-G521 VanDerWaalsContact O-N 3.11Å; G521-Q523 VanDerWaalsContact C-N 3.32Å; G521-Q523 PolarHBondContact O-N 3.32Å
522	R	81.6	Confident	78.5	Confident	57 Å²	57	46.5 Å²	46.5	22%	0.215	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-84.5	6.2	-177.9	-66	-168.5	173.5	158.9	3.5	115.1	A519 L520 E524 E525 W526 A558 D561	A519-R522 PolarHBondContact O-N 3.06Å; L520-R522 PolarHBondContact O-N 2.87Å; R522-E524 PolarHBondContact O-N 2.92Å; R522-E524 VanDerWaalsContact O-N 3.14Å; R522-E525 HydrophobicContact CB-CG 4.46Å; R522-E525 WeakPolarHBondContact CB-OE2 3.24Å; R522-E525 VanDerWaalsContact CD-OE2 3.27Å; R522-E525 WeakPolarHBondContact CD-OE2 3.07Å; R522-E525 WeakPolarHBondContact CG-OE1 3.42Å; R522-E525 WeakPolarHBondContact CG-OE2 3.45Å; R522-E525 IonicContact NE-OE2 2.71Å; R522-E525 VanDerWaalsContact O-CB 3.28Å; R522-E525 WeakPolarHBondContact O-CB 3.44Å; R522-E525 PolarHBondContact O-N 3.15Å; R522-W526 HydrophobicContact CB-CZ2 4.16Å; R522-W526 PolarHBondContact O-N 3Å; R522-A558 HydrophobicContact CB-CB 4.22Å; R522-A558 HydrophobicContact CG-CB 4.34Å; R522-D561 IonicContact CZ-OD2 3.49Å; R522-D561 IonicContact NH1-OD2 3.8Å; R522-D561 PolarHBondContact NH1-OD2 3.33Å; R522-D561 IonicContact NH2-OD2 2.77Å; R522-D561 PolarHBondContact NH2-OD2 2.87Å
523	Q	73.8	Confident	78.4	Confident	23 Å²	23	46 Å²	46	11%	0.107	22%	0.223	C	C	.	.	H	α-helix	trans	-53.9	-34.6	179.4	-82.7	167.6	59.3	0	0	114.9	L449 V452 L520 G521 E525 W526 A527	L449-Q523 WeakPolarHBondContact O-CB 3.06Å; L449-Q523 VanDerWaalsContact O-CG 3.26Å; L449-Q523 WeakPolarHBondContact O-CG 3.44Å; L449-Q523 PolarHBondContact O-OE1 3.46Å; V452-Q523 HydrophobicContact CB-CG 4.42Å; V452-Q523 VanDerWaalsContact O-CD 3.3Å; V452-Q523 PolarHBondContact O-NE2 3.48Å; V452-Q523 PolarHBondContact O-OE1 3.17Å; L520-Q523 VanDerWaalsContact O-CG 3.29Å; L520-Q523 WeakPolarHBondContact O-CG 3.15Å; L520-Q523 PolarHBondContact O-N 3.36Å; L520-Q523 PolarHBondContact O-NE2 2.87Å; G521-Q523 VanDerWaalsContact C-N 3.32Å; G521-Q523 PolarHBondContact O-N 3.32Å; Q523-E525 VanDerWaalsContact C-N 3.28Å; Q523-E525 PolarHBondContact O-N 3.15Å; Q523-W526 HydrophobicContact CB-CE3 4.24Å; Q523-W526 HydrophobicContact CB-CZ3 4.37Å; Q523-W526 HydrophobicContact CG-CE3 3.66Å; Q523-W526 HydrophobicContact CG-CH2 4.06Å; Q523-W526 HydrophobicContact CG-CZ3 3.37Å; Q523-W526 PolarHBondContact O-N 2.96Å; Q523-A527 WeakPolarHBondContact O-CB 3.44Å; Q523-A527 PolarHBondContact O-N 2.74Å
524	E	79.8	Confident	78.1	Confident	121 Å²	121	45.2 Å²	45.2	57%	0.565	22%	0.22	S	C	*	.	H	α-helix	trans	-66.1	-34.5	178.4	-62.8	-133.5	106.5	0	0	111.7	K450 R522 K528	K450-E524 WeakPolarHBondContact CE-OE1 3.3Å; K450-E524 IonicContact NZ-OE1 3.76Å; K450-E524 PolarHBondContact NZ-OE1 2.89Å; R522-E524 PolarHBondContact O-N 2.92Å; R522-E524 VanDerWaalsContact O-N 3.14Å; E524-K528 WeakPolarHBondContact O-CB 3.36Å; E524-K528 PolarHBondContact O-N 3.34Å
525	E	83.7	Confident	77.6	Confident	67 Å²	67	47.2 Å²	47.2	31%	0.313	23%	0.228	S	C	.	.	H	α-helix	trans	-65.7	-48.8	176	-54.3	166.6	-166.1	0	0	110.6	R522 Q523 A527 K528 Y529 M554	R522-E525 HydrophobicContact CB-CG 4.46Å; R522-E525 WeakPolarHBondContact CB-OE2 3.24Å; R522-E525 VanDerWaalsContact CD-OE2 3.27Å; R522-E525 WeakPolarHBondContact CD-OE2 3.07Å; R522-E525 WeakPolarHBondContact CG-OE1 3.42Å; R522-E525 WeakPolarHBondContact CG-OE2 3.45Å; R522-E525 IonicContact NE-OE2 2.71Å; R522-E525 VanDerWaalsContact O-CB 3.28Å; R522-E525 WeakPolarHBondContact O-CB 3.44Å; R522-E525 PolarHBondContact O-N 3.15Å; Q523-E525 VanDerWaalsContact C-N 3.28Å; Q523-E525 PolarHBondContact O-N 3.15Å; E525-A527 VanDerWaalsContact C-N 3.32Å; E525-A527 PolarHBondContact O-N 3.48Å; E525-K528 WeakPolarHBondContact O-CB 3.32Å; E525-K528 PolarHBondContact O-N 2.98Å; E525-K528 VanDerWaalsContact O-N 3.13Å; E525-Y529 PolarHBondContact O-N 2.71Å; E525-M554 HydrophobicContact CB-CE 3.94Å
526	W	82.8	Confident	77.2	Confident	11 Å²	11	47.9 Å²	47.9	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-45.2	177.9	-48.6	-22.9	0	0	0	111.4	L449 R522 Q523 K528 V530 V551 M554 I555 A558	L449-W526 HydrophobicContact CD1-CB 4.48Å; L449-W526 HydrophobicContact CD2-CB 4.32Å; L449-W526 HydrophobicContact CD2-CE3 4.48Å; R522-W526 HydrophobicContact CB-CZ2 4.16Å; R522-W526 PolarHBondContact O-N 3Å; Q523-W526 HydrophobicContact CB-CE3 4.24Å; Q523-W526 HydrophobicContact CB-CZ3 4.37Å; Q523-W526 HydrophobicContact CG-CE3 3.66Å; Q523-W526 HydrophobicContact CG-CH2 4.06Å; Q523-W526 HydrophobicContact CG-CZ3 3.37Å; Q523-W526 PolarHBondContact O-N 2.96Å; W526-K528 VanDerWaalsContact C-N 3.35Å; W526-V530 PolarHBondContact O-N 2.88Å; W526-V551 HydrophobicContact CB-CG1 4.34Å; W526-M554 PolarHBondContact NE1-O 2.92Å; W526-I555 HydrophobicContact CD2-CD1 4.34Å; W526-I555 HydrophobicContact CD2-CG1 3.51Å; W526-I555 HydrophobicContact CE3-CD1 4.13Å; W526-I555 HydrophobicContact CE3-CG1 3.63Å; W526-I555 HydrophobicContact CG-CG1 4.14Å; W526-I555 HydrophobicContact CH2-CB 4.49Å; W526-I555 HydrophobicContact CH2-CG1 3.92Å; W526-I555 HydrophobicContact CH2-CG2 4.31Å; W526-I555 HydrophobicContact CZ2-CB 4.23Å; W526-I555 HydrophobicContact CZ2-CG1 3.79Å; W526-I555 HydrophobicContact CZ2-CG2 4.43Å; W526-I555 HydrophobicContact CZ3-CD1 4.41Å; W526-I555 HydrophobicContact CZ3-CG1 3.83Å; W526-A558 HydrophobicContact CZ2-CB 3.84Å
527	A	77.8	Confident	76.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69.1	-31.8	178.1	0	0	0	0	0	112.7	I446 L449 K450 Q523 E525 K531	I446-A527 HydrophobicContact CG2-CB 4.02Å; I446-A527 WeakPolarHBondContact O-CB 3.37Å; L449-A527 HydrophobicContact CB-CB 3.81Å; K450-A527 HydrophobicContact CD-CB 4.21Å; K450-A527 HydrophobicContact CG-CB 3.45Å; K450-A527 VanDerWaalsContact CG-CB 3.45Å; Q523-A527 WeakPolarHBondContact O-CB 3.44Å; Q523-A527 PolarHBondContact O-N 2.74Å; E525-A527 VanDerWaalsContact C-N 3.32Å; E525-A527 PolarHBondContact O-N 3.48Å; A527-K531 PolarHBondContact O-N 3.5Å; A527-K531 VanDerWaalsContact O-N 3.13Å
528	K	82.5	Confident	75.6	Confident	41 Å²	41	48.2 Å²	48.2	18%	0.178	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-48.8	174.5	-136.3	-166.7	-173.9	174.5	0	111.2	E524 E525 W526 V530 K531 E532 Q875 A876 S894	E524-K528 WeakPolarHBondContact O-CB 3.36Å; E524-K528 PolarHBondContact O-N 3.34Å; E525-K528 WeakPolarHBondContact O-CB 3.32Å; E525-K528 PolarHBondContact O-N 2.98Å; E525-K528 VanDerWaalsContact O-N 3.13Å; W526-K528 VanDerWaalsContact C-N 3.35Å; K528-V530 VanDerWaalsContact C-N 3.26Å; K528-V530 PolarHBondContact O-N 3.37Å; K528-K531 WeakPolarHBondContact O-CA 3.23Å; K528-K531 VanDerWaalsContact O-CB 3.29Å; K528-K531 WeakPolarHBondContact O-CB 3.29Å; K528-K531 PolarHBondContact O-N 2.7Å; K528-E532 WeakPolarHBondContact CD-OE1 3.35Å; K528-E532 VanDerWaalsContact CE-OE1 3.25Å; K528-E532 WeakPolarHBondContact CE-OE1 3.46Å; K528-E532 WeakPolarHBondContact CG-OE1 3.25Å; K528-E532 WeakPolarHBondContact O-CG 3.49Å; K528-E532 PolarHBondContact O-N 3.22Å; K528-Q875 HydrophobicContact CD-CG 3.79Å; K528-A876 PolarHBondContact NZ-O 2.83Å; K528-S894 WeakPolarHBondContact CD-O 3.18Å; K528-S894 WeakPolarHBondContact CE-O 3.19Å; K528-S894 PolarHBondContact NZ-O 3.02Å
529	Y	84.4	Confident	74.7	Confident	51 Å²	51	48.3 Å²	48.3	20%	0.2	25%	0.252	C	S	.	.	H	α-helix	trans	-53.5	-44.4	178.2	-178.1	-90.9	0	0	0	111.7	E525 N533 I547 N550 V551 M554	E525-Y529 PolarHBondContact O-N 2.71Å; Y529-N533 WeakPolarHBondContact CD2-ND2 3.44Å; Y529-N533 WeakPolarHBondContact CE2-ND2 3.49Å; Y529-N533 WeakPolarHBondContact O-CB 3.38Å; Y529-N533 PolarHBondContact O-N 2.7Å; Y529-N533 VanDerWaalsContact O-N 3.09Å; Y529-N533 PolarHBondContact O-ND2 2.95Å; Y529-I547 HydrophobicContact CE1-CG2 4.39Å; Y529-N550 HydrophobicContact CE1-CB 3.67Å; Y529-N550 PolarHBondContact OH-ND2 3.41Å; Y529-V551 HydrophobicContact CD1-CG2 3.88Å; Y529-M554 HydrophobicContact CD1-SD 4.4Å; Y529-M554 HydrophobicContact CD2-SD 4.29Å; Y529-M554 HydrophobicContact CG-SD 3.9Å
530	V	76.8	Confident	73.4	Confident	2 Å²	2	51 Å²	51	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-60.8	-52	171.5	174.9	0	0	0	0	111.6	L445 I446 L449 W526 K528 E532 N533 F534 I547 V551	L445-V530 HydrophobicContact CB-CG1 4.23Å; L445-V530 HydrophobicContact CD2-CG1 3.91Å; L445-V530 HydrophobicContact CD2-CG2 4.49Å; I446-V530 HydrophobicContact CG1-CG1 4.35Å; L449-V530 HydrophobicContact CD1-CB 4.38Å; L449-V530 HydrophobicContact CD1-CG2 3.56Å; W526-V530 PolarHBondContact O-N 2.88Å; K528-V530 VanDerWaalsContact C-N 3.26Å; K528-V530 PolarHBondContact O-N 3.37Å; V530-E532 PolarHBondContact O-N 3.03Å; V530-E532 VanDerWaalsContact O-N 3.08Å; V530-N533 PolarHBondContact O-N 2.7Å; V530-F534 HydrophobicContact CG1-CD2 4.38Å; V530-F534 WeakPolarHBondContact O-CB 3.44Å; V530-F534 PolarHBondContact O-N 3.21Å; V530-I547 HydrophobicContact CG2-CG2 4.05Å; V530-V551 HydrophobicContact CG2-CG2 3.6Å
531	K	77.9	Confident	72.7	Confident	108 Å²	108	55.4 Å²	55.4	47%	0.47	31%	0.308	S	S	.	.	H	α-helix	trans	-51.1	-38	-177.2	-175.9	-170.6	172.5	-159.5	0	113	K442 I446 A527 K528	K442-K531 PolarHBondContact NZ-O 2.85Å; I446-K531 HydrophobicContact CD1-CB 3.46Å; I446-K531 VanDerWaalsContact CD1-CB 3.46Å; I446-K531 HydrophobicContact CD1-CD 4.42Å; I446-K531 HydrophobicContact CD1-CG 3.64Å; I446-K531 HydrophobicContact CG1-CB 3.94Å; A527-K531 PolarHBondContact O-N 3.5Å; A527-K531 VanDerWaalsContact O-N 3.13Å; K528-K531 WeakPolarHBondContact O-CA 3.23Å; K528-K531 VanDerWaalsContact O-CB 3.29Å; K528-K531 WeakPolarHBondContact O-CB 3.29Å; K528-K531 PolarHBondContact O-N 2.7Å
532	E	78	Confident	71.9	Confident	42 Å²	42	53.6 Å²	53.6	20%	0.196	28%	0.284	C	S	.	.	H	α-helix	trans	-91.1	-36.9	-169	-68.9	158.9	165.3	0	0	111.9	K528 V530 S895	K528-E532 WeakPolarHBondContact CD-OE1 3.35Å; K528-E532 VanDerWaalsContact CE-OE1 3.25Å; K528-E532 WeakPolarHBondContact CE-OE1 3.46Å; K528-E532 WeakPolarHBondContact CG-OE1 3.25Å; K528-E532 WeakPolarHBondContact O-CG 3.49Å; K528-E532 PolarHBondContact O-N 3.22Å; V530-E532 PolarHBondContact O-N 3.03Å; V530-E532 VanDerWaalsContact O-N 3.08Å; E532-S895 VanDerWaalsContact CD-CA 3.48Å; E532-S895 VanDerWaalsContact CD-CB 3.49Å; E532-S895 VanDerWaalsContact CD-OG 3.29Å; E532-S895 WeakPolarHBondContact CG-OG 3.36Å; E532-S895 PolarHBondContact OE1-OG 3.47Å; E532-S895 WeakPolarHBondContact OE2-CA 3.31Å
533	N	78.6	Confident	71	Confident	42 Å²	42	53 Å²	53	23%	0.225	29%	0.289	C	S	.	.	H	α-helix	trans	-85.4	-19.4	177.8	-68.7	-88.6	0	0	0	113.8	Y529 V530 D535 A536 N537 I542 I547	Y529-N533 WeakPolarHBondContact CD2-ND2 3.44Å; Y529-N533 WeakPolarHBondContact CE2-ND2 3.49Å; Y529-N533 WeakPolarHBondContact O-CB 3.38Å; Y529-N533 PolarHBondContact O-N 2.7Å; Y529-N533 VanDerWaalsContact O-N 3.09Å; Y529-N533 PolarHBondContact O-ND2 2.95Å; V530-N533 PolarHBondContact O-N 2.7Å; N533-D535 VanDerWaalsContact C-N 3.31Å; N533-D535 PolarHBondContact O-N 3Å; N533-A536 CarbonylContact O-C 3.52Å; N533-A536 WeakPolarHBondContact O-CA 3.35Å; N533-A536 WeakPolarHBondContact O-CB 3.35Å; N533-A536 PolarHBondContact O-N 2.7Å; N533-A536 VanDerWaalsContact O-N 3.15Å; N533-N537 PolarHBondContact O-N 2.87Å; N533-I542 HydrophobicContact CB-CG2 4.39Å; N533-I542 WeakPolarHBondContact O-CG2 3.45Å; N533-I547 HydrophobicContact CB-CD1 3.95Å; N533-I547 HydrophobicContact CB-CG1 3.98Å
534	F	71.8	Confident	70.4	Confident	7 Å²	7	54.9 Å²	54.9	3%	0.031	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-29.2	-177.3	-169.2	-73.9	0	0	0	113.3	V438 L441 K442 V530 A536 N537 M544	V438-F534 HydrophobicContact CG1-CE1 3.75Å; V438-F534 HydrophobicContact CG1-CZ 4.47Å; L441-F534 HydrophobicContact CB-CZ 4.21Å; L441-F534 HydrophobicContact CD2-CE2 4.2Å; L441-F534 HydrophobicContact CD2-CZ 3.98Å; K442-F534 HydrophobicContact CB-CD1 3.76Å; K442-F534 HydrophobicContact CB-CD2 4.23Å; K442-F534 HydrophobicContact CB-CE1 3.8Å; K442-F534 HydrophobicContact CB-CE2 4.26Å; K442-F534 HydrophobicContact CB-CG 3.99Å; K442-F534 HydrophobicContact CB-CZ 4.06Å; K442-F534 HydrophobicContact CD-CB 3.6Å; K442-F534 HydrophobicContact CD-CD1 3.72Å; K442-F534 HydrophobicContact CD-CG 3.77Å; K442-F534 HydrophobicContact CG-CB 4.22Å; K442-F534 HydrophobicContact CG-CD1 4.13Å; K442-F534 HydrophobicContact CG-CD2 4.48Å; K442-F534 HydrophobicContact CG-CG 4.04Å; V530-F534 HydrophobicContact CG1-CD2 4.38Å; V530-F534 WeakPolarHBondContact O-CB 3.44Å; V530-F534 PolarHBondContact O-N 3.21Å; F534-A536 VanDerWaalsContact C-N 3.35Å; F534-N537 WeakPolarHBondContact O-CB 3.38Å; F534-N537 PolarHBondContact O-N 2.94Å; F534-N537 VanDerWaalsContact O-N 3.15Å; F534-M544 HydrophobicContact CD2-SD 3.85Å; F534-M544 HydrophobicContact CE2-SD 3.96Å
535	D	66.7	Low	69.6	Low	87 Å²	87	55.9 Å²	55.9	47%	0.465	30%	0.301	S	S	.	.	H	α-helix	trans	-71.7	-34.8	174.8	-63.5	-20.9	0	0	0	110.7	K442 N533 N537 L538 D539	K442-D535 IonicContact NZ-OD1 3.71Å; K442-D535 PolarHBondContact NZ-OD1 3.44Å; K442-D535 IonicContact NZ-OD2 2.68Å; K442-D535 PolarHBondContact NZ-OD2 3.42Å; N533-D535 VanDerWaalsContact C-N 3.31Å; N533-D535 PolarHBondContact O-N 3Å; D535-N537 PolarHBondContact O-N 2.89Å; D535-L538 WeakPolarHBondContact O-CB 3.45Å; D535-L538 PolarHBondContact O-N 3.14Å; D535-D539 PolarHBondContact O-N 2.91Å
536	A	68.6	Low	69	Low	24 Å²	24	57.2 Å²	57.2	20%	0.198	31%	0.307	C	S	.	.	H	α-helix	trans	-70.3	-5.2	169.7	0	0	0	0	0	113.7	N533 F534 D539 T541 I542	N533-A536 CarbonylContact O-C 3.52Å; N533-A536 WeakPolarHBondContact O-CA 3.35Å; N533-A536 WeakPolarHBondContact O-CB 3.35Å; N533-A536 PolarHBondContact O-N 2.7Å; N533-A536 VanDerWaalsContact O-N 3.15Å; F534-A536 VanDerWaalsContact C-N 3.35Å; A536-D539 WeakPolarHBondContact CA-OD1 3.19Å; A536-T541 WeakPolarHBondContact O-CA 3.4Å; A536-T541 WeakPolarHBondContact O-CB 3.3Å; A536-T541 PolarHBondContact O-N 3.47Å; A536-I542 HydrophobicContact CB-CG2 3.88Å; A536-I542 PolarHBondContact O-N 3.43Å
537	N	63.5	Low	68.5	Low	47 Å²	47	56.7 Å²	56.7	25%	0.251	31%	0.305	S	S	.	.	H	α-helix	trans	-84.5	-22.3	164.7	178.9	-113.6	0	0	0	112.7	N533 F534 D535 I542 M544 I547	N533-N537 PolarHBondContact O-N 2.87Å; F534-N537 WeakPolarHBondContact O-CB 3.38Å; F534-N537 PolarHBondContact O-N 2.94Å; F534-N537 VanDerWaalsContact O-N 3.15Å; D535-N537 PolarHBondContact O-N 2.89Å; N537-I542 VanDerWaalsContact CA-O 3.29Å; N537-I542 WeakPolarHBondContact CA-O 3.41Å; N537-I542 WeakPolarHBondContact CB-O 3.34Å; N537-I542 PolarHBondContact ND2-O 3.34Å; N537-M544 PolarHBondContact ND2-N 2.84Å; N537-M544 WeakPolarHBondContact OD1-CG 3.22Å; N537-I547 HydrophobicContact CB-CD1 4.06Å
538	L	53.1	Low	67.9	Low	86 Å²	86	59.5 Å²	59.5	45%	0.45	33%	0.328	S	S	.	.	H	α-helix	trans	-85.1	-27.7	-177.4	-58.5	173.1	0	0	0	112.8	V438 D535	V438-L538 HydrophobicContact CG1-CD1 3.57Å; V438-L538 HydrophobicContact CG1-CD2 3.52Å; V438-L538 HydrophobicContact CG1-CG 4.16Å; D535-L538 WeakPolarHBondContact O-CB 3.45Å; D535-L538 PolarHBondContact O-N 3.14Å
539	D	58.8	Low	67.5	Low	113 Å²	113	62.8 Å²	62.8	60%	0.604	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-12.1	167.7	63.3	29.1	0	0	0	113.4	D535 A536 T541	D535-D539 PolarHBondContact O-N 2.91Å; A536-D539 WeakPolarHBondContact CA-OD1 3.19Å; D539-T541 WeakPolarHBondContact OD1-CB 3.41Å; D539-T541 PolarHBondContact OD1-N 2.88Å; D539-T541 PolarHBondContact OD1-OG1 3.41Å
540	G	49.6	Very low	67.4	Low	62 Å²	62	62.9 Å²	62.9	64%	0.639	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	8	177.5	0	0	0	0	0	115.5
541	T	59.1	Low	67.6	Low	112 Å²	112	63.3 Å²	63.3	69%	0.687	35%	0.351	S	S	*	.	S	Bend	trans	-67.7	-31	-179.4	-55.1	0	0	0	0	113.7	A536 D539	A536-T541 WeakPolarHBondContact O-CA 3.4Å; A536-T541 WeakPolarHBondContact O-CB 3.3Å; A536-T541 PolarHBondContact O-N 3.47Å; D539-T541 WeakPolarHBondContact OD1-CB 3.41Å; D539-T541 PolarHBondContact OD1-N 2.88Å; D539-T541 PolarHBondContact OD1-OG1 3.41Å
542	I	62	Low	67.2	Low	22 Å²	22	60.6 Å²	60.6	11%	0.113	35%	0.348	C	S	.	.	S	Bend	trans	-139.5	143.4	176.5	-172.8	170.9	0	0	0	111.4	N533 A536 N537 E546 I547	N533-I542 HydrophobicContact CB-CG2 4.39Å; N533-I542 WeakPolarHBondContact O-CG2 3.45Å; A536-I542 HydrophobicContact CB-CG2 3.88Å; A536-I542 PolarHBondContact O-N 3.43Å; N537-I542 VanDerWaalsContact CA-O 3.29Å; N537-I542 WeakPolarHBondContact CA-O 3.41Å; N537-I542 WeakPolarHBondContact CB-O 3.34Å; N537-I542 PolarHBondContact ND2-O 3.34Å; I542-E546 HydrophobicContact CD1-CB 4.04Å; I542-E546 HydrophobicContact CG1-CB 3.77Å; I542-I547 HydrophobicContact CD1-CG1 3.97Å; I542-I547 HydrophobicContact CG1-CG1 4.18Å; I542-I547 HydrophobicContact CG2-CD1 4.03Å; I542-I547 HydrophobicContact CG2-CG1 4.2Å
543	S	61.1	Low	67.2	Low	45 Å²	45	62.3 Å²	62.3	32%	0.315	36%	0.358	S	S	.	.			trans	-83	152.1	176.9	76.7	0	0	0	0	113	K545 E546 I547	S543-K545 PolarHBondContact O-N 3.23Å; S543-K545 PolarHBondContact OG-N 2.78Å; S543-E546 WeakPolarHBondContact CA-OE2 3.15Å; S543-E546 WeakPolarHBondContact CB-OE2 3.15Å; S543-E546 PolarHBondContact N-OE2 2.67Å; S543-E546 PolarHBondContact O-N 2.91Å; S543-E546 VanDerWaalsContact O-N 3.12Å; S543-E546 WeakPolarHBondContact OG-CG 3.44Å; S543-E546 PolarHBondContact OG-N 2.92Å; S543-E546 VanDerWaalsContact OG-N 3.15Å; S543-E546 PolarHBondContact OG-OE2 3.41Å; S543-I547 PolarHBondContact O-N 2.89Å
544	M	62.1	Low	67.3	Low	63 Å²	63	62.9 Å²	62.9	31%	0.31	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-21.7	169.1	-85.7	-58.9	-52.8	0	0	113.6	L445 F534 N537 I547 A548	L445-M544 HydrophobicContact CD2-CE 4.17Å; F534-M544 HydrophobicContact CD2-SD 3.85Å; F534-M544 HydrophobicContact CE2-SD 3.96Å; N537-M544 PolarHBondContact ND2-N 2.84Å; N537-M544 WeakPolarHBondContact OD1-CG 3.22Å; M544-I547 HydrophobicContact SD-CB 4.34Å; M544-I547 HydrophobicContact SD-CD1 3.89Å; M544-A548 WeakPolarHBondContact O-CB 3.34Å; M544-A548 PolarHBondContact O-N 3.21Å; M544-A548 VanDerWaalsContact O-N 3.1Å
545	K	64	Low	67.6	Low	141 Å²	141	65.1 Å²	65.1	61%	0.613	37%	0.372	S	S	*	.	H	α-helix	trans	-69.9	-41	173.5	-165.5	175.1	-174.7	178.6	0	110.1	S543 H549 E702	S543-K545 PolarHBondContact O-N 3.23Å; S543-K545 PolarHBondContact OG-N 2.78Å; K545-H549 VanDerWaalsContact O-CB 3.25Å; K545-H549 WeakPolarHBondContact O-CB 3.49Å; K545-H549 PolarHBondContact O-N 3.43Å; K545-E702 IonicContact NZ-OE1 2.67Å; K545-E702 PolarHBondContact NZ-OE1 3.01Å; K545-E702 IonicContact NZ-OE2 2.65Å
546	E	70.6	Confident	67.9	Low	95 Å²	95	63.7 Å²	63.7	44%	0.444	36%	0.363	S	S	.	.	H	α-helix	trans	-66.8	-45.8	173.8	-71	155.3	109.9	0	0	112.1	I542 S543 A548 H549 N550	I542-E546 HydrophobicContact CD1-CB 4.04Å; I542-E546 HydrophobicContact CG1-CB 3.77Å; S543-E546 WeakPolarHBondContact CA-OE2 3.15Å; S543-E546 WeakPolarHBondContact CB-OE2 3.15Å; S543-E546 PolarHBondContact N-OE2 2.67Å; S543-E546 PolarHBondContact O-N 2.91Å; S543-E546 VanDerWaalsContact O-N 3.12Å; S543-E546 WeakPolarHBondContact OG-CG 3.44Å; S543-E546 PolarHBondContact OG-N 2.92Å; S543-E546 VanDerWaalsContact OG-N 3.15Å; S543-E546 PolarHBondContact OG-OE2 3.41Å; E546-A548 VanDerWaalsContact C-N 3.29Å; E546-A548 PolarHBondContact O-N 3.5Å; E546-H549 PolarHBondContact O-N 2.93Å; E546-N550 WeakPolarHBondContact O-CB 3.42Å; E546-N550 PolarHBondContact O-N 3.04Å; E546-N550 PolarHBondContact O-ND2 3.49Å
547	I	72.6	Confident	68.4	Low	1 Å²	1	65 Å²	65	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-56.6	-45.4	176.9	-64.5	174.2	0	0	0	110.7	Y529 V530 N533 N537 I542 S543 M544 V551	Y529-I547 HydrophobicContact CE1-CG2 4.39Å; V530-I547 HydrophobicContact CG2-CG2 4.05Å; N533-I547 HydrophobicContact CB-CD1 3.95Å; N533-I547 HydrophobicContact CB-CG1 3.98Å; N537-I547 HydrophobicContact CB-CD1 4.06Å; I542-I547 HydrophobicContact CD1-CG1 3.97Å; I542-I547 HydrophobicContact CG1-CG1 4.18Å; I542-I547 HydrophobicContact CG2-CD1 4.03Å; I542-I547 HydrophobicContact CG2-CG1 4.2Å; S543-I547 PolarHBondContact O-N 2.89Å; M544-I547 HydrophobicContact SD-CB 4.34Å; M544-I547 HydrophobicContact SD-CD1 3.89Å; I547-V551 VanDerWaalsContact O-CG2 3.29Å; I547-V551 WeakPolarHBondContact O-CG2 3.43Å; I547-V551 PolarHBondContact O-N 2.95Å; I547-V551 VanDerWaalsContact O-N 3.14Å
548	A	65	Low	69.2	Low	58 Å²	58	62.8 Å²	62.8	48%	0.479	36%	0.357	S	S	.	.	H	α-helix	trans	-67.6	-39.7	178	0	0	0	0	0	113.1	M544 E546 A552	M544-A548 WeakPolarHBondContact O-CB 3.34Å; M544-A548 PolarHBondContact O-N 3.21Å; M544-A548 VanDerWaalsContact O-N 3.1Å; E546-A548 VanDerWaalsContact C-N 3.29Å; E546-A548 PolarHBondContact O-N 3.5Å; A548-A552 PolarHBondContact O-N 3.03Å; A548-A552 VanDerWaalsContact O-N 3.09Å
549	H	74.1	Confident	70.4	Confident	111 Å²	111	59.9 Å²	59.9	51%	0.514	34%	0.341	S	S	.	.	H	α-helix	trans	-64.1	-45.5	177.4	-177.7	73.6	0	0	0	111.8	K545 E546 V551 A552 L553	K545-H549 VanDerWaalsContact O-CB 3.25Å; K545-H549 WeakPolarHBondContact O-CB 3.49Å; K545-H549 PolarHBondContact O-N 3.43Å; E546-H549 PolarHBondContact O-N 2.93Å; H549-V551 PolarHBondContact O-N 3.2Å; H549-A552 WeakPolarHBondContact O-CB 3.36Å; H549-A552 PolarHBondContact O-N 2.94Å; H549-A552 VanDerWaalsContact O-N 3.11Å; H549-L553 PolarHBondContact O-N 3.36Å
550	N	82.5	Confident	71.2	Confident	52 Å²	52	58.6 Å²	58.6	28%	0.278	33%	0.33	S	S	.	.	H	α-helix	trans	-66.3	-38.5	-179.6	-65.3	-15.4	0	0	0	111.4	Y529 E546 A552 L553 M554	Y529-N550 HydrophobicContact CE1-CB 3.67Å; Y529-N550 PolarHBondContact OH-ND2 3.41Å; E546-N550 WeakPolarHBondContact O-CB 3.42Å; E546-N550 PolarHBondContact O-N 3.04Å; E546-N550 PolarHBondContact O-ND2 3.49Å; N550-A552 VanDerWaalsContact C-N 3.35Å; N550-A552 PolarHBondContact O-N 3.01Å; N550-L553 WeakPolarHBondContact O-CB 3.39Å; N550-L553 PolarHBondContact O-N 3.29Å; N550-M554 WeakPolarHBondContact O-CG 2.96Å; N550-M554 PolarHBondContact O-N 3.02Å
551	V	80.5	Confident	72.7	Confident	12 Å²	12	57.8 Å²	57.8	7%	0.073	31%	0.311	C	S	.	.	H	α-helix	trans	-61	-40.9	170.6	168.6	0	0	0	0	112	L449 W526 Y529 V530 I547 H549 M554 I555	L449-V551 HydrophobicContact CD1-CG1 4.27Å; L449-V551 HydrophobicContact CD2-CG1 3.94Å; W526-V551 HydrophobicContact CB-CG1 4.34Å; Y529-V551 HydrophobicContact CD1-CG2 3.88Å; V530-V551 HydrophobicContact CG2-CG2 3.6Å; I547-V551 VanDerWaalsContact O-CG2 3.29Å; I547-V551 WeakPolarHBondContact O-CG2 3.43Å; I547-V551 PolarHBondContact O-N 2.95Å; I547-V551 VanDerWaalsContact O-N 3.14Å; H549-V551 PolarHBondContact O-N 3.2Å; V551-M554 PolarHBondContact O-N 3.48Å; V551-I555 HydrophobicContact CG1-CD1 3.9Å; V551-I555 WeakPolarHBondContact O-CD1 3.45Å; V551-I555 VanDerWaalsContact O-CG1 3.29Å; V551-I555 WeakPolarHBondContact O-CG1 3.09Å; V551-I555 PolarHBondContact O-N 3.02Å
552	A	69.9	Low	73.7	Confident	51 Å²	51	52.6 Å²	52.6	42%	0.421	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-42.9	176.3	0	0	0	0	0	111.9	A548 H549 N550 M554 I555 E556	A548-A552 PolarHBondContact O-N 3.03Å; A548-A552 VanDerWaalsContact O-N 3.09Å; H549-A552 WeakPolarHBondContact O-CB 3.36Å; H549-A552 PolarHBondContact O-N 2.94Å; H549-A552 VanDerWaalsContact O-N 3.11Å; N550-A552 VanDerWaalsContact C-N 3.35Å; N550-A552 PolarHBondContact O-N 3.01Å; A552-M554 PolarHBondContact O-N 3.46Å; A552-I555 PolarHBondContact O-N 3.41Å; A552-E556 PolarHBondContact O-N 2.93Å
553	L	76.6	Confident	74.3	Confident	77 Å²	77	52.8 Å²	52.8	40%	0.403	28%	0.28	S	S	.	.	H	α-helix	trans	-59.5	-41.8	173.3	-104.5	155.7	0	0	0	112.7	H549 N550 I555 E556 T557	H549-L553 PolarHBondContact O-N 3.36Å; N550-L553 WeakPolarHBondContact O-CB 3.39Å; N550-L553 PolarHBondContact O-N 3.29Å; L553-I555 VanDerWaalsContact C-N 3.35Å; L553-I555 PolarHBondContact O-N 3.35Å; L553-E556 PolarHBondContact O-N 2.76Å; L553-T557 VanDerWaalsContact O-CB 3.31Å; L553-T557 WeakPolarHBondContact O-CB 3.24Å; L553-T557 PolarHBondContact O-N 2.8Å; L553-T557 PolarHBondContact O-OG1 2.84Å
554	M	81.7	Confident	74.9	Confident	54 Å²	54	54.2 Å²	54.2	27%	0.266	29%	0.285	S	S	.	.	H	α-helix	trans	-64	-37.3	174.3	-66.2	174	84.9	0	0	112.5	E525 W526 Y529 N550 V551 A552 A558	E525-M554 HydrophobicContact CB-CE 3.94Å; W526-M554 PolarHBondContact NE1-O 2.92Å; Y529-M554 HydrophobicContact CD1-SD 4.4Å; Y529-M554 HydrophobicContact CD2-SD 4.29Å; Y529-M554 HydrophobicContact CG-SD 3.9Å; N550-M554 WeakPolarHBondContact O-CG 2.96Å; N550-M554 PolarHBondContact O-N 3.02Å; V551-M554 PolarHBondContact O-N 3.48Å; A552-M554 PolarHBondContact O-N 3.46Å; M554-A558 WeakPolarHBondContact O-CB 3.1Å; M554-A558 PolarHBondContact O-N 2.84Å
555	I	77.8	Confident	75.6	Confident	54 Å²	54	53.4 Å²	53.4	28%	0.277	29%	0.285	S	S	.	.	H	α-helix	trans	-67.6	-46	177	-67.7	162.3	0	0	0	110.7	W526 V551 A552 L553 A558 I559	W526-I555 HydrophobicContact CD2-CD1 4.34Å; W526-I555 HydrophobicContact CD2-CG1 3.51Å; W526-I555 HydrophobicContact CE3-CD1 4.13Å; W526-I555 HydrophobicContact CE3-CG1 3.63Å; W526-I555 HydrophobicContact CG-CG1 4.14Å; W526-I555 HydrophobicContact CH2-CB 4.49Å; W526-I555 HydrophobicContact CH2-CG1 3.92Å; W526-I555 HydrophobicContact CH2-CG2 4.31Å; W526-I555 HydrophobicContact CZ2-CB 4.23Å; W526-I555 HydrophobicContact CZ2-CG1 3.79Å; W526-I555 HydrophobicContact CZ2-CG2 4.43Å; W526-I555 HydrophobicContact CZ3-CD1 4.41Å; W526-I555 HydrophobicContact CZ3-CG1 3.83Å; V551-I555 HydrophobicContact CG1-CD1 3.9Å; V551-I555 WeakPolarHBondContact O-CD1 3.45Å; V551-I555 VanDerWaalsContact O-CG1 3.29Å; V551-I555 WeakPolarHBondContact O-CG1 3.09Å; V551-I555 PolarHBondContact O-N 3.02Å; A552-I555 PolarHBondContact O-N 3.41Å; L553-I555 VanDerWaalsContact C-N 3.35Å; L553-I555 PolarHBondContact O-N 3.35Å; I555-A558 PolarHBondContact O-N 2.76Å; I555-I559 HydrophobicContact CG2-CD1 4.2Å; I555-I559 WeakPolarHBondContact O-CG1 3.46Å; I555-I559 PolarHBondContact O-N 2.99Å; I555-I559 VanDerWaalsContact O-N 3.12Å
556	E	72.8	Confident	76	Confident	58 Å²	58	48.4 Å²	48.4	27%	0.271	27%	0.265	S	S	.	.	H	α-helix	trans	-62.9	-44.1	178.2	-165.6	-170.5	136.9	0	0	111.6	Y459 A552 L553 A558 I559 K560	Y459-E556 HydrophobicContact CD2-CG 4.44Å; Y459-E556 HydrophobicContact CE2-CG 3.91Å; A552-E556 PolarHBondContact O-N 2.93Å; L553-E556 PolarHBondContact O-N 2.76Å; E556-A558 VanDerWaalsContact C-N 3.34Å; E556-A558 PolarHBondContact O-N 2.81Å; E556-I559 PolarHBondContact O-N 3.08Å; E556-I559 VanDerWaalsContact O-N 3.14Å; E556-K560 HydrophobicContact CG-CD 4.41Å; E556-K560 PolarHBondContact O-N 3.43Å; E556-K560 WeakPolarHBondContact OE1-CE 3.17Å; E556-K560 IonicContact OE1-NZ 2.75Å; E556-K560 PolarHBondContact OE1-NZ 2.89Å
557	T	78.7	Confident	76	Confident	50 Å²	50	45.4 Å²	45.4	31%	0.307	25%	0.252	S	S	.	.	H	α-helix	trans	-61.5	-41.3	176.4	-56.1	0	0	0	0	111.6	L553 I559 K560 D561	L553-T557 VanDerWaalsContact O-CB 3.31Å; L553-T557 WeakPolarHBondContact O-CB 3.24Å; L553-T557 PolarHBondContact O-N 2.8Å; L553-T557 PolarHBondContact O-OG1 2.84Å; T557-I559 VanDerWaalsContact C-N 3.3Å; T557-I559 PolarHBondContact O-N 3.43Å; T557-K560 PolarHBondContact O-N 3.15Å; T557-D561 WeakPolarHBondContact O-CB 3.42Å; T557-D561 PolarHBondContact O-N 3.3Å
558	A	81.8	Confident	75.6	Confident	2 Å²	2	50.3 Å²	50.3	2%	0.017	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-35.5	174.7	0	0	0	0	0	113.2	A519 R522 W526 M554 I555 E556 A562	A519-A558 HydrophobicContact CB-CB 4.29Å; A519-A558 VanDerWaalsContact CB-O 3.24Å; A519-A558 WeakPolarHBondContact CB-O 3.47Å; R522-A558 HydrophobicContact CB-CB 4.22Å; R522-A558 HydrophobicContact CG-CB 4.34Å; W526-A558 HydrophobicContact CZ2-CB 3.84Å; M554-A558 WeakPolarHBondContact O-CB 3.1Å; M554-A558 PolarHBondContact O-N 2.84Å; I555-A558 PolarHBondContact O-N 2.76Å; E556-A558 VanDerWaalsContact C-N 3.34Å; E556-A558 PolarHBondContact O-N 2.81Å; A558-A562 WeakPolarHBondContact O-CB 3.42Å; A558-A562 PolarHBondContact O-N 3.37Å
559	I	76.5	Confident	75.8	Confident	25 Å²	25	50.3 Å²	50.3	13%	0.128	28%	0.279	C	S	.	.	H	α-helix	trans	-70.1	-47.8	175.5	-68.4	167.1	0	0	0	110.3	Y459 L516 A519 I555 E556 T557 A562 I563	Y459-I559 HydrophobicContact CD1-CG2 4.31Å; Y459-I559 HydrophobicContact CG-CG2 4.26Å; L516-I559 HydrophobicContact CD2-CG2 4.36Å; A519-I559 HydrophobicContact CB-CB 4.47Å; A519-I559 HydrophobicContact CB-CG1 3.9Å; I555-I559 HydrophobicContact CG2-CD1 4.2Å; I555-I559 WeakPolarHBondContact O-CG1 3.46Å; I555-I559 PolarHBondContact O-N 2.99Å; I555-I559 VanDerWaalsContact O-N 3.12Å; E556-I559 PolarHBondContact O-N 3.08Å; E556-I559 VanDerWaalsContact O-N 3.14Å; T557-I559 VanDerWaalsContact C-N 3.3Å; T557-I559 PolarHBondContact O-N 3.43Å; I559-A562 PolarHBondContact O-N 2.85Å; I559-I563 HydrophobicContact CG2-CD1 3.78Å; I559-I563 WeakPolarHBondContact O-CD1 3.39Å; I559-I563 VanDerWaalsContact O-CG1 3.31Å; I559-I563 WeakPolarHBondContact O-CG1 3.44Å; I559-I563 PolarHBondContact O-N 3.03Å; I559-I563 VanDerWaalsContact O-N 3.11Å
560	K	77.1	Confident	75.6	Confident	86 Å²	86	48.7 Å²	48.7	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-57.4	-54.3	177	-75.6	171.5	166.9	172.1	0	111.7	Y459 E556 T557 A562 I563 D564	Y459-K560 WeakPolarHBondContact OH-CE 3.17Å; E556-K560 HydrophobicContact CG-CD 4.41Å; E556-K560 PolarHBondContact O-N 3.43Å; E556-K560 WeakPolarHBondContact OE1-CE 3.17Å; E556-K560 IonicContact OE1-NZ 2.75Å; E556-K560 PolarHBondContact OE1-NZ 2.89Å; T557-K560 PolarHBondContact O-N 3.15Å; K560-A562 VanDerWaalsContact C-N 3.26Å; K560-A562 PolarHBondContact O-N 3.03Å; K560-I563 PolarHBondContact O-N 3.37Å; K560-I563 VanDerWaalsContact O-N 3.11Å; K560-D564 WeakPolarHBondContact O-CB 3.33Å; K560-D564 PolarHBondContact O-N 3.32Å
561	D	81.3	Confident	75	Confident	44 Å²	44	46.7 Å²	46.7	24%	0.235	27%	0.274	C	S	.	.	H	α-helix	trans	-56	-38.3	178	-80.7	-4.9	0	0	0	113.1	R522 T557 S565	R522-D561 IonicContact CZ-OD2 3.49Å; R522-D561 IonicContact NH1-OD2 3.8Å; R522-D561 PolarHBondContact NH1-OD2 3.33Å; R522-D561 IonicContact NH2-OD2 2.77Å; R522-D561 PolarHBondContact NH2-OD2 2.87Å; T557-D561 WeakPolarHBondContact O-CB 3.42Å; T557-D561 PolarHBondContact O-N 3.3Å; D561-S565 WeakPolarHBondContact O-CB 3.42Å; D561-S565 PolarHBondContact O-N 3.01Å; D561-S565 PolarHBondContact O-OG 2.9Å
562	A	78.9	Confident	74.5	Confident	3 Å²	3	48.5 Å²	48.5	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-69.9	-38.2	179.8	0	0	0	0	0	112.4	F515 K518 A519 A558 I559 K560 S565	F515-A562 HydrophobicContact CB-CB 4.11Å; F515-A562 WeakPolarHBondContact CB-O 3.16Å; F515-A562 WeakPolarHBondContact O-CB 3.45Å; K518-A562 HydrophobicContact CB-CB 4.07Å; K518-A562 HydrophobicContact CD-CB 4.29Å; K518-A562 HydrophobicContact CG-CB 4.2Å; A519-A562 HydrophobicContact CB-CB 4.02Å; A558-A562 WeakPolarHBondContact O-CB 3.42Å; A558-A562 PolarHBondContact O-N 3.37Å; I559-A562 PolarHBondContact O-N 2.85Å; K560-A562 VanDerWaalsContact C-N 3.26Å; K560-A562 PolarHBondContact O-N 3.03Å; A562-S565 PolarHBondContact O-OG 2.66Å
563	I	75.2	Confident	74.4	Confident	26 Å²	26	51.6 Å²	51.6	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-49.6	172.9	-63.9	156.3	0	0	0	110.1	Y459 F460 F515 I559 K560 S565 N566 H583 L585	Y459-I563 HydrophobicContact CE1-CD1 4.47Å; F460-I563 HydrophobicContact CE1-CD1 4.2Å; F460-I563 HydrophobicContact CE2-CD1 4.32Å; F460-I563 HydrophobicContact CZ-CD1 3.5Å; F460-I563 VanDerWaalsContact CZ-CD1 3.5Å; F460-I563 HydrophobicContact CZ-CG1 4.19Å; F515-I563 HydrophobicContact CB-CG1 4.48Å; F515-I563 HydrophobicContact CD2-CG1 3.73Å; F515-I563 HydrophobicContact CE2-CG1 4.35Å; F515-I563 HydrophobicContact CG-CG1 4.26Å; I559-I563 HydrophobicContact CG2-CD1 3.78Å; I559-I563 WeakPolarHBondContact O-CD1 3.39Å; I559-I563 VanDerWaalsContact O-CG1 3.31Å; I559-I563 WeakPolarHBondContact O-CG1 3.44Å; I559-I563 PolarHBondContact O-N 3.03Å; I559-I563 VanDerWaalsContact O-N 3.11Å; K560-I563 PolarHBondContact O-N 3.37Å; K560-I563 VanDerWaalsContact O-N 3.11Å; I563-S565 PolarHBondContact O-N 2.91Å; I563-N566 PolarHBondContact O-N 3.45Å; I563-H583 PolarHBondContact O-NE2 3Å; I563-L585 HydrophobicContact CG2-CD1 4.31Å
564	D	73.6	Confident	74	Confident	75 Å²	75	53.6 Å²	53.6	40%	0.401	31%	0.305	S	S	.	.	H	α-helix	trans	-57.3	-33.8	179.9	-97.4	26.8	0	0	0	112.9	K560 N566 H583 K869	K560-D564 WeakPolarHBondContact O-CB 3.33Å; K560-D564 PolarHBondContact O-N 3.32Å; D564-N566 PolarHBondContact O-N 2.93Å; D564-H583 PolarHBondContact O-CE1 3.46Å; D564-H583 VanDerWaalsContact O-CE1 3.24Å; D564-K869 IonicContact OD2-NZ 2.65Å; D564-K869 PolarHBondContact OD2-NZ 3.35Å
565	S	76	Confident	73.2	Confident	47 Å²	47	53.4 Å²	53.4	33%	0.329	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-0.6	178.1	71.9	0	0	0	0	115.5	K518 D561 A562 I563 I567	K518-S565 PolarHBondContact NZ-OG 2.79Å; D561-S565 WeakPolarHBondContact O-CB 3.42Å; D561-S565 PolarHBondContact O-N 3.01Å; D561-S565 PolarHBondContact O-OG 2.9Å; A562-S565 PolarHBondContact O-OG 2.66Å; I563-S565 PolarHBondContact O-N 2.91Å; S565-I567 VanDerWaalsContact C-N 3.3Å; S565-I567 PolarHBondContact O-N 2.89Å; S565-I567 VanDerWaalsContact O-N 3.07Å
566	N	72.9	Confident	72.7	Confident	35 Å²	35	53.6 Å²	53.6	19%	0.187	31%	0.308	C	S	.	.			trans	39.6	53	168.8	-164.5	27.7	0	0	0	114.1	I563 D564 S582 T584	I563-N566 PolarHBondContact O-N 3.45Å; D564-N566 PolarHBondContact O-N 2.93Å; N566-S582 PolarHBondContact ND2-O 3.46Å; N566-T584 WeakPolarHBondContact OD1-CB 3.19Å; N566-T584 PolarHBondContact OD1-N 2.65Å; N566-T584 PolarHBondContact OD1-OG1 3.48Å
567	I	70.7	Confident	72.3	Confident	33 Å²	33	54.4 Å²	54.4	17%	0.169	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-53.8	132.6	-162.7	-56.2	170.9	0	0	0	111.5	P514 F515 K518 S565	P514-I567 VanDerWaalsContact O-CD1 3.23Å; P514-I567 WeakPolarHBondContact O-CD1 3.43Å; F515-I567 HydrophobicContact CB-CD1 4.21Å; K518-I567 HydrophobicContact CB-CD1 4.15Å; K518-I567 HydrophobicContact CD-CD1 3.74Å; K518-I567 HydrophobicContact CD-CG1 4.38Å; S565-I567 VanDerWaalsContact C-N 3.3Å; S565-I567 PolarHBondContact O-N 2.89Å; S565-I567 VanDerWaalsContact O-N 3.07Å
568	P	65.2	Low	71.6	Confident	103 Å²	103	56.8 Å²	56.8	67%	0.669	34%	0.335	S	S	*	.	S	Bend	trans	-52.8	148.1	178.5	-29.2	35.9	0	0	0	113.9
569	P	68.3	Low	70.7	Confident	59 Å²	59	58 Å²	58	38%	0.383	34%	0.34	S	S	.	.	S	Bend	cis	-82.7	142.5	9.8	31.6	-34.8	0	0	0	114	P511 R513	P511-P569 HydrophobicContact CB-CG 3.67Å; P511-P569 HydrophobicContact CG-CG 3.37Å; R513-P569 PolarHBondContact NE-O 3.36Å; R513-P569 PolarHBondContact NH2-O 3.46Å
570	A	68.8	Low	70.2	Confident	76 Å²	76	64 Å²	64	63%	0.628	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-57.8	156.3	175.9	0	0	0	0	0	112.6
571	N	70.9	Confident	69.8	Low	11 Å²	11	60.9 Å²	60.9	6%	0.059	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-59	143.8	172.1	-80.7	-15.3	0	0	0	111.1	R513 T575 I576 H583	R513-N571 PolarHBondContact NH1-OD1 2.93Å; R513-N571 PolarHBondContact NH2-OD1 2.95Å; N571-T575 HydrophobicContact CB-CG2 4.11Å; N571-I576 HydrophobicContact CB-CD1 4.16Å; N571-I576 HydrophobicContact CB-CG1 3.6Å; N571-H583 PolarHBondContact ND2-O 3.45Å
572	S	70.8	Confident	69.4	Low	50 Å²	50	62.2 Å²	62.2	35%	0.35	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-63	148.6	175.5	84.8	0	0	0	0	110.2	R574 T575 I576	S572-R574 PolarHBondContact O-N 3.05Å; S572-T575 WeakPolarHBondContact O-CA 3.42Å; S572-T575 VanDerWaalsContact O-CB 3.3Å; S572-T575 WeakPolarHBondContact O-CB 3.14Å; S572-T575 PolarHBondContact O-N 2.97Å; S572-T575 PolarHBondContact OG-N 3.5Å; S572-T575 VanDerWaalsContact OG-N 3.13Å; S572-T575 PolarHBondContact OG-OG1 3.5Å; S572-I576 WeakPolarHBondContact O-CG1 3.45Å; S572-I576 PolarHBondContact O-N 2.97Å
573	P	67.1	Low	69.4	Low	115 Å²	115	63.3 Å²	63.3	75%	0.747	37%	0.371	S	S	*	.	H	α-helix	trans	-53.6	-29.2	-179.4	-29.5	36	0	0	0	114.1	A577	P573-A577 WeakPolarHBondContact O-CB 3.26Å; P573-A577 PolarHBondContact O-N 3.26Å
574	R	67.5	Low	69.3	Low	119 Å²	119	62.6 Å²	62.6	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-81.9	-30.3	175.7	-163.8	149.2	179.6	142.7	5.3	113.6	V497 G498 M499 S572 I576 A577 L578	V497-R574 PolarHBondContact O-NE 3.4Å; V497-R574 PolarHBondContact O-NH2 2.82Å; G498-R574 VanDerWaalsContact O-CZ 3.3Å; G498-R574 PolarHBondContact O-NH1 3.28Å; G498-R574 PolarHBondContact O-NH2 3.44Å; M499-R574 HydrophobicContact CE-CB 4.32Å; M499-R574 VanDerWaalsContact CG-CD 3.49Å; M499-R574 HydrophobicContact CG-CG 4.26Å; M499-R574 HydrophobicContact SD-CB 4.07Å; M499-R574 VanDerWaalsContact SD-CD 3.58Å; M499-R574 HydrophobicContact SD-CG 3.67Å; S572-R574 PolarHBondContact O-N 3.05Å; R574-I576 VanDerWaalsContact C-N 3.32Å; R574-A577 PolarHBondContact O-N 3.42Å; R574-L578 WeakPolarHBondContact O-CG 3.39Å; R574-L578 PolarHBondContact O-N 3.45Å
575	T	65.1	Low	69.3	Low	50 Å²	50	59.6 Å²	59.6	31%	0.307	35%	0.352	S	S	.	.	H	α-helix	trans	-62.4	-43.1	167.1	-51.5	0	0	0	0	110.3	N571 S572 L578 K579	N571-T575 HydrophobicContact CB-CG2 4.11Å; S572-T575 WeakPolarHBondContact O-CA 3.42Å; S572-T575 VanDerWaalsContact O-CB 3.3Å; S572-T575 WeakPolarHBondContact O-CB 3.14Å; S572-T575 PolarHBondContact O-N 2.97Å; S572-T575 PolarHBondContact OG-N 3.5Å; S572-T575 VanDerWaalsContact OG-N 3.13Å; S572-T575 PolarHBondContact OG-OG1 3.5Å; T575-L578 PolarHBondContact O-N 3.36Å; T575-K579 HydrophobicContact CG2-CD 3.95Å; T575-K579 HydrophobicContact CG2-CG 4.28Å; T575-K579 WeakPolarHBondContact O-CB 3.49Å; T575-K579 WeakPolarHBondContact O-CG 3.24Å; T575-K579 PolarHBondContact O-N 3.13Å
576	I	68.1	Low	69.1	Low	58 Å²	58	61.2 Å²	61.2	30%	0.297	36%	0.356	S	S	.	.	H	α-helix	trans	-64.4	-43	175.4	-58.5	179.2	0	0	0	110.8	N571 S572 R574 L578 K580	N571-I576 HydrophobicContact CB-CD1 4.16Å; N571-I576 HydrophobicContact CB-CG1 3.6Å; S572-I576 WeakPolarHBondContact O-CG1 3.45Å; S572-I576 PolarHBondContact O-N 2.97Å; R574-I576 VanDerWaalsContact C-N 3.32Å; I576-L578 VanDerWaalsContact C-N 3.31Å; I576-L578 PolarHBondContact O-N 3.31Å; I576-K580 WeakPolarHBondContact O-CA 3.39Å; I576-K580 PolarHBondContact O-N 3.25Å
577	A	64.1	Low	68.6	Low	75 Å²	75	62 Å²	62	62%	0.62	36%	0.36	S	S	*	.	H	α-helix	trans	-65.1	-29.9	177.7	0	0	0	0	0	114.1	P573 R574	P573-A577 WeakPolarHBondContact O-CB 3.26Å; P573-A577 PolarHBondContact O-N 3.26Å; R574-A577 PolarHBondContact O-N 3.42Å
578	L	63.6	Low	67.6	Low	100 Å²	100	63.9 Å²	63.9	52%	0.524	37%	0.373	S	S	.	.	H	α-helix	trans	-79.8	-53.2	174.7	-71.3	168.8	0	0	0	111.5	R574 T575 I576 K580	R574-L578 WeakPolarHBondContact O-CG 3.39Å; R574-L578 PolarHBondContact O-N 3.45Å; T575-L578 PolarHBondContact O-N 3.36Å; I576-L578 VanDerWaalsContact C-N 3.31Å; I576-L578 PolarHBondContact O-N 3.31Å; L578-K580 PolarHBondContact O-N 2.79Å
579	K	63.5	Low	66.8	Low	28 Å²	28	64 Å²	64	12%	0.122	37%	0.365	C	S	.	.	H	α-helix	trans	-69.9	-13.6	-178.7	-70.2	-171.7	151.5	-77.5	0	114.6	T575 S581 I586 D587 T588	T575-K579 HydrophobicContact CG2-CD 3.95Å; T575-K579 HydrophobicContact CG2-CG 4.28Å; T575-K579 WeakPolarHBondContact O-CB 3.49Å; T575-K579 WeakPolarHBondContact O-CG 3.24Å; T575-K579 PolarHBondContact O-N 3.13Å; K579-S581 PolarHBondContact O-N 3.09Å; K579-I586 WeakPolarHBondContact CD-O 3.42Å; K579-I586 PolarHBondContact NZ-O 3.39Å; K579-D587 VanDerWaalsContact CA-OD1 3.31Å; K579-D587 WeakPolarHBondContact CA-OD1 3.48Å; K579-D587 VanDerWaalsContact NZ-CG 3.28Å; K579-D587 IonicContact NZ-OD2 3.92Å; K579-D587 PolarHBondContact NZ-OD2 3.45Å; K579-T588 PolarHBondContact O-N 3.31Å; K579-T588 PolarHBondContact O-OG1 2.98Å; K579-T588 VanDerWaalsContact O-OG1 3.05Å
580	K	66.3	Low	65.2	Low	152 Å²	152	69.7 Å²	69.7	66%	0.661	38%	0.379	S	S	*	.	S	Bend	trans	51.1	8.6	-161.8	-66	-171.2	176.7	-175.9	0	116	I576 L578	I576-K580 WeakPolarHBondContact O-CA 3.39Å; I576-K580 PolarHBondContact O-N 3.25Å; L578-K580 PolarHBondContact O-N 2.79Å
581	S	68.6	Low	63.3	Low	19 Å²	19	75.5 Å²	75.5	13%	0.133	39%	0.393	C	S	.	.			trans	-126.8	140	-177.7	-173.8	0	0	0	0	112.3	K579 H583	K579-S581 PolarHBondContact O-N 3.09Å; S581-H583 WeakPolarHBondContact OG-CB 3.19Å; S581-H583 PolarHBondContact OG-N 3.42Å; S581-H583 VanDerWaalsContact OG-N 3.14Å
582	S	72.4	Confident	61.3	Low	72 Å²	72	80.4 Å²	80.4	50%	0.503	42%	0.423	S	S	.	.	S	Bend	trans	-73.9	-15.9	169.4	56.3	0	0	0	0	112.6	N566	N566-S582 PolarHBondContact ND2-O 3.46Å
583	H	78.4	Confident	59.2	Low	26 Å²	26	83 Å²	83	12%	0.12	45%	0.448	C	S	.	.	S	Bend	trans	-76.6	143.1	-175.2	-131	78	0	0	0	112.8	I563 D564 N571 S581 L585 I586	I563-H583 PolarHBondContact O-NE2 3Å; D564-H583 PolarHBondContact O-CE1 3.46Å; D564-H583 VanDerWaalsContact O-CE1 3.24Å; N571-H583 PolarHBondContact ND2-O 3.45Å; S581-H583 WeakPolarHBondContact OG-CB 3.19Å; S581-H583 PolarHBondContact OG-N 3.42Å; S581-H583 VanDerWaalsContact OG-N 3.14Å; H583-L585 PolarHBondContact O-N 2.89Å; H583-I586 HydrophobicContact CB-CB 3.85Å; H583-I586 HydrophobicContact CB-CD1 3.82Å; H583-I586 HydrophobicContact CB-CG1 3.84Å
584	T	73.1	Confident	57.2	Low	11 Å²	11	82.3 Å²	82.3	7%	0.067	44%	0.441	C	S	.	.	S	Bend	trans	-61.9	-44.3	-178.9	-69.5	0	0	0	0	113	N478 R513 N566	N478-T584 HydrophobicContact CB-CG2 4.06Å; N478-T584 VanDerWaalsContact OD1-CG2 3.23Å; N478-T584 WeakPolarHBondContact OD1-CG2 3.33Å; R513-T584 WeakPolarHBondContact CD-OG1 3.3Å; N566-T584 WeakPolarHBondContact OD1-CB 3.19Å; N566-T584 PolarHBondContact OD1-N 2.65Å; N566-T584 PolarHBondContact OD1-OG1 3.48Å
585	L	74.1	Confident	55.6	Low	13 Å²	13	80.4 Å²	80.4	7%	0.068	44%	0.44	C	S	.	.	S	Bend	trans	-108	2	-171.8	-60.4	-178.5	0	0	0	114.6	F460 Y465 V474 A475 N478 F515 I563 H583	F460-L585 HydrophobicContact CE1-CD1 4.44Å; F460-L585 HydrophobicContact CZ-CD1 3.9Å; Y465-L585 VanDerWaalsContact CE1-O 3.25Å; Y465-L585 WeakPolarHBondContact CE1-O 3.16Å; Y465-L585 PolarHBondContact OH-O 3.49Å; V474-L585 HydrophobicContact CG1-CD2 4.19Å; A475-L585 HydrophobicContact CB-CD1 4.2Å; A475-L585 HydrophobicContact CB-CD2 4.44Å; N478-L585 HydrophobicContact CB-CD2 4.39Å; F515-L585 HydrophobicContact CE1-CD1 4.08Å; F515-L585 HydrophobicContact CE2-CD1 4.15Å; F515-L585 HydrophobicContact CZ-CD1 3.81Å; I563-L585 HydrophobicContact CG2-CD1 4.31Å; H583-L585 PolarHBondContact O-N 2.89Å
586	I	70.6	Confident	53.8	Low	80 Å²	80	84.7 Å²	84.7	41%	0.41	46%	0.461	S	S	.	.			trans	-96.8	146	175.3	-56.7	176.4	0	0	0	108.5	K579 H583 T588	K579-I586 WeakPolarHBondContact CD-O 3.42Å; K579-I586 PolarHBondContact NZ-O 3.39Å; H583-I586 HydrophobicContact CB-CB 3.85Å; H583-I586 HydrophobicContact CB-CD1 3.82Å; H583-I586 HydrophobicContact CB-CG1 3.84Å; I586-T588 HydrophobicContact CG2-CG2 4.35Å
587	D	62.8	Low	52.1	Low	52 Å²	52	89.5 Å²	89.5	28%	0.278	49%	0.487	S	S	.	.			trans	-143.8	122.4	176.7	-145.2	-35.7	0	0	0	108.8	Y465 K579	Y465-D587 HydrophobicContact CD1-CB 3.76Å; Y465-D587 HydrophobicContact CE1-CB 3.89Å; K579-D587 VanDerWaalsContact CA-OD1 3.31Å; K579-D587 WeakPolarHBondContact CA-OD1 3.48Å; K579-D587 VanDerWaalsContact NZ-CG 3.28Å; K579-D587 IonicContact NZ-OD2 3.92Å; K579-D587 PolarHBondContact NZ-OD2 3.45Å
588	T	49.9	Very low	50.5	Low	72 Å²	72	92.8 Å²	92.8	44%	0.442	49%	0.487	S	S	.	.			trans	-125.8	64.4	-176.7	43.3	0	0	0	0	111.1	K579 I586 R590	K579-T588 PolarHBondContact O-N 3.31Å; K579-T588 PolarHBondContact O-OG1 2.98Å; K579-T588 VanDerWaalsContact O-OG1 3.05Å; I586-T588 HydrophobicContact CG2-CG2 4.35Å; T588-R590 PolarHBondContact O-N 3.32Å
589	E	49.1	Very low	48.6	Very low	105 Å²	105	91.5 Å²	91.5	49%	0.491	50%	0.499	S	S	.	.			trans	-50.8	129.6	163.9	-88.6	-143.2	120.2	0	0	110.6
590	R	34	Very low	46.7	Very low	180 Å²	180	93.8 Å²	93.8	68%	0.679	52%	0.515	S	S	*	.				83.2	56.1	68.9	-160.8	-163.5	176.7	-174	-3.9	113.6	T588 V592	T588-R590 PolarHBondContact O-N 3.32Å; R590-V592 PolarHBondContact O-N 3.18Å
591	Q	28.8	Very low	44.7	Very low	197 Å²	197	93 Å²	93	92%	0.921	52%	0.523	S	S	*	.			trans	-73.6	96.6	154.9	-72.3	-167.8	-2.3	0	0	110.8
592	V	29.8	Very low	42.6	Very low	115 Å²	115	97.2 Å²	97.2	70%	0.697	55%	0.548	S	S	*	.			trans	-149.7	122.7	154.2	-178.7	0	0	0	0	108	R590 V594	R590-V592 PolarHBondContact O-N 3.18Å; V592-V594 HydrophobicContact CG1-CG2 3.96Å
593	A	26.3	Very low	40.4	Very low	105 Å²	105	97.5 Å²	97.5	87%	0.868	55%	0.554	S	S	*	*			trans	-115.4	120.6	166.4	0	0	0	0	0	109.2
594	V	25.4	Very low	37.8	Very low	100 Å²	100	104.9 Å²	104.9	61%	0.606	59%	0.589	S	S	*	*			trans	-139.4	133.2	171.9	175.8	0	0	0	0	106.7	V592 D596	V592-V594 HydrophobicContact CG1-CG2 3.96Å; V594-D596 WeakPolarHBondContact CG1-OD1 3.37Å
595	D	33.2	Very low	35.4	Very low	78 Å²	78	114.6 Å²	114.6	42%	0.417	63%	0.626	S	S	.	*			trans	-105.5	100.6	170.6	177.9	3.8	0	0	0	107.9	D597 K598	D595-D597 VanDerWaalsContact C-N 3.33Å; D595-D597 PolarHBondContact OD1-N 2.86Å; D595-K598 IonicContact OD2-NZ 2.71Å; D595-K598 PolarHBondContact OD2-NZ 2.81Å
596	D	28.1	Very low	33	Very low	141 Å²	141	120.4 Å²	120.4	75%	0.754	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-24.6	-175.5	-69.9	-47.2	0	0	0	112.7	V594 K598	V594-D596 WeakPolarHBondContact CG1-OD1 3.37Å; D596-K598 VanDerWaalsContact C-N 3.29Å; D596-K598 PolarHBondContact O-N 2.94Å
597	D	31.5	Very low	30.8	Very low	159 Å²	159	124.4 Å²	124.4	85%	0.85	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-7.7	-165.4	-83.5	-17.3	0	0	0	114.5	D595	D595-D597 VanDerWaalsContact C-N 3.33Å; D595-D597 PolarHBondContact OD1-N 2.86Å
598	K	30.6	Very low	29.2	Very low	143 Å²	143	130 Å²	130	62%	0.622	70%	0.702	S	S	*	*	S	Bend	trans	-117.2	-15	176.7	-57.8	-169.9	-164.1	85.2	0	114.5	D595 D596 T600	D595-K598 IonicContact OD2-NZ 2.71Å; D595-K598 PolarHBondContact OD2-NZ 2.81Å; D596-K598 VanDerWaalsContact C-N 3.29Å; D596-K598 PolarHBondContact O-N 2.94Å; K598-T600 VanDerWaalsContact CB-OG1 3.3Å; K598-T600 WeakPolarHBondContact CB-OG1 3.37Å; K598-T600 PolarHBondContact O-N 2.73Å
599	G	25.2	Very low	28.3	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	72%	0.717	S	S	*	*	S	Bend	trans	61.6	15.6	-170.5	0	0	0	0	0	114.2
600	T	23.5	Very low	27.4	Very low	75 Å²	75	137 Å²	137	46%	0.46	72%	0.724	S	S	.	*			trans	-118.9	111	-178.4	54.3	0	0	0	0	110.2	K598 T602	K598-T600 VanDerWaalsContact CB-OG1 3.3Å; K598-T600 WeakPolarHBondContact CB-OG1 3.37Å; K598-T600 PolarHBondContact O-N 2.73Å; T600-T602 PolarHBondContact O-N 3.36Å
601	V	24.3	Very low	27.7	Very low	137 Å²	137	135.3 Å²	135.3	83%	0.83	72%	0.718	S	S	*	*			trans	-72.7	95.4	166.7	-179.8	0	0	0	0	108	A603	V601-A603 VanDerWaalsContact C-N 3.33Å; V601-A603 PolarHBondContact O-N 3.06Å
602	T	23.7	Very low	28.2	Very low	107 Å²	107	129.1 Å²	129.1	66%	0.656	70%	0.697	S	S	*	*			trans	-76.8	86.1	175.8	-55.7	0	0	0	0	109.4	T600 E604	T600-T602 PolarHBondContact O-N 3.36Å; T602-E604 VanDerWaalsContact C-N 3.26Å; T602-E604 HydrophobicContact CG2-CG 4.26Å; T602-E604 PolarHBondContact O-N 3.46Å
603	A	26.3	Very low	28.8	Very low	77 Å²	77	126.8 Å²	126.8	64%	0.636	68%	0.68	S	S	*	*			trans	-76.7	72	177.5	0	0	0	0	0	111.7	V601 Y605	V601-A603 VanDerWaalsContact C-N 3.33Å; V601-A603 PolarHBondContact O-N 3.06Å; A603-Y605 PolarHBondContact O-N 3.29Å
604	E	23.6	Very low	29.9	Very low	182 Å²	182	126.8 Å²	126.8	85%	0.85	66%	0.662	S	S	*	*			trans	-74.1	68.9	160	-75.2	-173.6	154.2	0	0	109.6	T602	T602-E604 VanDerWaalsContact C-N 3.26Å; T602-E604 HydrophobicContact CG2-CG 4.26Å; T602-E604 PolarHBondContact O-N 3.46Å
605	Y	21.7	Very low	31.4	Very low	214 Å²	214	124.3 Å²	124.3	84%	0.839	64%	0.644	S	S	*	*			trans	-111.2	133.4	166.9	-92.5	-76.8	0	0	0	110	A603 I607	A603-Y605 PolarHBondContact O-N 3.29Å; Y605-I607 PolarHBondContact O-N 3.1Å
606	D	23.9	Very low	32.5	Very low	136 Å²	136	122.6 Å²	122.6	73%	0.727	64%	0.636	S	S	*	*			trans	-69.7	86.7	-179.2	-171.5	9	0	0	0	111.6	Q608	D606-Q608 WeakPolarHBondContact O-CG 3.4Å; D606-Q608 PolarHBondContact O-N 2.77Å
607	I	25.8	Very low	34	Very low	163 Å²	163	117 Å²	117	84%	0.836	61%	0.605	S	S	*	*	S	Bend	trans	40.1	18.8	154.8	-25	-179.3	0	0	0	119.1	Y605	Y605-I607 PolarHBondContact O-N 3.1Å
608	Q	27.8	Very low	35.2	Very low	171 Å²	171	113.4 Å²	113.4	80%	0.799	58%	0.58	S	S	*	*	S	Bend	trans	-108.2	-12.8	-176.2	-70.9	-159.9	-11.5	0	0	116	D606	D606-Q608 WeakPolarHBondContact O-CG 3.4Å; D606-Q608 PolarHBondContact O-N 2.77Å
609	R	31.2	Very low	36.8	Very low	201 Å²	201	106.7 Å²	106.7	76%	0.758	55%	0.551	S	S	*	*			trans	-143.3	68.3	-175	-67.9	-169.8	167.1	159.8	3.1	114.5	Y611	R609-Y611 HydrophobicContact CB-CD2 4.41Å; R609-Y611 HydrophobicContact CB-CE2 3.85Å; R609-Y611 HydrophobicContact CG-CE2 3.72Å; R609-Y611 PolarHBondContact NE-OH 3.3Å
610	I	31.5	Very low	38.7	Very low	122 Å²	122	110.9 Å²	110.9	63%	0.626	56%	0.556	S	S	*	*			trans	-106.5	104.2	151.7	-60.6	176.6	0	0	0	106	I613	I610-I613 HydrophobicContact CG2-CD1 4.4Å; I610-I613 HydrophobicContact CG2-CG1 3.93Å
611	Y	39.9	Very low	40.4	Very low	144 Å²	144	112.7 Å²	112.7	57%	0.565	56%	0.558	S	S	*	*			trans	-84.3	-50	-179.5	-72.2	-70.1	0	0	0	111.6	R609 D674 L675	R609-Y611 HydrophobicContact CB-CD2 4.41Å; R609-Y611 HydrophobicContact CB-CE2 3.85Å; R609-Y611 HydrophobicContact CG-CE2 3.72Å; R609-Y611 PolarHBondContact NE-OH 3.3Å; Y611-D674 VanDerWaalsContact O-CA 3.28Å; Y611-D674 WeakPolarHBondContact O-CA 3.27Å; Y611-L675 PolarHBondContact O-N 3.08Å
612	S	38.1	Very low	42.2	Very low	67 Å²	67	106.2 Å²	106.2	47%	0.469	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	147.8	-178.3	62.4	0	0	0	0	113	I673 D674	S612-I673 CarbonylContact C-O 3.49Å; S612-I673 WeakPolarHBondContact CA-O 3.2Å; S612-D674 VanDerWaalsContact CB-OD1 3.26Å; S612-D674 WeakPolarHBondContact CB-OD1 3.45Å
613	I	44.2	Very low	43.9	Very low	67 Å²	67	104.6 Å²	104.6	34%	0.344	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	108.7	169.9	-57.5	-177.3	0	0	0	109.1	I610 I615 I673 L675	I610-I613 HydrophobicContact CG2-CD1 4.4Å; I610-I613 HydrophobicContact CG2-CG1 3.93Å; I613-I615 HydrophobicContact CG2-CG1 4.06Å; I613-I615 PolarHBondContact O-N 3.46Å; I613-I673 PolarHBondContact N-O 2.69Å; I613-I673 PolarHBondContact O-N 3Å; I613-L675 HydrophobicContact CD1-CD1 3.63Å; I613-L675 HydrophobicContact CG1-CD1 4.3Å
614	Q	48.6	Very low	45.6	Very low	104 Å²	104	106.4 Å²	106.4	49%	0.486	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	122.7	171.6	-170.4	178.9	-9.1	0	0	110.4	D616 D672	Q614-D616 PolarHBondContact NE2-OD1 3Å; Q614-D616 PolarHBondContact NE2-OD2 2.85Å; Q614-D672 WeakPolarHBondContact CA-OD1 3.32Å; Q614-D672 WeakPolarHBondContact CB-OD1 3.44Å; Q614-D672 WeakPolarHBondContact CG-OD1 3.46Å
615	I	57.7	Low	47.6	Very low	48 Å²	48	99.7 Å²	99.7	25%	0.246	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.5	171.4	-51.6	-170.3	0	0	0	110	I613 F617 F629 G670 F671 I673	I613-I615 HydrophobicContact CG2-CG1 4.06Å; I613-I615 PolarHBondContact O-N 3.46Å; I615-F617 HydrophobicContact CB-CE2 4.18Å; I615-F617 HydrophobicContact CG2-CD2 4.32Å; I615-F617 HydrophobicContact CG2-CE2 3.48Å; I615-F617 VanDerWaalsContact CG2-CE2 3.48Å; I615-F617 HydrophobicContact CG2-CZ 3.85Å; I615-F629 HydrophobicContact CD1-CE1 4.12Å; I615-F629 HydrophobicContact CD1-CE2 4.16Å; I615-F629 HydrophobicContact CD1-CZ 3.6Å; I615-G670 WeakPolarHBondContact O-CA 3.18Å; I615-F671 HydrophobicContact CB-CE2 4.31Å; I615-F671 HydrophobicContact CB-CZ 4.33Å; I615-F671 PolarHBondContact N-O 3.5Å; I615-F671 PolarHBondContact O-N 2.81Å; I615-I673 HydrophobicContact CD1-CD1 3.56Å; I615-I673 HydrophobicContact CG1-CD1 4.16Å
616	D	54.7	Low	49.6	Very low	43 Å²	43	90 Å²	90	23%	0.23	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.7	-178.2	-66.1	-63.8	0	0	0	113.6	Q614 Y618 R668 G670	Q614-D616 PolarHBondContact NE2-OD1 3Å; Q614-D616 PolarHBondContact NE2-OD2 2.85Å; D616-Y618 HydrophobicContact CB-CD2 4.26Å; D616-Y618 HydrophobicContact CB-CE2 3.44Å; D616-Y618 VanDerWaalsContact CB-CE2 3.44Å; D616-R668 HydrophobicContact CB-CG 4.21Å; D616-R668 IonicContact OD1-CZ 3.56Å; D616-R668 IonicContact OD1-NE 2.63Å; D616-R668 PolarHBondContact OD1-NE 3.1Å; D616-R668 IonicContact OD1-NH2 2.77Å; D616-R668 PolarHBondContact OD1-NH2 3.13Å; D616-R668 IonicContact OD2-CZ 3.92Å; D616-R668 IonicContact OD2-NE 3.49Å; D616-R668 PolarHBondContact OD2-NE 3.2Å; D616-R668 IonicContact OD2-NH2 3.48Å; D616-R668 PolarHBondContact OD2-NH2 2.97Å; D616-G670 WeakPolarHBondContact OD1-CA 3.33Å
617	F	60	Low	51.5	Low	24 Å²	24	85.1 Å²	85.1	11%	0.105	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	137.3	172.1	-63	-97.7	0	0	0	109.7	I615 A622 N625 A626 F629 R668 Y669 F671	I615-F617 HydrophobicContact CB-CE2 4.18Å; I615-F617 HydrophobicContact CG2-CD2 4.32Å; I615-F617 HydrophobicContact CG2-CE2 3.48Å; I615-F617 VanDerWaalsContact CG2-CE2 3.48Å; I615-F617 HydrophobicContact CG2-CZ 3.85Å; F617-A622 HydrophobicContact CB-CB 4.06Å; F617-A622 WeakPolarHBondContact CB-O 3.48Å; F617-A622 WeakPolarHBondContact O-CB 3.26Å; F617-N625 HydrophobicContact CD1-CB 3.56Å; F617-N625 HydrophobicContact CE1-CB 4.12Å; F617-N625 HydrophobicContact CG-CB 4.39Å; F617-A626 HydrophobicContact CB-CB 4.43Å; F617-A626 HydrophobicContact CD2-CB 3.78Å; F617-A626 HydrophobicContact CE2-CB 4.29Å; F617-A626 HydrophobicContact CG-CB 4.05Å; F617-F629 HydrophobicContact CE1-CB 4.25Å; F617-F629 HydrophobicContact CZ-CB 3.71Å; F617-F629 HydrophobicContact CZ-CD2 4.02Å; F617-F629 AromaticContact CZ-CG 3.85Å; F617-F629 HydrophobicContact CZ-CG 3.85Å; F617-R668 CarbonylContact O-C 2.87Å; F617-R668 WeakPolarHBondContact O-CA 3.38Å; F617-Y669 PolarHBondContact N-O 2.85Å; F617-Y669 PolarHBondContact O-N 2.83Å; F617-F671 AromaticContact CD2-CE1 3.78Å; F617-F671 HydrophobicContact CD2-CE1 3.78Å; F617-F671 HydrophobicContact CD2-CZ 4.42Å; F617-F671 HydrophobicContact CE2-CD1 4.37Å; F617-F671 AromaticContact CE2-CE1 3.31Å; F617-F671 HydrophobicContact CE2-CE1 3.31Å; F617-F671 AromaticContact CE2-CZ 3.52Å; F617-F671 HydrophobicContact CE2-CZ 3.52Å; F617-F671 HydrophobicContact CZ-CE1 4.25Å; F617-F671 HydrophobicContact CZ-CZ 4.2Å
618	Y	56.8	Low	53.3	Low	82 Å²	82	81.7 Å²	81.7	32%	0.322	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	148	-175.7	-66.5	-96.5	0	0	0	111.6	D616 K667 R668	D616-Y618 HydrophobicContact CB-CD2 4.26Å; D616-Y618 HydrophobicContact CB-CE2 3.44Å; D616-Y618 VanDerWaalsContact CB-CE2 3.44Å; Y618-K667 WeakPolarHBondContact CA-O 3.15Å; Y618-R668 HydrophobicContact CD1-CB 4.24Å; Y618-R668 HydrophobicContact CD1-CG 4.46Å; Y618-R668 HydrophobicContact CE1-CB 3.96Å; Y618-R668 HydrophobicContact CE1-CG 3.85Å; Y618-R668 PolarHBondContact OH-NE 2.9Å
619	G	64.8	Low	55	Low	3 Å²	3	74.6 Å²	74.6	3%	0.031	37%	0.371	C	S	.	.	S	Bend	trans	99.7	-178.2	174.9	0	0	0	0	0	113.9	K621 A622 K667	G619-K621 PolarHBondContact O-N 2.79Å; G619-A622 WeakPolarHBondContact O-CB 3.34Å; G619-A622 PolarHBondContact O-N 2.85Å; G619-K667 PolarHBondContact N-O 3.32Å; G619-K667 VanDerWaalsContact N-O 3.17Å
620	D	64.8	Low	56.4	Low	161 Å²	161	69.3 Å²	69.3	86%	0.861	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-26.6	-169.2	-57.8	-36.4	0	0	0	113.6
621	K	58.1	Low	57.7	Low	113 Å²	113	70 Å²	70	49%	0.491	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	10.8	174.2	-68.4	-172.7	158.2	-81.4	0	114	G619 C623 E624 N625	G619-K621 PolarHBondContact O-N 2.79Å; K621-C623 VanDerWaalsContact C-N 3.27Å; K621-C623 PolarHBondContact O-N 2.78Å; K621-C623 VanDerWaalsContact O-N 3.16Å; K621-E624 VanDerWaalsContact CG-OE2 3.3Å; K621-E624 WeakPolarHBondContact CG-OE2 3.46Å; K621-E624 IonicContact NZ-OE1 2.76Å; K621-E624 IonicContact NZ-OE2 2.72Å; K621-E624 PolarHBondContact NZ-OE2 3.46Å; K621-E624 PolarHBondContact O-N 2.87Å; K621-N625 PolarHBondContact O-N 3.49Å
622	A	63.7	Low	58.6	Low	1 Å²	1	64.7 Å²	64.7	1%	0.008	34%	0.341	C	S	.	.	H	α-helix	trans	-51.5	-43.4	-176.1	0	0	0	0	0	113.5	F617 G619 A626 Y669	F617-A622 HydrophobicContact CB-CB 4.06Å; F617-A622 WeakPolarHBondContact CB-O 3.48Å; F617-A622 WeakPolarHBondContact O-CB 3.26Å; G619-A622 WeakPolarHBondContact O-CB 3.34Å; G619-A622 PolarHBondContact O-N 2.85Å; A622-A626 VanDerWaalsContact O-CB 3.24Å; A622-A626 WeakPolarHBondContact O-CB 3.42Å; A622-A626 PolarHBondContact O-N 2.68Å; A622-Y669 HydrophobicContact CB-CD2 3.96Å
623	C	58.4	Low	59.5	Low	73 Å²	73	63 Å²	63	49%	0.493	33%	0.327	S	S	.	.	H	α-helix	trans	-68.7	-35.7	178.2	-169.9	0	0	0	0	113.1	K621 G627 Y669	K621-C623 VanDerWaalsContact C-N 3.27Å; K621-C623 PolarHBondContact O-N 2.78Å; K621-C623 VanDerWaalsContact O-N 3.16Å; C623-G627 PolarHBondContact O-N 2.95Å; C623-Y669 HydrophobicContact CB-CD1 4.3Å; C623-Y669 HydrophobicContact CB-CD2 4.1Å; C623-Y669 HydrophobicContact CB-CE1 4.23Å; C623-Y669 HydrophobicContact CB-CE2 4.02Å; C623-Y669 HydrophobicContact CB-CG 4.24Å
624	E	61.5	Low	60	Low	116 Å²	116	64 Å²	64	54%	0.542	33%	0.331	S	S	.	.	H	α-helix	trans	-71.8	-43.3	176.5	-66.9	179.3	146.3	0	0	111.4	K621 A626 G627 L628	K621-E624 VanDerWaalsContact CG-OE2 3.3Å; K621-E624 WeakPolarHBondContact CG-OE2 3.46Å; K621-E624 IonicContact NZ-OE1 2.76Å; K621-E624 IonicContact NZ-OE2 2.72Å; K621-E624 PolarHBondContact NZ-OE2 3.46Å; K621-E624 PolarHBondContact O-N 2.87Å; E624-A626 VanDerWaalsContact C-N 3.35Å; E624-G627 PolarHBondContact O-N 3.38Å; E624-L628 WeakPolarHBondContact O-CB 3.42Å; E624-L628 PolarHBondContact O-N 2.95Å
625	N	66.2	Low	60.3	Low	40 Å²	40	65.7 Å²	65.7	21%	0.214	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-40	177.3	-67.8	-0.4	0	0	0	111.3	F617 K621 L628 F629	F617-N625 HydrophobicContact CD1-CB 3.56Å; F617-N625 HydrophobicContact CE1-CB 4.12Å; F617-N625 HydrophobicContact CG-CB 4.39Å; K621-N625 PolarHBondContact O-N 3.49Å; N625-L628 PolarHBondContact O-N 2.82Å; N625-F629 WeakPolarHBondContact O-CB 3.28Å; N625-F629 PolarHBondContact O-N 2.89Å
626	A	64.7	Low	60	Low	11 Å²	11	66.4 Å²	66.4	9%	0.091	34%	0.343	C	S	.	.	H	α-helix	trans	-61.8	-44.4	172.8	0	0	0	0	0	112	F617 A622 E624 F629 N630 F671	F617-A626 HydrophobicContact CB-CB 4.43Å; F617-A626 HydrophobicContact CD2-CB 3.78Å; F617-A626 HydrophobicContact CE2-CB 4.29Å; F617-A626 HydrophobicContact CG-CB 4.05Å; A622-A626 VanDerWaalsContact O-CB 3.24Å; A622-A626 WeakPolarHBondContact O-CB 3.42Å; A622-A626 PolarHBondContact O-N 2.68Å; E624-A626 VanDerWaalsContact C-N 3.35Å; A626-F629 PolarHBondContact O-N 2.95Å; A626-N630 WeakPolarHBondContact O-CB 3.21Å; A626-N630 PolarHBondContact O-N 2.93Å; A626-F671 HydrophobicContact CB-CD1 4.06Å; A626-F671 HydrophobicContact CB-CE1 3.71Å
627	G	63.2	Low	59.7	Low	33 Å²	33	69.4 Å²	69.4	34%	0.34	36%	0.359	S	S	.	.	H	α-helix	trans	-62.3	-43.4	175.7	0	0	0	0	0	113.2	C623 E624 N630 Q631	C623-G627 PolarHBondContact O-N 2.95Å; E624-G627 PolarHBondContact O-N 3.38Å; G627-N630 PolarHBondContact O-N 3.09Å; G627-Q631 WeakPolarHBondContact O-CG 3.38Å; G627-Q631 PolarHBondContact O-N 3.3Å
628	L	63.5	Low	59.1	Low	92 Å²	92	75 Å²	75	48%	0.482	39%	0.386	S	S	.	.	H	α-helix	trans	-67.5	-39.9	178.8	-170.8	69.8	0	0	0	111.9	E624 N625 Q631 T632	E624-L628 WeakPolarHBondContact O-CB 3.42Å; E624-L628 PolarHBondContact O-N 2.95Å; N625-L628 PolarHBondContact O-N 2.82Å; L628-Q631 PolarHBondContact O-N 2.69Å; L628-T632 WeakPolarHBondContact O-CB 3.45Å; L628-T632 PolarHBondContact O-N 2.88Å; L628-T632 PolarHBondContact O-OG1 2.87Å
629	F	63.7	Low	58.4	Low	21 Å²	21	75.4 Å²	75.4	9%	0.092	39%	0.393	C	S	.	.	H	α-helix	trans	-58.9	-49.6	172.5	177.4	-79.9	0	0	0	110.8	I615 F617 N625 A626 Q631 T632 L633 I650 F671 I673	I615-F629 HydrophobicContact CD1-CE1 4.12Å; I615-F629 HydrophobicContact CD1-CE2 4.16Å; I615-F629 HydrophobicContact CD1-CZ 3.6Å; F617-F629 HydrophobicContact CE1-CB 4.25Å; F617-F629 HydrophobicContact CZ-CB 3.71Å; F617-F629 HydrophobicContact CZ-CD2 4.02Å; F617-F629 AromaticContact CZ-CG 3.85Å; F617-F629 HydrophobicContact CZ-CG 3.85Å; N625-F629 WeakPolarHBondContact O-CB 3.28Å; N625-F629 PolarHBondContact O-N 2.89Å; A626-F629 PolarHBondContact O-N 2.95Å; F629-Q631 PolarHBondContact O-N 2.67Å; F629-T632 PolarHBondContact O-N 3.15Å; F629-T632 VanDerWaalsContact O-N 3.15Å; F629-L633 HydrophobicContact CE1-CB 4.22Å; F629-L633 HydrophobicContact CE1-CD2 3.84Å; F629-L633 HydrophobicContact CZ-CD2 4.44Å; F629-L633 WeakPolarHBondContact O-CB 3.43Å; F629-L633 PolarHBondContact O-N 3.08Å; F629-I650 HydrophobicContact CD2-CG2 4.25Å; F629-I650 HydrophobicContact CE2-CD1 4.15Å; F629-F671 HydrophobicContact CD1-CE1 4.49Å; F629-F671 AromaticContact CD1-CE2 3.9Å; F629-F671 HydrophobicContact CD1-CE2 3.9Å; F629-F671 AromaticContact CD1-CZ 3.39Å; F629-F671 HydrophobicContact CD1-CZ 3.39Å; F629-F671 AromaticContact CE1-CE2 3.89Å; F629-F671 HydrophobicContact CE1-CE2 3.89Å; F629-F671 AromaticContact CE1-CZ 3.83Å; F629-F671 HydrophobicContact CE1-CZ 3.83Å; F629-F671 HydrophobicContact CG-CZ 4.12Å; F629-I673 HydrophobicContact CE1-CD1 3.79Å; F629-I673 HydrophobicContact CZ-CD1 4.06Å
630	N	60.8	Low	57.3	Low	90 Å²	90	84.3 Å²	84.3	48%	0.481	43%	0.434	S	S	.	.	H	α-helix	trans	-61.1	-42.8	-178.5	-171.3	16.1	0	0	0	111.8	A626 G627 T632 L633 M634	A626-N630 WeakPolarHBondContact O-CB 3.21Å; A626-N630 PolarHBondContact O-N 2.93Å; G627-N630 PolarHBondContact O-N 3.09Å; N630-T632 PolarHBondContact O-N 2.93Å; N630-L633 PolarHBondContact O-N 2.84Å; N630-M634 WeakPolarHBondContact O-CB 3.38Å; N630-M634 PolarHBondContact O-N 2.96Å
631	Q	58.4	Low	56.1	Low	137 Å²	137	85.5 Å²	85.5	64%	0.64	43%	0.434	S	S	*	.	H	α-helix	trans	-61.7	-43	173.8	-73.7	-178.2	-8.3	0	0	112.6	G627 L628 F629 M634 Q635	G627-Q631 WeakPolarHBondContact O-CG 3.38Å; G627-Q631 PolarHBondContact O-N 3.3Å; L628-Q631 PolarHBondContact O-N 2.69Å; F629-Q631 PolarHBondContact O-N 2.67Å; Q631-M634 PolarHBondContact O-N 2.94Å; Q631-Q635 WeakPolarHBondContact O-CB 3.48Å; Q631-Q635 PolarHBondContact O-N 2.92Å
632	T	58.6	Low	55.1	Low	33 Å²	33	84.5 Å²	84.5	20%	0.202	43%	0.434	C	S	.	.	H	α-helix	trans	-66.8	-40.8	179.5	-50.9	0	0	0	0	111.4	L628 F629 N630 Q635 N636	L628-T632 WeakPolarHBondContact O-CB 3.45Å; L628-T632 PolarHBondContact O-N 2.88Å; L628-T632 PolarHBondContact O-OG1 2.87Å; F629-T632 PolarHBondContact O-N 3.15Å; F629-T632 VanDerWaalsContact O-N 3.15Å; N630-T632 PolarHBondContact O-N 2.93Å; T632-Q635 PolarHBondContact O-N 3Å; T632-N636 WeakPolarHBondContact O-CB 3.48Å; T632-N636 VanDerWaalsContact O-CG 3.23Å; T632-N636 PolarHBondContact O-N 3.21Å
633	L	57.6	Low	53.8	Low	31 Å²	31	92.4 Å²	92.4	16%	0.162	48%	0.476	C	S	.	.	H	α-helix	trans	-64.4	-48.1	175.9	179.4	60.8	0	0	0	111.3	F629 N630 Q635 N636 L637 L647 I673	F629-L633 HydrophobicContact CE1-CB 4.22Å; F629-L633 HydrophobicContact CE1-CD2 3.84Å; F629-L633 HydrophobicContact CZ-CD2 4.44Å; F629-L633 WeakPolarHBondContact O-CB 3.43Å; F629-L633 PolarHBondContact O-N 3.08Å; N630-L633 PolarHBondContact O-N 2.84Å; L633-Q635 VanDerWaalsContact C-N 3.32Å; L633-Q635 PolarHBondContact O-N 2.89Å; L633-N636 PolarHBondContact O-N 3.12Å; L633-L637 HydrophobicContact CD1-CD1 3.94Å; L633-L637 HydrophobicContact CD1-CG 4.25Å; L633-L637 HydrophobicContact CG-CD1 3.88Å; L633-L637 WeakPolarHBondContact O-CB 3.38Å; L633-L637 VanDerWaalsContact O-CG 3.28Å; L633-L637 WeakPolarHBondContact O-CG 3.04Å; L633-L637 PolarHBondContact O-N 2.76Å; L633-L647 HydrophobicContact CD1-CD2 4.3Å; L633-I673 HydrophobicContact CD2-CD1 3.96Å; L633-I673 HydrophobicContact CD2-CG2 4.44Å
634	M	53.4	Low	52.6	Low	88 Å²	88	97.6 Å²	97.6	43%	0.433	49%	0.49	S	S	.	.	H	α-helix	trans	-57.5	-43.4	175.2	-86.3	-59.8	-43.6	0	0	112.4	N630 Q631 L637 Q638	N630-M634 WeakPolarHBondContact O-CB 3.38Å; N630-M634 PolarHBondContact O-N 2.96Å; Q631-M634 PolarHBondContact O-N 2.94Å; M634-L637 PolarHBondContact O-N 2.87Å; M634-Q638 HydrophobicContact CE-CG 4.19Å; M634-Q638 WeakPolarHBondContact O-CG 3.49Å; M634-Q638 PolarHBondContact O-N 2.94Å
635	Q	56.7	Low	51.5	Low	140 Å²	140	95.5 Å²	95.5	65%	0.654	49%	0.485	S	S	*	.	H	α-helix	trans	-67.4	-43.3	179.9	-170.3	169.5	1.7	0	0	111.6	Q631 T632 L633 L637 Q638 D639	Q631-Q635 WeakPolarHBondContact O-CB 3.48Å; Q631-Q635 PolarHBondContact O-N 2.92Å; T632-Q635 PolarHBondContact O-N 3Å; L633-Q635 VanDerWaalsContact C-N 3.32Å; L633-Q635 PolarHBondContact O-N 2.89Å; Q635-L637 PolarHBondContact O-N 2.79Å; Q635-Q638 PolarHBondContact O-N 3.39Å; Q635-D639 PolarHBondContact O-N 2.82Å
636	N	50.2	Low	50.2	Low	62 Å²	62	96.4 Å²	96.4	33%	0.332	50%	0.495	S	S	.	.	H	α-helix	trans	-67.3	-18.4	175.6	-70.6	-9.3	0	0	0	113.6	T632 L633 V645	T632-N636 WeakPolarHBondContact O-CB 3.48Å; T632-N636 VanDerWaalsContact O-CG 3.23Å; T632-N636 PolarHBondContact O-N 3.21Å; L633-N636 PolarHBondContact O-N 3.12Å; N636-V645 HydrophobicContact CB-CG1 4.47Å
637	L	49.7	Very low	48.9	Very low	107 Å²	107	101.6 Å²	101.6	56%	0.56	52%	0.521	S	S	*	.	H	α-helix	trans	-90.9	-13.8	175.2	-74.9	168.8	0	0	0	113.7	L633 M634 Q635 V645	L633-L637 HydrophobicContact CD1-CD1 3.94Å; L633-L637 HydrophobicContact CD1-CG 4.25Å; L633-L637 HydrophobicContact CG-CD1 3.88Å; L633-L637 WeakPolarHBondContact O-CB 3.38Å; L633-L637 VanDerWaalsContact O-CG 3.28Å; L633-L637 WeakPolarHBondContact O-CG 3.04Å; L633-L637 PolarHBondContact O-N 2.76Å; M634-L637 PolarHBondContact O-N 2.87Å; Q635-L637 PolarHBondContact O-N 2.79Å; L637-V645 HydrophobicContact CD2-CG1 4.16Å; L637-V645 HydrophobicContact CD2-CG2 4.38Å
638	Q	46.1	Very low	47.8	Very low	142 Å²	142	108.8 Å²	108.8	66%	0.664	54%	0.542	S	S	*	.	H	α-helix	trans	-98.9	-8.3	179.5	-76.3	-172.4	-31.2	0	0	114	M634 Q635 E640	M634-Q638 HydrophobicContact CE-CG 4.19Å; M634-Q638 WeakPolarHBondContact O-CG 3.49Å; M634-Q638 PolarHBondContact O-N 2.94Å; Q635-Q638 PolarHBondContact O-N 3.39Å; Q638-E640 PolarHBondContact O-N 3.3Å
639	D	41.9	Very low	46.6	Very low	89 Å²	89	113.4 Å²	113.4	48%	0.476	56%	0.555	S	S	.	*			trans	-89.7	80.8	-174.3	-157.6	26.1	0	0	0	110.9	Q635 E641 N642	Q635-D639 PolarHBondContact O-N 2.82Å; D639-E641 PolarHBondContact O-N 2.98Å; D639-N642 PolarHBondContact O-N 3.15Å; D639-N642 PolarHBondContact OD2-ND2 3.11Å
640	E	41.6	Very low	45.6	Very low	190 Å²	190	116.3 Å²	116.3	89%	0.888	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-19.2	-170.3	-67	-174.1	161.4	0	0	115.1	Q638 N642	Q638-E640 PolarHBondContact O-N 3.3Å; E640-N642 PolarHBondContact O-N 2.95Å
641	E	41.1	Very low	44.7	Very low	186 Å²	186	114 Å²	114	87%	0.869	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-9.3	175.4	-68.2	-162.8	140.2	0	0	113.8	D639	D639-E641 PolarHBondContact O-N 2.98Å
642	N	36.5	Very low	44	Very low	93 Å²	93	115.5 Å²	115.5	50%	0.497	58%	0.58	S	S	.	*			trans	-106.2	84	-178.9	-79.9	-70.2	0	0	0	113.4	D639 E640 K644	D639-N642 PolarHBondContact O-N 3.15Å; D639-N642 PolarHBondContact OD2-ND2 3.11Å; E640-N642 PolarHBondContact O-N 2.95Å; N642-K644 PolarHBondContact O-N 2.9Å
643	D	37.2	Very low	43.2	Very low	166 Å²	166	117 Å²	117	89%	0.888	59%	0.589	S	S	*	*	S	Bend	trans	-48.6	-6.6	169.6	-94.4	-20.7	0	0	0	116
644	K	31.5	Very low	42.4	Very low	182 Å²	182	120.9 Å²	120.9	79%	0.791	61%	0.607	S	S	*	*	S	Bend	trans	-141	79.4	-176.9	-64.8	-176.2	-177.7	173.3	0	111.5	N642 S646	N642-K644 PolarHBondContact O-N 2.9Å; K644-S646 PolarHBondContact O-N 2.77Å
645	V	40.3	Very low	41.8	Very low	72 Å²	72	123.2 Å²	123.2	44%	0.436	62%	0.621	S	S	.	*			trans	-57.9	98.4	171.5	-177	0	0	0	0	110	N636 L637	N636-V645 HydrophobicContact CB-CG1 4.47Å; L637-V645 HydrophobicContact CD2-CG1 4.16Å; L637-V645 HydrophobicContact CD2-CG2 4.38Å
646	S	37.9	Very low	40.8	Very low	59 Å²	59	124.2 Å²	124.2	41%	0.413	62%	0.619	S	S	.	*			trans	-96.7	109.8	-174.7	-166.2	0	0	0	0	111.4	K644 K648 Y649	K644-S646 PolarHBondContact O-N 2.77Å; S646-K648 PolarHBondContact O-N 3.2Å; S646-K648 WeakPolarHBondContact OG-CB 3.07Å; S646-Y649 PolarHBondContact O-N 3.18Å
647	L	37.9	Very low	40.3	Very low	121 Å²	121	127.2 Å²	127.2	63%	0.634	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	5.1	169.9	-64.7	175.7	0	0	0	114.3	L633 I650	L633-L647 HydrophobicContact CD1-CD2 4.3Å; L647-I650 WeakPolarHBondContact O-CG1 3.43Å
648	K	40.5	Very low	39.8	Very low	183 Å²	183	131.2 Å²	131.2	80%	0.796	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-18.6	175.7	-154.8	173.1	-173.7	177.9	0	113.2	S646	S646-K648 PolarHBondContact O-N 3.2Å; S646-K648 WeakPolarHBondContact OG-CB 3.07Å
649	Y	37.9	Very low	39.4	Very low	190 Å²	190	128.5 Å²	128.5	75%	0.745	64%	0.642	S	S	*	*			trans	-103.7	58.2	175.3	-72	-77.2	0	0	0	111.6	S646	S646-Y649 PolarHBondContact O-N 3.18Å
650	I	41.8	Very low	39.3	Very low	81 Å²	81	127.5 Å²	127.5	42%	0.415	65%	0.646	S	S	.	*			trans	-78.3	117.6	161.2	-51.8	170.9	0	0	0	106	F629 L647 V653	F629-I650 HydrophobicContact CD2-CG2 4.25Å; F629-I650 HydrophobicContact CE2-CD1 4.15Å; L647-I650 WeakPolarHBondContact O-CG1 3.43Å; I650-V653 HydrophobicContact CG2-CG2 3.9Å
651	G	41.7	Very low	39.3	Very low	42 Å²	42	126.8 Å²	126.8	43%	0.433	64%	0.642	S	S	.	*			trans	-59.1	158	179	0	0	0	0	0	112.5	V653	G651-V653 WeakPolarHBondContact O-CG2 2.89Å; G651-V653 PolarHBondContact O-N 3Å
652	D	43.3	Very low	39.7	Very low	168 Å²	168	122.4 Å²	122.4	90%	0.898	63%	0.625	S	S	*	*			trans	-50.3	84.3	-165.1	-68.3	-47.3	0	0	0	115.5	E654	D652-E654 PolarHBondContact O-N 3.33Å
653	V	43.7	Very low	40	Very low	65 Å²	65	124.1 Å²	124.1	39%	0.394	63%	0.628	S	S	.	*			trans	-68.4	121.9	168.6	-176.2	0	0	0	0	107.5	I650 G651 N655	I650-V653 HydrophobicContact CG2-CG2 3.9Å; G651-V653 WeakPolarHBondContact O-CG2 2.89Å; G651-V653 PolarHBondContact O-N 3Å; V653-N655 VanDerWaalsContact C-N 3.26Å; V653-N655 PolarHBondContact O-N 3.47Å
654	E	40.5	Very low	40.5	Very low	112 Å²	112	123.7 Å²	123.7	52%	0.523	62%	0.621	S	S	.	*			trans	-64.4	81.2	178.9	-76.7	-159.6	160.4	0	0	112.1	D652 R656	D652-E654 PolarHBondContact O-N 3.33Å; E654-R656 HydrophobicContact CB-CG 4.49Å; E654-R656 PolarHBondContact O-N 3.3Å; E654-R656 IonicContact OE1-CZ 2.64Å; E654-R656 IonicContact OE1-NH2 2.65Å; E654-R656 PolarHBondContact OE1-NH2 2.92Å; E654-R656 IonicContact OE2-CZ 2.63Å; E654-R656 IonicContact OE2-NE 3.73Å; E654-R656 PolarHBondContact OE2-NE 2.91Å; E654-R656 IonicContact OE2-NH2 2.77Å; E654-R656 PolarHBondContact OE2-NH2 3.26Å
655	N	39.5	Very low	41.4	Very low	137 Å²	137	123.5 Å²	123.5	73%	0.733	62%	0.616	S	S	*	*			trans	-75.3	75.8	175.5	-170.8	-3.2	0	0	0	110.1	V653 V657	V653-N655 VanDerWaalsContact C-N 3.26Å; V653-N655 PolarHBondContact O-N 3.47Å; N655-V657 VanDerWaalsContact C-N 3.3Å; N655-V657 PolarHBondContact O-N 2.87Å
656	R	36.1	Very low	42	Very low	162 Å²	162	122.5 Å²	122.5	61%	0.611	61%	0.607	S	S	*	*			trans	-71.5	88.5	174.3	-63.7	-172.2	-174.6	-119.9	-2.3	109	E654 F658 L659	E654-R656 HydrophobicContact CB-CG 4.49Å; E654-R656 PolarHBondContact O-N 3.3Å; E654-R656 IonicContact OE1-CZ 2.64Å; E654-R656 IonicContact OE1-NH2 2.65Å; E654-R656 PolarHBondContact OE1-NH2 2.92Å; E654-R656 IonicContact OE2-CZ 2.63Å; E654-R656 IonicContact OE2-NE 3.73Å; E654-R656 PolarHBondContact OE2-NE 2.91Å; E654-R656 IonicContact OE2-NH2 2.77Å; E654-R656 PolarHBondContact OE2-NH2 3.26Å; R656-F658 PolarHBondContact O-N 3.4Å; R656-L659 PolarHBondContact O-N 3.18Å
657	V	41	Very low	42.7	Very low	124 Å²	124	126.9 Å²	126.9	75%	0.752	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-40.3	-26.2	-177.2	-178.1	0	0	0	0	115.1	N655 L659	N655-V657 VanDerWaalsContact C-N 3.3Å; N655-V657 PolarHBondContact O-N 2.87Å; V657-L659 VanDerWaalsContact C-N 3.25Å; V657-L659 PolarHBondContact O-N 3.43Å
658	F	38.4	Very low	43.2	Very low	191 Å²	191	127.5 Å²	127.5	84%	0.838	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-66	-13.5	-178.9	-155.4	-99.7	0	0	0	115.7	R656	R656-F658 PolarHBondContact O-N 3.4Å
659	L	38.3	Very low	43.8	Very low	85 Å²	85	124.6 Å²	124.6	45%	0.445	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-89.6	1.6	-174	-63.8	-177	0	0	0	115.6	R656 V657 E661	R656-L659 PolarHBondContact O-N 3.18Å; V657-L659 VanDerWaalsContact C-N 3.25Å; V657-L659 PolarHBondContact O-N 3.43Å; L659-E661 VanDerWaalsContact C-N 3.3Å; L659-E661 PolarHBondContact O-N 3.36Å
660	A	39.4	Very low	44.4	Very low	68 Å²	68	117.5 Å²	117.5	56%	0.562	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-61	-33	-176	0	0	0	0	0	114.4	N662	A660-N662 PolarHBondContact O-N 3.2Å
661	E	41.9	Very low	44.9	Very low	175 Å²	175	116.1 Å²	116.1	82%	0.818	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-81.7	-12.4	-167.3	-60.5	-174.2	162.4	0	0	115.2	L659	L659-E661 VanDerWaalsContact C-N 3.3Å; L659-E661 PolarHBondContact O-N 3.36Å
662	N	47.8	Very low	45.1	Very low	94 Å²	94	118.9 Å²	118.9	50%	0.503	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-128.2	25.6	-170.4	-85.8	-76.5	0	0	0	115.1	A660 Q664 Y665	A660-N662 PolarHBondContact O-N 3.2Å; N662-Q664 PolarHBondContact O-N 3.43Å; N662-Q664 VanDerWaalsContact O-N 3.08Å; N662-Y665 PolarHBondContact O-N 3.13Å
663	K	43.2	Very low	45.2	Very low	130 Å²	130	112.2 Å²	112.2	57%	0.565	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-50.5	-36.2	-177.1	-70.1	-173.8	178.6	-173.7	0	114.9	Y665 Q666	K663-Y665 PolarHBondContact O-N 3.14Å; K663-Y665 VanDerWaalsContact O-N 3.15Å; K663-Q666 PolarHBondContact O-N 3.03Å
664	Q	48.6	Very low	45.1	Very low	156 Å²	156	115.1 Å²	115.1	73%	0.729	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-67	-13.7	-174.9	74.8	177.2	-2.2	0	0	115.2	N662	N662-Q664 PolarHBondContact O-N 3.43Å; N662-Q664 VanDerWaalsContact O-N 3.08Å
665	Y	50.1	Low	45.1	Very low	178 Å²	178	113.1 Å²	113.1	70%	0.698	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-112	1.4	-177.9	-61.5	-53.9	0	0	0	114	N662 K663	N662-Y665 PolarHBondContact O-N 3.13Å; K663-Y665 PolarHBondContact O-N 3.14Å; K663-Y665 VanDerWaalsContact O-N 3.15Å
666	Q	52.8	Low	44.9	Very low	51 Å²	51	113.4 Å²	113.4	24%	0.238	55%	0.545	C	S	.	.	S	Bend	trans	-95.4	149.7	-179.1	-67	-162.7	-29.4	0	0	112.3	K663 R668	K663-Q666 PolarHBondContact O-N 3.03Å; Q666-R668 PolarHBondContact O-N 2.95Å
667	K	52.2	Low	44.7	Very low	151 Å²	151	114.4 Å²	114.4	66%	0.657	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-63	128.3	171.5	-68.6	-178.8	179.8	177.4	0	109.4	Y618 G619	Y618-K667 WeakPolarHBondContact CA-O 3.15Å; G619-K667 PolarHBondContact N-O 3.32Å; G619-K667 VanDerWaalsContact N-O 3.17Å
668	R	49.7	Very low	44	Very low	135 Å²	135	115.9 Å²	115.9	51%	0.509	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.6	126.6	174.9	-177.5	-179.2	-179.8	175.4	5.5	108.3	D616 F617 Y618 Q666	D616-R668 HydrophobicContact CB-CG 4.21Å; D616-R668 IonicContact OD1-CZ 3.56Å; D616-R668 IonicContact OD1-NE 2.63Å; D616-R668 PolarHBondContact OD1-NE 3.1Å; D616-R668 IonicContact OD1-NH2 2.77Å; D616-R668 PolarHBondContact OD1-NH2 3.13Å; D616-R668 IonicContact OD2-CZ 3.92Å; D616-R668 IonicContact OD2-NE 3.49Å; D616-R668 PolarHBondContact OD2-NE 3.2Å; D616-R668 IonicContact OD2-NH2 3.48Å; D616-R668 PolarHBondContact OD2-NH2 2.97Å; F617-R668 CarbonylContact O-C 2.87Å; F617-R668 WeakPolarHBondContact O-CA 3.38Å; Y618-R668 HydrophobicContact CD1-CB 4.24Å; Y618-R668 HydrophobicContact CD1-CG 4.46Å; Y618-R668 HydrophobicContact CE1-CB 3.96Å; Y618-R668 HydrophobicContact CE1-CG 3.85Å; Y618-R668 PolarHBondContact OH-NE 2.9Å; Q666-R668 PolarHBondContact O-N 2.95Å
669	Y	52.1	Low	43.5	Very low	121 Å²	121	115.1 Å²	115.1	48%	0.475	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	103.9	164.2	-87	-95.9	0	0	0	107.4	F617 A622 C623	F617-Y669 PolarHBondContact N-O 2.85Å; F617-Y669 PolarHBondContact O-N 2.83Å; A622-Y669 HydrophobicContact CB-CD2 3.96Å; C623-Y669 HydrophobicContact CB-CD1 4.3Å; C623-Y669 HydrophobicContact CB-CD2 4.1Å; C623-Y669 HydrophobicContact CB-CE1 4.23Å; C623-Y669 HydrophobicContact CB-CE2 4.02Å; C623-Y669 HydrophobicContact CB-CG 4.24Å
670	G	51.4	Low	43	Very low	42 Å²	42	116.1 Å²	116.1	43%	0.433	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95	149.4	169.5	0	0	0	0	0	110.6	I615 D616	I615-G670 WeakPolarHBondContact O-CA 3.18Å; D616-G670 WeakPolarHBondContact OD1-CA 3.33Å
671	F	51.7	Low	42.4	Very low	52 Å²	52	118.8 Å²	118.8	23%	0.228	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-138.3	151.3	157.6	55.8	-95.3	0	0	0	108.8	I615 F617 A626 F629 I673	I615-F671 HydrophobicContact CB-CE2 4.31Å; I615-F671 HydrophobicContact CB-CZ 4.33Å; I615-F671 PolarHBondContact N-O 3.5Å; I615-F671 PolarHBondContact O-N 2.81Å; F617-F671 AromaticContact CD2-CE1 3.78Å; F617-F671 HydrophobicContact CD2-CE1 3.78Å; F617-F671 HydrophobicContact CD2-CZ 4.42Å; F617-F671 HydrophobicContact CE2-CD1 4.37Å; F617-F671 AromaticContact CE2-CE1 3.31Å; F617-F671 HydrophobicContact CE2-CE1 3.31Å; F617-F671 AromaticContact CE2-CZ 3.52Å; F617-F671 HydrophobicContact CE2-CZ 3.52Å; F617-F671 HydrophobicContact CZ-CE1 4.25Å; F617-F671 HydrophobicContact CZ-CZ 4.2Å; A626-F671 HydrophobicContact CB-CD1 4.06Å; A626-F671 HydrophobicContact CB-CE1 3.71Å; F629-F671 HydrophobicContact CD1-CE1 4.49Å; F629-F671 AromaticContact CD1-CE2 3.9Å; F629-F671 HydrophobicContact CD1-CE2 3.9Å; F629-F671 AromaticContact CD1-CZ 3.39Å; F629-F671 HydrophobicContact CD1-CZ 3.39Å; F629-F671 AromaticContact CE1-CE2 3.89Å; F629-F671 HydrophobicContact CE1-CE2 3.89Å; F629-F671 AromaticContact CE1-CZ 3.83Å; F629-F671 HydrophobicContact CE1-CZ 3.83Å; F629-F671 HydrophobicContact CG-CZ 4.12Å; F671-I673 HydrophobicContact CD2-CG1 4Å; F671-I673 HydrophobicContact CE2-CD1 4.06Å; F671-I673 HydrophobicContact CE2-CG1 3.8Å
672	D	45.7	Very low	41.9	Very low	100 Å²	100	116 Å²	116	54%	0.535	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	133	176.5	-56.3	-60.5	0	0	0	109.1	Q614	Q614-D672 WeakPolarHBondContact CA-OD1 3.32Å; Q614-D672 WeakPolarHBondContact CB-OD1 3.44Å; Q614-D672 WeakPolarHBondContact CG-OD1 3.46Å
673	I	45.3	Very low	41.3	Very low	28 Å²	28	113.4 Å²	113.4	14%	0.144	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	109	171.3	-51.7	173.9	0	0	0	107.7	S612 I613 I615 F629 L633 F671 L675	S612-I673 CarbonylContact C-O 3.49Å; S612-I673 WeakPolarHBondContact CA-O 3.2Å; I613-I673 PolarHBondContact N-O 2.69Å; I613-I673 PolarHBondContact O-N 3Å; I615-I673 HydrophobicContact CD1-CD1 3.56Å; I615-I673 HydrophobicContact CG1-CD1 4.16Å; F629-I673 HydrophobicContact CE1-CD1 3.79Å; F629-I673 HydrophobicContact CZ-CD1 4.06Å; L633-I673 HydrophobicContact CD2-CD1 3.96Å; L633-I673 HydrophobicContact CD2-CG2 4.44Å; F671-I673 HydrophobicContact CD2-CG1 4Å; F671-I673 HydrophobicContact CE2-CD1 4.06Å; F671-I673 HydrophobicContact CE2-CG1 3.8Å; I673-L675 HydrophobicContact CG2-CD2 3.72Å; I673-L675 HydrophobicContact CG2-CG 4.11Å
674	D	42.2	Very low	41	Very low	125 Å²	125	109.3 Å²	109.3	67%	0.668	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	127.7	167.8	-68.2	-35.8	0	0	0	110	Y611 S612	Y611-D674 VanDerWaalsContact O-CA 3.28Å; Y611-D674 WeakPolarHBondContact O-CA 3.27Å; S612-D674 VanDerWaalsContact CB-OD1 3.26Å; S612-D674 WeakPolarHBondContact CB-OD1 3.45Å
675	L	40.5	Very low	40.7	Very low	70 Å²	70	104.2 Å²	104.2	37%	0.366	51%	0.505	S	S	.	.			trans	-111.7	95.7	-174.2	-70.6	179	0	0	0	112.4	Y611 I613 I673 F677	Y611-L675 PolarHBondContact O-N 3.08Å; I613-L675 HydrophobicContact CD1-CD1 3.63Å; I613-L675 HydrophobicContact CG1-CD1 4.3Å; I673-L675 HydrophobicContact CG2-CD2 3.72Å; I673-L675 HydrophobicContact CG2-CG 4.11Å; L675-F677 HydrophobicContact CB-CD2 4.31Å; L675-F677 HydrophobicContact CB-CE2 3.89Å; L675-F677 HydrophobicContact CD1-CE2 4.29Å; L675-F677 PolarHBondContact O-N 3.21Å
676	E	34.8	Very low	40.1	Very low	144 Å²	144	98.8 Å²	98.8	67%	0.673	49%	0.487	S	S	*	.			trans	-88.1	90.2	-179.4	-163.2	-167.1	-164.2	0	0	112.6	K678	E676-K678 HydrophobicContact CG-CG 4.24Å; E676-K678 PolarHBondContact O-N 3.18Å; E676-K678 WeakPolarHBondContact OE1-CE 3.36Å; E676-K678 IonicContact OE1-NZ 2.69Å; E676-K678 PolarHBondContact OE1-NZ 3.17Å; E676-K678 WeakPolarHBondContact OE2-CE 3.4Å; E676-K678 IonicContact OE2-NZ 2.7Å; E676-K678 PolarHBondContact OE2-NZ 3.38Å
677	F	31.7	Very low	39.8	Very low	183 Å²	183	96.5 Å²	96.5	80%	0.803	48%	0.476	S	S	*	.			trans	-75	79.9	178.3	-75.5	-83.5	0	0	0	113.5	L675 Q679	L675-F677 HydrophobicContact CB-CD2 4.31Å; L675-F677 HydrophobicContact CB-CE2 3.89Å; L675-F677 HydrophobicContact CD1-CE2 4.29Å; L675-F677 PolarHBondContact O-N 3.21Å; F677-Q679 VanDerWaalsContact C-N 3.34Å; F677-Q679 PolarHBondContact O-N 3Å
678	K	26.4	Very low	39.6	Very low	155 Å²	155	89.6 Å²	89.6	67%	0.674	45%	0.447	S	S	*	.			trans	-74.3	72.9	173.8	-80.7	174.5	166.7	137.4	0	113.5	E676	E676-K678 HydrophobicContact CG-CG 4.24Å; E676-K678 PolarHBondContact O-N 3.18Å; E676-K678 WeakPolarHBondContact OE1-CE 3.36Å; E676-K678 IonicContact OE1-NZ 2.69Å; E676-K678 PolarHBondContact OE1-NZ 3.17Å; E676-K678 WeakPolarHBondContact OE2-CE 3.4Å; E676-K678 IonicContact OE2-NZ 2.7Å; E676-K678 PolarHBondContact OE2-NZ 3.38Å
679	Q	28	Very low	39.4	Very low	175 Å²	175	83.9 Å²	83.9	82%	0.818	43%	0.427	S	S	*	.			trans	-116.8	75	161.7	-166.7	172.3	70.1	0	0	111.4	F677 L681	F677-Q679 VanDerWaalsContact C-N 3.34Å; F677-Q679 PolarHBondContact O-N 3Å; Q679-L681 PolarHBondContact O-N 2.88Å; Q679-L681 VanDerWaalsContact O-N 3.09Å
680	T	26.7	Very low	38.9	Very low	106 Å²	106	78.9 Å²	78.9	65%	0.65	41%	0.409	S	S	*	.			trans	-73.9	100.1	178.9	-41.4	0	0	0	0	111.1	K682	T680-K682 HydrophobicContact CG2-CG 3.52Å; T680-K682 PolarHBondContact O-N 2.87Å
681	L	27.8	Very low	38.1	Very low	123 Å²	123	83.4 Å²	83.4	64%	0.644	41%	0.413	S	S	*	.			trans	-67.5	70.6	161	-86.1	164.7	0	0	0	110	Q679 G683 V684	Q679-L681 PolarHBondContact O-N 2.88Å; Q679-L681 VanDerWaalsContact O-N 3.09Å; L681-G683 PolarHBondContact O-N 3.47Å; L681-V684 HydrophobicContact CB-CG2 4.25Å
682	K	30.7	Very low	37.4	Very low	118 Å²	118	84.9 Å²	84.9	51%	0.513	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	120.6	177.5	-75	-158.5	171.8	-155.2	0	109.2	T680 D978	T680-K682 HydrophobicContact CG2-CG 3.52Å; T680-K682 PolarHBondContact O-N 2.87Å; K682-D978 IonicContact NZ-OD2 2.7Å; K682-D978 PolarHBondContact NZ-OD2 2.97Å
683	G	35	Very low	37.1	Very low	38 Å²	38	83.2 Å²	83.2	39%	0.392	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.5	-5	172.7	0	0	0	0	0	116.8	L681 K685 T1205	L681-G683 PolarHBondContact O-N 3.47Å; G683-K685 PolarHBondContact O-N 2.93Å; G683-T1205 PolarHBondContact O-OG1 2.87Å
684	V	37.1	Very low	36.9	Very low	45 Å²	45	83.5 Å²	83.5	27%	0.273	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	93.5	177.3	-172.4	0	0	0	0	110.9	L681 T1205 R1207	L681-V684 HydrophobicContact CB-CG2 4.25Å; V684-T1205 WeakPolarHBondContact CA-OG1 3.36Å; V684-R1207 HydrophobicContact CG1-CG 4.15Å
685	K	43.2	Very low	36.3	Very low	49 Å²	49	82 Å²	82	21%	0.213	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	158.4	174	-79.8	-172.5	170.3	-176.8	0	112.5	G683 T955 E1090 T1205 R1207	G683-K685 PolarHBondContact O-N 2.93Å; K685-T955 HydrophobicContact CD-CG2 4.17Å; K685-T955 VanDerWaalsContact NZ-CG2 3.3Å; K685-E1090 IonicContact NZ-OE2 3.83Å; K685-E1090 PolarHBondContact NZ-OE2 3.38Å; K685-T1205 PolarHBondContact N-O 2.73Å; K685-R1207 WeakPolarHBondContact O-CB 3.23Å; K685-R1207 PolarHBondContact O-N 2.85Å
686	I	38.3	Very low	35.9	Very low	64 Å²	64	82.3 Å²	82.3	33%	0.328	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.3	172	-68.4	177.3	0	0	0	108.2	G950 R1207 Y1209	I686-G950 WeakPolarHBondContact CB-O 3.49Å; I686-G950 WeakPolarHBondContact CG2-O 3.37Å; I686-R1207 HydrophobicContact CG1-CB 4.22Å; I686-Y1209 HydrophobicContact CB-CE2 4.39Å; I686-Y1209 HydrophobicContact CD1-CE2 4.22Å; I686-Y1209 HydrophobicContact CG1-CE2 4.1Å; I686-Y1209 HydrophobicContact CG2-CD2 3.66Å; I686-Y1209 HydrophobicContact CG2-CE2 3.57Å
687	M	44.8	Very low	35.9	Very low	2 Å²	2	80 Å²	80	1%	0.01	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	95.6	173	-177.2	-159.1	-44.2	0	0	107.4	E1094 I1097 N1206 R1207 I1208 Y1209	M687-E1094 HydrophobicContact CE-CB 4.14Å; M687-E1094 HydrophobicContact CE-CG 3.68Å; M687-E1094 HydrophobicContact SD-CB 4.29Å; M687-E1094 HydrophobicContact SD-CG 4.43Å; M687-I1097 HydrophobicContact CE-CD1 4.22Å; M687-I1097 HydrophobicContact SD-CG2 4.38Å; M687-N1206 WeakPolarHBondContact CB-OD1 3.38Å; M687-N1206 VanDerWaalsContact CE-ND2 3.33Å; M687-N1206 WeakPolarHBondContact CE-ND2 3.21Å; M687-N1206 PolarHBondContact N-OD1 3.1Å; M687-R1207 PolarHBondContact N-O 2.94Å; M687-I1208 HydrophobicContact CB-CG1 4.34Å; M687-I1208 HydrophobicContact CE-CD1 3.85Å; M687-I1208 HydrophobicContact CE-CG1 3.86Å; M687-I1208 CarbonylContact O-C 3.51Å; M687-I1208 WeakPolarHBondContact O-CA 3.37Å; M687-I1208 HydrophobicContact SD-CD1 3.74Å; M687-I1208 HydrophobicContact SD-CG1 3.85Å; M687-I1208 HydrophobicContact SD-CG2 4.48Å; M687-Y1209 PolarHBondContact O-N 2.85Å
688	S	49	Very low	36	Very low	6 Å²	6	74.9 Å²	74.9	4%	0.042	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	161.9	163.2	-170.7	0	0	0	0	110.2	P690 D949 Q951 Y1209	S688-P690 WeakPolarHBondContact O-CD 3.23Å; S688-D949 WeakPolarHBondContact CB-O 3.05Å; S688-D949 PolarHBondContact OG-O 2.68Å; S688-Q951 PolarHBondContact O-NE2 3.36Å; S688-Y1209 CarbonylContact C-O 3.18Å
689	L	45.5	Very low	36.3	Very low	15 Å²	15	71.7 Å²	71.7	8%	0.079	44%	0.437	C	S	.	.			trans	-105.8	75.8	164	-60.8	-172.7	0	0	0	108.3	W691 Q1098 V1101 I1208 Y1209 T1210	L689-W691 PolarHBondContact O-N 3.13Å; L689-Q1098 HydrophobicContact CD2-CB 4.38Å; L689-Q1098 HydrophobicContact CD2-CG 3.56Å; L689-V1101 HydrophobicContact CD1-CB 3.89Å; L689-V1101 HydrophobicContact CD1-CG1 3.56Å; L689-V1101 HydrophobicContact CD1-CG2 4.25Å; L689-I1208 HydrophobicContact CG-CG2 4.32Å; L689-Y1209 PolarHBondContact N-O 3.49Å; L689-T1210 HydrophobicContact CD1-CG2 3.81Å
690	P	41.2	Very low	36.6	Very low	16 Å²	16	68 Å²	68	10%	0.104	43%	0.425	C	S	.	.			trans	-66.8	127.3	-172.2	29.2	-36.6	0	0	0	110.8	S688 S692 A693 D949	S688-P690 WeakPolarHBondContact O-CD 3.23Å; P690-S692 PolarHBondContact O-N 2.88Å; P690-S692 VanDerWaalsContact O-N 3.14Å; P690-A693 PolarHBondContact O-N 3.43Å; P690-D949 HydrophobicContact CB-CB 4.09Å; P690-D949 WeakPolarHBondContact CB-OD2 3.04Å
691	W	34.9	Very low	37	Very low	138 Å²	138	68.7 Å²	68.7	52%	0.523	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-64.2	-19.6	-179.3	-165.2	-87.9	0	0	0	113	L689 A693 I694 F1213	L689-W691 PolarHBondContact O-N 3.13Å; W691-A693 PolarHBondContact O-N 3.12Å; W691-I694 PolarHBondContact O-N 3.01Å; W691-F1213 HydrophobicContact CH2-CE1 4.48Å
692	S	37.3	Very low	37.6	Very low	83 Å²	83	68.8 Å²	68.8	58%	0.58	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-57.1	-31.3	176.1	54	0	0	0	0	113.5	P690 I694	P690-S692 PolarHBondContact O-N 2.88Å; P690-S692 VanDerWaalsContact O-N 3.14Å; S692-I694 VanDerWaalsContact C-N 3.28Å; S692-I694 PolarHBondContact O-N 3.3Å
693	A	40	Very low	37.8	Very low	64 Å²	64	68.3 Å²	68.3	53%	0.529	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-77.5	-8.2	176.4	0	0	0	0	0	114.2	P690 W691	P690-A693 PolarHBondContact O-N 3.43Å; W691-A693 PolarHBondContact O-N 3.12Å
694	I	41.1	Very low	38.5	Very low	34 Å²	34	71 Å²	71	17%	0.174	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-115.6	1.6	-165.2	-58.7	159.5	0	0	0	112	W691 S692 P696 F706 V1102	W691-I694 PolarHBondContact O-N 3.01Å; S692-I694 VanDerWaalsContact C-N 3.28Å; S692-I694 PolarHBondContact O-N 3.3Å; I694-P696 WeakPolarHBondContact O-CD 3.37Å; I694-F706 HydrophobicContact CG2-CZ 4.47Å; I694-V1102 HydrophobicContact CD1-CG2 3.56Å; I694-V1102 HydrophobicContact CG1-CG2 4.08Å; I694-V1102 HydrophobicContact CG2-CG1 4.2Å
695	V	28.4	Very low	39.1	Very low	95 Å²	95	72.2 Å²	72.2	58%	0.576	46%	0.464	S	S	*	.			trans	-83.8	106.9	175.4	-176.9	0	0	0	0	110.6	A697	V695-A697 PolarHBondContact O-N 2.88Å
696	P	31.6	Very low	39.8	Very low	75 Å²	75	74.4 Å²	74.4	49%	0.487	47%	0.473	S	S	.	.			trans	-65.5	124.3	164.7	29	-34.3	0	0	0	108.8	I694 S698	I694-P696 WeakPolarHBondContact O-CD 3.37Å; P696-S698 PolarHBondContact O-N 2.95Å; P696-S698 VanDerWaalsContact O-N 3.13Å
697	A	35.2	Very low	41.1	Very low	96 Å²	96	75.8 Å²	75.8	79%	0.793	49%	0.494	S	S	*	.	S	Bend	trans	-60.2	-24.6	179.8	0	0	0	0	0	112.8	V695	V695-A697 PolarHBondContact O-N 2.88Å
698	S	34.9	Very low	42.2	Very low	75 Å²	75	78.2 Å²	78.2	52%	0.524	51%	0.509	S	S	.	.	S	Bend	trans	-92.3	123.3	167.2	51.6	0	0	0	0	111.7	P696 V700	P696-S698 PolarHBondContact O-N 2.95Å; P696-S698 VanDerWaalsContact O-N 3.13Å; S698-V700 PolarHBondContact O-N 3.02Å
699	G	32.6	Very low	43.3	Very low	89 Å²	89	82.1 Å²	82.1	92%	0.918	53%	0.527	S	S	*	.	S	Bend	trans	-69.9	37.3	177.7	0	0	0	0	0	116
700	V	34.1	Very low	45	Very low	96 Å²	96	85.4 Å²	85.4	58%	0.582	54%	0.54	S	S	*	.			trans	-114.1	116.5	171.6	179.6	0	0	0	0	107.2	S698 E702	S698-V700 PolarHBondContact O-N 3.02Å; V700-E702 HydrophobicContact CG1-CG 4.13Å; V700-E702 PolarHBondContact O-N 2.9Å
701	V	35	Very low	47.2	Very low	122 Å²	122	85.2 Å²	85.2	74%	0.739	54%	0.538	S	S	*	.			trans	-77.6	80.1	168.9	-173.3	0	0	0	0	107.6
702	E	39	Very low	50	Low	125 Å²	125	78.8 Å²	78.8	58%	0.584	51%	0.514	S	S	*	.			trans	-61.4	141	154.9	-67.6	-168	-177.6	0	0	106.8	K545 V700 P704	K545-E702 IonicContact NZ-OE1 2.67Å; K545-E702 PolarHBondContact NZ-OE1 3.01Å; K545-E702 IonicContact NZ-OE2 2.65Å; V700-E702 HydrophobicContact CG1-CG 4.13Å; V700-E702 PolarHBondContact O-N 2.9Å; E702-P704 WeakPolarHBondContact O-CD 3.36Å
703	S	36.7	Very low	52.8	Low	107 Å²	107	75 Å²	75	75%	0.748	49%	0.487	S	S	*	.			trans	-113	51.1	-173.6	-54.2	0	0	0	0	114.8
704	P	47.8	Very low	55.4	Low	94 Å²	94	72 Å²	72	61%	0.61	46%	0.462	S	S	*	.			trans	-69.1	155.1	154.9	34.7	-31	0	0	0	108.9	E702	E702-P704 WeakPolarHBondContact O-CD 3.36Å
705	A	51.3	Low	58	Low	72 Å²	72	70.4 Å²	70.4	60%	0.595	45%	0.454	S	S	*	.			trans	-65.4	139.1	160	0	0	0	0	0	108.8	A707 N1103	A705-A707 PolarHBondContact O-N 2.83Å; A705-A707 VanDerWaalsContact O-N 3.11Å; A705-N1103 WeakPolarHBondContact CA-OD1 3.45Å
706	F	58.2	Low	61.3	Low	95 Å²	95	65.9 Å²	65.9	42%	0.417	43%	0.426	S	S	.	.			trans	-59.7	115.1	170.4	-72.7	-97.5	0	0	0	108.6	I694 V1102 N1103 V1106	I694-F706 HydrophobicContact CG2-CZ 4.47Å; F706-V1102 HydrophobicContact CD2-CB 4.45Å; F706-V1102 HydrophobicContact CD2-CG1 3.5Å; F706-V1102 VanDerWaalsContact CD2-CG1 3.5Å; F706-V1102 HydrophobicContact CE2-CG1 3.53Å; F706-V1102 HydrophobicContact CG-CG1 4.05Å; F706-V1102 HydrophobicContact CZ-CG1 4.09Å; F706-N1103 PolarHBondContact N-OD1 2.96Å; F706-N1103 PolarHBondContact O-ND2 2.86Å; F706-V1106 HydrophobicContact CE2-CG2 4.3Å
707	A	63.7	Low	64.3	Low	92 Å²	92	62.4 Å²	62.4	76%	0.76	40%	0.404	S	S	*	.			trans	-93.7	140.4	177.6	0	0	0	0	0	110.2	A705 E709	A705-A707 PolarHBondContact O-N 2.83Å; A705-A707 VanDerWaalsContact O-N 3.11Å; A707-E709 PolarHBondContact O-N 2.64Å
708	T	67.8	Low	66.9	Low	54 Å²	54	61.3 Å²	61.3	33%	0.331	39%	0.385	S	S	.	.			trans	-67.8	113.6	170.1	-49.8	0	0	0	0	108.9	Q1095 N1096	T708-Q1095 HydrophobicContact CG2-CB 4.08Å; T708-N1096 PolarHBondContact OG1-ND2 2.88Å
709	E	72.2	Confident	69.5	Low	87 Å²	87	58.9 Å²	58.9	41%	0.407	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-70.6	147.1	176.4	-177.2	161.3	-122	0	0	111	A707 H712 K770	A707-E709 PolarHBondContact O-N 2.64Å; E709-H712 IonicContact OE2-CE1 3.25Å; E709-H712 PolarHBondContact OE2-CE1 3.25Å; E709-H712 IonicContact OE2-ND1 2.81Å; E709-K770 WeakPolarHBondContact OE1-CE 3.35Å; E709-K770 IonicContact OE1-NZ 2.76Å; E709-K770 PolarHBondContact OE1-NZ 3.49Å; E709-K770 IonicContact OE2-NZ 2.75Å; E709-K770 PolarHBondContact OE2-NZ 3.31Å
710	K	81.4	Confident	72	Confident	84 Å²	84	59.8 Å²	59.8	37%	0.365	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-67.9	136.1	173.3	-74.5	-164.5	172.7	-168.8	0	110.7	H712 V769 D1006	K710-H712 PolarHBondContact O-ND1 3.5Å; K710-V769 HydrophobicContact CD-CG2 4.33Å; K710-D1006 WeakPolarHBondContact CE-OD2 3.27Å; K710-D1006 VanDerWaalsContact NZ-CG 3.34Å; K710-D1006 IonicContact NZ-OD2 3.42Å; K710-D1006 PolarHBondContact NZ-OD2 3.32Å
711	K	88.4	Confident	74.5	Confident	12 Å²	12	56.6 Å²	56.6	5%	0.052	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-55	137.9	175	-57	-67.6	179.7	-178.7	0	109.9	F922 A1003 L1088 S1091	K711-F922 HydrophobicContact CB-CB 4.15Å; K711-F922 HydrophobicContact CD-CB 3.87Å; K711-F922 HydrophobicContact CD-CD2 4.15Å; K711-F922 HydrophobicContact CD-CG 4.1Å; K711-A1003 WeakPolarHBondContact O-CA 3.41Å; K711-A1003 VanDerWaalsContact O-CB 3.32Å; K711-A1003 WeakPolarHBondContact O-CB 3.4Å; K711-L1088 HydrophobicContact CB-CD1 4.04Å; K711-L1088 HydrophobicContact CD-CD1 4.46Å; K711-L1088 HydrophobicContact CG-CD1 3.87Å; K711-S1091 PolarHBondContact NZ-O 3.47Å; K711-S1091 PolarHBondContact NZ-OG 3.02Å
712	H	93.3	Very high	77.1	Confident	3 Å²	3	50.8 Å²	50.8	1%	0.014	29%	0.294	C	S	.	.			trans	-150.7	168.1	-175.3	54.9	-85.7	0	0	0	112.9	E709 K710 K770 I772 N918 G920 G921 F922 A923	E709-H712 IonicContact OE2-CE1 3.25Å; E709-H712 PolarHBondContact OE2-CE1 3.25Å; E709-H712 IonicContact OE2-ND1 2.81Å; K710-H712 PolarHBondContact O-ND1 3.5Å; H712-K770 HydrophobicContact CB-CB 4.36Å; H712-K770 VanDerWaalsContact CB-O 3.25Å; H712-K770 WeakPolarHBondContact CB-O 3.35Å; H712-K770 WeakPolarHBondContact CE1-CE 3.41Å; H712-K770 WeakPolarHBondContact NE2-CE 3.39Å; H712-I772 WeakPolarHBondContact NE2-CG1 3.18Å; H712-N918 PolarHBondContact NE2-OD1 2.99Å; H712-G920 PolarHBondContact CE1-O 3.25Å; H712-G921 PolarHBondContact CE1-N 3.28Å; H712-G921 WeakPolarHBondContact NE2-CA 3.36Å; H712-G921 PolarHBondContact NE2-N 3.14Å; H712-F922 PolarHBondContact O-N 3.27Å; H712-A923 PolarHBondContact O-N 3.49Å
713	I	95.5	Very high	79.6	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	143	179	-165.1	176.5	0	0	0	112	L715 Y757 A771 I772 A923 T925 I996 A999	I713-L715 HydrophobicContact CD1-CB 4.49Å; I713-L715 HydrophobicContact CD1-CD1 4.31Å; I713-Y757 HydrophobicContact CB-CD2 4.26Å; I713-Y757 HydrophobicContact CB-CE2 3.57Å; I713-Y757 HydrophobicContact CD1-CD2 4.1Å; I713-Y757 HydrophobicContact CD1-CE2 4.22Å; I713-Y757 HydrophobicContact CG1-CE2 4.46Å; I713-Y757 HydrophobicContact CG2-CD1 4.13Å; I713-Y757 HydrophobicContact CG2-CD2 3.97Å; I713-Y757 HydrophobicContact CG2-CE1 3.67Å; I713-Y757 HydrophobicContact CG2-CE2 3.51Å; I713-Y757 HydrophobicContact CG2-CG 4.25Å; I713-Y757 PolarHBondContact N-OH 3.36Å; I713-Y757 VanDerWaalsContact N-OH 3.08Å; I713-A771 HydrophobicContact CG2-CB 3.45Å; I713-A771 VanDerWaalsContact CG2-CB 3.45Å; I713-I772 PolarHBondContact O-N 2.84Å; I713-A923 CarbonylContact C-O 3.29Å; I713-A923 WeakPolarHBondContact CA-O 3.26Å; I713-T925 HydrophobicContact CD1-CG2 3.9Å; I713-T925 HydrophobicContact CG1-CG2 4.21Å; I713-I996 HydrophobicContact CD1-CD1 4.09Å; I713-A999 HydrophobicContact CB-CB 4.07Å; I713-A999 HydrophobicContact CD1-CB 3.65Å; I713-A999 HydrophobicContact CG1-CB 3.74Å
714	I	94.6	Very high	82.1	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	109.2	159.5	-70.1	160.2	0	0	0	106.6	I772 I914 A923 I924 T925	I714-I772 CarbonylContact C-O 3.46Å; I714-I772 WeakPolarHBondContact CA-O 3.28Å; I714-I772 HydrophobicContact CG1-CB 4.07Å; I714-I772 HydrophobicContact CG1-CG2 4.2Å; I714-I914 HydrophobicContact CD1-CG2 3.97Å; I714-I914 HydrophobicContact CG1-CG2 4.21Å; I714-I914 HydrophobicContact CG2-CB 4.45Å; I714-I914 HydrophobicContact CG2-CG2 3.64Å; I714-A923 PolarHBondContact N-O 3.27Å; I714-I924 HydrophobicContact CB-CB 4.45Å; I714-I924 HydrophobicContact CB-CG1 4.07Å; I714-I924 HydrophobicContact CD1-CD1 4.45Å; I714-I924 HydrophobicContact CD1-CG1 3.89Å; I714-I924 HydrophobicContact CG2-CG1 4.31Å; I714-I924 HydrophobicContact CG2-CG2 4.15Å; I714-I924 WeakPolarHBondContact O-CA 3.45Å; I714-T925 PolarHBondContact O-N 3.13Å
715	L	96.7	Very high	83.9	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	111.8	-179	-172.9	67.6	0	0	0	109.7	I713 V717 I772 A774 T925 C927 I996	I713-L715 HydrophobicContact CD1-CB 4.49Å; I713-L715 HydrophobicContact CD1-CD1 4.31Å; L715-V717 HydrophobicContact CD2-CG1 4.07Å; L715-V717 HydrophobicContact CG-CG1 3.95Å; L715-I772 PolarHBondContact N-O 3.22Å; L715-A774 PolarHBondContact O-N 3.3Å; L715-T925 HydrophobicContact CD1-CG2 4.17Å; L715-C927 HydrophobicContact CD1-CB 3.79Å; L715-C927 HydrophobicContact CD2-CB 4.41Å; L715-C927 HydrophobicContact CG-CB 4.04Å; L715-I996 HydrophobicContact CD1-CD1 3.68Å
716	A	96.6	Very high	85.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	126.3	173.7	0	0	0	0	0	110.1	A774 F907 F910 T925 C927	A716-A774 WeakPolarHBondContact CA-O 3.4Å; A716-F907 HydrophobicContact CB-CE2 3.97Å; A716-F910 HydrophobicContact CB-CD1 4.35Å; A716-F910 HydrophobicContact CB-CE1 3.48Å; A716-F910 VanDerWaalsContact CB-CE1 3.48Å; A716-F910 HydrophobicContact CB-CE2 4.07Å; A716-F910 HydrophobicContact CB-CZ 3.31Å; A716-T925 PolarHBondContact N-O 2.84Å; A716-C927 VanDerWaalsContact O-CB 3.25Å; A716-C927 WeakPolarHBondContact O-CB 3.26Å; A716-C927 PolarHBondContact O-N 2.9Å
717	V	95.9	Very high	87	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.7	-175.6	-59.9	0	0	0	0	112.3	L715 N719 I722 D750 V773 A774 R775 W776 C927	L715-V717 HydrophobicContact CD2-CG1 4.07Å; L715-V717 HydrophobicContact CG-CG1 3.95Å; V717-N719 HydrophobicContact CG2-CB 4.16Å; V717-I722 HydrophobicContact CG2-CD1 3.51Å; V717-D750 HydrophobicContact CB-CB 4.43Å; V717-D750 HydrophobicContact CG1-CB 3.67Å; V717-V773 HydrophobicContact CB-CG1 4.39Å; V717-V773 HydrophobicContact CG1-CG1 3.79Å; V717-V773 HydrophobicContact CG2-CG1 3.63Å; V717-A774 PolarHBondContact N-O 3.44Å; V717-R775 VanDerWaalsContact O-CA 3.28Å; V717-R775 WeakPolarHBondContact O-CA 3.5Å; V717-W776 PolarHBondContact O-N 3.47Å; V717-C927 HydrophobicContact CG1-CB 3.93Å
718	N	89.5	Confident	88.4	Confident	73 Å²	73	37 Å²	37	39%	0.39	20%	0.199	S	C	.	.			trans	-103.8	34.9	172.7	-65.2	5.9	0	0	0	111.1	D720 V930	N718-D720 PolarHBondContact O-N 3.08Å; N718-V930 HydrophobicContact CB-CG2 4.35Å
719	N	89.8	Confident	89.7	Confident	24 Å²	24	35.6 Å²	35.6	13%	0.128	19%	0.19	C	C	.	.			trans	-81.2	109.8	-177.6	-170.3	-36.3	0	0	0	110.6	V717 L721 I722 Y744 D750 R775	V717-N719 HydrophobicContact CG2-CB 4.16Å; N719-L721 PolarHBondContact O-N 2.83Å; N719-L721 WeakPolarHBondContact OD1-CB 3.4Å; N719-L721 PolarHBondContact OD1-N 2.8Å; N719-L721 VanDerWaalsContact OD1-N 3.09Å; N719-I722 HydrophobicContact CB-CD1 4.02Å; N719-I722 HydrophobicContact CB-CG1 4.21Å; N719-I722 PolarHBondContact O-N 3.39Å; N719-Y744 PolarHBondContact ND2-O 3.46Å; N719-D750 PolarHBondContact ND2-OD2 2.9Å; N719-R775 WeakPolarHBondContact O-CD 3.37Å
720	D	84.3	Confident	90.7	Very high	109 Å²	109	35 Å²	35	58%	0.583	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.5	-173.5	-74.1	-32.2	0	0	0	114.7	N718 I722 R775 F784	N718-D720 PolarHBondContact O-N 3.08Å; D720-I722 VanDerWaalsContact C-N 3.27Å; D720-I722 PolarHBondContact O-N 2.89Å; D720-R775 PolarHBondContact O-NH1 3.27Å; D720-R775 IonicContact OD1-CZ 3.09Å; D720-R775 IonicContact OD1-NE 2.67Å; D720-R775 IonicContact OD1-NH2 2.69Å; D720-R775 PolarHBondContact OD1-NH2 3.01Å; D720-F784 WeakPolarHBondContact O-CE1 3.44Å; D720-F784 VanDerWaalsContact O-CZ 3.22Å; D720-F784 WeakPolarHBondContact O-CZ 3.44Å
721	L	85.9	Confident	91.4	Very high	28 Å²	28	31.1 Å²	31.1	15%	0.147	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-9.1	178.9	-60.3	175.2	0	0	0	113.8	N719 Y744 K786 V856 T857 V861	N719-L721 PolarHBondContact O-N 2.83Å; N719-L721 WeakPolarHBondContact OD1-CB 3.4Å; N719-L721 PolarHBondContact OD1-N 2.8Å; N719-L721 VanDerWaalsContact OD1-N 3.09Å; L721-Y744 HydrophobicContact CB-CD1 4.04Å; L721-Y744 WeakPolarHBondContact O-CE1 3.27Å; L721-K786 HydrophobicContact CB-CD 4.24Å; L721-K786 HydrophobicContact CD2-CD 4.28Å; L721-K786 PolarHBondContact O-NZ 3.1Å; L721-V856 HydrophobicContact CD1-CB 4.31Å; L721-V856 HydrophobicContact CD1-CG1 3.77Å; L721-T857 HydrophobicContact CD1-CG2 4.36Å; L721-V861 HydrophobicContact CD2-CG2 4.35Å
722	I	91.3	Very high	91.7	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.193	C	C	.	.	S	Bend	trans	-81.1	116.8	175	-57.1	177.4	0	0	0	108.9	V717 N719 D720 I729 Y744 V773 R775	V717-I722 HydrophobicContact CG2-CD1 3.51Å; N719-I722 HydrophobicContact CB-CD1 4.02Å; N719-I722 HydrophobicContact CB-CG1 4.21Å; N719-I722 PolarHBondContact O-N 3.39Å; D720-I722 VanDerWaalsContact C-N 3.27Å; D720-I722 PolarHBondContact O-N 2.89Å; I722-I729 HydrophobicContact CB-CD1 4.45Å; I722-I729 HydrophobicContact CD1-CD1 3.91Å; I722-I729 HydrophobicContact CG1-CD1 3.77Å; I722-I729 HydrophobicContact CG2-CD1 4.01Å; I722-Y744 HydrophobicContact CB-CE1 4.4Å; I722-Y744 HydrophobicContact CG1-CD1 3.63Å; I722-Y744 HydrophobicContact CG1-CE1 3.84Å; I722-Y744 HydrophobicContact CG1-CG 4.46Å; I722-V773 HydrophobicContact CD1-CG1 4.28Å; I722-R775 HydrophobicContact CB-CB 4.11Å; I722-R775 HydrophobicContact CD1-CB 4.36Å; I722-R775 HydrophobicContact CG2-CB 4.02Å; I722-R775 WeakPolarHBondContact O-CD 3.23Å; I722-R775 PolarHBondContact O-NH1 3.47Å
723	P	90.3	Very high	91.5	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	21%	0.205	C	C	.	.			trans	-75.6	150.8	-176.2	34.6	-38.9	0	0	0	112.2	S725 L726 F784 V897	P723-S725 PolarHBondContact O-N 3.41Å; P723-S725 VanDerWaalsContact O-N 3.16Å; P723-L726 HydrophobicContact CG-CB 4.33Å; P723-L726 HydrophobicContact CG-CD1 3.87Å; P723-L726 HydrophobicContact CG-CG 3.91Å; P723-L726 PolarHBondContact O-N 2.98Å; P723-L726 VanDerWaalsContact O-N 3.12Å; P723-F784 HydrophobicContact CB-CZ 4.38Å; P723-V897 HydrophobicContact CB-CG1 3.84Å; P723-V897 HydrophobicContact CG-CG1 3.85Å
724	S	89.2	Confident	91	Very high	39 Å²	39	40.9 Å²	40.9	27%	0.273	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.9	178.5	57.7	0	0	0	0	115	L726 S899 N900	S724-L726 VanDerWaalsContact C-N 3.35Å; S724-S899 PolarHBondContact N-OG 2.8Å; S724-S899 PolarHBondContact OG-OG 3.16Å; S724-N900 PolarHBondContact OG-N 3.09Å; S724-N900 PolarHBondContact OG-O 3Å
725	S	85.7	Confident	90.7	Very high	67 Å²	67	47.5 Å²	47.5	47%	0.469	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-15.9	172.3	51.4	0	0	0	0	113.9	P723	P723-S725 PolarHBondContact O-N 3.41Å; P723-S725 VanDerWaalsContact O-N 3.16Å
726	L	88.2	Confident	90.5	Very high	69 Å²	69	48.2 Å²	48.2	36%	0.361	27%	0.272	S	S	.	.			trans	-102.5	119.6	173.9	-65.5	179.6	0	0	0	109.4	P723 S724 Y728 I729	P723-L726 HydrophobicContact CG-CB 4.33Å; P723-L726 HydrophobicContact CG-CD1 3.87Å; P723-L726 HydrophobicContact CG-CG 3.91Å; P723-L726 PolarHBondContact O-N 2.98Å; P723-L726 VanDerWaalsContact O-N 3.12Å; S724-L726 VanDerWaalsContact C-N 3.35Å; L726-Y728 VanDerWaalsContact C-N 3.25Å; L726-Y728 PolarHBondContact O-N 2.96Å; L726-I729 HydrophobicContact CD1-CG1 4.24Å
727	P	86.6	Confident	90.3	Very high	59 Å²	59	48.3 Å²	48.3	38%	0.383	27%	0.273	S	S	.	.	S	Bend	trans	-66.3	-34.3	175	27.4	-33.1	0	0	0	111.2	R913 I914 A917	P727-R913 PolarHBondContact O-NH1 3.19Å; P727-I914 WeakPolarHBondContact O-CD1 3.46Å; P727-A917 HydrophobicContact CB-CB 4.17Å
728	Y	93.8	Very high	89.9	Confident	60 Å²	60	51 Å²	51	24%	0.235	29%	0.289	C	S	.	.			trans	-158	171.3	176.7	62.5	-99.2	0	0	0	110.6	L726 E730 I772 V773 A917 N918	L726-Y728 VanDerWaalsContact C-N 3.25Å; L726-Y728 PolarHBondContact O-N 2.96Å; Y728-E730 HydrophobicContact CE2-CB 4.43Å; Y728-I772 HydrophobicContact CD1-CG2 4.44Å; Y728-I772 HydrophobicContact CD2-CD1 3.76Å; Y728-I772 HydrophobicContact CD2-CG2 3.79Å; Y728-I772 HydrophobicContact CE2-CD1 3.69Å; Y728-I772 HydrophobicContact CG-CG2 3.7Å; Y728-V773 CarbonylContact C-O 3.57Å; Y728-V773 VanDerWaalsContact CA-O 3.31Å; Y728-V773 WeakPolarHBondContact CA-O 3.46Å; Y728-V773 WeakPolarHBondContact CB-O 3.47Å; Y728-A917 HydrophobicContact CD1-CB 4.18Å; Y728-A917 HydrophobicContact CE1-CB 4.11Å; Y728-N918 HydrophobicContact CD1-CB 4.47Å; Y728-N918 HydrophobicContact CE1-CB 4.02Å
729	I	93.6	Very high	89.9	Confident	24 Å²	24	50.2 Å²	50.2	12%	0.123	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.5	170	-62.9	157	0	0	0	108.1	I722 L726 V731 Y740 Y744 V773	I722-I729 HydrophobicContact CB-CD1 4.45Å; I722-I729 HydrophobicContact CD1-CD1 3.91Å; I722-I729 HydrophobicContact CG1-CD1 3.77Å; I722-I729 HydrophobicContact CG2-CD1 4.01Å; L726-I729 HydrophobicContact CD1-CG1 4.24Å; I729-V731 HydrophobicContact CG2-CG2 4.42Å; I729-Y740 HydrophobicContact CD1-CD2 4.49Å; I729-Y740 HydrophobicContact CD1-CE2 4.02Å; I729-Y740 HydrophobicContact CG2-CD2 4.17Å; I729-Y744 HydrophobicContact CD1-CD1 4.19Å; I729-Y744 HydrophobicContact CD1-CD2 4.04Å; I729-Y744 HydrophobicContact CD1-CE1 3.72Å; I729-Y744 HydrophobicContact CD1-CE2 3.57Å; I729-Y744 HydrophobicContact CD1-CG 4.35Å; I729-Y744 VanDerWaalsContact CD1-CZ 3.41Å; I729-Y744 HydrophobicContact CG1-CE2 4.48Å; I729-V773 PolarHBondContact N-O 2.98Å; I729-V773 PolarHBondContact O-N 3.06Å
730	E	94.7	Very high	90.1	Very high	75 Å²	75	49.4 Å²	49.4	35%	0.35	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.1	177.2	-172.5	169.5	88.7	0	0	111.1	Y728 K732 K770 I772	Y728-E730 HydrophobicContact CE2-CB 4.43Å; E730-K732 WeakPolarHBondContact OE1-CE 3.25Å; E730-K732 IonicContact OE1-NZ 3.61Å; E730-K732 PolarHBondContact OE1-NZ 3.22Å; E730-K770 HydrophobicContact CG-CD 3.94Å; E730-K770 HydrophobicContact CG-CG 4Å; E730-K770 WeakPolarHBondContact OE2-CD 3.28Å; E730-K770 VanDerWaalsContact OE2-CE 3.29Å; E730-K770 WeakPolarHBondContact OE2-CE 3.42Å; E730-K770 IonicContact OE2-NZ 3.21Å; E730-K770 PolarHBondContact OE2-NZ 3Å; E730-I772 HydrophobicContact CB-CD1 4.03Å; E730-I772 HydrophobicContact CG-CD1 3.91Å
731	V	96.4	Very high	90.3	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.012	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129.2	-176.7	-174	0	0	0	0	108.8	I729 G736 V737 Y740 L754 F758 K770 A771 V773	I729-V731 HydrophobicContact CG2-CG2 4.42Å; V731-G736 VanDerWaalsContact CG1-C 3.46Å; V731-V737 HydrophobicContact CG1-CG2 4.19Å; V731-Y740 HydrophobicContact CG2-CD2 4.21Å; V731-L754 HydrophobicContact CB-CD2 4.31Å; V731-L754 HydrophobicContact CG1-CD1 4.5Å; V731-L754 HydrophobicContact CG1-CD2 4.27Å; V731-L754 HydrophobicContact CG2-CD1 4.24Å; V731-L754 HydrophobicContact CG2-CD2 4.26Å; V731-F758 HydrophobicContact CB-CE2 4.32Å; V731-F758 HydrophobicContact CG1-CE2 3.72Å; V731-F758 HydrophobicContact CG1-CZ 4.27Å; V731-K770 CarbonylContact O-C 3.17Å; V731-K770 WeakPolarHBondContact O-CA 3.3Å; V731-A771 HydrophobicContact CB-CB 4.34Å; V731-A771 PolarHBondContact N-O 3.3Å; V731-A771 PolarHBondContact O-N 3.22Å; V731-V773 HydrophobicContact CG2-CG2 3.98Å
732	K	93.3	Very high	90.2	Very high	123 Å²	123	49.5 Å²	49.5	54%	0.535	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	112.5	-177.4	-73.9	172.1	-178.3	153.3	0	111.1	E730 G736 K770	E730-K732 WeakPolarHBondContact OE1-CE 3.25Å; E730-K732 IonicContact OE1-NZ 3.61Å; E730-K732 PolarHBondContact OE1-NZ 3.22Å; K732-G736 WeakPolarHBondContact O-CA 3.42Å; K732-G736 PolarHBondContact O-N 2.99Å; K732-G736 VanDerWaalsContact O-N 3.16Å; K732-K770 HydrophobicContact CG-CG 4.06Å
733	G	89.4	Confident	90	Very high	25 Å²	25	53.4 Å²	53.4	26%	0.258	30%	0.3	S	S	.	.	H	α-helix	trans	56.3	-171.8	-179.4	0	0	0	0	0	114.7	D735 G736 V737 V769	G733-D735 VanDerWaalsContact C-N 3.33Å; G733-D735 PolarHBondContact O-N 2.8Å; G733-G736 PolarHBondContact O-N 3.31Å; G733-G736 VanDerWaalsContact O-N 3.14Å; G733-V737 PolarHBondContact O-N 3.02Å; G733-V769 PolarHBondContact N-O 3.44Å
734	S	85.8	Confident	90	Very high	75 Å²	75	53.9 Å²	53.9	52%	0.524	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-36.2	-176.3	-46.1	0	0	0	0	113.7	G736 V737 V738	S734-G736 VanDerWaalsContact C-N 3.32Å; S734-G736 PolarHBondContact O-N 2.84Å; S734-V737 WeakPolarHBondContact O-CB 3.44Å; S734-V737 PolarHBondContact O-N 3.33Å; S734-V737 VanDerWaalsContact O-N 3.15Å; S734-V738 PolarHBondContact O-N 2.91Å
735	D	87.2	Confident	89.7	Confident	141 Å²	141	52.2 Å²	52.2	75%	0.754	29%	0.291	S	S	*	.	H	α-helix	trans	-65	-37.5	176.7	-66.5	-37.5	0	0	0	111.6	G733 V738 A739	G733-D735 VanDerWaalsContact C-N 3.33Å; G733-D735 PolarHBondContact O-N 2.8Å; D735-V738 PolarHBondContact O-N 2.66Å; D735-A739 PolarHBondContact O-N 2.77Å
736	G	92.2	Very high	89.4	Confident	16 Å²	16	54.2 Å²	54.2	17%	0.165	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-40.1	171.1	0	0	0	0	0	112.6	V731 K732 G733 S734 A739 Y740	V731-G736 VanDerWaalsContact CG1-C 3.46Å; K732-G736 WeakPolarHBondContact O-CA 3.42Å; K732-G736 PolarHBondContact O-N 2.99Å; K732-G736 VanDerWaalsContact O-N 3.16Å; G733-G736 PolarHBondContact O-N 3.31Å; G733-G736 VanDerWaalsContact O-N 3.14Å; S734-G736 VanDerWaalsContact C-N 3.32Å; S734-G736 PolarHBondContact O-N 2.84Å; G736-A739 PolarHBondContact O-N 3.37Å; G736-Y740 WeakPolarHBondContact O-CB 3.1Å; G736-Y740 PolarHBondContact O-N 3.29Å
737	V	93.3	Very high	88.6	Confident	2 Å²	2	56 Å²	56	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-45.2	175.1	-174.1	0	0	0	0	110.6	V731 G733 S734 A739 Y740 G741 Y751 L754 N755 F758	V731-V737 HydrophobicContact CG1-CG2 4.19Å; G733-V737 PolarHBondContact O-N 3.02Å; S734-V737 WeakPolarHBondContact O-CB 3.44Å; S734-V737 PolarHBondContact O-N 3.33Å; S734-V737 VanDerWaalsContact O-N 3.15Å; V737-A739 VanDerWaalsContact C-N 3.3Å; V737-A739 PolarHBondContact O-N 3.49Å; V737-Y740 PolarHBondContact O-N 3.02Å; V737-G741 PolarHBondContact O-N 2.8Å; V737-Y751 HydrophobicContact CG1-CD2 3.89Å; V737-Y751 HydrophobicContact CG1-CE2 3.66Å; V737-Y751 VanDerWaalsContact O-CE2 3.29Å; V737-Y751 WeakPolarHBondContact O-CE2 3.38Å; V737-L754 HydrophobicContact CG1-CB 3.97Å; V737-L754 HydrophobicContact CG2-CB 4.06Å; V737-N755 HydrophobicContact CG1-CB 4.17Å; V737-F758 HydrophobicContact CG2-CB 4.42Å; V737-F758 HydrophobicContact CG2-CD2 3.32Å; V737-F758 HydrophobicContact CG2-CE2 3.9Å; V737-F758 HydrophobicContact CG2-CG 4.17Å
738	V	88.1	Confident	88.3	Confident	59 Å²	59	54.3 Å²	54.3	36%	0.358	31%	0.305	S	S	.	.	H	α-helix	trans	-63.7	-35.2	177	173.2	0	0	0	0	111.8	S734 D735 K742	S734-V738 PolarHBondContact O-N 2.91Å; D735-V738 PolarHBondContact O-N 2.66Å; V738-K742 WeakPolarHBondContact O-CD 3.22Å; V738-K742 VanDerWaalsContact O-CG 3.3Å; V738-K742 WeakPolarHBondContact O-CG 3.39Å; V738-K742 PolarHBondContact O-N 3.38Å
739	A	89.6	Confident	88	Confident	56 Å²	56	55.7 Å²	55.7	46%	0.463	31%	0.312	S	S	.	.	H	α-helix	trans	-66.8	-51.5	173	0	0	0	0	0	111.9	D735 G736 V737 G741 K742 E743	D735-A739 PolarHBondContact O-N 2.77Å; G736-A739 PolarHBondContact O-N 3.37Å; V737-A739 VanDerWaalsContact C-N 3.3Å; V737-A739 PolarHBondContact O-N 3.49Å; A739-G741 VanDerWaalsContact C-N 3.29Å; A739-G741 PolarHBondContact O-N 3.47Å; A739-K742 PolarHBondContact O-N 3.21Å; A739-K742 VanDerWaalsContact O-N 3.1Å; A739-E743 PolarHBondContact O-N 3.42Å
740	Y	94	Very high	88	Confident	6 Å²	6	55 Å²	55	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-53.3	-47.3	175.5	-179.3	-87.4	0	0	0	111.2	I729 V731 G736 V737 K742 E743 Y744 D750 L754 V773	I729-Y740 HydrophobicContact CD1-CD2 4.49Å; I729-Y740 HydrophobicContact CD1-CE2 4.02Å; I729-Y740 HydrophobicContact CG2-CD2 4.17Å; V731-Y740 HydrophobicContact CG2-CD2 4.21Å; G736-Y740 WeakPolarHBondContact O-CB 3.1Å; G736-Y740 PolarHBondContact O-N 3.29Å; V737-Y740 PolarHBondContact O-N 3.02Å; Y740-K742 VanDerWaalsContact C-N 3.28Å; Y740-K742 PolarHBondContact O-N 2.77Å; Y740-E743 PolarHBondContact O-N 3.2Å; Y740-E743 VanDerWaalsContact O-N 3.12Å; Y740-Y744 AromaticContact CD2-CD2 3.67Å; Y740-Y744 HydrophobicContact CD2-CD2 3.67Å; Y740-Y744 HydrophobicContact CD2-CE2 4.4Å; Y740-Y744 HydrophobicContact CD2-CG 4.29Å; Y740-Y744 AromaticContact CE2-CD2 3.75Å; Y740-Y744 HydrophobicContact CE2-CD2 3.75Å; Y740-Y744 AromaticContact CE2-CG 3.94Å; Y740-Y744 HydrophobicContact CE2-CG 3.94Å; Y740-Y744 HydrophobicContact CG-CD2 4.16Å; Y740-Y744 WeakPolarHBondContact O-CD2 3.41Å; Y740-Y744 PolarHBondContact O-N 3.14Å; Y740-D750 HydrophobicContact CE1-CB 4.36Å; Y740-D750 WeakPolarHBondContact CE1-OD2 3.38Å; Y740-D750 PolarHBondContact OH-OD2 2.81Å; Y740-L754 HydrophobicContact CD1-CD1 3.56Å; Y740-L754 HydrophobicContact CD2-CD1 4.22Å; Y740-L754 HydrophobicContact CE1-CD1 3.95Å; Y740-L754 HydrophobicContact CG-CD1 3.72Å; Y740-V773 HydrophobicContact CE2-CB 4.14Å; Y740-V773 HydrophobicContact CE2-CG1 3.87Å; Y740-V773 HydrophobicContact CE2-CG2 4.22Å
741	G	87.6	Confident	87.9	Confident	2 Å²	2	53.3 Å²	53.3	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-31.4	-179.7	0	0	0	0	0	114.5	V737 A739 G745 Q746 Y751	V737-G741 PolarHBondContact O-N 2.8Å; A739-G741 VanDerWaalsContact C-N 3.29Å; A739-G741 PolarHBondContact O-N 3.47Å; G741-G745 WeakPolarHBondContact CA-O 3.43Å; G741-G745 CarbonylContact O-C 3.11Å; G741-G745 VanDerWaalsContact O-C 3.22Å; G741-G745 VanDerWaalsContact O-CA 3.27Å; G741-G745 WeakPolarHBondContact O-CA 3.46Å; G741-G745 PolarHBondContact O-N 3.24Å; G741-G745 VanDerWaalsContact O-N 3.1Å; G741-Q746 VanDerWaalsContact O-CG 3.32Å; G741-Q746 WeakPolarHBondContact O-CG 3.06Å; G741-Q746 PolarHBondContact O-N 3.15Å; G741-Y751 VanDerWaalsContact CA-CD2 3.47Å
742	K	83.9	Confident	87.7	Confident	138 Å²	138	55.8 Å²	55.8	60%	0.6	31%	0.312	S	S	*	.	H	α-helix	trans	-72.4	-26	176.6	-73	165.1	-178	171.9	0	113.6	V738 A739 Y740	V738-K742 WeakPolarHBondContact O-CD 3.22Å; V738-K742 VanDerWaalsContact O-CG 3.3Å; V738-K742 WeakPolarHBondContact O-CG 3.39Å; V738-K742 PolarHBondContact O-N 3.38Å; A739-K742 PolarHBondContact O-N 3.21Å; A739-K742 VanDerWaalsContact O-N 3.1Å; Y740-K742 VanDerWaalsContact C-N 3.28Å; Y740-K742 PolarHBondContact O-N 2.77Å
743	E	86.9	Confident	87.7	Confident	82 Å²	82	50 Å²	50	38%	0.383	29%	0.287	S	S	.	.	H	α-helix	trans	-106.1	-27.3	-175.9	-154.4	-155.9	153.7	0	0	113.4	A739 Y740 K786	A739-E743 PolarHBondContact O-N 3.42Å; Y740-E743 PolarHBondContact O-N 3.2Å; Y740-E743 VanDerWaalsContact O-N 3.12Å; E743-K786 WeakPolarHBondContact OE1-CE 3.32Å; E743-K786 IonicContact OE1-NZ 3.29Å; E743-K786 PolarHBondContact OE1-NZ 2.71Å
744	Y	89.6	Confident	88	Confident	12 Å²	12	48.9 Å²	48.9	5%	0.047	28%	0.275	C	S	.	.	H	α-helix	trans	-122.4	-13.1	-174	-56.2	-78.3	0	0	0	114.2	N719 L721 I722 I729 Y740	N719-Y744 PolarHBondContact ND2-O 3.46Å; L721-Y744 HydrophobicContact CB-CD1 4.04Å; L721-Y744 WeakPolarHBondContact O-CE1 3.27Å; I722-Y744 HydrophobicContact CB-CE1 4.4Å; I722-Y744 HydrophobicContact CG1-CD1 3.63Å; I722-Y744 HydrophobicContact CG1-CE1 3.84Å; I722-Y744 HydrophobicContact CG1-CG 4.46Å; I729-Y744 HydrophobicContact CD1-CD1 4.19Å; I729-Y744 HydrophobicContact CD1-CD2 4.04Å; I729-Y744 HydrophobicContact CD1-CE1 3.72Å; I729-Y744 HydrophobicContact CD1-CE2 3.57Å; I729-Y744 HydrophobicContact CD1-CG 4.35Å; I729-Y744 VanDerWaalsContact CD1-CZ 3.41Å; I729-Y744 HydrophobicContact CG1-CE2 4.48Å; Y740-Y744 AromaticContact CD2-CD2 3.67Å; Y740-Y744 HydrophobicContact CD2-CD2 3.67Å; Y740-Y744 HydrophobicContact CD2-CE2 4.4Å; Y740-Y744 HydrophobicContact CD2-CG 4.29Å; Y740-Y744 AromaticContact CE2-CD2 3.75Å; Y740-Y744 HydrophobicContact CE2-CD2 3.75Å; Y740-Y744 AromaticContact CE2-CG 3.94Å; Y740-Y744 HydrophobicContact CE2-CG 3.94Å; Y740-Y744 HydrophobicContact CG-CD2 4.16Å; Y740-Y744 WeakPolarHBondContact O-CD2 3.41Å; Y740-Y744 PolarHBondContact O-N 3.14Å
745	G	84	Confident	88.4	Confident	4 Å²	4	49 Å²	49	4%	0.041	27%	0.27	C	S	.	.			trans	123.8	140.5	170.4	0	0	0	0	0	114.7	G741 Y751 V856	G741-G745 WeakPolarHBondContact CA-O 3.43Å; G741-G745 CarbonylContact O-C 3.11Å; G741-G745 VanDerWaalsContact O-C 3.22Å; G741-G745 VanDerWaalsContact O-CA 3.27Å; G741-G745 WeakPolarHBondContact O-CA 3.46Å; G741-G745 PolarHBondContact O-N 3.24Å; G741-G745 VanDerWaalsContact O-N 3.1Å; G745-Y751 VanDerWaalsContact O-CB 3.25Å; G745-Y751 WeakPolarHBondContact O-CB 3.35Å; G745-V856 VanDerWaalsContact CA-CG1 3.46Å
746	Q	79.5	Confident	88.7	Confident	108 Å²	108	45 Å²	45	51%	0.505	25%	0.246	S	C	.	.	S	Bend	trans	-96.7	-6.5	179.9	-60.8	-174.3	-5.1	0	0	114.2	G741 Y751	G741-Q746 VanDerWaalsContact O-CG 3.32Å; G741-Q746 WeakPolarHBondContact O-CG 3.06Å; G741-Q746 PolarHBondContact O-N 3.15Å; Q746-Y751 HydrophobicContact CB-CD1 4.4Å; Q746-Y751 HydrophobicContact CB-CE1 4.24Å; Q746-Y751 HydrophobicContact CB-CE2 4.43Å; Q746-Y751 HydrophobicContact CG-CE2 4.13Å; Q746-Y751 WeakPolarHBondContact O-CD1 3.41Å
747	S	70.3	Confident	88.9	Confident	106 Å²	106	44.3 Å²	44.3	74%	0.741	24%	0.238	S	C	*	.	S	Bend	trans	-108.6	-4.8	-176.6	51.2	0	0	0	0	114.1
748	G	80.9	Confident	89	Confident	24 Å²	24	44.9 Å²	44.9	25%	0.247	24%	0.24	C	C	.	.	S	Bend	trans	-77.3	155.4	179.6	0	0	0	0	0	113.1	D750 Y751 I752	G748-D750 VanDerWaalsContact C-OD1 3.25Å; G748-D750 VanDerWaalsContact CA-OD1 3.28Å; G748-D750 WeakPolarHBondContact CA-OD1 3.21Å; G748-D750 PolarHBondContact O-N 2.97Å; G748-Y751 PolarHBondContact O-N 2.92Å; G748-I752 WeakPolarHBondContact O-CG1 3.17Å; G748-I752 PolarHBondContact O-N 3.28Å; G748-I752 VanDerWaalsContact O-N 3.08Å
749	F	88.8	Confident	89.1	Confident	89 Å²	89	45.5 Å²	45.5	39%	0.39	25%	0.247	S	C	.	.	H	α-helix	trans	-62.2	-24.1	175.2	-63	-57.5	0	0	0	112.7	S753 C927 Y928	F749-S753 WeakPolarHBondContact O-CB 3.48Å; F749-S753 PolarHBondContact O-N 3.34Å; F749-S753 PolarHBondContact O-OG 3.36Å; F749-C927 PolarHBondContact O-SG 2.89Å; F749-Y928 HydrophobicContact CB-CD1 4.48Å; F749-Y928 VanDerWaalsContact CB-O 3.28Å; F749-Y928 WeakPolarHBondContact CB-O 3.36Å; F749-Y928 AromaticContact CD1-CD1 3.65Å; F749-Y928 HydrophobicContact CD1-CD1 3.65Å; F749-Y928 HydrophobicContact CD1-CE1 4.28Å; F749-Y928 AromaticContact CD2-CD1 3.86Å; F749-Y928 HydrophobicContact CD2-CD1 3.86Å; F749-Y928 HydrophobicContact CD2-CE1 4.35Å; F749-Y928 WeakPolarHBondContact CD2-O 3.24Å; F749-Y928 AromaticContact CE1-CD1 3.69Å; F749-Y928 HydrophobicContact CE1-CD1 3.69Å; F749-Y928 AromaticContact CE1-CE1 3.83Å; F749-Y928 HydrophobicContact CE1-CE1 3.83Å; F749-Y928 AromaticContact CE2-CD1 3.91Å; F749-Y928 HydrophobicContact CE2-CD1 3.91Å; F749-Y928 AromaticContact CE2-CE1 3.92Å; F749-Y928 HydrophobicContact CE2-CE1 3.92Å; F749-Y928 AromaticContact CG-CD1 3.75Å; F749-Y928 HydrophobicContact CG-CD1 3.75Å; F749-Y928 AromaticContact CZ-CD1 3.83Å; F749-Y928 HydrophobicContact CZ-CD1 3.83Å; F749-Y928 AromaticContact CZ-CE1 3.65Å; F749-Y928 HydrophobicContact CZ-CE1 3.65Å
750	D	92.6	Very high	89.3	Confident	10 Å²	10	43 Å²	43	5%	0.053	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-51.2	173.9	55.5	-16.4	0	0	0	111.6	V717 N719 Y740 G748 I752 S753 L754 C927	V717-D750 HydrophobicContact CB-CB 4.43Å; V717-D750 HydrophobicContact CG1-CB 3.67Å; N719-D750 PolarHBondContact ND2-OD2 2.9Å; Y740-D750 HydrophobicContact CE1-CB 4.36Å; Y740-D750 WeakPolarHBondContact CE1-OD2 3.38Å; Y740-D750 PolarHBondContact OH-OD2 2.81Å; G748-D750 VanDerWaalsContact C-OD1 3.25Å; G748-D750 VanDerWaalsContact CA-OD1 3.28Å; G748-D750 WeakPolarHBondContact CA-OD1 3.21Å; G748-D750 PolarHBondContact O-N 2.97Å; D750-I752 VanDerWaalsContact C-N 3.35Å; D750-I752 PolarHBondContact O-N 3.03Å; D750-S753 PolarHBondContact O-N 3.36Å; D750-L754 WeakPolarHBondContact O-CG 3.49Å; D750-L754 PolarHBondContact O-N 3.45Å; D750-C927 PolarHBondContact N-SG 3.41Å; D750-C927 VanDerWaalsContact N-SG 3.4Å
751	Y	93.4	Very high	89	Confident	39 Å²	39	47.4 Å²	47.4	15%	0.153	25%	0.25	C	C	.	.	H	α-helix	trans	-62.2	-40.7	173.9	179	-91.1	0	0	0	112.2	V737 G741 G745 Q746 G748 L754 N755	V737-Y751 HydrophobicContact CG1-CD2 3.89Å; V737-Y751 HydrophobicContact CG1-CE2 3.66Å; V737-Y751 VanDerWaalsContact O-CE2 3.29Å; V737-Y751 WeakPolarHBondContact O-CE2 3.38Å; G741-Y751 VanDerWaalsContact CA-CD2 3.47Å; G745-Y751 VanDerWaalsContact O-CB 3.25Å; G745-Y751 WeakPolarHBondContact O-CB 3.35Å; Q746-Y751 HydrophobicContact CB-CD1 4.4Å; Q746-Y751 HydrophobicContact CB-CE1 4.24Å; Q746-Y751 HydrophobicContact CB-CE2 4.43Å; Q746-Y751 HydrophobicContact CG-CE2 4.13Å; Q746-Y751 WeakPolarHBondContact O-CD1 3.41Å; G748-Y751 PolarHBondContact O-N 2.92Å; Y751-L754 PolarHBondContact O-N 3.06Å; Y751-N755 WeakPolarHBondContact O-CB 3.45Å; Y751-N755 PolarHBondContact O-N 3.12Å
752	I	91	Very high	89.1	Confident	55 Å²	55	47.6 Å²	47.6	28%	0.282	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-42.2	176	-62.4	166.6	0	0	0	110.5	G748 D750 N755 K756 Y993	G748-I752 WeakPolarHBondContact O-CG1 3.17Å; G748-I752 PolarHBondContact O-N 3.28Å; G748-I752 VanDerWaalsContact O-N 3.08Å; D750-I752 VanDerWaalsContact C-N 3.35Å; D750-I752 PolarHBondContact O-N 3.03Å; I752-N755 PolarHBondContact O-N 3.24Å; I752-K756 HydrophobicContact CG2-CG 4.43Å; I752-K756 WeakPolarHBondContact O-CB 3.46Å; I752-K756 VanDerWaalsContact O-CG 3.28Å; I752-K756 WeakPolarHBondContact O-CG 3.27Å; I752-K756 PolarHBondContact O-N 2.77Å; I752-Y993 HydrophobicContact CB-CE1 4.41Å; I752-Y993 HydrophobicContact CG2-CE1 3.81Å; I752-Y993 HydrophobicContact CG2-CE2 4.34Å; I752-Y993 WeakPolarHBondContact CG2-OH 3.37Å
753	S	94	Very high	89	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.007	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-45.5	176.6	-62.4	0	0	0	0	111.6	F749 D750 N755 K756 Y757 I996	F749-S753 WeakPolarHBondContact O-CB 3.48Å; F749-S753 PolarHBondContact O-N 3.34Å; F749-S753 PolarHBondContact O-OG 3.36Å; D750-S753 PolarHBondContact O-N 3.36Å; S753-N755 PolarHBondContact O-N 3.36Å; S753-K756 PolarHBondContact O-N 2.99Å; S753-Y757 VanDerWaalsContact O-CB 3.28Å; S753-Y757 WeakPolarHBondContact O-CB 3.25Å; S753-Y757 PolarHBondContact O-N 3.25Å; S753-I996 WeakPolarHBondContact O-CG2 3.34Å
754	L	96.3	Very high	88.8	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-47.6	173.7	-72.7	171.6	0	0	0	111.8	V731 V737 Y740 D750 Y751 K756 Y757 F758 A771 V773	V731-L754 HydrophobicContact CB-CD2 4.31Å; V731-L754 HydrophobicContact CG1-CD1 4.5Å; V731-L754 HydrophobicContact CG1-CD2 4.27Å; V731-L754 HydrophobicContact CG2-CD1 4.24Å; V731-L754 HydrophobicContact CG2-CD2 4.26Å; V737-L754 HydrophobicContact CG1-CB 3.97Å; V737-L754 HydrophobicContact CG2-CB 4.06Å; Y740-L754 HydrophobicContact CD1-CD1 3.56Å; Y740-L754 HydrophobicContact CD2-CD1 4.22Å; Y740-L754 HydrophobicContact CE1-CD1 3.95Å; Y740-L754 HydrophobicContact CG-CD1 3.72Å; D750-L754 WeakPolarHBondContact O-CG 3.49Å; D750-L754 PolarHBondContact O-N 3.45Å; Y751-L754 PolarHBondContact O-N 3.06Å; L754-K756 VanDerWaalsContact C-N 3.32Å; L754-K756 PolarHBondContact O-N 3.25Å; L754-Y757 WeakPolarHBondContact O-CB 3.47Å; L754-Y757 PolarHBondContact O-N 3.47Å; L754-F758 HydrophobicContact CD2-CE2 4.25Å; L754-F758 VanDerWaalsContact O-CD2 3.28Å; L754-F758 WeakPolarHBondContact O-CD2 3.08Å; L754-F758 PolarHBondContact O-N 3.22Å; L754-A771 HydrophobicContact CD2-CB 3.85Å; L754-V773 HydrophobicContact CD1-CG2 4.05Å; L754-V773 HydrophobicContact CD2-CG2 3.8Å; L754-V773 HydrophobicContact CG-CG2 4.29Å
755	N	93.2	Very high	88.5	Confident	76 Å²	76	48.9 Å²	48.9	41%	0.406	27%	0.273	S	S	.	.	H	α-helix	trans	-63.5	-38.1	179.8	-170.5	38.1	0	0	0	111.9	V737 Y751 I752 S753 S759	V737-N755 HydrophobicContact CG1-CB 4.17Å; Y751-N755 WeakPolarHBondContact O-CB 3.45Å; Y751-N755 PolarHBondContact O-N 3.12Å; I752-N755 PolarHBondContact O-N 3.24Å; S753-N755 PolarHBondContact O-N 3.36Å; N755-S759 VanDerWaalsContact O-CB 3.22Å; N755-S759 WeakPolarHBondContact O-CB 3.38Å; N755-S759 PolarHBondContact O-N 3.25Å; N755-S759 PolarHBondContact O-OG 3.28Å
756	K	92.9	Very high	88.7	Confident	58 Å²	58	51.1 Å²	51.1	25%	0.252	29%	0.285	S	S	.	.	H	α-helix	trans	-62.2	-54.9	171.4	-72.9	-73.9	177.1	179.3	0	110.9	I752 S753 L754 F758 S759 F760 Y993 I996 A1023 Y1024	I752-K756 HydrophobicContact CG2-CG 4.43Å; I752-K756 WeakPolarHBondContact O-CB 3.46Å; I752-K756 VanDerWaalsContact O-CG 3.28Å; I752-K756 WeakPolarHBondContact O-CG 3.27Å; I752-K756 PolarHBondContact O-N 2.77Å; S753-K756 PolarHBondContact O-N 2.99Å; L754-K756 VanDerWaalsContact C-N 3.32Å; L754-K756 PolarHBondContact O-N 3.25Å; K756-F758 PolarHBondContact O-N 3.44Å; K756-S759 CarbonylContact O-C 3.59Å; K756-S759 WeakPolarHBondContact O-CA 3.5Å; K756-S759 WeakPolarHBondContact O-CB 3.06Å; K756-S759 PolarHBondContact O-N 3.5Å; K756-F760 PolarHBondContact O-N 3.16Å; K756-Y993 HydrophobicContact CG-CG 4.41Å; K756-I996 HydrophobicContact CB-CG2 4.44Å; K756-A1023 PolarHBondContact NZ-O 2.86Å; K756-Y1024 HydrophobicContact CB-CE1 3.93Å; K756-Y1024 HydrophobicContact CD-CE1 4.36Å; K756-Y1024 PolarHBondContact O-OH 3.33Å
757	Y	96.4	Very high	89.2	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-50	-52.2	-179.5	-178.6	-102	0	0	0	112.8	I713 S753 L754 S759 F760 P768 K770 A771 I996 A999 A1000 A1003	I713-Y757 HydrophobicContact CB-CD2 4.26Å; I713-Y757 HydrophobicContact CB-CE2 3.57Å; I713-Y757 HydrophobicContact CD1-CD2 4.1Å; I713-Y757 HydrophobicContact CD1-CE2 4.22Å; I713-Y757 HydrophobicContact CG1-CE2 4.46Å; I713-Y757 HydrophobicContact CG2-CD1 4.13Å; I713-Y757 HydrophobicContact CG2-CD2 3.97Å; I713-Y757 HydrophobicContact CG2-CE1 3.67Å; I713-Y757 HydrophobicContact CG2-CE2 3.51Å; I713-Y757 HydrophobicContact CG2-CG 4.25Å; I713-Y757 PolarHBondContact N-OH 3.36Å; I713-Y757 VanDerWaalsContact N-OH 3.08Å; S753-Y757 VanDerWaalsContact O-CB 3.28Å; S753-Y757 WeakPolarHBondContact O-CB 3.25Å; S753-Y757 PolarHBondContact O-N 3.25Å; L754-Y757 WeakPolarHBondContact O-CB 3.47Å; L754-Y757 PolarHBondContact O-N 3.47Å; Y757-S759 VanDerWaalsContact C-N 3.28Å; Y757-S759 PolarHBondContact O-N 3.42Å; Y757-F760 WeakPolarHBondContact O-CB 3.46Å; Y757-F760 PolarHBondContact O-N 3.45Å; Y757-P768 HydrophobicContact CD1-CB 3.92Å; Y757-P768 HydrophobicContact CD1-CG 4.29Å; Y757-P768 HydrophobicContact CD2-CG 4.41Å; Y757-P768 HydrophobicContact CE1-CB 3.33Å; Y757-P768 HydrophobicContact CE1-CG 4.02Å; Y757-P768 HydrophobicContact CE2-CB 4.2Å; Y757-P768 HydrophobicContact CE2-CG 4.13Å; Y757-P768 HydrophobicContact CG-CG 4.49Å; Y757-P768 WeakPolarHBondContact O-CD 3.34Å; Y757-P768 WeakPolarHBondContact O-CG 3.15Å; Y757-K770 VanDerWaalsContact CE1-O 3.32Å; Y757-K770 WeakPolarHBondContact CE1-O 3.26Å; Y757-K770 PolarHBondContact OH-O 2.94Å; Y757-A771 HydrophobicContact CD1-CB 4.08Å; Y757-A771 HydrophobicContact CE1-CB 3.81Å; Y757-I996 HydrophobicContact CD2-CG2 4.24Å; Y757-I996 HydrophobicContact CG-CG2 4.48Å; Y757-A999 HydrophobicContact CE2-CB 4.26Å; Y757-A1000 HydrophobicContact CD2-CB 3.68Å; Y757-A1000 HydrophobicContact CE2-CB 4Å; Y757-A1000 HydrophobicContact CG-CB 4.48Å; Y757-A1003 HydrophobicContact CE2-CB 4.21Å; Y757-A1003 WeakPolarHBondContact OH-CB 3.35Å
758	F	95.8	Very high	90.3	Very high	13 Å²	13	43.7 Å²	43.7	6%	0.057	25%	0.245	C	C	.	.	H	α-helix	trans	-75.3	-12.4	178.8	-71.8	-68.1	0	0	0	114.5	V731 V737 L754 K756 P768 A771	V731-F758 HydrophobicContact CB-CE2 4.32Å; V731-F758 HydrophobicContact CG1-CE2 3.72Å; V731-F758 HydrophobicContact CG1-CZ 4.27Å; V737-F758 HydrophobicContact CG2-CB 4.42Å; V737-F758 HydrophobicContact CG2-CD2 3.32Å; V737-F758 HydrophobicContact CG2-CE2 3.9Å; V737-F758 HydrophobicContact CG2-CG 4.17Å; L754-F758 HydrophobicContact CD2-CE2 4.25Å; L754-F758 VanDerWaalsContact O-CD2 3.28Å; L754-F758 WeakPolarHBondContact O-CD2 3.08Å; L754-F758 PolarHBondContact O-N 3.22Å; K756-F758 PolarHBondContact O-N 3.44Å; F758-P768 HydrophobicContact CD1-CB 4.48Å; F758-P768 WeakPolarHBondContact CD1-O 3.45Å; F758-A771 HydrophobicContact CE2-CB 3.8Å; F758-A771 HydrophobicContact CZ-CB 3.7Å
759	S	91	Very high	90.8	Very high	72 Å²	72	46.6 Å²	46.6	50%	0.503	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-1.1	171.5	-60.4	0	0	0	0	113.4	N755 K756 Y757	N755-S759 VanDerWaalsContact O-CB 3.22Å; N755-S759 WeakPolarHBondContact O-CB 3.38Å; N755-S759 PolarHBondContact O-N 3.25Å; N755-S759 PolarHBondContact O-OG 3.28Å; K756-S759 CarbonylContact O-C 3.59Å; K756-S759 WeakPolarHBondContact O-CA 3.5Å; K756-S759 WeakPolarHBondContact O-CB 3.06Å; K756-S759 PolarHBondContact O-N 3.5Å; Y757-S759 VanDerWaalsContact C-N 3.28Å; Y757-S759 PolarHBondContact O-N 3.42Å
760	F	93.6	Very high	91	Very high	3 Å²	3	43.1 Å²	43.1	1%	0.013	24%	0.242	C	C	.	.			trans	-67.3	138.1	173.2	-178.9	-106.6	0	0	0	111.3	K756 Y757 S767 L997 A1000 I1001 Q1019 P1020 Y1024	K756-F760 PolarHBondContact O-N 3.16Å; Y757-F760 WeakPolarHBondContact O-CB 3.46Å; Y757-F760 PolarHBondContact O-N 3.45Å; F760-S767 WeakPolarHBondContact O-CA 3.34Å; F760-S767 WeakPolarHBondContact O-CB 3.24Å; F760-L997 HydrophobicContact CD2-CD1 3.49Å; F760-L997 VanDerWaalsContact CD2-CD1 3.49Å; F760-L997 HydrophobicContact CE2-CD1 3.48Å; F760-L997 VanDerWaalsContact CE2-CD1 3.48Å; F760-A1000 HydrophobicContact CB-CB 3.58Å; F760-A1000 HydrophobicContact CD1-CB 3.97Å; F760-A1000 HydrophobicContact CD2-CB 4.49Å; F760-A1000 HydrophobicContact CG-CB 3.74Å; F760-I1001 HydrophobicContact CE1-CB 4.41Å; F760-I1001 HydrophobicContact CE1-CG1 3.97Å; F760-I1001 HydrophobicContact CE2-CG1 3.92Å; F760-I1001 HydrophobicContact CZ-CB 4.36Å; F760-I1001 HydrophobicContact CZ-CG1 3.49Å; F760-I1001 VanDerWaalsContact CZ-CG1 3.49Å; F760-Q1019 HydrophobicContact CZ-CB 4.39Å; F760-P1020 WeakPolarHBondContact CE2-O 3.39Å; F760-Y1024 WeakPolarHBondContact CA-OH 3.41Å; F760-Y1024 WeakPolarHBondContact CB-OH 3.39Å; F760-Y1024 PolarHBondContact N-OH 3.28Å
761	L	88.2	Confident	91.1	Very high	100 Å²	100	42.7 Å²	42.7	52%	0.524	24%	0.24	S	C	.	.			trans	-129.6	124.2	168.8	-68.4	170.8	0	0	0	108.4	G765 N766	L761-G765 WeakPolarHBondContact CD2-O 3.23Å; L761-N766 WeakPolarHBondContact CA-O 3.26Å
762	S	88.8	Confident	91.2	Very high	6 Å²	6	40.8 Å²	40.8	4%	0.042	23%	0.232	C	C	.	.			trans	-64.6	168.6	170.7	76.1	0	0	0	0	111.1	D764 G765 N766	S762-D764 PolarHBondContact O-N 2.87Å; S762-D764 VanDerWaalsContact O-N 3.08Å; S762-D764 PolarHBondContact OG-N 3.44Å; S762-G765 PolarHBondContact O-N 2.87Å; S762-G765 PolarHBondContact OG-N 3.49Å; S762-N766 PolarHBondContact N-O 2.83Å; S762-N766 PolarHBondContact OG-N 2.8Å; S762-N766 VanDerWaalsContact OG-N 3.17Å
763	K	82.6	Confident	91.5	Very high	101 Å²	101	38.2 Å²	38.2	44%	0.439	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-34.3	170.3	-65.6	163.1	-166.2	139.2	0	112.9	N1015 N1017 F1018	K763-N1015 PolarHBondContact NZ-O 3.34Å; K763-N1017 PolarHBondContact NZ-O 3.34Å; K763-F1018 WeakPolarHBondContact CE-O 3.44Å
764	D	80.9	Confident	91.6	Very high	111 Å²	111	38.1 Å²	38.1	59%	0.594	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-5.1	-174.8	-44.8	-76.5	0	0	0	112.5	S762	S762-D764 PolarHBondContact O-N 2.87Å; S762-D764 VanDerWaalsContact O-N 3.08Å; S762-D764 PolarHBondContact OG-N 3.44Å
765	G	84	Confident	91.5	Very high	46 Å²	46	38.7 Å²	38.7	47%	0.474	22%	0.22	S	C	.	.	S	Bend	trans	92.8	9.5	176.4	0	0	0	0	0	115.4	L761 S762	L761-G765 WeakPolarHBondContact CD2-O 3.23Å; S762-G765 PolarHBondContact O-N 2.87Å; S762-G765 PolarHBondContact OG-N 3.49Å
766	N	89	Confident	91.6	Very high	52 Å²	52	35.3 Å²	35.3	28%	0.278	20%	0.202	S	C	.	.			trans	-84.1	143.3	179.2	-66.3	-12	0	0	0	111.8	L761 S762 S1004	L761-N766 WeakPolarHBondContact CA-O 3.26Å; S762-N766 PolarHBondContact N-O 2.83Å; S762-N766 PolarHBondContact OG-N 2.8Å; S762-N766 VanDerWaalsContact OG-N 3.17Å; N766-S1004 WeakPolarHBondContact CB-O 3.47Å; N766-S1004 PolarHBondContact ND2-O 3.16Å
767	S	88.6	Confident	91.6	Very high	54 Å²	54	33 Å²	33	38%	0.378	19%	0.192	S	C	.	.			trans	-119.1	160.9	171.6	60.7	0	0	0	0	112.1	F760	F760-S767 WeakPolarHBondContact O-CA 3.34Å; F760-S767 WeakPolarHBondContact O-CB 3.24Å
768	P	93.8	Very high	91.4	Very high	4 Å²	4	35.7 Å²	35.7	3%	0.026	20%	0.204	C	C	.	.			trans	-63.1	146.1	171.9	-24.5	36.8	0	0	0	113.2	Y757 F758 A1000 A1003	Y757-P768 HydrophobicContact CD1-CB 3.92Å; Y757-P768 HydrophobicContact CD1-CG 4.29Å; Y757-P768 HydrophobicContact CD2-CG 4.41Å; Y757-P768 HydrophobicContact CE1-CB 3.33Å; Y757-P768 HydrophobicContact CE1-CG 4.02Å; Y757-P768 HydrophobicContact CE2-CB 4.2Å; Y757-P768 HydrophobicContact CE2-CG 4.13Å; Y757-P768 HydrophobicContact CG-CG 4.49Å; Y757-P768 WeakPolarHBondContact O-CD 3.34Å; Y757-P768 WeakPolarHBondContact O-CG 3.15Å; F758-P768 HydrophobicContact CD1-CB 4.48Å; F758-P768 WeakPolarHBondContact CD1-O 3.45Å; P768-A1000 HydrophobicContact CG-CB 3.89Å; P768-A1003 HydrophobicContact CB-CB 3.88Å; P768-A1003 HydrophobicContact CG-CB 4.09Å
769	V	91.7	Very high	91	Very high	85 Å²	85	40.5 Å²	40.5	52%	0.515	23%	0.23	S	C	.	.			trans	-102.9	-30.1	-175.8	-175.9	0	0	0	0	113.1	K710 G733	K710-V769 HydrophobicContact CD-CG2 4.33Å; G733-V769 PolarHBondContact N-O 3.44Å
770	K	93	Very high	91.1	Very high	16 Å²	16	41.8 Å²	41.8	7%	0.07	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	150	-174.3	-161.1	177.4	91.9	161	0	111.4	E709 H712 E730 V731 K732 Y757	E709-K770 WeakPolarHBondContact OE1-CE 3.35Å; E709-K770 IonicContact OE1-NZ 2.76Å; E709-K770 PolarHBondContact OE1-NZ 3.49Å; E709-K770 IonicContact OE2-NZ 2.75Å; E709-K770 PolarHBondContact OE2-NZ 3.31Å; H712-K770 HydrophobicContact CB-CB 4.36Å; H712-K770 VanDerWaalsContact CB-O 3.25Å; H712-K770 WeakPolarHBondContact CB-O 3.35Å; H712-K770 WeakPolarHBondContact CE1-CE 3.41Å; H712-K770 WeakPolarHBondContact NE2-CE 3.39Å; E730-K770 HydrophobicContact CG-CD 3.94Å; E730-K770 HydrophobicContact CG-CG 4Å; E730-K770 WeakPolarHBondContact OE2-CD 3.28Å; E730-K770 VanDerWaalsContact OE2-CE 3.29Å; E730-K770 WeakPolarHBondContact OE2-CE 3.42Å; E730-K770 IonicContact OE2-NZ 3.21Å; E730-K770 PolarHBondContact OE2-NZ 3Å; V731-K770 CarbonylContact O-C 3.17Å; V731-K770 WeakPolarHBondContact O-CA 3.3Å; K732-K770 HydrophobicContact CG-CG 4.06Å; Y757-K770 VanDerWaalsContact CE1-O 3.32Å; Y757-K770 WeakPolarHBondContact CE1-O 3.26Å; Y757-K770 PolarHBondContact OH-O 2.94Å
771	A	95.5	Very high	90.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	149.6	169.1	0	0	0	0	0	109.8	I713 V731 L754 Y757 F758	I713-A771 HydrophobicContact CG2-CB 3.45Å; I713-A771 VanDerWaalsContact CG2-CB 3.45Å; V731-A771 HydrophobicContact CB-CB 4.34Å; V731-A771 PolarHBondContact N-O 3.3Å; V731-A771 PolarHBondContact O-N 3.22Å; L754-A771 HydrophobicContact CD2-CB 3.85Å; Y757-A771 HydrophobicContact CD1-CB 4.08Å; Y757-A771 HydrophobicContact CE1-CB 3.81Å; F758-A771 HydrophobicContact CE2-CB 3.8Å; F758-A771 HydrophobicContact CZ-CB 3.7Å
772	I	95.3	Very high	91.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.1	174.1	-62.9	-68.9	0	0	0	107.6	H712 I713 I714 L715 Y728 E730	H712-I772 WeakPolarHBondContact NE2-CG1 3.18Å; I713-I772 PolarHBondContact O-N 2.84Å; I714-I772 CarbonylContact C-O 3.46Å; I714-I772 WeakPolarHBondContact CA-O 3.28Å; I714-I772 HydrophobicContact CG1-CB 4.07Å; I714-I772 HydrophobicContact CG1-CG2 4.2Å; L715-I772 PolarHBondContact N-O 3.22Å; Y728-I772 HydrophobicContact CD1-CG2 4.44Å; Y728-I772 HydrophobicContact CD2-CD1 3.76Å; Y728-I772 HydrophobicContact CD2-CG2 3.79Å; Y728-I772 HydrophobicContact CE2-CD1 3.69Å; Y728-I772 HydrophobicContact CG-CG2 3.7Å; E730-I772 HydrophobicContact CB-CD1 4.03Å; E730-I772 HydrophobicContact CG-CD1 3.91Å
773	V	96.7	Very high	91.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.7	177.9	-176.2	0	0	0	0	108.8	V717 I722 Y728 I729 V731 Y740 L754	V717-V773 HydrophobicContact CB-CG1 4.39Å; V717-V773 HydrophobicContact CG1-CG1 3.79Å; V717-V773 HydrophobicContact CG2-CG1 3.63Å; I722-V773 HydrophobicContact CD1-CG1 4.28Å; Y728-V773 CarbonylContact C-O 3.57Å; Y728-V773 VanDerWaalsContact CA-O 3.31Å; Y728-V773 WeakPolarHBondContact CA-O 3.46Å; Y728-V773 WeakPolarHBondContact CB-O 3.47Å; I729-V773 PolarHBondContact N-O 2.98Å; I729-V773 PolarHBondContact O-N 3.06Å; V731-V773 HydrophobicContact CG2-CG2 3.98Å; Y740-V773 HydrophobicContact CE2-CB 4.14Å; Y740-V773 HydrophobicContact CE2-CG1 3.87Å; Y740-V773 HydrophobicContact CE2-CG2 4.22Å; L754-V773 HydrophobicContact CD1-CG2 4.05Å; L754-V773 HydrophobicContact CD2-CG2 3.8Å; L754-V773 HydrophobicContact CG-CG2 4.29Å
774	A	95.3	Very high	91.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.3	-175.7	0	0	0	0	0	111.1	L715 A716 V717 W776 F910 I914	L715-A774 PolarHBondContact O-N 3.3Å; A716-A774 WeakPolarHBondContact CA-O 3.4Å; V717-A774 PolarHBondContact N-O 3.44Å; A774-W776 PolarHBondContact O-N 3Å; A774-F910 HydrophobicContact CB-CE2 3.72Å; A774-F910 HydrophobicContact CB-CZ 3.88Å; A774-I914 HydrophobicContact CB-CD1 3.53Å; A774-I914 HydrophobicContact CB-CG1 3.78Å
775	R	95.2	Very high	92.4	Very high	13 Å²	13	28.9 Å²	28.9	5%	0.049	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	130.5	172.8	-174.8	172.1	177.7	177.8	3	109.5	V717 N719 D720 I722 F777 R913	V717-R775 VanDerWaalsContact O-CA 3.28Å; V717-R775 WeakPolarHBondContact O-CA 3.5Å; N719-R775 WeakPolarHBondContact O-CD 3.37Å; D720-R775 PolarHBondContact O-NH1 3.27Å; D720-R775 IonicContact OD1-CZ 3.09Å; D720-R775 IonicContact OD1-NE 2.67Å; D720-R775 IonicContact OD1-NH2 2.69Å; D720-R775 PolarHBondContact OD1-NH2 3.01Å; I722-R775 HydrophobicContact CB-CB 4.11Å; I722-R775 HydrophobicContact CD1-CB 4.36Å; I722-R775 HydrophobicContact CG2-CB 4.02Å; I722-R775 WeakPolarHBondContact O-CD 3.23Å; I722-R775 PolarHBondContact O-NH1 3.47Å; R775-F777 HydrophobicContact CB-CE2 4.45Å; R775-F777 HydrophobicContact CB-CZ 4.17Å; R775-F777 HydrophobicContact CG-CD1 4.31Å; R775-F777 HydrophobicContact CG-CE1 3.97Å; R775-F777 HydrophobicContact CG-CZ 4.08Å; R775-R913 PolarHBondContact O-NH2 3.11Å
776	W	95.4	Very high	92.8	Very high	5 Å²	5	27.1 Å²	27.1	2%	0.019	15%	0.146	C	C	.	.			trans	-93.2	121.7	166	176.3	26.7	0	0	0	109	V717 A774 K778 E905 F907 F910 V930 V932 E936	V717-W776 PolarHBondContact O-N 3.47Å; A774-W776 PolarHBondContact O-N 3Å; W776-K778 HydrophobicContact CD2-CB 3.94Å; W776-K778 HydrophobicContact CD2-CG 4.48Å; W776-K778 HydrophobicContact CE3-CB 4.28Å; W776-K778 HydrophobicContact CG-CB 4.43Å; W776-K778 HydrophobicContact CH2-CB 4.44Å; W776-K778 HydrophobicContact CH2-CD 3.92Å; W776-K778 HydrophobicContact CH2-CG 3.96Å; W776-K778 HydrophobicContact CZ2-CB 4.05Å; W776-K778 HydrophobicContact CZ2-CD 4.21Å; W776-K778 HydrophobicContact CZ2-CG 3.72Å; W776-K778 HydrophobicContact CZ3-CD 4.08Å; W776-K778 HydrophobicContact CZ3-CG 4.36Å; W776-K778 PolarHBondContact O-N 3.34Å; W776-K778 VanDerWaalsContact O-N 3.1Å; W776-E905 PolarHBondContact NE1-O 3.35Å; W776-F907 AromaticContact CD2-CD2 3.91Å; W776-F907 HydrophobicContact CD2-CD2 3.91Å; W776-F907 AromaticContact CE3-CD2 3.87Å; W776-F907 HydrophobicContact CE3-CD2 3.87Å; W776-F907 HydrophobicContact CE3-CE2 4.42Å; W776-F907 HydrophobicContact CH2-CB 3.96Å; W776-F907 AromaticContact CH2-CD2 3.97Å; W776-F907 HydrophobicContact CH2-CD2 3.97Å; W776-F907 HydrophobicContact CH2-CG 4.36Å; W776-F907 HydrophobicContact CZ2-CB 3.68Å; W776-F907 HydrophobicContact CZ2-CD2 4.07Å; W776-F907 HydrophobicContact CZ2-CG 4.37Å; W776-F907 AromaticContact CZ3-CD2 3.9Å; W776-F907 HydrophobicContact CZ3-CD2 3.9Å; W776-F910 HydrophobicContact CB-CD2 3.74Å; W776-F910 HydrophobicContact CB-CE2 4.08Å; W776-F910 HydrophobicContact CB-CG 4.24Å; W776-F910 HydrophobicContact CG-CB 4.28Å; W776-F910 HydrophobicContact CG-CD2 4.18Å; W776-F910 HydrophobicContact CG-CG 4.24Å; W776-V930 HydrophobicContact CE3-CG1 3.53Å; W776-V930 HydrophobicContact CZ3-CG1 3.8Å; W776-V932 HydrophobicContact CH2-CB 4.5Å; W776-V932 HydrophobicContact CH2-CG1 4.49Å; W776-V932 HydrophobicContact CH2-CG2 4.11Å; W776-V932 HydrophobicContact CZ3-CG2 3.75Å; W776-E936 WeakPolarHBondContact CH2-OE1 3.36Å; W776-E936 VanDerWaalsContact CZ2-OE1 3.29Å; W776-E936 WeakPolarHBondContact CZ2-OE1 3.49Å
777	F	93.4	Very high	92.7	Very high	10 Å²	10	24.8 Å²	24.8	4%	0.044	14%	0.135	C	C	.	.			trans	-86.1	58.8	178.6	-60.3	-78.9	0	0	0	110.8	R775 D779 T781 V902 A904 E905	R775-F777 HydrophobicContact CB-CE2 4.45Å; R775-F777 HydrophobicContact CB-CZ 4.17Å; R775-F777 HydrophobicContact CG-CD1 4.31Å; R775-F777 HydrophobicContact CG-CE1 3.97Å; R775-F777 HydrophobicContact CG-CZ 4.08Å; F777-D779 VanDerWaalsContact C-N 3.28Å; F777-D779 PolarHBondContact O-N 3.44Å; F777-T781 HydrophobicContact CD1-CG2 3.96Å; F777-V902 HydrophobicContact CB-CB 4.41Å; F777-V902 HydrophobicContact CB-CG1 4.25Å; F777-V902 HydrophobicContact CD1-CB 3.83Å; F777-V902 HydrophobicContact CD1-CG1 4.29Å; F777-V902 HydrophobicContact CD1-CG2 3.82Å; F777-V902 HydrophobicContact CD2-CG1 4.16Å; F777-V902 HydrophobicContact CE1-CB 4.24Å; F777-V902 HydrophobicContact CE1-CG2 3.69Å; F777-V902 HydrophobicContact CE2-CG2 4.48Å; F777-V902 HydrophobicContact CG-CB 4.01Å; F777-V902 HydrophobicContact CG-CG1 3.97Å; F777-V902 HydrophobicContact CG-CG2 4.28Å; F777-V902 HydrophobicContact CZ-CG2 4.06Å; F777-A904 CarbonylContact O-C 3.49Å; F777-A904 VanDerWaalsContact O-CA 3.25Å; F777-A904 WeakPolarHBondContact O-CA 3.44Å; F777-E905 HydrophobicContact CB-CG 4.17Å; F777-E905 WeakPolarHBondContact CD2-OE1 3.25Å; F777-E905 PolarHBondContact N-OE1 3.44Å; F777-E905 PolarHBondContact O-N 3.31Å
778	K	90.6	Very high	92.7	Very high	58 Å²	58	25.3 Å²	25.3	25%	0.252	14%	0.136	S	C	.	.			trans	-57.2	-38.8	-176.9	-170.2	-172.3	-177.2	79.7	0	113.3	W776 A904 V931 E936	W776-K778 HydrophobicContact CD2-CB 3.94Å; W776-K778 HydrophobicContact CD2-CG 4.48Å; W776-K778 HydrophobicContact CE3-CB 4.28Å; W776-K778 HydrophobicContact CG-CB 4.43Å; W776-K778 HydrophobicContact CH2-CB 4.44Å; W776-K778 HydrophobicContact CH2-CD 3.92Å; W776-K778 HydrophobicContact CH2-CG 3.96Å; W776-K778 HydrophobicContact CZ2-CB 4.05Å; W776-K778 HydrophobicContact CZ2-CD 4.21Å; W776-K778 HydrophobicContact CZ2-CG 3.72Å; W776-K778 HydrophobicContact CZ3-CD 4.08Å; W776-K778 HydrophobicContact CZ3-CG 4.36Å; W776-K778 PolarHBondContact O-N 3.34Å; W776-K778 VanDerWaalsContact O-N 3.1Å; K778-A904 WeakPolarHBondContact O-CB 3.46Å; K778-V931 PolarHBondContact NZ-O 3.04Å; K778-E936 IonicContact NZ-OE1 3.99Å; K778-E936 PolarHBondContact NZ-OE1 3.18Å; K778-E936 IonicContact NZ-OE2 3.22Å; K778-E936 PolarHBondContact NZ-OE2 2.85Å
779	D	89.3	Confident	92.2	Very high	115 Å²	115	31.4 Å²	31.4	62%	0.615	16%	0.161	S	C	*	.	S	Bend	trans	-111	155.7	176.6	-71	-68	0	0	0	110.8	F777 T781	F777-D779 VanDerWaalsContact C-N 3.28Å; F777-D779 PolarHBondContact O-N 3.44Å; D779-T781 PolarHBondContact O-N 3.49Å
780	E	91.2	Very high	92	Very high	98 Å²	98	27.6 Å²	27.6	46%	0.458	14%	0.139	S	C	.	.	P	Polyproline II helix	trans	-59.1	125.9	171	-62.9	-169.4	142.5	0	0	110.7	K867 V902 A904	E780-K867 HydrophobicContact CB-CB 4.13Å; E780-K867 VanDerWaalsContact O-CD 3.27Å; E780-K867 WeakPolarHBondContact O-CD 3.24Å; E780-K867 VanDerWaalsContact O-CE 3.29Å; E780-K867 WeakPolarHBondContact O-CE 3.25Å; E780-K867 PolarHBondContact O-NZ 3.49Å; E780-V902 WeakPolarHBondContact CA-O 3.45Å; E780-A904 HydrophobicContact CG-CB 4.29Å
781	T	91.4	Very high	91.5	Very high	18 Å²	18	35 Å²	35	11%	0.11	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-101	149.1	-176.4	49.9	0	0	0	0	111.5	F777 D779 K867 G868 G901 V902	F777-T781 HydrophobicContact CD1-CG2 3.96Å; D779-T781 PolarHBondContact O-N 3.49Å; T781-K867 CarbonylContact O-C 3.07Å; T781-K867 WeakPolarHBondContact O-CA 3.15Å; T781-G868 PolarHBondContact O-N 3.34Å; T781-G901 WeakPolarHBondContact O-CA 3.33Å; T781-V902 PolarHBondContact N-O 3.22Å; T781-V902 WeakPolarHBondContact OG1-CB 3.33Å; T781-V902 PolarHBondContact OG1-N 3.09Å; T781-V902 PolarHBondContact OG1-O 3.36Å
782	A	91.4	Very high	91	Very high	17 Å²	17	38.2 Å²	38.2	14%	0.14	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	154.1	171.8	0	0	0	0	0	110.5	T863 T866 K867	A782-T863 HydrophobicContact CB-CG2 3.75Å; A782-T866 WeakPolarHBondContact CA-O 3.15Å; A782-T866 VanDerWaalsContact CB-O 3.3Å; A782-T866 WeakPolarHBondContact CB-O 3.4Å; A782-K867 HydrophobicContact CB-CG 4.12Å
783	A	93.7	Very high	90.6	Very high	2 Å²	2	41.3 Å²	41.3	2%	0.017	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	144.5	167.2	0	0	0	0	0	110.5	G864 A871 L873 S899	A783-G864 PolarHBondContact O-N 2.89Å; A783-A871 HydrophobicContact CB-CB 4.36Å; A783-L873 HydrophobicContact CB-CB 4.38Å; A783-L873 HydrophobicContact CB-CD1 4.33Å; A783-L873 HydrophobicContact CB-CG 3.9Å; A783-S899 CarbonylContact C-O 3.52Å; A783-S899 WeakPolarHBondContact CA-O 3.43Å; A783-S899 WeakPolarHBondContact CB-O 3.19Å
784	F	93.5	Very high	90.2	Very high	12 Å²	12	41.6 Å²	41.6	5%	0.053	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	161.2	179	70.4	-92.4	0	0	0	112.8	D720 P723 K786 L862 T863 S899	D720-F784 WeakPolarHBondContact O-CE1 3.44Å; D720-F784 VanDerWaalsContact O-CZ 3.22Å; D720-F784 WeakPolarHBondContact O-CZ 3.44Å; P723-F784 HydrophobicContact CB-CZ 4.38Å; F784-K786 HydrophobicContact CD2-CB 4.3Å; F784-K786 HydrophobicContact CE2-CB 4.1Å; F784-L862 CarbonylContact C-O 3.58Å; F784-L862 WeakPolarHBondContact CA-O 3.39Å; F784-L862 WeakPolarHBondContact CB-O 3.4Å; F784-T863 HydrophobicContact CB-CG2 4.47Å; F784-S899 VanDerWaalsContact CE1-OG 3.24Å; F784-S899 WeakPolarHBondContact CE1-OG 3.02Å; F784-S899 VanDerWaalsContact CZ-CB 3.48Å; F784-S899 PolarHBondContact N-O 3Å; F784-S899 PolarHBondContact O-N 2.86Å
785	I	92.6	Very high	89.8	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	114.5	174.5	-55.1	-173.9	0	0	0	107.8	I807 V861 L862 L873 S874 A896 V898	I785-I807 HydrophobicContact CD1-CG2 4.28Å; I785-V861 WeakPolarHBondContact O-CA 3.47Å; I785-L862 HydrophobicContact CB-CB 4.29Å; I785-L862 HydrophobicContact CD1-CD2 4.12Å; I785-L862 PolarHBondContact N-O 3.34Å; I785-L862 PolarHBondContact O-N 3.3Å; I785-L873 HydrophobicContact CD1-CB 4.12Å; I785-L873 HydrophobicContact CD1-CD1 4.38Å; I785-L873 HydrophobicContact CG1-CB 4.06Å; I785-L873 HydrophobicContact CG1-CD1 3.91Å; I785-S874 WeakPolarHBondContact CD1-O 3.38Å; I785-A896 HydrophobicContact CG2-CB 3.25Å; I785-V898 HydrophobicContact CG1-CG2 4.26Å; I785-V898 HydrophobicContact CG2-CG2 4.43Å
786	K	91.3	Very high	89.4	Confident	9 Å²	9	46.6 Å²	46.6	4%	0.039	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	96	177	-175.8	177.4	80.4	173.6	0	109.4	L721 E743 F784 T857 A896 V897	L721-K786 HydrophobicContact CB-CD 4.24Å; L721-K786 HydrophobicContact CD2-CD 4.28Å; L721-K786 PolarHBondContact O-NZ 3.1Å; E743-K786 WeakPolarHBondContact OE1-CE 3.32Å; E743-K786 IonicContact OE1-NZ 3.29Å; E743-K786 PolarHBondContact OE1-NZ 2.71Å; F784-K786 HydrophobicContact CD2-CB 4.3Å; F784-K786 HydrophobicContact CE2-CB 4.1Å; K786-T857 HydrophobicContact CD-CG2 4.02Å; K786-T857 HydrophobicContact CG-CG2 4.16Å; K786-A896 CarbonylContact O-C 3.44Å; K786-A896 WeakPolarHBondContact O-CA 3.28Å; K786-A896 WeakPolarHBondContact O-CB 3.28Å; K786-V897 HydrophobicContact CB-CB 4.33Å; K786-V897 PolarHBondContact N-O 3.26Å; K786-V897 PolarHBondContact O-N 2.86Å
787	G	88.9	Confident	89.2	Confident	4 Å²	4	46.3 Å²	46.3	4%	0.041	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-64.2	150.4	-179.5	0	0	0	0	0	113.9	F860 G892	G787-F860 VanDerWaalsContact CA-O 3.23Å; G787-F860 WeakPolarHBondContact CA-O 3.28Å; G787-F860 PolarHBondContact N-O 2.94Å; G787-G892 WeakPolarHBondContact CA-O 3.36Å
788	V	87.7	Confident	88.9	Confident	65 Å²	65	47 Å²	47	39%	0.394	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-78.2	165.3	167.3	-60.2	0	0	0	0	110.3	G892	V788-G892 WeakPolarHBondContact CG2-O 3.5Å; V788-G892 PolarHBondContact N-O 2.95Å
789	K	83.6	Confident	88.8	Confident	131 Å²	131	48.1 Å²	48.1	57%	0.57	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-62.2	133.9	177.2	177.6	172.9	177.9	-177.7	0	111.7	G858	K789-G858 VanDerWaalsContact CA-O 3.29Å; K789-G858 WeakPolarHBondContact CA-O 3.44Å; K789-G858 WeakPolarHBondContact CB-O 3.5Å; K789-G858 WeakPolarHBondContact CG-O 3.27Å
790	P	87.8	Confident	88.7	Confident	6 Å²	6	46.6 Å²	46.6	4%	0.039	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-60.1	140.8	173.2	-24.7	34.4	0	0	0	113.2	I797 Y830 G858 F860	P790-I797 HydrophobicContact CB-CD1 3.86Å; P790-I797 HydrophobicContact CG-CD1 4.41Å; P790-Y830 HydrophobicContact CB-CE1 4.12Å; P790-Y830 HydrophobicContact CG-CD1 4.34Å; P790-Y830 HydrophobicContact CG-CE1 4.05Å; P790-G858 WeakPolarHBondContact CD-O 3.29Å; P790-F860 HydrophobicContact CG-CD2 4.12Å; P790-F860 HydrophobicContact CG-CE2 3.64Å
791	N	82.4	Confident	88.4	Confident	170 Å²	170	42.5 Å²	42.5	91%	0.909	25%	0.249	S	C	*	.	S	Bend	trans	-82.3	-22.9	176.9	-72.9	-27.4	0	0	0	113.3
792	E	85.1	Confident	88.4	Confident	69 Å²	69	46.4 Å²	46.4	32%	0.322	26%	0.264	S	S	.	.	S	Bend	trans	-100.1	150.1	174.1	-68.8	-164.7	-134.1	0	0	110.6	A796 I797 K800 Y830	E792-A796 HydrophobicContact CB-CB 4.18Å; E792-A796 WeakPolarHBondContact OE2-CB 3.18Å; E792-I797 HydrophobicContact CB-CG1 3.95Å; E792-K800 WeakPolarHBondContact OE1-CE 3.43Å; E792-K800 IonicContact OE1-NZ 2.59Å; E792-K800 PolarHBondContact OE1-NZ 2.88Å; E792-K800 WeakPolarHBondContact OE2-CE 3.36Å; E792-K800 IonicContact OE2-NZ 3.53Å; E792-K800 PolarHBondContact OE2-NZ 2.7Å; E792-Y830 PolarHBondContact O-OH 3.47Å
793	S	86.7	Confident	88.3	Confident	64 Å²	64	45.6 Å²	45.6	45%	0.448	26%	0.257	S	S	.	.			trans	-69	156	175.2	61.9	0	0	0	0	111.7	T795 A796 I797	S793-T795 VanDerWaalsContact C-N 3.26Å; S793-T795 PolarHBondContact O-N 3.19Å; S793-A796 WeakPolarHBondContact O-CA 3.49Å; S793-A796 WeakPolarHBondContact O-CB 3.49Å; S793-A796 PolarHBondContact O-N 3.36Å; S793-I797 WeakPolarHBondContact O-CG1 3.19Å; S793-I797 PolarHBondContact O-N 3.43Å
794	A	87.9	Confident	88	Confident	7 Å²	7	45.5 Å²	45.5	6%	0.058	26%	0.256	C	S	.	.	H	α-helix	trans	-48.9	-46.4	176.9	0	0	0	0	0	112.7	A796 I797 I798 P828 Y830 I833	A794-A796 VanDerWaalsContact C-N 3.31Å; A794-A796 PolarHBondContact O-N 2.98Å; A794-I797 PolarHBondContact O-N 2.94Å; A794-I798 WeakPolarHBondContact O-CG1 3.42Å; A794-I798 PolarHBondContact O-N 3.44Å; A794-P828 WeakPolarHBondContact CB-O 3.39Å; A794-Y830 HydrophobicContact CB-CD1 3.9Å; A794-Y830 HydrophobicContact CB-CE1 3.93Å; A794-Y830 HydrophobicContact CB-CG 4.41Å; A794-I833 HydrophobicContact CB-CD1 3.72Å
795	T	86.9	Confident	88	Confident	87 Å²	87	44.9 Å²	44.9	53%	0.534	25%	0.254	S	S	.	.	H	α-helix	trans	-56.9	-39.4	175	-35.2	0	0	0	0	113.3	S793 A799	S793-T795 VanDerWaalsContact C-N 3.26Å; S793-T795 PolarHBondContact O-N 3.19Å; T795-A799 WeakPolarHBondContact O-CB 3.36Å; T795-A799 PolarHBondContact O-N 2.89Å
796	A	87.5	Confident	87.9	Confident	30 Å²	30	46 Å²	46	25%	0.248	26%	0.259	C	S	.	.	H	α-helix	trans	-76.6	-32.3	-180	0	0	0	0	0	112.5	E792 S793 A794 A799 K800	E792-A796 HydrophobicContact CB-CB 4.18Å; E792-A796 WeakPolarHBondContact OE2-CB 3.18Å; S793-A796 WeakPolarHBondContact O-CA 3.49Å; S793-A796 WeakPolarHBondContact O-CB 3.49Å; S793-A796 PolarHBondContact O-N 3.36Å; A794-A796 VanDerWaalsContact C-N 3.31Å; A794-A796 PolarHBondContact O-N 2.98Å; A796-A799 PolarHBondContact O-N 3.42Å; A796-K800 VanDerWaalsContact O-CE 3.23Å; A796-K800 WeakPolarHBondContact O-CE 3.38Å
797	I	90.2	Very high	87.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-42.7	171.7	-61.7	173	0	0	0	110.6	P790 E792 S793 A794 A799 K800 L820 Y830 I833 L891	P790-I797 HydrophobicContact CB-CD1 3.86Å; P790-I797 HydrophobicContact CG-CD1 4.41Å; E792-I797 HydrophobicContact CB-CG1 3.95Å; S793-I797 WeakPolarHBondContact O-CG1 3.19Å; S793-I797 PolarHBondContact O-N 3.43Å; A794-I797 PolarHBondContact O-N 2.94Å; I797-A799 VanDerWaalsContact C-N 3.31Å; I797-A799 PolarHBondContact O-N 2.86Å; I797-K800 WeakPolarHBondContact O-CB 3.46Å; I797-K800 WeakPolarHBondContact O-CG 3.16Å; I797-K800 PolarHBondContact O-N 3Å; I797-L820 HydrophobicContact CG2-CD1 3.77Å; I797-Y830 HydrophobicContact CD1-CD1 4.49Å; I797-Y830 HydrophobicContact CD1-CE1 4.01Å; I797-I833 HydrophobicContact CB-CD1 4.21Å; I797-I833 HydrophobicContact CG2-CD1 4.24Å; I797-L891 HydrophobicContact CG2-CD2 4.04Å
798	I	87.8	Confident	87.9	Confident	23 Å²	23	46.5 Å²	46.5	12%	0.118	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-38.7	175.6	-72	163.8	0	0	0	111.3	A794 K800 G801 L820 I823 P828 I833	A794-I798 WeakPolarHBondContact O-CG1 3.42Å; A794-I798 PolarHBondContact O-N 3.44Å; I798-K800 PolarHBondContact O-N 2.78Å; I798-G801 PolarHBondContact O-N 3.13Å; I798-L820 HydrophobicContact CG1-CB 4.27Å; I798-I823 HydrophobicContact CD1-CB 4.17Å; I798-I823 HydrophobicContact CD1-CD1 3.95Å; I798-I823 HydrophobicContact CD1-CG2 3.94Å; I798-I823 HydrophobicContact CG1-CD1 4.09Å; I798-P828 HydrophobicContact CD1-CB 3.38Å; I798-P828 HydrophobicContact CD1-CG 3.64Å; I798-I833 HydrophobicContact CD1-CD1 4.02Å; I798-I833 HydrophobicContact CD1-CG1 3.87Å; I798-I833 HydrophobicContact CG1-CD1 3.89Å; I798-I833 HydrophobicContact CG1-CG1 3.84Å
799	A	87.2	Confident	88	Confident	83 Å²	83	44.1 Å²	44.1	69%	0.686	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-6.1	177	0	0	0	0	0	115	T795 A796 I797	T795-A799 WeakPolarHBondContact O-CB 3.36Å; T795-A799 PolarHBondContact O-N 2.89Å; A796-A799 PolarHBondContact O-N 3.42Å; I797-A799 VanDerWaalsContact C-N 3.31Å; I797-A799 PolarHBondContact O-N 2.86Å
800	K	87.1	Confident	88.2	Confident	82 Å²	82	41.2 Å²	41.2	36%	0.357	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-21.8	169	-45.1	-64.2	176.3	177.3	0	112.4	E792 A796 I797 I798 K802 V803 A885 L890	E792-K800 WeakPolarHBondContact OE1-CE 3.43Å; E792-K800 IonicContact OE1-NZ 2.59Å; E792-K800 PolarHBondContact OE1-NZ 2.88Å; E792-K800 WeakPolarHBondContact OE2-CE 3.36Å; E792-K800 IonicContact OE2-NZ 3.53Å; E792-K800 PolarHBondContact OE2-NZ 2.7Å; A796-K800 VanDerWaalsContact O-CE 3.23Å; A796-K800 WeakPolarHBondContact O-CE 3.38Å; I797-K800 WeakPolarHBondContact O-CB 3.46Å; I797-K800 WeakPolarHBondContact O-CG 3.16Å; I797-K800 PolarHBondContact O-N 3Å; I798-K800 PolarHBondContact O-N 2.78Å; K800-K802 PolarHBondContact O-N 3.22Å; K800-K802 VanDerWaalsContact O-N 3.09Å; K800-V803 HydrophobicContact CB-CG2 3.84Å; K800-A885 HydrophobicContact CB-CB 4.46Å; K800-L890 HydrophobicContact CD-CD2 4.47Å; K800-L890 HydrophobicContact CG-CD1 4.02Å; K800-L890 HydrophobicContact CG-CD2 4.49Å
801	G	86.9	Confident	88	Confident	13 Å²	13	44.1 Å²	44.1	13%	0.134	27%	0.272	C	S	.	.			trans	67.2	-99	-174	0	0	0	0	0	111.8	I798 V803 D819 L820	I798-G801 PolarHBondContact O-N 3.13Å; G801-V803 PolarHBondContact O-N 3.1Å; G801-D819 VanDerWaalsContact C-OD1 3.29Å; G801-L820 PolarHBondContact O-N 3.36Å
802	K	89.4	Confident	88.1	Confident	99 Å²	99	38.6 Å²	38.6	43%	0.43	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	119.2	-176.9	-70.5	-172.1	177.3	-172.6	0	112.3	K800 D819 Y884 A885	K800-K802 PolarHBondContact O-N 3.22Å; K800-K802 VanDerWaalsContact O-N 3.09Å; K802-D819 WeakPolarHBondContact CE-OD2 3.33Å; K802-D819 HydrophobicContact CG-CB 4.18Å; K802-D819 VanDerWaalsContact CG-CG 3.49Å; K802-D819 WeakPolarHBondContact CG-OD2 3.41Å; K802-Y884 HydrophobicContact CB-CD1 3.74Å; K802-Y884 HydrophobicContact CB-CE1 4.03Å; K802-Y884 HydrophobicContact CB-CG 4.36Å; K802-Y884 HydrophobicContact CD-CE1 4.28Å; K802-Y884 HydrophobicContact CG-CE1 4.31Å; K802-A885 PolarHBondContact O-N 2.73Å
803	V	89.4	Confident	88.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	149.5	-175.9	-178.2	0	0	0	0	109	K800 G801 F818 L820 A885 L890	K800-V803 HydrophobicContact CB-CG2 3.84Å; G801-V803 PolarHBondContact O-N 3.1Å; V803-F818 HydrophobicContact CB-CD2 3.97Å; V803-F818 HydrophobicContact CB-CE2 3.48Å; V803-F818 VanDerWaalsContact CB-CE2 3.48Å; V803-F818 HydrophobicContact CB-CZ 4.13Å; V803-F818 HydrophobicContact CG1-CD2 4.5Å; V803-F818 HydrophobicContact CG1-CE2 3.55Å; V803-F818 HydrophobicContact CG1-CZ 3.79Å; V803-F818 PolarHBondContact N-O 2.87Å; V803-F818 PolarHBondContact O-N 3.3Å; V803-L820 HydrophobicContact CG2-CD1 4.19Å; V803-A885 HydrophobicContact CG2-CB 4.39Å; V803-L890 HydrophobicContact CG1-CD1 4.23Å; V803-L890 HydrophobicContact CG2-CD1 4.4Å
804	G	89.2	Confident	88.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	171.5	174	0	0	0	0	0	113.4	V816 P879 A885 G887	G804-V816 CarbonylContact C-O 3.56Å; G804-V816 WeakPolarHBondContact CA-O 3.41Å; G804-P879 VanDerWaalsContact O-CD 3.29Å; G804-P879 WeakPolarHBondContact O-CD 3.39Å; G804-P879 WeakPolarHBondContact O-CG 3.31Å; G804-A885 PolarHBondContact N-O 3.29Å; G804-A885 VanDerWaalsContact N-O 3.09Å; G804-G887 VanDerWaalsContact O-CA 3.26Å; G804-G887 WeakPolarHBondContact O-CA 3.34Å; G804-G887 PolarHBondContact O-N 3.37Å
805	F	92.7	Very high	88.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	153.7	174.3	55.2	-98.5	0	0	0	111.3	I807 V816 F818 I837 V841 F851 L862 S877 L891 L893	F805-I807 HydrophobicContact CD2-CG2 4.18Å; F805-I807 HydrophobicContact CE2-CD1 4.23Å; F805-I807 HydrophobicContact CE2-CG2 4.44Å; F805-V816 HydrophobicContact CD2-CB 4.12Å; F805-V816 HydrophobicContact CD2-CG2 4.31Å; F805-V816 HydrophobicContact CE1-CB 4.42Å; F805-V816 HydrophobicContact CE1-CG1 4.34Å; F805-V816 HydrophobicContact CE2-CB 3.76Å; F805-V816 HydrophobicContact CE2-CG1 4.27Å; F805-V816 HydrophobicContact CE2-CG2 3.76Å; F805-V816 HydrophobicContact CZ-CB 3.93Å; F805-V816 HydrophobicContact CZ-CG1 3.93Å; F805-V816 HydrophobicContact CZ-CG2 4.24Å; F805-V816 PolarHBondContact N-O 2.95Å; F805-V816 PolarHBondContact O-N 3.48Å; F805-F818 AromaticContact CD1-CE1 3.87Å; F805-F818 HydrophobicContact CD1-CE1 3.87Å; F805-F818 AromaticContact CD1-CZ 3.99Å; F805-F818 HydrophobicContact CD1-CZ 3.99Å; F805-F818 AromaticContact CE1-CE1 3.64Å; F805-F818 HydrophobicContact CE1-CE1 3.64Å; F805-F818 AromaticContact CE1-CZ 3.91Å; F805-F818 HydrophobicContact CE1-CZ 3.91Å; F805-I837 HydrophobicContact CE1-CG2 4.23Å; F805-I837 HydrophobicContact CZ-CG2 4.39Å; F805-V841 HydrophobicContact CZ-CG2 4.31Å; F805-F851 HydrophobicContact CE1-CE2 4.49Å; F805-F851 HydrophobicContact CZ-CE2 4.24Å; F805-L862 HydrophobicContact CE2-CD2 4.38Å; F805-S877 WeakPolarHBondContact CA-O 3.36Å; F805-L891 HydrophobicContact CD1-CD1 4.28Å; F805-L891 HydrophobicContact CE1-CD1 4.15Å; F805-L893 HydrophobicContact CD1-CD1 3.92Å; F805-L893 HydrophobicContact CE1-CD1 3.76Å; F805-L893 HydrophobicContact CE2-CD1 4.43Å; F805-L893 HydrophobicContact CG-CD1 4.32Å; F805-L893 HydrophobicContact CZ-CD1 4.04Å
806	N	89.6	Confident	88.5	Confident	23 Å²	23	38.6 Å²	38.6	12%	0.123	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.5	174.2	-168.6	-78.3	0	0	0	111.3	K814 D815 S877	N806-K814 WeakPolarHBondContact CA-O 3.3Å; N806-D815 VanDerWaalsContact ND2-CG 3.28Å; N806-D815 PolarHBondContact ND2-OD1 3.38Å; N806-S877 PolarHBondContact N-O 3.32Å; N806-S877 PolarHBondContact O-N 2.85Å; N806-S877 PolarHBondContact O-OG 3.35Å; N806-S877 VanDerWaalsContact O-OG 3.05Å
807	I	90.7	Very high	88.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	148.4	177.3	45.7	170.6	0	0	0	109.4	I785 F805 V809 A813 K814 V816 I845 L862 A876	I785-I807 HydrophobicContact CD1-CG2 4.28Å; F805-I807 HydrophobicContact CD2-CG2 4.18Å; F805-I807 HydrophobicContact CE2-CD1 4.23Å; F805-I807 HydrophobicContact CE2-CG2 4.44Å; I807-V809 HydrophobicContact CD1-CG2 4.14Å; I807-A813 CarbonylContact O-C 3.55Å; I807-K814 HydrophobicContact CG1-CB 4.32Å; I807-K814 PolarHBondContact N-O 3.01Å; I807-K814 PolarHBondContact O-N 2.75Å; I807-V816 HydrophobicContact CD1-CG2 4.18Å; I807-V816 HydrophobicContact CG1-CG2 4.43Å; I807-I845 HydrophobicContact CD1-CD1 3.44Å; I807-I845 VanDerWaalsContact CD1-CD1 3.44Å; I807-I845 HydrophobicContact CD1-CG1 4.16Å; I807-L862 HydrophobicContact CD1-CD2 3.79Å; I807-A876 HydrophobicContact CG2-CB 4Å
808	A	89.5	Confident	88.5	Confident	24 Å²	24	39.8 Å²	39.8	20%	0.198	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.1	164.2	0	0	0	0	0	110	A812 L873 S874	A808-A812 CarbonylContact C-O 3.55Å; A808-A812 WeakPolarHBondContact CA-O 3.47Å; A808-L873 CarbonylContact O-C 3.22Å; A808-L873 WeakPolarHBondContact O-CA 3.22Å; A808-S874 PolarHBondContact N-OG 2.96Å; A808-S874 PolarHBondContact O-N 3.19Å
809	V	90	Very high	88.6	Confident	15 Å²	15	41.3 Å²	41.3	9%	0.091	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.8	174.5	-175.6	0	0	0	0	107.4	I807 G811 A812 K814 I845 L873	I807-V809 HydrophobicContact CD1-CG2 4.14Å; V809-G811 PolarHBondContact O-N 2.99Å; V809-G811 VanDerWaalsContact O-N 3.08Å; V809-A812 PolarHBondContact N-O 2.93Å; V809-A812 PolarHBondContact O-N 3.29Å; V809-K814 HydrophobicContact CB-CG 4.37Å; V809-K814 HydrophobicContact CG2-CB 4.43Å; V809-K814 HydrophobicContact CG2-CG 3.87Å; V809-I845 HydrophobicContact CG1-CG2 3.99Å; V809-I845 HydrophobicContact CG2-CD1 4.34Å; V809-I845 HydrophobicContact CG2-CG1 4.14Å; V809-I845 HydrophobicContact CG2-CG2 4Å; V809-L873 HydrophobicContact CB-CD2 4.28Å; V809-L873 HydrophobicContact CG1-CD2 4.17Å; V809-L873 HydrophobicContact CG2-CD2 3.83Å
810	D	88.9	Confident	88.7	Confident	70 Å²	70	37.3 Å²	37.3	37%	0.374	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	33.9	-177.2	-58.8	-25.3	0	0	0	113	T866 A871 T872	D810-T866 VanDerWaalsContact OD2-CB 3.31Å; D810-T866 WeakPolarHBondContact OD2-CB 2.98Å; D810-T866 PolarHBondContact OD2-OG1 3.21Å; D810-A871 VanDerWaalsContact OD1-CA 3.3Å; D810-A871 WeakPolarHBondContact OD1-CA 3.2Å; D810-T872 WeakPolarHBondContact CA-OG1 3.43Å; D810-T872 PolarHBondContact N-O 3.48Å; D810-T872 PolarHBondContact OD1-N 3.02Å
811	G	84	Confident	88.6	Confident	67 Å²	67	37.3 Å²	37.3	69%	0.691	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.1	-4.5	-177.3	0	0	0	0	0	116	V809	V809-G811 PolarHBondContact O-N 2.99Å; V809-G811 VanDerWaalsContact O-N 3.08Å
812	A	84.4	Confident	88.5	Confident	55 Å²	55	41.1 Å²	41.1	46%	0.455	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	122.8	178.5	0	0	0	0	0	111.8	A808 V809	A808-A812 CarbonylContact C-O 3.55Å; A808-A812 WeakPolarHBondContact CA-O 3.47Å; V809-A812 PolarHBondContact N-O 2.93Å; V809-A812 PolarHBondContact O-N 3.29Å
813	A	88.1	Confident	88.5	Confident	74 Å²	74	37.7 Å²	37.7	61%	0.612	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	140.7	179.3	0	0	0	0	0	112.8	I807	I807-A813 CarbonylContact O-C 3.55Å
814	K	88.1	Confident	87.9	Confident	81 Å²	81	47 Å²	47	35%	0.352	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	122.4	-179.4	-64.2	-68	-170.8	143.6	0	108.8	N806 I807 V809 A844	N806-K814 WeakPolarHBondContact CA-O 3.3Å; I807-K814 HydrophobicContact CG1-CB 4.32Å; I807-K814 PolarHBondContact N-O 3.01Å; I807-K814 PolarHBondContact O-N 2.75Å; V809-K814 HydrophobicContact CB-CG 4.37Å; V809-K814 HydrophobicContact CG2-CB 4.43Å; V809-K814 HydrophobicContact CG2-CG 3.87Å; K814-A844 WeakPolarHBondContact CD-O 3.5Å; K814-A844 WeakPolarHBondContact CE-O 3.45Å; K814-A844 PolarHBondContact NZ-O 3.23Å
815	D	87.4	Confident	87.3	Confident	70 Å²	70	50.8 Å²	50.8	37%	0.374	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	132	162.8	-66.9	-66.1	0	0	0	109	N806 V880	N806-D815 VanDerWaalsContact ND2-CG 3.28Å; N806-D815 PolarHBondContact ND2-OD1 3.38Å; D815-V880 PolarHBondContact OD1-N 2.95Å
816	V	89.8	Confident	86.5	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118.7	168.7	-176	0	0	0	0	106.5	G804 F805 I807 F818 E840 V841 A844	G804-V816 CarbonylContact C-O 3.56Å; G804-V816 WeakPolarHBondContact CA-O 3.41Å; F805-V816 HydrophobicContact CD2-CB 4.12Å; F805-V816 HydrophobicContact CD2-CG2 4.31Å; F805-V816 HydrophobicContact CE1-CB 4.42Å; F805-V816 HydrophobicContact CE1-CG1 4.34Å; F805-V816 HydrophobicContact CE2-CB 3.76Å; F805-V816 HydrophobicContact CE2-CG1 4.27Å; F805-V816 HydrophobicContact CE2-CG2 3.76Å; F805-V816 HydrophobicContact CZ-CB 3.93Å; F805-V816 HydrophobicContact CZ-CG1 3.93Å; F805-V816 HydrophobicContact CZ-CG2 4.24Å; F805-V816 PolarHBondContact N-O 2.95Å; F805-V816 PolarHBondContact O-N 3.48Å; I807-V816 HydrophobicContact CD1-CG2 4.18Å; I807-V816 HydrophobicContact CG1-CG2 4.43Å; V816-F818 HydrophobicContact CG1-CD1 4.09Å; V816-F818 HydrophobicContact CG1-CE1 4.12Å; V816-E840 HydrophobicContact CG1-CB 4.31Å; V816-V841 HydrophobicContact CG1-CG2 3.85Å; V816-A844 HydrophobicContact CG2-CB 4.12Å
817	V	88.8	Confident	86.2	Confident	48 Å²	48	63.4 Å²	63.4	29%	0.291	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.5	-173.6	-72.3	0	0	0	0	110.3	Y884	V817-Y884 HydrophobicContact CB-CD1 4.03Å; V817-Y884 HydrophobicContact CB-CE1 3.66Å; V817-Y884 HydrophobicContact CG1-CD1 4.1Å; V817-Y884 HydrophobicContact CG1-CD2 4.35Å; V817-Y884 HydrophobicContact CG1-CE1 4.12Å; V817-Y884 HydrophobicContact CG1-CE2 4.36Å; V817-Y884 HydrophobicContact CG1-CG 4.23Å
818	F	89.5	Confident	85.8	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.035	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	163.1	-171.6	39.3	-85.7	0	0	0	110.7	V803 F805 V816 L820 I837 E840 L891	V803-F818 HydrophobicContact CB-CD2 3.97Å; V803-F818 HydrophobicContact CB-CE2 3.48Å; V803-F818 VanDerWaalsContact CB-CE2 3.48Å; V803-F818 HydrophobicContact CB-CZ 4.13Å; V803-F818 HydrophobicContact CG1-CD2 4.5Å; V803-F818 HydrophobicContact CG1-CE2 3.55Å; V803-F818 HydrophobicContact CG1-CZ 3.79Å; V803-F818 PolarHBondContact N-O 2.87Å; V803-F818 PolarHBondContact O-N 3.3Å; F805-F818 AromaticContact CD1-CE1 3.87Å; F805-F818 HydrophobicContact CD1-CE1 3.87Å; F805-F818 AromaticContact CD1-CZ 3.99Å; F805-F818 HydrophobicContact CD1-CZ 3.99Å; F805-F818 AromaticContact CE1-CE1 3.64Å; F805-F818 HydrophobicContact CE1-CE1 3.64Å; F805-F818 AromaticContact CE1-CZ 3.91Å; F805-F818 HydrophobicContact CE1-CZ 3.91Å; V816-F818 HydrophobicContact CG1-CD1 4.09Å; V816-F818 HydrophobicContact CG1-CE1 4.12Å; F818-L820 HydrophobicContact CD2-CD2 3.86Å; F818-L820 HydrophobicContact CD2-CG 4.05Å; F818-L820 HydrophobicContact CE2-CD2 4.34Å; F818-L820 HydrophobicContact CE2-CG 4.42Å; F818-I837 HydrophobicContact CD1-CG1 4.05Å; F818-I837 HydrophobicContact CD1-CG2 4.35Å; F818-I837 HydrophobicContact CD2-CD1 4.12Å; F818-I837 HydrophobicContact CD2-CG1 3.63Å; F818-I837 HydrophobicContact CE1-CD1 4.35Å; F818-I837 HydrophobicContact CE1-CG1 4.02Å; F818-I837 HydrophobicContact CE1-CG2 4.1Å; F818-I837 HydrophobicContact CE2-CD1 3.53Å; F818-I837 HydrophobicContact CE2-CG1 3.55Å; F818-I837 HydrophobicContact CG-CG1 3.88Å; F818-I837 HydrophobicContact CZ-CD1 3.69Å; F818-I837 HydrophobicContact CZ-CG1 3.78Å; F818-I837 HydrophobicContact CZ-CG2 4.45Å; F818-E840 HydrophobicContact CB-CG 4.28Å; F818-L891 HydrophobicContact CE2-CD1 4.33Å; F818-L891 HydrophobicContact CZ-CD1 3.84Å
819	D	89.4	Confident	85.8	Confident	54 Å²	54	65.4 Å²	65.4	29%	0.289	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	109	175.8	-157.2	-23.5	0	0	0	108.9	G801 K802 S821 T822	G801-D819 VanDerWaalsContact C-OD1 3.29Å; K802-D819 WeakPolarHBondContact CE-OD2 3.33Å; K802-D819 HydrophobicContact CG-CB 4.18Å; K802-D819 VanDerWaalsContact CG-CG 3.49Å; K802-D819 WeakPolarHBondContact CG-OD2 3.41Å; D819-S821 PolarHBondContact O-N 3.19Å; D819-S821 PolarHBondContact OD1-N 3.15Å; D819-S821 PolarHBondContact OD1-OG 3.13Å; D819-T822 PolarHBondContact O-OG1 2.85Å
820	L	90.1	Very high	85.9	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-77.7	-6.2	-177.3	-61	179.6	0	0	0	112.5	I797 I798 G801 V803 F818 T822 I823 I833 V836 I837	I797-L820 HydrophobicContact CG2-CD1 3.77Å; I798-L820 HydrophobicContact CG1-CB 4.27Å; G801-L820 PolarHBondContact O-N 3.36Å; V803-L820 HydrophobicContact CG2-CD1 4.19Å; F818-L820 HydrophobicContact CD2-CD2 3.86Å; F818-L820 HydrophobicContact CD2-CG 4.05Å; F818-L820 HydrophobicContact CE2-CD2 4.34Å; F818-L820 HydrophobicContact CE2-CG 4.42Å; L820-T822 PolarHBondContact O-N 2.93Å; L820-I823 HydrophobicContact CD2-CD1 4.31Å; L820-I823 PolarHBondContact O-N 2.8Å; L820-I833 HydrophobicContact CD1-CG2 4.32Å; L820-I833 HydrophobicContact CD2-CG2 4.22Å; L820-V836 HydrophobicContact CD2-CB 4.36Å; L820-V836 HydrophobicContact CD2-CG1 4.1Å; L820-I837 HydrophobicContact CD2-CG1 4.46Å
821	S	84.9	Confident	86.1	Confident	81 Å²	81	65.9 Å²	65.9	57%	0.566	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-69.2	0.8	178.4	91.5	0	0	0	0	114	D819	D819-S821 PolarHBondContact O-N 3.19Å; D819-S821 PolarHBondContact OD1-N 3.15Å; D819-S821 PolarHBondContact OD1-OG 3.13Å
822	T	84.5	Confident	86.4	Confident	94 Å²	94	65 Å²	65	58%	0.577	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-86.5	-6.6	173.2	61.5	0	0	0	0	113.4	D819 L820 E824	D819-T822 PolarHBondContact O-OG1 2.85Å; L820-T822 PolarHBondContact O-N 2.93Å; T822-E824 PolarHBondContact O-N 2.67Å
823	I	88.9	Confident	86.9	Confident	27 Å²	27	62.4 Å²	62.4	14%	0.138	36%	0.355	C	S	.	.			trans	-85	89.9	179.4	-57.5	177.9	0	0	0	109	I798 L820 D825 P828 D832 I833 V836	I798-I823 HydrophobicContact CD1-CB 4.17Å; I798-I823 HydrophobicContact CD1-CD1 3.95Å; I798-I823 HydrophobicContact CD1-CG2 3.94Å; I798-I823 HydrophobicContact CG1-CD1 4.09Å; L820-I823 HydrophobicContact CD2-CD1 4.31Å; L820-I823 PolarHBondContact O-N 2.8Å; I823-D825 VanDerWaalsContact C-N 3.3Å; I823-D825 HydrophobicContact CG2-CB 4.34Å; I823-D825 PolarHBondContact O-N 3.23Å; I823-P828 HydrophobicContact CG2-CB 4.07Å; I823-D832 HydrophobicContact CD1-CB 4.43Å; I823-D832 HydrophobicContact CG2-CB 4.29Å; I823-I833 HydrophobicContact CD1-CG1 4.05Å; I823-V836 HydrophobicContact CD1-CG2 3.9Å; I823-V836 HydrophobicContact CG1-CG2 3.81Å
824	E	78.2	Confident	87.2	Confident	194 Å²	194	59 Å²	59	91%	0.907	33%	0.327	S	S	*	.			trans	-87	55.6	177.5	-62.3	-172.8	172.2	0	0	112.2	T822	T822-E824 PolarHBondContact O-N 2.67Å
825	D	76.7	Confident	87.4	Confident	80 Å²	80	61.2 Å²	61.2	43%	0.428	34%	0.339	S	S	.	.			trans	-111.1	141.2	174.2	-160.3	-61.4	0	0	0	111	I823 T827 P828	I823-D825 VanDerWaalsContact C-N 3.3Å; I823-D825 HydrophobicContact CG2-CB 4.34Å; I823-D825 PolarHBondContact O-N 3.23Å; D825-T827 VanDerWaalsContact C-N 3.28Å; D825-T827 WeakPolarHBondContact OD1-CA 3.36Å; D825-T827 PolarHBondContact OD1-N 2.9Å; D825-T827 PolarHBondContact OD1-OG1 3.3Å; D825-T827 VanDerWaalsContact OD1-OG1 3.1Å; D825-P828 HydrophobicContact CB-CB 4.31Å; D825-P828 WeakPolarHBondContact O-CD 3.48Å
826	D	76	Confident	87.6	Confident	168 Å²	168	59.7 Å²	59.7	90%	0.898	33%	0.332	S	S	*	.	S	Bend	trans	-72.4	-21.4	175.5	-77.3	-40.1	0	0	0	112.6
827	T	82.3	Confident	87.8	Confident	120 Å²	120	59.6 Å²	59.6	74%	0.736	33%	0.331	S	S	*	.	S	Bend	trans	-138.4	52	-171.8	46.1	0	0	0	0	112.9	D825	D825-T827 VanDerWaalsContact C-N 3.28Å; D825-T827 WeakPolarHBondContact OD1-CA 3.36Å; D825-T827 PolarHBondContact OD1-N 2.9Å; D825-T827 PolarHBondContact OD1-OG1 3.3Å; D825-T827 VanDerWaalsContact OD1-OG1 3.1Å
828	P	83.3	Confident	88.1	Confident	17 Å²	17	58.6 Å²	58.6	11%	0.11	32%	0.324	C	S	.	.			trans	-66	143	-169.4	28.5	-36.3	0	0	0	113.1	A794 I798 I823 D825	A794-P828 WeakPolarHBondContact CB-O 3.39Å; I798-P828 HydrophobicContact CD1-CB 3.38Å; I798-P828 HydrophobicContact CD1-CG 3.64Å; I823-P828 HydrophobicContact CG2-CB 4.07Å; D825-P828 HydrophobicContact CB-CB 4.31Å; D825-P828 WeakPolarHBondContact O-CD 3.48Å
829	S	87.6	Confident	88.3	Confident	49 Å²	49	62.6 Å²	62.6	34%	0.343	35%	0.349	S	S	.	.			trans	-104.8	173.7	178.1	83.3	0	0	0	0	112.3	S831 D832	S829-S831 PolarHBondContact O-N 3.33Å; S829-S831 WeakPolarHBondContact OG-CB 3.28Å; S829-S831 PolarHBondContact OG-N 3.35Å; S829-D832 VanDerWaalsContact CA-OD2 3.31Å; S829-D832 WeakPolarHBondContact CA-OD2 3.31Å; S829-D832 WeakPolarHBondContact CB-OD2 3.37Å; S829-D832 PolarHBondContact N-OD2 2.85Å; S829-D832 PolarHBondContact OG-N 2.96Å; S829-D832 PolarHBondContact OG-OD2 2.91Å
830	Y	93.7	Very high	88.4	Confident	43 Å²	43	63.8 Å²	63.8	17%	0.169	35%	0.353	C	S	.	.	H	α-helix	trans	-71.9	-15.6	169.5	-57	-67.1	0	0	0	113.1	P790 E792 A794 I797 I833 A834 Y853 F860	P790-Y830 HydrophobicContact CB-CE1 4.12Å; P790-Y830 HydrophobicContact CG-CD1 4.34Å; P790-Y830 HydrophobicContact CG-CE1 4.05Å; E792-Y830 PolarHBondContact O-OH 3.47Å; A794-Y830 HydrophobicContact CB-CD1 3.9Å; A794-Y830 HydrophobicContact CB-CE1 3.93Å; A794-Y830 HydrophobicContact CB-CG 4.41Å; I797-Y830 HydrophobicContact CD1-CD1 4.49Å; I797-Y830 HydrophobicContact CD1-CE1 4.01Å; Y830-I833 HydrophobicContact CD1-CD1 4.34Å; Y830-A834 WeakPolarHBondContact O-CB 3.12Å; Y830-A834 PolarHBondContact O-N 2.93Å; Y830-Y853 HydrophobicContact CD2-CD2 4.27Å; Y830-Y853 HydrophobicContact CD2-CE1 4.32Å; Y830-Y853 AromaticContact CD2-CE2 3.57Å; Y830-Y853 HydrophobicContact CD2-CE2 3.57Å; Y830-Y853 AromaticContact CD2-CZ 3.61Å; Y830-Y853 HydrophobicContact CE2-CE2 4.46Å; Y830-Y853 AromaticContact CG-CD2 3.98Å; Y830-Y853 HydrophobicContact CG-CD2 3.98Å; Y830-Y853 AromaticContact CG-CE2 3.72Å; Y830-Y853 HydrophobicContact CG-CE2 3.72Å; Y830-F860 HydrophobicContact CD1-CE2 4.42Å; Y830-F860 HydrophobicContact CD1-CZ 4.1Å; Y830-F860 HydrophobicContact CG-CZ 4.44Å; Y830-F860 VanDerWaalsContact O-CE1 3.31Å; Y830-F860 WeakPolarHBondContact O-CE1 3.39Å
831	S	91.6	Very high	88.5	Confident	52 Å²	52	63.8 Å²	63.8	36%	0.364	35%	0.353	S	S	.	.	H	α-helix	trans	-70.4	-42.7	175	-158.1	0	0	0	0	110.8	S829 I833 A834 E835	S829-S831 PolarHBondContact O-N 3.33Å; S829-S831 WeakPolarHBondContact OG-CB 3.28Å; S829-S831 PolarHBondContact OG-N 3.35Å; S831-I833 VanDerWaalsContact C-N 3.31Å; S831-I833 PolarHBondContact O-N 3.44Å; S831-A834 CarbonylContact O-C 3.58Å; S831-A834 WeakPolarHBondContact O-CA 3.36Å; S831-A834 WeakPolarHBondContact O-CB 3.48Å; S831-A834 PolarHBondContact O-N 3.33Å; S831-E835 PolarHBondContact O-N 3.3Å
832	D	92.1	Very high	89	Confident	49 Å²	49	63.5 Å²	63.5	26%	0.262	34%	0.341	S	S	.	.	H	α-helix	trans	-67.3	-36.6	-179.2	-39.5	-64.4	0	0	0	110.7	I823 S829 A834 E835 V836	I823-D832 HydrophobicContact CD1-CB 4.43Å; I823-D832 HydrophobicContact CG2-CB 4.29Å; S829-D832 VanDerWaalsContact CA-OD2 3.31Å; S829-D832 WeakPolarHBondContact CA-OD2 3.31Å; S829-D832 WeakPolarHBondContact CB-OD2 3.37Å; S829-D832 PolarHBondContact N-OD2 2.85Å; S829-D832 PolarHBondContact OG-N 2.96Å; S829-D832 PolarHBondContact OG-OD2 2.91Å; D832-A834 VanDerWaalsContact C-N 3.35Å; D832-E835 PolarHBondContact O-N 3.27Å; D832-V836 PolarHBondContact O-N 3.38Å
833	I	93.1	Very high	89.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-41.4	169.1	-64.1	173	0	0	0	110.9	A794 I797 I798 L820 I823 Y830 S831 I837 F860 L891	A794-I833 HydrophobicContact CB-CD1 3.72Å; I797-I833 HydrophobicContact CB-CD1 4.21Å; I797-I833 HydrophobicContact CG2-CD1 4.24Å; I798-I833 HydrophobicContact CD1-CD1 4.02Å; I798-I833 HydrophobicContact CD1-CG1 3.87Å; I798-I833 HydrophobicContact CG1-CD1 3.89Å; I798-I833 HydrophobicContact CG1-CG1 3.84Å; L820-I833 HydrophobicContact CD1-CG2 4.32Å; L820-I833 HydrophobicContact CD2-CG2 4.22Å; I823-I833 HydrophobicContact CD1-CG1 4.05Å; Y830-I833 HydrophobicContact CD1-CD1 4.34Å; S831-I833 VanDerWaalsContact C-N 3.31Å; S831-I833 PolarHBondContact O-N 3.44Å; I833-I837 HydrophobicContact CG2-CD1 3.73Å; I833-I837 WeakPolarHBondContact O-CD1 3.42Å; I833-I837 VanDerWaalsContact O-CG1 3.24Å; I833-I837 WeakPolarHBondContact O-CG1 3.44Å; I833-I837 PolarHBondContact O-N 2.99Å; I833-F860 HydrophobicContact CB-CE1 4.47Å; I833-F860 HydrophobicContact CB-CZ 4.31Å; I833-F860 HydrophobicContact CG2-CE1 4.17Å; I833-F860 HydrophobicContact CG2-CZ 3.86Å; I833-L891 HydrophobicContact CG2-CD2 4.16Å
834	A	94.1	Very high	89.3	Confident	3 Å²	3	63.1 Å²	63.1	3%	0.025	35%	0.346	C	S	.	.	H	α-helix	trans	-65.3	-43	178.1	0	0	0	0	0	112	Y830 S831 D832 V836 I837 D838 F851 F860	Y830-A834 WeakPolarHBondContact O-CB 3.12Å; Y830-A834 PolarHBondContact O-N 2.93Å; S831-A834 CarbonylContact O-C 3.58Å; S831-A834 WeakPolarHBondContact O-CA 3.36Å; S831-A834 WeakPolarHBondContact O-CB 3.48Å; S831-A834 PolarHBondContact O-N 3.33Å; D832-A834 VanDerWaalsContact C-N 3.35Å; A834-V836 PolarHBondContact O-N 3.47Å; A834-I837 PolarHBondContact O-N 3.06Å; A834-D838 VanDerWaalsContact O-CB 3.29Å; A834-D838 WeakPolarHBondContact O-CB 3.45Å; A834-D838 PolarHBondContact O-N 2.97Å; A834-F851 HydrophobicContact CB-CD1 4.13Å; A834-F860 HydrophobicContact CB-CD1 4.08Å; A834-F860 HydrophobicContact CB-CE1 3.94Å
835	E	93	Very high	89.8	Confident	128 Å²	128	54.4 Å²	54.4	60%	0.598	31%	0.306	S	S	*	.	H	α-helix	trans	-62.8	-39.9	-179.7	-72.8	-177.2	-155.5	0	0	112.8	S831 D832	S831-E835 PolarHBondContact O-N 3.3Å; D832-E835 PolarHBondContact O-N 3.27Å
836	V	91.8	Very high	90.3	Very high	37 Å²	37	51.9 Å²	51.9	22%	0.224	30%	0.299	C	S	.	.	H	α-helix	trans	-65	-40	173.8	173.8	0	0	0	0	111.5	L820 I823 D832 A834	L820-V836 HydrophobicContact CD2-CB 4.36Å; L820-V836 HydrophobicContact CD2-CG1 4.1Å; I823-V836 HydrophobicContact CD1-CG2 3.9Å; I823-V836 HydrophobicContact CG1-CG2 3.81Å; D832-V836 PolarHBondContact O-N 3.38Å; A834-V836 PolarHBondContact O-N 3.47Å
837	I	93.7	Very high	90.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-73.8	-35.3	-179.7	-64.5	169	0	0	0	111.7	F805 F818 L820 I833 A834 V839 E840 V841 F851 L891	F805-I837 HydrophobicContact CE1-CG2 4.23Å; F805-I837 HydrophobicContact CZ-CG2 4.39Å; F818-I837 HydrophobicContact CD1-CG1 4.05Å; F818-I837 HydrophobicContact CD1-CG2 4.35Å; F818-I837 HydrophobicContact CD2-CD1 4.12Å; F818-I837 HydrophobicContact CD2-CG1 3.63Å; F818-I837 HydrophobicContact CE1-CD1 4.35Å; F818-I837 HydrophobicContact CE1-CG1 4.02Å; F818-I837 HydrophobicContact CE1-CG2 4.1Å; F818-I837 HydrophobicContact CE2-CD1 3.53Å; F818-I837 HydrophobicContact CE2-CG1 3.55Å; F818-I837 HydrophobicContact CG-CG1 3.88Å; F818-I837 HydrophobicContact CZ-CD1 3.69Å; F818-I837 HydrophobicContact CZ-CG1 3.78Å; F818-I837 HydrophobicContact CZ-CG2 4.45Å; L820-I837 HydrophobicContact CD2-CG1 4.46Å; I833-I837 HydrophobicContact CG2-CD1 3.73Å; I833-I837 WeakPolarHBondContact O-CD1 3.42Å; I833-I837 VanDerWaalsContact O-CG1 3.24Å; I833-I837 WeakPolarHBondContact O-CG1 3.44Å; I833-I837 PolarHBondContact O-N 2.99Å; A834-I837 PolarHBondContact O-N 3.06Å; I837-V839 VanDerWaalsContact C-N 3.29Å; I837-V839 PolarHBondContact O-N 2.94Å; I837-E840 PolarHBondContact O-N 3.06Å; I837-E840 VanDerWaalsContact O-N 3.15Å; I837-V841 HydrophobicContact CG2-CG2 3.87Å; I837-V841 WeakPolarHBondContact O-CB 2.99Å; I837-V841 WeakPolarHBondContact O-CG2 3.5Å; I837-V841 PolarHBondContact O-N 3.28Å; I837-F851 HydrophobicContact CB-CD1 3.63Å; I837-F851 HydrophobicContact CB-CE1 3.87Å; I837-F851 HydrophobicContact CB-CG 4.25Å; I837-F851 HydrophobicContact CD1-CD1 4.37Å; I837-F851 HydrophobicContact CD1-CE1 3.72Å; I837-F851 HydrophobicContact CD1-CZ 4.27Å; I837-F851 HydrophobicContact CG1-CE1 4.4Å; I837-F851 HydrophobicContact CG2-CB 4.26Å; I837-F851 HydrophobicContact CG2-CD1 3.45Å; I837-F851 VanDerWaalsContact CG2-CD1 3.45Å; I837-F851 HydrophobicContact CG2-CD2 4.01Å; I837-F851 HydrophobicContact CG2-CE1 3.64Å; I837-F851 HydrophobicContact CG2-CE2 4.19Å; I837-F851 HydrophobicContact CG2-CG 3.64Å; I837-F851 HydrophobicContact CG2-CZ 4.01Å; I837-L891 HydrophobicContact CD1-CD1 3.61Å; I837-L891 HydrophobicContact CD1-CD2 4.27Å
838	D	96	Very high	91.3	Very high	27 Å²	27	48.7 Å²	48.7	14%	0.144	29%	0.289	C	S	.	.	H	α-helix	trans	-59.1	-36.6	-179.8	178.2	75.4	0	0	0	112.7	A834 V841 K842 S850 F851	A834-D838 VanDerWaalsContact O-CB 3.29Å; A834-D838 WeakPolarHBondContact O-CB 3.45Å; A834-D838 PolarHBondContact O-N 2.97Å; D838-V841 PolarHBondContact O-N 3.12Å; D838-K842 VanDerWaalsContact CG-NZ 3.28Å; D838-K842 WeakPolarHBondContact O-CB 3.32Å; D838-K842 WeakPolarHBondContact O-CG 3.39Å; D838-K842 PolarHBondContact O-N 2.83Å; D838-K842 WeakPolarHBondContact OD1-CE 3.45Å; D838-K842 IonicContact OD1-NZ 2.66Å; D838-K842 PolarHBondContact OD1-NZ 2.76Å; D838-K842 VanDerWaalsContact OD1-NZ 3.15Å; D838-K842 VanDerWaalsContact OD2-CE 3.28Å; D838-K842 WeakPolarHBondContact OD2-CE 3.38Å; D838-K842 IonicContact OD2-NZ 3.18Å; D838-K842 PolarHBondContact OD2-NZ 3.19Å; D838-S850 WeakPolarHBondContact OD1-CA 3.49Å; D838-F851 HydrophobicContact CB-CB 4.11Å; D838-F851 PolarHBondContact OD1-N 3.42Å
839	V	92.6	Very high	91.7	Very high	92 Å²	92	48 Å²	48	56%	0.558	28%	0.284	S	S	*	.	H	α-helix	trans	-60.2	-49.4	173.7	175.9	0	0	0	0	111.2	I837 K842 S843	I837-V839 VanDerWaalsContact C-N 3.29Å; I837-V839 PolarHBondContact O-N 2.94Å; V839-K842 PolarHBondContact O-N 3.05Å; V839-S843 WeakPolarHBondContact O-CB 3.26Å; V839-S843 PolarHBondContact O-N 3.05Å
840	E	91.2	Very high	92	Very high	78 Å²	78	47.2 Å²	47.2	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-75.8	-29.6	-179	-63.3	-59	162.7	0	0	112.6	V816 F818 I837 S843 A844	V816-E840 HydrophobicContact CG1-CB 4.31Å; F818-E840 HydrophobicContact CB-CG 4.28Å; I837-E840 PolarHBondContact O-N 3.06Å; I837-E840 VanDerWaalsContact O-N 3.15Å; E840-S843 WeakPolarHBondContact O-CB 3.39Å; E840-S843 PolarHBondContact O-N 2.92Å; E840-A844 VanDerWaalsContact O-CB 3.3Å; E840-A844 WeakPolarHBondContact O-CB 3.46Å; E840-A844 PolarHBondContact O-N 2.87Å
841	V	94.1	Very high	92.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.7	-47.2	168.9	157.5	0	0	0	0	110.8	F805 V816 I837 D838 S843 A844 I845 A849 F851 L862	F805-V841 HydrophobicContact CZ-CG2 4.31Å; V816-V841 HydrophobicContact CG1-CG2 3.85Å; I837-V841 HydrophobicContact CG2-CG2 3.87Å; I837-V841 WeakPolarHBondContact O-CB 2.99Å; I837-V841 WeakPolarHBondContact O-CG2 3.5Å; I837-V841 PolarHBondContact O-N 3.28Å; D838-V841 PolarHBondContact O-N 3.12Å; V841-S843 VanDerWaalsContact C-N 3.31Å; V841-S843 PolarHBondContact O-N 3.41Å; V841-A844 PolarHBondContact O-N 2.76Å; V841-I845 HydrophobicContact CG1-CD1 3.96Å; V841-I845 VanDerWaalsContact O-CB 3.24Å; V841-I845 WeakPolarHBondContact O-CB 3.4Å; V841-I845 WeakPolarHBondContact O-CG1 3.5Å; V841-I845 PolarHBondContact O-N 3.38Å; V841-A849 HydrophobicContact CG1-CB 3.88Å; V841-F851 HydrophobicContact CB-CB 4.24Å; V841-F851 HydrophobicContact CG1-CB 4.28Å; V841-F851 HydrophobicContact CG2-CB 4.02Å; V841-F851 HydrophobicContact CG2-CD2 4.2Å; V841-F851 HydrophobicContact CG2-CG 4.32Å; V841-L862 HydrophobicContact CG1-CD1 3.6Å; V841-L862 HydrophobicContact CG2-CD1 4.09Å
842	K	95.1	Very high	92.2	Very high	75 Å²	75	46.7 Å²	46.7	33%	0.326	28%	0.278	S	S	.	.	H	α-helix	trans	-66.4	-33.4	175.9	-76	166.6	-179.5	165.3	0	112.5	D838 V839 G846 A849	D838-K842 VanDerWaalsContact CG-NZ 3.28Å; D838-K842 WeakPolarHBondContact O-CB 3.32Å; D838-K842 WeakPolarHBondContact O-CG 3.39Å; D838-K842 PolarHBondContact O-N 2.83Å; D838-K842 WeakPolarHBondContact OD1-CE 3.45Å; D838-K842 IonicContact OD1-NZ 2.66Å; D838-K842 PolarHBondContact OD1-NZ 2.76Å; D838-K842 VanDerWaalsContact OD1-NZ 3.15Å; D838-K842 VanDerWaalsContact OD2-CE 3.28Å; D838-K842 WeakPolarHBondContact OD2-CE 3.38Å; D838-K842 IonicContact OD2-NZ 3.18Å; D838-K842 PolarHBondContact OD2-NZ 3.19Å; V839-K842 PolarHBondContact O-N 3.05Å; K842-G846 CarbonylContact O-C 3.33Å; K842-G846 WeakPolarHBondContact O-CA 3.29Å; K842-G846 PolarHBondContact O-N 3.41Å; K842-G846 VanDerWaalsContact O-N 3.07Å; K842-A849 WeakPolarHBondContact CE-O 3.48Å; K842-A849 VanDerWaalsContact CG-O 3.25Å; K842-A849 WeakPolarHBondContact CG-O 3.16Å
843	S	90.8	Very high	92.2	Very high	91 Å²	91	47 Å²	47	64%	0.636	28%	0.276	S	S	*	.	H	α-helix	trans	-64.3	-49.2	172.7	-171.2	0	0	0	0	112.1	V839 E840 V841	V839-S843 WeakPolarHBondContact O-CB 3.26Å; V839-S843 PolarHBondContact O-N 3.05Å; E840-S843 WeakPolarHBondContact O-CB 3.39Å; E840-S843 PolarHBondContact O-N 2.92Å; V841-S843 VanDerWaalsContact C-N 3.31Å; V841-S843 PolarHBondContact O-N 3.41Å
844	A	88.2	Confident	91.8	Very high	22 Å²	22	48 Å²	48	18%	0.182	28%	0.282	C	S	.	.	H	α-helix	trans	-82.1	-39.7	-174	0	0	0	0	0	114.2	K814 V816 E840 V841	K814-A844 WeakPolarHBondContact CD-O 3.5Å; K814-A844 WeakPolarHBondContact CE-O 3.45Å; K814-A844 PolarHBondContact NZ-O 3.23Å; V816-A844 HydrophobicContact CG2-CB 4.12Å; E840-A844 VanDerWaalsContact O-CB 3.3Å; E840-A844 WeakPolarHBondContact O-CB 3.46Å; E840-A844 PolarHBondContact O-N 2.87Å; V841-A844 PolarHBondContact O-N 2.76Å
845	I	89	Confident	91.1	Very high	12 Å²	12	53 Å²	53	6%	0.062	32%	0.318	C	S	.	.	H	α-helix	trans	-96.7	-26.3	-174.2	-51.7	-175.8	0	0	0	111.8	I807 V809 V841 A849 L862 S865	I807-I845 HydrophobicContact CD1-CD1 3.44Å; I807-I845 VanDerWaalsContact CD1-CD1 3.44Å; I807-I845 HydrophobicContact CD1-CG1 4.16Å; V809-I845 HydrophobicContact CG1-CG2 3.99Å; V809-I845 HydrophobicContact CG2-CD1 4.34Å; V809-I845 HydrophobicContact CG2-CG1 4.14Å; V809-I845 HydrophobicContact CG2-CG2 4Å; V841-I845 HydrophobicContact CG1-CD1 3.96Å; V841-I845 VanDerWaalsContact O-CB 3.24Å; V841-I845 WeakPolarHBondContact O-CB 3.4Å; V841-I845 WeakPolarHBondContact O-CG1 3.5Å; V841-I845 PolarHBondContact O-N 3.38Å; I845-A849 HydrophobicContact CB-CB 3.78Å; I845-A849 HydrophobicContact CG2-CB 3.72Å; I845-L862 HydrophobicContact CD1-CD1 3.79Å; I845-L862 HydrophobicContact CD1-CD2 4.38Å; I845-S865 PolarHBondContact O-OG 2.88Å
846	G	87.7	Confident	90.2	Very high	27 Å²	27	49.3 Å²	49.3	28%	0.278	30%	0.303	S	S	.	.			trans	115.2	155	-178.7	0	0	0	0	0	112.7	K842 N848 A849	K842-G846 CarbonylContact O-C 3.33Å; K842-G846 WeakPolarHBondContact O-CA 3.29Å; K842-G846 PolarHBondContact O-N 3.41Å; K842-G846 VanDerWaalsContact O-N 3.07Å; G846-N848 PolarHBondContact O-N 3.1Å; G846-A849 VanDerWaalsContact O-CB 3.3Å; G846-A849 WeakPolarHBondContact O-CB 3.5Å; G846-A849 PolarHBondContact O-N 2.79Å
847	A	87.3	Confident	89.4	Confident	84 Å²	84	49 Å²	49	69%	0.694	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-18.4	-163	0	0	0	0	0	117.1
848	N	90.5	Very high	88.8	Confident	137 Å²	137	49.6 Å²	49.6	73%	0.733	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-8.5	177.5	-67.8	-6.1	0	0	0	113.8	G846	G846-N848 PolarHBondContact O-N 3.1Å
849	A	93.6	Very high	88.5	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.008	30%	0.301	C	S	.	.			trans	-67	161.9	172.3	0	0	0	0	0	110.8	V841 K842 I845 G846 T863	V841-A849 HydrophobicContact CG1-CB 3.88Å; K842-A849 WeakPolarHBondContact CE-O 3.48Å; K842-A849 VanDerWaalsContact CG-O 3.25Å; K842-A849 WeakPolarHBondContact CG-O 3.16Å; I845-A849 HydrophobicContact CB-CB 3.78Å; I845-A849 HydrophobicContact CG2-CB 3.72Å; G846-A849 VanDerWaalsContact O-CB 3.3Å; G846-A849 WeakPolarHBondContact O-CB 3.5Å; G846-A849 PolarHBondContact O-N 2.79Å; A849-T863 VanDerWaalsContact CA-O 3.26Å; A849-T863 WeakPolarHBondContact CA-O 3.28Å; A849-T863 WeakPolarHBondContact CB-O 3.48Å
850	S	93.7	Very high	88.6	Confident	33 Å²	33	43.9 Å²	43.9	23%	0.231	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	150.6	175.1	64.6	0	0	0	0	112.5	D838 L862 T863	D838-S850 WeakPolarHBondContact OD1-CA 3.49Å; S850-L862 CarbonylContact O-C 3.53Å; S850-L862 WeakPolarHBondContact O-CA 3.29Å; S850-T863 PolarHBondContact N-O 3.44Å; S850-T863 VanDerWaalsContact N-O 3.08Å; S850-T863 PolarHBondContact O-N 3.35Å; S850-T863 WeakPolarHBondContact OG-CB 3.14Å; S850-T863 PolarHBondContact OG-OG1 2.65Å
851	F	95.2	Very high	88.6	Confident	3 Å²	3	41.2 Å²	41.2	1%	0.013	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	113.5	171.8	-165.5	-95.1	0	0	0	110	F805 A834 I837 D838 V841 F860 V861 L862 L891 L893	F805-F851 HydrophobicContact CE1-CE2 4.49Å; F805-F851 HydrophobicContact CZ-CE2 4.24Å; A834-F851 HydrophobicContact CB-CD1 4.13Å; I837-F851 HydrophobicContact CB-CD1 3.63Å; I837-F851 HydrophobicContact CB-CE1 3.87Å; I837-F851 HydrophobicContact CB-CG 4.25Å; I837-F851 HydrophobicContact CD1-CD1 4.37Å; I837-F851 HydrophobicContact CD1-CE1 3.72Å; I837-F851 HydrophobicContact CD1-CZ 4.27Å; I837-F851 HydrophobicContact CG1-CE1 4.4Å; I837-F851 HydrophobicContact CG2-CB 4.26Å; I837-F851 HydrophobicContact CG2-CD1 3.45Å; I837-F851 VanDerWaalsContact CG2-CD1 3.45Å; I837-F851 HydrophobicContact CG2-CD2 4.01Å; I837-F851 HydrophobicContact CG2-CE1 3.64Å; I837-F851 HydrophobicContact CG2-CE2 4.19Å; I837-F851 HydrophobicContact CG2-CG 3.64Å; I837-F851 HydrophobicContact CG2-CZ 4.01Å; D838-F851 HydrophobicContact CB-CB 4.11Å; D838-F851 PolarHBondContact OD1-N 3.42Å; V841-F851 HydrophobicContact CB-CB 4.24Å; V841-F851 HydrophobicContact CG1-CB 4.28Å; V841-F851 HydrophobicContact CG2-CB 4.02Å; V841-F851 HydrophobicContact CG2-CD2 4.2Å; V841-F851 HydrophobicContact CG2-CG 4.32Å; F851-F860 HydrophobicContact CD1-CD1 4.16Å; F851-F860 HydrophobicContact CE1-CB 3.92Å; F851-F860 AromaticContact CE1-CD1 3.31Å; F851-F860 HydrophobicContact CE1-CD1 3.31Å; F851-F860 AromaticContact CE1-CE1 3.93Å; F851-F860 HydrophobicContact CE1-CE1 3.93Å; F851-F860 AromaticContact CE1-CG 3.76Å; F851-F860 HydrophobicContact CE1-CG 3.76Å; F851-F860 HydrophobicContact CE2-CB 4.15Å; F851-F860 HydrophobicContact CZ-CB 3.53Å; F851-F860 AromaticContact CZ-CD1 3.81Å; F851-F860 HydrophobicContact CZ-CD1 3.81Å; F851-F860 AromaticContact CZ-CG 3.72Å; F851-F860 HydrophobicContact CZ-CG 3.72Å; F851-V861 WeakPolarHBondContact CA-O 3.39Å; F851-L862 HydrophobicContact CD2-CB 3.87Å; F851-L862 HydrophobicContact CD2-CD1 4.13Å; F851-L862 HydrophobicContact CE2-CB 4.2Å; F851-L891 HydrophobicContact CZ-CD1 4.28Å; F851-L893 HydrophobicContact CE2-CD1 3.93Å; F851-L893 HydrophobicContact CE2-CD2 4.29Å; F851-L893 HydrophobicContact CZ-CD1 4.13Å
852	V	92.7	Very high	88.6	Confident	81 Å²	81	41.2 Å²	41.2	49%	0.491	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135.6	-169.8	-175	0	0	0	0	110.3	V861	V852-V861 PolarHBondContact N-O 2.72Å; V852-V861 PolarHBondContact O-N 3.41Å
853	Y	92.8	Very high	88.6	Confident	57 Å²	57	39.5 Å²	39.5	22%	0.224	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.5	169.7	175.2	-98.8	0	0	0	110.9	Y830 G858 F860	Y830-Y853 HydrophobicContact CD2-CD2 4.27Å; Y830-Y853 HydrophobicContact CD2-CE1 4.32Å; Y830-Y853 AromaticContact CD2-CE2 3.57Å; Y830-Y853 HydrophobicContact CD2-CE2 3.57Å; Y830-Y853 AromaticContact CD2-CZ 3.61Å; Y830-Y853 HydrophobicContact CE2-CE2 4.46Å; Y830-Y853 AromaticContact CG-CD2 3.98Å; Y830-Y853 HydrophobicContact CG-CD2 3.98Å; Y830-Y853 AromaticContact CG-CE2 3.72Å; Y830-Y853 HydrophobicContact CG-CE2 3.72Å; Y853-G858 WeakPolarHBondContact CE2-O 3.48Å; Y853-F860 HydrophobicContact CD2-CD1 4.27Å; Y853-F860 HydrophobicContact CD2-CE1 4.21Å; Y853-F860 HydrophobicContact CD2-CZ 4.41Å
854	S	86	Confident	88.7	Confident	20 Å²	20	35.4 Å²	35.4	14%	0.14	23%	0.231	C	C	.	.			trans	-94.1	117	178.3	179.6	0	0	0	0	111.2	V856 T857 G858 G859	S854-V856 PolarHBondContact O-N 2.9Å; S854-V856 PolarHBondContact OG-N 2.9Å; S854-T857 WeakPolarHBondContact CB-OG1 3.4Å; S854-T857 PolarHBondContact OG-N 3.5Å; S854-G858 VanDerWaalsContact O-CA 3.29Å; S854-G858 WeakPolarHBondContact O-CA 3.38Å; S854-G858 PolarHBondContact O-N 2.72Å; S854-G859 WeakPolarHBondContact CB-O 3.4Å; S854-G859 PolarHBondContact N-O 2.99Å
855	S	78.1	Confident	88.7	Confident	109 Å²	109	35.9 Å²	35.9	76%	0.762	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-16	171.1	56	0	0	0	0	113.5
856	V	73.4	Confident	88.8	Confident	50 Å²	50	37.7 Å²	37.7	30%	0.303	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-54.6	176.2	164.7	0	0	0	0	111.1	L721 G745 S854	L721-V856 HydrophobicContact CD1-CB 4.31Å; L721-V856 HydrophobicContact CD1-CG1 3.77Å; G745-V856 VanDerWaalsContact CA-CG1 3.46Å; S854-V856 PolarHBondContact O-N 2.9Å; S854-V856 PolarHBondContact OG-N 2.9Å
857	T	75.6	Confident	89	Confident	30 Å²	30	41.9 Å²	41.9	18%	0.184	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-18.6	-178.9	62.2	0	0	0	0	112.7	L721 K786 S854 G859	L721-T857 HydrophobicContact CD1-CG2 4.36Å; K786-T857 HydrophobicContact CD-CG2 4.02Å; K786-T857 HydrophobicContact CG-CG2 4.16Å; S854-T857 WeakPolarHBondContact CB-OG1 3.4Å; S854-T857 PolarHBondContact OG-N 3.5Å; T857-G859 PolarHBondContact O-N 3.38Å; T857-G859 PolarHBondContact OG1-N 2.95Å; T857-G859 VanDerWaalsContact OG1-N 3.16Å
858	G	82.3	Confident	89.1	Confident	12 Å²	12	38 Å²	38	12%	0.124	22%	0.223	C	C	.	.	S	Bend	trans	71.5	13.5	-168.8	0	0	0	0	0	113.9	K789 P790 Y853 S854	K789-G858 VanDerWaalsContact CA-O 3.29Å; K789-G858 WeakPolarHBondContact CA-O 3.44Å; K789-G858 WeakPolarHBondContact CB-O 3.5Å; K789-G858 WeakPolarHBondContact CG-O 3.27Å; P790-G858 WeakPolarHBondContact CD-O 3.29Å; Y853-G858 WeakPolarHBondContact CE2-O 3.48Å; S854-G858 VanDerWaalsContact O-CA 3.29Å; S854-G858 WeakPolarHBondContact O-CA 3.38Å; S854-G858 PolarHBondContact O-N 2.72Å
859	G	89.3	Confident	89	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-130.3	170	-177.2	0	0	0	0	0	113.1	S854 T857	S854-G859 WeakPolarHBondContact CB-O 3.4Å; S854-G859 PolarHBondContact N-O 2.99Å; T857-G859 PolarHBondContact O-N 3.38Å; T857-G859 PolarHBondContact OG1-N 2.95Å; T857-G859 VanDerWaalsContact OG1-N 3.16Å
860	F	93.3	Very high	88.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	141.9	179.4	-62.5	-85.9	0	0	0	112	G787 P790 Y830 I833 A834 F851 Y853 L891 L893	G787-F860 VanDerWaalsContact CA-O 3.23Å; G787-F860 WeakPolarHBondContact CA-O 3.28Å; G787-F860 PolarHBondContact N-O 2.94Å; P790-F860 HydrophobicContact CG-CD2 4.12Å; P790-F860 HydrophobicContact CG-CE2 3.64Å; Y830-F860 HydrophobicContact CD1-CE2 4.42Å; Y830-F860 HydrophobicContact CD1-CZ 4.1Å; Y830-F860 HydrophobicContact CG-CZ 4.44Å; Y830-F860 VanDerWaalsContact O-CE1 3.31Å; Y830-F860 WeakPolarHBondContact O-CE1 3.39Å; I833-F860 HydrophobicContact CB-CE1 4.47Å; I833-F860 HydrophobicContact CB-CZ 4.31Å; I833-F860 HydrophobicContact CG2-CE1 4.17Å; I833-F860 HydrophobicContact CG2-CZ 3.86Å; A834-F860 HydrophobicContact CB-CD1 4.08Å; A834-F860 HydrophobicContact CB-CE1 3.94Å; F851-F860 HydrophobicContact CD1-CD1 4.16Å; F851-F860 HydrophobicContact CE1-CB 3.92Å; F851-F860 AromaticContact CE1-CD1 3.31Å; F851-F860 HydrophobicContact CE1-CD1 3.31Å; F851-F860 AromaticContact CE1-CE1 3.93Å; F851-F860 HydrophobicContact CE1-CE1 3.93Å; F851-F860 AromaticContact CE1-CG 3.76Å; F851-F860 HydrophobicContact CE1-CG 3.76Å; F851-F860 HydrophobicContact CE2-CB 4.15Å; F851-F860 HydrophobicContact CZ-CB 3.53Å; F851-F860 AromaticContact CZ-CD1 3.81Å; F851-F860 HydrophobicContact CZ-CD1 3.81Å; F851-F860 AromaticContact CZ-CG 3.72Å; F851-F860 HydrophobicContact CZ-CG 3.72Å; Y853-F860 HydrophobicContact CD2-CD1 4.27Å; Y853-F860 HydrophobicContact CD2-CE1 4.21Å; Y853-F860 HydrophobicContact CD2-CZ 4.41Å; F860-L891 HydrophobicContact CD2-CB 4.01Å; F860-L891 HydrophobicContact CD2-CD2 4.3Å; F860-L891 WeakPolarHBondContact CD2-O 3.48Å; F860-L891 HydrophobicContact CE2-CB 4.17Å; F860-L891 HydrophobicContact CE2-CD2 3.66Å; F860-L891 HydrophobicContact CZ-CD2 4Å; F860-L893 HydrophobicContact CB-CD2 4.32Å
861	V	93	Very high	88.7	Confident	21 Å²	21	40.9 Å²	40.9	13%	0.127	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120.7	174.1	-175.4	0	0	0	0	109.1	L721 I785 F851 V852	L721-V861 HydrophobicContact CD2-CG2 4.35Å; I785-V861 WeakPolarHBondContact O-CA 3.47Å; F851-V861 WeakPolarHBondContact CA-O 3.39Å; V852-V861 PolarHBondContact N-O 2.72Å; V852-V861 PolarHBondContact O-N 3.41Å
862	L	94.1	Very high	88.5	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.2	172.2	168.3	62.4	0	0	0	109.1	F784 I785 F805 I807 V841 I845 S850 F851 L873	F784-L862 CarbonylContact C-O 3.58Å; F784-L862 WeakPolarHBondContact CA-O 3.39Å; F784-L862 WeakPolarHBondContact CB-O 3.4Å; I785-L862 HydrophobicContact CB-CB 4.29Å; I785-L862 HydrophobicContact CD1-CD2 4.12Å; I785-L862 PolarHBondContact N-O 3.34Å; I785-L862 PolarHBondContact O-N 3.3Å; F805-L862 HydrophobicContact CE2-CD2 4.38Å; I807-L862 HydrophobicContact CD1-CD2 3.79Å; V841-L862 HydrophobicContact CG1-CD1 3.6Å; V841-L862 HydrophobicContact CG2-CD1 4.09Å; I845-L862 HydrophobicContact CD1-CD1 3.79Å; I845-L862 HydrophobicContact CD1-CD2 4.38Å; S850-L862 CarbonylContact O-C 3.53Å; S850-L862 WeakPolarHBondContact O-CA 3.29Å; F851-L862 HydrophobicContact CD2-CB 3.87Å; F851-L862 HydrophobicContact CD2-CD1 4.13Å; F851-L862 HydrophobicContact CE2-CB 4.2Å; L862-L873 HydrophobicContact CD2-CD1 4.49Å; L862-L873 HydrophobicContact CG-CD1 4.3Å
863	T	94	Very high	88.5	Confident	39 Å²	39	39.2 Å²	39.2	24%	0.239	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136	174.6	-43.9	0	0	0	0	110.5	A782 F784 A849 S850	A782-T863 HydrophobicContact CB-CG2 3.75Å; F784-T863 HydrophobicContact CB-CG2 4.47Å; A849-T863 VanDerWaalsContact CA-O 3.26Å; A849-T863 WeakPolarHBondContact CA-O 3.28Å; A849-T863 WeakPolarHBondContact CB-O 3.48Å; S850-T863 PolarHBondContact N-O 3.44Å; S850-T863 VanDerWaalsContact N-O 3.08Å; S850-T863 PolarHBondContact O-N 3.35Å; S850-T863 WeakPolarHBondContact OG-CB 3.14Å; S850-T863 PolarHBondContact OG-OG1 2.65Å
864	G	92.3	Very high	88.3	Confident	5 Å²	5	38.3 Å²	38.3	5%	0.052	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	163	177.5	0	0	0	0	0	113.5	A783	A783-G864 PolarHBondContact O-N 2.89Å
865	S	88.7	Confident	88.4	Confident	31 Å²	31	39.2 Å²	39.2	22%	0.217	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-19.9	-179.3	52.1	0	0	0	0	114.2	I845	I845-S865 PolarHBondContact O-OG 2.88Å
866	T	90.6	Very high	88.9	Confident	50 Å²	50	34 Å²	34	31%	0.307	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	148.8	178.8	-43.4	0	0	0	0	111.4	A782 D810 A871	A782-T866 WeakPolarHBondContact CA-O 3.15Å; A782-T866 VanDerWaalsContact CB-O 3.3Å; A782-T866 WeakPolarHBondContact CB-O 3.4Å; D810-T866 VanDerWaalsContact OD2-CB 3.31Å; D810-T866 WeakPolarHBondContact OD2-CB 2.98Å; D810-T866 PolarHBondContact OD2-OG1 3.21Å; T866-A871 HydrophobicContact CG2-CB 4.08Å; T866-A871 VanDerWaalsContact O-CB 3.29Å; T866-A871 WeakPolarHBondContact O-CB 3.35Å
867	K	92.3	Very high	89.5	Confident	116 Å²	116	34.1 Å²	34.1	50%	0.504	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	165	175.3	-76.2	-177.8	158.2	-135.1	0	112.3	E780 T781 A782	E780-K867 HydrophobicContact CB-CB 4.13Å; E780-K867 VanDerWaalsContact O-CD 3.27Å; E780-K867 WeakPolarHBondContact O-CD 3.24Å; E780-K867 VanDerWaalsContact O-CE 3.29Å; E780-K867 WeakPolarHBondContact O-CE 3.25Å; E780-K867 PolarHBondContact O-NZ 3.49Å; T781-K867 CarbonylContact O-C 3.07Å; T781-K867 WeakPolarHBondContact O-CA 3.15Å; A782-K867 HydrophobicContact CB-CG 4.12Å
868	G	89.3	Confident	89.6	Confident	2 Å²	2	37.2 Å²	37.2	2%	0.021	21%	0.211	C	C	.	.	S	Bend	trans	89.5	174	176.2	0	0	0	0	0	114	T781 T870 A871 G901 V902	T781-G868 PolarHBondContact O-N 3.34Å; G868-T870 PolarHBondContact O-N 3.22Å; G868-A871 VanDerWaalsContact O-CB 3.31Å; G868-A871 WeakPolarHBondContact O-CB 3.27Å; G868-A871 PolarHBondContact O-N 3.13Å; G868-G901 CarbonylContact O-C 3.59Å; G868-G901 WeakPolarHBondContact O-CA 3.01Å; G868-V902 WeakPolarHBondContact CA-O 3.35Å
869	K	89.4	Confident	89	Confident	114 Å²	114	36.8 Å²	36.8	50%	0.496	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-17.9	-175.7	-178.2	169.2	175.4	175	0	114.5	D564 G901 N903	D564-K869 IonicContact OD2-NZ 2.65Å; D564-K869 PolarHBondContact OD2-NZ 3.35Å; K869-G901 WeakPolarHBondContact CA-O 3.38Å; K869-N903 VanDerWaalsContact CB-OD1 3.26Å; K869-N903 WeakPolarHBondContact CB-OD1 3.39Å; K869-N903 PolarHBondContact N-OD1 3.23Å
870	T	88.9	Confident	87.4	Confident	116 Å²	116	42.3 Å²	42.3	71%	0.712	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-17.5	174.3	48.2	0	0	0	0	113.9	G868 T872	G868-T870 PolarHBondContact O-N 3.22Å; T870-T872 PolarHBondContact O-N 3.09Å
871	A	90.5	Very high	85.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.008	26%	0.258	C	S	.	.			trans	-72.8	125.8	179.8	0	0	0	0	0	110.5	A783 D810 T866 G868 G901	A783-A871 HydrophobicContact CB-CB 4.36Å; D810-A871 VanDerWaalsContact OD1-CA 3.3Å; D810-A871 WeakPolarHBondContact OD1-CA 3.2Å; T866-A871 HydrophobicContact CG2-CB 4.08Å; T866-A871 VanDerWaalsContact O-CB 3.29Å; T866-A871 WeakPolarHBondContact O-CB 3.35Å; G868-A871 VanDerWaalsContact O-CB 3.31Å; G868-A871 WeakPolarHBondContact O-CB 3.27Å; G868-A871 PolarHBondContact O-N 3.13Å; A871-G901 PolarHBondContact O-N 2.99Å
872	T	92.6	Very high	84.5	Confident	42 Å²	42	49 Å²	49	26%	0.258	29%	0.29	S	S	.	.			trans	-141.9	143.9	-177.5	55.6	0	0	0	0	111.9	D810 T870	D810-T872 WeakPolarHBondContact CA-OG1 3.43Å; D810-T872 PolarHBondContact N-O 3.48Å; D810-T872 PolarHBondContact OD1-N 3.02Å; T870-T872 PolarHBondContact O-N 3.09Å
873	L	91.5	Very high	83.6	Confident	8 Å²	8	54.9 Å²	54.9	4%	0.042	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-122.5	138.9	167.4	-67	176.2	0	0	0	108.1	A783 I785 A808 V809 L862 V898	A783-L873 HydrophobicContact CB-CB 4.38Å; A783-L873 HydrophobicContact CB-CD1 4.33Å; A783-L873 HydrophobicContact CB-CG 3.9Å; I785-L873 HydrophobicContact CD1-CB 4.12Å; I785-L873 HydrophobicContact CD1-CD1 4.38Å; I785-L873 HydrophobicContact CG1-CB 4.06Å; I785-L873 HydrophobicContact CG1-CD1 3.91Å; A808-L873 CarbonylContact O-C 3.22Å; A808-L873 WeakPolarHBondContact O-CA 3.22Å; V809-L873 HydrophobicContact CB-CD2 4.28Å; V809-L873 HydrophobicContact CG1-CD2 4.17Å; V809-L873 HydrophobicContact CG2-CD2 3.83Å; L862-L873 HydrophobicContact CD2-CD1 4.49Å; L862-L873 HydrophobicContact CG-CD1 4.3Å; L873-V898 WeakPolarHBondContact O-CG1 3.34Å
874	S	88.4	Confident	83	Confident	38 Å²	38	56.4 Å²	56.4	27%	0.266	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-79.9	160.6	165.6	78.1	0	0	0	0	111	I785 A808	I785-S874 WeakPolarHBondContact CD1-O 3.38Å; A808-S874 PolarHBondContact N-OG 2.96Å; A808-S874 PolarHBondContact O-N 3.19Å
875	Q	88	Confident	82.6	Confident	38 Å²	38	57.8 Å²	57.8	18%	0.178	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-49.9	142.7	162.3	-158.2	74.8	59.2	0	0	111.4	K528 L893 S894 A896 V898	K528-Q875 HydrophobicContact CD-CG 3.79Å; Q875-L893 PolarHBondContact NE2-O 2.85Å; Q875-L893 VanDerWaalsContact NE2-O 3.13Å; Q875-S894 VanDerWaalsContact CD-O 3.26Å; Q875-S894 VanDerWaalsContact CG-O 3.24Å; Q875-S894 WeakPolarHBondContact CG-O 3.44Å; Q875-S894 PolarHBondContact NE2-O 3.06Å; Q875-S894 VanDerWaalsContact NE2-O 3.09Å; Q875-A896 PolarHBondContact NE2-O 3.39Å; Q875-A896 PolarHBondContact OE1-O 3.37Å; Q875-V898 HydrophobicContact CB-CG2 4.34Å; Q875-V898 VanDerWaalsContact OE1-CG2 3.31Å
876	A	88.3	Confident	82.5	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-69.3	148.4	174.5	0	0	0	0	0	112.3	K528 I807 L893	K528-A876 PolarHBondContact NZ-O 2.83Å; I807-A876 HydrophobicContact CG2-CB 4Å; A876-L893 HydrophobicContact CB-CB 3.62Å
877	S	86.5	Confident	82.3	Confident	51 Å²	51	56 Å²	56	36%	0.357	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-143.2	168.4	-178.4	61.7	0	0	0	0	111.8	F805 N806	F805-S877 WeakPolarHBondContact CA-O 3.36Å; N806-S877 PolarHBondContact N-O 3.32Å; N806-S877 PolarHBondContact O-N 2.85Å; N806-S877 PolarHBondContact O-OG 3.35Å; N806-S877 VanDerWaalsContact O-OG 3.05Å
878	N	78.6	Confident	82.1	Confident	96 Å²	96	50.7 Å²	50.7	51%	0.513	30%	0.298	S	S	.	.			trans	-58	135.2	179.1	-179.4	86.7	0	0	0	111.4	D886	N878-D886 WeakPolarHBondContact OD1-CB 3.36Å
879	P	68.5	Low	82	Confident	3 Å²	3	55 Å²	55	2%	0.019	32%	0.324	C	S	.	.			trans	-64.8	155.7	-178.6	28.7	-35.1	0	0	0	111.9	G804 A881	G804-P879 VanDerWaalsContact O-CD 3.29Å; G804-P879 WeakPolarHBondContact O-CD 3.39Å; G804-P879 WeakPolarHBondContact O-CG 3.31Å; P879-A881 VanDerWaalsContact C-N 3.32Å; P879-A881 PolarHBondContact O-N 2.98Å
880	V	55.9	Low	81.9	Confident	116 Å²	116	50.8 Å²	50.8	70%	0.703	31%	0.306	S	S	*	.	S	Bend	trans	-74.5	-22.6	-177.7	-176.9	0	0	0	0	112.7	D815	D815-V880 PolarHBondContact OD1-N 2.95Å
881	A	62.4	Low	81.9	Confident	46 Å²	46	45.2 Å²	45.2	38%	0.38	27%	0.272	S	S	.	.			trans	-85.4	127.3	-178.5	0	0	0	0	0	112.6	P879 D883 Y884	P879-A881 VanDerWaalsContact C-N 3.32Å; P879-A881 PolarHBondContact O-N 2.98Å; A881-D883 PolarHBondContact O-N 3.05Å; A881-D883 VanDerWaalsContact O-N 3.15Å; A881-Y884 HydrophobicContact CB-CD2 3.79Å; A881-Y884 HydrophobicContact CB-CE2 4.16Å
882	S	63.5	Low	81.9	Confident	114 Å²	114	45.4 Å²	45.4	80%	0.797	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-17.9	-177.9	46.6	0	0	0	0	115.8	Y884	S882-Y884 VanDerWaalsContact C-N 3.35Å
883	D	75.8	Confident	81.7	Confident	126 Å²	126	43.4 Å²	43.4	67%	0.674	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	8.1	-165.2	-60.2	14.6	0	0	0	112.2	A881	A881-D883 PolarHBondContact O-N 3.05Å; A881-D883 VanDerWaalsContact O-N 3.15Å
884	Y	81.6	Confident	81.3	Confident	70 Å²	70	43.7 Å²	43.7	28%	0.275	27%	0.265	S	S	.	.	S	Bend	trans	-125.2	142.4	-177.7	-66.3	-98.8	0	0	0	110.3	K802 V817 A881 S882	K802-Y884 HydrophobicContact CB-CD1 3.74Å; K802-Y884 HydrophobicContact CB-CE1 4.03Å; K802-Y884 HydrophobicContact CB-CG 4.36Å; K802-Y884 HydrophobicContact CD-CE1 4.28Å; K802-Y884 HydrophobicContact CG-CE1 4.31Å; V817-Y884 HydrophobicContact CB-CD1 4.03Å; V817-Y884 HydrophobicContact CB-CE1 3.66Å; V817-Y884 HydrophobicContact CG1-CD1 4.1Å; V817-Y884 HydrophobicContact CG1-CD2 4.35Å; V817-Y884 HydrophobicContact CG1-CE1 4.12Å; V817-Y884 HydrophobicContact CG1-CE2 4.36Å; V817-Y884 HydrophobicContact CG1-CG 4.23Å; A881-Y884 HydrophobicContact CB-CD2 3.79Å; A881-Y884 HydrophobicContact CB-CE2 4.16Å; S882-Y884 VanDerWaalsContact C-N 3.35Å
885	A	83.4	Confident	80.9	Confident	35 Å²	35	44 Å²	44	29%	0.289	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	153	172.2	0	0	0	0	0	112.1	K800 K802 V803 G804 G887 L890	K800-A885 HydrophobicContact CB-CB 4.46Å; K802-A885 PolarHBondContact O-N 2.73Å; V803-A885 HydrophobicContact CG2-CB 4.39Å; G804-A885 PolarHBondContact N-O 3.29Å; G804-A885 VanDerWaalsContact N-O 3.09Å; A885-G887 PolarHBondContact O-N 3Å; A885-L890 HydrophobicContact CB-CD1 3.98Å
886	D	86.5	Confident	80.9	Confident	44 Å²	44	42.4 Å²	42.4	24%	0.235	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	91.1	-178.2	-170.7	-4.3	0	0	0	112.4	N878 S888 V889 L890	N878-D886 WeakPolarHBondContact OD1-CB 3.36Å; D886-S888 PolarHBondContact O-N 2.98Å; D886-S888 WeakPolarHBondContact OD1-CA 3.33Å; D886-S888 VanDerWaalsContact OD1-CB 3.24Å; D886-S888 WeakPolarHBondContact OD1-CB 3.13Å; D886-S888 PolarHBondContact OD1-N 3.18Å; D886-S888 PolarHBondContact OD1-OG 3.32Å; D886-S888 PolarHBondContact OD2-OG 2.77Å; D886-V889 PolarHBondContact O-N 3.28Å; D886-L890 WeakPolarHBondContact O-CB 3.42Å; D886-L890 VanDerWaalsContact O-CG 3.31Å; D886-L890 WeakPolarHBondContact O-CG 3.44Å; D886-L890 PolarHBondContact O-N 3.36Å; D886-L890 VanDerWaalsContact O-N 3.13Å
887	G	87.5	Confident	80.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-22.4	173.6	0	0	0	0	0	113.4	G804 A885 V889 L891	G804-G887 VanDerWaalsContact O-CA 3.26Å; G804-G887 WeakPolarHBondContact O-CA 3.34Å; G804-G887 PolarHBondContact O-N 3.37Å; A885-G887 PolarHBondContact O-N 3Å; G887-V889 PolarHBondContact O-N 3.16Å; G887-L891 VanDerWaalsContact O-CB 3.26Å; G887-L891 WeakPolarHBondContact O-CB 3.45Å; G887-L891 WeakPolarHBondContact O-CG 3.35Å; G887-L891 PolarHBondContact O-N 3.19Å
888	S	87.5	Confident	81.1	Confident	4 Å²	4	44.2 Å²	44.2	3%	0.028	27%	0.269	C	S	.	.	H	α-helix	trans	-66.4	-40.7	180	79.2	0	0	0	0	111.2	D886 L893 S894	D886-S888 PolarHBondContact O-N 2.98Å; D886-S888 WeakPolarHBondContact OD1-CA 3.33Å; D886-S888 VanDerWaalsContact OD1-CB 3.24Å; D886-S888 WeakPolarHBondContact OD1-CB 3.13Å; D886-S888 PolarHBondContact OD1-N 3.18Å; D886-S888 PolarHBondContact OD1-OG 3.32Å; D886-S888 PolarHBondContact OD2-OG 2.77Å; S888-L893 CarbonylContact O-C 3.56Å; S888-L893 WeakPolarHBondContact O-CA 3.3Å; S888-L893 PolarHBondContact O-N 3.27Å; S888-S894 PolarHBondContact O-N 3.23Å
889	V	86	Confident	81.8	Confident	92 Å²	92	39.8 Å²	39.8	56%	0.558	25%	0.245	S	C	*	.	H	α-helix	trans	-81.1	-44.6	174.8	179.7	0	0	0	0	111.4	D886 G887 L891 G892	D886-V889 PolarHBondContact O-N 3.28Å; G887-V889 PolarHBondContact O-N 3.16Å; V889-L891 VanDerWaalsContact C-N 3.3Å; V889-L891 PolarHBondContact O-N 2.83Å; V889-G892 PolarHBondContact O-N 3.4Å
890	L	88	Confident	83	Confident	25 Å²	25	41.7 Å²	41.7	13%	0.131	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-36.5	-176.4	-73.7	167.7	0	0	0	113.5	K800 V803 A885 D886	K800-L890 HydrophobicContact CD-CD2 4.47Å; K800-L890 HydrophobicContact CG-CD1 4.02Å; K800-L890 HydrophobicContact CG-CD2 4.49Å; V803-L890 HydrophobicContact CG1-CD1 4.23Å; V803-L890 HydrophobicContact CG2-CD1 4.4Å; A885-L890 HydrophobicContact CB-CD1 3.98Å; D886-L890 WeakPolarHBondContact O-CB 3.42Å; D886-L890 VanDerWaalsContact O-CG 3.31Å; D886-L890 WeakPolarHBondContact O-CG 3.44Å; D886-L890 PolarHBondContact O-N 3.36Å; D886-L890 VanDerWaalsContact O-N 3.13Å
891	L	90	Very high	84.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	8.4	-177.1	-55.9	171.7	0	0	0	113.3	I797 F805 F818 I833 I837 F851 F860 G887 V889 L893	I797-L891 HydrophobicContact CG2-CD2 4.04Å; F805-L891 HydrophobicContact CD1-CD1 4.28Å; F805-L891 HydrophobicContact CE1-CD1 4.15Å; F818-L891 HydrophobicContact CE2-CD1 4.33Å; F818-L891 HydrophobicContact CZ-CD1 3.84Å; I833-L891 HydrophobicContact CG2-CD2 4.16Å; I837-L891 HydrophobicContact CD1-CD1 3.61Å; I837-L891 HydrophobicContact CD1-CD2 4.27Å; F851-L891 HydrophobicContact CZ-CD1 4.28Å; F860-L891 HydrophobicContact CD2-CB 4.01Å; F860-L891 HydrophobicContact CD2-CD2 4.3Å; F860-L891 WeakPolarHBondContact CD2-O 3.48Å; F860-L891 HydrophobicContact CE2-CB 4.17Å; F860-L891 HydrophobicContact CE2-CD2 3.66Å; F860-L891 HydrophobicContact CZ-CD2 4Å; G887-L891 VanDerWaalsContact O-CB 3.26Å; G887-L891 WeakPolarHBondContact O-CB 3.45Å; G887-L891 WeakPolarHBondContact O-CG 3.35Å; G887-L891 PolarHBondContact O-N 3.19Å; V889-L891 VanDerWaalsContact C-N 3.3Å; V889-L891 PolarHBondContact O-N 2.83Å; L891-L893 HydrophobicContact CB-CD1 4.05Å; L891-L893 HydrophobicContact CB-CG 3.96Å; L891-L893 HydrophobicContact CD1-CD1 4.22Å; L891-L893 PolarHBondContact O-N 3.36Å
892	G	88.5	Confident	86	Confident	4 Å²	4	35.8 Å²	35.8	4%	0.041	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	19.6	-178.6	0	0	0	0	0	114.6	G787 V788 V889	G787-G892 WeakPolarHBondContact CA-O 3.36Å; V788-G892 WeakPolarHBondContact CG2-O 3.5Å; V788-G892 PolarHBondContact N-O 2.95Å; V889-G892 PolarHBondContact O-N 3.4Å
893	L	90.1	Very high	87.5	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	20%	0.197	C	C	.	.			trans	-85.7	-18.4	-178.8	-59.4	174.9	0	0	0	113	F805 F851 F860 Q875 A876 S888 L891 A896	F805-L893 HydrophobicContact CD1-CD1 3.92Å; F805-L893 HydrophobicContact CE1-CD1 3.76Å; F805-L893 HydrophobicContact CE2-CD1 4.43Å; F805-L893 HydrophobicContact CG-CD1 4.32Å; F805-L893 HydrophobicContact CZ-CD1 4.04Å; F851-L893 HydrophobicContact CE2-CD1 3.93Å; F851-L893 HydrophobicContact CE2-CD2 4.29Å; F851-L893 HydrophobicContact CZ-CD1 4.13Å; F860-L893 HydrophobicContact CB-CD2 4.32Å; Q875-L893 PolarHBondContact NE2-O 2.85Å; Q875-L893 VanDerWaalsContact NE2-O 3.13Å; A876-L893 HydrophobicContact CB-CB 3.62Å; S888-L893 CarbonylContact O-C 3.56Å; S888-L893 WeakPolarHBondContact O-CA 3.3Å; S888-L893 PolarHBondContact O-N 3.27Å; L891-L893 HydrophobicContact CB-CD1 4.05Å; L891-L893 HydrophobicContact CB-CG 3.96Å; L891-L893 HydrophobicContact CD1-CD1 4.22Å; L891-L893 PolarHBondContact O-N 3.36Å; L893-A896 WeakPolarHBondContact O-CB 3.49Å
894	S	82.5	Confident	88.3	Confident	14 Å²	14	30.7 Å²	30.7	10%	0.098	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-48.3	177.5	66.8	0	0	0	0	110.9	K528 Q875 S888	K528-S894 WeakPolarHBondContact CD-O 3.18Å; K528-S894 WeakPolarHBondContact CE-O 3.19Å; K528-S894 PolarHBondContact NZ-O 3.02Å; Q875-S894 VanDerWaalsContact CD-O 3.26Å; Q875-S894 VanDerWaalsContact CG-O 3.24Å; Q875-S894 WeakPolarHBondContact CG-O 3.44Å; Q875-S894 PolarHBondContact NE2-O 3.06Å; Q875-S894 VanDerWaalsContact NE2-O 3.09Å; S888-S894 PolarHBondContact O-N 3.23Å
895	S	80.1	Confident	88.9	Confident	43 Å²	43	28.5 Å²	28.5	30%	0.301	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	18.8	-172.3	-35.1	0	0	0	0	112.8	E532	E532-S895 VanDerWaalsContact CD-CA 3.48Å; E532-S895 VanDerWaalsContact CD-CB 3.49Å; E532-S895 VanDerWaalsContact CD-OG 3.29Å; E532-S895 WeakPolarHBondContact CG-OG 3.36Å; E532-S895 PolarHBondContact OE1-OG 3.47Å; E532-S895 WeakPolarHBondContact OE2-CA 3.31Å
896	A	87.4	Confident	89.4	Confident	5 Å²	5	30 Å²	30	4%	0.041	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-76	150	-172.3	0	0	0	0	0	112.6	I785 K786 Q875 L893 V898	I785-A896 HydrophobicContact CG2-CB 3.25Å; K786-A896 CarbonylContact O-C 3.44Å; K786-A896 WeakPolarHBondContact O-CA 3.28Å; K786-A896 WeakPolarHBondContact O-CB 3.28Å; Q875-A896 PolarHBondContact NE2-O 3.39Å; Q875-A896 PolarHBondContact OE1-O 3.37Å; L893-A896 WeakPolarHBondContact O-CB 3.49Å; A896-V898 PolarHBondContact O-N 3.3Å
897	V	89.5	Confident	89.9	Confident	54 Å²	54	27.9 Å²	27.9	33%	0.327	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	116.1	172.5	179.5	0	0	0	0	109.1	P723 K786	P723-V897 HydrophobicContact CB-CG1 3.84Å; P723-V897 HydrophobicContact CG-CG1 3.85Å; K786-V897 HydrophobicContact CB-CB 4.33Å; K786-V897 PolarHBondContact N-O 3.26Å; K786-V897 PolarHBondContact O-N 2.86Å
898	V	90.1	Very high	90.2	Very high	37 Å²	37	28.6 Å²	28.6	22%	0.224	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	134.1	176.4	179.8	0	0	0	0	109.9	I785 L873 Q875 A896	I785-V898 HydrophobicContact CG1-CG2 4.26Å; I785-V898 HydrophobicContact CG2-CG2 4.43Å; L873-V898 WeakPolarHBondContact O-CG1 3.34Å; Q875-V898 HydrophobicContact CB-CG2 4.34Å; Q875-V898 VanDerWaalsContact OE1-CG2 3.31Å; A896-V898 PolarHBondContact O-N 3.3Å
899	S	93.2	Very high	90.6	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.014	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.8	175.5	-176.9	0	0	0	0	109.7	S724 A783 F784	S724-S899 PolarHBondContact N-OG 2.8Å; S724-S899 PolarHBondContact OG-OG 3.16Å; A783-S899 CarbonylContact C-O 3.52Å; A783-S899 WeakPolarHBondContact CA-O 3.43Å; A783-S899 WeakPolarHBondContact CB-O 3.19Å; F784-S899 VanDerWaalsContact CE1-OG 3.24Å; F784-S899 WeakPolarHBondContact CE1-OG 3.02Å; F784-S899 VanDerWaalsContact CZ-CB 3.48Å; F784-S899 PolarHBondContact N-O 3Å; F784-S899 PolarHBondContact O-N 2.86Å
900	N	92.6	Very high	91	Very high	43 Å²	43	29.3 Å²	29.3	23%	0.23	18%	0.176	C	C	.	.			trans	-72.6	159.2	167.7	-66.6	-32.5	0	0	0	110	S724	S724-N900 PolarHBondContact OG-N 3.09Å; S724-N900 PolarHBondContact OG-O 3Å
901	G	91	Very high	91.2	Very high	4 Å²	4	28.1 Å²	28.1	4%	0.041	17%	0.169	C	C	.	.			trans	-67.1	158.6	167.4	0	0	0	0	0	111.3	T781 G868 K869 A871	T781-G901 WeakPolarHBondContact O-CA 3.33Å; G868-G901 CarbonylContact O-C 3.59Å; G868-G901 WeakPolarHBondContact O-CA 3.01Å; K869-G901 WeakPolarHBondContact CA-O 3.38Å; A871-G901 PolarHBondContact O-N 2.99Å
902	V	92.1	Very high	91.2	Very high	34 Å²	34	30.8 Å²	30.8	21%	0.206	18%	0.184	C	C	.	.			trans	-131.4	146.2	177.9	-164	0	0	0	0	108.3	F777 E780 T781 G868	F777-V902 HydrophobicContact CB-CB 4.41Å; F777-V902 HydrophobicContact CB-CG1 4.25Å; F777-V902 HydrophobicContact CD1-CB 3.83Å; F777-V902 HydrophobicContact CD1-CG1 4.29Å; F777-V902 HydrophobicContact CD1-CG2 3.82Å; F777-V902 HydrophobicContact CD2-CG1 4.16Å; F777-V902 HydrophobicContact CE1-CB 4.24Å; F777-V902 HydrophobicContact CE1-CG2 3.69Å; F777-V902 HydrophobicContact CE2-CG2 4.48Å; F777-V902 HydrophobicContact CG-CB 4.01Å; F777-V902 HydrophobicContact CG-CG1 3.97Å; F777-V902 HydrophobicContact CG-CG2 4.28Å; F777-V902 HydrophobicContact CZ-CG2 4.06Å; E780-V902 WeakPolarHBondContact CA-O 3.45Å; T781-V902 PolarHBondContact N-O 3.22Å; T781-V902 WeakPolarHBondContact OG1-CB 3.33Å; T781-V902 PolarHBondContact OG1-N 3.09Å; T781-V902 PolarHBondContact OG1-O 3.36Å; G868-V902 WeakPolarHBondContact CA-O 3.35Å
903	N	93.2	Very high	91.4	Very high	80 Å²	80	33.9 Å²	33.9	43%	0.428	19%	0.194	S	C	.	.			trans	-64.6	164.4	168.6	-68.6	7	0	0	0	110.4	K869	K869-N903 VanDerWaalsContact CB-OD1 3.26Å; K869-N903 WeakPolarHBondContact CB-OD1 3.39Å; K869-N903 PolarHBondContact N-OD1 3.23Å
904	A	92.7	Very high	91.3	Very high	53 Å²	53	33.8 Å²	33.8	44%	0.438	19%	0.194	S	C	.	.			trans	-61.2	142	163.9	0	0	0	0	0	110.9	F777 K778 E780	F777-A904 CarbonylContact O-C 3.49Å; F777-A904 VanDerWaalsContact O-CA 3.25Å; F777-A904 WeakPolarHBondContact O-CA 3.44Å; K778-A904 WeakPolarHBondContact O-CB 3.46Å; E780-A904 HydrophobicContact CG-CB 4.29Å
905	E	94.1	Very high	91.4	Very high	25 Å²	25	34.5 Å²	34.5	12%	0.117	20%	0.195	C	C	.	.			trans	-126.8	141.9	170.9	79.2	-169.3	158.1	0	0	109.8	W776 F777 E909 F910 R913	W776-E905 PolarHBondContact NE1-O 3.35Å; F777-E905 HydrophobicContact CB-CG 4.17Å; F777-E905 WeakPolarHBondContact CD2-OE1 3.25Å; F777-E905 PolarHBondContact N-OE1 3.44Å; F777-E905 PolarHBondContact O-N 3.31Å; E905-E909 HydrophobicContact CB-CB 4.19Å; E905-F910 HydrophobicContact CG-CB 4.3Å; E905-R913 IonicContact OE1-CZ 2.66Å; E905-R913 IonicContact OE1-NE 3.55Å; E905-R913 IonicContact OE1-NH2 2.78Å; E905-R913 PolarHBondContact OE1-NH2 3.08Å; E905-R913 IonicContact OE2-CZ 2.77Å; E905-R913 IonicContact OE2-NE 2.81Å; E905-R913 PolarHBondContact OE2-NE 3.31Å; E905-R913 IonicContact OE2-NH2 2.65Å; E905-R913 PolarHBondContact OE2-NH2 3.4Å
906	T	95.1	Very high	91.4	Very high	65 Å²	65	37.3 Å²	37.3	40%	0.399	21%	0.206	S	C	.	.			trans	-70.2	162.7	172	60.7	0	0	0	0	111.5	A908 E909 F910	T906-A908 PolarHBondContact O-N 2.93Å; T906-E909 VanDerWaalsContact CB-OE2 3.32Å; T906-E909 WeakPolarHBondContact CB-OE2 3.4Å; T906-E909 WeakPolarHBondContact CG2-OE2 3.44Å; T906-E909 PolarHBondContact N-OE2 3.38Å; T906-E909 PolarHBondContact O-N 3.4Å; T906-E909 WeakPolarHBondContact OG1-CG 3.31Å; T906-E909 PolarHBondContact OG1-N 3.05Å; T906-E909 PolarHBondContact OG1-OE2 2.8Å; T906-F910 PolarHBondContact O-N 3.01Å
907	F	96.1	Very high	90.9	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-27.5	176.3	-164.2	-105.9	0	0	0	112.7	A716 W776 F910 C911 I924 V932 E936 A940 F961	A716-F907 HydrophobicContact CB-CE2 3.97Å; W776-F907 AromaticContact CD2-CD2 3.91Å; W776-F907 HydrophobicContact CD2-CD2 3.91Å; W776-F907 AromaticContact CE3-CD2 3.87Å; W776-F907 HydrophobicContact CE3-CD2 3.87Å; W776-F907 HydrophobicContact CE3-CE2 4.42Å; W776-F907 HydrophobicContact CH2-CB 3.96Å; W776-F907 AromaticContact CH2-CD2 3.97Å; W776-F907 HydrophobicContact CH2-CD2 3.97Å; W776-F907 HydrophobicContact CH2-CG 4.36Å; W776-F907 HydrophobicContact CZ2-CB 3.68Å; W776-F907 HydrophobicContact CZ2-CD2 4.07Å; W776-F907 HydrophobicContact CZ2-CG 4.37Å; W776-F907 AromaticContact CZ3-CD2 3.9Å; W776-F907 HydrophobicContact CZ3-CD2 3.9Å; F907-F910 HydrophobicContact CD2-CD1 4.11Å; F907-F910 AromaticContact CE2-CD1 3.82Å; F907-F910 HydrophobicContact CE2-CD1 3.82Å; F907-F910 HydrophobicContact CE2-CE1 4.1Å; F907-F910 HydrophobicContact CZ-CD1 4.28Å; F907-F910 HydrophobicContact CZ-CE1 4.4Å; F907-C911 PolarHBondContact O-N 2.94Å; F907-C911 PolarHBondContact O-SG 3.3Å; F907-I924 HydrophobicContact CZ-CG2 4.44Å; F907-V932 HydrophobicContact CB-CG1 4Å; F907-V932 HydrophobicContact CD1-CG1 4.01Å; F907-V932 HydrophobicContact CD1-CG2 4.49Å; F907-V932 HydrophobicContact CD2-CG1 4.4Å; F907-V932 HydrophobicContact CD2-CG2 3.85Å; F907-V932 HydrophobicContact CE2-CG2 3.97Å; F907-V932 HydrophobicContact CG-CG1 3.86Å; F907-V932 HydrophobicContact CG-CG2 4.13Å; F907-V932 HydrophobicContact CZ-CG2 4.37Å; F907-E936 HydrophobicContact CB-CB 4.12Å; F907-A940 HydrophobicContact CD1-CB 3.76Å; F907-A940 HydrophobicContact CE1-CB 4.39Å; F907-F961 HydrophobicContact CD1-CE1 4.03Å; F907-F961 HydrophobicContact CD1-CZ 4.09Å; F907-F961 AromaticContact CE1-CE1 3.53Å; F907-F961 HydrophobicContact CE1-CE1 3.53Å; F907-F961 AromaticContact CE1-CZ 3.76Å; F907-F961 HydrophobicContact CE1-CZ 3.76Å; F907-F961 HydrophobicContact CZ-CE1 4.24Å
908	A	94.4	Very high	90.6	Very high	16 Å²	16	37 Å²	37	13%	0.132	21%	0.208	C	C	.	.	H	α-helix	trans	-70	-43.9	173.3	0	0	0	0	0	112.2	T906 F910 C911 D912 A939 A940 W943	T906-A908 PolarHBondContact O-N 2.93Å; A908-F910 VanDerWaalsContact C-N 3.33Å; A908-F910 PolarHBondContact O-N 3.46Å; A908-C911 PolarHBondContact O-N 3.37Å; A908-D912 PolarHBondContact O-N 2.85Å; A908-A939 HydrophobicContact CB-CB 4.35Å; A908-A940 HydrophobicContact CB-CB 4.49Å; A908-W943 HydrophobicContact CB-CB 4.32Å
909	E	95	Very high	89.5	Confident	110 Å²	110	38.3 Å²	38.3	51%	0.514	22%	0.218	S	C	.	.	H	α-helix	trans	-64.4	-37.1	174	-71.9	162.7	124.3	0	0	111.9	E905 T906 D912 R913	E905-E909 HydrophobicContact CB-CB 4.19Å; T906-E909 VanDerWaalsContact CB-OE2 3.32Å; T906-E909 WeakPolarHBondContact CB-OE2 3.4Å; T906-E909 WeakPolarHBondContact CG2-OE2 3.44Å; T906-E909 PolarHBondContact N-OE2 3.38Å; T906-E909 PolarHBondContact O-N 3.4Å; T906-E909 WeakPolarHBondContact OG1-CG 3.31Å; T906-E909 PolarHBondContact OG1-N 3.05Å; T906-E909 PolarHBondContact OG1-OE2 2.8Å; E909-D912 PolarHBondContact O-N 3.19Å; E909-R913 WeakPolarHBondContact O-CB 3.33Å; E909-R913 PolarHBondContact O-N 3.33Å
910	F	95.6	Very high	88.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.2	-47.6	169.2	166.6	-90.1	0	0	0	111.9	A716 A774 W776 E905 T906 F907 A908 D912 R913 I914 I924	A716-F910 HydrophobicContact CB-CD1 4.35Å; A716-F910 HydrophobicContact CB-CE1 3.48Å; A716-F910 VanDerWaalsContact CB-CE1 3.48Å; A716-F910 HydrophobicContact CB-CE2 4.07Å; A716-F910 HydrophobicContact CB-CZ 3.31Å; A774-F910 HydrophobicContact CB-CE2 3.72Å; A774-F910 HydrophobicContact CB-CZ 3.88Å; W776-F910 HydrophobicContact CB-CD2 3.74Å; W776-F910 HydrophobicContact CB-CE2 4.08Å; W776-F910 HydrophobicContact CB-CG 4.24Å; W776-F910 HydrophobicContact CG-CB 4.28Å; W776-F910 HydrophobicContact CG-CD2 4.18Å; W776-F910 HydrophobicContact CG-CG 4.24Å; E905-F910 HydrophobicContact CG-CB 4.3Å; T906-F910 PolarHBondContact O-N 3.01Å; F907-F910 HydrophobicContact CD2-CD1 4.11Å; F907-F910 AromaticContact CE2-CD1 3.82Å; F907-F910 HydrophobicContact CE2-CD1 3.82Å; F907-F910 HydrophobicContact CE2-CE1 4.1Å; F907-F910 HydrophobicContact CZ-CD1 4.28Å; F907-F910 HydrophobicContact CZ-CE1 4.4Å; A908-F910 VanDerWaalsContact C-N 3.33Å; A908-F910 PolarHBondContact O-N 3.46Å; F910-D912 PolarHBondContact O-N 2.7Å; F910-R913 PolarHBondContact O-N 3.44Å; F910-I914 HydrophobicContact CD2-CG1 4.13Å; F910-I914 HydrophobicContact CE1-CG1 4.4Å; F910-I914 HydrophobicContact CE2-CD1 4.42Å; F910-I914 HydrophobicContact CE2-CG1 3.73Å; F910-I914 HydrophobicContact CZ-CG1 3.86Å; F910-I914 WeakPolarHBondContact O-CG1 3.48Å; F910-I914 PolarHBondContact O-N 3.06Å; F910-I924 HydrophobicContact CE1-CG2 4.1Å
911	C	92.9	Very high	87.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-46	179.2	-70.7	0	0	0	0	111.4	F907 A908 I914 Y915 I924 W943	F907-C911 PolarHBondContact O-N 2.94Å; F907-C911 PolarHBondContact O-SG 3.3Å; A908-C911 PolarHBondContact O-N 3.37Å; C911-I914 PolarHBondContact O-N 2.84Å; C911-Y915 WeakPolarHBondContact O-CB 3.23Å; C911-Y915 PolarHBondContact O-N 3.2Å; C911-I924 HydrophobicContact CB-CD1 4.44Å; C911-W943 HydrophobicContact CB-CD2 3.99Å; C911-W943 HydrophobicContact CB-CE3 3.66Å; C911-W943 HydrophobicContact CB-CH2 3.91Å; C911-W943 HydrophobicContact CB-CZ2 4.2Å; C911-W943 HydrophobicContact CB-CZ3 3.62Å
912	D	89.8	Confident	87.8	Confident	57 Å²	57	36.8 Å²	36.8	31%	0.305	21%	0.212	S	C	.	.	H	α-helix	trans	-63.6	-44.7	176.9	-162.5	72.5	0	0	0	112.1	A908 E909 F910 I914 Y915 N916 W943	A908-D912 PolarHBondContact O-N 2.85Å; E909-D912 PolarHBondContact O-N 3.19Å; F910-D912 PolarHBondContact O-N 2.7Å; D912-I914 VanDerWaalsContact C-N 3.34Å; D912-I914 PolarHBondContact O-N 2.96Å; D912-Y915 PolarHBondContact O-N 2.87Å; D912-N916 VanDerWaalsContact CG-ND2 3.3Å; D912-N916 WeakPolarHBondContact O-CB 3.46Å; D912-N916 PolarHBondContact O-N 3.28Å; D912-N916 PolarHBondContact O-ND2 3.19Å; D912-N916 PolarHBondContact OD1-ND2 2.77Å; D912-N916 PolarHBondContact OD2-ND2 3.09Å; D912-W943 VanDerWaalsContact CB-NE1 3.35Å; D912-W943 PolarHBondContact OD1-NE1 3.34Å
913	R	91.7	Very high	87.9	Confident	68 Å²	68	35.3 Å²	35.3	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-59.2	-42.4	178.1	-179.7	172.1	63.1	78.2	-4.5	112.3	P727 R775 E905 E909 F910 A917	P727-R913 PolarHBondContact O-NH1 3.19Å; R775-R913 PolarHBondContact O-NH2 3.11Å; E905-R913 IonicContact OE1-CZ 2.66Å; E905-R913 IonicContact OE1-NE 3.55Å; E905-R913 IonicContact OE1-NH2 2.78Å; E905-R913 PolarHBondContact OE1-NH2 3.08Å; E905-R913 IonicContact OE2-CZ 2.77Å; E905-R913 IonicContact OE2-NE 2.81Å; E905-R913 PolarHBondContact OE2-NE 3.31Å; E905-R913 IonicContact OE2-NH2 2.65Å; E905-R913 PolarHBondContact OE2-NH2 3.4Å; E909-R913 WeakPolarHBondContact O-CB 3.33Å; E909-R913 PolarHBondContact O-N 3.33Å; F910-R913 PolarHBondContact O-N 3.44Å; R913-A917 WeakPolarHBondContact O-CB 3.38Å; R913-A917 PolarHBondContact O-N 3.13Å
914	I	88.9	Confident	88	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-81.1	-36.3	-179.5	-56.6	-56.6	0	0	0	112.1	I714 P727 A774 F910 C911 D912 N916 A917 N918	I714-I914 HydrophobicContact CD1-CG2 3.97Å; I714-I914 HydrophobicContact CG1-CG2 4.21Å; I714-I914 HydrophobicContact CG2-CB 4.45Å; I714-I914 HydrophobicContact CG2-CG2 3.64Å; P727-I914 WeakPolarHBondContact O-CD1 3.46Å; A774-I914 HydrophobicContact CB-CD1 3.53Å; A774-I914 HydrophobicContact CB-CG1 3.78Å; F910-I914 HydrophobicContact CD2-CG1 4.13Å; F910-I914 HydrophobicContact CE1-CG1 4.4Å; F910-I914 HydrophobicContact CE2-CD1 4.42Å; F910-I914 HydrophobicContact CE2-CG1 3.73Å; F910-I914 HydrophobicContact CZ-CG1 3.86Å; F910-I914 WeakPolarHBondContact O-CG1 3.48Å; F910-I914 PolarHBondContact O-N 3.06Å; C911-I914 PolarHBondContact O-N 2.84Å; D912-I914 VanDerWaalsContact C-N 3.34Å; D912-I914 PolarHBondContact O-N 2.96Å; I914-N916 VanDerWaalsContact C-N 3.35Å; I914-N916 PolarHBondContact O-N 2.87Å; I914-A917 CarbonylContact O-C 3.59Å; I914-A917 PolarHBondContact O-N 3.39Å; I914-A917 VanDerWaalsContact O-N 3.12Å; I914-N918 PolarHBondContact O-N 2.88Å
915	Y	83.8	Confident	88.2	Confident	29 Å²	29	29 Å²	29	11%	0.114	16%	0.162	C	C	.	.	H	α-helix	trans	-60.2	-43.9	174.5	179.9	-99.6	0	0	0	112	C911 D912 A917 N918 S919 W943 Y953 A956 A957	C911-Y915 WeakPolarHBondContact O-CB 3.23Å; C911-Y915 PolarHBondContact O-N 3.2Å; D912-Y915 PolarHBondContact O-N 2.87Å; Y915-A917 VanDerWaalsContact C-N 3.31Å; Y915-A917 PolarHBondContact O-N 3Å; Y915-N918 CarbonylContact O-C 3.5Å; Y915-N918 VanDerWaalsContact O-C 3.29Å; Y915-N918 PolarHBondContact O-N 2.86Å; Y915-S919 PolarHBondContact O-N 3.42Å; Y915-W943 HydrophobicContact CD1-CZ2 4.24Å; Y915-W943 HydrophobicContact CD2-CH2 4.33Å; Y915-W943 HydrophobicContact CG-CH2 4.09Å; Y915-W943 AromaticContact CG-CZ2 3.94Å; Y915-W943 HydrophobicContact CG-CZ2 3.94Å; Y915-Y953 HydrophobicContact CD1-CE1 4.29Å; Y915-Y953 HydrophobicContact CD1-CE2 4.32Å; Y915-Y953 AromaticContact CE1-CD1 3.72Å; Y915-Y953 HydrophobicContact CE1-CD1 3.72Å; Y915-Y953 HydrophobicContact CE1-CD2 4.49Å; Y915-Y953 AromaticContact CE1-CE1 3.47Å; Y915-Y953 HydrophobicContact CE1-CE1 3.47Å; Y915-Y953 VanDerWaalsContact CE1-CE1 3.47Å; Y915-Y953 HydrophobicContact CE1-CE2 4.27Å; Y915-Y953 HydrophobicContact CE1-CG 4.23Å; Y915-Y953 AromaticContact CE1-CZ 3.76Å; Y915-Y953 AromaticContact CZ-CD1 3.82Å; Y915-A956 HydrophobicContact CE2-CB 3.81Å; Y915-A956 VanDerWaalsContact OH-CB 3.27Å; Y915-A956 WeakPolarHBondContact OH-CB 3.21Å; Y915-A957 HydrophobicContact CD2-CB 4.13Å; Y915-A957 HydrophobicContact CE2-CB 4.17Å
916	N	79.9	Confident	88.2	Confident	102 Å²	102	28.5 Å²	28.5	55%	0.545	16%	0.161	S	C	.	.	H	α-helix	trans	-71.3	-22.7	175	-71.7	-63.1	0	0	0	113.5	D912 I914	D912-N916 VanDerWaalsContact CG-ND2 3.3Å; D912-N916 WeakPolarHBondContact O-CB 3.46Å; D912-N916 PolarHBondContact O-N 3.28Å; D912-N916 PolarHBondContact O-ND2 3.19Å; D912-N916 PolarHBondContact OD1-ND2 2.77Å; D912-N916 PolarHBondContact OD2-ND2 3.09Å; I914-N916 VanDerWaalsContact C-N 3.35Å; I914-N916 PolarHBondContact O-N 2.87Å
917	A	78.2	Confident	88.1	Confident	40 Å²	40	25.7 Å²	25.7	33%	0.331	14%	0.144	S	C	.	.	H	α-helix	trans	-85.9	-25.2	173.6	0	0	0	0	0	113.2	P727 Y728 R913 I914 Y915	P727-A917 HydrophobicContact CB-CB 4.17Å; Y728-A917 HydrophobicContact CD1-CB 4.18Å; Y728-A917 HydrophobicContact CE1-CB 4.11Å; R913-A917 WeakPolarHBondContact O-CB 3.38Å; R913-A917 PolarHBondContact O-N 3.13Å; I914-A917 CarbonylContact O-C 3.59Å; I914-A917 PolarHBondContact O-N 3.39Å; I914-A917 VanDerWaalsContact O-N 3.12Å; Y915-A917 VanDerWaalsContact C-N 3.31Å; Y915-A917 PolarHBondContact O-N 3Å
918	N	81.4	Confident	87.6	Confident	13 Å²	13	29 Å²	29	7%	0.07	16%	0.157	C	C	.	.			trans	-150.4	89.7	-177	-166	-78.8	0	0	0	111.5	H712 Y728 I914 Y915 G920 G921	H712-N918 PolarHBondContact NE2-OD1 2.99Å; Y728-N918 HydrophobicContact CD1-CB 4.47Å; Y728-N918 HydrophobicContact CE1-CB 4.02Å; I914-N918 PolarHBondContact O-N 2.88Å; Y915-N918 CarbonylContact O-C 3.5Å; Y915-N918 VanDerWaalsContact O-C 3.29Å; Y915-N918 PolarHBondContact O-N 2.86Å; N918-G920 VanDerWaalsContact C-N 3.25Å; N918-G920 PolarHBondContact O-N 2.82Å; N918-G921 PolarHBondContact OD1-N 3.01Å
919	S	67.6	Low	87	Confident	63 Å²	63	30.5 Å²	30.5	44%	0.441	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-0.5	178.9	53.1	0	0	0	0	114.7	Y915 Q1095	Y915-S919 PolarHBondContact O-N 3.42Å; S919-Q1095 PolarHBondContact O-NE2 2.93Å
920	G	71.3	Confident	86.8	Confident	12 Å²	12	26 Å²	26	12%	0.124	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-26	173.9	0	0	0	0	0	113.7	H712 N918	H712-G920 PolarHBondContact CE1-O 3.25Å; N918-G920 VanDerWaalsContact C-N 3.25Å; N918-G920 PolarHBondContact O-N 2.82Å
921	G	81.4	Confident	86.4	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.01	18%	0.183	C	C	.	.			trans	-70.3	135.1	178.8	0	0	0	0	0	111.8	H712 N918	H712-G921 PolarHBondContact CE1-N 3.28Å; H712-G921 WeakPolarHBondContact NE2-CA 3.36Å; H712-G921 PolarHBondContact NE2-N 3.14Å; N918-G921 PolarHBondContact OD1-N 3.01Å
922	F	89.7	Confident	86.4	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.018	19%	0.187	C	C	.	.			trans	-111	-47.5	-172.2	178	-100.3	0	0	0	112.4	K711 H712 A956 A957 K958 Q1087 L1088 S1091	K711-F922 HydrophobicContact CB-CB 4.15Å; K711-F922 HydrophobicContact CD-CB 3.87Å; K711-F922 HydrophobicContact CD-CD2 4.15Å; K711-F922 HydrophobicContact CD-CG 4.1Å; H712-F922 PolarHBondContact O-N 3.27Å; F922-A956 WeakPolarHBondContact CD2-O 3.28Å; F922-A957 CarbonylContact O-C 3.52Å; F922-A957 WeakPolarHBondContact O-CA 3.32Å; F922-K958 HydrophobicContact CD1-CB 4.32Å; F922-K958 HydrophobicContact CE1-CB 3.82Å; F922-K958 HydrophobicContact CE1-CD 3.93Å; F922-K958 HydrophobicContact CE1-CG 4.49Å; F922-K958 HydrophobicContact CE2-CB 4.37Å; F922-K958 HydrophobicContact CZ-CB 3.85Å; F922-K958 HydrophobicContact CZ-CD 4.32Å; F922-K958 PolarHBondContact O-N 3.45Å; F922-Q1087 HydrophobicContact CE2-CG 4.29Å; F922-Q1087 HydrophobicContact CZ-CG 3.96Å; F922-L1088 HydrophobicContact CD1-CD1 3.48Å; F922-L1088 VanDerWaalsContact CD1-CD1 3.48Å; F922-L1088 HydrophobicContact CD2-CD1 4.47Å; F922-L1088 HydrophobicContact CE1-CB 4.31Å; F922-L1088 HydrophobicContact CE1-CD1 3.34Å; F922-L1088 HydrophobicContact CE1-CG 4.43Å; F922-L1088 HydrophobicContact CE2-CD1 4.36Å; F922-L1088 HydrophobicContact CG-CD1 4.07Å; F922-L1088 HydrophobicContact CZ-CB 4.2Å; F922-L1088 HydrophobicContact CZ-CD1 3.82Å; F922-S1091 WeakPolarHBondContact CE2-OG 3.42Å
923	A	93.5	Very high	86.5	Confident	3 Å²	3	31.5 Å²	31.5	3%	0.025	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	97.5	-172.2	0	0	0	0	0	111	H712 I713 I714 I960 A999	H712-A923 PolarHBondContact O-N 3.49Å; I713-A923 CarbonylContact C-O 3.29Å; I713-A923 WeakPolarHBondContact CA-O 3.26Å; I714-A923 PolarHBondContact N-O 3.27Å; A923-I960 HydrophobicContact CB-CD1 3.76Å; A923-A999 HydrophobicContact CB-CB 3.74Å
924	I	95.5	Very high	86.4	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	125	175.5	-51.1	174.5	0	0	0	109.1	I714 F907 F910 C911 W943 K958 L959 I960	I714-I924 HydrophobicContact CB-CB 4.45Å; I714-I924 HydrophobicContact CB-CG1 4.07Å; I714-I924 HydrophobicContact CD1-CD1 4.45Å; I714-I924 HydrophobicContact CD1-CG1 3.89Å; I714-I924 HydrophobicContact CG2-CG1 4.31Å; I714-I924 HydrophobicContact CG2-CG2 4.15Å; I714-I924 WeakPolarHBondContact O-CA 3.45Å; F907-I924 HydrophobicContact CZ-CG2 4.44Å; F910-I924 HydrophobicContact CE1-CG2 4.1Å; C911-I924 HydrophobicContact CB-CD1 4.44Å; I924-W943 HydrophobicContact CD1-CH2 4.25Å; I924-W943 HydrophobicContact CD1-CZ3 4.34Å; I924-K958 PolarHBondContact N-O 3.29Å; I924-L959 HydrophobicContact CB-CD2 3.83Å; I924-L959 HydrophobicContact CD1-CD2 4.09Å; I924-L959 HydrophobicContact CG1-CD2 4.43Å; I924-L959 HydrophobicContact CG2-CD2 4.25Å; I924-I960 PolarHBondContact O-N 3.04Å
925	T	95.5	Very high	86.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	143.6	177.4	-164.5	0	0	0	0	112.9	I713 I714 L715 A716 I960 N995 I996	I713-T925 HydrophobicContact CD1-CG2 3.9Å; I713-T925 HydrophobicContact CG1-CG2 4.21Å; I714-T925 PolarHBondContact O-N 3.13Å; L715-T925 HydrophobicContact CD1-CG2 4.17Å; A716-T925 PolarHBondContact N-O 2.84Å; T925-I960 PolarHBondContact OG1-O 3.06Å; T925-N995 PolarHBondContact OG1-ND2 2.9Å; T925-I996 HydrophobicContact CG2-CD1 4.12Å
926	P	95.2	Very high	87	Confident	14 Å²	14	39 Å²	39	9%	0.091	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	136.8	166.2	27.7	-34.2	0	0	0	111.5	V930 V932 I960 F961 N995	P926-V930 HydrophobicContact CB-CB 3.93Å; P926-V930 HydrophobicContact CB-CG1 3.95Å; P926-V932 HydrophobicContact CB-CG2 3.94Å; P926-V932 HydrophobicContact CG-CG2 3.95Å; P926-I960 WeakPolarHBondContact CD-O 3.43Å; P926-F961 HydrophobicContact CG-CD1 4.43Å; P926-N995 PolarHBondContact O-ND2 2.87Å
927	C	93	Very high	87.8	Confident	6 Å²	6	35 Å²	35	4%	0.041	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-61.6	151.3	165.2	179.4	0	0	0	0	110.6	L715 A716 V717 F749 D750 G929 V930	L715-C927 HydrophobicContact CD1-CB 3.79Å; L715-C927 HydrophobicContact CD2-CB 4.41Å; L715-C927 HydrophobicContact CG-CB 4.04Å; A716-C927 VanDerWaalsContact O-CB 3.25Å; A716-C927 WeakPolarHBondContact O-CB 3.26Å; A716-C927 PolarHBondContact O-N 2.9Å; V717-C927 HydrophobicContact CG1-CB 3.93Å; F749-C927 PolarHBondContact O-SG 2.89Å; D750-C927 PolarHBondContact N-SG 3.41Å; D750-C927 VanDerWaalsContact N-SG 3.4Å; C927-G929 PolarHBondContact O-N 3.33Å; C927-V930 HydrophobicContact CB-CG2 4.03Å; C927-V930 VanDerWaalsContact O-CB 3.26Å; C927-V930 WeakPolarHBondContact O-CB 3.16Å; C927-V930 PolarHBondContact O-N 2.91Å
928	Y	86.1	Confident	88.5	Confident	70 Å²	70	35.5 Å²	35.5	28%	0.275	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	136	171.3	-179.8	-94.4	0	0	0	110.8	F749 A990 P991	F749-Y928 HydrophobicContact CB-CD1 4.48Å; F749-Y928 VanDerWaalsContact CB-O 3.28Å; F749-Y928 WeakPolarHBondContact CB-O 3.36Å; F749-Y928 AromaticContact CD1-CD1 3.65Å; F749-Y928 HydrophobicContact CD1-CD1 3.65Å; F749-Y928 HydrophobicContact CD1-CE1 4.28Å; F749-Y928 AromaticContact CD2-CD1 3.86Å; F749-Y928 HydrophobicContact CD2-CD1 3.86Å; F749-Y928 HydrophobicContact CD2-CE1 4.35Å; F749-Y928 WeakPolarHBondContact CD2-O 3.24Å; F749-Y928 AromaticContact CE1-CD1 3.69Å; F749-Y928 HydrophobicContact CE1-CD1 3.69Å; F749-Y928 AromaticContact CE1-CE1 3.83Å; F749-Y928 HydrophobicContact CE1-CE1 3.83Å; F749-Y928 AromaticContact CE2-CD1 3.91Å; F749-Y928 HydrophobicContact CE2-CD1 3.91Å; F749-Y928 AromaticContact CE2-CE1 3.92Å; F749-Y928 HydrophobicContact CE2-CE1 3.92Å; F749-Y928 AromaticContact CG-CD1 3.75Å; F749-Y928 HydrophobicContact CG-CD1 3.75Å; F749-Y928 AromaticContact CZ-CD1 3.83Å; F749-Y928 HydrophobicContact CZ-CD1 3.83Å; F749-Y928 AromaticContact CZ-CE1 3.65Å; F749-Y928 HydrophobicContact CZ-CE1 3.65Å; Y928-A990 HydrophobicContact CE2-CB 3.95Å; Y928-A990 WeakPolarHBondContact OH-CB 3.4Å; Y928-P991 HydrophobicContact CD1-CB 3.85Å; Y928-P991 HydrophobicContact CD2-CB 4.36Å; Y928-P991 HydrophobicContact CE1-CB 3.72Å; Y928-P991 HydrophobicContact CE2-CB 4.26Å; Y928-P991 HydrophobicContact CG-CB 4.17Å
929	G	81.7	Confident	89.1	Confident	48 Å²	48	36.6 Å²	36.6	50%	0.495	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-15.8	-171	0	0	0	0	0	114.9	C927 V931	C927-G929 PolarHBondContact O-N 3.33Å; G929-V931 PolarHBondContact O-N 2.74Å
930	V	90.1	Very high	90.4	Very high	16 Å²	16	33.6 Å²	33.6	10%	0.097	19%	0.193	C	C	.	.			trans	-86.3	105.7	174.5	-179.9	0	0	0	0	109.6	N718 W776 P926 C927 V932	N718-V930 HydrophobicContact CB-CG2 4.35Å; W776-V930 HydrophobicContact CE3-CG1 3.53Å; W776-V930 HydrophobicContact CZ3-CG1 3.8Å; P926-V930 HydrophobicContact CB-CB 3.93Å; P926-V930 HydrophobicContact CB-CG1 3.95Å; C927-V930 HydrophobicContact CB-CG2 4.03Å; C927-V930 VanDerWaalsContact O-CB 3.26Å; C927-V930 WeakPolarHBondContact O-CB 3.16Å; C927-V930 PolarHBondContact O-N 2.91Å; V930-V932 PolarHBondContact O-N 3.49Å
931	V	87.2	Confident	91.5	Very high	101 Å²	101	33 Å²	33	61%	0.612	19%	0.187	S	C	*	.			trans	-86.5	112.3	-176	-176.7	0	0	0	0	111.2	K778 G929	K778-V931 PolarHBondContact NZ-O 3.04Å; G929-V931 PolarHBondContact O-N 2.74Å
932	V	93.1	Very high	91.9	Very high	12 Å²	12	38 Å²	38	7%	0.073	21%	0.211	C	C	.	.			trans	-101.1	122.8	167.4	-168.5	0	0	0	0	107.8	W776 F907 P926 V930 E936 K937 F961	W776-V932 HydrophobicContact CH2-CB 4.5Å; W776-V932 HydrophobicContact CH2-CG1 4.49Å; W776-V932 HydrophobicContact CH2-CG2 4.11Å; W776-V932 HydrophobicContact CZ3-CG2 3.75Å; F907-V932 HydrophobicContact CB-CG1 4Å; F907-V932 HydrophobicContact CD1-CG1 4.01Å; F907-V932 HydrophobicContact CD1-CG2 4.49Å; F907-V932 HydrophobicContact CD2-CG1 4.4Å; F907-V932 HydrophobicContact CD2-CG2 3.85Å; F907-V932 HydrophobicContact CE2-CG2 3.97Å; F907-V932 HydrophobicContact CG-CG1 3.86Å; F907-V932 HydrophobicContact CG-CG2 4.13Å; F907-V932 HydrophobicContact CZ-CG2 4.37Å; P926-V932 HydrophobicContact CB-CG2 3.94Å; P926-V932 HydrophobicContact CG-CG2 3.95Å; V930-V932 PolarHBondContact O-N 3.49Å; V932-E936 WeakPolarHBondContact CA-OE2 3.39Å; V932-E936 HydrophobicContact CG1-CB 3.52Å; V932-K937 HydrophobicContact CB-CG 4.25Å; V932-K937 HydrophobicContact CG1-CG 3.74Å; V932-K937 VanDerWaalsContact O-CE 3.3Å; V932-K937 WeakPolarHBondContact O-CE 3.45Å; V932-F961 HydrophobicContact CG1-CE1 4.26Å
933	T	92.2	Very high	92.1	Very high	59 Å²	59	39 Å²	39	36%	0.362	21%	0.214	S	C	.	.			trans	-71.4	160.2	176	70.2	0	0	0	0	110.8	E935 E936 K937	T933-E935 PolarHBondContact O-N 2.95Å; T933-E936 PolarHBondContact N-OE2 3.41Å; T933-E936 PolarHBondContact O-N 3.41Å; T933-E936 VanDerWaalsContact O-N 3.09Å; T933-E936 WeakPolarHBondContact OG1-CG 3.28Å; T933-E936 PolarHBondContact OG1-N 3.08Å; T933-E936 VanDerWaalsContact OG1-N 3.14Å; T933-E936 PolarHBondContact OG1-OE2 2.89Å; T933-K937 WeakPolarHBondContact O-CG 3.28Å; T933-K937 PolarHBondContact O-N 2.67Å
934	D	90.2	Very high	91.9	Very high	59 Å²	59	38.8 Å²	38.8	32%	0.316	21%	0.213	S	C	.	.	H	α-helix	trans	-64	-30.4	179	-61.2	-50.7	0	0	0	112.5	K937 H938 F972	D934-K937 PolarHBondContact O-N 3Å; D934-K937 WeakPolarHBondContact OD1-CE 3.44Å; D934-K937 IonicContact OD1-NZ 2.87Å; D934-K937 PolarHBondContact OD1-NZ 3.39Å; D934-H938 WeakPolarHBondContact O-CB 3.4Å; D934-H938 PolarHBondContact O-N 2.94Å; D934-F972 HydrophobicContact CB-CD2 4.06Å; D934-F972 HydrophobicContact CB-CE2 4.37Å
935	E	89.8	Confident	91.6	Very high	163 Å²	163	41 Å²	41	76%	0.762	22%	0.223	S	C	*	.	H	α-helix	trans	-62.8	-45.9	169.5	-62.1	172.5	172.1	0	0	111.9	T933 H938 A939	T933-E935 PolarHBondContact O-N 2.95Å; E935-H938 PolarHBondContact O-N 3.14Å; E935-A939 PolarHBondContact O-N 2.91Å
936	E	95	Very high	90.8	Very high	33 Å²	33	43.8 Å²	43.8	15%	0.154	24%	0.24	C	C	.	.	H	α-helix	trans	-66.7	-35.6	176.2	-71.8	170.8	136.2	0	0	112.3	W776 K778 F907 V932 T933 A940	W776-E936 WeakPolarHBondContact CH2-OE1 3.36Å; W776-E936 VanDerWaalsContact CZ2-OE1 3.29Å; W776-E936 WeakPolarHBondContact CZ2-OE1 3.49Å; K778-E936 IonicContact NZ-OE1 3.99Å; K778-E936 PolarHBondContact NZ-OE1 3.18Å; K778-E936 IonicContact NZ-OE2 3.22Å; K778-E936 PolarHBondContact NZ-OE2 2.85Å; F907-E936 HydrophobicContact CB-CB 4.12Å; V932-E936 WeakPolarHBondContact CA-OE2 3.39Å; V932-E936 HydrophobicContact CG1-CB 3.52Å; T933-E936 PolarHBondContact N-OE2 3.41Å; T933-E936 PolarHBondContact O-N 3.41Å; T933-E936 VanDerWaalsContact O-N 3.09Å; T933-E936 WeakPolarHBondContact OG1-CG 3.28Å; T933-E936 PolarHBondContact OG1-N 3.08Å; T933-E936 VanDerWaalsContact OG1-N 3.14Å; T933-E936 PolarHBondContact OG1-OE2 2.89Å; E936-A940 WeakPolarHBondContact O-CB 3.36Å; E936-A940 PolarHBondContact O-N 2.86Å; E936-A940 VanDerWaalsContact O-N 3.13Å
937	K	95.7	Very high	89.5	Confident	17 Å²	17	47.5 Å²	47.5	7%	0.074	26%	0.262	C	S	.	.	H	α-helix	trans	-65.4	-44.8	173.5	-64.5	173.3	-161.5	165.4	0	111	V932 T933 D934 A940 I941 F961 F963 F972	V932-K937 HydrophobicContact CB-CG 4.25Å; V932-K937 HydrophobicContact CG1-CG 3.74Å; V932-K937 VanDerWaalsContact O-CE 3.3Å; V932-K937 WeakPolarHBondContact O-CE 3.45Å; T933-K937 WeakPolarHBondContact O-CG 3.28Å; T933-K937 PolarHBondContact O-N 2.67Å; D934-K937 PolarHBondContact O-N 3Å; D934-K937 WeakPolarHBondContact OD1-CE 3.44Å; D934-K937 IonicContact OD1-NZ 2.87Å; D934-K937 PolarHBondContact OD1-NZ 3.39Å; K937-A940 PolarHBondContact O-N 3.16Å; K937-I941 WeakPolarHBondContact O-CG1 3.46Å; K937-I941 PolarHBondContact O-N 3.26Å; K937-F961 HydrophobicContact CB-CD2 4.1Å; K937-F961 HydrophobicContact CB-CE1 4.38Å; K937-F961 HydrophobicContact CB-CE2 3.87Å; K937-F961 HydrophobicContact CB-CG 4.45Å; K937-F961 HydrophobicContact CB-CZ 4.01Å; K937-F961 HydrophobicContact CD-CB 4.13Å; K937-F961 HydrophobicContact CD-CD1 4.23Å; K937-F961 HydrophobicContact CD-CD2 4.31Å; K937-F961 HydrophobicContact CD-CG 3.98Å; K937-F961 HydrophobicContact CG-CD1 3.78Å; K937-F961 HydrophobicContact CG-CD2 4.04Å; K937-F961 HydrophobicContact CG-CE1 3.84Å; K937-F961 HydrophobicContact CG-CE2 4.1Å; K937-F961 HydrophobicContact CG-CG 3.88Å; K937-F961 HydrophobicContact CG-CZ 4Å; K937-F963 HydrophobicContact CD-CE1 4.29Å; K937-F963 HydrophobicContact CD-CZ 3.79Å; K937-F972 HydrophobicContact CB-CE2 3.65Å; K937-F972 HydrophobicContact CB-CZ 3.53Å; K937-F972 HydrophobicContact CD-CE2 4.17Å; K937-F972 HydrophobicContact CD-CZ 4.14Å; K937-F972 HydrophobicContact CG-CZ 4.48Å
938	H	93.8	Very high	88.1	Confident	50 Å²	50	50.2 Å²	50.2	23%	0.231	28%	0.277	C	S	.	.	H	α-helix	trans	-61.2	-50.7	178.9	-178.9	49.6	0	0	0	111	D934 E935 A940 I941 E942 Q976	D934-H938 WeakPolarHBondContact O-CB 3.4Å; D934-H938 PolarHBondContact O-N 2.94Å; E935-H938 PolarHBondContact O-N 3.14Å; H938-A940 VanDerWaalsContact C-N 3.26Å; H938-A940 PolarHBondContact O-N 3.01Å; H938-I941 CarbonylContact O-C 3.59Å; H938-I941 WeakPolarHBondContact O-CA 3.25Å; H938-I941 PolarHBondContact O-N 2.92Å; H938-E942 PolarHBondContact O-N 3.1Å; H938-Q976 PolarHBondContact ND1-NE2 3.48Å; H938-Q976 PolarHBondContact ND1-OE1 3.21Å
939	A	93.7	Very high	86.5	Confident	36 Å²	36	51.2 Å²	51.2	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-59	-34.8	177.1	0	0	0	0	0	113.1	A908 E935 W943	A908-A939 HydrophobicContact CB-CB 4.35Å; E935-A939 PolarHBondContact O-N 2.91Å; A939-W943 PolarHBondContact O-N 3.39Å
940	A	95.6	Very high	85.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-72.4	-34.2	174	0	0	0	0	0	112.8	F907 A908 E936 K937 H938 W943 L944 L959 F961	F907-A940 HydrophobicContact CD1-CB 3.76Å; F907-A940 HydrophobicContact CE1-CB 4.39Å; A908-A940 HydrophobicContact CB-CB 4.49Å; E936-A940 WeakPolarHBondContact O-CB 3.36Å; E936-A940 PolarHBondContact O-N 2.86Å; E936-A940 VanDerWaalsContact O-N 3.13Å; K937-A940 PolarHBondContact O-N 3.16Å; H938-A940 VanDerWaalsContact C-N 3.26Å; H938-A940 PolarHBondContact O-N 3.01Å; A940-W943 WeakPolarHBondContact O-CB 3.39Å; A940-W943 PolarHBondContact O-N 3.11Å; A940-L944 PolarHBondContact O-N 3.37Å; A940-L959 VanDerWaalsContact C-CD1 3.47Å; A940-L959 HydrophobicContact CB-CD1 3.71Å; A940-L959 VanDerWaalsContact O-CD1 3.31Å; A940-L959 WeakPolarHBondContact O-CD1 3.32Å; A940-F961 HydrophobicContact CB-CZ 4.29Å
941	I	94.2	Very high	83.6	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.7	-39.1	172.8	-67.9	168.2	0	0	0	110.8	K937 H938 L944 Q945 L959 F961 F972 Q976 M979 Y982	K937-I941 WeakPolarHBondContact O-CG1 3.46Å; K937-I941 PolarHBondContact O-N 3.26Å; H938-I941 CarbonylContact O-C 3.59Å; H938-I941 WeakPolarHBondContact O-CA 3.25Å; H938-I941 PolarHBondContact O-N 2.92Å; I941-L944 WeakPolarHBondContact O-CB 3.46Å; I941-L944 PolarHBondContact O-N 2.88Å; I941-L944 VanDerWaalsContact O-N 3.17Å; I941-Q945 WeakPolarHBondContact O-CG 3.1Å; I941-Q945 PolarHBondContact O-N 2.97Å; I941-Q945 VanDerWaalsContact O-N 3.1Å; I941-Q945 PolarHBondContact O-NE2 3.01Å; I941-L959 HydrophobicContact CG1-CD1 4.19Å; I941-F961 HydrophobicContact CD1-CD2 4.49Å; I941-F961 HydrophobicContact CD1-CE2 4.21Å; I941-F961 HydrophobicContact CG1-CE2 4.09Å; I941-F972 HydrophobicContact CD1-CE1 3.77Å; I941-F972 HydrophobicContact CD1-CZ 3.55Å; I941-Q976 HydrophobicContact CD1-CG 3.91Å; I941-M979 HydrophobicContact CB-CE 4.48Å; I941-M979 HydrophobicContact CG2-CB 3.93Å; I941-M979 HydrophobicContact CG2-CE 3.69Å; I941-M979 HydrophobicContact CG2-SD 3.92Å; I941-Y982 HydrophobicContact CB-CD1 4.42Å; I941-Y982 HydrophobicContact CD1-CD1 3.73Å; I941-Y982 HydrophobicContact CD1-CD2 3.67Å; I941-Y982 HydrophobicContact CD1-CE1 4.07Å; I941-Y982 HydrophobicContact CD1-CE2 4.03Å; I941-Y982 HydrophobicContact CD1-CG 3.53Å; I941-Y982 HydrophobicContact CG1-CD1 3.9Å; I941-Y982 HydrophobicContact CG1-CD2 4.46Å; I941-Y982 HydrophobicContact CG1-CG 3.84Å; I941-Y982 HydrophobicContact CG2-CD1 3.61Å; I941-Y982 HydrophobicContact CG2-CE1 3.86Å; I941-Y982 HydrophobicContact CG2-CG 4.42Å
942	E	90.1	Very high	82.8	Confident	107 Å²	107	47 Å²	47	50%	0.5	26%	0.256	S	S	.	.	H	α-helix	trans	-59.9	-46.9	170.6	-69.9	-168.2	118	0	0	111.3	H938 L944 Q945 T946 M979	H938-E942 PolarHBondContact O-N 3.1Å; E942-L944 VanDerWaalsContact C-N 3.25Å; E942-L944 PolarHBondContact O-N 2.92Å; E942-Q945 WeakPolarHBondContact O-CA 3.35Å; E942-Q945 PolarHBondContact O-N 2.7Å; E942-T946 PolarHBondContact O-N 2.86Å; E942-M979 HydrophobicContact CG-CE 4.49Å; E942-M979 HydrophobicContact CG-SD 4.39Å
943	W	92.7	Very high	82.2	Confident	23 Å²	23	47.1 Å²	47.1	9%	0.087	26%	0.255	C	S	.	.	H	α-helix	trans	-54.4	-42.1	171.7	166.9	84.5	0	0	0	111.7	A908 C911 D912 Y915 I924 A939 A940 Q945 T946 Y953 L959	A908-W943 HydrophobicContact CB-CB 4.32Å; C911-W943 HydrophobicContact CB-CD2 3.99Å; C911-W943 HydrophobicContact CB-CE3 3.66Å; C911-W943 HydrophobicContact CB-CH2 3.91Å; C911-W943 HydrophobicContact CB-CZ2 4.2Å; C911-W943 HydrophobicContact CB-CZ3 3.62Å; D912-W943 VanDerWaalsContact CB-NE1 3.35Å; D912-W943 PolarHBondContact OD1-NE1 3.34Å; Y915-W943 HydrophobicContact CD1-CZ2 4.24Å; Y915-W943 HydrophobicContact CD2-CH2 4.33Å; Y915-W943 HydrophobicContact CG-CH2 4.09Å; Y915-W943 AromaticContact CG-CZ2 3.94Å; Y915-W943 HydrophobicContact CG-CZ2 3.94Å; I924-W943 HydrophobicContact CD1-CH2 4.25Å; I924-W943 HydrophobicContact CD1-CZ3 4.34Å; A939-W943 PolarHBondContact O-N 3.39Å; A940-W943 WeakPolarHBondContact O-CB 3.39Å; A940-W943 PolarHBondContact O-N 3.11Å; W943-Q945 PolarHBondContact O-N 3.38Å; W943-T946 WeakPolarHBondContact O-CB 3.05Å; W943-T946 PolarHBondContact O-N 2.89Å; W943-T946 PolarHBondContact O-OG1 3.31Å; W943-Y953 HydrophobicContact CD2-CD2 4.28Å; W943-Y953 AromaticContact CE2-CD2 3.6Å; W943-Y953 AromaticContact CE2-CE2 3.86Å; W943-Y953 HydrophobicContact CH2-CD2 4.27Å; W943-Y953 AromaticContact CZ2-CD2 3.6Å; W943-Y953 HydrophobicContact CZ2-CD2 3.6Å; W943-Y953 AromaticContact CZ2-CE2 3.94Å; W943-Y953 HydrophobicContact CZ2-CE2 3.94Å; W943-Y953 HydrophobicContact CZ2-CG 4.49Å; W943-Y953 AromaticContact NE1-CD2 3.77Å; W943-Y953 AromaticContact NE1-CE2 3.61Å; W943-L959 HydrophobicContact CZ3-CD2 4.33Å
944	L	90.1	Very high	81.6	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.9	-21.8	177.4	-161	79.1	0	0	0	113	A940 I941 E942 T946 N954 A957 L959 G981	A940-L944 PolarHBondContact O-N 3.37Å; I941-L944 WeakPolarHBondContact O-CB 3.46Å; I941-L944 PolarHBondContact O-N 2.88Å; I941-L944 VanDerWaalsContact O-N 3.17Å; E942-L944 VanDerWaalsContact C-N 3.25Å; E942-L944 PolarHBondContact O-N 2.92Å; L944-T946 VanDerWaalsContact C-N 3.29Å; L944-N954 HydrophobicContact CD2-CB 3.89Å; L944-N954 HydrophobicContact CG-CB 3.86Å; L944-N954 WeakPolarHBondContact O-CB 3.21Å; L944-N954 PolarHBondContact O-N 3.05Å; L944-A957 HydrophobicContact CD1-CB 4.1Å; L944-L959 HydrophobicContact CB-CD1 4.34Å; L944-L959 HydrophobicContact CD1-CG 4.32Å; L944-L959 HydrophobicContact CD2-CG 4.2Å; L944-G981 WeakPolarHBondContact CD2-O 3.12Å
945	Q	87.9	Confident	80.9	Confident	46 Å²	46	42.3 Å²	42.3	22%	0.215	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	0.2	170.9	-47.6	-36.2	-74.7	0	0	113.1	I941 E942 W943 V947 T952 N954 M979 T980	I941-Q945 WeakPolarHBondContact O-CG 3.1Å; I941-Q945 PolarHBondContact O-N 2.97Å; I941-Q945 VanDerWaalsContact O-N 3.1Å; I941-Q945 PolarHBondContact O-NE2 3.01Å; E942-Q945 WeakPolarHBondContact O-CA 3.35Å; E942-Q945 PolarHBondContact O-N 2.7Å; W943-Q945 PolarHBondContact O-N 3.38Å; Q945-V947 PolarHBondContact O-N 3.03Å; Q945-T952 WeakPolarHBondContact O-CG2 3.36Å; Q945-N954 PolarHBondContact OE1-ND2 2.86Å; Q945-M979 HydrophobicContact CG-CB 4.16Å; Q945-M979 HydrophobicContact CG-CG 3.89Å; Q945-M979 HydrophobicContact CG-SD 3.6Å; Q945-T980 PolarHBondContact NE2-O 2.78Å; Q945-T980 PolarHBondContact OE1-O 3.48Å
946	T	80.7	Confident	80.3	Confident	59 Å²	59	35.2 Å²	35.2	36%	0.362	20%	0.196	S	C	.	.			trans	-59.4	128.9	177.3	-58.5	0	0	0	0	110.3	E942 W943 L944 T952 Y953	E942-T946 PolarHBondContact O-N 2.86Å; W943-T946 WeakPolarHBondContact O-CB 3.05Å; W943-T946 PolarHBondContact O-N 2.89Å; W943-T946 PolarHBondContact O-OG1 3.31Å; L944-T946 VanDerWaalsContact C-N 3.29Å; T946-T952 WeakPolarHBondContact O-CA 3.46Å; T946-Y953 HydrophobicContact CG2-CE2 4.4Å; T946-Y953 PolarHBondContact O-N 3.39Å
947	V	67.9	Low	80	Confident	92 Å²	92	33.6 Å²	33.6	56%	0.558	19%	0.189	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	104.9	173.3	-176.9	0	0	0	0	108.8	Q945 Q951 T952	Q945-V947 PolarHBondContact O-N 3.03Å; V947-Q951 CarbonylContact C-O 3.49Å; V947-Q951 WeakPolarHBondContact CA-O 3.42Å; V947-T952 HydrophobicContact CG2-CG2 4.35Å
948	N	62.1	Low	79.8	Confident	64 Å²	64	32.9 Å²	32.9	34%	0.342	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.6	176	-165.2	7.8	0	0	0	109.5	G950 Q951 Y953	N948-G950 PolarHBondContact O-N 3.02Å; N948-Q951 PolarHBondContact N-O 3.38Å; N948-Q951 PolarHBondContact O-N 3.34Å; N948-Q951 VanDerWaalsContact O-O 3.13Å; N948-Y953 HydrophobicContact CB-CE1 3.64Å; N948-Y953 PolarHBondContact ND2-OH 3.41Å
949	D	53.4	Low	79.8	Confident	91 Å²	91	30.5 Å²	30.5	49%	0.487	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	20.8	-172	-60.8	-33.2	0	0	0	115.5	S688 P690	S688-D949 WeakPolarHBondContact CB-O 3.05Å; S688-D949 PolarHBondContact OG-O 2.68Å; P690-D949 HydrophobicContact CB-CB 4.09Å; P690-D949 WeakPolarHBondContact CB-OD2 3.04Å
950	G	54	Low	79.8	Confident	26 Å²	26	28.8 Å²	28.8	27%	0.268	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.8	-11.7	-176.1	0	0	0	0	0	115.6	I686 N948	I686-G950 WeakPolarHBondContact CB-O 3.49Å; I686-G950 WeakPolarHBondContact CG2-O 3.37Å; N948-G950 PolarHBondContact O-N 3.02Å
951	Q	57.3	Low	79.7	Confident	13 Å²	13	28.8 Å²	28.8	6%	0.061	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	149.1	165.1	-69.5	-153.5	-12.6	0	0	110.6	S688 V947 N948 Q1098	S688-Q951 PolarHBondContact O-NE2 3.36Å; V947-Q951 CarbonylContact C-O 3.49Å; V947-Q951 WeakPolarHBondContact CA-O 3.42Å; N948-Q951 PolarHBondContact N-O 3.38Å; N948-Q951 PolarHBondContact O-N 3.34Å; N948-Q951 VanDerWaalsContact O-O 3.13Å; Q951-Q1098 VanDerWaalsContact NE2-NE2 3.14Å
952	T	69	Low	79.5	Confident	36 Å²	36	30.4 Å²	30.4	22%	0.221	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.3	170.4	-42.3	0	0	0	0	109.7	Q945 T946 V947 N954 T955	Q945-T952 WeakPolarHBondContact O-CG2 3.36Å; T946-T952 WeakPolarHBondContact O-CA 3.46Å; V947-T952 HydrophobicContact CG2-CG2 4.35Å; T952-N954 HydrophobicContact CG2-CB 4.5Å; T952-N954 VanDerWaalsContact CG2-ND2 3.33Å; T952-N954 WeakPolarHBondContact CG2-ND2 3.39Å; T952-N954 PolarHBondContact O-N 3.26Å; T952-T955 PolarHBondContact O-N 3.33Å; T952-T955 PolarHBondContact O-OG1 2.98Å
953	Y	81.3	Confident	79.5	Confident	16 Å²	16	25.7 Å²	25.7	6%	0.063	15%	0.148	C	C	.	.	H	α-helix	trans	-57.8	-24.8	-176.5	-67.7	-15.7	0	0	0	113.7	Y915 W943 T946 N948 T955 A956 A957	Y915-Y953 HydrophobicContact CD1-CE1 4.29Å; Y915-Y953 HydrophobicContact CD1-CE2 4.32Å; Y915-Y953 AromaticContact CE1-CD1 3.72Å; Y915-Y953 HydrophobicContact CE1-CD1 3.72Å; Y915-Y953 HydrophobicContact CE1-CD2 4.49Å; Y915-Y953 AromaticContact CE1-CE1 3.47Å; Y915-Y953 HydrophobicContact CE1-CE1 3.47Å; Y915-Y953 VanDerWaalsContact CE1-CE1 3.47Å; Y915-Y953 HydrophobicContact CE1-CE2 4.27Å; Y915-Y953 HydrophobicContact CE1-CG 4.23Å; Y915-Y953 AromaticContact CE1-CZ 3.76Å; Y915-Y953 AromaticContact CZ-CD1 3.82Å; W943-Y953 HydrophobicContact CD2-CD2 4.28Å; W943-Y953 AromaticContact CE2-CD2 3.6Å; W943-Y953 AromaticContact CE2-CE2 3.86Å; W943-Y953 HydrophobicContact CH2-CD2 4.27Å; W943-Y953 AromaticContact CZ2-CD2 3.6Å; W943-Y953 HydrophobicContact CZ2-CD2 3.6Å; W943-Y953 AromaticContact CZ2-CE2 3.94Å; W943-Y953 HydrophobicContact CZ2-CE2 3.94Å; W943-Y953 HydrophobicContact CZ2-CG 4.49Å; W943-Y953 AromaticContact NE1-CD2 3.77Å; W943-Y953 AromaticContact NE1-CE2 3.61Å; T946-Y953 HydrophobicContact CG2-CE2 4.4Å; T946-Y953 PolarHBondContact O-N 3.39Å; N948-Y953 HydrophobicContact CB-CE1 3.64Å; N948-Y953 PolarHBondContact ND2-OH 3.41Å; Y953-T955 PolarHBondContact O-N 3.21Å; Y953-A956 PolarHBondContact O-N 3.04Å; Y953-A957 PolarHBondContact O-N 3.03Å
954	N	79.8	Confident	79.2	Confident	10 Å²	10	28.4 Å²	28.4	5%	0.053	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-5.8	171.5	70.1	32.7	0	0	0	116	L944 Q945 T952 T980 F1081 Q1087	L944-N954 HydrophobicContact CD2-CB 3.89Å; L944-N954 HydrophobicContact CG-CB 3.86Å; L944-N954 WeakPolarHBondContact O-CB 3.21Å; L944-N954 PolarHBondContact O-N 3.05Å; Q945-N954 PolarHBondContact OE1-ND2 2.86Å; T952-N954 HydrophobicContact CG2-CB 4.5Å; T952-N954 VanDerWaalsContact CG2-ND2 3.33Å; T952-N954 WeakPolarHBondContact CG2-ND2 3.39Å; T952-N954 PolarHBondContact O-N 3.26Å; N954-T980 HydrophobicContact CB-CG2 4.34Å; N954-T980 VanDerWaalsContact ND2-CG2 3.32Å; N954-T980 WeakPolarHBondContact ND2-CG2 3.29Å; N954-F1081 WeakPolarHBondContact O-CE2 3.22Å; N954-F1081 VanDerWaalsContact O-CZ 3.29Å; N954-F1081 WeakPolarHBondContact O-CZ 3.34Å; N954-Q1087 PolarHBondContact O-NE2 2.89Å
955	T	74.1	Confident	78.9	Confident	7 Å²	7	31.6 Å²	31.6	4%	0.043	18%	0.182	C	C	.	.	H	α-helix	trans	-96	-33.2	167.8	82.4	0	0	0	0	112.9	K685 T952 Y953 F1081 S1091 E1094	K685-T955 HydrophobicContact CD-CG2 4.17Å; K685-T955 VanDerWaalsContact NZ-CG2 3.3Å; T952-T955 PolarHBondContact O-N 3.33Å; T952-T955 PolarHBondContact O-OG1 2.98Å; Y953-T955 PolarHBondContact O-N 3.21Å; T955-F1081 HydrophobicContact CG2-CZ 4.46Å; T955-S1091 WeakPolarHBondContact O-CB 3.25Å; T955-S1091 PolarHBondContact O-OG 3.17Å; T955-E1094 WeakPolarHBondContact CB-OE2 3.24Å; T955-E1094 PolarHBondContact OG1-OE2 2.94Å
956	A	77.2	Confident	78.7	Confident	13 Å²	13	30.6 Å²	30.6	11%	0.107	18%	0.178	C	C	.	.	H	α-helix	trans	-83.9	-34.1	-179.9	0	0	0	0	0	113	Y915 F922 Y953	Y915-A956 HydrophobicContact CE2-CB 3.81Å; Y915-A956 VanDerWaalsContact OH-CB 3.27Å; Y915-A956 WeakPolarHBondContact OH-CB 3.21Å; F922-A956 WeakPolarHBondContact CD2-O 3.28Å; Y953-A956 PolarHBondContact O-N 3.04Å
957	A	88.4	Confident	78.9	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.194	C	C	.	.			trans	-133.8	164.4	-176.4	0	0	0	0	0	112.6	Y915 F922 L944 Y953 Q1087	Y915-A957 HydrophobicContact CD2-CB 4.13Å; Y915-A957 HydrophobicContact CE2-CB 4.17Å; F922-A957 CarbonylContact O-C 3.52Å; F922-A957 WeakPolarHBondContact O-CA 3.32Å; L944-A957 HydrophobicContact CD1-CB 4.1Å; Y953-A957 PolarHBondContact O-N 3.03Å; A957-Q1087 PolarHBondContact O-NE2 2.67Å; A957-Q1087 VanDerWaalsContact O-NE2 3.1Å
958	K	91.8	Very high	80	Confident	1 Å²	1	33.5 Å²	33.5	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	135	-178.8	-172.9	-167.3	74.9	152.5	0	110.4	F922 I924 I960 G981 V983 D998 M1077 E1084 Q1087	F922-K958 HydrophobicContact CD1-CB 4.32Å; F922-K958 HydrophobicContact CE1-CB 3.82Å; F922-K958 HydrophobicContact CE1-CD 3.93Å; F922-K958 HydrophobicContact CE1-CG 4.49Å; F922-K958 HydrophobicContact CE2-CB 4.37Å; F922-K958 HydrophobicContact CZ-CB 3.85Å; F922-K958 HydrophobicContact CZ-CD 4.32Å; F922-K958 PolarHBondContact O-N 3.45Å; I924-K958 PolarHBondContact N-O 3.29Å; K958-I960 VanDerWaalsContact CE-CG1 3.49Å; K958-G981 VanDerWaalsContact CA-O 3.26Å; K958-G981 WeakPolarHBondContact CA-O 3.48Å; K958-G981 VanDerWaalsContact CG-O 3.28Å; K958-G981 WeakPolarHBondContact CG-O 3.25Å; K958-V983 HydrophobicContact CD-CG2 3.82Å; K958-V983 HydrophobicContact CG-CG2 4.37Å; K958-D998 IonicContact NZ-OD1 2.87Å; K958-D998 PolarHBondContact NZ-OD1 3.37Å; K958-D998 IonicContact NZ-OD2 2.71Å; K958-M1077 HydrophobicContact CD-SD 4.39Å; K958-E1084 HydrophobicContact CD-CG 4.02Å; K958-E1084 VanDerWaalsContact NZ-CD 3.27Å; K958-E1084 IonicContact NZ-OE1 3.59Å; K958-E1084 PolarHBondContact NZ-OE1 2.95Å; K958-E1084 IonicContact NZ-OE2 3.29Å; K958-Q1087 VanDerWaalsContact CG-OE1 3.23Å
959	L	94.4	Very high	81.4	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	141	173.9	-57.3	-176.4	0	0	0	111.2	I924 A940 I941 W943 L944 F961 G981 Y982 V983	I924-L959 HydrophobicContact CB-CD2 3.83Å; I924-L959 HydrophobicContact CD1-CD2 4.09Å; I924-L959 HydrophobicContact CG1-CD2 4.43Å; I924-L959 HydrophobicContact CG2-CD2 4.25Å; A940-L959 VanDerWaalsContact C-CD1 3.47Å; A940-L959 HydrophobicContact CB-CD1 3.71Å; A940-L959 VanDerWaalsContact O-CD1 3.31Å; A940-L959 WeakPolarHBondContact O-CD1 3.32Å; I941-L959 HydrophobicContact CG1-CD1 4.19Å; W943-L959 HydrophobicContact CZ3-CD2 4.33Å; L944-L959 HydrophobicContact CB-CD1 4.34Å; L944-L959 HydrophobicContact CD1-CG 4.32Å; L944-L959 HydrophobicContact CD2-CG 4.2Å; L959-F961 HydrophobicContact CB-CE2 3.9Å; L959-F961 HydrophobicContact CB-CZ 4.19Å; L959-F961 HydrophobicContact CD1-CE2 4.01Å; L959-F961 HydrophobicContact CD1-CZ 4.03Å; L959-G981 PolarHBondContact N-O 3.36Å; L959-Y982 CarbonylContact O-C 3.52Å; L959-Y982 VanDerWaalsContact O-CA 3.24Å; L959-Y982 WeakPolarHBondContact O-CA 3.36Å; L959-V983 PolarHBondContact O-N 2.76Å
960	I	93.5	Very high	83.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	118.9	178.4	-47.6	152.9	0	0	0	109.5	A923 I924 T925 P926 K958 V983 V985 N995 D998 A999	A923-I960 HydrophobicContact CB-CD1 3.76Å; I924-I960 PolarHBondContact O-N 3.04Å; T925-I960 PolarHBondContact OG1-O 3.06Å; P926-I960 WeakPolarHBondContact CD-O 3.43Å; K958-I960 VanDerWaalsContact CE-CG1 3.49Å; I960-V983 HydrophobicContact CG2-CB 4.4Å; I960-V985 HydrophobicContact CG2-CG2 3.66Å; I960-N995 HydrophobicContact CG2-CB 3.68Å; I960-D998 WeakPolarHBondContact CD1-OD1 3.34Å; I960-D998 VanDerWaalsContact CG1-OD1 3.26Å; I960-D998 WeakPolarHBondContact CG1-OD1 3.49Å; I960-D998 HydrophobicContact CG2-CB 4.5Å; I960-A999 HydrophobicContact CD1-CB 3.9Å
961	F	93.1	Very high	84.7	Confident	1 Å²	1	30.3 Å²	30.3	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.5	-178.1	-63.4	-58.5	0	0	0	112.3	F907 P926 V932 K937 A940 I941 L959 F963 V983 V985	F907-F961 HydrophobicContact CD1-CE1 4.03Å; F907-F961 HydrophobicContact CD1-CZ 4.09Å; F907-F961 AromaticContact CE1-CE1 3.53Å; F907-F961 HydrophobicContact CE1-CE1 3.53Å; F907-F961 AromaticContact CE1-CZ 3.76Å; F907-F961 HydrophobicContact CE1-CZ 3.76Å; F907-F961 HydrophobicContact CZ-CE1 4.24Å; P926-F961 HydrophobicContact CG-CD1 4.43Å; V932-F961 HydrophobicContact CG1-CE1 4.26Å; K937-F961 HydrophobicContact CB-CD2 4.1Å; K937-F961 HydrophobicContact CB-CE1 4.38Å; K937-F961 HydrophobicContact CB-CE2 3.87Å; K937-F961 HydrophobicContact CB-CG 4.45Å; K937-F961 HydrophobicContact CB-CZ 4.01Å; K937-F961 HydrophobicContact CD-CB 4.13Å; K937-F961 HydrophobicContact CD-CD1 4.23Å; K937-F961 HydrophobicContact CD-CD2 4.31Å; K937-F961 HydrophobicContact CD-CG 3.98Å; K937-F961 HydrophobicContact CG-CD1 3.78Å; K937-F961 HydrophobicContact CG-CD2 4.04Å; K937-F961 HydrophobicContact CG-CE1 3.84Å; K937-F961 HydrophobicContact CG-CE2 4.1Å; K937-F961 HydrophobicContact CG-CG 3.88Å; K937-F961 HydrophobicContact CG-CZ 4Å; A940-F961 HydrophobicContact CB-CZ 4.29Å; I941-F961 HydrophobicContact CD1-CD2 4.49Å; I941-F961 HydrophobicContact CD1-CE2 4.21Å; I941-F961 HydrophobicContact CG1-CE2 4.09Å; L959-F961 HydrophobicContact CB-CE2 3.9Å; L959-F961 HydrophobicContact CB-CZ 4.19Å; L959-F961 HydrophobicContact CD1-CE2 4.01Å; L959-F961 HydrophobicContact CD1-CZ 4.03Å; F961-F963 HydrophobicContact CB-CE2 3.83Å; F961-F963 HydrophobicContact CB-CZ 4.44Å; F961-F963 WeakPolarHBondContact O-CD2 3.31Å; F961-V983 PolarHBondContact N-O 3.1Å; F961-V985 PolarHBondContact O-N 3.48Å
962	T	90.8	Very high	86.4	Confident	34 Å²	34	29.9 Å²	29.9	21%	0.209	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	141	177.8	-50.7	0	0	0	0	111.6	V985 T992	T962-V985 CarbonylContact C-O 3.5Å; T962-V985 WeakPolarHBondContact CA-O 3.45Å; T962-V985 HydrophobicContact CG2-CG1 4.48Å; T962-T992 HydrophobicContact CG2-CG2 3.73Å
963	F	89.9	Confident	87.3	Confident	7 Å²	7	29.1 Å²	29.1	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137.1	175.5	-63.8	-99.7	0	0	0	110.4	K937 F961 T968 L969 F972 C984 V985 Y986 S987	K937-F963 HydrophobicContact CD-CE1 4.29Å; K937-F963 HydrophobicContact CD-CZ 3.79Å; F961-F963 HydrophobicContact CB-CE2 3.83Å; F961-F963 HydrophobicContact CB-CZ 4.44Å; F961-F963 WeakPolarHBondContact O-CD2 3.31Å; F963-T968 HydrophobicContact CD1-CG2 4.18Å; F963-L969 HydrophobicContact CB-CB 4.01Å; F963-L969 HydrophobicContact CB-CD1 4.06Å; F963-L969 HydrophobicContact CB-CG 4.48Å; F963-L969 HydrophobicContact CD1-CB 4.22Å; F963-L969 HydrophobicContact CD2-CD1 4.12Å; F963-L969 HydrophobicContact CD2-CG 4.35Å; F963-L969 HydrophobicContact CG-CB 4.03Å; F963-L969 HydrophobicContact CG-CD1 4.23Å; F963-L969 HydrophobicContact CG-CG 4.32Å; F963-F972 HydrophobicContact CE1-CB 3.99Å; F963-F972 HydrophobicContact CE1-CD1 4.11Å; F963-F972 AromaticContact CE1-CG 3.95Å; F963-F972 HydrophobicContact CE1-CG 3.95Å; F963-F972 HydrophobicContact CE2-CD1 4.24Å; F963-F972 HydrophobicContact CE2-CE1 4.49Å; F963-F972 HydrophobicContact CZ-CB 4.2Å; F963-F972 AromaticContact CZ-CD1 3.44Å; F963-F972 HydrophobicContact CZ-CD1 3.44Å; F963-F972 VanDerWaalsContact CZ-CD1 3.44Å; F963-F972 HydrophobicContact CZ-CD2 4.35Å; F963-F972 AromaticContact CZ-CE1 3.82Å; F963-F972 HydrophobicContact CZ-CE1 3.82Å; F963-F972 AromaticContact CZ-CG 3.73Å; F963-F972 HydrophobicContact CZ-CG 3.73Å; F963-F972 HydrophobicContact CZ-CZ 4.42Å; F963-C984 HydrophobicContact CD2-CB 4.16Å; F963-C984 HydrophobicContact CE2-CB 4Å; F963-V985 PolarHBondContact N-O 2.92Å; F963-Y986 WeakPolarHBondContact O-CA 3.47Å; F963-S987 PolarHBondContact O-N 3.39Å
964	N	85.4	Confident	87.5	Confident	81 Å²	81	36 Å²	36	43%	0.433	19%	0.191	S	C	.	.	S	Bend	trans	-103.5	-1.6	-177.2	-56.4	11.4	0	0	0	113.2	S987	N964-S987 VanDerWaalsContact CA-O 3.32Å; N964-S987 WeakPolarHBondContact CA-O 3.32Å
965	D	84.2	Confident	87.9	Confident	66 Å²	66	41.2 Å²	41.2	35%	0.353	22%	0.215	S	C	.	.			trans	-135.5	135.5	176.8	163.2	51.9	0	0	0	110.2	Q967 T968 L969	D965-Q967 PolarHBondContact OD1-N 3.44Å; D965-Q967 VanDerWaalsContact OD1-N 3.11Å; D965-Q967 WeakPolarHBondContact OD2-CB 3.4Å; D965-Q967 PolarHBondContact OD2-N 2.61Å; D965-T968 WeakPolarHBondContact OD2-CB 3.41Å; D965-T968 PolarHBondContact OD2-N 3.02Å; D965-T968 PolarHBondContact OD2-OG1 3.29Å; D965-L969 PolarHBondContact O-N 2.72Å; D965-L969 VanDerWaalsContact O-N 3.16Å
966	L	84	Confident	88.5	Confident	26 Å²	26	41 Å²	41	14%	0.136	21%	0.213	C	C	.	.	H	α-helix	trans	-70	-34.8	-179.5	177.7	64.2	0	0	0	111.9	L969 Q970 Y986 M1047 A1050 L1051	L966-L969 PolarHBondContact O-N 2.9Å; L966-Q970 HydrophobicContact CD1-CG 4.01Å; L966-Q970 HydrophobicContact CG-CG 4.28Å; L966-Q970 VanDerWaalsContact O-CB 3.26Å; L966-Q970 WeakPolarHBondContact O-CB 3.32Å; L966-Q970 VanDerWaalsContact O-CG 3.28Å; L966-Q970 WeakPolarHBondContact O-CG 3.43Å; L966-Q970 PolarHBondContact O-N 3.29Å; L966-Y986 HydrophobicContact CB-CE2 4.29Å; L966-M1047 HydrophobicContact CD2-SD 3.74Å; L966-A1050 HydrophobicContact CD2-CB 3.92Å; L966-L1051 HydrophobicContact CD1-CD2 3.71Å; L966-L1051 HydrophobicContact CD1-CG 4.19Å
967	Q	86.1	Confident	88.8	Confident	152 Å²	152	42.4 Å²	42.4	71%	0.71	23%	0.229	S	C	*	.	H	α-helix	trans	-68.5	-40.9	-178.5	-59.9	-170.3	5.3	0	0	111.2	D965 Q970 A971	D965-Q967 PolarHBondContact OD1-N 3.44Å; D965-Q967 VanDerWaalsContact OD1-N 3.11Å; D965-Q967 WeakPolarHBondContact OD2-CB 3.4Å; D965-Q967 PolarHBondContact OD2-N 2.61Å; Q967-Q970 PolarHBondContact O-N 3.17Å; Q967-A971 WeakPolarHBondContact O-CB 3.31Å; Q967-A971 PolarHBondContact O-N 3.43Å
968	T	89.6	Confident	88.5	Confident	60 Å²	60	47.8 Å²	47.8	37%	0.368	26%	0.258	S	S	.	.	H	α-helix	trans	-62	-48.6	173.9	-53.7	0	0	0	0	110.7	F963 D965 Q970 A971 F972	F963-T968 HydrophobicContact CD1-CG2 4.18Å; D965-T968 WeakPolarHBondContact OD2-CB 3.41Å; D965-T968 PolarHBondContact OD2-N 3.02Å; D965-T968 PolarHBondContact OD2-OG1 3.29Å; T968-Q970 VanDerWaalsContact C-N 3.31Å; T968-Q970 PolarHBondContact O-N 3.12Å; T968-A971 PolarHBondContact O-N 3.46Å; T968-F972 WeakPolarHBondContact O-CB 3.18Å; T968-F972 PolarHBondContact O-N 2.98Å
969	L	91.3	Very high	88.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-42.4	174.3	-175	154.2	0	0	0	111.8	F963 D965 L966 F972 Q973 C984 A1056	F963-L969 HydrophobicContact CB-CB 4.01Å; F963-L969 HydrophobicContact CB-CD1 4.06Å; F963-L969 HydrophobicContact CB-CG 4.48Å; F963-L969 HydrophobicContact CD1-CB 4.22Å; F963-L969 HydrophobicContact CD2-CD1 4.12Å; F963-L969 HydrophobicContact CD2-CG 4.35Å; F963-L969 HydrophobicContact CG-CB 4.03Å; F963-L969 HydrophobicContact CG-CD1 4.23Å; F963-L969 HydrophobicContact CG-CG 4.32Å; D965-L969 PolarHBondContact O-N 2.72Å; D965-L969 VanDerWaalsContact O-N 3.16Å; L966-L969 PolarHBondContact O-N 2.9Å; L969-F972 PolarHBondContact O-N 3.17Å; L969-Q973 HydrophobicContact CD2-CG 3.95Å; L969-Q973 WeakPolarHBondContact O-CB 3.37Å; L969-Q973 WeakPolarHBondContact O-CG 3.25Å; L969-Q973 PolarHBondContact O-N 2.98Å; L969-C984 HydrophobicContact CD1-CB 3.85Å; L969-C984 HydrophobicContact CG-CB 4.11Å; L969-A1056 HydrophobicContact CD1-CB 3.71Å; L969-A1056 HydrophobicContact CD2-CB 3.97Å
970	Q	89.4	Confident	87.9	Confident	54 Å²	54	50.1 Å²	50.1	25%	0.252	27%	0.27	S	S	.	.	H	α-helix	trans	-71.7	-27.6	179.4	-80.3	-177.7	-5.6	0	0	114.3	L966 Q967 T968 K974 S1054	L966-Q970 HydrophobicContact CD1-CG 4.01Å; L966-Q970 HydrophobicContact CG-CG 4.28Å; L966-Q970 VanDerWaalsContact O-CB 3.26Å; L966-Q970 WeakPolarHBondContact O-CB 3.32Å; L966-Q970 VanDerWaalsContact O-CG 3.28Å; L966-Q970 WeakPolarHBondContact O-CG 3.43Å; L966-Q970 PolarHBondContact O-N 3.29Å; Q967-Q970 PolarHBondContact O-N 3.17Å; T968-Q970 VanDerWaalsContact C-N 3.31Å; T968-Q970 PolarHBondContact O-N 3.12Å; Q970-K974 VanDerWaalsContact O-CD 3.23Å; Q970-K974 WeakPolarHBondContact O-CD 3.32Å; Q970-K974 WeakPolarHBondContact O-CE 3.41Å; Q970-K974 VanDerWaalsContact O-CG 3.27Å; Q970-K974 WeakPolarHBondContact O-CG 3.14Å; Q970-S1054 WeakPolarHBondContact CG-OG 3.46Å; Q970-S1054 PolarHBondContact NE2-OG 2.97Å
971	A	88.2	Confident	87.7	Confident	60 Å²	60	50.1 Å²	50.1	50%	0.496	27%	0.27	S	S	.	.	H	α-helix	trans	-71.4	-52.7	170.6	0	0	0	0	0	109.5	Q967 T968 Q973 K974 E975	Q967-A971 WeakPolarHBondContact O-CB 3.31Å; Q967-A971 PolarHBondContact O-N 3.43Å; T968-A971 PolarHBondContact O-N 3.46Å; A971-Q973 PolarHBondContact O-N 3.02Å; A971-K974 WeakPolarHBondContact O-CB 3.09Å; A971-K974 PolarHBondContact O-N 3.38Å; A971-E975 PolarHBondContact O-N 3.2Å; A971-E975 VanDerWaalsContact O-N 3.1Å
972	F	92.3	Very high	87.6	Confident	3 Å²	3	50.1 Å²	50.1	1%	0.013	27%	0.27	C	S	.	.	H	α-helix	trans	-55.8	-48	179.1	-175.3	-100.2	0	0	0	112.5	D934 K937 I941 F963 T968 L969 K974 E975 Q976 Y982	D934-F972 HydrophobicContact CB-CD2 4.06Å; D934-F972 HydrophobicContact CB-CE2 4.37Å; K937-F972 HydrophobicContact CB-CE2 3.65Å; K937-F972 HydrophobicContact CB-CZ 3.53Å; K937-F972 HydrophobicContact CD-CE2 4.17Å; K937-F972 HydrophobicContact CD-CZ 4.14Å; K937-F972 HydrophobicContact CG-CZ 4.48Å; I941-F972 HydrophobicContact CD1-CE1 3.77Å; I941-F972 HydrophobicContact CD1-CZ 3.55Å; F963-F972 HydrophobicContact CE1-CB 3.99Å; F963-F972 HydrophobicContact CE1-CD1 4.11Å; F963-F972 AromaticContact CE1-CG 3.95Å; F963-F972 HydrophobicContact CE1-CG 3.95Å; F963-F972 HydrophobicContact CE2-CD1 4.24Å; F963-F972 HydrophobicContact CE2-CE1 4.49Å; F963-F972 HydrophobicContact CZ-CB 4.2Å; F963-F972 AromaticContact CZ-CD1 3.44Å; F963-F972 HydrophobicContact CZ-CD1 3.44Å; F963-F972 VanDerWaalsContact CZ-CD1 3.44Å; F963-F972 HydrophobicContact CZ-CD2 4.35Å; F963-F972 AromaticContact CZ-CE1 3.82Å; F963-F972 HydrophobicContact CZ-CE1 3.82Å; F963-F972 AromaticContact CZ-CG 3.73Å; F963-F972 HydrophobicContact CZ-CG 3.73Å; F963-F972 HydrophobicContact CZ-CZ 4.42Å; T968-F972 WeakPolarHBondContact O-CB 3.18Å; T968-F972 PolarHBondContact O-N 2.98Å; L969-F972 PolarHBondContact O-N 3.17Å; F972-K974 PolarHBondContact O-N 2.86Å; F972-E975 WeakPolarHBondContact O-CB 3.17Å; F972-E975 PolarHBondContact O-N 3.26Å; F972-E975 VanDerWaalsContact O-N 3.1Å; F972-Q976 HydrophobicContact CD1-CG 4.01Å; F972-Q976 HydrophobicContact CE1-CG 3.66Å; F972-Q976 HydrophobicContact CE2-CG 4.36Å; F972-Q976 VanDerWaalsContact CE2-NE2 3.33Å; F972-Q976 HydrophobicContact CZ-CG 3.86Å; F972-Q976 WeakPolarHBondContact O-CG 3.21Å; F972-Q976 PolarHBondContact O-N 2.92Å; F972-Y982 HydrophobicContact CE1-CE2 4.42Å
973	Q	88.3	Confident	87.6	Confident	21 Å²	21	48.5 Å²	48.5	10%	0.098	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-25.8	178.2	-77	-78.2	45.2	0	0	114.1	L969 A971 Y982 S1054 K1055	L969-Q973 HydrophobicContact CD2-CG 3.95Å; L969-Q973 WeakPolarHBondContact O-CB 3.37Å; L969-Q973 WeakPolarHBondContact O-CG 3.25Å; L969-Q973 PolarHBondContact O-N 2.98Å; A971-Q973 PolarHBondContact O-N 3.02Å; Q973-Y982 VanDerWaalsContact OE1-CE2 3.28Å; Q973-Y982 PolarHBondContact OE1-OH 2.85Å; Q973-S1054 WeakPolarHBondContact CG-O 3.32Å; Q973-S1054 PolarHBondContact NE2-O 3.12Å; Q973-K1055 PolarHBondContact NE2-O 2.97Å
974	K	85.7	Confident	87.6	Confident	160 Å²	160	48.2 Å²	48.2	70%	0.696	26%	0.259	S	S	*	.	H	α-helix	trans	-78.9	-34.9	174.1	-71.4	166.9	-170.3	159.2	0	111.8	Q970 A971 F972 G977	Q970-K974 VanDerWaalsContact O-CD 3.23Å; Q970-K974 WeakPolarHBondContact O-CD 3.32Å; Q970-K974 WeakPolarHBondContact O-CE 3.41Å; Q970-K974 VanDerWaalsContact O-CG 3.27Å; Q970-K974 WeakPolarHBondContact O-CG 3.14Å; A971-K974 WeakPolarHBondContact O-CB 3.09Å; A971-K974 PolarHBondContact O-N 3.38Å; F972-K974 PolarHBondContact O-N 2.86Å; K974-G977 PolarHBondContact O-N 2.91Å
975	E	87.6	Confident	87.8	Confident	119 Å²	119	44.3 Å²	44.3	56%	0.556	24%	0.238	S	C	*	.	H	α-helix	trans	-66.5	-39.1	175.6	-176.6	171.2	-135.2	0	0	112	A971 F972 G977	A971-E975 PolarHBondContact O-N 3.2Å; A971-E975 VanDerWaalsContact O-N 3.1Å; F972-E975 WeakPolarHBondContact O-CB 3.17Å; F972-E975 PolarHBondContact O-N 3.26Å; F972-E975 VanDerWaalsContact O-N 3.1Å; E975-G977 PolarHBondContact O-N 3.21Å
976	Q	88	Confident	88	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.009	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-9.5	177.8	-56.4	-36.4	-67.8	0	0	114.5	H938 I941 F972 D978 M979 Y982	H938-Q976 PolarHBondContact ND1-NE2 3.48Å; H938-Q976 PolarHBondContact ND1-OE1 3.21Å; I941-Q976 HydrophobicContact CD1-CG 3.91Å; F972-Q976 HydrophobicContact CD1-CG 4.01Å; F972-Q976 HydrophobicContact CE1-CG 3.66Å; F972-Q976 HydrophobicContact CE2-CG 4.36Å; F972-Q976 VanDerWaalsContact CE2-NE2 3.33Å; F972-Q976 HydrophobicContact CZ-CG 3.86Å; F972-Q976 WeakPolarHBondContact O-CG 3.21Å; F972-Q976 PolarHBondContact O-N 2.92Å; Q976-D978 PolarHBondContact O-N 2.84Å; Q976-M979 HydrophobicContact CB-CE 4.15Å; Q976-M979 VanDerWaalsContact O-CB 3.3Å; Q976-M979 WeakPolarHBondContact O-CB 3.45Å; Q976-M979 WeakPolarHBondContact O-CG 3.41Å; Q976-M979 PolarHBondContact O-N 3.26Å; Q976-M979 VanDerWaalsContact O-N 3.12Å; Q976-Y982 HydrophobicContact CB-CE1 4.19Å; Q976-Y982 WeakPolarHBondContact CB-OH 3.44Å; Q976-Y982 HydrophobicContact CG-CE1 4.45Å; Q976-Y982 HydrophobicContact CG-CE2 4.31Å
977	G	83.5	Confident	88	Confident	43 Å²	43	41.5 Å²	41.5	44%	0.443	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	-121.5	172.4	0	0	0	0	0	114.7	K974 E975 N1078	K974-G977 PolarHBondContact O-N 2.91Å; E975-G977 PolarHBondContact O-N 3.21Å; G977-N1078 PolarHBondContact O-ND2 3.02Å
978	D	80.6	Confident	87.3	Confident	114 Å²	114	36.3 Å²	36.3	61%	0.61	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	6.2	-179.9	-113.6	11.3	0	0	0	112.6	K682 Q976 G1079	K682-D978 IonicContact NZ-OD2 2.7Å; K682-D978 PolarHBondContact NZ-OD2 2.97Å; Q976-D978 PolarHBondContact O-N 2.84Å; D978-G1079 WeakPolarHBondContact O-CA 3.07Å
979	M	88	Confident	86.3	Confident	37 Å²	37	37.6 Å²	37.6	18%	0.182	21%	0.21	C	C	.	.			trans	-64.2	157.9	-178.7	-64.9	-164	-72.1	0	0	112.8	I941 E942 Q945 Q976 Y982 N1078 G1079	I941-M979 HydrophobicContact CB-CE 4.48Å; I941-M979 HydrophobicContact CG2-CB 3.93Å; I941-M979 HydrophobicContact CG2-CE 3.69Å; I941-M979 HydrophobicContact CG2-SD 3.92Å; E942-M979 HydrophobicContact CG-CE 4.49Å; E942-M979 HydrophobicContact CG-SD 4.39Å; Q945-M979 HydrophobicContact CG-CB 4.16Å; Q945-M979 HydrophobicContact CG-CG 3.89Å; Q945-M979 HydrophobicContact CG-SD 3.6Å; Q976-M979 HydrophobicContact CB-CE 4.15Å; Q976-M979 VanDerWaalsContact O-CB 3.3Å; Q976-M979 WeakPolarHBondContact O-CB 3.45Å; Q976-M979 WeakPolarHBondContact O-CG 3.41Å; Q976-M979 PolarHBondContact O-N 3.26Å; Q976-M979 VanDerWaalsContact O-N 3.12Å; M979-Y982 HydrophobicContact CB-CE1 4.28Å; M979-N1078 CarbonylContact O-C 3.14Å; M979-N1078 WeakPolarHBondContact O-CB 3.33Å; M979-N1078 PolarHBondContact O-ND2 3.14Å; M979-G1079 PolarHBondContact O-N 2.95Å
980	T	87.3	Confident	85	Confident	12 Å²	12	39.4 Å²	39.4	7%	0.074	23%	0.225	C	C	.	.			trans	-145	164.8	-165	-155.4	0	0	0	0	113.9	Q945 N954 N1078 N1080 F1081	Q945-T980 PolarHBondContact NE2-O 2.78Å; Q945-T980 PolarHBondContact OE1-O 3.48Å; N954-T980 HydrophobicContact CB-CG2 4.34Å; N954-T980 VanDerWaalsContact ND2-CG2 3.32Å; N954-T980 WeakPolarHBondContact ND2-CG2 3.29Å; T980-N1078 WeakPolarHBondContact CB-O 3.34Å; T980-N1078 PolarHBondContact OG1-O 2.63Å; T980-N1080 PolarHBondContact OG1-N 3.43Å; T980-F1081 HydrophobicContact CG2-CD2 4.12Å; T980-F1081 HydrophobicContact CG2-CE2 4.01Å; T980-F1081 VanDerWaalsContact OG1-CD2 3.3Å; T980-F1081 WeakPolarHBondContact OG1-CD2 3.12Å
981	G	87.7	Confident	84	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	83.7	13.8	-179.4	0	0	0	0	0	115.8	L944 K958 L959 Q1087	L944-G981 WeakPolarHBondContact CD2-O 3.12Å; K958-G981 VanDerWaalsContact CA-O 3.26Å; K958-G981 WeakPolarHBondContact CA-O 3.48Å; K958-G981 VanDerWaalsContact CG-O 3.28Å; K958-G981 WeakPolarHBondContact CG-O 3.25Å; L959-G981 PolarHBondContact N-O 3.36Å; G981-Q1087 VanDerWaalsContact CA-NE2 3.34Å
982	Y	92.2	Very high	83.7	Confident	1 Å²	1	36.2 Å²	36.2	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	152.1	171.5	69.8	-86.2	0	0	0	111.2	I941 L959 F972 Q973 Q976 M979 N1078	I941-Y982 HydrophobicContact CB-CD1 4.42Å; I941-Y982 HydrophobicContact CD1-CD1 3.73Å; I941-Y982 HydrophobicContact CD1-CD2 3.67Å; I941-Y982 HydrophobicContact CD1-CE1 4.07Å; I941-Y982 HydrophobicContact CD1-CE2 4.03Å; I941-Y982 HydrophobicContact CD1-CG 3.53Å; I941-Y982 HydrophobicContact CG1-CD1 3.9Å; I941-Y982 HydrophobicContact CG1-CD2 4.46Å; I941-Y982 HydrophobicContact CG1-CG 3.84Å; I941-Y982 HydrophobicContact CG2-CD1 3.61Å; I941-Y982 HydrophobicContact CG2-CE1 3.86Å; I941-Y982 HydrophobicContact CG2-CG 4.42Å; L959-Y982 CarbonylContact O-C 3.52Å; L959-Y982 VanDerWaalsContact O-CA 3.24Å; L959-Y982 WeakPolarHBondContact O-CA 3.36Å; F972-Y982 HydrophobicContact CE1-CE2 4.42Å; Q973-Y982 VanDerWaalsContact OE1-CE2 3.28Å; Q973-Y982 PolarHBondContact OE1-OH 2.85Å; Q976-Y982 HydrophobicContact CB-CE1 4.19Å; Q976-Y982 WeakPolarHBondContact CB-OH 3.44Å; Q976-Y982 HydrophobicContact CG-CE1 4.45Å; Q976-Y982 HydrophobicContact CG-CE2 4.31Å; M979-Y982 HydrophobicContact CB-CE1 4.28Å; Y982-N1078 HydrophobicContact CE1-CB 4.12Å; Y982-N1078 VanDerWaalsContact OH-CB 3.26Å; Y982-N1078 WeakPolarHBondContact OH-CB 3.43Å; Y982-N1078 PolarHBondContact OH-ND2 2.78Å
983	V	90.4	Very high	83.6	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129	177	-176.7	0	0	0	0	109.6	K958 L959 I960 F961 V985 M1077 E1084	K958-V983 HydrophobicContact CD-CG2 3.82Å; K958-V983 HydrophobicContact CG-CG2 4.37Å; L959-V983 PolarHBondContact O-N 2.76Å; I960-V983 HydrophobicContact CG2-CB 4.4Å; F961-V983 PolarHBondContact N-O 3.1Å; V983-V985 HydrophobicContact CG1-CG2 4.05Å; V983-M1077 HydrophobicContact CG2-CG 4Å; V983-M1077 HydrophobicContact CG2-SD 3.67Å; V983-E1084 HydrophobicContact CG2-CG 4.41Å
984	C	90.4	Very high	83.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.9	167.1	-66.4	0	0	0	0	109.1	F963 L969 A1056 S1057	F963-C984 HydrophobicContact CD2-CB 4.16Å; F963-C984 HydrophobicContact CE2-CB 4Å; L969-C984 HydrophobicContact CD1-CB 3.85Å; L969-C984 HydrophobicContact CG-CB 4.11Å; C984-A1056 CarbonylContact O-C 3.55Å; C984-A1056 VanDerWaalsContact O-CA 3.31Å; C984-A1056 WeakPolarHBondContact O-CA 3.41Å; C984-S1057 PolarHBondContact O-N 2.79Å
985	V	90.1	Very high	83.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	137.5	177.1	171	0	0	0	0	109.8	I960 F961 T962 F963 V983 V994 N995 S1057	I960-V985 HydrophobicContact CG2-CG2 3.66Å; F961-V985 PolarHBondContact O-N 3.48Å; T962-V985 CarbonylContact C-O 3.5Å; T962-V985 WeakPolarHBondContact CA-O 3.45Å; T962-V985 HydrophobicContact CG2-CG1 4.48Å; F963-V985 PolarHBondContact N-O 2.92Å; V983-V985 HydrophobicContact CG1-CG2 4.05Å; V985-V994 HydrophobicContact CG1-CB 3.58Å; V985-V994 HydrophobicContact CG1-CG1 3.46Å; V985-V994 VanDerWaalsContact CG1-CG1 3.46Å; V985-N995 HydrophobicContact CG2-CB 4.48Å; V985-S1057 CarbonylContact C-O 3.58Å; V985-S1057 WeakPolarHBondContact CA-O 3.27Å
986	Y	87.9	Confident	84.2	Confident	30 Å²	30	23.1 Å²	23.1	12%	0.118	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.6	177.6	178.1	-92.2	0	0	0	112.5	F963 L966 V1029 L1051 S1057	F963-Y986 WeakPolarHBondContact O-CA 3.47Å; L966-Y986 HydrophobicContact CB-CE2 4.29Å; Y986-V1029 HydrophobicContact CD1-CG2 4.15Å; Y986-V1029 HydrophobicContact CE1-CG2 4.24Å; Y986-L1051 HydrophobicContact CD1-CD1 3.69Å; Y986-L1051 HydrophobicContact CD1-CD2 3.84Å; Y986-L1051 HydrophobicContact CD1-CG 4.43Å; Y986-L1051 HydrophobicContact CD2-CD2 4Å; Y986-L1051 HydrophobicContact CE1-CD1 4.14Å; Y986-L1051 HydrophobicContact CG-CD1 4.26Å; Y986-L1051 HydrophobicContact CG-CD2 3.52Å; Y986-S1057 PolarHBondContact N-O 3.11Å
987	S	83.3	Confident	84.5	Confident	3 Å²	3	23 Å²	23	2%	0.021	14%	0.144	C	C	.	.			trans	-148.8	127.3	170.2	-147.1	0	0	0	0	107.8	F963 N964 H989 T992 D1027	F963-S987 PolarHBondContact O-N 3.39Å; N964-S987 VanDerWaalsContact CA-O 3.32Å; N964-S987 WeakPolarHBondContact CA-O 3.32Å; S987-H989 PolarHBondContact O-N 3.04Å; S987-T992 WeakPolarHBondContact CB-OG1 3.39Å; S987-T992 WeakPolarHBondContact OG-CB 3.3Å; S987-T992 PolarHBondContact OG-OG1 2.79Å; S987-D1027 PolarHBondContact OG-OD1 3.3Å
988	G	71.5	Confident	84.9	Confident	42 Å²	42	21 Å²	21	43%	0.433	12%	0.123	S	C	.	.	S	Bend	trans	-74.8	-11.4	179.5	0	0	0	0	0	113.9	D1027	G988-D1027 WeakPolarHBondContact CA-OD2 3.4Å; G988-D1027 PolarHBondContact N-OD1 3.34Å; G988-D1027 PolarHBondContact N-OD2 3Å
989	H	67.9	Low	85.5	Confident	88 Å²	88	15.7 Å²	15.7	41%	0.407	10%	0.095	S	C	.	.	S	Bend	trans	-113.2	162.7	179.1	-162.8	62.7	0	0	0	113.7	S987 D1027	S987-H989 PolarHBondContact O-N 3.04Å; H989-D1027 HydrophobicContact CB-CB 3.81Å; H989-D1027 VanDerWaalsContact CB-OD1 3.3Å; H989-D1027 WeakPolarHBondContact CB-OD1 3.48Å; H989-D1027 PolarHBondContact N-OD1 3.06Å
990	A	65.2	Low	85.8	Confident	37 Å²	37	13.9 Å²	13.9	31%	0.306	9%	0.086	S	C	.	.	S	Bend	trans	-146.4	119.6	-177.2	0	0	0	0	0	108.5	Y928	Y928-A990 HydrophobicContact CE2-CB 3.95Å; Y928-A990 WeakPolarHBondContact OH-CB 3.4Å
991	P	68.1	Low	86.1	Confident	44 Å²	44	13.3 Å²	13.3	29%	0.286	8%	0.083	S	C	.	.	S	Bend	cis	-71.6	157	11.3	31.5	-37.2	0	0	0	114.9	Y928 Y993	Y928-P991 HydrophobicContact CD1-CB 3.85Å; Y928-P991 HydrophobicContact CD2-CB 4.36Å; Y928-P991 HydrophobicContact CE1-CB 3.72Å; Y928-P991 HydrophobicContact CE2-CB 4.26Å; Y928-P991 HydrophobicContact CG-CB 4.17Å; P991-Y993 HydrophobicContact CB-CE2 4.08Å
992	T	81.1	Confident	86.2	Confident	3 Å²	3	13.6 Å²	13.6	2%	0.018	9%	0.085	C	C	.	.			trans	-146.8	146.3	173.9	-177.9	0	0	0	0	108.8	T962 S987 V994	T962-T992 HydrophobicContact CG2-CG2 3.73Å; S987-T992 WeakPolarHBondContact CB-OG1 3.39Å; S987-T992 WeakPolarHBondContact OG-CB 3.3Å; S987-T992 PolarHBondContact OG-OG1 2.79Å; T992-V994 WeakPolarHBondContact OG1-CG2 3.48Å
993	Y	90.1	Very high	86.2	Confident	24 Å²	24	13.7 Å²	13.7	9%	0.094	9%	0.087	C	C	.	.			trans	-125.7	20.9	-176.9	-56.8	-85	0	0	0	111.7	I752 K756 P991 N995 I996 L997 Y1024	I752-Y993 HydrophobicContact CB-CE1 4.41Å; I752-Y993 HydrophobicContact CG2-CE1 3.81Å; I752-Y993 HydrophobicContact CG2-CE2 4.34Å; I752-Y993 WeakPolarHBondContact CG2-OH 3.37Å; K756-Y993 HydrophobicContact CG-CG 4.41Å; P991-Y993 HydrophobicContact CB-CE2 4.08Å; Y993-N995 VanDerWaalsContact C-N 3.27Å; Y993-N995 PolarHBondContact O-N 3.39Å; Y993-I996 HydrophobicContact CD1-CG1 4.28Å; Y993-I996 WeakPolarHBondContact O-CA 3.3Å; Y993-I996 VanDerWaalsContact O-CB 3.3Å; Y993-I996 WeakPolarHBondContact O-CB 3.39Å; Y993-I996 PolarHBondContact O-N 3.35Å; Y993-L997 PolarHBondContact O-N 3.44Å; Y993-Y1024 PolarHBondContact N-O 3.46Å
994	V	89.7	Confident	86.2	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-67.1	-27.8	-176.9	-178.6	0	0	0	0	112.3	V985 T992 I996 L997 D998 A1025 V1059 Y1072	V985-V994 HydrophobicContact CG1-CB 3.58Å; V985-V994 HydrophobicContact CG1-CG1 3.46Å; V985-V994 VanDerWaalsContact CG1-CG1 3.46Å; T992-V994 WeakPolarHBondContact OG1-CG2 3.48Å; V994-I996 VanDerWaalsContact C-N 3.31Å; V994-L997 WeakPolarHBondContact O-CB 3.39Å; V994-L997 PolarHBondContact O-N 3.01Å; V994-D998 WeakPolarHBondContact O-CB 3.39Å; V994-D998 PolarHBondContact O-N 3.18Å; V994-A1025 HydrophobicContact CG2-CB 3.82Å; V994-V1059 HydrophobicContact CB-CG2 4.33Å; V994-V1059 HydrophobicContact CG1-CG2 3.77Å; V994-V1059 HydrophobicContact CG2-CB 4.43Å; V994-V1059 HydrophobicContact CG2-CG2 3.56Å; V994-Y1072 HydrophobicContact CG1-CD2 4.2Å; V994-Y1072 HydrophobicContact CG1-CE2 3.75Å
995	N	91.7	Very high	86.2	Confident	4 Å²	4	14.1 Å²	14.1	2%	0.021	9%	0.089	C	C	.	.	H	α-helix	trans	-69.5	-27.6	168.8	64.3	-46.9	0	0	0	113.2	T925 P926 I960 V985 Y993 A999	T925-N995 PolarHBondContact OG1-ND2 2.9Å; P926-N995 PolarHBondContact O-ND2 2.87Å; I960-N995 HydrophobicContact CG2-CB 3.68Å; V985-N995 HydrophobicContact CG2-CB 4.48Å; Y993-N995 VanDerWaalsContact C-N 3.27Å; Y993-N995 PolarHBondContact O-N 3.39Å; N995-A999 PolarHBondContact O-N 3.36Å
996	I	94.5	Very high	86.1	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-76.9	-37.2	173.6	-50	-56	0	0	0	110.5	I713 L715 S753 K756 Y757 T925 Y993 V994 A1000	I713-I996 HydrophobicContact CD1-CD1 4.09Å; L715-I996 HydrophobicContact CD1-CD1 3.68Å; S753-I996 WeakPolarHBondContact O-CG2 3.34Å; K756-I996 HydrophobicContact CB-CG2 4.44Å; Y757-I996 HydrophobicContact CD2-CG2 4.24Å; Y757-I996 HydrophobicContact CG-CG2 4.48Å; T925-I996 HydrophobicContact CG2-CD1 4.12Å; Y993-I996 HydrophobicContact CD1-CG1 4.28Å; Y993-I996 WeakPolarHBondContact O-CA 3.3Å; Y993-I996 VanDerWaalsContact O-CB 3.3Å; Y993-I996 WeakPolarHBondContact O-CB 3.39Å; Y993-I996 PolarHBondContact O-N 3.35Å; V994-I996 VanDerWaalsContact C-N 3.31Å; I996-A1000 VanDerWaalsContact O-CB 3.24Å; I996-A1000 WeakPolarHBondContact O-CB 3.48Å; I996-A1000 PolarHBondContact O-N 3.21Å
997	L	92.7	Very high	86.2	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.1	-51.1	171.7	175.4	59.3	0	0	0	111.6	F760 Y993 V994 A999 A1000 I1001 A1021 Y1024 V1059 Y1072	F760-L997 HydrophobicContact CD2-CD1 3.49Å; F760-L997 VanDerWaalsContact CD2-CD1 3.49Å; F760-L997 HydrophobicContact CE2-CD1 3.48Å; F760-L997 VanDerWaalsContact CE2-CD1 3.48Å; Y993-L997 PolarHBondContact O-N 3.44Å; V994-L997 WeakPolarHBondContact O-CB 3.39Å; V994-L997 PolarHBondContact O-N 3.01Å; L997-A999 PolarHBondContact O-N 3.11Å; L997-A1000 WeakPolarHBondContact O-CA 3.14Å; L997-A1000 WeakPolarHBondContact O-CB 3.49Å; L997-A1000 PolarHBondContact O-N 2.88Å; L997-I1001 HydrophobicContact CD1-CD1 4.1Å; L997-I1001 HydrophobicContact CD1-CG1 4.18Å; L997-I1001 HydrophobicContact CG-CD1 4Å; L997-I1001 WeakPolarHBondContact O-CG1 3.3Å; L997-I1001 PolarHBondContact O-N 3.23Å; L997-A1021 HydrophobicContact CD2-CB 3.45Å; L997-A1021 VanDerWaalsContact CD2-CB 3.45Å; L997-Y1024 HydrophobicContact CB-CD1 3.57Å; L997-Y1024 HydrophobicContact CB-CD2 4.5Å; L997-Y1024 HydrophobicContact CB-CE1 3.99Å; L997-Y1024 HydrophobicContact CB-CG 3.83Å; L997-Y1024 HydrophobicContact CD1-CD1 4.38Å; L997-Y1024 HydrophobicContact CD1-CD2 4.04Å; L997-Y1024 HydrophobicContact CD1-CE1 4.31Å; L997-Y1024 HydrophobicContact CD1-CE2 4Å; L997-Y1024 HydrophobicContact CD1-CG 4.22Å; L997-Y1024 HydrophobicContact CD2-CD2 4.32Å; L997-Y1024 HydrophobicContact CD2-CG 4.1Å; L997-Y1024 HydrophobicContact CG-CD1 4.41Å; L997-Y1024 HydrophobicContact CG-CG 4.28Å; L997-V1059 HydrophobicContact CD2-CG2 4.13Å; L997-Y1072 HydrophobicContact CD2-CD2 3.78Å; L997-Y1072 HydrophobicContact CD2-CG 4.3Å; L997-Y1072 HydrophobicContact CG-CD2 4.24Å
998	D	92.7	Very high	86.3	Confident	0 Å²	0	20 Å²	20	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-49.8	-54.3	174.6	171.9	-78.6	0	0	0	111.7	K958 I960 V994 A1000 I1001 G1002 Y1072	K958-D998 IonicContact NZ-OD1 2.87Å; K958-D998 PolarHBondContact NZ-OD1 3.37Å; K958-D998 IonicContact NZ-OD2 2.71Å; I960-D998 WeakPolarHBondContact CD1-OD1 3.34Å; I960-D998 VanDerWaalsContact CG1-OD1 3.26Å; I960-D998 WeakPolarHBondContact CG1-OD1 3.49Å; I960-D998 HydrophobicContact CG2-CB 4.5Å; V994-D998 WeakPolarHBondContact O-CB 3.39Å; V994-D998 PolarHBondContact O-N 3.18Å; D998-A1000 VanDerWaalsContact C-N 3.3Å; D998-A1000 PolarHBondContact O-N 3.4Å; D998-I1001 PolarHBondContact O-N 3.12Å; D998-G1002 PolarHBondContact O-N 3.34Å; D998-Y1072 HydrophobicContact CB-CE2 4.36Å; D998-Y1072 WeakPolarHBondContact CB-OH 3.37Å; D998-Y1072 PolarHBondContact OD2-OH 3.01Å
999	A	93.8	Very high	86.8	Confident	2 Å²	2	22 Å²	22	2%	0.017	12%	0.124	C	C	.	.	H	α-helix	trans	-63.5	-31.6	176.2	0	0	0	0	0	113.6	I713 Y757 A923 I960 N995 L997 A1003	I713-A999 HydrophobicContact CB-CB 4.07Å; I713-A999 HydrophobicContact CD1-CB 3.65Å; I713-A999 HydrophobicContact CG1-CB 3.74Å; Y757-A999 HydrophobicContact CE2-CB 4.26Å; A923-A999 HydrophobicContact CB-CB 3.74Å; I960-A999 HydrophobicContact CD1-CB 3.9Å; N995-A999 PolarHBondContact O-N 3.36Å; L997-A999 PolarHBondContact O-N 3.11Å; A999-A1003 WeakPolarHBondContact O-CB 3.11Å; A999-A1003 PolarHBondContact O-N 3.4Å
1000	A	94.3	Very high	87.6	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-73.9	-37.4	178.5	0	0	0	0	0	112.6	Y757 F760 P768 I996 L997 D998 A1003 S1004	Y757-A1000 HydrophobicContact CD2-CB 3.68Å; Y757-A1000 HydrophobicContact CE2-CB 4Å; Y757-A1000 HydrophobicContact CG-CB 4.48Å; F760-A1000 HydrophobicContact CB-CB 3.58Å; F760-A1000 HydrophobicContact CD1-CB 3.97Å; F760-A1000 HydrophobicContact CD2-CB 4.49Å; F760-A1000 HydrophobicContact CG-CB 3.74Å; P768-A1000 HydrophobicContact CG-CB 3.89Å; I996-A1000 VanDerWaalsContact O-CB 3.24Å; I996-A1000 WeakPolarHBondContact O-CB 3.48Å; I996-A1000 PolarHBondContact O-N 3.21Å; L997-A1000 WeakPolarHBondContact O-CA 3.14Å; L997-A1000 WeakPolarHBondContact O-CB 3.49Å; L997-A1000 PolarHBondContact O-N 2.88Å; D998-A1000 VanDerWaalsContact C-N 3.3Å; D998-A1000 PolarHBondContact O-N 3.4Å; A1000-A1003 PolarHBondContact O-N 3.02Å; A1000-S1004 WeakPolarHBondContact O-CB 3.14Å; A1000-S1004 PolarHBondContact O-N 2.89Å
1001	I	92.6	Very high	88.4	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-52.3	173.9	-65.4	159.9	0	0	0	109.1	F760 L997 D998 A1003 S1004 V1005 I1014 F1016 Q1019 Y1072	F760-I1001 HydrophobicContact CE1-CB 4.41Å; F760-I1001 HydrophobicContact CE1-CG1 3.97Å; F760-I1001 HydrophobicContact CE2-CG1 3.92Å; F760-I1001 HydrophobicContact CZ-CB 4.36Å; F760-I1001 HydrophobicContact CZ-CG1 3.49Å; F760-I1001 VanDerWaalsContact CZ-CG1 3.49Å; L997-I1001 HydrophobicContact CD1-CD1 4.1Å; L997-I1001 HydrophobicContact CD1-CG1 4.18Å; L997-I1001 HydrophobicContact CG-CD1 4Å; L997-I1001 WeakPolarHBondContact O-CG1 3.3Å; L997-I1001 PolarHBondContact O-N 3.23Å; D998-I1001 PolarHBondContact O-N 3.12Å; I1001-A1003 PolarHBondContact O-N 3.29Å; I1001-S1004 PolarHBondContact O-N 3.49Å; I1001-S1004 VanDerWaalsContact O-N 3.11Å; I1001-S1004 PolarHBondContact O-OG 3.25Å; I1001-V1005 WeakPolarHBondContact O-CG2 3.49Å; I1001-I1014 HydrophobicContact CG2-CD1 3.98Å; I1001-F1016 HydrophobicContact CB-CD1 3.82Å; I1001-F1016 HydrophobicContact CB-CE1 3.63Å; I1001-F1016 HydrophobicContact CB-CZ 4.34Å; I1001-F1016 HydrophobicContact CD1-CD1 4.25Å; I1001-F1016 HydrophobicContact CG2-CB 4.44Å; I1001-F1016 HydrophobicContact CG2-CD1 3.35Å; I1001-F1016 HydrophobicContact CG2-CD2 4.04Å; I1001-F1016 HydrophobicContact CG2-CE1 3.4Å; I1001-F1016 VanDerWaalsContact CG2-CE1 3.4Å; I1001-F1016 HydrophobicContact CG2-CE2 4.12Å; I1001-F1016 HydrophobicContact CG2-CG 3.69Å; I1001-F1016 HydrophobicContact CG2-CZ 3.84Å; I1001-Q1019 HydrophobicContact CD1-CB 3.78Å; I1001-Q1019 HydrophobicContact CD1-CG 4.16Å; I1001-Q1019 HydrophobicContact CG1-CB 3.99Å; I1001-Q1019 HydrophobicContact CG1-CG 4.16Å; I1001-Q1019 HydrophobicContact CG2-CG 3.89Å; I1001-Y1072 HydrophobicContact CD1-CD1 3.4Å; I1001-Y1072 VanDerWaalsContact CD1-CD1 3.4Å; I1001-Y1072 HydrophobicContact CD1-CD2 4.41Å; I1001-Y1072 HydrophobicContact CD1-CE1 3.98Å; I1001-Y1072 HydrophobicContact CD1-CG 3.64Å
1002	G	89.9	Confident	89.1	Confident	5 Å²	5	27 Å²	27	5%	0.052	14%	0.143	C	C	.	.	H	α-helix	trans	-63.8	-25	179.4	0	0	0	0	0	115	D998 F1016	D998-G1002 PolarHBondContact O-N 3.34Å; G1002-F1016 VanDerWaalsContact CA-CZ 3.48Å
1003	A	92.6	Very high	89.3	Confident	4 Å²	4	28.2 Å²	28.2	3%	0.033	15%	0.152	C	C	.	.	H	α-helix	trans	-89.9	-9.5	176.4	0	0	0	0	0	114.6	K711 Y757 P768 A999 A1000 I1001 V1005	K711-A1003 WeakPolarHBondContact O-CA 3.41Å; K711-A1003 VanDerWaalsContact O-CB 3.32Å; K711-A1003 WeakPolarHBondContact O-CB 3.4Å; Y757-A1003 HydrophobicContact CE2-CB 4.21Å; Y757-A1003 WeakPolarHBondContact OH-CB 3.35Å; P768-A1003 HydrophobicContact CB-CB 3.88Å; P768-A1003 HydrophobicContact CG-CB 4.09Å; A999-A1003 WeakPolarHBondContact O-CB 3.11Å; A999-A1003 PolarHBondContact O-N 3.4Å; A1000-A1003 PolarHBondContact O-N 3.02Å; I1001-A1003 PolarHBondContact O-N 3.29Å; A1003-V1005 VanDerWaalsContact C-N 3.35Å
1004	S	90.7	Very high	88.9	Confident	3 Å²	3	28 Å²	28	2%	0.021	15%	0.152	C	C	.	.	S	Bend	trans	-84.4	-8.3	174.4	73.7	0	0	0	0	113.8	N766 A1000 I1001	N766-S1004 WeakPolarHBondContact CB-O 3.47Å; N766-S1004 PolarHBondContact ND2-O 3.16Å; A1000-S1004 WeakPolarHBondContact O-CB 3.14Å; A1000-S1004 PolarHBondContact O-N 2.89Å; I1001-S1004 PolarHBondContact O-N 3.49Å; I1001-S1004 VanDerWaalsContact O-N 3.11Å; I1001-S1004 PolarHBondContact O-OG 3.25Å
1005	V	90.2	Very high	88.4	Confident	7 Å²	7	31.5 Å²	31.5	4%	0.042	17%	0.171	C	C	.	.			trans	-74.6	136.6	-175.6	-166.3	0	0	0	0	110.8	I1001 A1003 Y1007 G1012 I1014 L1088	I1001-V1005 WeakPolarHBondContact O-CG2 3.49Å; A1003-V1005 VanDerWaalsContact C-N 3.35Å; V1005-Y1007 HydrophobicContact CB-CE2 4.05Å; V1005-Y1007 HydrophobicContact CG1-CD1 4.45Å; V1005-Y1007 HydrophobicContact CG1-CD2 4.21Å; V1005-Y1007 HydrophobicContact CG1-CE1 3.93Å; V1005-Y1007 HydrophobicContact CG1-CE2 3.67Å; V1005-G1012 VanDerWaalsContact CG1-O 3.31Å; V1005-G1012 WeakPolarHBondContact CG1-O 3.49Å; V1005-I1014 HydrophobicContact CG2-CD1 3.79Å; V1005-I1014 HydrophobicContact CG2-CG1 3.79Å; V1005-L1088 HydrophobicContact CB-CD2 4.25Å; V1005-L1088 HydrophobicContact CG2-CD2 3.57Å
1006	D	88.6	Confident	88.1	Confident	26 Å²	26	31.4 Å²	31.4	14%	0.139	17%	0.17	C	C	.	.			trans	-121.4	100.4	176.5	-160.5	-32.6	0	0	0	111.2	K710 T1008 I1009 G1012	K710-D1006 WeakPolarHBondContact CE-OD2 3.27Å; K710-D1006 VanDerWaalsContact NZ-CG 3.34Å; K710-D1006 IonicContact NZ-OD2 3.42Å; K710-D1006 PolarHBondContact NZ-OD2 3.32Å; D1006-T1008 PolarHBondContact O-N 3.34Å; D1006-T1008 WeakPolarHBondContact OD1-CB 3.46Å; D1006-T1008 PolarHBondContact OD1-N 3.01Å; D1006-T1008 PolarHBondContact OD1-OG1 3.5Å; D1006-I1009 HydrophobicContact CB-CD1 4.38Å; D1006-I1009 HydrophobicContact CB-CG1 4.3Å; D1006-I1009 WeakPolarHBondContact O-CG1 3.38Å; D1006-G1012 WeakPolarHBondContact O-CA 3.46Å
1007	Y	89.2	Confident	87.3	Confident	26 Å²	26	32 Å²	32	10%	0.102	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	1.1	179.7	-66.1	-73.8	0	0	0	114.3	V1005 L1088 N1089 A1092 F1133 N1136 V1138	V1005-Y1007 HydrophobicContact CB-CE2 4.05Å; V1005-Y1007 HydrophobicContact CG1-CD1 4.45Å; V1005-Y1007 HydrophobicContact CG1-CD2 4.21Å; V1005-Y1007 HydrophobicContact CG1-CE1 3.93Å; V1005-Y1007 HydrophobicContact CG1-CE2 3.67Å; Y1007-L1088 WeakPolarHBondContact OH-CD2 3.3Å; Y1007-L1088 VanDerWaalsContact OH-CG 3.31Å; Y1007-L1088 WeakPolarHBondContact OH-CG 3.42Å; Y1007-N1089 VanDerWaalsContact CE1-OD1 3.27Å; Y1007-N1089 WeakPolarHBondContact CE1-OD1 3.31Å; Y1007-N1089 PolarHBondContact OH-N 2.69Å; Y1007-N1089 PolarHBondContact OH-OD1 3.5Å; Y1007-A1092 HydrophobicContact CD1-CB 4.15Å; Y1007-A1092 HydrophobicContact CD2-CB 3.53Å; Y1007-A1092 HydrophobicContact CE1-CB 4.02Å; Y1007-A1092 HydrophobicContact CE2-CB 3.37Å; Y1007-A1092 HydrophobicContact CG-CB 3.92Å; Y1007-F1133 HydrophobicContact CD1-CD1 4.42Å; Y1007-F1133 AromaticContact CD1-CE1 3.66Å; Y1007-F1133 HydrophobicContact CD1-CE1 3.66Å; Y1007-F1133 HydrophobicContact CD1-CZ 4.16Å; Y1007-F1133 HydrophobicContact CE1-CE1 4.24Å; Y1007-F1133 HydrophobicContact CG-CE1 4.04Å; Y1007-F1133 HydrophobicContact CG-CZ 4.08Å; Y1007-N1136 PolarHBondContact O-ND2 3.21Å; Y1007-V1138 HydrophobicContact CD1-CG2 4Å; Y1007-V1138 HydrophobicContact CE1-CG2 3.66Å
1008	T	84.9	Confident	86.6	Confident	105 Å²	105	37 Å²	37	64%	0.644	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-11	179.4	70.6	0	0	0	0	114.3	D1006	D1006-T1008 PolarHBondContact O-N 3.34Å; D1006-T1008 WeakPolarHBondContact OD1-CB 3.46Å; D1006-T1008 PolarHBondContact OD1-N 3.01Å; D1006-T1008 PolarHBondContact OD1-OG1 3.5Å
1009	I	83.1	Confident	86.4	Confident	83 Å²	83	37 Å²	37	43%	0.426	20%	0.196	S	C	.	.	S	Bend	trans	-107.9	154.5	-179	65.6	174.6	0	0	0	112.5	D1006 N1011 G1012 N1136	D1006-I1009 HydrophobicContact CB-CD1 4.38Å; D1006-I1009 HydrophobicContact CB-CG1 4.3Å; D1006-I1009 WeakPolarHBondContact O-CG1 3.38Å; I1009-N1011 PolarHBondContact O-N 3.11Å; I1009-G1012 PolarHBondContact O-N 3.43Å; I1009-G1012 VanDerWaalsContact O-N 3.14Å; I1009-N1136 WeakPolarHBondContact O-CA 3.39Å; I1009-N1136 VanDerWaalsContact O-CB 3.28Å; I1009-N1136 WeakPolarHBondContact O-CB 3.49Å
1010	E	83.4	Confident	86.1	Confident	149 Å²	149	39 Å²	39	70%	0.696	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	131.6	174.6	-67.5	-176.8	176.1	0	0	111.2	G1012 T1135	E1010-G1012 PolarHBondContact O-N 3.46Å; E1010-T1135 VanDerWaalsContact CA-O 3.32Å; E1010-T1135 WeakPolarHBondContact CA-O 3.42Å
1011	N	82.9	Confident	85.8	Confident	119 Å²	119	39 Å²	39	64%	0.636	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	25.3	-174.3	-51.1	-93.1	0	0	0	114.6	I1009 S1013 T1135 N1136	I1009-N1011 PolarHBondContact O-N 3.11Å; N1011-S1013 PolarHBondContact O-N 3.35Å; N1011-T1135 PolarHBondContact N-O 3.02Å; N1011-N1136 CarbonylContact C-O 3.47Å; N1011-N1136 VanDerWaalsContact CA-O 3.31Å; N1011-N1136 WeakPolarHBondContact CA-O 3.39Å
1012	G	83.2	Confident	85.2	Confident	6 Å²	6	42.9 Å²	42.9	6%	0.062	23%	0.229	C	C	.	.			trans	-67.1	-12.1	-180	0	0	0	0	0	116.3	V1005 D1006 I1009 E1010 N1136	V1005-G1012 VanDerWaalsContact CG1-O 3.31Å; V1005-G1012 WeakPolarHBondContact CG1-O 3.49Å; D1006-G1012 WeakPolarHBondContact O-CA 3.46Å; I1009-G1012 PolarHBondContact O-N 3.43Å; I1009-G1012 VanDerWaalsContact O-N 3.14Å; E1010-G1012 PolarHBondContact O-N 3.46Å; G1012-N1136 PolarHBondContact N-O 3.3Å
1013	S	85.3	Confident	84.6	Confident	28 Å²	28	45.7 Å²	45.7	20%	0.196	25%	0.252	C	S	.	.			trans	-71.9	125.1	171.8	65.7	0	0	0	0	111.6	N1011 N1136 G1137	N1011-S1013 PolarHBondContact O-N 3.35Å; S1013-N1136 WeakPolarHBondContact CB-O 3.32Å; S1013-N1136 PolarHBondContact N-O 3.27Å; S1013-N1136 PolarHBondContact OG-O 3.45Å; S1013-N1136 VanDerWaalsContact OG-O 3.1Å; S1013-G1137 VanDerWaalsContact OG-C 3.26Å; S1013-G1137 WeakPolarHBondContact OG-CA 3.47Å; S1013-G1137 PolarHBondContact OG-O 3.44Å
1014	I	81.9	Confident	84.3	Confident	19 Å²	19	46.1 Å²	46.1	10%	0.097	25%	0.253	C	S	.	.			trans	-109.7	149.4	-178.5	72.3	-176.3	0	0	0	112.6	I1001 V1005	I1001-I1014 HydrophobicContact CG2-CD1 3.98Å; V1005-I1014 HydrophobicContact CG2-CD1 3.79Å; V1005-I1014 HydrophobicContact CG2-CG1 3.79Å
1015	N	78	Confident	83.3	Confident	74 Å²	74	46.6 Å²	46.6	40%	0.396	26%	0.257	S	S	.	.			trans	-82.9	132.8	165.7	-172.7	-31.5	0	0	0	109.8	K763 N1017 Q1019	K763-N1015 PolarHBondContact NZ-O 3.34Å; N1015-N1017 VanDerWaalsContact OD1-CB 3.23Å; N1015-N1017 WeakPolarHBondContact OD1-CB 3.43Å; N1015-N1017 PolarHBondContact OD1-N 3.17Å; N1015-Q1019 PolarHBondContact O-NE2 2.96Å
1016	F	85.2	Confident	82.3	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.009	29%	0.289	C	S	.	.	S	Bend	trans	-69	-30.4	178.7	-83.7	-112.4	0	0	0	113.4	I1001 G1002 Q1019 Y1072 E1084 D1085 L1088	I1001-F1016 HydrophobicContact CB-CD1 3.82Å; I1001-F1016 HydrophobicContact CB-CE1 3.63Å; I1001-F1016 HydrophobicContact CB-CZ 4.34Å; I1001-F1016 HydrophobicContact CD1-CD1 4.25Å; I1001-F1016 HydrophobicContact CG2-CB 4.44Å; I1001-F1016 HydrophobicContact CG2-CD1 3.35Å; I1001-F1016 HydrophobicContact CG2-CD2 4.04Å; I1001-F1016 HydrophobicContact CG2-CE1 3.4Å; I1001-F1016 VanDerWaalsContact CG2-CE1 3.4Å; I1001-F1016 HydrophobicContact CG2-CE2 4.12Å; I1001-F1016 HydrophobicContact CG2-CG 3.69Å; I1001-F1016 HydrophobicContact CG2-CZ 3.84Å; G1002-F1016 VanDerWaalsContact CA-CZ 3.48Å; F1016-Q1019 WeakPolarHBondContact O-CG 3.34Å; F1016-Q1019 PolarHBondContact O-N 3.47Å; F1016-Y1072 HydrophobicContact CB-CD1 4.43Å; F1016-Y1072 HydrophobicContact CD1-CD1 4.5Å; F1016-Y1072 HydrophobicContact CD1-CE1 4.13Å; F1016-E1084 WeakPolarHBondContact CD1-OE2 3.16Å; F1016-E1084 HydrophobicContact CE1-CG 4.24Å; F1016-E1084 WeakPolarHBondContact CE1-OE1 3.3Å; F1016-E1084 WeakPolarHBondContact CE1-OE2 3.27Å; F1016-E1084 HydrophobicContact CZ-CG 4.24Å; F1016-E1084 VanDerWaalsContact CZ-OE1 3.22Å; F1016-E1084 WeakPolarHBondContact CZ-OE1 3.26Å; F1016-D1085 HydrophobicContact CD2-CB 3.98Å; F1016-D1085 HydrophobicContact CE2-CB 4.38Å; F1016-L1088 HydrophobicContact CE2-CD2 3.94Å; F1016-L1088 HydrophobicContact CZ-CD2 4.02Å
1017	N	77.6	Confident	81.2	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.08	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	142.2	177	-167.5	4.3	0	0	0	111.2	K763 N1015 Q1019 Y1060 G1073 F1074	K763-N1017 PolarHBondContact NZ-O 3.34Å; N1015-N1017 VanDerWaalsContact OD1-CB 3.23Å; N1015-N1017 WeakPolarHBondContact OD1-CB 3.43Å; N1015-N1017 PolarHBondContact OD1-N 3.17Å; N1017-Q1019 PolarHBondContact O-N 3.46Å; N1017-Y1060 PolarHBondContact OD1-OH 3.28Å; N1017-G1073 WeakPolarHBondContact CA-O 3.43Å; N1017-F1074 WeakPolarHBondContact ND2-CD1 3.41Å
1018	F	78	Confident	80.3	Confident	104 Å²	104	53.5 Å²	53.5	46%	0.456	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	16.6	-178.2	-43.4	-81.5	0	0	0	115.2	K763 Y1060 L1062 L1071 Y1072	K763-F1018 WeakPolarHBondContact CE-O 3.44Å; F1018-Y1060 WeakPolarHBondContact CD1-OH 3.5Å; F1018-Y1060 VanDerWaalsContact CE1-OH 3.31Å; F1018-Y1060 WeakPolarHBondContact CE1-OH 3.45Å; F1018-L1062 HydrophobicContact CD1-CD1 4.38Å; F1018-L1062 HydrophobicContact CE1-CD1 4.39Å; F1018-L1071 HydrophobicContact CB-CD1 4.26Å; F1018-L1071 HydrophobicContact CD1-CD1 4.06Å; F1018-Y1072 PolarHBondContact N-O 3.29Å
1019	Q	88.4	Confident	79.6	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.269	C	S	.	.			trans	-69.2	148.5	172.9	-67.3	-67.1	-14.1	0	0	111	F760 I1001 N1015 F1016 N1017 A1021 L1071 Y1072	F760-Q1019 HydrophobicContact CZ-CB 4.39Å; I1001-Q1019 HydrophobicContact CD1-CB 3.78Å; I1001-Q1019 HydrophobicContact CD1-CG 4.16Å; I1001-Q1019 HydrophobicContact CG1-CB 3.99Å; I1001-Q1019 HydrophobicContact CG1-CG 4.16Å; I1001-Q1019 HydrophobicContact CG2-CG 3.89Å; N1015-Q1019 PolarHBondContact O-NE2 2.96Å; F1016-Q1019 WeakPolarHBondContact O-CG 3.34Å; F1016-Q1019 PolarHBondContact O-N 3.47Å; N1017-Q1019 PolarHBondContact O-N 3.46Å; Q1019-A1021 PolarHBondContact O-N 2.99Å; Q1019-L1071 CarbonylContact O-C 3.54Å; Q1019-L1071 VanDerWaalsContact O-CA 3.32Å; Q1019-L1071 WeakPolarHBondContact O-CA 3.11Å; Q1019-Y1072 PolarHBondContact O-N 2.72Å
1020	P	87.1	Confident	78.6	Confident	44 Å²	44	45.7 Å²	45.7	29%	0.286	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-63	129.4	-177.6	-20.9	33.5	0	0	0	112.1	F760	F760-P1020 WeakPolarHBondContact CE2-O 3.39Å
1021	A	87.9	Confident	77.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.244	C	C	.	.			trans	-122.2	14.5	-177.8	0	0	0	0	0	113.3	L997 Q1019 A1023 Y1024 V1059 T1070	L997-A1021 HydrophobicContact CD2-CB 3.45Å; L997-A1021 VanDerWaalsContact CD2-CB 3.45Å; Q1019-A1021 PolarHBondContact O-N 2.99Å; A1021-A1023 PolarHBondContact O-N 3.31Å; A1021-Y1024 PolarHBondContact O-N 3.21Å; A1021-V1059 HydrophobicContact CB-CB 4.44Å; A1021-V1059 HydrophobicContact CB-CG1 3.7Å; A1021-V1059 HydrophobicContact CB-CG2 3.84Å; A1021-T1070 HydrophobicContact CB-CG2 4.15Å; A1021-T1070 PolarHBondContact N-O 3.17Å
1022	D	80.2	Confident	75.5	Confident	80 Å²	80	38.3 Å²	38.3	43%	0.428	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	121.5	179.9	-68.8	-27.1	0	0	0	110.7	Y1024 K1069 T1070	D1022-Y1024 WeakPolarHBondContact O-CD2 3.3Å; D1022-K1069 IonicContact OD2-NZ 2.78Å; D1022-T1070 WeakPolarHBondContact OD1-CB 3.14Å
1023	A	79.1	Confident	73.8	Confident	65 Å²	65	40.4 Å²	40.4	54%	0.537	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	26.4	-179.3	0	0	0	0	0	117.7	K756 A1021	K756-A1023 PolarHBondContact NZ-O 2.86Å; A1021-A1023 PolarHBondContact O-N 3.31Å
1024	Y	85.6	Confident	72.2	Confident	13 Å²	13	42.6 Å²	42.6	5%	0.051	25%	0.252	C	S	.	.	S	Bend	trans	-95.6	-19.2	169.7	-75.3	-92.8	0	0	0	114.8	K756 F760 Y993 L997 A1021 D1022	K756-Y1024 HydrophobicContact CB-CE1 3.93Å; K756-Y1024 HydrophobicContact CD-CE1 4.36Å; K756-Y1024 PolarHBondContact O-OH 3.33Å; F760-Y1024 WeakPolarHBondContact CA-OH 3.41Å; F760-Y1024 WeakPolarHBondContact CB-OH 3.39Å; F760-Y1024 PolarHBondContact N-OH 3.28Å; Y993-Y1024 PolarHBondContact N-O 3.46Å; L997-Y1024 HydrophobicContact CB-CD1 3.57Å; L997-Y1024 HydrophobicContact CB-CD2 4.5Å; L997-Y1024 HydrophobicContact CB-CE1 3.99Å; L997-Y1024 HydrophobicContact CB-CG 3.83Å; L997-Y1024 HydrophobicContact CD1-CD1 4.38Å; L997-Y1024 HydrophobicContact CD1-CD2 4.04Å; L997-Y1024 HydrophobicContact CD1-CE1 4.31Å; L997-Y1024 HydrophobicContact CD1-CE2 4Å; L997-Y1024 HydrophobicContact CD1-CG 4.22Å; L997-Y1024 HydrophobicContact CD2-CD2 4.32Å; L997-Y1024 HydrophobicContact CD2-CG 4.1Å; L997-Y1024 HydrophobicContact CG-CD1 4.41Å; L997-Y1024 HydrophobicContact CG-CG 4.28Å; A1021-Y1024 PolarHBondContact O-N 3.21Å; D1022-Y1024 WeakPolarHBondContact O-CD2 3.3Å
1025	A	70.2	Confident	70.7	Confident	13 Å²	13	44.8 Å²	44.8	11%	0.107	27%	0.266	C	S	.	.			trans	-140.1	146.5	167.8	0	0	0	0	0	109.2	V994 D1027	V994-A1025 HydrophobicContact CG2-CB 3.82Å; A1025-D1027 VanDerWaalsContact C-N 3.33Å; A1025-D1027 VanDerWaalsContact CB-O 3.26Å; A1025-D1027 WeakPolarHBondContact CB-O 3.45Å
1026	D	67.9	Low	69.4	Low	133 Å²	133	47.2 Å²	47.2	71%	0.711	28%	0.278	S	S	*	.	S	Bend	trans	-83.7	-14.4	170.2	-65	-36.9	0	0	0	111.6
1027	D	65.9	Low	67.7	Low	42 Å²	42	49.4 Å²	49.4	23%	0.225	29%	0.289	C	S	.	.			trans	-110.7	145	172.7	86.7	-75	0	0	0	112.2	S987 G988 H989 A1025	S987-D1027 PolarHBondContact OG-OD1 3.3Å; G988-D1027 WeakPolarHBondContact CA-OD2 3.4Å; G988-D1027 PolarHBondContact N-OD1 3.34Å; G988-D1027 PolarHBondContact N-OD2 3Å; H989-D1027 HydrophobicContact CB-CB 3.81Å; H989-D1027 VanDerWaalsContact CB-OD1 3.3Å; H989-D1027 WeakPolarHBondContact CB-OD1 3.48Å; H989-D1027 PolarHBondContact N-OD1 3.06Å; A1025-D1027 VanDerWaalsContact C-N 3.33Å; A1025-D1027 VanDerWaalsContact CB-O 3.26Å; A1025-D1027 WeakPolarHBondContact CB-O 3.45Å
1028	V	70.2	Confident	66.3	Low	29 Å²	29	54 Å²	54	18%	0.176	31%	0.307	C	S	.	.			trans	-134.2	135.2	179.2	-62.2	0	0	0	0	109.5	T1030 N1031 V1059 E1061 T1070	V1028-T1030 PolarHBondContact O-N 3.18Å; V1028-T1030 VanDerWaalsContact O-N 3.17Å; V1028-N1031 HydrophobicContact CG2-CB 4.17Å; V1028-V1059 HydrophobicContact CG1-CG1 4.07Å; V1028-E1061 HydrophobicContact CB-CG 4.31Å; V1028-E1061 HydrophobicContact CG1-CG 4.3Å; V1028-E1061 HydrophobicContact CG2-CB 4.49Å; V1028-E1061 HydrophobicContact CG2-CG 3.9Å; V1028-T1070 HydrophobicContact CG1-CG2 3.89Å
1029	V	69.7	Low	65	Low	13 Å²	13	56.6 Å²	56.6	8%	0.079	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.8	-173.3	177.1	0	0	0	0	112	Y986 N1044 M1047 V1048 L1051 F1058 V1059	Y986-V1029 HydrophobicContact CD1-CG2 4.15Å; Y986-V1029 HydrophobicContact CE1-CG2 4.24Å; V1029-N1044 PolarHBondContact O-ND2 2.99Å; V1029-M1047 HydrophobicContact CG1-CB 3.93Å; V1029-M1047 HydrophobicContact CG1-CG 3.58Å; V1029-V1048 HydrophobicContact CG1-CG2 3.81Å; V1029-L1051 HydrophobicContact CG1-CD1 3.99Å; V1029-L1051 HydrophobicContact CG2-CD1 3.85Å; V1029-F1058 HydrophobicContact CB-CD2 4.12Å; V1029-F1058 HydrophobicContact CG2-CB 3.92Å; V1029-F1058 HydrophobicContact CG2-CD2 3.79Å; V1029-F1058 HydrophobicContact CG2-CG 4.05Å; V1029-V1059 PolarHBondContact N-O 3.08Å
1030	T	62.4	Low	63.2	Low	10 Å²	10	59.6 Å²	59.6	6%	0.061	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114	60.7	-178	55.5	0	0	0	0	113	V1028 N1032 N1044 V1048 Y1060 E1061	V1028-T1030 PolarHBondContact O-N 3.18Å; V1028-T1030 VanDerWaalsContact O-N 3.17Å; T1030-N1032 PolarHBondContact O-N 3.21Å; T1030-N1044 HydrophobicContact CG2-CB 4.01Å; T1030-V1048 HydrophobicContact CG2-CG2 3.38Å; T1030-Y1060 WeakPolarHBondContact OG1-CB 3.27Å; T1030-E1061 PolarHBondContact OG1-N 2.74Å; T1030-E1061 PolarHBondContact OG1-O 3.48Å
1031	N	51.6	Low	61.3	Low	100 Å²	100	59.9 Å²	59.9	54%	0.535	36%	0.356	S	S	.	.			trans	-70.7	73.8	164.3	-166.4	7.4	0	0	0	110.3	V1028 G1033 K1068	V1028-N1031 HydrophobicContact CG2-CB 4.17Å; N1031-G1033 PolarHBondContact O-N 3.32Å; N1031-K1068 PolarHBondContact OD1-NZ 3.05Å; N1031-K1068 VanDerWaalsContact OD1-NZ 3.11Å
1032	N	50.8	Low	59.5	Low	13 Å²	13	66 Å²	66	7%	0.07	39%	0.385	C	S	.	.			trans	-66.9	94.8	177.8	-61.8	-34.3	0	0	0	108	T1030	T1030-N1032 PolarHBondContact O-N 3.21Å
1033	G	47.1	Very low	58	Low	51 Å²	51	65.6 Å²	65.6	53%	0.526	39%	0.385	S	S	.	.			trans	-57	-80.5	-156.7	0	0	0	0	0	115.9	N1031	N1031-G1033 PolarHBondContact O-N 3.32Å
1034	T	51	Low	56.8	Low	73 Å²	73	66.4 Å²	66.4	45%	0.448	38%	0.38	S	S	.	.	S	Bend	trans	-98.6	164.6	-179.9	75.6	0	0	0	0	111.7	I1036 D1037 Y1038	T1034-I1036 PolarHBondContact O-N 2.91Å; T1034-I1036 VanDerWaalsContact O-N 3.17Å; T1034-I1036 PolarHBondContact OG1-N 3.21Å; T1034-D1037 WeakPolarHBondContact CA-OD2 3.46Å; T1034-D1037 VanDerWaalsContact CB-OD2 3.29Å; T1034-D1037 WeakPolarHBondContact CB-OD2 3.45Å; T1034-D1037 PolarHBondContact N-OD2 3.23Å; T1034-D1037 PolarHBondContact O-N 2.87Å; T1034-D1037 VanDerWaalsContact O-N 3.09Å; T1034-D1037 VanDerWaalsContact OG1-CG 3.3Å; T1034-D1037 PolarHBondContact OG1-N 2.86Å; T1034-D1037 PolarHBondContact OG1-OD2 3.15Å; T1034-Y1038 PolarHBondContact O-N 2.83Å
1035	V	50.6	Low	55.6	Low	66 Å²	66	68 Å²	68	40%	0.4	39%	0.393	S	S	.	.	H	α-helix	trans	-56.7	-29.9	172.3	-176.8	0	0	0	0	111.5	Q1039 F1064	V1035-Q1039 HydrophobicContact CG1-CG 4.4Å; V1035-Q1039 WeakPolarHBondContact O-CB 3.45Å; V1035-Q1039 VanDerWaalsContact O-CG 3.3Å; V1035-Q1039 WeakPolarHBondContact O-CG 3.41Å; V1035-Q1039 PolarHBondContact O-N 2.83Å; V1035-F1064 HydrophobicContact CG2-CD2 3.81Å; V1035-F1064 HydrophobicContact CG2-CE2 4.2Å; V1035-F1064 HydrophobicContact CG2-CG 4.4Å
1036	I	50.2	Low	55.5	Low	125 Å²	125	71.3 Å²	71.3	64%	0.641	42%	0.421	S	S	*	.	H	α-helix	trans	-68.2	-41.7	178.7	-51.7	176.8	0	0	0	110.3	T1034 Q1039 A1040	T1034-I1036 PolarHBondContact O-N 2.91Å; T1034-I1036 VanDerWaalsContact O-N 3.17Å; T1034-I1036 PolarHBondContact OG1-N 3.21Å; I1036-Q1039 CarbonylContact O-C 3.57Å; I1036-Q1039 PolarHBondContact O-N 3Å; I1036-A1040 VanDerWaalsContact O-CB 3.24Å; I1036-A1040 WeakPolarHBondContact O-CB 3.32Å; I1036-A1040 PolarHBondContact O-N 2.85Å
1037	D	50.3	Low	55.9	Low	48 Å²	48	68.4 Å²	68.4	26%	0.257	40%	0.404	S	S	.	.	H	α-helix	trans	-68	-41.5	-177.9	-49.6	-53.4	0	0	0	110.8	T1034 A1040 G1041 Q1042	T1034-D1037 WeakPolarHBondContact CA-OD2 3.46Å; T1034-D1037 VanDerWaalsContact CB-OD2 3.29Å; T1034-D1037 WeakPolarHBondContact CB-OD2 3.45Å; T1034-D1037 PolarHBondContact N-OD2 3.23Å; T1034-D1037 PolarHBondContact O-N 2.87Å; T1034-D1037 VanDerWaalsContact O-N 3.09Å; T1034-D1037 VanDerWaalsContact OG1-CG 3.3Å; T1034-D1037 PolarHBondContact OG1-N 2.86Å; T1034-D1037 PolarHBondContact OG1-OD2 3.15Å; D1037-A1040 PolarHBondContact O-N 3.39Å; D1037-G1041 PolarHBondContact O-N 3.25Å; D1037-Q1042 HydrophobicContact CB-CB 4.43Å; D1037-Q1042 WeakPolarHBondContact O-CB 3.48Å; D1037-Q1042 PolarHBondContact O-N 3.2Å
1038	Y	48.6	Very low	56.4	Low	112 Å²	112	67.3 Å²	67.3	44%	0.439	40%	0.399	S	S	.	.	H	α-helix	trans	-62.4	-45.1	171.8	-173.2	-96.3	0	0	0	112.1	T1034 A1040 G1041 F1064	T1034-Y1038 PolarHBondContact O-N 2.83Å; Y1038-A1040 VanDerWaalsContact C-N 3.31Å; Y1038-A1040 PolarHBondContact O-N 2.87Å; Y1038-G1041 PolarHBondContact O-N 3.33Å; Y1038-G1041 VanDerWaalsContact O-N 3.15Å; Y1038-F1064 AromaticContact CD1-CD1 3.96Å; Y1038-F1064 HydrophobicContact CD1-CD1 3.96Å; Y1038-F1064 HydrophobicContact CD1-CE1 4.15Å; Y1038-F1064 HydrophobicContact CE1-CD1 4.24Å; Y1038-F1064 HydrophobicContact CE1-CE1 4.22Å; Y1038-F1064 HydrophobicContact CG-CD1 4.28Å
1039	Q	50.4	Low	56.8	Low	157 Å²	157	70 Å²	70	73%	0.734	41%	0.412	S	S	*	.	H	α-helix	trans	-67.8	-27.5	176.1	-76	-177.6	-6.4	0	0	113.5	V1035 I1036 G1041	V1035-Q1039 HydrophobicContact CG1-CG 4.4Å; V1035-Q1039 WeakPolarHBondContact O-CB 3.45Å; V1035-Q1039 VanDerWaalsContact O-CG 3.3Å; V1035-Q1039 WeakPolarHBondContact O-CG 3.41Å; V1035-Q1039 PolarHBondContact O-N 2.83Å; I1036-Q1039 CarbonylContact O-C 3.57Å; I1036-Q1039 PolarHBondContact O-N 3Å; Q1039-G1041 PolarHBondContact O-N 2.78Å
1040	A	51	Low	57.3	Low	64 Å²	64	70.4 Å²	70.4	53%	0.529	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-1	173.8	0	0	0	0	0	113.3	I1036 D1037 Y1038 Q1042	I1036-A1040 VanDerWaalsContact O-CB 3.24Å; I1036-A1040 WeakPolarHBondContact O-CB 3.32Å; I1036-A1040 PolarHBondContact O-N 2.85Å; D1037-A1040 PolarHBondContact O-N 3.39Å; Y1038-A1040 VanDerWaalsContact C-N 3.31Å; Y1038-A1040 PolarHBondContact O-N 2.87Å; A1040-Q1042 HydrophobicContact CB-CG 4.19Å; A1040-Q1042 PolarHBondContact O-N 3.1Å
1041	G	47.7	Very low	58.4	Low	51 Å²	51	70 Å²	70	53%	0.526	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	12.4	-175.9	0	0	0	0	0	113.9	D1037 Y1038 Q1039 T1043	D1037-G1041 PolarHBondContact O-N 3.25Å; Y1038-G1041 PolarHBondContact O-N 3.33Å; Y1038-G1041 VanDerWaalsContact O-N 3.15Å; Q1039-G1041 PolarHBondContact O-N 2.78Å; G1041-T1043 PolarHBondContact O-N 3.18Å
1042	Q	48.7	Very low	60	Low	128 Å²	128	66.5 Å²	66.5	60%	0.598	40%	0.396	S	S	*	.			trans	-75.7	65.5	175.4	-63.2	-168	21.7	0	0	110.6	D1037 A1040	D1037-Q1042 HydrophobicContact CB-CB 4.43Å; D1037-Q1042 WeakPolarHBondContact O-CB 3.48Å; D1037-Q1042 PolarHBondContact O-N 3.2Å; A1040-Q1042 HydrophobicContact CB-CG 4.19Å; A1040-Q1042 PolarHBondContact O-N 3.1Å
1043	T	49.8	Very low	61.6	Low	71 Å²	71	72.2 Å²	72.2	44%	0.436	43%	0.427	S	S	.	.			trans	-65.3	143.2	159.8	51.6	0	0	0	0	108.9	G1041 S1045	G1041-T1043 PolarHBondContact O-N 3.18Å; T1043-S1045 PolarHBondContact O-N 3.17Å; T1043-S1045 PolarHBondContact O-OG 3.15Å; T1043-S1045 VanDerWaalsContact OG1-CB 3.27Å; T1043-S1045 WeakPolarHBondContact OG1-CB 3.49Å; T1043-S1045 PolarHBondContact OG1-OG 3.4Å
1044	N	52.5	Low	63.5	Low	82 Å²	82	70.4 Å²	70.4	44%	0.439	41%	0.406	S	S	.	.	S	Bend	trans	-69.9	32.3	166.1	-107.1	9.6	0	0	0	112.5	V1029 T1030 A1046 M1047 V1048	V1029-N1044 PolarHBondContact O-ND2 2.99Å; T1030-N1044 HydrophobicContact CG2-CB 4.01Å; N1044-A1046 PolarHBondContact O-N 2.9Å; N1044-M1047 PolarHBondContact O-N 3.27Å; N1044-V1048 PolarHBondContact O-N 3.22Å
1045	S	61.5	Low	65.2	Low	46 Å²	46	70.5 Å²	70.5	32%	0.322	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-26.6	-173.8	47.2	0	0	0	0	113.1	T1043 M1047 V1048 N1049	T1043-S1045 PolarHBondContact O-N 3.17Å; T1043-S1045 PolarHBondContact O-OG 3.15Å; T1043-S1045 VanDerWaalsContact OG1-CB 3.27Å; T1043-S1045 WeakPolarHBondContact OG1-CB 3.49Å; T1043-S1045 PolarHBondContact OG1-OG 3.4Å; S1045-M1047 VanDerWaalsContact C-N 3.31Å; S1045-M1047 PolarHBondContact O-N 3.04Å; S1045-V1048 PolarHBondContact O-N 3.47Å; S1045-N1049 WeakPolarHBondContact O-CB 3.38Å; S1045-N1049 PolarHBondContact O-N 2.97Å; S1045-N1049 PolarHBondContact O-ND2 3.47Å; S1045-N1049 PolarHBondContact O-OD1 3.48Å
1046	A	68.4	Low	66.9	Low	84 Å²	84	67.3 Å²	67.3	69%	0.694	38%	0.381	S	S	*	.	H	α-helix	trans	-58.4	-41.1	172.4	0	0	0	0	0	112.6	N1044 A1050	N1044-A1046 PolarHBondContact O-N 2.9Å; A1046-A1050 VanDerWaalsContact O-CB 3.25Å; A1046-A1050 WeakPolarHBondContact O-CB 3.35Å; A1046-A1050 PolarHBondContact O-N 3.2Å; A1046-A1050 VanDerWaalsContact O-N 3.1Å
1047	M	75	Confident	68.7	Low	71 Å²	71	61.4 Å²	61.4	35%	0.35	35%	0.35	S	S	.	.	H	α-helix	trans	-78.1	-42.7	178.3	-171.3	64.4	76.9	0	0	111.5	L966 V1029 N1044 S1045 N1049 A1050 L1051	L966-M1047 HydrophobicContact CD2-SD 3.74Å; V1029-M1047 HydrophobicContact CG1-CB 3.93Å; V1029-M1047 HydrophobicContact CG1-CG 3.58Å; N1044-M1047 PolarHBondContact O-N 3.27Å; S1045-M1047 VanDerWaalsContact C-N 3.31Å; S1045-M1047 PolarHBondContact O-N 3.04Å; M1047-N1049 PolarHBondContact O-N 3.46Å; M1047-A1050 PolarHBondContact O-N 2.97Å; M1047-L1051 HydrophobicContact CG-CD1 4.1Å; M1047-L1051 WeakPolarHBondContact O-CB 3.48Å; M1047-L1051 WeakPolarHBondContact O-CG 3.22Å; M1047-L1051 PolarHBondContact O-N 3.15Å
1048	V	76.7	Confident	70.4	Confident	19 Å²	19	59.1 Å²	59.1	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-60	-44.4	176.2	170.1	0	0	0	0	111.6	V1029 T1030 N1044 S1045 L1051 N1052 F1058 F1074	V1029-V1048 HydrophobicContact CG1-CG2 3.81Å; T1030-V1048 HydrophobicContact CG2-CG2 3.38Å; N1044-V1048 PolarHBondContact O-N 3.22Å; S1045-V1048 PolarHBondContact O-N 3.47Å; V1048-L1051 PolarHBondContact O-N 3.44Å; V1048-N1052 WeakPolarHBondContact O-CB 3.47Å; V1048-N1052 PolarHBondContact O-N 3.16Å; V1048-N1052 PolarHBondContact O-ND2 2.95Å; V1048-F1058 HydrophobicContact CG1-CE2 4.29Å; V1048-F1058 HydrophobicContact CG1-CZ 3.95Å; V1048-F1058 HydrophobicContact CG2-CE2 4.23Å; V1048-F1074 HydrophobicContact CG1-CE2 4.31Å
1049	N	78.4	Confident	72.3	Confident	85 Å²	85	53.9 Å²	53.9	46%	0.455	32%	0.318	S	S	.	.	H	α-helix	trans	-67.2	-45.9	176.7	-65.7	-5	0	0	0	110.5	S1045 M1047 L1051 N1052 D1053	S1045-N1049 WeakPolarHBondContact O-CB 3.38Å; S1045-N1049 PolarHBondContact O-N 2.97Å; S1045-N1049 PolarHBondContact O-ND2 3.47Å; S1045-N1049 PolarHBondContact O-OD1 3.48Å; M1047-N1049 PolarHBondContact O-N 3.46Å; N1049-L1051 VanDerWaalsContact C-N 3.25Å; N1049-L1051 PolarHBondContact O-N 3.47Å; N1049-N1052 PolarHBondContact O-N 3Å; N1049-N1052 VanDerWaalsContact O-N 3.12Å; N1049-D1053 WeakPolarHBondContact O-CB 3.21Å; N1049-D1053 PolarHBondContact O-N 3.01Å
1050	A	81.3	Confident	73.7	Confident	23 Å²	23	47.1 Å²	47.1	19%	0.19	29%	0.286	C	S	.	.	H	α-helix	trans	-59.7	-35.4	177.4	0	0	0	0	0	112.8	L966 A1046 M1047 S1054	L966-A1050 HydrophobicContact CD2-CB 3.92Å; A1046-A1050 VanDerWaalsContact O-CB 3.25Å; A1046-A1050 WeakPolarHBondContact O-CB 3.35Å; A1046-A1050 PolarHBondContact O-N 3.2Å; A1046-A1050 VanDerWaalsContact O-N 3.1Å; M1047-A1050 PolarHBondContact O-N 2.97Å; A1050-S1054 WeakPolarHBondContact O-CB 3.23Å; A1050-S1054 PolarHBondContact O-N 3.22Å; A1050-S1054 PolarHBondContact O-OG 3.25Å
1051	L	85.3	Confident	75	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-71.1	-44	173	-74.5	163.8	0	0	0	112.3	L966 Y986 V1029 M1047 V1048 N1049 S1054 K1055 A1056 F1058	L966-L1051 HydrophobicContact CD1-CD2 3.71Å; L966-L1051 HydrophobicContact CD1-CG 4.19Å; Y986-L1051 HydrophobicContact CD1-CD1 3.69Å; Y986-L1051 HydrophobicContact CD1-CD2 3.84Å; Y986-L1051 HydrophobicContact CD1-CG 4.43Å; Y986-L1051 HydrophobicContact CD2-CD2 4Å; Y986-L1051 HydrophobicContact CE1-CD1 4.14Å; Y986-L1051 HydrophobicContact CG-CD1 4.26Å; Y986-L1051 HydrophobicContact CG-CD2 3.52Å; V1029-L1051 HydrophobicContact CG1-CD1 3.99Å; V1029-L1051 HydrophobicContact CG2-CD1 3.85Å; M1047-L1051 HydrophobicContact CG-CD1 4.1Å; M1047-L1051 WeakPolarHBondContact O-CB 3.48Å; M1047-L1051 WeakPolarHBondContact O-CG 3.22Å; M1047-L1051 PolarHBondContact O-N 3.15Å; V1048-L1051 PolarHBondContact O-N 3.44Å; N1049-L1051 VanDerWaalsContact C-N 3.25Å; N1049-L1051 PolarHBondContact O-N 3.47Å; L1051-S1054 CarbonylContact O-C 3.32Å; L1051-S1054 WeakPolarHBondContact O-CA 3.35Å; L1051-S1054 WeakPolarHBondContact O-CB 3.4Å; L1051-S1054 PolarHBondContact O-N 2.98Å; L1051-S1054 VanDerWaalsContact O-N 3.13Å; L1051-K1055 PolarHBondContact O-N 3.06Å; L1051-K1055 VanDerWaalsContact O-N 3.11Å; L1051-A1056 HydrophobicContact CB-CB 4.23Å; L1051-A1056 HydrophobicContact CD2-CB 3.76Å; L1051-A1056 WeakPolarHBondContact O-CB 3.31Å; L1051-A1056 PolarHBondContact O-N 2.79Å; L1051-F1058 HydrophobicContact CB-CD1 3.65Å; L1051-F1058 HydrophobicContact CB-CE1 3.6Å; L1051-F1058 HydrophobicContact CB-CZ 4.48Å; L1051-F1058 HydrophobicContact CD1-CB 4.25Å; L1051-F1058 HydrophobicContact CD1-CD1 3.78Å; L1051-F1058 HydrophobicContact CD1-CD2 4.45Å; L1051-F1058 HydrophobicContact CD1-CE1 4.3Å; L1051-F1058 HydrophobicContact CD1-CG 3.89Å; L1051-F1058 HydrophobicContact CG-CD1 4.22Å
1052	N	84	Confident	76.1	Confident	27 Å²	27	46.5 Å²	46.5	14%	0.144	26%	0.26	C	S	.	.	H	α-helix	trans	-60.8	-45.8	175.4	-74.8	-18.1	0	0	0	112.4	V1048 N1049 S1054 K1055 F1058 F1074 Y1076	V1048-N1052 WeakPolarHBondContact O-CB 3.47Å; V1048-N1052 PolarHBondContact O-N 3.16Å; V1048-N1052 PolarHBondContact O-ND2 2.95Å; N1049-N1052 PolarHBondContact O-N 3Å; N1049-N1052 VanDerWaalsContact O-N 3.12Å; N1052-S1054 PolarHBondContact O-N 3.22Å; N1052-K1055 WeakPolarHBondContact O-CA 3.37Å; N1052-K1055 PolarHBondContact O-N 3.35Å; N1052-F1058 WeakPolarHBondContact OD1-CE1 3.4Å; N1052-F1074 WeakPolarHBondContact ND2-CE2 3.33Å; N1052-F1074 WeakPolarHBondContact OD1-CD2 3.29Å; N1052-Y1076 HydrophobicContact CB-CD2 4.31Å; N1052-Y1076 HydrophobicContact CB-CE2 4.05Å
1053	D	84.4	Confident	76.9	Confident	134 Å²	134	41.3 Å²	41.3	72%	0.717	24%	0.241	S	C	*	.	H	α-helix	trans	-62	-29	175.3	-66	-23.2	0	0	0	111.4	N1049 K1055	N1049-D1053 WeakPolarHBondContact O-CB 3.21Å; N1049-D1053 PolarHBondContact O-N 3.01Å; D1053-K1055 VanDerWaalsContact C-N 3.31Å
1054	S	87.2	Confident	77.6	Confident	12 Å²	12	41.2 Å²	41.2	8%	0.084	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	5.2	173.6	-48.6	0	0	0	0	113.6	Q970 Q973 A1050 L1051 N1052 A1056	Q970-S1054 WeakPolarHBondContact CG-OG 3.46Å; Q970-S1054 PolarHBondContact NE2-OG 2.97Å; Q973-S1054 WeakPolarHBondContact CG-O 3.32Å; Q973-S1054 PolarHBondContact NE2-O 3.12Å; A1050-S1054 WeakPolarHBondContact O-CB 3.23Å; A1050-S1054 PolarHBondContact O-N 3.22Å; A1050-S1054 PolarHBondContact O-OG 3.25Å; L1051-S1054 CarbonylContact O-C 3.32Å; L1051-S1054 WeakPolarHBondContact O-CA 3.35Å; L1051-S1054 WeakPolarHBondContact O-CB 3.4Å; L1051-S1054 PolarHBondContact O-N 2.98Å; L1051-S1054 VanDerWaalsContact O-N 3.13Å; N1052-S1054 PolarHBondContact O-N 3.22Å; S1054-A1056 VanDerWaalsContact C-N 3.26Å; S1054-A1056 PolarHBondContact O-N 3.1Å
1055	K	86.8	Confident	78.2	Confident	75 Å²	75	40 Å²	40	33%	0.326	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	45.7	-176.4	-48.9	179.3	-168.1	176.5	0	112.4	Q973 L1051 N1052 D1053 N1078	Q973-K1055 PolarHBondContact NE2-O 2.97Å; L1051-K1055 PolarHBondContact O-N 3.06Å; L1051-K1055 VanDerWaalsContact O-N 3.11Å; N1052-K1055 WeakPolarHBondContact O-CA 3.37Å; N1052-K1055 PolarHBondContact O-N 3.35Å; D1053-K1055 VanDerWaalsContact C-N 3.31Å; K1055-N1078 HydrophobicContact CD-CB 4.22Å; K1055-N1078 PolarHBondContact NZ-OD1 3.18Å
1056	A	88	Confident	78.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.1	178.9	0	0	0	0	0	111.4	L969 C984 L1051 S1054 F1058	L969-A1056 HydrophobicContact CD1-CB 3.71Å; L969-A1056 HydrophobicContact CD2-CB 3.97Å; C984-A1056 CarbonylContact O-C 3.55Å; C984-A1056 VanDerWaalsContact O-CA 3.31Å; C984-A1056 WeakPolarHBondContact O-CA 3.41Å; L1051-A1056 HydrophobicContact CB-CB 4.23Å; L1051-A1056 HydrophobicContact CD2-CB 3.76Å; L1051-A1056 WeakPolarHBondContact O-CB 3.31Å; L1051-A1056 PolarHBondContact O-N 2.79Å; S1054-A1056 VanDerWaalsContact C-N 3.26Å; S1054-A1056 PolarHBondContact O-N 3.1Å; A1056-F1058 WeakPolarHBondContact O-CD1 3.3Å; A1056-F1058 WeakPolarHBondContact O-CE1 3.49Å
1057	S	87.6	Confident	78.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	147.1	166.9	-71.8	0	0	0	0	110.8	C984 V985 Y986 Y1072	C984-S1057 PolarHBondContact O-N 2.79Å; V985-S1057 CarbonylContact C-O 3.58Å; V985-S1057 WeakPolarHBondContact CA-O 3.27Å; Y986-S1057 PolarHBondContact N-O 3.11Å; S1057-Y1072 WeakPolarHBondContact CB-OH 3.49Å; S1057-Y1072 PolarHBondContact OG-OH 2.61Å
1058	F	85.8	Confident	78.3	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	169.7	-174.5	51.7	-88.2	0	0	0	109.9	V1029 V1048 L1051 N1052 A1056 Y1060 G1073 F1074	V1029-F1058 HydrophobicContact CB-CD2 4.12Å; V1029-F1058 HydrophobicContact CG2-CB 3.92Å; V1029-F1058 HydrophobicContact CG2-CD2 3.79Å; V1029-F1058 HydrophobicContact CG2-CG 4.05Å; V1048-F1058 HydrophobicContact CG1-CE2 4.29Å; V1048-F1058 HydrophobicContact CG1-CZ 3.95Å; V1048-F1058 HydrophobicContact CG2-CE2 4.23Å; L1051-F1058 HydrophobicContact CB-CD1 3.65Å; L1051-F1058 HydrophobicContact CB-CE1 3.6Å; L1051-F1058 HydrophobicContact CB-CZ 4.48Å; L1051-F1058 HydrophobicContact CD1-CB 4.25Å; L1051-F1058 HydrophobicContact CD1-CD1 3.78Å; L1051-F1058 HydrophobicContact CD1-CD2 4.45Å; L1051-F1058 HydrophobicContact CD1-CE1 4.3Å; L1051-F1058 HydrophobicContact CD1-CG 3.89Å; L1051-F1058 HydrophobicContact CG-CD1 4.22Å; N1052-F1058 WeakPolarHBondContact OD1-CE1 3.4Å; A1056-F1058 WeakPolarHBondContact O-CD1 3.3Å; A1056-F1058 WeakPolarHBondContact O-CE1 3.49Å; F1058-Y1060 HydrophobicContact CD2-CD1 4.42Å; F1058-Y1060 HydrophobicContact CE2-CD1 4.09Å; F1058-Y1060 HydrophobicContact CE2-CG 4.34Å; F1058-G1073 WeakPolarHBondContact O-CA 3.13Å; F1058-G1073 PolarHBondContact O-N 2.82Å; F1058-F1074 HydrophobicContact CZ-CD2 4.19Å; F1058-F1074 HydrophobicContact CZ-CE2 4.32Å
1059	V	88	Confident	78.5	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	137.8	173.4	175.9	0	0	0	0	110.7	V994 L997 A1021 V1028 V1029 T1070 L1071 Y1072	V994-V1059 HydrophobicContact CB-CG2 4.33Å; V994-V1059 HydrophobicContact CG1-CG2 3.77Å; V994-V1059 HydrophobicContact CG2-CB 4.43Å; V994-V1059 HydrophobicContact CG2-CG2 3.56Å; L997-V1059 HydrophobicContact CD2-CG2 4.13Å; A1021-V1059 HydrophobicContact CB-CB 4.44Å; A1021-V1059 HydrophobicContact CB-CG1 3.7Å; A1021-V1059 HydrophobicContact CB-CG2 3.84Å; V1028-V1059 HydrophobicContact CG1-CG1 4.07Å; V1029-V1059 PolarHBondContact N-O 3.08Å; V1059-T1070 HydrophobicContact CG1-CG2 3.24Å; V1059-L1071 WeakPolarHBondContact CA-O 3.44Å; V1059-Y1072 HydrophobicContact CG2-CD2 4.49Å
1060	Y	80.1	Confident	78.8	Confident	14 Å²	14	48.5 Å²	48.5	6%	0.055	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	153.4	-176.7	73	-81.1	0	0	0	111.5	N1017 F1018 T1030 F1058 L1062 L1071 Y1072	N1017-Y1060 PolarHBondContact OD1-OH 3.28Å; F1018-Y1060 WeakPolarHBondContact CD1-OH 3.5Å; F1018-Y1060 VanDerWaalsContact CE1-OH 3.31Å; F1018-Y1060 WeakPolarHBondContact CE1-OH 3.45Å; T1030-Y1060 WeakPolarHBondContact OG1-CB 3.27Å; F1058-Y1060 HydrophobicContact CD2-CD1 4.42Å; F1058-Y1060 HydrophobicContact CE2-CD1 4.09Å; F1058-Y1060 HydrophobicContact CE2-CG 4.34Å; Y1060-L1062 HydrophobicContact CD2-CD2 4.15Å; Y1060-L1062 HydrophobicContact CD2-CG 4.17Å; Y1060-L1062 HydrophobicContact CE2-CD1 4.07Å; Y1060-L1062 HydrophobicContact CE2-CD2 3.79Å; Y1060-L1062 HydrophobicContact CE2-CG 3.67Å; Y1060-L1071 WeakPolarHBondContact CD1-O 3.33Å; Y1060-L1071 HydrophobicContact CE1-CB 4.07Å; Y1060-L1071 PolarHBondContact N-O 3.22Å; Y1060-L1071 PolarHBondContact O-N 3.29Å; Y1060-Y1072 WeakPolarHBondContact CE1-O 3.48Å
1061	E	77.9	Confident	78.9	Confident	25 Å²	25	48.5 Å²	48.5	12%	0.117	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	139.7	173.7	-82.6	178.6	160.1	0	0	111.8	V1028 T1030 K1068 K1069	V1028-E1061 HydrophobicContact CB-CG 4.31Å; V1028-E1061 HydrophobicContact CG1-CG 4.3Å; V1028-E1061 HydrophobicContact CG2-CB 4.49Å; V1028-E1061 HydrophobicContact CG2-CG 3.9Å; T1030-E1061 PolarHBondContact OG1-N 2.74Å; T1030-E1061 PolarHBondContact OG1-O 3.48Å; E1061-K1068 VanDerWaalsContact CD-NZ 3.33Å; E1061-K1068 WeakPolarHBondContact OE1-CD 3.39Å; E1061-K1068 IonicContact OE1-NZ 2.67Å; E1061-K1068 PolarHBondContact OE1-NZ 3.44Å; E1061-K1068 WeakPolarHBondContact OE2-CE 3.46Å; E1061-K1068 IonicContact OE2-NZ 3.14Å; E1061-K1068 PolarHBondContact OE2-NZ 3.05Å; E1061-K1069 WeakPolarHBondContact CA-O 3.31Å
1062	L	70.8	Confident	79.1	Confident	78 Å²	78	48.5 Å²	48.5	41%	0.408	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	149.9	161.2	-65.7	-177.3	0	0	0	110.5	F1018 Y1060 K1068 K1069 L1071	F1018-L1062 HydrophobicContact CD1-CD1 4.38Å; F1018-L1062 HydrophobicContact CE1-CD1 4.39Å; Y1060-L1062 HydrophobicContact CD2-CD2 4.15Å; Y1060-L1062 HydrophobicContact CD2-CG 4.17Å; Y1060-L1062 HydrophobicContact CE2-CD1 4.07Å; Y1060-L1062 HydrophobicContact CE2-CD2 3.79Å; Y1060-L1062 HydrophobicContact CE2-CG 3.67Å; L1062-K1068 CarbonylContact O-C 3.43Å; L1062-K1068 VanDerWaalsContact O-CA 3.32Å; L1062-K1068 WeakPolarHBondContact O-CA 3.48Å; L1062-K1069 PolarHBondContact N-O 2.84Å; L1062-K1069 PolarHBondContact O-N 3.06Å; L1062-L1071 HydrophobicContact CD1-CD1 3.74Å; L1062-L1071 HydrophobicContact CG-CD1 4.16Å
1063	G	66.3	Low	78.6	Confident	19 Å²	19	47.2 Å²	47.2	20%	0.196	26%	0.261	C	S	.	.	S	Bend	trans	83.3	-173.1	-178.8	0	0	0	0	0	114
1064	F	63.6	Low	77.9	Confident	68 Å²	68	43.6 Å²	43.6	30%	0.298	24%	0.239	S	C	.	.	S	Bend	trans	-145.7	154.8	-178.5	57.2	-96.7	0	0	0	111.2	V1035 Y1038 S1066 Q1067	V1035-F1064 HydrophobicContact CG2-CD2 3.81Å; V1035-F1064 HydrophobicContact CG2-CE2 4.2Å; V1035-F1064 HydrophobicContact CG2-CG 4.4Å; Y1038-F1064 AromaticContact CD1-CD1 3.96Å; Y1038-F1064 HydrophobicContact CD1-CD1 3.96Å; Y1038-F1064 HydrophobicContact CD1-CE1 4.15Å; Y1038-F1064 HydrophobicContact CE1-CD1 4.24Å; Y1038-F1064 HydrophobicContact CE1-CE1 4.22Å; Y1038-F1064 HydrophobicContact CG-CD1 4.28Å; F1064-S1066 PolarHBondContact O-N 3.38Å; F1064-Q1067 PolarHBondContact O-N 3.41Å
1065	G	65.7	Low	77.2	Confident	58 Å²	58	43.1 Å²	43.1	60%	0.598	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	51.3	-133.4	-177.8	0	0	0	0	0	112.6	Q1067 K1068	G1065-Q1067 PolarHBondContact O-N 3.41Å; G1065-Q1067 VanDerWaalsContact O-N 3.1Å; G1065-K1068 WeakPolarHBondContact O-CB 3.25Å; G1065-K1068 WeakPolarHBondContact O-CG 3.04Å; G1065-K1068 PolarHBondContact O-N 3.26Å; G1065-K1068 VanDerWaalsContact O-N 3.14Å
1066	S	67	Low	76.9	Confident	137 Å²	137	43.5 Å²	43.5	96%	0.958	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-68	-2.6	178.5	-42.6	0	0	0	0	115.2	F1064	F1064-S1066 PolarHBondContact O-N 3.38Å
1067	Q	67.4	Low	76.5	Confident	143 Å²	143	43.6 Å²	43.6	67%	0.668	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-100.3	3.6	173.7	-66.5	-174.6	-17.1	0	0	113	F1064 G1065	F1064-Q1067 PolarHBondContact O-N 3.41Å; G1065-Q1067 PolarHBondContact O-N 3.41Å; G1065-Q1067 VanDerWaalsContact O-N 3.1Å
1068	K	72.8	Confident	76.1	Confident	66 Å²	66	43.9 Å²	43.9	29%	0.287	24%	0.238	S	C	.	.			trans	-57	136.9	174.2	-80.8	179.8	161.1	-145.3	0	111.4	N1031 E1061 L1062 G1065	N1031-K1068 PolarHBondContact OD1-NZ 3.05Å; N1031-K1068 VanDerWaalsContact OD1-NZ 3.11Å; E1061-K1068 VanDerWaalsContact CD-NZ 3.33Å; E1061-K1068 WeakPolarHBondContact OE1-CD 3.39Å; E1061-K1068 IonicContact OE1-NZ 2.67Å; E1061-K1068 PolarHBondContact OE1-NZ 3.44Å; E1061-K1068 WeakPolarHBondContact OE2-CE 3.46Å; E1061-K1068 IonicContact OE2-NZ 3.14Å; E1061-K1068 PolarHBondContact OE2-NZ 3.05Å; L1062-K1068 CarbonylContact O-C 3.43Å; L1062-K1068 VanDerWaalsContact O-CA 3.32Å; L1062-K1068 WeakPolarHBondContact O-CA 3.48Å; G1065-K1068 WeakPolarHBondContact O-CB 3.25Å; G1065-K1068 WeakPolarHBondContact O-CG 3.04Å; G1065-K1068 PolarHBondContact O-N 3.26Å; G1065-K1068 VanDerWaalsContact O-N 3.14Å
1069	K	80.3	Confident	75.5	Confident	118 Å²	118	44.7 Å²	44.7	51%	0.513	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.4	171.3	-80.8	-56.8	-166	178	0	110.7	D1022 E1061 L1062 L1071	D1022-K1069 IonicContact OD2-NZ 2.78Å; E1061-K1069 WeakPolarHBondContact CA-O 3.31Å; L1062-K1069 PolarHBondContact N-O 2.84Å; L1062-K1069 PolarHBondContact O-N 3.06Å; K1069-L1071 HydrophobicContact CB-CD2 4.49Å
1070	T	84	Confident	74.8	Confident	19 Å²	19	49.3 Å²	49.3	12%	0.117	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.1	-177.9	-56.3	0	0	0	0	109.1	A1021 D1022 V1028 V1059	A1021-T1070 HydrophobicContact CB-CG2 4.15Å; A1021-T1070 PolarHBondContact N-O 3.17Å; D1022-T1070 WeakPolarHBondContact OD1-CB 3.14Å; V1028-T1070 HydrophobicContact CG1-CG2 3.89Å; V1059-T1070 HydrophobicContact CG1-CG2 3.24Å
1071	L	84.9	Confident	74.6	Confident	23 Å²	23	49 Å²	49	12%	0.12	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	152.4	-165.7	-58.5	178.9	0	0	0	112.5	F1018 Q1019 V1059 Y1060 L1062 K1069	F1018-L1071 HydrophobicContact CB-CD1 4.26Å; F1018-L1071 HydrophobicContact CD1-CD1 4.06Å; Q1019-L1071 CarbonylContact O-C 3.54Å; Q1019-L1071 VanDerWaalsContact O-CA 3.32Å; Q1019-L1071 WeakPolarHBondContact O-CA 3.11Å; V1059-L1071 WeakPolarHBondContact CA-O 3.44Å; Y1060-L1071 WeakPolarHBondContact CD1-O 3.33Å; Y1060-L1071 HydrophobicContact CE1-CB 4.07Å; Y1060-L1071 PolarHBondContact N-O 3.22Å; Y1060-L1071 PolarHBondContact O-N 3.29Å; L1062-L1071 HydrophobicContact CD1-CD1 3.74Å; L1062-L1071 HydrophobicContact CG-CD1 4.16Å; K1069-L1071 HydrophobicContact CB-CD2 4.49Å
1072	Y	88.3	Confident	74.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	140.1	172.9	-166.6	-117.9	0	0	0	112	V994 L997 D998 I1001 F1016 F1018 Q1019 S1057 V1059 Y1060	V994-Y1072 HydrophobicContact CG1-CD2 4.2Å; V994-Y1072 HydrophobicContact CG1-CE2 3.75Å; L997-Y1072 HydrophobicContact CD2-CD2 3.78Å; L997-Y1072 HydrophobicContact CD2-CG 4.3Å; L997-Y1072 HydrophobicContact CG-CD2 4.24Å; D998-Y1072 HydrophobicContact CB-CE2 4.36Å; D998-Y1072 WeakPolarHBondContact CB-OH 3.37Å; D998-Y1072 PolarHBondContact OD2-OH 3.01Å; I1001-Y1072 HydrophobicContact CD1-CD1 3.4Å; I1001-Y1072 VanDerWaalsContact CD1-CD1 3.4Å; I1001-Y1072 HydrophobicContact CD1-CD2 4.41Å; I1001-Y1072 HydrophobicContact CD1-CE1 3.98Å; I1001-Y1072 HydrophobicContact CD1-CG 3.64Å; F1016-Y1072 HydrophobicContact CB-CD1 4.43Å; F1016-Y1072 HydrophobicContact CD1-CD1 4.5Å; F1016-Y1072 HydrophobicContact CD1-CE1 4.13Å; F1018-Y1072 PolarHBondContact N-O 3.29Å; Q1019-Y1072 PolarHBondContact O-N 2.72Å; S1057-Y1072 WeakPolarHBondContact CB-OH 3.49Å; S1057-Y1072 PolarHBondContact OG-OH 2.61Å; V1059-Y1072 HydrophobicContact CG2-CD2 4.49Å; Y1060-Y1072 WeakPolarHBondContact CE1-O 3.48Å
1073	G	73.1	Confident	75.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.269	C	S	.	.			trans	-63.1	-175.5	-177.3	0	0	0	0	0	115.7	N1017 F1058 G1075	N1017-G1073 WeakPolarHBondContact CA-O 3.43Å; F1058-G1073 WeakPolarHBondContact O-CA 3.13Å; F1058-G1073 PolarHBondContact O-N 2.82Å; G1073-G1075 PolarHBondContact O-N 2.87Å
1074	F	70.3	Confident	76	Confident	58 Å²	58	46.3 Å²	46.3	25%	0.254	26%	0.26	S	S	.	.			trans	-67.9	-6.8	-166.5	-64.2	-94.1	0	0	0	115.9	N1017 V1048 N1052 F1058 Y1076	N1017-F1074 WeakPolarHBondContact ND2-CD1 3.41Å; V1048-F1074 HydrophobicContact CG1-CE2 4.31Å; N1052-F1074 WeakPolarHBondContact ND2-CE2 3.33Å; N1052-F1074 WeakPolarHBondContact OD1-CD2 3.29Å; F1058-F1074 HydrophobicContact CZ-CD2 4.19Å; F1058-F1074 HydrophobicContact CZ-CE2 4.32Å; F1074-Y1076 VanDerWaalsContact C-N 3.32Å; F1074-Y1076 HydrophobicContact CB-CD1 4.47Å; F1074-Y1076 HydrophobicContact CB-CD2 3.62Å; F1074-Y1076 HydrophobicContact CB-CE1 4.22Å; F1074-Y1076 HydrophobicContact CB-CE2 3.31Å; F1074-Y1076 HydrophobicContact CB-CG 4.19Å; F1074-Y1076 HydrophobicContact CD1-CE2 4.29Å; F1074-Y1076 HydrophobicContact CD2-CE2 4.27Å; F1074-Y1076 HydrophobicContact CG-CD2 4.42Å; F1074-Y1076 AromaticContact CG-CE2 3.72Å; F1074-Y1076 HydrophobicContact CG-CE2 3.72Å; F1074-Y1076 PolarHBondContact O-N 2.85Å
1075	G	72	Confident	77	Confident	2 Å²	2	44.5 Å²	44.5	2%	0.021	25%	0.253	C	S	.	.			trans	65.7	30.8	179.5	0	0	0	0	0	113.8	G1073 T1083 E1084	G1073-G1075 PolarHBondContact O-N 2.87Å; G1075-T1083 CarbonylContact O-C 3.57Å; G1075-T1083 WeakPolarHBondContact O-CA 3.4Å; G1075-E1084 PolarHBondContact O-N 3.47Å
1076	Y	81.8	Confident	77.8	Confident	82 Å²	82	43 Å²	43	32%	0.322	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-72.7	143.9	178.5	-65.9	-49.3	0	0	0	111.8	N1052 F1074 T1083	N1052-Y1076 HydrophobicContact CB-CD2 4.31Å; N1052-Y1076 HydrophobicContact CB-CE2 4.05Å; F1074-Y1076 VanDerWaalsContact C-N 3.32Å; F1074-Y1076 HydrophobicContact CB-CD1 4.47Å; F1074-Y1076 HydrophobicContact CB-CD2 3.62Å; F1074-Y1076 HydrophobicContact CB-CE1 4.22Å; F1074-Y1076 HydrophobicContact CB-CE2 3.31Å; F1074-Y1076 HydrophobicContact CB-CG 4.19Å; F1074-Y1076 HydrophobicContact CD1-CE2 4.29Å; F1074-Y1076 HydrophobicContact CD2-CE2 4.27Å; F1074-Y1076 HydrophobicContact CG-CD2 4.42Å; F1074-Y1076 AromaticContact CG-CE2 3.72Å; F1074-Y1076 HydrophobicContact CG-CE2 3.72Å; F1074-Y1076 PolarHBondContact O-N 2.85Å; Y1076-T1083 HydrophobicContact CD1-CG2 3.8Å; Y1076-T1083 HydrophobicContact CE1-CG2 4.19Å
1077	M	79.6	Confident	78.6	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.01	19%	0.187	C	C	.	.			trans	-134.7	158.2	177.1	-61	-158.3	-48.7	0	0	112.1	K958 V983 F1081 G1082 E1084 Q1087	K958-M1077 HydrophobicContact CD-SD 4.39Å; V983-M1077 HydrophobicContact CG2-CG 4Å; V983-M1077 HydrophobicContact CG2-SD 3.67Å; M1077-F1081 HydrophobicContact CE-CB 3.57Å; M1077-F1081 HydrophobicContact CE-CD2 3.89Å; M1077-F1081 HydrophobicContact CE-CG 3.92Å; M1077-G1082 PolarHBondContact N-O 2.65Å; M1077-E1084 HydrophobicContact CG-CB 4.09Å; M1077-E1084 HydrophobicContact SD-CB 3.95Å; M1077-E1084 HydrophobicContact SD-CG 3.96Å; M1077-Q1087 HydrophobicContact CE-CB 3.63Å; M1077-Q1087 HydrophobicContact CE-CG 4.31Å; M1077-Q1087 VanDerWaalsContact CE-OE1 3.31Å; M1077-Q1087 PolarHBondContact SD-OE1 2.84Å
1078	N	79.3	Confident	79.6	Confident	7 Å²	7	29.7 Å²	29.7	4%	0.037	16%	0.155	C	C	.	.	S	Bend	trans	-76.2	160.6	176	-158.5	18	0	0	0	113	G977 M979 T980 Y982 K1055	G977-N1078 PolarHBondContact O-ND2 3.02Å; M979-N1078 CarbonylContact O-C 3.14Å; M979-N1078 WeakPolarHBondContact O-CB 3.33Å; M979-N1078 PolarHBondContact O-ND2 3.14Å; T980-N1078 WeakPolarHBondContact CB-O 3.34Å; T980-N1078 PolarHBondContact OG1-O 2.63Å; Y982-N1078 HydrophobicContact CE1-CB 4.12Å; Y982-N1078 VanDerWaalsContact OH-CB 3.26Å; Y982-N1078 WeakPolarHBondContact OH-CB 3.43Å; Y982-N1078 PolarHBondContact OH-ND2 2.78Å; K1055-N1078 HydrophobicContact CD-CB 4.22Å; K1055-N1078 PolarHBondContact NZ-OD1 3.18Å
1079	G	73.3	Confident	80.3	Confident	16 Å²	16	27.3 Å²	27.3	17%	0.165	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	-151	-179.4	0	0	0	0	0	115.6	D978 M979 F1081	D978-G1079 WeakPolarHBondContact O-CA 3.07Å; M979-G1079 PolarHBondContact O-N 2.95Å; G1079-F1081 PolarHBondContact O-N 3.24Å
1080	N	71.4	Confident	80.4	Confident	101 Å²	101	22 Å²	22	54%	0.54	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-11.1	-161	-72.4	-26.5	0	0	0	116.3	T980	T980-N1080 PolarHBondContact OG1-N 3.43Å
1081	F	76.9	Confident	80.3	Confident	6 Å²	6	21.1 Å²	21.1	3%	0.026	12%	0.118	C	C	.	.	S	Bend	trans	-74.1	-42	173.6	-68	-73.1	0	0	0	111.7	N954 T955 T980 M1077 G1079 T1083 V1086 Q1087 E1090	N954-F1081 WeakPolarHBondContact O-CE2 3.22Å; N954-F1081 VanDerWaalsContact O-CZ 3.29Å; N954-F1081 WeakPolarHBondContact O-CZ 3.34Å; T955-F1081 HydrophobicContact CG2-CZ 4.46Å; T980-F1081 HydrophobicContact CG2-CD2 4.12Å; T980-F1081 HydrophobicContact CG2-CE2 4.01Å; T980-F1081 VanDerWaalsContact OG1-CD2 3.3Å; T980-F1081 WeakPolarHBondContact OG1-CD2 3.12Å; M1077-F1081 HydrophobicContact CE-CB 3.57Å; M1077-F1081 HydrophobicContact CE-CD2 3.89Å; M1077-F1081 HydrophobicContact CE-CG 3.92Å; G1079-F1081 PolarHBondContact O-N 3.24Å; F1081-T1083 PolarHBondContact O-N 3.14Å; F1081-V1086 HydrophobicContact CD1-CG1 4.38Å; F1081-Q1087 HydrophobicContact CB-CB 4.45Å; F1081-Q1087 HydrophobicContact CD1-CB 3.62Å; F1081-Q1087 HydrophobicContact CD1-CG 4.17Å; F1081-Q1087 HydrophobicContact CD2-CB 4.13Å; F1081-Q1087 HydrophobicContact CD2-CG 4.2Å; F1081-Q1087 HydrophobicContact CE1-CB 3.7Å; F1081-Q1087 HydrophobicContact CE1-CG 3.76Å; F1081-Q1087 HydrophobicContact CE2-CB 4.24Å; F1081-Q1087 HydrophobicContact CE2-CG 3.84Å; F1081-Q1087 HydrophobicContact CG-CB 3.84Å; F1081-Q1087 HydrophobicContact CG-CG 4.37Å; F1081-Q1087 HydrophobicContact CZ-CB 4.03Å; F1081-Q1087 HydrophobicContact CZ-CG 3.6Å; F1081-E1090 WeakPolarHBondContact CE1-OE2 3.38Å
1082	G	75.7	Confident	80.4	Confident	29 Å²	29	20.1 Å²	20.1	30%	0.299	11%	0.113	S	C	.	.			trans	77.3	-48.2	-176.8	0	0	0	0	0	113.9	M1077	M1077-G1082 PolarHBondContact N-O 2.65Å
1083	T	82.6	Confident	80.2	Confident	36 Å²	36	20.4 Å²	20.4	22%	0.221	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-132.2	156.5	173.5	50.5	0	0	0	0	111.9	G1075 Y1076 F1081 D1085 V1086	G1075-T1083 CarbonylContact O-C 3.57Å; G1075-T1083 WeakPolarHBondContact O-CA 3.4Å; Y1076-T1083 HydrophobicContact CD1-CG2 3.8Å; Y1076-T1083 HydrophobicContact CE1-CG2 4.19Å; F1081-T1083 PolarHBondContact O-N 3.14Å; T1083-D1085 WeakPolarHBondContact CB-OD1 3.31Å; T1083-D1085 PolarHBondContact OG1-OD1 2.75Å; T1083-V1086 PolarHBondContact O-N 3.13Å
1084	E	86.8	Confident	80.5	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-70	-39	-173.5	-167.3	-165.4	158.1	0	0	113.7	K958 V983 F1016 G1075 M1077 V1086 Q1087 L1088	K958-E1084 HydrophobicContact CD-CG 4.02Å; K958-E1084 VanDerWaalsContact NZ-CD 3.27Å; K958-E1084 IonicContact NZ-OE1 3.59Å; K958-E1084 PolarHBondContact NZ-OE1 2.95Å; K958-E1084 IonicContact NZ-OE2 3.29Å; V983-E1084 HydrophobicContact CG2-CG 4.41Å; F1016-E1084 WeakPolarHBondContact CD1-OE2 3.16Å; F1016-E1084 HydrophobicContact CE1-CG 4.24Å; F1016-E1084 WeakPolarHBondContact CE1-OE1 3.3Å; F1016-E1084 WeakPolarHBondContact CE1-OE2 3.27Å; F1016-E1084 HydrophobicContact CZ-CG 4.24Å; F1016-E1084 VanDerWaalsContact CZ-OE1 3.22Å; F1016-E1084 WeakPolarHBondContact CZ-OE1 3.26Å; G1075-E1084 PolarHBondContact O-N 3.47Å; M1077-E1084 HydrophobicContact CG-CB 4.09Å; M1077-E1084 HydrophobicContact SD-CB 3.95Å; M1077-E1084 HydrophobicContact SD-CG 3.96Å; E1084-V1086 PolarHBondContact O-N 2.86Å; E1084-Q1087 PolarHBondContact O-N 3.14Å; E1084-L1088 PolarHBondContact O-N 2.89Å
1085	D	84.2	Confident	81	Confident	30 Å²	30	19.4 Å²	19.4	16%	0.16	11%	0.11	C	C	.	.	H	α-helix	trans	-53.4	-42.8	174.4	53.8	-2.5	0	0	0	111.6	F1016 T1083 Q1087 L1088 N1089	F1016-D1085 HydrophobicContact CD2-CB 3.98Å; F1016-D1085 HydrophobicContact CE2-CB 4.38Å; T1083-D1085 WeakPolarHBondContact CB-OD1 3.31Å; T1083-D1085 PolarHBondContact OG1-OD1 2.75Å; D1085-Q1087 VanDerWaalsContact C-N 3.34Å; D1085-Q1087 PolarHBondContact O-N 3.28Å; D1085-L1088 PolarHBondContact O-N 3.06Å; D1085-N1089 WeakPolarHBondContact O-CB 3.22Å; D1085-N1089 PolarHBondContact O-N 3.47Å; D1085-N1089 PolarHBondContact O-ND2 2.79Å; D1085-N1089 PolarHBondContact O-OD1 3.25Å
1086	V	81.8	Confident	81.6	Confident	26 Å²	26	20.6 Å²	20.6	16%	0.158	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-38.1	176	178.9	0	0	0	0	112.1	F1081 T1083 E1084 E1090	F1081-V1086 HydrophobicContact CD1-CG1 4.38Å; T1083-V1086 PolarHBondContact O-N 3.13Å; E1084-V1086 PolarHBondContact O-N 2.86Å; V1086-E1090 WeakPolarHBondContact CG1-OE1 3.19Å; V1086-E1090 WeakPolarHBondContact O-CB 3.36Å; V1086-E1090 VanDerWaalsContact O-CG 3.25Å; V1086-E1090 WeakPolarHBondContact O-CG 3.41Å; V1086-E1090 PolarHBondContact O-N 2.87Å
1087	Q	84.6	Confident	81.8	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-69.6	-48	176	-178.2	-169.3	22.9	0	0	111.8	F922 N954 A957 K958 G981 M1077 F1081 E1084 D1085 N1089 E1090 S1091	F922-Q1087 HydrophobicContact CE2-CG 4.29Å; F922-Q1087 HydrophobicContact CZ-CG 3.96Å; N954-Q1087 PolarHBondContact O-NE2 2.89Å; A957-Q1087 PolarHBondContact O-NE2 2.67Å; A957-Q1087 VanDerWaalsContact O-NE2 3.1Å; K958-Q1087 VanDerWaalsContact CG-OE1 3.23Å; G981-Q1087 VanDerWaalsContact CA-NE2 3.34Å; M1077-Q1087 HydrophobicContact CE-CB 3.63Å; M1077-Q1087 HydrophobicContact CE-CG 4.31Å; M1077-Q1087 VanDerWaalsContact CE-OE1 3.31Å; M1077-Q1087 PolarHBondContact SD-OE1 2.84Å; F1081-Q1087 HydrophobicContact CB-CB 4.45Å; F1081-Q1087 HydrophobicContact CD1-CB 3.62Å; F1081-Q1087 HydrophobicContact CD1-CG 4.17Å; F1081-Q1087 HydrophobicContact CD2-CB 4.13Å; F1081-Q1087 HydrophobicContact CD2-CG 4.2Å; F1081-Q1087 HydrophobicContact CE1-CB 3.7Å; F1081-Q1087 HydrophobicContact CE1-CG 3.76Å; F1081-Q1087 HydrophobicContact CE2-CB 4.24Å; F1081-Q1087 HydrophobicContact CE2-CG 3.84Å; F1081-Q1087 HydrophobicContact CG-CB 3.84Å; F1081-Q1087 HydrophobicContact CG-CG 4.37Å; F1081-Q1087 HydrophobicContact CZ-CB 4.03Å; F1081-Q1087 HydrophobicContact CZ-CG 3.6Å; E1084-Q1087 PolarHBondContact O-N 3.14Å; D1085-Q1087 VanDerWaalsContact C-N 3.34Å; D1085-Q1087 PolarHBondContact O-N 3.28Å; Q1087-N1089 VanDerWaalsContact C-N 3.33Å; Q1087-N1089 PolarHBondContact O-N 3.42Å; Q1087-E1090 PolarHBondContact O-N 3.49Å; Q1087-S1091 VanDerWaalsContact O-CB 3.25Å; Q1087-S1091 WeakPolarHBondContact O-CB 3.45Å; Q1087-S1091 PolarHBondContact O-N 2.99Å
1088	L	88.5	Confident	81.6	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-44.6	179.9	-172.7	79.7	0	0	0	111.1	K711 F922 V1005 Y1007 F1016 E1084 D1085 S1091 A1092	K711-L1088 HydrophobicContact CB-CD1 4.04Å; K711-L1088 HydrophobicContact CD-CD1 4.46Å; K711-L1088 HydrophobicContact CG-CD1 3.87Å; F922-L1088 HydrophobicContact CD1-CD1 3.48Å; F922-L1088 VanDerWaalsContact CD1-CD1 3.48Å; F922-L1088 HydrophobicContact CD2-CD1 4.47Å; F922-L1088 HydrophobicContact CE1-CB 4.31Å; F922-L1088 HydrophobicContact CE1-CD1 3.34Å; F922-L1088 HydrophobicContact CE1-CG 4.43Å; F922-L1088 HydrophobicContact CE2-CD1 4.36Å; F922-L1088 HydrophobicContact CG-CD1 4.07Å; F922-L1088 HydrophobicContact CZ-CB 4.2Å; F922-L1088 HydrophobicContact CZ-CD1 3.82Å; V1005-L1088 HydrophobicContact CB-CD2 4.25Å; V1005-L1088 HydrophobicContact CG2-CD2 3.57Å; Y1007-L1088 WeakPolarHBondContact OH-CD2 3.3Å; Y1007-L1088 VanDerWaalsContact OH-CG 3.31Å; Y1007-L1088 WeakPolarHBondContact OH-CG 3.42Å; F1016-L1088 HydrophobicContact CE2-CD2 3.94Å; F1016-L1088 HydrophobicContact CZ-CD2 4.02Å; E1084-L1088 PolarHBondContact O-N 2.89Å; D1085-L1088 PolarHBondContact O-N 3.06Å; L1088-S1091 WeakPolarHBondContact O-CB 3.37Å; L1088-S1091 PolarHBondContact O-N 3.41Å; L1088-A1092 WeakPolarHBondContact O-CB 3.2Å; L1088-A1092 PolarHBondContact O-N 2.65Å
1089	N	87.6	Confident	81.5	Confident	16 Å²	16	19 Å²	19	9%	0.086	11%	0.113	C	C	.	.	H	α-helix	trans	-65	-42.3	178.6	-70.1	-14.3	0	0	0	112.3	Y1007 D1085 Q1087 L1093 V1138	Y1007-N1089 VanDerWaalsContact CE1-OD1 3.27Å; Y1007-N1089 WeakPolarHBondContact CE1-OD1 3.31Å; Y1007-N1089 PolarHBondContact OH-N 2.69Å; Y1007-N1089 PolarHBondContact OH-OD1 3.5Å; D1085-N1089 WeakPolarHBondContact O-CB 3.22Å; D1085-N1089 PolarHBondContact O-N 3.47Å; D1085-N1089 PolarHBondContact O-ND2 2.79Å; D1085-N1089 PolarHBondContact O-OD1 3.25Å; Q1087-N1089 VanDerWaalsContact C-N 3.33Å; Q1087-N1089 PolarHBondContact O-N 3.42Å; N1089-L1093 PolarHBondContact O-N 2.87Å; N1089-L1093 VanDerWaalsContact O-N 3.16Å; N1089-V1138 HydrophobicContact CB-CB 4.35Å; N1089-V1138 HydrophobicContact CB-CG1 3.79Å; N1089-V1138 HydrophobicContact CB-CG2 3.7Å
1090	E	81.6	Confident	81.9	Confident	7 Å²	7	19.7 Å²	19.7	3%	0.033	11%	0.114	C	C	.	.	H	α-helix	trans	-59.6	-53.9	170	-79.3	179.7	-150.8	0	0	110.3	K685 F1081 V1086 Q1087 A1092 L1093 E1094 Y1194 K1204	K685-E1090 IonicContact NZ-OE2 3.83Å; K685-E1090 PolarHBondContact NZ-OE2 3.38Å; F1081-E1090 WeakPolarHBondContact CE1-OE2 3.38Å; V1086-E1090 WeakPolarHBondContact CG1-OE1 3.19Å; V1086-E1090 WeakPolarHBondContact O-CB 3.36Å; V1086-E1090 VanDerWaalsContact O-CG 3.25Å; V1086-E1090 WeakPolarHBondContact O-CG 3.41Å; V1086-E1090 PolarHBondContact O-N 2.87Å; Q1087-E1090 PolarHBondContact O-N 3.49Å; E1090-A1092 PolarHBondContact O-N 3.04Å; E1090-A1092 VanDerWaalsContact O-N 3.14Å; E1090-L1093 WeakPolarHBondContact O-CB 3.34Å; E1090-L1093 PolarHBondContact O-N 2.99Å; E1090-E1094 WeakPolarHBondContact O-CG 3.39Å; E1090-E1094 PolarHBondContact O-N 2.98Å; E1090-Y1194 WeakPolarHBondContact CG-OH 3.39Å; E1090-K1204 WeakPolarHBondContact OE1-CD 3.32Å; E1090-K1204 WeakPolarHBondContact OE1-CE 3.27Å; E1090-K1204 IonicContact OE1-NZ 3.61Å; E1090-K1204 PolarHBondContact OE1-NZ 3.18Å
1091	S	82.7	Confident	82.2	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.007	9%	0.091	C	C	.	.	H	α-helix	trans	-55.6	-33.4	-179.1	-163.1	0	0	0	0	113.8	K711 F922 T955 Q1087 L1088 Q1095	K711-S1091 PolarHBondContact NZ-O 3.47Å; K711-S1091 PolarHBondContact NZ-OG 3.02Å; F922-S1091 WeakPolarHBondContact CE2-OG 3.42Å; T955-S1091 WeakPolarHBondContact O-CB 3.25Å; T955-S1091 PolarHBondContact O-OG 3.17Å; Q1087-S1091 VanDerWaalsContact O-CB 3.25Å; Q1087-S1091 WeakPolarHBondContact O-CB 3.45Å; Q1087-S1091 PolarHBondContact O-N 2.99Å; L1088-S1091 WeakPolarHBondContact O-CB 3.37Å; L1088-S1091 PolarHBondContact O-N 3.41Å; S1091-Q1095 PolarHBondContact O-N 2.7Å
1092	A	86.2	Confident	82.1	Confident	2 Å²	2	15.7 Å²	15.7	2%	0.017	9%	0.094	C	C	.	.	H	α-helix	trans	-75.6	-39.7	176.3	0	0	0	0	0	112.4	Y1007 L1088 E1090 N1096 F1133	Y1007-A1092 HydrophobicContact CD1-CB 4.15Å; Y1007-A1092 HydrophobicContact CD2-CB 3.53Å; Y1007-A1092 HydrophobicContact CE1-CB 4.02Å; Y1007-A1092 HydrophobicContact CE2-CB 3.37Å; Y1007-A1092 HydrophobicContact CG-CB 3.92Å; L1088-A1092 WeakPolarHBondContact O-CB 3.2Å; L1088-A1092 PolarHBondContact O-N 2.65Å; E1090-A1092 PolarHBondContact O-N 3.04Å; E1090-A1092 VanDerWaalsContact O-N 3.14Å; A1092-N1096 WeakPolarHBondContact O-CB 3.22Å; A1092-N1096 PolarHBondContact O-N 3.28Å; A1092-F1133 VanDerWaalsContact C-CZ 3.47Å; A1092-F1133 HydrophobicContact CB-CE1 3.73Å; A1092-F1133 HydrophobicContact CB-CZ 3.92Å; A1092-F1133 WeakPolarHBondContact O-CZ 3.48Å
1093	L	85.2	Confident	82	Confident	5 Å²	5	16.3 Å²	16.3	3%	0.026	9%	0.091	C	C	.	.	H	α-helix	trans	-64.6	-44.1	174.9	175.6	58.8	0	0	0	111.4	N1089 E1090 N1096 I1097 L1130 F1133 I1139 Y1194	N1089-L1093 PolarHBondContact O-N 2.87Å; N1089-L1093 VanDerWaalsContact O-N 3.16Å; E1090-L1093 WeakPolarHBondContact O-CB 3.34Å; E1090-L1093 PolarHBondContact O-N 2.99Å; L1093-N1096 PolarHBondContact O-N 2.94Å; L1093-I1097 HydrophobicContact CD1-CD1 3.75Å; L1093-I1097 HydrophobicContact CD1-CG1 4.1Å; L1093-I1097 HydrophobicContact CG-CD1 3.89Å; L1093-I1097 WeakPolarHBondContact O-CG1 3.35Å; L1093-I1097 PolarHBondContact O-N 2.82Å; L1093-L1130 HydrophobicContact CD1-CD2 4.19Å; L1093-L1130 HydrophobicContact CD2-CD2 4.36Å; L1093-F1133 HydrophobicContact CB-CD1 3.77Å; L1093-F1133 HydrophobicContact CB-CE1 3.95Å; L1093-F1133 HydrophobicContact CB-CG 4.19Å; L1093-F1133 HydrophobicContact CD1-CB 3.89Å; L1093-F1133 HydrophobicContact CD1-CD1 4.19Å; L1093-F1133 HydrophobicContact CD1-CD2 3.93Å; L1093-F1133 HydrophobicContact CD1-CG 3.7Å; L1093-F1133 HydrophobicContact CG-CD1 4.5Å; L1093-F1133 HydrophobicContact CG-CG 4.47Å; L1093-I1139 HydrophobicContact CD2-CD1 4.15Å; L1093-Y1194 HydrophobicContact CD2-CE1 4.3Å; L1093-Y1194 HydrophobicContact CD2-CE2 4.44Å
1094	E	78.8	Confident	81.5	Confident	7 Å²	7	15.2 Å²	15.2	3%	0.033	9%	0.085	C	C	.	.	H	α-helix	trans	-61.4	-46.3	179.5	-58.8	-162.9	139.4	0	0	111.4	M687 T955 E1090 N1096 I1097 Q1098 N1206	M687-E1094 HydrophobicContact CE-CB 4.14Å; M687-E1094 HydrophobicContact CE-CG 3.68Å; M687-E1094 HydrophobicContact SD-CB 4.29Å; M687-E1094 HydrophobicContact SD-CG 4.43Å; T955-E1094 WeakPolarHBondContact CB-OE2 3.24Å; T955-E1094 PolarHBondContact OG1-OE2 2.94Å; E1090-E1094 WeakPolarHBondContact O-CG 3.39Å; E1090-E1094 PolarHBondContact O-N 2.98Å; E1094-N1096 PolarHBondContact O-N 3.1Å; E1094-I1097 PolarHBondContact O-N 3.48Å; E1094-Q1098 WeakPolarHBondContact O-CG 3.17Å; E1094-Q1098 PolarHBondContact O-N 3.29Å; E1094-N1206 PolarHBondContact OE1-ND2 3.17Å
1095	Q	80	Confident	80.7	Confident	30 Å²	30	18.9 Å²	18.9	14%	0.14	11%	0.105	C	C	.	.	H	α-helix	trans	-67.4	-31.1	176.4	-76	-178.1	-18.4	0	0	113.6	T708 S919 S1091 A1099	T708-Q1095 HydrophobicContact CG2-CB 4.08Å; S919-Q1095 PolarHBondContact O-NE2 2.93Å; S1091-Q1095 PolarHBondContact O-N 2.7Å; Q1095-A1099 WeakPolarHBondContact O-CB 3.46Å; Q1095-A1099 PolarHBondContact O-N 3.49Å
1096	N	86	Confident	79.9	Confident	27 Å²	27	21.9 Å²	21.9	14%	0.144	12%	0.124	C	C	.	.	H	α-helix	trans	-73.4	-35	175.9	-165.9	-108.2	0	0	0	112.3	T708 A1092 L1093 E1094 T1100 P1129 F1133	T708-N1096 PolarHBondContact OG1-ND2 2.88Å; A1092-N1096 WeakPolarHBondContact O-CB 3.22Å; A1092-N1096 PolarHBondContact O-N 3.28Å; L1093-N1096 PolarHBondContact O-N 2.94Å; E1094-N1096 PolarHBondContact O-N 3.1Å; N1096-T1100 VanDerWaalsContact O-CB 3.31Å; N1096-T1100 WeakPolarHBondContact O-CB 3.43Å; N1096-T1100 PolarHBondContact O-N 2.94Å; N1096-T1100 PolarHBondContact O-OG1 3.1Å; N1096-P1129 VanDerWaalsContact OD1-CB 3.3Å; N1096-P1129 WeakPolarHBondContact OD1-CB 3.48Å; N1096-F1133 HydrophobicContact CB-CD2 4.49Å; N1096-F1133 HydrophobicContact CB-CE2 3.59Å; N1096-F1133 HydrophobicContact CB-CZ 4.1Å
1097	I	84.2	Confident	79.1	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-66.9	-46	170.8	-67.5	165.1	0	0	0	110.8	M687 L1093 E1094 A1099 T1100 V1101 L1126 P1129 I1192 I1208	M687-I1097 HydrophobicContact CE-CD1 4.22Å; M687-I1097 HydrophobicContact SD-CG2 4.38Å; L1093-I1097 HydrophobicContact CD1-CD1 3.75Å; L1093-I1097 HydrophobicContact CD1-CG1 4.1Å; L1093-I1097 HydrophobicContact CG-CD1 3.89Å; L1093-I1097 WeakPolarHBondContact O-CG1 3.35Å; L1093-I1097 PolarHBondContact O-N 2.82Å; E1094-I1097 PolarHBondContact O-N 3.48Å; I1097-A1099 PolarHBondContact O-N 3Å; I1097-T1100 PolarHBondContact O-N 3.41Å; I1097-V1101 HydrophobicContact CG2-CG2 4.29Å; I1097-V1101 WeakPolarHBondContact O-CG2 3.41Å; I1097-V1101 PolarHBondContact O-N 3.31Å; I1097-L1126 HydrophobicContact CG2-CD2 3.56Å; I1097-P1129 HydrophobicContact CG1-CB 3.86Å; I1097-P1129 HydrophobicContact CG1-CG 3.74Å; I1097-I1192 HydrophobicContact CD1-CD1 4.13Å; I1097-I1208 HydrophobicContact CD1-CD1 4.28Å; I1097-I1208 HydrophobicContact CG2-CD1 3.67Å
1098	Q	75.5	Confident	78.1	Confident	44 Å²	44	28.2 Å²	28.2	21%	0.206	16%	0.163	C	C	.	.	H	α-helix	trans	-52.6	-55.4	174.6	-77.6	168.8	-16.6	0	0	111.1	L689 Q951 E1094 T1100 V1101 V1102	L689-Q1098 HydrophobicContact CD2-CB 4.38Å; L689-Q1098 HydrophobicContact CD2-CG 3.56Å; Q951-Q1098 VanDerWaalsContact NE2-NE2 3.14Å; E1094-Q1098 WeakPolarHBondContact O-CG 3.17Å; E1094-Q1098 PolarHBondContact O-N 3.29Å; Q1098-T1100 VanDerWaalsContact C-N 3.34Å; Q1098-T1100 PolarHBondContact O-N 2.94Å; Q1098-V1101 PolarHBondContact O-N 3.17Å; Q1098-V1102 WeakPolarHBondContact O-CG2 3.14Å; Q1098-V1102 PolarHBondContact O-N 2.94Å
1099	A	78.5	Confident	76.6	Confident	13 Å²	13	36.3 Å²	36.3	11%	0.107	21%	0.207	C	C	.	.	H	α-helix	trans	-58.4	-43.1	178.3	0	0	0	0	0	112.5	Q1095 I1097 V1102 N1103	Q1095-A1099 WeakPolarHBondContact O-CB 3.46Å; Q1095-A1099 PolarHBondContact O-N 3.49Å; I1097-A1099 PolarHBondContact O-N 3Å; A1099-V1102 PolarHBondContact O-N 2.86Å; A1099-N1103 WeakPolarHBondContact O-CB 3.02Å; A1099-N1103 PolarHBondContact O-N 2.88Å; A1099-N1103 PolarHBondContact O-ND2 2.62Å
1100	T	81.9	Confident	75.3	Confident	30 Å²	30	43.3 Å²	43.3	18%	0.184	24%	0.236	C	C	.	.	H	α-helix	trans	-60.7	-45.9	178	-62.6	0	0	0	0	112.2	N1096 I1097 Q1098 A1104 L1125 P1129	N1096-T1100 VanDerWaalsContact O-CB 3.31Å; N1096-T1100 WeakPolarHBondContact O-CB 3.43Å; N1096-T1100 PolarHBondContact O-N 2.94Å; N1096-T1100 PolarHBondContact O-OG1 3.1Å; I1097-T1100 PolarHBondContact O-N 3.41Å; Q1098-T1100 VanDerWaalsContact C-N 3.34Å; Q1098-T1100 PolarHBondContact O-N 2.94Å; T1100-A1104 PolarHBondContact O-N 3.43Å; T1100-A1104 VanDerWaalsContact O-N 3.1Å; T1100-L1125 HydrophobicContact CG2-CD1 3.71Å; T1100-L1125 HydrophobicContact CG2-CG 4.41Å; T1100-P1129 HydrophobicContact CG2-CG 4.42Å
1101	V	77.1	Confident	74.3	Confident	9 Å²	9	45.1 Å²	45.1	6%	0.055	25%	0.247	C	C	.	.	H	α-helix	trans	-69.4	-42.1	-179.8	176.7	0	0	0	0	111.3	L689 I1097 Q1098 N1103 A1104 L1105 L1125 L1126 T1210	L689-V1101 HydrophobicContact CD1-CB 3.89Å; L689-V1101 HydrophobicContact CD1-CG1 3.56Å; L689-V1101 HydrophobicContact CD1-CG2 4.25Å; I1097-V1101 HydrophobicContact CG2-CG2 4.29Å; I1097-V1101 WeakPolarHBondContact O-CG2 3.41Å; I1097-V1101 PolarHBondContact O-N 3.31Å; Q1098-V1101 PolarHBondContact O-N 3.17Å; V1101-N1103 PolarHBondContact O-N 2.89Å; V1101-A1104 PolarHBondContact O-N 2.73Å; V1101-L1105 HydrophobicContact CG1-CD1 4.04Å; V1101-L1105 HydrophobicContact CG1-CG 4.42Å; V1101-L1105 WeakPolarHBondContact O-CG 3.34Å; V1101-L1105 PolarHBondContact O-N 2.64Å; V1101-L1125 HydrophobicContact CG2-CD2 4.26Å; V1101-L1126 HydrophobicContact CG2-CD2 4.07Å; V1101-T1210 HydrophobicContact CG1-CG2 4.45Å
1102	V	74	Confident	73.7	Confident	15 Å²	15	51.7 Å²	51.7	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-43.6	176.6	176.6	0	0	0	0	111	I694 F706 Q1098 A1099 A1104 L1105 V1106	I694-V1102 HydrophobicContact CD1-CG2 3.56Å; I694-V1102 HydrophobicContact CG1-CG2 4.08Å; I694-V1102 HydrophobicContact CG2-CG1 4.2Å; F706-V1102 HydrophobicContact CD2-CB 4.45Å; F706-V1102 HydrophobicContact CD2-CG1 3.5Å; F706-V1102 VanDerWaalsContact CD2-CG1 3.5Å; F706-V1102 HydrophobicContact CE2-CG1 3.53Å; F706-V1102 HydrophobicContact CG-CG1 4.05Å; F706-V1102 HydrophobicContact CZ-CG1 4.09Å; Q1098-V1102 WeakPolarHBondContact O-CG2 3.14Å; Q1098-V1102 PolarHBondContact O-N 2.94Å; A1099-V1102 PolarHBondContact O-N 2.86Å; V1102-A1104 VanDerWaalsContact C-N 3.3Å; V1102-A1104 PolarHBondContact O-N 2.89Å; V1102-L1105 PolarHBondContact O-N 3.21Å; V1102-L1105 VanDerWaalsContact O-N 3.14Å; V1102-V1106 HydrophobicContact CG1-CG2 4.25Å; V1102-V1106 WeakPolarHBondContact O-CG2 3.22Å; V1102-V1106 PolarHBondContact O-N 3.42Å
1103	N	75.4	Confident	72.5	Confident	42 Å²	42	54.9 Å²	54.9	23%	0.225	29%	0.292	C	S	.	.	H	α-helix	trans	-62.1	-35.4	176.1	-73	-34.2	0	0	0	112.9	A705 F706 A1099 V1101 S1107	A705-N1103 WeakPolarHBondContact CA-OD1 3.45Å; F706-N1103 PolarHBondContact N-OD1 2.96Å; F706-N1103 PolarHBondContact O-ND2 2.86Å; A1099-N1103 WeakPolarHBondContact O-CB 3.02Å; A1099-N1103 PolarHBondContact O-N 2.88Å; A1099-N1103 PolarHBondContact O-ND2 2.62Å; V1101-N1103 PolarHBondContact O-N 2.89Å; N1103-S1107 WeakPolarHBondContact O-CB 3.41Å; N1103-S1107 PolarHBondContact O-N 3.01Å; N1103-S1107 VanDerWaalsContact O-N 3.13Å; N1103-S1107 PolarHBondContact O-OG 3.5Å
1104	A	71.8	Confident	71.4	Confident	13 Å²	13	62.1 Å²	62.1	11%	0.107	32%	0.319	C	S	.	.	H	α-helix	trans	-69.7	-37.4	173	0	0	0	0	0	112.8	T1100 V1101 V1102 S1107 L1108 L1125	T1100-A1104 PolarHBondContact O-N 3.43Å; T1100-A1104 VanDerWaalsContact O-N 3.1Å; V1101-A1104 PolarHBondContact O-N 2.73Å; V1102-A1104 VanDerWaalsContact C-N 3.3Å; V1102-A1104 PolarHBondContact O-N 2.89Å; A1104-S1107 PolarHBondContact O-OG 2.81Å; A1104-L1108 VanDerWaalsContact O-CB 3.29Å; A1104-L1108 WeakPolarHBondContact O-CB 3.4Å; A1104-L1108 VanDerWaalsContact O-CG 3.27Å; A1104-L1108 WeakPolarHBondContact O-CG 3.4Å; A1104-L1108 PolarHBondContact O-N 3.03Å; A1104-L1125 HydrophobicContact CB-CD1 3.57Å; A1104-L1125 HydrophobicContact CB-CD2 3.78Å; A1104-L1125 HydrophobicContact CB-CG 4.35Å
1105	L	69.7	Low	71.1	Confident	78 Å²	78	64.2 Å²	64.2	41%	0.408	34%	0.342	S	S	.	.	H	α-helix	trans	-69.3	-37.6	175.8	-70.2	170.1	0	0	0	112.4	V1101 V1102 V1111	V1101-L1105 HydrophobicContact CG1-CD1 4.04Å; V1101-L1105 HydrophobicContact CG1-CG 4.42Å; V1101-L1105 WeakPolarHBondContact O-CG 3.34Å; V1101-L1105 PolarHBondContact O-N 2.64Å; V1102-L1105 PolarHBondContact O-N 3.21Å; V1102-L1105 VanDerWaalsContact O-N 3.14Å; L1105-V1111 HydrophobicContact CD2-CG2 4.16Å
1106	V	66.4	Low	70.9	Confident	92 Å²	92	66.5 Å²	66.5	56%	0.558	37%	0.367	S	S	*	.	H	α-helix	trans	-70.4	-31.9	176.9	171.3	0	0	0	0	112.1	F706 V1102	F706-V1106 HydrophobicContact CE2-CG2 4.3Å; V1102-V1106 HydrophobicContact CG1-CG2 4.25Å; V1102-V1106 WeakPolarHBondContact O-CG2 3.22Å; V1102-V1106 PolarHBondContact O-N 3.42Å
1107	S	65.6	Low	70.2	Confident	89 Å²	89	70.2 Å²	70.2	62%	0.622	39%	0.387	S	S	*	.	H	α-helix	trans	-88.3	-10.9	-179.4	54.2	0	0	0	0	115	N1103 A1104	N1103-S1107 WeakPolarHBondContact O-CB 3.41Å; N1103-S1107 PolarHBondContact O-N 3.01Å; N1103-S1107 VanDerWaalsContact O-N 3.13Å; N1103-S1107 PolarHBondContact O-OG 3.5Å; A1104-S1107 PolarHBondContact O-OG 2.81Å
1108	L	63.1	Low	69.6	Low	71 Å²	71	70.2 Å²	70.2	37%	0.372	39%	0.387	S	S	.	.			trans	-120.8	105.6	-175.3	-63.5	174.4	0	0	0	112.6	A1104 K1110 V1111 F1121	A1104-L1108 VanDerWaalsContact O-CB 3.29Å; A1104-L1108 WeakPolarHBondContact O-CB 3.4Å; A1104-L1108 VanDerWaalsContact O-CG 3.27Å; A1104-L1108 WeakPolarHBondContact O-CG 3.4Å; A1104-L1108 PolarHBondContact O-N 3.03Å; L1108-K1110 PolarHBondContact O-N 3.16Å; L1108-V1111 HydrophobicContact CB-CG2 3.95Å; L1108-V1111 HydrophobicContact CD1-CG2 4.06Å; L1108-F1121 HydrophobicContact CD1-CE2 3.79Å; L1108-F1121 HydrophobicContact CD1-CZ 3.45Å; L1108-F1121 VanDerWaalsContact CD1-CZ 3.45Å
1109	N	58	Low	69.7	Low	171 Å²	171	71.2 Å²	71.2	91%	0.914	39%	0.391	S	S	*	.	S	Bend	trans	-48.2	-32.9	177.8	-78.2	-22.8	0	0	0	114.9
1110	K	59.3	Low	69.7	Low	163 Å²	163	76.3 Å²	76.3	71%	0.709	41%	0.412	S	S	*	.			trans	-149	133	173.7	-62.8	-168.6	179	-170.1	0	109.9	L1108	L1108-K1110 PolarHBondContact O-N 3.16Å
1111	V	62.1	Low	69.7	Low	44 Å²	44	78.3 Å²	78.3	27%	0.267	42%	0.418	S	S	.	.			trans	-107.8	129.8	173.6	-179.9	0	0	0	0	109.7	L1105 L1108 L1113 F1121	L1105-V1111 HydrophobicContact CD2-CG2 4.16Å; L1108-V1111 HydrophobicContact CB-CG2 3.95Å; L1108-V1111 HydrophobicContact CD1-CG2 4.06Å; V1111-L1113 HydrophobicContact CG1-CD2 3.99Å; V1111-L1113 PolarHBondContact O-N 3.45Å; V1111-F1121 HydrophobicContact CG1-CD1 3.94Å; V1111-F1121 HydrophobicContact CG1-CE1 3.54Å; V1111-F1121 HydrophobicContact CG1-CZ 4.37Å
1112	K	68.4	Low	69.8	Low	139 Å²	139	78.5 Å²	78.5	60%	0.604	42%	0.42	S	S	*	.			trans	-72.6	122.4	168.6	-83.7	-176.3	173.1	177.5	0	108.7	D1117 A1118	K1112-D1117 IonicContact NZ-OD2 2.68Å; K1112-D1117 PolarHBondContact NZ-OD2 2.93Å; K1112-A1118 HydrophobicContact CB-CB 4.19Å; K1112-A1118 WeakPolarHBondContact O-CB 3.41Å
1113	L	61.4	Low	70.2	Confident	69 Å²	69	79.4 Å²	79.4	36%	0.361	43%	0.426	S	S	.	.			trans	-97.1	-20.5	173.5	-54.8	-176.9	0	0	0	113.4	V1111 A1118 I1178 R1186 V1188	V1111-L1113 HydrophobicContact CG1-CD2 3.99Å; V1111-L1113 PolarHBondContact O-N 3.45Å; L1113-A1118 WeakPolarHBondContact O-CB 3.38Å; L1113-I1178 HydrophobicContact CB-CD1 4.31Å; L1113-I1178 WeakPolarHBondContact O-CD1 3.34Å; L1113-R1186 WeakPolarHBondContact CD1-O 3.48Å; L1113-V1188 HydrophobicContact CB-CG2 3.79Å; L1113-V1188 HydrophobicContact CD1-CG2 4.2Å; L1113-V1188 HydrophobicContact CD2-CG2 3.82Å; L1113-V1188 HydrophobicContact CG-CG2 4.12Å
1114	R	63.4	Low	70.6	Confident	158 Å²	158	80.9 Å²	80.9	60%	0.596	44%	0.437	S	S	*	.	S	Bend	trans	-110.5	149.7	-174.3	-57.3	-173.6	-169.5	175.8	7.6	113.2	A1118 I1178 I1183	R1114-A1118 WeakPolarHBondContact O-CB 3.38Å; R1114-I1178 HydrophobicContact CG-CD1 4.05Å; R1114-I1183 VanDerWaalsContact NH2-CG2 3.27Å
1115	G	70.9	Confident	71.2	Confident	50 Å²	50	82 Å²	82	52%	0.515	44%	0.441	S	S	.	.	S	Bend	trans	93.1	172.7	177.5	0	0	0	0	0	113.9	D1117 A1118 K1119	G1115-D1117 PolarHBondContact O-N 3.47Å; G1115-A1118 WeakPolarHBondContact O-CB 3.49Å; G1115-A1118 PolarHBondContact O-N 2.99Å; G1115-K1119 PolarHBondContact O-N 3.34Å
1116	A	76.2	Confident	72	Confident	79 Å²	79	78.3 Å²	78.3	65%	0.653	42%	0.422	S	S	*	.	H	α-helix	trans	-60.1	-44.6	-179.3	0	0	0	0	0	112	A1118 K1119 Q1120	A1116-A1118 PolarHBondContact O-N 3.25Å; A1116-K1119 PolarHBondContact O-N 3.38Å; A1116-Q1120 PolarHBondContact O-N 3.14Å
1117	D	71.8	Confident	73.1	Confident	105 Å²	105	75.3 Å²	75.3	56%	0.561	41%	0.405	S	S	*	.	H	α-helix	trans	-53.8	-39.2	176.2	-43	-16.5	0	0	0	112.4	K1112 G1115 Q1120 F1121	K1112-D1117 IonicContact NZ-OD2 2.68Å; K1112-D1117 PolarHBondContact NZ-OD2 2.93Å; G1115-D1117 PolarHBondContact O-N 3.47Å; D1117-Q1120 PolarHBondContact O-N 3.37Å; D1117-F1121 WeakPolarHBondContact O-CB 3.41Å; D1117-F1121 PolarHBondContact O-N 3.47Å
1118	A	70.7	Confident	74.1	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.008	40%	0.402	C	S	.	.	H	α-helix	trans	-71.9	-43.2	-179.2	0	0	0	0	0	111.9	K1112 L1113 R1114 G1115 A1116 Q1120 F1121 V1122	K1112-A1118 HydrophobicContact CB-CB 4.19Å; K1112-A1118 WeakPolarHBondContact O-CB 3.41Å; L1113-A1118 WeakPolarHBondContact O-CB 3.38Å; R1114-A1118 WeakPolarHBondContact O-CB 3.38Å; G1115-A1118 WeakPolarHBondContact O-CB 3.49Å; G1115-A1118 PolarHBondContact O-N 2.99Å; A1116-A1118 PolarHBondContact O-N 3.25Å; A1118-Q1120 VanDerWaalsContact C-N 3.27Å; A1118-Q1120 PolarHBondContact O-N 3.01Å; A1118-F1121 PolarHBondContact O-N 3.49Å; A1118-V1122 WeakPolarHBondContact O-CG2 3.25Å; A1118-V1122 PolarHBondContact O-N 3.47Å
1119	K	78.4	Confident	75.4	Confident	65 Å²	65	72 Å²	72	28%	0.283	38%	0.384	S	S	.	.	H	α-helix	trans	-60	-40.5	172.5	-66.1	-163	177.7	-168.7	0	111	G1115 A1116 S1123 V1175 D1177	G1115-K1119 PolarHBondContact O-N 3.34Å; A1116-K1119 PolarHBondContact O-N 3.38Å; K1119-S1123 VanDerWaalsContact O-CB 3.26Å; K1119-S1123 WeakPolarHBondContact O-CB 3.24Å; K1119-S1123 PolarHBondContact O-N 3.48Å; K1119-V1175 HydrophobicContact CB-CB 4.08Å; K1119-V1175 HydrophobicContact CB-CG1 4.26Å; K1119-V1175 HydrophobicContact CD-CB 4.3Å; K1119-V1175 HydrophobicContact CD-CG1 4.46Å; K1119-V1175 WeakPolarHBondContact CE-O 3.3Å; K1119-V1175 HydrophobicContact CG-CB 4.01Å; K1119-V1175 HydrophobicContact CG-CG1 3.86Å; K1119-V1175 PolarHBondContact NZ-O 3.06Å; K1119-D1177 WeakPolarHBondContact CE-OD1 3.18Å; K1119-D1177 IonicContact NZ-OD1 3.45Å; K1119-D1177 PolarHBondContact NZ-OD1 2.95Å; K1119-D1177 IonicContact NZ-OD2 2.77Å; K1119-D1177 PolarHBondContact NZ-OD2 3.05Å; K1119-D1177 VanDerWaalsContact NZ-OD2 3.11Å
1120	Q	79.2	Confident	77	Confident	119 Å²	119	64 Å²	64	56%	0.556	34%	0.341	S	S	*	.	H	α-helix	trans	-65.4	-45.6	175.7	-173.9	57.5	58.8	0	0	111.9	A1116 D1117 A1118 S1123 T1124	A1116-Q1120 PolarHBondContact O-N 3.14Å; D1117-Q1120 PolarHBondContact O-N 3.37Å; A1118-Q1120 VanDerWaalsContact C-N 3.27Å; A1118-Q1120 PolarHBondContact O-N 3.01Å; Q1120-S1123 PolarHBondContact O-N 2.92Å; Q1120-T1124 PolarHBondContact NE2-OG1 2.85Å; Q1120-T1124 VanDerWaalsContact NE2-OG1 3.09Å; Q1120-T1124 WeakPolarHBondContact O-CB 3.37Å; Q1120-T1124 PolarHBondContact O-N 3.39Å; Q1120-T1124 PolarHBondContact O-OG1 2.88Å
1121	F	80.3	Confident	78.5	Confident	73 Å²	73	59.7 Å²	59.7	32%	0.32	33%	0.326	S	S	.	.	H	α-helix	trans	-57.5	-50.5	176.5	171	-96.7	0	0	0	112	L1108 V1111 D1117 A1118 S1123 T1124 L1125	L1108-F1121 HydrophobicContact CD1-CE2 3.79Å; L1108-F1121 HydrophobicContact CD1-CZ 3.45Å; L1108-F1121 VanDerWaalsContact CD1-CZ 3.45Å; V1111-F1121 HydrophobicContact CG1-CD1 3.94Å; V1111-F1121 HydrophobicContact CG1-CE1 3.54Å; V1111-F1121 HydrophobicContact CG1-CZ 4.37Å; D1117-F1121 WeakPolarHBondContact O-CB 3.41Å; D1117-F1121 PolarHBondContact O-N 3.47Å; A1118-F1121 PolarHBondContact O-N 3.49Å; F1121-S1123 VanDerWaalsContact C-N 3.34Å; F1121-S1123 PolarHBondContact O-N 3.06Å; F1121-T1124 PolarHBondContact O-N 3.21Å; F1121-L1125 HydrophobicContact CE1-CD2 4.22Å; F1121-L1125 HydrophobicContact CZ-CD2 4.35Å; F1121-L1125 WeakPolarHBondContact O-CB 3.27Å; F1121-L1125 PolarHBondContact O-N 3.09Å
1122	V	80.1	Confident	79.8	Confident	13 Å²	13	60.2 Å²	60.2	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-63.7	-39.6	179	173.7	0	0	0	0	111.4	A1118 L1125 L1126 V1175 V1190	A1118-V1122 WeakPolarHBondContact O-CG2 3.25Å; A1118-V1122 PolarHBondContact O-N 3.47Å; V1122-L1125 PolarHBondContact O-N 2.91Å; V1122-L1126 HydrophobicContact CG1-CD1 3.94Å; V1122-L1126 WeakPolarHBondContact O-CB 3.28Å; V1122-L1126 WeakPolarHBondContact O-CG 3.47Å; V1122-L1126 PolarHBondContact O-N 3.5Å; V1122-L1126 VanDerWaalsContact O-N 3.08Å; V1122-V1175 HydrophobicContact CB-CG2 4.01Å; V1122-V1175 HydrophobicContact CG1-CG1 4.45Å; V1122-V1175 HydrophobicContact CG1-CG2 3.81Å; V1122-V1190 HydrophobicContact CG1-CG2 3.68Å
1123	S	82.1	Confident	81	Confident	33 Å²	33	53.8 Å²	53.8	23%	0.231	30%	0.299	C	S	.	.	H	α-helix	trans	-64.8	-42.9	175.8	-169.1	0	0	0	0	112.4	K1119 Q1120 F1121 L1126 S1127 I1173	K1119-S1123 VanDerWaalsContact O-CB 3.26Å; K1119-S1123 WeakPolarHBondContact O-CB 3.24Å; K1119-S1123 PolarHBondContact O-N 3.48Å; Q1120-S1123 PolarHBondContact O-N 2.92Å; F1121-S1123 VanDerWaalsContact C-N 3.34Å; F1121-S1123 PolarHBondContact O-N 3.06Å; S1123-L1126 PolarHBondContact O-N 2.95Å; S1123-S1127 WeakPolarHBondContact O-CB 3.48Å; S1123-S1127 PolarHBondContact O-N 2.78Å; S1123-I1173 WeakPolarHBondContact O-CD1 3.31Å
1124	T	83.4	Confident	82.4	Confident	74 Å²	74	52.9 Å²	52.9	45%	0.454	29%	0.292	S	S	.	.	H	α-helix	trans	-65.1	-44.7	175.8	-67.1	0	0	0	0	111.5	Q1120 F1121 L1126 S1127	Q1120-T1124 PolarHBondContact NE2-OG1 2.85Å; Q1120-T1124 VanDerWaalsContact NE2-OG1 3.09Å; Q1120-T1124 WeakPolarHBondContact O-CB 3.37Å; Q1120-T1124 PolarHBondContact O-N 3.39Å; Q1120-T1124 PolarHBondContact O-OG1 2.88Å; F1121-T1124 PolarHBondContact O-N 3.21Å; T1124-L1126 VanDerWaalsContact C-N 3.32Å; T1124-L1126 PolarHBondContact O-N 3.43Å; T1124-S1127 PolarHBondContact O-N 3.43Å; T1124-S1127 VanDerWaalsContact O-N 3.17Å; T1124-S1127 PolarHBondContact O-OG 3.02Å
1125	L	83.8	Confident	83.6	Confident	35 Å²	35	48.9 Å²	48.9	18%	0.183	29%	0.285	C	S	.	.	H	α-helix	trans	-56.7	-44	176.4	176.9	60.6	0	0	0	112.4	T1100 V1101 A1104 F1121 V1122 P1129	T1100-L1125 HydrophobicContact CG2-CD1 3.71Å; T1100-L1125 HydrophobicContact CG2-CG 4.41Å; V1101-L1125 HydrophobicContact CG2-CD2 4.26Å; A1104-L1125 HydrophobicContact CB-CD1 3.57Å; A1104-L1125 HydrophobicContact CB-CD2 3.78Å; A1104-L1125 HydrophobicContact CB-CG 4.35Å; F1121-L1125 HydrophobicContact CE1-CD2 4.22Å; F1121-L1125 HydrophobicContact CZ-CD2 4.35Å; F1121-L1125 WeakPolarHBondContact O-CB 3.27Å; F1121-L1125 PolarHBondContact O-N 3.09Å; V1122-L1125 PolarHBondContact O-N 2.91Å; L1125-P1129 WeakPolarHBondContact O-CD 3.45Å
1126	L	88.1	Confident	84.5	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-79.3	-16.3	179.9	-66.7	173.2	0	0	0	113.7	I1097 V1101 V1122 S1123 T1124 T1128 P1129 L1130 I1173 V1190 I1208	I1097-L1126 HydrophobicContact CG2-CD2 3.56Å; V1101-L1126 HydrophobicContact CG2-CD2 4.07Å; V1122-L1126 HydrophobicContact CG1-CD1 3.94Å; V1122-L1126 WeakPolarHBondContact O-CB 3.28Å; V1122-L1126 WeakPolarHBondContact O-CG 3.47Å; V1122-L1126 PolarHBondContact O-N 3.5Å; V1122-L1126 VanDerWaalsContact O-N 3.08Å; S1123-L1126 PolarHBondContact O-N 2.95Å; T1124-L1126 VanDerWaalsContact C-N 3.32Å; T1124-L1126 PolarHBondContact O-N 3.43Å; L1126-T1128 VanDerWaalsContact C-N 3.35Å; L1126-T1128 PolarHBondContact O-N 3.42Å; L1126-P1129 WeakPolarHBondContact O-CD 3.31Å; L1126-P1129 WeakPolarHBondContact O-CG 3.49Å; L1126-L1130 WeakPolarHBondContact O-CD1 3.38Å; L1126-L1130 WeakPolarHBondContact O-CG 3.48Å; L1126-I1173 HydrophobicContact CB-CD1 4.12Å; L1126-I1173 HydrophobicContact CD1-CG2 4.44Å; L1126-V1190 HydrophobicContact CD1-CB 4.27Å; L1126-V1190 HydrophobicContact CD1-CG1 3.84Å; L1126-V1190 HydrophobicContact CD1-CG2 4.05Å; L1126-I1208 HydrophobicContact CD2-CD1 4.25Å
1127	S	88.4	Confident	85	Confident	28 Å²	28	43.7 Å²	43.7	20%	0.196	24%	0.239	C	C	.	.	H	α-helix	trans	-68	-32	176.5	74	0	0	0	0	113	S1123 T1124 L1130 N1131	S1123-S1127 WeakPolarHBondContact O-CB 3.48Å; S1123-S1127 PolarHBondContact O-N 2.78Å; T1124-S1127 PolarHBondContact O-N 3.43Å; T1124-S1127 VanDerWaalsContact O-N 3.17Å; T1124-S1127 PolarHBondContact O-OG 3.02Å; S1127-L1130 PolarHBondContact O-N 2.92Å; S1127-N1131 WeakPolarHBondContact O-CB 3.44Å; S1127-N1131 PolarHBondContact O-N 3.22Å; S1127-N1131 PolarHBondContact O-ND2 3.25Å; S1127-N1131 VanDerWaalsContact O-ND2 3.13Å
1128	T	87.7	Confident	85.8	Confident	91 Å²	91	39 Å²	39	56%	0.558	22%	0.215	S	C	*	.	H	α-helix	trans	-59.7	-55.8	179.3	-60	0	0	0	0	113.3	L1126 L1130 N1131 L1132	L1126-T1128 VanDerWaalsContact C-N 3.35Å; L1126-T1128 PolarHBondContact O-N 3.42Å; T1128-L1130 VanDerWaalsContact C-N 3.34Å; T1128-L1130 PolarHBondContact O-N 2.77Å; T1128-N1131 PolarHBondContact O-N 3.46Å; T1128-L1132 PolarHBondContact O-N 2.91Å
1129	P	89.2	Confident	86.7	Confident	1 Å²	1	39 Å²	39	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-35.8	177.8	24.4	-34.4	0	0	0	112.3	N1096 I1097 T1100 L1125 L1126 N1131 L1132 F1133	N1096-P1129 VanDerWaalsContact OD1-CB 3.3Å; N1096-P1129 WeakPolarHBondContact OD1-CB 3.48Å; I1097-P1129 HydrophobicContact CG1-CB 3.86Å; I1097-P1129 HydrophobicContact CG1-CG 3.74Å; T1100-P1129 HydrophobicContact CG2-CG 4.42Å; L1125-P1129 WeakPolarHBondContact O-CD 3.45Å; L1126-P1129 WeakPolarHBondContact O-CD 3.31Å; L1126-P1129 WeakPolarHBondContact O-CG 3.49Å; P1129-N1131 PolarHBondContact O-N 3.25Å; P1129-L1132 PolarHBondContact O-N 3.44Å; P1129-F1133 WeakPolarHBondContact O-CB 3.1Å; P1129-F1133 WeakPolarHBondContact O-CD2 3.48Å; P1129-F1133 PolarHBondContact O-N 3.12Å
1130	L	92	Very high	86.9	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-36.1	176.7	-66.2	170.8	0	0	0	112.5	L1093 L1126 S1127 T1128 K1134 I1139 Y1171 I1173 I1192	L1093-L1130 HydrophobicContact CD1-CD2 4.19Å; L1093-L1130 HydrophobicContact CD2-CD2 4.36Å; L1126-L1130 WeakPolarHBondContact O-CD1 3.38Å; L1126-L1130 WeakPolarHBondContact O-CG 3.48Å; S1127-L1130 PolarHBondContact O-N 2.92Å; T1128-L1130 VanDerWaalsContact C-N 3.34Å; T1128-L1130 PolarHBondContact O-N 2.77Å; L1130-K1134 WeakPolarHBondContact O-CB 3.43Å; L1130-K1134 PolarHBondContact O-N 3.16Å; L1130-I1139 HydrophobicContact CB-CD1 4.36Å; L1130-I1139 HydrophobicContact CD2-CD1 3.61Å; L1130-Y1171 HydrophobicContact CB-CD1 4.04Å; L1130-Y1171 HydrophobicContact CB-CD2 4.33Å; L1130-Y1171 HydrophobicContact CB-CE1 3.87Å; L1130-Y1171 HydrophobicContact CB-CE2 4.18Å; L1130-Y1171 HydrophobicContact CB-CG 4.27Å; L1130-Y1171 HydrophobicContact CD1-CD2 3.71Å; L1130-Y1171 HydrophobicContact CD1-CE2 3.91Å; L1130-Y1171 HydrophobicContact CD1-CG 4.18Å; L1130-I1173 HydrophobicContact CD1-CD1 3.71Å; L1130-I1173 HydrophobicContact CD1-CG1 3.77Å; L1130-I1192 HydrophobicContact CD1-CD1 4.27Å; L1130-I1192 HydrophobicContact CD1-CG2 3.96Å; L1130-I1192 HydrophobicContact CD2-CG2 3.98Å
1131	N	91	Very high	87.1	Confident	74 Å²	74	37 Å²	37	40%	0.396	21%	0.212	S	C	.	.	H	α-helix	trans	-69.5	-39.8	173.9	-71.3	-26.8	0	0	0	112	S1127 T1128 P1129 K1134 T1135 Y1171	S1127-N1131 WeakPolarHBondContact O-CB 3.44Å; S1127-N1131 PolarHBondContact O-N 3.22Å; S1127-N1131 PolarHBondContact O-ND2 3.25Å; S1127-N1131 VanDerWaalsContact O-ND2 3.13Å; T1128-N1131 PolarHBondContact O-N 3.46Å; P1129-N1131 PolarHBondContact O-N 3.25Å; N1131-K1134 WeakPolarHBondContact O-CB 3.32Å; N1131-K1134 PolarHBondContact O-N 2.87Å; N1131-T1135 PolarHBondContact O-N 3.25Å; N1131-T1135 PolarHBondContact O-OG1 2.83Å; N1131-Y1171 WeakPolarHBondContact OD1-CE1 3.37Å; N1131-Y1171 PolarHBondContact OD1-OH 2.8Å
1132	L	90.3	Very high	87	Confident	55 Å²	55	33.9 Å²	33.9	29%	0.288	20%	0.201	S	C	.	.	H	α-helix	trans	-59.5	-48	172.6	174.8	62	0	0	0	111.1	T1128 P1129 K1134 T1135 N1136	T1128-L1132 PolarHBondContact O-N 2.91Å; P1129-L1132 PolarHBondContact O-N 3.44Å; L1132-K1134 PolarHBondContact O-N 3.26Å; L1132-T1135 WeakPolarHBondContact CA-OG1 3.4Å; L1132-T1135 PolarHBondContact O-N 2.92Å; L1132-T1135 PolarHBondContact O-OG1 2.88Å; L1132-N1136 PolarHBondContact O-N 3.01Å
1133	F	92.6	Very high	87	Confident	3 Å²	3	34.6 Å²	34.6	1%	0.013	21%	0.211	C	C	.	.	H	α-helix	trans	-73.2	-14.8	-179.7	-82.6	-103.9	0	0	0	114	Y1007 A1092 L1093 N1096 P1129 N1136 V1138 I1139	Y1007-F1133 HydrophobicContact CD1-CD1 4.42Å; Y1007-F1133 AromaticContact CD1-CE1 3.66Å; Y1007-F1133 HydrophobicContact CD1-CE1 3.66Å; Y1007-F1133 HydrophobicContact CD1-CZ 4.16Å; Y1007-F1133 HydrophobicContact CE1-CE1 4.24Å; Y1007-F1133 HydrophobicContact CG-CE1 4.04Å; Y1007-F1133 HydrophobicContact CG-CZ 4.08Å; A1092-F1133 VanDerWaalsContact C-CZ 3.47Å; A1092-F1133 HydrophobicContact CB-CE1 3.73Å; A1092-F1133 HydrophobicContact CB-CZ 3.92Å; A1092-F1133 WeakPolarHBondContact O-CZ 3.48Å; L1093-F1133 HydrophobicContact CB-CD1 3.77Å; L1093-F1133 HydrophobicContact CB-CE1 3.95Å; L1093-F1133 HydrophobicContact CB-CG 4.19Å; L1093-F1133 HydrophobicContact CD1-CB 3.89Å; L1093-F1133 HydrophobicContact CD1-CD1 4.19Å; L1093-F1133 HydrophobicContact CD1-CD2 3.93Å; L1093-F1133 HydrophobicContact CD1-CG 3.7Å; L1093-F1133 HydrophobicContact CG-CD1 4.5Å; L1093-F1133 HydrophobicContact CG-CG 4.47Å; N1096-F1133 HydrophobicContact CB-CD2 4.49Å; N1096-F1133 HydrophobicContact CB-CE2 3.59Å; N1096-F1133 HydrophobicContact CB-CZ 4.1Å; P1129-F1133 WeakPolarHBondContact O-CB 3.1Å; P1129-F1133 WeakPolarHBondContact O-CD2 3.48Å; P1129-F1133 PolarHBondContact O-N 3.12Å; F1133-N1136 WeakPolarHBondContact CA-OD1 3.38Å; F1133-N1136 PolarHBondContact O-OD1 3.37Å; F1133-N1136 VanDerWaalsContact O-OD1 3.05Å; F1133-V1138 HydrophobicContact CB-CB 4.32Å; F1133-V1138 HydrophobicContact CD1-CB 3.78Å; F1133-V1138 HydrophobicContact CD1-CG1 3.93Å; F1133-V1138 HydrophobicContact CD1-CG2 3.81Å; F1133-V1138 HydrophobicContact CE1-CG2 4.26Å; F1133-V1138 PolarHBondContact O-N 2.76Å; F1133-I1139 HydrophobicContact CB-CD1 4Å; F1133-I1139 HydrophobicContact CB-CG1 4.2Å; F1133-I1139 PolarHBondContact O-N 3.36Å
1134	K	90.6	Very high	86.8	Confident	50 Å²	50	40.8 Å²	40.8	22%	0.217	24%	0.241	C	C	.	.	H	α-helix	trans	-74.1	-45.9	162.8	179.5	174.3	173.4	163.6	0	111.7	L1130 N1131 L1132 N1136 G1137 I1139 D1141 N1169	L1130-K1134 WeakPolarHBondContact O-CB 3.43Å; L1130-K1134 PolarHBondContact O-N 3.16Å; N1131-K1134 WeakPolarHBondContact O-CB 3.32Å; N1131-K1134 PolarHBondContact O-N 2.87Å; L1132-K1134 PolarHBondContact O-N 3.26Å; K1134-N1136 PolarHBondContact O-N 3.43Å; K1134-G1137 PolarHBondContact O-N 2.69Å; K1134-I1139 WeakPolarHBondContact CA-O 3.25Å; K1134-I1139 HydrophobicContact CB-CB 4.25Å; K1134-D1141 WeakPolarHBondContact CE-OD1 3.49Å; K1134-D1141 IonicContact NZ-OD1 2.6Å; K1134-D1141 PolarHBondContact NZ-OD1 3.09Å; K1134-N1169 PolarHBondContact NZ-O 2.81Å
1135	T	89.4	Confident	86.4	Confident	74 Å²	74	38.2 Å²	38.2	45%	0.454	22%	0.224	S	C	.	.	H	α-helix	trans	-67.5	-34	178.6	53	0	0	0	0	114	E1010 N1011 N1131 L1132 G1137	E1010-T1135 VanDerWaalsContact CA-O 3.32Å; E1010-T1135 WeakPolarHBondContact CA-O 3.42Å; N1011-T1135 PolarHBondContact N-O 3.02Å; N1131-T1135 PolarHBondContact O-N 3.25Å; N1131-T1135 PolarHBondContact O-OG1 2.83Å; L1132-T1135 WeakPolarHBondContact CA-OG1 3.4Å; L1132-T1135 PolarHBondContact O-N 2.92Å; L1132-T1135 PolarHBondContact O-OG1 2.88Å; T1135-G1137 VanDerWaalsContact C-N 3.27Å; T1135-G1137 PolarHBondContact O-N 2.89Å
1136	N	89.6	Confident	86	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-2.5	179.5	73.5	21.8	0	0	0	114.3	Y1007 I1009 N1011 G1012 S1013 L1132 F1133 K1134 V1138	Y1007-N1136 PolarHBondContact O-ND2 3.21Å; I1009-N1136 WeakPolarHBondContact O-CA 3.39Å; I1009-N1136 VanDerWaalsContact O-CB 3.28Å; I1009-N1136 WeakPolarHBondContact O-CB 3.49Å; N1011-N1136 CarbonylContact C-O 3.47Å; N1011-N1136 VanDerWaalsContact CA-O 3.31Å; N1011-N1136 WeakPolarHBondContact CA-O 3.39Å; G1012-N1136 PolarHBondContact N-O 3.3Å; S1013-N1136 WeakPolarHBondContact CB-O 3.32Å; S1013-N1136 PolarHBondContact N-O 3.27Å; S1013-N1136 PolarHBondContact OG-O 3.45Å; S1013-N1136 VanDerWaalsContact OG-O 3.1Å; L1132-N1136 PolarHBondContact O-N 3.01Å; F1133-N1136 WeakPolarHBondContact CA-OD1 3.38Å; F1133-N1136 PolarHBondContact O-OD1 3.37Å; F1133-N1136 VanDerWaalsContact O-OD1 3.05Å; K1134-N1136 PolarHBondContact O-N 3.43Å; N1136-V1138 WeakPolarHBondContact OD1-CG2 3.03Å; N1136-V1138 PolarHBondContact OD1-N 3.09Å
1137	G	86	Confident	85.3	Confident	20 Å²	20	46.7 Å²	46.7	21%	0.206	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	3.3	174.1	0	0	0	0	0	116.1	S1013 K1134 T1135 A1197	S1013-G1137 VanDerWaalsContact OG-C 3.26Å; S1013-G1137 WeakPolarHBondContact OG-CA 3.47Å; S1013-G1137 PolarHBondContact OG-O 3.44Å; K1134-G1137 PolarHBondContact O-N 2.69Å; T1135-G1137 VanDerWaalsContact C-N 3.27Å; T1135-G1137 PolarHBondContact O-N 2.89Å; G1137-A1197 WeakPolarHBondContact O-CB 3.26Å
1138	V	89	Confident	84.4	Confident	7 Å²	7	52.1 Å²	52.1	4%	0.042	30%	0.299	C	S	.	.	S	Bend	trans	-76.6	-40.1	176.4	169.1	0	0	0	0	112.9	Y1007 N1089 F1133 N1136 A1197	Y1007-V1138 HydrophobicContact CD1-CG2 4Å; Y1007-V1138 HydrophobicContact CE1-CG2 3.66Å; N1089-V1138 HydrophobicContact CB-CB 4.35Å; N1089-V1138 HydrophobicContact CB-CG1 3.79Å; N1089-V1138 HydrophobicContact CB-CG2 3.7Å; F1133-V1138 HydrophobicContact CB-CB 4.32Å; F1133-V1138 HydrophobicContact CD1-CB 3.78Å; F1133-V1138 HydrophobicContact CD1-CG1 3.93Å; F1133-V1138 HydrophobicContact CD1-CG2 3.81Å; F1133-V1138 HydrophobicContact CE1-CG2 4.26Å; F1133-V1138 PolarHBondContact O-N 2.76Å; N1136-V1138 WeakPolarHBondContact OD1-CG2 3.03Å; N1136-V1138 PolarHBondContact OD1-N 3.09Å; V1138-A1197 PolarHBondContact O-N 2.61Å
1139	I	89.6	Confident	83.9	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-103.5	127.5	177.1	-59.4	177.2	0	0	0	108.2	L1093 L1130 F1133 K1134 Y1194 L1195	L1093-I1139 HydrophobicContact CD2-CD1 4.15Å; L1130-I1139 HydrophobicContact CB-CD1 4.36Å; L1130-I1139 HydrophobicContact CD2-CD1 3.61Å; F1133-I1139 HydrophobicContact CB-CD1 4Å; F1133-I1139 HydrophobicContact CB-CG1 4.2Å; F1133-I1139 PolarHBondContact O-N 3.36Å; K1134-I1139 WeakPolarHBondContact CA-O 3.25Å; K1134-I1139 HydrophobicContact CB-CB 4.25Å; I1139-Y1194 HydrophobicContact CD1-CD2 4.34Å; I1139-Y1194 HydrophobicContact CD1-CG 4.39Å; I1139-Y1194 HydrophobicContact CG1-CD2 3.89Å; I1139-Y1194 HydrophobicContact CG1-CG 4.4Å; I1139-L1195 WeakPolarHBondContact CA-O 3.49Å
1140	A	83.5	Confident	83.5	Confident	9 Å²	9	53 Å²	53	7%	0.074	29%	0.294	C	S	.	.			trans	-69.2	145.7	-178.7	0	0	0	0	0	112.2	G1142 G1170 L1195 A1197 N1201	A1140-G1142 WeakPolarHBondContact CB-O 3.32Å; A1140-G1142 PolarHBondContact O-N 3.45Å; A1140-G1170 WeakPolarHBondContact O-CA 3.24Å; A1140-L1195 HydrophobicContact CB-CB 3.89Å; A1140-L1195 HydrophobicContact CB-CD1 4.4Å; A1140-L1195 PolarHBondContact N-O 2.73Å; A1140-A1197 HydrophobicContact CB-CB 4.17Å; A1140-N1201 HydrophobicContact CB-CB 4.48Å; A1140-N1201 WeakPolarHBondContact CB-ND2 3.46Å
1141	D	82.9	Confident	82.4	Confident	132 Å²	132	56.4 Å²	56.4	71%	0.706	31%	0.314	S	S	*	.	S	Bend	trans	-77.7	69.5	170.5	-162.8	-3.2	0	0	0	111.1	K1134	K1134-D1141 WeakPolarHBondContact CE-OD1 3.49Å; K1134-D1141 IonicContact NZ-OD1 2.6Å; K1134-D1141 PolarHBondContact NZ-OD1 3.09Å
1142	G	78.3	Confident	81.4	Confident	9 Å²	9	54.6 Å²	54.6	9%	0.093	31%	0.308	C	S	.	.			trans	75.1	-173	-172.9	0	0	0	0	0	114.1	A1140 A1167 L1195 N1201	A1140-G1142 WeakPolarHBondContact CB-O 3.32Å; A1140-G1142 PolarHBondContact O-N 3.45Å; G1142-A1167 CarbonylContact C-O 3.5Å; G1142-A1167 WeakPolarHBondContact CA-O 3.31Å; G1142-L1195 WeakPolarHBondContact O-CD1 3.31Å; G1142-N1201 PolarHBondContact O-ND2 3.14Å
1143	G	79	Confident	80.7	Confident	28 Å²	28	52 Å²	52	29%	0.289	29%	0.294	S	S	.	.			trans	155.8	158.8	178.7	0	0	0	0	0	113.4	A1167	G1143-A1167 PolarHBondContact N-O 2.88Å; G1143-A1167 WeakPolarHBondContact O-CA 2.87Å; G1143-A1167 WeakPolarHBondContact O-CB 3.23Å
1144	D	78.8	Confident	79.9	Confident	163 Å²	163	54 Å²	54	87%	0.872	31%	0.307	S	S	*	.			trans	-66.3	133.6	175.6	-66.4	-49.8	0	0	0	111.1
1145	L	75.7	Confident	78.9	Confident	19 Å²	19	58.5 Å²	58.5	10%	0.099	33%	0.328	C	S	.	.			trans	-109.8	131.8	172.6	-72.1	171.5	0	0	0	109.3	E1149 R1150 I1153 A1163 V1166 A1167 L1195	L1145-E1149 HydrophobicContact CB-CB 4.5Å; L1145-E1149 HydrophobicContact CD2-CB 4.09Å; L1145-R1150 HydrophobicContact CB-CG 3.5Å; L1145-R1150 HydrophobicContact CD1-CG 4.12Å; L1145-R1150 HydrophobicContact CG-CG 4.49Å; L1145-I1153 HydrophobicContact CD1-CD1 3.63Å; L1145-I1153 HydrophobicContact CD2-CD1 3.87Å; L1145-I1153 HydrophobicContact CG-CD1 4.42Å; L1145-A1163 HydrophobicContact CD1-CB 4.31Å; L1145-A1163 VanDerWaalsContact CD1-O 3.26Å; L1145-A1163 WeakPolarHBondContact CD1-O 3.36Å; L1145-V1166 HydrophobicContact CD1-CB 4.34Å; L1145-V1166 HydrophobicContact CD1-CG1 4.22Å; L1145-A1167 HydrophobicContact CD1-CB 3.98Å; L1145-A1167 HydrophobicContact CG-CB 4.28Å; L1145-L1195 HydrophobicContact CD2-CD2 3.74Å
1146	T	74.9	Confident	77.9	Confident	82 Å²	82	56.3 Å²	56.3	50%	0.503	32%	0.318	S	S	.	.			trans	-68.2	156.5	172	64	0	0	0	0	111.4	L1148 E1149 R1150	T1146-L1148 PolarHBondContact O-N 3.08Å; T1146-L1148 VanDerWaalsContact O-N 3.15Å; T1146-E1149 WeakPolarHBondContact CB-OE2 3.21Å; T1146-E1149 WeakPolarHBondContact CG2-OE2 3.44Å; T1146-E1149 PolarHBondContact N-OE2 2.96Å; T1146-E1149 PolarHBondContact O-N 3.41Å; T1146-E1149 VanDerWaalsContact OG1-CG 3.3Å; T1146-E1149 WeakPolarHBondContact OG1-CG 3.46Å; T1146-E1149 PolarHBondContact OG1-OE2 2.66Å; T1146-R1150 WeakPolarHBondContact O-CG 3.11Å; T1146-R1150 PolarHBondContact O-N 3.13Å
1147	D	73.7	Confident	77.5	Confident	133 Å²	133	57 Å²	57	71%	0.711	32%	0.322	S	S	*	.	H	α-helix	trans	-55.3	-36.3	-179.4	-68.5	-43.9	0	0	0	112.9	R1150 V1151	D1147-R1150 PolarHBondContact O-N 3.01Å; D1147-V1151 WeakPolarHBondContact O-CB 3.31Å; D1147-V1151 VanDerWaalsContact O-CG2 3.26Å; D1147-V1151 WeakPolarHBondContact O-CG2 3.35Å; D1147-V1151 PolarHBondContact O-N 3.35Å
1148	L	69.2	Low	77	Confident	142 Å²	142	59.5 Å²	59.5	74%	0.743	35%	0.348	S	S	*	.	H	α-helix	trans	-63.8	-40.4	175.2	-74.2	168.2	0	0	0	112.4	T1146 S1152	T1146-L1148 PolarHBondContact O-N 3.08Å; T1146-L1148 VanDerWaalsContact O-N 3.15Å; L1148-S1152 WeakPolarHBondContact O-CB 3.15Å; L1148-S1152 PolarHBondContact O-N 3.26Å; L1148-S1152 PolarHBondContact O-OG 2.82Å
1149	E	75.8	Confident	76.7	Confident	36 Å²	36	61.8 Å²	61.8	17%	0.168	36%	0.36	C	S	.	.	H	α-helix	trans	-71.6	-42.2	176.1	-63.9	169.7	106.5	0	0	111.1	L1145 T1146 V1151 S1152 I1153 Y1203	L1145-E1149 HydrophobicContact CB-CB 4.5Å; L1145-E1149 HydrophobicContact CD2-CB 4.09Å; T1146-E1149 WeakPolarHBondContact CB-OE2 3.21Å; T1146-E1149 WeakPolarHBondContact CG2-OE2 3.44Å; T1146-E1149 PolarHBondContact N-OE2 2.96Å; T1146-E1149 PolarHBondContact O-N 3.41Å; T1146-E1149 VanDerWaalsContact OG1-CG 3.3Å; T1146-E1149 WeakPolarHBondContact OG1-CG 3.46Å; T1146-E1149 PolarHBondContact OG1-OE2 2.66Å; E1149-V1151 VanDerWaalsContact C-N 3.32Å; E1149-V1151 PolarHBondContact O-N 3.44Å; E1149-S1152 PolarHBondContact O-N 3.33Å; E1149-S1152 VanDerWaalsContact O-N 3.14Å; E1149-I1153 WeakPolarHBondContact O-CB 3.43Å; E1149-I1153 VanDerWaalsContact O-CG1 3.24Å; E1149-I1153 WeakPolarHBondContact O-CG1 3.36Å; E1149-I1153 PolarHBondContact O-N 3.1Å; E1149-Y1203 HydrophobicContact CB-CD1 3.8Å; E1149-Y1203 HydrophobicContact CB-CE1 4.03Å; E1149-Y1203 HydrophobicContact CG-CD1 3.65Å; E1149-Y1203 HydrophobicContact CG-CE1 3.76Å
1150	R	81.2	Confident	75.9	Confident	74 Å²	74	65.5 Å²	65.5	28%	0.279	39%	0.386	S	S	.	.	H	α-helix	trans	-59.3	-42.8	174.9	-65.2	-175.7	59	96.3	5.4	111.3	L1145 T1146 D1147 T1154 A1163 D1164	L1145-R1150 HydrophobicContact CB-CG 3.5Å; L1145-R1150 HydrophobicContact CD1-CG 4.12Å; L1145-R1150 HydrophobicContact CG-CG 4.49Å; T1146-R1150 WeakPolarHBondContact O-CG 3.11Å; T1146-R1150 PolarHBondContact O-N 3.13Å; D1147-R1150 PolarHBondContact O-N 3.01Å; R1150-T1154 VanDerWaalsContact O-CB 3.32Å; R1150-T1154 WeakPolarHBondContact O-CB 3.44Å; R1150-T1154 PolarHBondContact O-N 3.32Å; R1150-T1154 PolarHBondContact O-OG1 3.19Å; R1150-A1163 HydrophobicContact CB-CB 4.04Å; R1150-A1163 HydrophobicContact CG-CB 4.15Å; R1150-D1164 IonicContact CZ-OD1 2.7Å; R1150-D1164 VanDerWaalsContact CZ-OD1 3.25Å; R1150-D1164 IonicContact NH1-OD1 3.63Å; R1150-D1164 PolarHBondContact NH1-OD1 2.65Å; R1150-D1164 VanDerWaalsContact NH2-CG 3.3Å; R1150-D1164 IonicContact NH2-OD1 2.74Å; R1150-D1164 PolarHBondContact NH2-OD1 2.86Å; R1150-D1164 IonicContact NH2-OD2 3.34Å; R1150-D1164 PolarHBondContact NH2-OD2 3.38Å
1151	V	69.9	Low	75.8	Confident	73 Å²	73	67.2 Å²	67.2	44%	0.442	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-46.6	172.2	167.4	0	0	0	0	111.2	D1147 E1149 I1153 T1154 Q1155	D1147-V1151 WeakPolarHBondContact O-CB 3.31Å; D1147-V1151 VanDerWaalsContact O-CG2 3.26Å; D1147-V1151 WeakPolarHBondContact O-CG2 3.35Å; D1147-V1151 PolarHBondContact O-N 3.35Å; E1149-V1151 VanDerWaalsContact C-N 3.32Å; E1149-V1151 PolarHBondContact O-N 3.44Å; V1151-I1153 PolarHBondContact O-N 3.07Å; V1151-T1154 WeakPolarHBondContact O-CB 3.44Å; V1151-T1154 PolarHBondContact O-N 3.11Å; V1151-Q1155 HydrophobicContact CG1-CG 4.32Å; V1151-Q1155 WeakPolarHBondContact O-CB 3.4Å; V1151-Q1155 WeakPolarHBondContact O-CG 3.46Å; V1151-Q1155 PolarHBondContact O-N 3.45Å
1152	S	68.8	Low	75.8	Confident	37 Å²	37	60.9 Å²	60.9	26%	0.259	37%	0.366	S	S	.	.	H	α-helix	trans	-63.4	-42.3	-178.8	-58.2	0	0	0	0	112.7	L1148 E1149 Q1155 A1156 Y1203	L1148-S1152 WeakPolarHBondContact O-CB 3.15Å; L1148-S1152 PolarHBondContact O-N 3.26Å; L1148-S1152 PolarHBondContact O-OG 2.82Å; E1149-S1152 PolarHBondContact O-N 3.33Å; E1149-S1152 VanDerWaalsContact O-N 3.14Å; S1152-Q1155 PolarHBondContact O-N 3.45Å; S1152-A1156 WeakPolarHBondContact O-CB 3.32Å; S1152-A1156 PolarHBondContact O-N 3.11Å; S1152-Y1203 WeakPolarHBondContact CB-OH 3.41Å
1153	I	76.6	Confident	75.8	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-64	-43.3	174.6	-66.2	163.5	0	0	0	110.3	L1145 E1149 V1151 Q1155 A1156 T1157 A1162 A1163 V1166 V1193 Y1203	L1145-I1153 HydrophobicContact CD1-CD1 3.63Å; L1145-I1153 HydrophobicContact CD2-CD1 3.87Å; L1145-I1153 HydrophobicContact CG-CD1 4.42Å; E1149-I1153 WeakPolarHBondContact O-CB 3.43Å; E1149-I1153 VanDerWaalsContact O-CG1 3.24Å; E1149-I1153 WeakPolarHBondContact O-CG1 3.36Å; E1149-I1153 PolarHBondContact O-N 3.1Å; V1151-I1153 PolarHBondContact O-N 3.07Å; I1153-Q1155 VanDerWaalsContact C-N 3.34Å; I1153-Q1155 PolarHBondContact O-N 3.3Å; I1153-A1156 PolarHBondContact O-N 3.48Å; I1153-T1157 HydrophobicContact CG2-CG2 4.42Å; I1153-T1157 WeakPolarHBondContact O-CB 3.35Å; I1153-T1157 WeakPolarHBondContact O-CG2 3.49Å; I1153-T1157 PolarHBondContact O-N 3.29Å; I1153-T1157 PolarHBondContact O-OG1 3.42Å; I1153-A1162 HydrophobicContact CG2-CB 3.9Å; I1153-A1163 HydrophobicContact CB-CB 4.47Å; I1153-A1163 HydrophobicContact CG2-CB 4.31Å; I1153-V1166 HydrophobicContact CD1-CB 4.48Å; I1153-V1166 HydrophobicContact CD1-CG1 4.23Å; I1153-V1193 HydrophobicContact CD1-CG1 4.42Å; I1153-V1193 HydrophobicContact CG1-CG1 4.02Å; I1153-V1193 HydrophobicContact CG2-CG1 4.18Å; I1153-Y1203 HydrophobicContact CD1-CD2 4.08Å; I1153-Y1203 HydrophobicContact CD1-CG 3.92Å; I1153-Y1203 HydrophobicContact CG1-CD2 3.52Å; I1153-Y1203 HydrophobicContact CG1-CE2 4.03Å; I1153-Y1203 HydrophobicContact CG1-CG 3.87Å
1154	T	75.7	Confident	76.1	Confident	46 Å²	46	62.7 Å²	62.7	28%	0.282	37%	0.367	S	S	.	.	H	α-helix	trans	-61.2	-41.8	176	-59.1	0	0	0	0	111.5	R1150 V1151 G1158	R1150-T1154 VanDerWaalsContact O-CB 3.32Å; R1150-T1154 WeakPolarHBondContact O-CB 3.44Å; R1150-T1154 PolarHBondContact O-N 3.32Å; R1150-T1154 PolarHBondContact O-OG1 3.19Å; V1151-T1154 WeakPolarHBondContact O-CB 3.44Å; V1151-T1154 PolarHBondContact O-N 3.11Å; T1154-G1158 VanDerWaalsContact O-CA 3.26Å; T1154-G1158 WeakPolarHBondContact O-CA 3.16Å; T1154-G1158 PolarHBondContact O-N 3.3Å
1155	Q	68.7	Low	76.5	Confident	143 Å²	143	56.4 Å²	56.4	67%	0.668	34%	0.336	S	S	*	.	H	α-helix	trans	-69.1	-40.9	176.8	-72.8	174.1	-4.9	0	0	112.6	V1151 S1152 I1153	V1151-Q1155 HydrophobicContact CG1-CG 4.32Å; V1151-Q1155 WeakPolarHBondContact O-CB 3.4Å; V1151-Q1155 WeakPolarHBondContact O-CG 3.46Å; V1151-Q1155 PolarHBondContact O-N 3.45Å; S1152-Q1155 PolarHBondContact O-N 3.45Å; I1153-Q1155 VanDerWaalsContact C-N 3.34Å; I1153-Q1155 PolarHBondContact O-N 3.3Å
1156	A	69.9	Low	77	Confident	28 Å²	28	55.5 Å²	55.5	23%	0.231	33%	0.331	C	S	.	.	H	α-helix	trans	-68.6	-33.7	-180	0	0	0	0	0	113.2	S1152 I1153 R1176 L1191 T1205	S1152-A1156 WeakPolarHBondContact O-CB 3.32Å; S1152-A1156 PolarHBondContact O-N 3.11Å; I1153-A1156 PolarHBondContact O-N 3.48Å; A1156-R1176 PolarHBondContact O-NH2 2.68Å; A1156-L1191 HydrophobicContact CB-CD2 4.39Å; A1156-L1191 WeakPolarHBondContact O-CD2 3.49Å; A1156-T1205 HydrophobicContact CB-CG2 4.29Å
1157	T	80.9	Confident	77.3	Confident	15 Å²	15	52.7 Å²	52.7	9%	0.092	32%	0.316	C	S	.	.	H	α-helix	trans	-99	-22.7	-176.6	60.9	0	0	0	0	114.4	I1153 N1159 A1162 Y1172 L1174 L1191 V1193	I1153-T1157 HydrophobicContact CG2-CG2 4.42Å; I1153-T1157 WeakPolarHBondContact O-CB 3.35Å; I1153-T1157 WeakPolarHBondContact O-CG2 3.49Å; I1153-T1157 PolarHBondContact O-N 3.29Å; I1153-T1157 PolarHBondContact O-OG1 3.42Å; T1157-N1159 PolarHBondContact O-N 3.05Å; T1157-N1159 PolarHBondContact OG1-N 3.39Å; T1157-N1159 PolarHBondContact OG1-O 3.39Å; T1157-A1162 HydrophobicContact CG2-CB 3.85Å; T1157-A1162 WeakPolarHBondContact OG1-CB 3.28Å; T1157-Y1172 HydrophobicContact CG2-CD1 4.06Å; T1157-Y1172 HydrophobicContact CG2-CE1 4.12Å; T1157-L1174 WeakPolarHBondContact O-CD2 3.4Å; T1157-L1191 HydrophobicContact CG2-CD2 3.82Å; T1157-V1193 HydrophobicContact CG2-CG2 3.65Å
1158	G	75.9	Confident	78	Confident	72 Å²	72	51 Å²	51	74%	0.742	31%	0.311	S	S	*	.	S	Bend	trans	73.1	8.4	-169.1	0	0	0	0	0	114.4	T1154	T1154-G1158 VanDerWaalsContact O-CA 3.26Å; T1154-G1158 WeakPolarHBondContact O-CA 3.16Å; T1154-G1158 PolarHBondContact O-N 3.3Å
1159	N	80.9	Confident	78.7	Confident	55 Å²	55	48 Å²	48	29%	0.294	30%	0.296	S	S	.	.			trans	-133.1	120	-175.5	-177.9	7	0	0	0	111.2	T1157 A1161 A1162 Y1172	T1157-N1159 PolarHBondContact O-N 3.05Å; T1157-N1159 PolarHBondContact OG1-N 3.39Å; T1157-N1159 PolarHBondContact OG1-O 3.39Å; N1159-A1161 VanDerWaalsContact C-N 3.31Å; N1159-A1161 PolarHBondContact O-N 3.35Å; N1159-A1161 WeakPolarHBondContact OD1-CB 3.19Å; N1159-A1161 PolarHBondContact OD1-N 2.93Å; N1159-A1162 HydrophobicContact CB-CB 4.41Å; N1159-A1162 WeakPolarHBondContact O-CB 3.26Å; N1159-A1162 PolarHBondContact O-N 3.17Å; N1159-A1162 VanDerWaalsContact O-N 3.15Å; N1159-Y1172 PolarHBondContact ND2-OH 3.47Å
1160	S	73.2	Confident	79.2	Confident	80 Å²	80	46.3 Å²	46.3	56%	0.559	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-34.3	178.2	49.1	0	0	0	0	113.1	A1162 A1163	S1160-A1162 PolarHBondContact O-N 2.91Å; S1160-A1162 VanDerWaalsContact O-N 3.15Å; S1160-A1163 PolarHBondContact O-N 3.1Å
1161	A	81.4	Confident	79.7	Confident	44 Å²	44	44.3 Å²	44.3	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-68.5	-10.1	177.2	0	0	0	0	0	113.4	N1159 A1163 S1165	N1159-A1161 VanDerWaalsContact C-N 3.31Å; N1159-A1161 PolarHBondContact O-N 3.35Å; N1159-A1161 WeakPolarHBondContact OD1-CB 3.19Å; N1159-A1161 PolarHBondContact OD1-N 2.93Å; A1161-A1163 VanDerWaalsContact C-N 3.34Å; A1161-S1165 WeakPolarHBondContact O-CB 3.21Å; A1161-S1165 PolarHBondContact O-N 2.87Å; A1161-S1165 PolarHBondContact O-OG 3.46Å
1162	A	83.1	Confident	80.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-37.5	171.3	0	0	0	0	0	111.6	I1153 T1157 N1159 S1160 S1165 V1166 Y1172	I1153-A1162 HydrophobicContact CG2-CB 3.9Å; T1157-A1162 HydrophobicContact CG2-CB 3.85Å; T1157-A1162 WeakPolarHBondContact OG1-CB 3.28Å; N1159-A1162 HydrophobicContact CB-CB 4.41Å; N1159-A1162 WeakPolarHBondContact O-CB 3.26Å; N1159-A1162 PolarHBondContact O-N 3.17Å; N1159-A1162 VanDerWaalsContact O-N 3.15Å; S1160-A1162 PolarHBondContact O-N 2.91Å; S1160-A1162 VanDerWaalsContact O-N 3.15Å; A1162-S1165 PolarHBondContact O-N 3.21Å; A1162-V1166 VanDerWaalsContact O-CG2 3.27Å; A1162-V1166 WeakPolarHBondContact O-CG2 3.28Å; A1162-V1166 PolarHBondContact O-N 2.97Å; A1162-Y1172 HydrophobicContact CB-CD1 3.42Å; A1162-Y1172 VanDerWaalsContact CB-CD1 3.42Å; A1162-Y1172 HydrophobicContact CB-CD2 4.33Å; A1162-Y1172 HydrophobicContact CB-CE1 3.48Å; A1162-Y1172 VanDerWaalsContact CB-CE1 3.48Å; A1162-Y1172 HydrophobicContact CB-CE2 4.41Å; A1162-Y1172 HydrophobicContact CB-CG 3.86Å
1163	A	79.5	Confident	81.5	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-43.7	177.2	0	0	0	0	0	111.4	L1145 R1150 I1153 S1160 A1161 S1165 V1166 A1167	L1145-A1163 HydrophobicContact CD1-CB 4.31Å; L1145-A1163 VanDerWaalsContact CD1-O 3.26Å; L1145-A1163 WeakPolarHBondContact CD1-O 3.36Å; R1150-A1163 HydrophobicContact CB-CB 4.04Å; R1150-A1163 HydrophobicContact CG-CB 4.15Å; I1153-A1163 HydrophobicContact CB-CB 4.47Å; I1153-A1163 HydrophobicContact CG2-CB 4.31Å; S1160-A1163 PolarHBondContact O-N 3.1Å; A1161-A1163 VanDerWaalsContact C-N 3.34Å; A1163-S1165 VanDerWaalsContact C-N 3.35Å; A1163-V1166 PolarHBondContact O-N 3.4Å; A1163-A1167 WeakPolarHBondContact O-CB 3.48Å; A1163-A1167 PolarHBondContact O-N 2.69Å
1164	D	85.1	Confident	81.8	Confident	74 Å²	74	43.7 Å²	43.7	40%	0.396	27%	0.268	S	S	.	.	H	α-helix	trans	-66	-37	175.2	-63.6	-53.8	0	0	0	112.5	R1150 A1167 T1168	R1150-D1164 IonicContact CZ-OD1 2.7Å; R1150-D1164 VanDerWaalsContact CZ-OD1 3.25Å; R1150-D1164 IonicContact NH1-OD1 3.63Å; R1150-D1164 PolarHBondContact NH1-OD1 2.65Å; R1150-D1164 VanDerWaalsContact NH2-CG 3.3Å; R1150-D1164 IonicContact NH2-OD1 2.74Å; R1150-D1164 PolarHBondContact NH2-OD1 2.86Å; R1150-D1164 IonicContact NH2-OD2 3.34Å; R1150-D1164 PolarHBondContact NH2-OD2 3.38Å; D1164-A1167 PolarHBondContact O-N 2.74Å; D1164-T1168 VanDerWaalsContact O-CB 3.25Å; D1164-T1168 WeakPolarHBondContact O-CB 3.49Å; D1164-T1168 PolarHBondContact O-N 3.3Å; D1164-T1168 PolarHBondContact O-OG1 2.92Å
1165	S	85.6	Confident	82.2	Confident	32 Å²	32	42.2 Å²	42.2	22%	0.224	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-43.8	174.8	-59	0	0	0	0	112	A1161 A1162 A1163 T1168 N1169	A1161-S1165 WeakPolarHBondContact O-CB 3.21Å; A1161-S1165 PolarHBondContact O-N 2.87Å; A1161-S1165 PolarHBondContact O-OG 3.46Å; A1162-S1165 PolarHBondContact O-N 3.21Å; A1163-S1165 VanDerWaalsContact C-N 3.35Å; S1165-T1168 PolarHBondContact O-N 3.24Å; S1165-N1169 VanDerWaalsContact O-CB 3.27Å; S1165-N1169 WeakPolarHBondContact O-CB 3.41Å; S1165-N1169 PolarHBondContact O-N 3.04Å
1166	V	86	Confident	82.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-44.9	176.6	171.3	0	0	0	0	111	L1145 I1153 A1162 A1163 T1168 G1170 V1193 L1195	L1145-V1166 HydrophobicContact CD1-CB 4.34Å; L1145-V1166 HydrophobicContact CD1-CG1 4.22Å; I1153-V1166 HydrophobicContact CD1-CB 4.48Å; I1153-V1166 HydrophobicContact CD1-CG1 4.23Å; A1162-V1166 VanDerWaalsContact O-CG2 3.27Å; A1162-V1166 WeakPolarHBondContact O-CG2 3.28Å; A1162-V1166 PolarHBondContact O-N 2.97Å; A1163-V1166 PolarHBondContact O-N 3.4Å; V1166-T1168 PolarHBondContact O-N 3.38Å; V1166-G1170 CarbonylContact O-C 3.53Å; V1166-G1170 VanDerWaalsContact O-CA 3.23Å; V1166-G1170 WeakPolarHBondContact O-CA 3.22Å; V1166-G1170 PolarHBondContact O-N 3.35Å; V1166-V1193 HydrophobicContact CG2-CB 3.9Å; V1166-V1193 HydrophobicContact CG2-CG1 3.73Å; V1166-L1195 HydrophobicContact CG1-CD1 4.47Å; V1166-L1195 HydrophobicContact CG1-CD2 3.87Å; V1166-L1195 HydrophobicContact CG1-CG 3.69Å
1167	A	82.8	Confident	82.7	Confident	22 Å²	22	42.7 Å²	42.7	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-33.8	177.9	0	0	0	0	0	113.7	G1142 G1143 L1145 A1163 D1164	G1142-A1167 CarbonylContact C-O 3.5Å; G1142-A1167 WeakPolarHBondContact CA-O 3.31Å; G1143-A1167 PolarHBondContact N-O 2.88Å; G1143-A1167 WeakPolarHBondContact O-CA 2.87Å; G1143-A1167 WeakPolarHBondContact O-CB 3.23Å; L1145-A1167 HydrophobicContact CD1-CB 3.98Å; L1145-A1167 HydrophobicContact CG-CB 4.28Å; A1163-A1167 WeakPolarHBondContact O-CB 3.48Å; A1163-A1167 PolarHBondContact O-N 2.69Å; D1164-A1167 PolarHBondContact O-N 2.74Å
1168	T	86.9	Confident	82.1	Confident	98 Å²	98	44.2 Å²	44.2	60%	0.601	27%	0.265	S	S	*	.	H	α-helix	trans	-89.5	-44	-176.5	-50.1	0	0	0	0	112.7	D1164 S1165 V1166	D1164-T1168 VanDerWaalsContact O-CB 3.25Å; D1164-T1168 WeakPolarHBondContact O-CB 3.49Å; D1164-T1168 PolarHBondContact O-N 3.3Å; D1164-T1168 PolarHBondContact O-OG1 2.92Å; S1165-T1168 PolarHBondContact O-N 3.24Å; V1166-T1168 PolarHBondContact O-N 3.38Å
1169	N	85.2	Confident	81.7	Confident	79 Å²	79	43.7 Å²	43.7	42%	0.422	25%	0.248	S	C	.	.	H	α-helix	trans	-101.4	-15.3	-171	-56.5	-30.1	0	0	0	113.2	K1134 S1165 Y1171	K1134-N1169 PolarHBondContact NZ-O 2.81Å; S1165-N1169 VanDerWaalsContact O-CB 3.27Å; S1165-N1169 WeakPolarHBondContact O-CB 3.41Å; S1165-N1169 PolarHBondContact O-N 3.04Å; N1169-Y1171 VanDerWaalsContact C-N 3.32Å
1170	G	85.5	Confident	80.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.272	C	S	.	.	S	Bend	trans	91.3	-22.8	-168.7	0	0	0	0	0	114.1	A1140 V1166 Y1194 L1195	A1140-G1170 WeakPolarHBondContact O-CA 3.24Å; V1166-G1170 CarbonylContact O-C 3.53Å; V1166-G1170 VanDerWaalsContact O-CA 3.23Å; V1166-G1170 WeakPolarHBondContact O-CA 3.22Å; V1166-G1170 PolarHBondContact O-N 3.35Å; G1170-Y1194 CarbonylContact O-C 3.53Å; G1170-Y1194 VanDerWaalsContact O-CA 3.28Å; G1170-Y1194 WeakPolarHBondContact O-CA 3.27Å; G1170-L1195 PolarHBondContact O-N 3.3Å
1171	Y	91.8	Very high	80.2	Confident	32 Å²	32	50 Å²	50	13%	0.125	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	165.8	-178.6	68.7	-97.4	0	0	0	114.6	L1130 N1131 N1169 I1173 V1193	L1130-Y1171 HydrophobicContact CB-CD1 4.04Å; L1130-Y1171 HydrophobicContact CB-CD2 4.33Å; L1130-Y1171 HydrophobicContact CB-CE1 3.87Å; L1130-Y1171 HydrophobicContact CB-CE2 4.18Å; L1130-Y1171 HydrophobicContact CB-CG 4.27Å; L1130-Y1171 HydrophobicContact CD1-CD2 3.71Å; L1130-Y1171 HydrophobicContact CD1-CE2 3.91Å; L1130-Y1171 HydrophobicContact CD1-CG 4.18Å; N1131-Y1171 WeakPolarHBondContact OD1-CE1 3.37Å; N1131-Y1171 PolarHBondContact OD1-OH 2.8Å; N1169-Y1171 VanDerWaalsContact C-N 3.32Å; Y1171-I1173 HydrophobicContact CD2-CD1 4.47Å; Y1171-I1173 HydrophobicContact CD2-CG1 4.08Å; Y1171-I1173 HydrophobicContact CE2-CD1 4.09Å; Y1171-I1173 HydrophobicContact CE2-CG1 4.17Å; Y1171-V1193 CarbonylContact C-O 3.52Å; Y1171-V1193 WeakPolarHBondContact CA-O 3.22Å; Y1171-V1193 WeakPolarHBondContact CB-O 3.37Å
1172	Y	87.3	Confident	79.3	Confident	43 Å²	43	48 Å²	48	17%	0.169	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	139.1	173.8	179.9	-106.5	0	0	0	110.5	T1157 N1159 A1162 L1174 V1193	T1157-Y1172 HydrophobicContact CG2-CD1 4.06Å; T1157-Y1172 HydrophobicContact CG2-CE1 4.12Å; N1159-Y1172 PolarHBondContact ND2-OH 3.47Å; A1162-Y1172 HydrophobicContact CB-CD1 3.42Å; A1162-Y1172 VanDerWaalsContact CB-CD1 3.42Å; A1162-Y1172 HydrophobicContact CB-CD2 4.33Å; A1162-Y1172 HydrophobicContact CB-CE1 3.48Å; A1162-Y1172 VanDerWaalsContact CB-CE1 3.48Å; A1162-Y1172 HydrophobicContact CB-CE2 4.41Å; A1162-Y1172 HydrophobicContact CB-CG 3.86Å; Y1172-L1174 HydrophobicContact CE1-CB 3.92Å; Y1172-V1193 PolarHBondContact N-O 3.35Å; Y1172-V1193 PolarHBondContact O-N 3.02Å
1173	I	88.8	Confident	78.2	Confident	20 Å²	20	51.4 Å²	51.4	10%	0.103	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.4	-179.9	-48.5	173.9	0	0	0	108.9	S1123 L1126 L1130 Y1171 V1190	S1123-I1173 WeakPolarHBondContact O-CD1 3.31Å; L1126-I1173 HydrophobicContact CB-CD1 4.12Å; L1126-I1173 HydrophobicContact CD1-CG2 4.44Å; L1130-I1173 HydrophobicContact CD1-CD1 3.71Å; L1130-I1173 HydrophobicContact CD1-CG1 3.77Å; Y1171-I1173 HydrophobicContact CD2-CD1 4.47Å; Y1171-I1173 HydrophobicContact CD2-CG1 4.08Å; Y1171-I1173 HydrophobicContact CE2-CD1 4.09Å; Y1171-I1173 HydrophobicContact CE2-CG1 4.17Å; I1173-V1190 HydrophobicContact CG2-CG1 3.59Å
1174	L	83	Confident	77.1	Confident	34 Å²	34	55 Å²	55	18%	0.178	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	100.2	175.2	178.4	68.7	0	0	0	110.4	T1157 Y1172 R1176 V1190 L1191	T1157-L1174 WeakPolarHBondContact O-CD2 3.4Å; Y1172-L1174 HydrophobicContact CE1-CB 3.92Å; L1174-R1176 HydrophobicContact CD2-CG 4.29Å; L1174-R1176 HydrophobicContact CG-CG 4.29Å; L1174-R1176 PolarHBondContact O-N 3.01Å; L1174-V1190 CarbonylContact O-C 3.45Å; L1174-V1190 WeakPolarHBondContact O-CA 3.38Å; L1174-L1191 HydrophobicContact CB-CB 4.27Å; L1174-L1191 HydrophobicContact CD2-CB 4.47Å; L1174-L1191 HydrophobicContact CD2-CD2 4.31Å; L1174-L1191 PolarHBondContact N-O 3.09Å; L1174-L1191 PolarHBondContact O-N 3.15Å
1175	V	83.9	Confident	75.8	Confident	15 Å²	15	56.1 Å²	56.1	9%	0.091	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	110.4	166.1	-170.6	0	0	0	0	108.1	K1119 V1122 V1188 V1190	K1119-V1175 HydrophobicContact CB-CB 4.08Å; K1119-V1175 HydrophobicContact CB-CG1 4.26Å; K1119-V1175 HydrophobicContact CD-CB 4.3Å; K1119-V1175 HydrophobicContact CD-CG1 4.46Å; K1119-V1175 WeakPolarHBondContact CE-O 3.3Å; K1119-V1175 HydrophobicContact CG-CB 4.01Å; K1119-V1175 HydrophobicContact CG-CG1 3.86Å; K1119-V1175 PolarHBondContact NZ-O 3.06Å; V1122-V1175 HydrophobicContact CB-CG2 4.01Å; V1122-V1175 HydrophobicContact CG1-CG1 4.45Å; V1122-V1175 HydrophobicContact CG1-CG2 3.81Å; V1175-V1188 HydrophobicContact CG1-CG1 3.68Å; V1175-V1190 HydrophobicContact CG1-CG2 4.48Å; V1175-V1190 HydrophobicContact CG2-CG1 4.34Å; V1175-V1190 HydrophobicContact CG2-CG2 4.29Å
1176	R	77.3	Confident	74.7	Confident	62 Å²	62	60.1 Å²	60.1	23%	0.234	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-71	165.3	-175.1	-68.6	179.8	165.7	-179.5	-8.7	111.2	A1156 L1174 R1189	A1156-R1176 PolarHBondContact O-NH2 2.68Å; L1174-R1176 HydrophobicContact CD2-CG 4.29Å; L1174-R1176 HydrophobicContact CG-CG 4.29Å; L1174-R1176 PolarHBondContact O-N 3.01Å; R1176-R1189 HydrophobicContact CB-CB 4.46Å; R1176-R1189 WeakPolarHBondContact CB-O 3.34Å; R1176-R1189 PolarHBondContact N-O 3.03Å
1177	D	73.6	Confident	73.7	Confident	120 Å²	120	60.5 Å²	60.5	64%	0.642	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-73.3	137.2	168.6	-67.7	-67.4	0	0	0	110.4	K1119	K1119-D1177 WeakPolarHBondContact CE-OD1 3.18Å; K1119-D1177 IonicContact NZ-OD1 3.45Å; K1119-D1177 PolarHBondContact NZ-OD1 2.95Å; K1119-D1177 IonicContact NZ-OD2 2.77Å; K1119-D1177 PolarHBondContact NZ-OD2 3.05Å; K1119-D1177 VanDerWaalsContact NZ-OD2 3.11Å
1178	I	68.3	Low	73	Confident	47 Å²	47	59.6 Å²	59.6	24%	0.241	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-75.4	122.2	-176.3	-75.7	170.9	0	0	0	108.7	L1113 R1114 D1182 I1183 V1188	L1113-I1178 HydrophobicContact CB-CD1 4.31Å; L1113-I1178 WeakPolarHBondContact O-CD1 3.34Å; R1114-I1178 HydrophobicContact CG-CD1 4.05Å; I1178-D1182 WeakPolarHBondContact CA-OD2 3.4Å; I1178-D1182 HydrophobicContact CB-CB 4.4Å; I1178-D1182 HydrophobicContact CG2-CB 3.87Å; I1178-I1183 HydrophobicContact CG2-CD1 4.08Å; I1178-I1183 HydrophobicContact CG2-CG1 3.46Å; I1178-I1183 VanDerWaalsContact CG2-CG1 3.46Å; I1178-V1188 HydrophobicContact CD1-CG2 4.09Å
1179	T	66.1	Low	72.2	Confident	61 Å²	61	57 Å²	57	37%	0.374	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-86.2	170.2	171.1	52.8	0	0	0	0	111.7	E1181 D1182 I1183 R1189	T1179-E1181 PolarHBondContact O-N 3.27Å; T1179-D1182 PolarHBondContact N-OD2 2.74Å; T1179-D1182 WeakPolarHBondContact O-CB 3.45Å; T1179-D1182 PolarHBondContact O-N 3.48Å; T1179-D1182 PolarHBondContact OG1-OD2 3.25Å; T1179-I1183 WeakPolarHBondContact O-CG1 3.42Å; T1179-I1183 PolarHBondContact O-N 2.89Å; T1179-R1189 VanDerWaalsContact CG2-NH2 3.28Å; T1179-R1189 PolarHBondContact OG1-NH2 3.19Å
1180	E	62	Low	71.8	Confident	172 Å²	172	53.4 Å²	53.4	80%	0.804	26%	0.262	S	S	*	.	H	α-helix	trans	-60.8	-32.6	174.2	-60.7	-174.4	154.9	0	0	112.3	I1183 A1184	E1180-I1183 WeakPolarHBondContact O-CB 3.33Å; E1180-I1183 PolarHBondContact O-N 3.38Å; E1180-A1184 PolarHBondContact O-N 2.94Å
1181	E	61.5	Low	71.4	Confident	95 Å²	95	53.4 Å²	53.4	44%	0.444	26%	0.262	S	S	.	.	H	α-helix	trans	-61.3	-45.2	169.2	-168.2	-153.5	168.1	0	0	112.2	T1179 I1183 A1184 K1185	T1179-E1181 PolarHBondContact O-N 3.27Å; E1181-I1183 PolarHBondContact O-N 3.44Å; E1181-A1184 PolarHBondContact O-N 3.24Å; E1181-K1185 HydrophobicContact CG-CD 4.33Å; E1181-K1185 PolarHBondContact O-N 2.8Å; E1181-K1185 WeakPolarHBondContact OE1-CE 3.15Å; E1181-K1185 IonicContact OE1-NZ 2.71Å; E1181-K1185 PolarHBondContact OE1-NZ 3.13Å
1182	D	62.5	Low	71	Confident	1 Å²	1	52 Å²	52	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-35.9	176.8	-68	-29.3	0	0	0	111.2	I1178 T1179 K1185 R1186 Q1187 R1189	I1178-D1182 WeakPolarHBondContact CA-OD2 3.4Å; I1178-D1182 HydrophobicContact CB-CB 4.4Å; I1178-D1182 HydrophobicContact CG2-CB 3.87Å; T1179-D1182 PolarHBondContact N-OD2 2.74Å; T1179-D1182 WeakPolarHBondContact O-CB 3.45Å; T1179-D1182 PolarHBondContact O-N 3.48Å; T1179-D1182 PolarHBondContact OG1-OD2 3.25Å; D1182-K1185 CarbonylContact O-C 3.21Å; D1182-R1186 CarbonylContact O-C 3.55Å; D1182-R1186 WeakPolarHBondContact O-CA 3.47Å; D1182-R1186 PolarHBondContact O-N 3.24Å; D1182-Q1187 HydrophobicContact CB-CG 4.01Å; D1182-Q1187 PolarHBondContact O-N 2.98Å; D1182-Q1187 PolarHBondContact OD1-NE2 2.9Å; D1182-R1189 VanDerWaalsContact CG-NE 3.26Å; D1182-R1189 VanDerWaalsContact OD1-CD 3.24Å; D1182-R1189 WeakPolarHBondContact OD1-CD 3.4Å; D1182-R1189 WeakPolarHBondContact OD1-CG 3.14Å; D1182-R1189 IonicContact OD1-CZ 3.64Å; D1182-R1189 VanDerWaalsContact OD1-CZ 3.29Å; D1182-R1189 IonicContact OD1-NE 3.19Å; D1182-R1189 PolarHBondContact OD1-NE 2.9Å; D1182-R1189 IonicContact OD1-NH2 2.61Å; D1182-R1189 IonicContact OD2-CZ 2.69Å; D1182-R1189 IonicContact OD2-NE 3.32Å; D1182-R1189 PolarHBondContact OD2-NE 3.19Å; D1182-R1189 IonicContact OD2-NH2 3.74Å; D1182-R1189 PolarHBondContact OD2-NH2 2.84Å
1183	I	59.3	Low	70.8	Confident	72 Å²	72	50 Å²	50	37%	0.369	25%	0.249	S	C	.	.	H	α-helix	trans	-65.4	-46.4	175	-66	170.4	0	0	0	110.9	R1114 I1178 T1179 E1180 E1181 K1185 R1186	R1114-I1183 VanDerWaalsContact NH2-CG2 3.27Å; I1178-I1183 HydrophobicContact CG2-CD1 4.08Å; I1178-I1183 HydrophobicContact CG2-CG1 3.46Å; I1178-I1183 VanDerWaalsContact CG2-CG1 3.46Å; T1179-I1183 WeakPolarHBondContact O-CG1 3.42Å; T1179-I1183 PolarHBondContact O-N 2.89Å; E1180-I1183 WeakPolarHBondContact O-CB 3.33Å; E1180-I1183 PolarHBondContact O-N 3.38Å; E1181-I1183 PolarHBondContact O-N 3.44Å; I1183-K1185 VanDerWaalsContact C-N 3.35Å; I1183-R1186 PolarHBondContact O-N 3.37Å; I1183-R1186 VanDerWaalsContact O-N 3.11Å
1184	A	55.8	Low	70.8	Confident	75 Å²	75	49.4 Å²	49.4	62%	0.62	25%	0.245	S	C	*	.	H	α-helix	trans	-62.8	-41.5	179.1	0	0	0	0	0	111.9	E1180 E1181 R1186	E1180-A1184 PolarHBondContact O-N 2.94Å; E1181-A1184 PolarHBondContact O-N 3.24Å; A1184-R1186 VanDerWaalsContact C-N 3.27Å; A1184-R1186 PolarHBondContact O-N 3.27Å
1185	K	58.4	Low	70.8	Confident	98 Å²	98	47.8 Å²	47.8	43%	0.426	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-1.4	174.4	-70.1	176.6	174.7	174.9	0	114.2	E1181 D1182 I1183 Q1187 G1212	E1181-K1185 HydrophobicContact CG-CD 4.33Å; E1181-K1185 PolarHBondContact O-N 2.8Å; E1181-K1185 WeakPolarHBondContact OE1-CE 3.15Å; E1181-K1185 IonicContact OE1-NZ 2.71Å; E1181-K1185 PolarHBondContact OE1-NZ 3.13Å; D1182-K1185 CarbonylContact O-C 3.21Å; I1183-K1185 VanDerWaalsContact C-N 3.35Å; K1185-Q1187 HydrophobicContact CB-CB 4.31Å; K1185-Q1187 HydrophobicContact CB-CG 3.84Å; K1185-Q1187 PolarHBondContact O-N 2.74Å; K1185-G1212 WeakPolarHBondContact O-CA 3.37Å; K1185-G1212 PolarHBondContact O-N 2.75Å
1186	R	63	Low	70.5	Confident	117 Å²	117	47.8 Å²	47.8	44%	0.442	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	22.1	-175.5	-57.2	179.3	177.4	-168.8	0.1	114.6	L1113 D1182 I1183 A1184 G1212	L1113-R1186 WeakPolarHBondContact CD1-O 3.48Å; D1182-R1186 CarbonylContact O-C 3.55Å; D1182-R1186 WeakPolarHBondContact O-CA 3.47Å; D1182-R1186 PolarHBondContact O-N 3.24Å; I1183-R1186 PolarHBondContact O-N 3.37Å; I1183-R1186 VanDerWaalsContact O-N 3.11Å; A1184-R1186 VanDerWaalsContact C-N 3.27Å; A1184-R1186 PolarHBondContact O-N 3.27Å; R1186-G1212 WeakPolarHBondContact O-CA 3.49Å
1187	Q	64	Low	70.3	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.037	24%	0.241	C	C	.	.			trans	-97.6	164.1	-169.8	67.2	178.7	4.7	0	0	113.3	D1182 K1185 T1210	D1182-Q1187 HydrophobicContact CB-CG 4.01Å; D1182-Q1187 PolarHBondContact O-N 2.98Å; D1182-Q1187 PolarHBondContact OD1-NE2 2.9Å; K1185-Q1187 HydrophobicContact CB-CB 4.31Å; K1185-Q1187 HydrophobicContact CB-CG 3.84Å; K1185-Q1187 PolarHBondContact O-N 2.74Å; Q1187-T1210 WeakPolarHBondContact CA-O 3.33Å; Q1187-T1210 WeakPolarHBondContact CB-O 3.36Å
1188	V	68.6	Low	69.8	Low	2 Å²	2	43.3 Å²	43.3	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.1	162.5	-179.1	0	0	0	0	110.7	L1113 V1175 I1178 V1190 T1210	L1113-V1188 HydrophobicContact CB-CG2 3.79Å; L1113-V1188 HydrophobicContact CD1-CG2 4.2Å; L1113-V1188 HydrophobicContact CD2-CG2 3.82Å; L1113-V1188 HydrophobicContact CG-CG2 4.12Å; V1175-V1188 HydrophobicContact CG1-CG1 3.68Å; I1178-V1188 HydrophobicContact CD1-CG2 4.09Å; V1188-V1190 HydrophobicContact CG1-CG2 4.37Å; V1188-T1210 WeakPolarHBondContact CA-OG1 3.17Å; V1188-T1210 WeakPolarHBondContact CB-OG1 3.33Å; V1188-T1210 PolarHBondContact N-O 3.4Å; V1188-T1210 PolarHBondContact N-OG1 2.83Å; V1188-T1210 VanDerWaalsContact N-OG1 3.1Å; V1188-T1210 PolarHBondContact O-N 3.13Å; V1188-T1210 PolarHBondContact O-OG1 2.88Å
1189	R	69.4	Low	68.9	Low	44 Å²	44	48 Å²	48	17%	0.166	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.7	176.4	-65.2	-177.3	-63.5	-171.6	-7.4	111	R1176 T1179 D1182 I1208 Y1209	R1176-R1189 HydrophobicContact CB-CB 4.46Å; R1176-R1189 WeakPolarHBondContact CB-O 3.34Å; R1176-R1189 PolarHBondContact N-O 3.03Å; T1179-R1189 VanDerWaalsContact CG2-NH2 3.28Å; T1179-R1189 PolarHBondContact OG1-NH2 3.19Å; D1182-R1189 VanDerWaalsContact CG-NE 3.26Å; D1182-R1189 VanDerWaalsContact OD1-CD 3.24Å; D1182-R1189 WeakPolarHBondContact OD1-CD 3.4Å; D1182-R1189 WeakPolarHBondContact OD1-CG 3.14Å; D1182-R1189 IonicContact OD1-CZ 3.64Å; D1182-R1189 VanDerWaalsContact OD1-CZ 3.29Å; D1182-R1189 IonicContact OD1-NE 3.19Å; D1182-R1189 PolarHBondContact OD1-NE 2.9Å; D1182-R1189 IonicContact OD1-NH2 2.61Å; D1182-R1189 IonicContact OD2-CZ 2.69Å; D1182-R1189 IonicContact OD2-NE 3.32Å; D1182-R1189 PolarHBondContact OD2-NE 3.19Å; D1182-R1189 IonicContact OD2-NH2 3.74Å; D1182-R1189 PolarHBondContact OD2-NH2 2.84Å; R1189-I1208 WeakPolarHBondContact CA-O 3.44Å; R1189-Y1209 HydrophobicContact CG-CD1 3.64Å; R1189-Y1209 HydrophobicContact CG-CE1 3.67Å; R1189-Y1209 HydrophobicContact CG-CG 4.43Å
1190	V	78.2	Confident	68	Low	3 Å²	3	50.2 Å²	50.2	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	140.9	174.6	-169.5	0	0	0	0	108.9	V1122 L1126 I1173 L1174 V1175 V1188 I1192 R1207 I1208	V1122-V1190 HydrophobicContact CG1-CG2 3.68Å; L1126-V1190 HydrophobicContact CD1-CB 4.27Å; L1126-V1190 HydrophobicContact CD1-CG1 3.84Å; L1126-V1190 HydrophobicContact CD1-CG2 4.05Å; I1173-V1190 HydrophobicContact CG2-CG1 3.59Å; L1174-V1190 CarbonylContact O-C 3.45Å; L1174-V1190 WeakPolarHBondContact O-CA 3.38Å; V1175-V1190 HydrophobicContact CG1-CG2 4.48Å; V1175-V1190 HydrophobicContact CG2-CG1 4.34Å; V1175-V1190 HydrophobicContact CG2-CG2 4.29Å; V1188-V1190 HydrophobicContact CG1-CG2 4.37Å; V1190-I1192 HydrophobicContact CG1-CG1 4.29Å; V1190-R1207 CarbonylContact O-C 3.56Å; V1190-R1207 WeakPolarHBondContact O-CA 3.35Å; V1190-I1208 HydrophobicContact CB-CB 4.29Å; V1190-I1208 PolarHBondContact N-O 3.07Å; V1190-I1208 PolarHBondContact O-N 3.06Å
1191	L	76.9	Confident	67.4	Low	1 Å²	1	44.3 Å²	44.3	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.5	165.2	170.4	66.4	0	0	0	108.1	A1156 T1157 L1174 V1193 R1207	A1156-L1191 HydrophobicContact CB-CD2 4.39Å; A1156-L1191 WeakPolarHBondContact O-CD2 3.49Å; T1157-L1191 HydrophobicContact CG2-CD2 3.82Å; L1174-L1191 HydrophobicContact CB-CB 4.27Å; L1174-L1191 HydrophobicContact CD2-CB 4.47Å; L1174-L1191 HydrophobicContact CD2-CD2 4.31Å; L1174-L1191 PolarHBondContact N-O 3.09Å; L1174-L1191 PolarHBondContact O-N 3.15Å; L1191-V1193 HydrophobicContact CD2-CG2 4.41Å; L1191-V1193 HydrophobicContact CG-CG2 4.16Å; L1191-R1207 HydrophobicContact CD1-CG 3.95Å
1192	I	83.2	Confident	67.4	Low	3 Å²	3	47.3 Å²	47.3	2%	0.015	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	135	168.8	-55.8	178	0	0	0	107.7	I1097 L1130 V1190 Y1194 N1206 I1208	I1097-I1192 HydrophobicContact CD1-CD1 4.13Å; L1130-I1192 HydrophobicContact CD1-CD1 4.27Å; L1130-I1192 HydrophobicContact CD1-CG2 3.96Å; L1130-I1192 HydrophobicContact CD2-CG2 3.98Å; V1190-I1192 HydrophobicContact CG1-CG1 4.29Å; I1192-Y1194 HydrophobicContact CG2-CD1 4.15Å; I1192-N1206 PolarHBondContact N-O 3.47Å; I1192-N1206 PolarHBondContact O-N 2.65Å; I1192-I1208 HydrophobicContact CD1-CD1 3.51Å; I1192-I1208 HydrophobicContact CD1-CG1 4.17Å; I1192-I1208 HydrophobicContact CG1-CD1 4.35Å
1193	V	83.9	Confident	67.5	Low	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.8	168.6	-169	0	0	0	0	107.8	I1153 T1157 V1166 Y1171 Y1172 L1191 Y1203 K1204 T1205	I1153-V1193 HydrophobicContact CD1-CG1 4.42Å; I1153-V1193 HydrophobicContact CG1-CG1 4.02Å; I1153-V1193 HydrophobicContact CG2-CG1 4.18Å; T1157-V1193 HydrophobicContact CG2-CG2 3.65Å; V1166-V1193 HydrophobicContact CG2-CB 3.9Å; V1166-V1193 HydrophobicContact CG2-CG1 3.73Å; Y1171-V1193 CarbonylContact C-O 3.52Å; Y1171-V1193 WeakPolarHBondContact CA-O 3.22Å; Y1171-V1193 WeakPolarHBondContact CB-O 3.37Å; Y1172-V1193 PolarHBondContact N-O 3.35Å; Y1172-V1193 PolarHBondContact O-N 3.02Å; L1191-V1193 HydrophobicContact CD2-CG2 4.41Å; L1191-V1193 HydrophobicContact CG-CG2 4.16Å; V1193-Y1203 HydrophobicContact CG1-CD2 4.33Å; V1193-K1204 VanDerWaalsContact CA-O 3.31Å; V1193-K1204 WeakPolarHBondContact CA-O 3.45Å; V1193-K1204 WeakPolarHBondContact CG1-O 3.23Å; V1193-T1205 HydrophobicContact CG1-CG2 4.11Å; V1193-T1205 HydrophobicContact CG2-CG2 4.13Å
1194	Y	87.6	Confident	67.9	Low	7 Å²	7	48.5 Å²	48.5	3%	0.027	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	155.4	179	65	-84.4	0	0	0	112	E1090 L1093 I1139 G1170 I1192 A1196 Y1203 K1204	E1090-Y1194 WeakPolarHBondContact CG-OH 3.39Å; L1093-Y1194 HydrophobicContact CD2-CE1 4.3Å; L1093-Y1194 HydrophobicContact CD2-CE2 4.44Å; I1139-Y1194 HydrophobicContact CD1-CD2 4.34Å; I1139-Y1194 HydrophobicContact CD1-CG 4.39Å; I1139-Y1194 HydrophobicContact CG1-CD2 3.89Å; I1139-Y1194 HydrophobicContact CG1-CG 4.4Å; G1170-Y1194 CarbonylContact O-C 3.53Å; G1170-Y1194 VanDerWaalsContact O-CA 3.28Å; G1170-Y1194 WeakPolarHBondContact O-CA 3.27Å; I1192-Y1194 HydrophobicContact CG2-CD1 4.15Å; Y1194-A1196 HydrophobicContact CE2-CB 4.18Å; Y1194-Y1203 CarbonylContact O-C 2.97Å; Y1194-Y1203 WeakPolarHBondContact O-CA 3.12Å; Y1194-K1204 HydrophobicContact CD1-CB 4.19Å; Y1194-K1204 HydrophobicContact CD2-CB 4.34Å; Y1194-K1204 HydrophobicContact CE1-CB 3.69Å; Y1194-K1204 HydrophobicContact CE2-CB 3.87Å; Y1194-K1204 HydrophobicContact CE2-CG 4.01Å; Y1194-K1204 HydrophobicContact CG-CB 4.48Å; Y1194-K1204 PolarHBondContact N-O 2.89Å; Y1194-K1204 VanDerWaalsContact N-O 3.08Å; Y1194-K1204 PolarHBondContact O-N 3.34Å
1195	L	82.9	Confident	67.7	Low	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	110.1	167.5	-68.1	177.8	0	0	0	108.9	I1139 A1140 G1142 L1145 V1166 G1170 A1197	I1139-L1195 WeakPolarHBondContact CA-O 3.49Å; A1140-L1195 HydrophobicContact CB-CB 3.89Å; A1140-L1195 HydrophobicContact CB-CD1 4.4Å; A1140-L1195 PolarHBondContact N-O 2.73Å; G1142-L1195 WeakPolarHBondContact O-CD1 3.31Å; L1145-L1195 HydrophobicContact CD2-CD2 3.74Å; V1166-L1195 HydrophobicContact CG1-CD1 4.47Å; V1166-L1195 HydrophobicContact CG1-CD2 3.87Å; V1166-L1195 HydrophobicContact CG1-CG 3.69Å; G1170-L1195 PolarHBondContact O-N 3.3Å; L1195-A1197 PolarHBondContact O-N 3.13Å
1196	A	78.1	Confident	67.5	Low	15 Å²	15	40.9 Å²	40.9	12%	0.124	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	124.1	163.7	0	0	0	0	0	108.3	Y1194 N1201 R1202 K1204	Y1194-A1196 HydrophobicContact CE2-CB 4.18Å; A1196-N1201 WeakPolarHBondContact O-CA 3.4Å; A1196-R1202 PolarHBondContact N-O 2.84Å; A1196-R1202 PolarHBondContact O-N 3.08Å; A1196-K1204 HydrophobicContact CB-CG 3.85Å
1197	A	72.4	Confident	66.9	Low	35 Å²	35	38.7 Å²	38.7	29%	0.289	21%	0.208	S	C	.	.			trans	-70.3	146.7	179.4	0	0	0	0	0	111.5	G1137 V1138 A1140 L1195 N1201	G1137-A1197 WeakPolarHBondContact O-CB 3.26Å; V1138-A1197 PolarHBondContact O-N 2.61Å; A1140-A1197 HydrophobicContact CB-CB 4.17Å; L1195-A1197 PolarHBondContact O-N 3.13Å; A1197-N1201 WeakPolarHBondContact CA-OD1 3.49Å
1198	G	64.1	Low	66.2	Low	52 Å²	52	38.4 Å²	38.4	54%	0.536	21%	0.207	S	C	.	.	S	Bend	trans	175.3	-166.2	175.6	0	0	0	0	0	112.4	V1200 N1201	G1198-V1200 PolarHBondContact O-N 3.24Å; G1198-N1201 PolarHBondContact N-OD1 3.25Å; G1198-N1201 PolarHBondContact O-OD1 2.76Å
1199	V	49.6	Very low	65	Low	147 Å²	147	40.7 Å²	40.7	89%	0.891	22%	0.215	S	C	*	.	S	Bend	trans	-62.5	-29.4	175.8	-177.2	0	0	0	0	111.7
1200	V	45.6	Very low	63.7	Low	107 Å²	107	39.8 Å²	39.8	65%	0.648	22%	0.215	S	C	*	.	S	Bend	trans	-133.8	116.1	164.4	-178.8	0	0	0	0	106	G1198	G1198-V1200 PolarHBondContact O-N 3.24Å
1201	N	49.6	Very low	61.9	Low	47 Å²	47	42.9 Å²	42.9	25%	0.251	23%	0.231	S	C	.	.			trans	-60.9	137.1	175.5	-65.8	-15.7	0	0	0	109.2	A1140 G1142 A1196 A1197 G1198	A1140-N1201 HydrophobicContact CB-CB 4.48Å; A1140-N1201 WeakPolarHBondContact CB-ND2 3.46Å; G1142-N1201 PolarHBondContact O-ND2 3.14Å; A1196-N1201 WeakPolarHBondContact O-CA 3.4Å; A1197-N1201 WeakPolarHBondContact CA-OD1 3.49Å; G1198-N1201 PolarHBondContact N-OD1 3.25Å; G1198-N1201 PolarHBondContact O-OD1 2.76Å
1202	R	61.8	Low	60	Low	158 Å²	158	43.3 Å²	43.3	60%	0.596	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	138.5	177.9	-62.8	-176.6	-169	160	5.1	110	A1196	A1196-R1202 PolarHBondContact N-O 2.84Å; A1196-R1202 PolarHBondContact O-N 3.08Å
1203	Y	64.7	Low	57.8	Low	59 Å²	59	47.5 Å²	47.5	23%	0.231	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	143	172.9	87	-77	0	0	0	111.4	E1149 S1152 I1153 V1193 Y1194 T1205	E1149-Y1203 HydrophobicContact CB-CD1 3.8Å; E1149-Y1203 HydrophobicContact CB-CE1 4.03Å; E1149-Y1203 HydrophobicContact CG-CD1 3.65Å; E1149-Y1203 HydrophobicContact CG-CE1 3.76Å; S1152-Y1203 WeakPolarHBondContact CB-OH 3.41Å; I1153-Y1203 HydrophobicContact CD1-CD2 4.08Å; I1153-Y1203 HydrophobicContact CD1-CG 3.92Å; I1153-Y1203 HydrophobicContact CG1-CD2 3.52Å; I1153-Y1203 HydrophobicContact CG1-CE2 4.03Å; I1153-Y1203 HydrophobicContact CG1-CG 3.87Å; V1193-Y1203 HydrophobicContact CG1-CD2 4.33Å; Y1194-Y1203 CarbonylContact O-C 2.97Å; Y1194-Y1203 WeakPolarHBondContact O-CA 3.12Å; Y1203-T1205 HydrophobicContact CD2-CG2 3.95Å; Y1203-T1205 HydrophobicContact CE2-CG2 3.85Å
1204	K	68.2	Low	55.4	Low	39 Å²	39	50.4 Å²	50.4	17%	0.17	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	144.5	173.3	-67.7	-76.2	-178.6	151.2	0	108.5	E1090 V1193 Y1194 A1196	E1090-K1204 WeakPolarHBondContact OE1-CD 3.32Å; E1090-K1204 WeakPolarHBondContact OE1-CE 3.27Å; E1090-K1204 IonicContact OE1-NZ 3.61Å; E1090-K1204 PolarHBondContact OE1-NZ 3.18Å; V1193-K1204 VanDerWaalsContact CA-O 3.31Å; V1193-K1204 WeakPolarHBondContact CA-O 3.45Å; V1193-K1204 WeakPolarHBondContact CG1-O 3.23Å; Y1194-K1204 HydrophobicContact CD1-CB 4.19Å; Y1194-K1204 HydrophobicContact CD2-CB 4.34Å; Y1194-K1204 HydrophobicContact CE1-CB 3.69Å; Y1194-K1204 HydrophobicContact CE2-CB 3.87Å; Y1194-K1204 HydrophobicContact CE2-CG 4.01Å; Y1194-K1204 HydrophobicContact CG-CB 4.48Å; Y1194-K1204 PolarHBondContact N-O 2.89Å; Y1194-K1204 VanDerWaalsContact N-O 3.08Å; Y1194-K1204 PolarHBondContact O-N 3.34Å; A1196-K1204 HydrophobicContact CB-CG 3.85Å
1205	T	52.2	Low	52.8	Low	7 Å²	7	55.4 Å²	55.4	4%	0.043	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	119.5	177.7	52.8	0	0	0	0	110.3	G683 V684 K685 A1156 V1193 Y1203	G683-T1205 PolarHBondContact O-OG1 2.87Å; V684-T1205 WeakPolarHBondContact CA-OG1 3.36Å; K685-T1205 PolarHBondContact N-O 2.73Å; A1156-T1205 HydrophobicContact CB-CG2 4.29Å; V1193-T1205 HydrophobicContact CG1-CG2 4.11Å; V1193-T1205 HydrophobicContact CG2-CG2 4.13Å; Y1203-T1205 HydrophobicContact CD2-CG2 3.95Å; Y1203-T1205 HydrophobicContact CE2-CG2 3.85Å
1206	N	54	Low	50.3	Low	7 Å²	7	61.4 Å²	61.4	4%	0.037	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	124	-177.9	-157.2	-19.2	0	0	0	110.9	M687 E1094 I1192	M687-N1206 WeakPolarHBondContact CB-OD1 3.38Å; M687-N1206 VanDerWaalsContact CE-ND2 3.33Å; M687-N1206 WeakPolarHBondContact CE-ND2 3.21Å; M687-N1206 PolarHBondContact N-OD1 3.1Å; E1094-N1206 PolarHBondContact OE1-ND2 3.17Å; I1192-N1206 PolarHBondContact N-O 3.47Å; I1192-N1206 PolarHBondContact O-N 2.65Å
1207	R	49	Very low	47.9	Very low	71 Å²	71	61.3 Å²	61.3	27%	0.268	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	103.4	-178.8	-66.8	177.7	178.4	-178.5	4.3	109.7	V684 K685 I686 M687 V1190 L1191 Y1209	V684-R1207 HydrophobicContact CG1-CG 4.15Å; K685-R1207 WeakPolarHBondContact O-CB 3.23Å; K685-R1207 PolarHBondContact O-N 2.85Å; I686-R1207 HydrophobicContact CG1-CB 4.22Å; M687-R1207 PolarHBondContact N-O 2.94Å; V1190-R1207 CarbonylContact O-C 3.56Å; V1190-R1207 WeakPolarHBondContact O-CA 3.35Å; L1191-R1207 HydrophobicContact CD1-CG 3.95Å; R1207-Y1209 HydrophobicContact CB-CE2 4.06Å
1208	I	50.1	Low	45.7	Very low	1 Å²	1	65.3 Å²	65.3	1%	0.005	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	123.8	172.6	-50.7	-168.5	0	0	0	109.8	M687 L689 I1097 L1126 R1189 V1190 I1192 T1210	M687-I1208 HydrophobicContact CB-CG1 4.34Å; M687-I1208 HydrophobicContact CE-CD1 3.85Å; M687-I1208 HydrophobicContact CE-CG1 3.86Å; M687-I1208 CarbonylContact O-C 3.51Å; M687-I1208 WeakPolarHBondContact O-CA 3.37Å; M687-I1208 HydrophobicContact SD-CD1 3.74Å; M687-I1208 HydrophobicContact SD-CG1 3.85Å; M687-I1208 HydrophobicContact SD-CG2 4.48Å; L689-I1208 HydrophobicContact CG-CG2 4.32Å; I1097-I1208 HydrophobicContact CD1-CD1 4.28Å; I1097-I1208 HydrophobicContact CG2-CD1 3.67Å; L1126-I1208 HydrophobicContact CD2-CD1 4.25Å; R1189-I1208 WeakPolarHBondContact CA-O 3.44Å; V1190-I1208 HydrophobicContact CB-CB 4.29Å; V1190-I1208 PolarHBondContact N-O 3.07Å; V1190-I1208 PolarHBondContact O-N 3.06Å; I1192-I1208 HydrophobicContact CD1-CD1 3.51Å; I1192-I1208 HydrophobicContact CD1-CG1 4.17Å; I1192-I1208 HydrophobicContact CG1-CD1 4.35Å; I1208-T1210 HydrophobicContact CG2-CG2 4.08Å
1209	Y	44.3	Very low	43.8	Very low	50 Å²	50	71.2 Å²	71.2	20%	0.196	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	106.8	160.4	-64.1	-107.4	0	0	0	105.9	I686 M687 S688 L689 R1189 R1207 D1211	I686-Y1209 HydrophobicContact CB-CE2 4.39Å; I686-Y1209 HydrophobicContact CD1-CE2 4.22Å; I686-Y1209 HydrophobicContact CG1-CE2 4.1Å; I686-Y1209 HydrophobicContact CG2-CD2 3.66Å; I686-Y1209 HydrophobicContact CG2-CE2 3.57Å; M687-Y1209 PolarHBondContact O-N 2.85Å; S688-Y1209 CarbonylContact C-O 3.18Å; L689-Y1209 PolarHBondContact N-O 3.49Å; R1189-Y1209 HydrophobicContact CG-CD1 3.64Å; R1189-Y1209 HydrophobicContact CG-CE1 3.67Å; R1189-Y1209 HydrophobicContact CG-CG 4.43Å; R1207-Y1209 HydrophobicContact CB-CE2 4.06Å; Y1209-D1211 PolarHBondContact O-N 3.02Å
1210	T	42.1	Very low	42.5	Very low	26 Å²	26	73.4 Å²	73.4	16%	0.16	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	84.2	165.3	51.7	0	0	0	0	106.1	L689 V1101 Q1187 V1188 I1208 G1212	L689-T1210 HydrophobicContact CD1-CG2 3.81Å; V1101-T1210 HydrophobicContact CG1-CG2 4.45Å; Q1187-T1210 WeakPolarHBondContact CA-O 3.33Å; Q1187-T1210 WeakPolarHBondContact CB-O 3.36Å; V1188-T1210 WeakPolarHBondContact CA-OG1 3.17Å; V1188-T1210 WeakPolarHBondContact CB-OG1 3.33Å; V1188-T1210 PolarHBondContact N-O 3.4Å; V1188-T1210 PolarHBondContact N-OG1 2.83Å; V1188-T1210 VanDerWaalsContact N-OG1 3.1Å; V1188-T1210 PolarHBondContact O-N 3.13Å; V1188-T1210 PolarHBondContact O-OG1 2.88Å; I1208-T1210 HydrophobicContact CG2-CG2 4.08Å; T1210-G1212 PolarHBondContact O-N 3.24Å
1211	D	39.5	Very low	41.4	Very low	67 Å²	67	76.3 Å²	76.3	36%	0.358	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-58.7	135	-174.9	-164.7	19.4	0	0	0	109.1	Y1209	Y1209-D1211 PolarHBondContact O-N 3.02Å
1212	G	37.9	Very low	40.2	Very low	11 Å²	11	80.4 Å²	80.4	11%	0.113	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-74.9	170.2	-175.8	0	0	0	0	0	110.8	K1185 R1186 T1210 A1214	K1185-G1212 WeakPolarHBondContact O-CA 3.37Å; K1185-G1212 PolarHBondContact O-N 2.75Å; R1186-G1212 WeakPolarHBondContact O-CA 3.49Å; T1210-G1212 PolarHBondContact O-N 3.24Å; G1212-A1214 PolarHBondContact O-N 3.46Å; G1212-A1214 VanDerWaalsContact O-N 3.1Å
1213	F	35.6	Very low	38.6	Very low	90 Å²	90	77 Å²	77	40%	0.395	40%	0.399	S	S	.	.	S	Bend	trans	-49.9	125	160.2	-51.5	-86.4	0	0	0	107.9	W691 I1218	W691-F1213 HydrophobicContact CH2-CE1 4.48Å; F1213-I1218 HydrophobicContact CD1-CD1 4.33Å; F1213-I1218 HydrophobicContact CE1-CD1 4.38Å
1214	A	33.4	Very low	36.6	Very low	61 Å²	61	76.5 Å²	76.5	50%	0.504	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-46.2	158.7	-177.6	0	0	0	0	0	112.4	G1212 D1216 G1217	G1212-A1214 PolarHBondContact O-N 3.46Å; G1212-A1214 VanDerWaalsContact O-N 3.1Å; A1214-D1216 HydrophobicContact CB-CB 4.37Å; A1214-D1216 CarbonylContact O-C 3.41Å; A1214-D1216 PolarHBondContact O-N 3.12Å; A1214-G1217 WeakPolarHBondContact O-CA 3.31Å; A1214-G1217 PolarHBondContact O-N 2.99Å
1215	S	34.6	Very low	34.8	Very low	112 Å²	112	77.1 Å²	77.1	78%	0.783	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.9	-39.8	175.4	31.8	0	0	0	0	113.3	G1217	S1215-G1217 PolarHBondContact O-N 3.46Å
1216	D	30.4	Very low	34.2	Very low	127 Å²	127	77 Å²	77	68%	0.679	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	11.8	173.8	-52	54.4	0	0	0	115	A1214	A1214-D1216 HydrophobicContact CB-CB 4.37Å; A1214-D1216 CarbonylContact O-C 3.41Å; A1214-D1216 PolarHBondContact O-N 3.12Å
1217	G	26.3	Very low	33.3	Very low	14 Å²	14	79 Å²	79	14%	0.144	42%	0.422	C	S	.	.			trans	-62.6	157.6	-155.5	0	0	0	0	0	115.2	A1214 S1215 Q1219	A1214-G1217 WeakPolarHBondContact O-CA 3.31Å; A1214-G1217 PolarHBondContact O-N 2.99Å; S1215-G1217 PolarHBondContact O-N 3.46Å; G1217-Q1219 PolarHBondContact O-N 3.34Å
1218	I	26.1	Very low	32.6	Very low	118 Å²	118	79.6 Å²	79.6	61%	0.605	43%	0.433	S	S	*	.			trans	-40.8	113.3	-179	-58.5	172.9	0	0	0	110.4	F1213 W1220	F1213-I1218 HydrophobicContact CD1-CD1 4.33Å; F1213-I1218 HydrophobicContact CE1-CD1 4.38Å; I1218-W1220 PolarHBondContact O-N 3.37Å
1219	Q	25	Very low	31.9	Very low	177 Å²	177	84 Å²	84	83%	0.827	46%	0.456	S	S	*	.			trans	-65.5	129	179.5	-67.5	-177.9	-97.8	0	0	109.5	G1217	G1217-Q1219 PolarHBondContact O-N 3.34Å
1220	W	22.5	Very low	31.3	Very low	192 Å²	192	86 Å²	86	73%	0.727	47%	0.474	S	S	*	.			trans	-108	143	160.7	-72.7	75.4	0	0	0	106.6	I1218 D1222	I1218-W1220 PolarHBondContact O-N 3.37Å; W1220-D1222 PolarHBondContact O-N 3.39Å
1221	D	22.9	Very low	31.1	Very low	168 Å²	168	86.3 Å²	86.3	90%	0.898	48%	0.481	S	S	*	.			trans	-62	121.5	177.1	-49.5	-48	0	0	0	109.2
1222	D	22.9	Very low	31.2	Very low	133 Å²	133	89 Å²	89	71%	0.711	51%	0.514	S	S	*	.			trans	-110.5	158.4	177.5	-140.9	-30.3	0	0	0	111	W1220	W1220-D1222 PolarHBondContact O-N 3.39Å
1223	V	28.7	Very low	31.3	Very low	86 Å²	86	92.6 Å²	92.6	52%	0.521	53%	0.53	S	S	.	.			trans	-127.2	86.1	-155.9	-174.9	0	0	0	0	110.9	I1873	V1223-I1873 HydrophobicContact CG1-CB 4.3Å; V1223-I1873 HydrophobicContact CG1-CD1 3.97Å; V1223-I1873 HydrophobicContact CG1-CG2 3.84Å
1224	E	23.3	Very low	31.2	Very low	49 Å²	49	90.6 Å²	90.6	23%	0.229	54%	0.535	C	S	.	.			trans	-98.5	154.6	-160.3	-53.4	-177.4	103	0	0	114.5	D1869 T1870 V1871 N1872 I1873	E1224-D1869 WeakPolarHBondContact OE2-CA 3.49Å; E1224-D1869 WeakPolarHBondContact OE2-CB 3.48Å; E1224-T1870 WeakPolarHBondContact OE1-CG2 3.35Å; E1224-T1870 WeakPolarHBondContact OE2-CA 3.47Å; E1224-V1871 VanDerWaalsContact C-C 3.47Å; E1224-V1871 CarbonylContact C-O 3.55Å; E1224-V1871 HydrophobicContact CB-CB 3.81Å; E1224-V1871 HydrophobicContact CB-CG2 3.69Å; E1224-V1871 VanDerWaalsContact CB-N 3.28Å; E1224-V1871 VanDerWaalsContact CB-O 3.27Å; E1224-V1871 WeakPolarHBondContact CB-O 3.37Å; E1224-V1871 HydrophobicContact CG-CB 4.46Å; E1224-V1871 HydrophobicContact CG-CG2 3.8Å; E1224-V1871 CarbonylContact O-C 3.09Å; E1224-V1871 WeakPolarHBondContact OE2-CG2 3.42Å; E1224-V1871 PolarHBondContact OE2-N 2.97Å; E1224-N1872 WeakPolarHBondContact O-CA 3.32Å; E1224-N1872 PolarHBondContact O-N 2.84Å; E1224-I1873 WeakPolarHBondContact O-CA 3.46Å; E1224-I1873 WeakPolarHBondContact O-CB 3.49Å; E1224-I1873 WeakPolarHBondContact O-CG1 3.3Å
1225	P	30.8	Very low	31	Very low	52 Å²	52	92 Å²	92	34%	0.338	53%	0.534	S	S	.	.			trans	-98.2	138.8	-157.9	35.5	-34.8	0	0	0	117	V1238 V1871 N1872 A1874	P1225-V1238 HydrophobicContact CB-CG1 3.57Å; P1225-V1238 HydrophobicContact CG-CG1 4.14Å; P1225-V1871 VanDerWaalsContact N-O 3.13Å; P1225-N1872 PolarHBondContact O-ND2 2.77Å; P1225-A1874 WeakPolarHBondContact CB-O 3.43Å
1226	A	39.4	Very low	30.9	Very low	6 Å²	6	90 Å²	90	5%	0.05	52%	0.518	C	S	.	.			trans	-80.1	-36.9	-161.8	0	0	0	0	0	120.5	N1872 A1874	A1226-N1872 VanDerWaalsContact CA-CB 3.45Å; A1226-N1872 HydrophobicContact CB-CB 3.58Å; A1226-A1874 VanDerWaalsContact CB-CA 3.46Å; A1226-A1874 HydrophobicContact CB-CB 4.32Å
1227	S	33.5	Very low	31.1	Very low	49 Å²	49	85 Å²	85	34%	0.343	49%	0.492	S	S	.	.			trans	-162.1	86.1	-159.9	59.3	0	0	0	0	112.3	D1229 G1875 G1876	S1227-D1229 PolarHBondContact O-N 2.93Å; S1227-G1875 VanDerWaalsContact C-C 3.42Å; S1227-G1875 CarbonylContact C-O 3.52Å; S1227-G1875 PolarHBondContact N-O 3.42Å; S1227-G1875 CarbonylContact O-C 3.58Å; S1227-G1876 PolarHBondContact O-N 3.08Å
1228	V	34.7	Very low	31.2	Very low	82 Å²	82	85.1 Å²	85.1	50%	0.497	49%	0.49	S	S	.	.			trans	-66.3	99.7	-175.9	-164.3	0	0	0	0	110.5	P1236 S1237 V1238 G1875	V1228-P1236 HydrophobicContact CG1-CB 3.36Å; V1228-S1237 WeakPolarHBondContact CA-O 3.42Å; V1228-V1238 HydrophobicContact CG1-CG2 3.98Å; V1228-V1238 HydrophobicContact CG2-CG2 4.19Å; V1228-G1875 PolarHBondContact N-O 3.09Å
1229	D	36.5	Very low	31.7	Very low	93 Å²	93	83.9 Å²	83.9	50%	0.497	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	131.3	-178.9	-78.7	-42.7	0	0	0	110.3	S1227 P1236 S1237 G1876	S1227-D1229 PolarHBondContact O-N 2.93Å; D1229-P1236 CarbonylContact O-C 3.06Å; D1229-P1236 WeakPolarHBondContact O-CA 3.23Å; D1229-S1237 PolarHBondContact N-O 2.95Å; D1229-S1237 VanDerWaalsContact O-CB 3.3Å; D1229-S1237 WeakPolarHBondContact O-CB 3.09Å; D1229-S1237 PolarHBondContact O-N 2.91Å; D1229-S1237 PolarHBondContact O-OG 2.84Å; D1229-G1876 WeakPolarHBondContact OD2-CA 3.45Å
1230	V	31.4	Very low	31.8	Very low	94 Å²	94	81 Å²	81	57%	0.57	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	121.6	179.1	-168.3	0	0	0	0	109.8	G1234 P1236	V1230-G1234 VanDerWaalsContact CG1-C 3.43Å; V1230-G1234 WeakPolarHBondContact CG1-O 3.07Å; V1230-P1236 HydrophobicContact CG2-CB 4.26Å; V1230-P1236 HydrophobicContact CG2-CG 4.23Å
1231	G	37.3	Very low	32.1	Very low	31 Å²	31	80.3 Å²	80.3	32%	0.32	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-66.2	167.3	179.6	0	0	0	0	0	113.7	D1233 G1234 L1235	G1231-D1233 WeakPolarHBondContact CA-OD1 3.43Å; G1231-D1233 PolarHBondContact O-N 3.38Å; G1231-G1234 PolarHBondContact O-N 3.48Å; G1231-L1235 PolarHBondContact N-O 3.39Å
1232	A	42.8	Very low	32.4	Very low	125 Å²	125	78 Å²	78	100%	1.033	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-8.1	176.8	0	0	0	0	0	113.8
1233	D	38.6	Very low	32.8	Very low	86 Å²	86	76.8 Å²	76.8	46%	0.46	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-9.6	168.5	62.1	-13.7	0	0	0	113.3	G1231 L1235	G1231-D1233 WeakPolarHBondContact CA-OD1 3.43Å; G1231-D1233 PolarHBondContact O-N 3.38Å; D1233-L1235 PolarHBondContact OD1-N 3.3Å; D1233-L1235 VanDerWaalsContact OD1-N 3.12Å
1234	G	33	Very low	33	Very low	48 Å²	48	78 Å²	78	50%	0.495	47%	0.474	S	S	.	.	S	Bend	trans	91.1	8	-178.5	0	0	0	0	0	115.2	V1230 G1231	V1230-G1234 VanDerWaalsContact CG1-C 3.43Å; V1230-G1234 WeakPolarHBondContact CG1-O 3.07Å; G1231-G1234 PolarHBondContact O-N 3.48Å
1235	L	29.3	Very low	33.3	Very low	91 Å²	91	83 Å²	83	48%	0.476	49%	0.492	S	S	.	.			trans	-98.7	129.1	-178.9	-73.3	175.1	0	0	0	113.2	G1231 D1233	G1231-L1235 PolarHBondContact N-O 3.39Å; D1233-L1235 PolarHBondContact OD1-N 3.3Å; D1233-L1235 VanDerWaalsContact OD1-N 3.12Å
1236	P	33.4	Very low	33.2	Very low	69 Å²	69	83.2 Å²	83.2	45%	0.448	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	149.9	175.6	-14.6	29.3	0	0	0	113.4	V1228 D1229 V1230	V1228-P1236 HydrophobicContact CG1-CB 3.36Å; D1229-P1236 CarbonylContact O-C 3.06Å; D1229-P1236 WeakPolarHBondContact O-CA 3.23Å; V1230-P1236 HydrophobicContact CG2-CB 4.26Å; V1230-P1236 HydrophobicContact CG2-CG 4.23Å
1237	S	33.7	Very low	32.9	Very low	21 Å²	21	85.3 Å²	85.3	15%	0.147	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	146.9	-163.5	79.5	0	0	0	0	113.5	V1228 D1229 G1876 G1877 A1878	V1228-S1237 WeakPolarHBondContact CA-O 3.42Å; D1229-S1237 PolarHBondContact N-O 2.95Å; D1229-S1237 VanDerWaalsContact O-CB 3.3Å; D1229-S1237 WeakPolarHBondContact O-CB 3.09Å; D1229-S1237 PolarHBondContact O-N 2.91Å; D1229-S1237 PolarHBondContact O-OG 2.84Å; S1237-G1876 PolarHBondContact O-N 3.05Å; S1237-G1877 PolarHBondContact O-N 2.92Å; S1237-G1877 VanDerWaalsContact O-N 3.16Å; S1237-G1877 VanDerWaalsContact OG-CA 3.23Å; S1237-G1877 WeakPolarHBondContact OG-CA 3.44Å; S1237-G1877 PolarHBondContact OG-N 2.99Å; S1237-G1877 VanDerWaalsContact OG-N 3.13Å; S1237-A1878 VanDerWaalsContact CB-N 3.33Å
1238	V	29	Very low	32.7	Very low	17 Å²	17	84.7 Å²	84.7	10%	0.103	51%	0.508	C	S	.	.			trans	-130.9	93.4	-166.6	-173.8	0	0	0	0	118.7	P1225 V1228 G1875 G1876 G1877 G1879	P1225-V1238 HydrophobicContact CB-CG1 3.57Å; P1225-V1238 HydrophobicContact CG-CG1 4.14Å; V1228-V1238 HydrophobicContact CG1-CG2 3.98Å; V1228-V1238 HydrophobicContact CG2-CG2 4.19Å; V1238-G1875 VanDerWaalsContact CA-C 3.48Å; V1238-G1875 WeakPolarHBondContact CA-O 3.33Å; V1238-G1876 VanDerWaalsContact CA-N 3.31Å; V1238-G1877 VanDerWaalsContact C-C 3.46Å; V1238-G1877 CarbonylContact C-O 3.36Å; V1238-G1877 PolarHBondContact N-O 3.15Å; V1238-G1879 WeakPolarHBondContact CG1-O 3.22Å; V1238-G1879 CarbonylContact O-C 3.5Å; V1238-G1879 WeakPolarHBondContact O-CA 3.22Å; V1238-G1879 PolarHBondContact O-N 3.35Å
1239	N	36	Very low	32.6	Very low	92 Å²	92	87.4 Å²	87.4	49%	0.492	51%	0.514	S	S	.	.			trans	-103.7	130.1	-174.6	-105.4	-44	0	0	0	115.1	A1874 G1875 G1876 G1877	N1239-A1874 CarbonylContact O-C 3.56Å; N1239-A1874 WeakPolarHBondContact O-CB 3.29Å; N1239-G1875 VanDerWaalsContact N-C 3.31Å; N1239-G1875 WeakPolarHBondContact O-CA 3.49Å; N1239-G1875 PolarHBondContact O-N 2.89Å; N1239-G1876 WeakPolarHBondContact CB-O 3.33Å; N1239-G1876 VanDerWaalsContact N-N 3.13Å; N1239-G1876 PolarHBondContact ND2-O 3.39Å; N1239-G1877 WeakPolarHBondContact CA-O 3.4Å; N1239-G1877 PolarHBondContact N-O 3.35Å; N1239-G1877 VanDerWaalsContact N-O 3.12Å; N1239-G1877 WeakPolarHBondContact ND2-CA 3.22Å
1240	M	27.8	Very low	32.4	Very low	118 Å²	118	85.9 Å²	85.9	58%	0.581	51%	0.508	S	S	*	.			trans	-97.4	143.4	178.9	-54.4	-173.8	-178.3	0	0	114.7	A1874	M1240-A1874 WeakPolarHBondContact CG-O 3.25Å
1241	K	29	Very low	32.3	Very low	177 Å²	177	85.6 Å²	85.6	77%	0.77	50%	0.502	S	S	*	.			trans	-148.6	108.8	168.4	-73.3	-167.1	179.1	175.2	0	113.7
1242	P	28.9	Very low	31.8	Very low	118 Å²	118	88 Å²	88	77%	0.766	50%	0.504	S	S	*	.			trans	-71.8	150.5	170.9	-16.6	31.1	0	0	0	113.1
1243	V	32.5	Very low	31.5	Very low	108 Å²	108	84.5 Å²	84.5	66%	0.655	47%	0.471	S	S	*	.			trans	-113.7	111.9	170.7	179.5	0	0	0	0	109.2	Y1245	V1243-Y1245 HydrophobicContact CG1-CE2 3.93Å
1244	V	32.9	Very low	31	Very low	112 Å²	112	85.3 Å²	85.3	68%	0.679	48%	0.475	S	S	*	.			trans	-102.3	119.2	-178.3	179.7	0	0	0	0	110.2	T1246	V1244-T1246 HydrophobicContact CG1-CG2 4.2Å
1245	Y	28.6	Very low	30.9	Very low	155 Å²	155	86.4 Å²	86.4	61%	0.608	48%	0.475	S	S	*	.			trans	-89.1	130.5	167.1	-58.9	-89.4	0	0	0	109.1	V1243	V1243-Y1245 HydrophobicContact CG1-CE2 3.93Å
1246	T	29.6	Very low	30.9	Very low	55 Å²	55	87 Å²	87	34%	0.337	48%	0.479	S	S	.	.			trans	-131.7	137.5	173.3	31.7	0	0	0	0	108.9	V1244 F1999	V1244-T1246 HydrophobicContact CG1-CG2 4.2Å; T1246-F1999 HydrophobicContact CG2-CZ 3.99Å
1247	G	32.5	Very low	30.7	Very low	50 Å²	50	85.7 Å²	85.7	52%	0.515	47%	0.471	S	S	.	.	B	Isolated β-bridge	trans	-137.3	121.8	175.8	0	0	0	0	0	109.7
1248	T	29.3	Very low	30.6	Very low	37 Å²	37	91 Å²	91	23%	0.227	49%	0.488	C	S	.	.			trans	-78.7	137.8	-175.4	-36.6	0	0	0	0	111.6	L1283	T1248-L1283 WeakPolarHBondContact O-CD2 3.28Å
1249	F	33.2	Very low	31	Very low	139 Å²	139	95.8 Å²	95.8	61%	0.61	51%	0.513	S	S	*	.			trans	-116.6	135.6	-179.8	-177.4	-98	0	0	0	110.7	L1251 L1281	F1249-L1251 HydrophobicContact CE1-CD1 3.86Å; F1249-L1251 HydrophobicContact CE1-CD2 4.05Å; F1249-L1251 HydrophobicContact CE1-CG 3.84Å; F1249-L1251 HydrophobicContact CE2-CD2 4.34Å; F1249-L1251 HydrophobicContact CZ-CD1 4.21Å; F1249-L1251 HydrophobicContact CZ-CD2 3.66Å; F1249-L1251 HydrophobicContact CZ-CG 4Å; F1249-L1281 HydrophobicContact CB-CD1 4.42Å; F1249-L1281 HydrophobicContact CD2-CD1 3.55Å; F1249-L1281 HydrophobicContact CD2-CD2 4.43Å; F1249-L1281 HydrophobicContact CE2-CD1 4.11Å; F1249-L1281 HydrophobicContact CE2-CD2 4.24Å; F1249-L1281 HydrophobicContact CG-CD1 4.13Å
1250	T	30.9	Very low	30.7	Very low	61 Å²	61	96.6 Å²	96.6	37%	0.374	52%	0.515	S	S	.	.			trans	-154.3	168.1	-175.5	-51.2	0	0	0	0	107.1	E1280 L1281	T1250-E1280 WeakPolarHBondContact CB-O 3.32Å; T1250-E1280 WeakPolarHBondContact CG2-O 3.21Å; T1250-L1281 WeakPolarHBondContact O-CA 3.38Å; T1250-L1281 WeakPolarHBondContact O-CB 3.4Å; T1250-L1281 WeakPolarHBondContact O-CD1 3.11Å
1251	L	28.9	Very low	31.2	Very low	87 Å²	87	95.5 Å²	95.5	46%	0.455	51%	0.511	S	S	.	.			trans	-145.5	121.6	-167.4	-74.6	171.9	0	0	0	114.8	F1249 P1253 Y1279	F1249-L1251 HydrophobicContact CE1-CD1 3.86Å; F1249-L1251 HydrophobicContact CE1-CD2 4.05Å; F1249-L1251 HydrophobicContact CE1-CG 3.84Å; F1249-L1251 HydrophobicContact CE2-CD2 4.34Å; F1249-L1251 HydrophobicContact CZ-CD1 4.21Å; F1249-L1251 HydrophobicContact CZ-CD2 3.66Å; F1249-L1251 HydrophobicContact CZ-CG 4Å; L1251-P1253 WeakPolarHBondContact O-CD 3.41Å; L1251-Y1279 CarbonylContact C-O 3.44Å
1252	K	27.1	Very low	31.6	Very low	83 Å²	83	90.7 Å²	90.7	36%	0.361	49%	0.493	S	S	.	.			trans	-75.7	119.7	159.2	-82.7	-67.6	165.4	177.5	0	107.8	N1254 D1278 Y1279 E1280	K1252-N1254 PolarHBondContact O-N 2.88Å; K1252-D1278 PolarHBondContact NZ-O 3.44Å; K1252-D1278 IonicContact NZ-OD1 2.71Å; K1252-Y1279 WeakPolarHBondContact CA-O 3.41Å; K1252-Y1279 WeakPolarHBondContact CB-O 3.37Å; K1252-Y1279 WeakPolarHBondContact CD-O 3.41Å; K1252-Y1279 VanDerWaalsContact CE-C 3.45Å; K1252-Y1279 WeakPolarHBondContact CE-O 3.36Å; K1252-Y1279 WeakPolarHBondContact CG-O 3.16Å; K1252-Y1279 PolarHBondContact N-O 3.32Å; K1252-E1280 HydrophobicContact CD-CB 4.49Å; K1252-E1280 HydrophobicContact CG-CB 4.02Å; K1252-E1280 HydrophobicContact CG-CG 4.16Å
1253	P	37.5	Very low	32	Very low	50 Å²	50	89 Å²	89	33%	0.325	48%	0.481	S	S	.	.			trans	-72.8	91.6	174.5	29.7	-33.4	0	0	0	110.2	L1251 C1257	L1251-P1253 WeakPolarHBondContact O-CD 3.41Å; P1253-C1257 HydrophobicContact CB-CB 4.4Å
1254	N	26.8	Very low	32.1	Very low	103 Å²	103	88.8 Å²	88.8	55%	0.551	48%	0.475	S	S	*	.			trans	-71.6	177.6	156.3	69.7	36.3	0	0	0	110	K1252 N1256 C1257	K1252-N1254 PolarHBondContact O-N 2.88Å; N1254-N1256 PolarHBondContact O-N 3.45Å; N1254-N1256 PolarHBondContact OD1-N 2.86Å; N1254-C1257 PolarHBondContact O-N 2.77Å
1255	S	32.4	Very low	32.3	Very low	72 Å²	72	86.8 Å²	86.8	50%	0.503	46%	0.463	S	S	.	.	H	α-helix	trans	-53.9	-31	-166.6	49.6	0	0	0	0	115.7	R1258	S1255-R1258 VanDerWaalsContact O-CB 3.26Å; S1255-R1258 WeakPolarHBondContact O-CB 3.49Å
1256	N	29.2	Very low	32.5	Very low	104 Å²	104	87.3 Å²	87.3	56%	0.556	47%	0.471	S	S	*	.	H	α-helix	trans	-88.8	-34.1	-170.3	-63.1	24.8	0	0	0	111.7	N1254 R1258	N1254-N1256 PolarHBondContact O-N 3.45Å; N1254-N1256 PolarHBondContact OD1-N 2.86Å; N1256-R1258 PolarHBondContact O-N 3.41Å
1257	C	29.3	Very low	32.8	Very low	41 Å²	41	90.8 Å²	90.8	28%	0.277	49%	0.492	S	S	.	.	H	α-helix	trans	-62.6	-22.4	170.6	-60.4	0	0	0	0	112.4	P1253 N1254 M1260 L1261	P1253-C1257 HydrophobicContact CB-CB 4.4Å; N1254-C1257 PolarHBondContact O-N 2.77Å; C1257-M1260 PolarHBondContact O-N 3Å; C1257-L1261 WeakPolarHBondContact O-CB 3.09Å; C1257-L1261 PolarHBondContact O-N 3.45Å
1258	R	31.1	Very low	32.7	Very low	133 Å²	133	91.5 Å²	91.5	50%	0.502	49%	0.493	S	S	.	.	H	α-helix	trans	-57.1	-52.5	180	-151.1	-171.1	-51.5	-83.2	0.8	111.7	S1255 N1256 M1260 L1261 D1262	S1255-R1258 VanDerWaalsContact O-CB 3.26Å; S1255-R1258 WeakPolarHBondContact O-CB 3.49Å; N1256-R1258 PolarHBondContact O-N 3.41Å; R1258-M1260 VanDerWaalsContact C-N 3.33Å; R1258-M1260 PolarHBondContact O-N 2.97Å; R1258-L1261 PolarHBondContact O-N 3.5Å; R1258-D1262 WeakPolarHBondContact O-CB 3.37Å; R1258-D1262 PolarHBondContact O-N 3.49Å
1259	N	36.9	Very low	32.7	Very low	116 Å²	116	93.4 Å²	93.4	62%	0.62	51%	0.505	S	S	*	.	H	α-helix	trans	-60.3	-39	-178.3	-66.4	9.8	0	0	0	113.2	T1263	N1259-T1263 WeakPolarHBondContact O-CB 3.28Å; N1259-T1263 PolarHBondContact O-N 3.05Å; N1259-T1263 PolarHBondContact O-OG1 2.89Å
1260	M	31.3	Very low	32.7	Very low	110 Å²	110	93 Å²	93	54%	0.542	52%	0.516	S	S	.	.	H	α-helix	trans	-75.4	-34.1	-179.7	-170.7	162.2	59.7	0	0	111.8	C1257 R1258 I1264	C1257-M1260 PolarHBondContact O-N 3Å; R1258-M1260 VanDerWaalsContact C-N 3.33Å; R1258-M1260 PolarHBondContact O-N 2.97Å; M1260-I1264 HydrophobicContact CG-CD1 4.39Å; M1260-I1264 WeakPolarHBondContact O-CG1 3.37Å; M1260-I1264 PolarHBondContact O-N 2.96Å; M1260-I1264 VanDerWaalsContact O-N 3.14Å
1261	L	37.1	Very low	32.5	Very low	95 Å²	95	93.8 Å²	93.8	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-72	-41.7	172.4	-162.3	69.9	0	0	0	111.5	C1257 R1258 T1263 I1264 V1265	C1257-L1261 WeakPolarHBondContact O-CB 3.09Å; C1257-L1261 PolarHBondContact O-N 3.45Å; R1258-L1261 PolarHBondContact O-N 3.5Å; L1261-T1263 VanDerWaalsContact C-N 3.26Å; L1261-T1263 PolarHBondContact O-N 3.18Å; L1261-I1264 PolarHBondContact O-N 2.59Å; L1261-I1264 VanDerWaalsContact O-N 3.15Å; L1261-V1265 HydrophobicContact CG-CG2 4.34Å; L1261-V1265 WeakPolarHBondContact O-CB 3.35Å; L1261-V1265 VanDerWaalsContact O-CG2 3.29Å; L1261-V1265 WeakPolarHBondContact O-CG2 3.39Å; L1261-V1265 PolarHBondContact O-N 2.74Å
1262	D	37.6	Very low	32.3	Very low	75 Å²	75	101 Å²	101	40%	0.401	55%	0.55	S	S	.	*	H	α-helix	trans	-58.8	-38.4	173.5	-71.3	-23.1	0	0	0	111	R1258 V1265 Q1266	R1258-D1262 WeakPolarHBondContact O-CB 3.37Å; R1258-D1262 PolarHBondContact O-N 3.49Å; D1262-V1265 PolarHBondContact O-N 3.31Å; D1262-Q1266 VanDerWaalsContact O-CB 3.28Å; D1262-Q1266 WeakPolarHBondContact O-CB 3.43Å; D1262-Q1266 VanDerWaalsContact O-CG 3.24Å; D1262-Q1266 WeakPolarHBondContact O-CG 3.5Å; D1262-Q1266 PolarHBondContact O-N 2.99Å
1263	T	36.6	Very low	32.4	Very low	82 Å²	82	104.8 Å²	104.8	50%	0.503	58%	0.575	S	S	.	*	H	α-helix	trans	-64.9	-45.8	174.4	-55.8	0	0	0	0	111.5	N1259 L1261 V1265 V1267	N1259-T1263 WeakPolarHBondContact O-CB 3.28Å; N1259-T1263 PolarHBondContact O-N 3.05Å; N1259-T1263 PolarHBondContact O-OG1 2.89Å; L1261-T1263 VanDerWaalsContact C-N 3.26Å; L1261-T1263 PolarHBondContact O-N 3.18Å; T1263-V1265 VanDerWaalsContact C-N 3.33Å; T1263-V1265 PolarHBondContact O-N 2.84Å; T1263-V1267 WeakPolarHBondContact O-CG2 3.36Å; T1263-V1267 PolarHBondContact O-N 3.23Å
1264	I	35.4	Very low	31.9	Very low	104 Å²	104	111.8 Å²	111.8	53%	0.533	60%	0.6	S	S	.	*	H	α-helix	trans	-66	-35.9	178.1	-68.8	166.6	0	0	0	111.3	M1260 L1261 A1268	M1260-I1264 HydrophobicContact CG-CD1 4.39Å; M1260-I1264 WeakPolarHBondContact O-CG1 3.37Å; M1260-I1264 PolarHBondContact O-N 2.96Å; M1260-I1264 VanDerWaalsContact O-N 3.14Å; L1261-I1264 PolarHBondContact O-N 2.59Å; L1261-I1264 VanDerWaalsContact O-N 3.15Å; I1264-A1268 VanDerWaalsContact O-CB 3.26Å; I1264-A1268 WeakPolarHBondContact O-CB 3.43Å; I1264-A1268 PolarHBondContact O-N 2.59Å
1265	V	36.7	Very low	31.8	Very low	71 Å²	71	114.5 Å²	114.5	43%	0.43	61%	0.614	S	S	.	*	H	α-helix	trans	-78.3	-35.6	179.5	172.5	0	0	0	0	112.3	L1261 D1262 T1263 V1267 A1268 T1269	L1261-V1265 HydrophobicContact CG-CG2 4.34Å; L1261-V1265 WeakPolarHBondContact O-CB 3.35Å; L1261-V1265 VanDerWaalsContact O-CG2 3.29Å; L1261-V1265 WeakPolarHBondContact O-CG2 3.39Å; L1261-V1265 PolarHBondContact O-N 2.74Å; D1262-V1265 PolarHBondContact O-N 3.31Å; T1263-V1265 VanDerWaalsContact C-N 3.33Å; T1263-V1265 PolarHBondContact O-N 2.84Å; V1265-V1267 VanDerWaalsContact C-N 3.26Å; V1265-V1267 PolarHBondContact O-N 3.26Å; V1265-A1268 PolarHBondContact O-N 2.96Å; V1265-T1269 PolarHBondContact O-N 3.13Å
1266	Q	33.9	Very low	31.4	Very low	165 Å²	165	118.3 Å²	118.3	77%	0.771	63%	0.628	S	S	*	*	H	α-helix	trans	-63.5	-32.9	171.3	-78.3	179.4	16.8	0	0	112.1	D1262 A1268	D1262-Q1266 VanDerWaalsContact O-CB 3.28Å; D1262-Q1266 WeakPolarHBondContact O-CB 3.43Å; D1262-Q1266 VanDerWaalsContact O-CG 3.24Å; D1262-Q1266 WeakPolarHBondContact O-CG 3.5Å; D1262-Q1266 PolarHBondContact O-N 2.99Å; Q1266-A1268 VanDerWaalsContact C-N 3.29Å
1267	V	35.1	Very low	31.3	Very low	128 Å²	128	118.2 Å²	118.2	78%	0.776	63%	0.631	S	S	*	*	H	α-helix	trans	-71.9	-22.4	170.6	171.4	0	0	0	0	112.3	T1263 V1265	T1263-V1267 WeakPolarHBondContact O-CG2 3.36Å; T1263-V1267 PolarHBondContact O-N 3.23Å; V1265-V1267 VanDerWaalsContact C-N 3.26Å; V1265-V1267 PolarHBondContact O-N 3.26Å
1268	A	31.5	Very low	31.1	Very low	66 Å²	66	121.1 Å²	121.1	55%	0.545	64%	0.644	S	S	.	*	H	α-helix	trans	-108.7	-28.6	-168.2	0	0	0	0	0	116.9	I1264 V1265 Q1266	I1264-A1268 VanDerWaalsContact O-CB 3.26Å; I1264-A1268 WeakPolarHBondContact O-CB 3.43Å; I1264-A1268 PolarHBondContact O-N 2.59Å; V1265-A1268 PolarHBondContact O-N 2.96Å; Q1266-A1268 VanDerWaalsContact C-N 3.29Å
1269	T	28.2	Very low	30.9	Very low	77 Å²	77	121 Å²	121	47%	0.472	64%	0.644	S	S	.	*			trans	-154.9	87.5	-169.8	-41	0	0	0	0	117.6	V1265 A1271	V1265-T1269 PolarHBondContact O-N 3.13Å; T1269-A1271 HydrophobicContact CG2-CB 4.1Å; T1269-A1271 PolarHBondContact O-N 3.25Å
1270	P	32.7	Very low	30.5	Very low	129 Å²	129	118.8 Å²	118.8	84%	0.838	63%	0.63	S	S	*	*	S	Bend	trans	-87.9	76.7	156.1	34.4	-31.7	0	0	0	111
1271	A	27.5	Very low	30.6	Very low	78 Å²	78	116.2 Å²	116.2	65%	0.645	62%	0.618	S	S	*	*	S	Bend	trans	-152.2	-47.2	177	0	0	0	0	0	116.4	T1269	T1269-A1271 HydrophobicContact CG2-CB 4.1Å; T1269-A1271 PolarHBondContact O-N 3.25Å
1272	W	25.6	Very low	30.4	Very low	239 Å²	239	114.2 Å²	114.2	91%	0.905	61%	0.611	S	S	*	*			trans	-116.1	127.9	-170.2	-70.4	-23.2	0	0	0	113.5
1273	N	29.2	Very low	30.1	Very low	163 Å²	163	114.1 Å²	114.1	87%	0.872	61%	0.609	S	S	*	*			trans	-110.6	66.1	-158.6	-172.1	16.2	0	0	0	112.1
1274	K	26.3	Very low	30	Very low	196 Å²	196	111 Å²	111	85%	0.852	59%	0.59	S	S	*	*			trans	-151.8	135.9	171.9	-73.4	-165.2	177.4	179.9	0	112.2
1275	D	25.5	Very low	29.8	Very low	161 Å²	161	110.3 Å²	110.3	86%	0.861	59%	0.585	S	S	*	*			trans	-73.5	151.8	177.3	-49.2	-69.4	0	0	0	113.2
1276	L	23.1	Very low	29.7	Very low	151 Å²	151	109.2 Å²	109.2	79%	0.791	58%	0.576	S	S	*	*			trans	-134	154.8	173.5	-82.8	173.3	0	0	0	111.6
1277	V	26.2	Very low	29.8	Very low	102 Å²	102	103.9 Å²	103.9	62%	0.618	55%	0.553	S	S	*	*			trans	-142.4	142.6	-160.2	-147.8	0	0	0	0	111.9	Y1279	V1277-Y1279 WeakPolarHBondContact O-CE1 3.25Å
1278	D	25.7	Very low	29.8	Very low	103 Å²	103	106.8 Å²	106.8	55%	0.551	55%	0.55	S	S	*	.			trans	70.2	84.4	153.3	-74.7	-34.8	0	0	0	123.6	K1252	K1252-D1278 PolarHBondContact NZ-O 3.44Å; K1252-D1278 IonicContact NZ-OD1 2.71Å
1279	Y	26.7	Very low	30.2	Very low	130 Å²	130	109.5 Å²	109.5	51%	0.51	56%	0.56	S	S	.	*			trans	-130.9	153.2	170	-30	-66.6	0	0	0	113.6	L1251 K1252 V1277	L1251-Y1279 CarbonylContact C-O 3.44Å; K1252-Y1279 WeakPolarHBondContact CA-O 3.41Å; K1252-Y1279 WeakPolarHBondContact CB-O 3.37Å; K1252-Y1279 WeakPolarHBondContact CD-O 3.41Å; K1252-Y1279 VanDerWaalsContact CE-C 3.45Å; K1252-Y1279 WeakPolarHBondContact CE-O 3.36Å; K1252-Y1279 WeakPolarHBondContact CG-O 3.16Å; K1252-Y1279 PolarHBondContact N-O 3.32Å; V1277-Y1279 WeakPolarHBondContact O-CE1 3.25Å
1280	E	29.9	Very low	30.6	Very low	69 Å²	69	111.3 Å²	111.3	32%	0.322	57%	0.571	S	S	.	*			trans	-122.9	145.5	-165.3	-168.9	172.4	143.6	0	0	119.3	T1250 K1252 T1282 S1297 G1298	T1250-E1280 WeakPolarHBondContact CB-O 3.32Å; T1250-E1280 WeakPolarHBondContact CG2-O 3.21Å; K1252-E1280 HydrophobicContact CD-CB 4.49Å; K1252-E1280 HydrophobicContact CG-CB 4.02Å; K1252-E1280 HydrophobicContact CG-CG 4.16Å; E1280-T1282 PolarHBondContact O-N 2.85Å; E1280-T1282 PolarHBondContact O-OG1 3.03Å; E1280-S1297 WeakPolarHBondContact OE1-CB 3.48Å; E1280-S1297 PolarHBondContact OE1-OG 3.06Å; E1280-G1298 PolarHBondContact OE1-N 3.39Å
1281	L	32.7	Very low	30.6	Very low	56 Å²	56	107 Å²	107	29%	0.293	55%	0.551	S	S	.	*			trans	-66.6	112.3	169	-179.9	50.9	0	0	0	112.6	F1249 T1250 L1283	F1249-L1281 HydrophobicContact CB-CD1 4.42Å; F1249-L1281 HydrophobicContact CD2-CD1 3.55Å; F1249-L1281 HydrophobicContact CD2-CD2 4.43Å; F1249-L1281 HydrophobicContact CE2-CD1 4.11Å; F1249-L1281 HydrophobicContact CE2-CD2 4.24Å; F1249-L1281 HydrophobicContact CG-CD1 4.13Å; T1250-L1281 WeakPolarHBondContact O-CA 3.38Å; T1250-L1281 WeakPolarHBondContact O-CB 3.4Å; T1250-L1281 WeakPolarHBondContact O-CD1 3.11Å; L1281-L1283 HydrophobicContact CD1-CD1 4.48Å; L1281-L1283 HydrophobicContact CD1-CG 4.14Å
1282	T	32.8	Very low	30.8	Very low	54 Å²	54	108.3 Å²	108.3	33%	0.331	55%	0.551	S	S	.	*			trans	-126.6	86.6	-177.5	-51.9	0	0	0	0	111.2	E1280 T1284 T1294	E1280-T1282 PolarHBondContact O-N 2.85Å; E1280-T1282 PolarHBondContact O-OG1 3.03Å; T1282-T1284 PolarHBondContact O-N 3.44Å; T1282-T1284 PolarHBondContact O-OG1 3.32Å; T1282-T1294 HydrophobicContact CG2-CG2 3.51Å
1283	L	30.5	Very low	31.1	Very low	72 Å²	72	100.9 Å²	100.9	38%	0.377	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	111.6	179.3	-83.7	162	0	0	0	110.7	T1248 L1281 V1295 Y1296	T1248-L1283 WeakPolarHBondContact O-CD2 3.28Å; L1281-L1283 HydrophobicContact CD1-CD1 4.48Å; L1281-L1283 HydrophobicContact CD1-CG 4.14Å; L1283-V1295 PolarHBondContact O-N 3.35Å; L1283-V1295 VanDerWaalsContact O-N 3.1Å; L1283-Y1296 PolarHBondContact N-O 3.23Å
1284	T	35.8	Very low	31.3	Very low	17 Å²	17	95.8 Å²	95.8	10%	0.104	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.6	-174.3	-61.6	0	0	0	0	110.4	T1282 I1286 T1292 T1294	T1282-T1284 PolarHBondContact O-N 3.44Å; T1282-T1284 PolarHBondContact O-OG1 3.32Å; T1284-I1286 HydrophobicContact CG2-CG1 4.19Å; T1284-T1292 HydrophobicContact CG2-CG2 3.34Å; T1284-T1294 PolarHBondContact OG1-OG1 2.93Å
1285	E	30.9	Very low	31.9	Very low	90 Å²	90	89.7 Å²	89.7	42%	0.421	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.7	172.5	-170.4	-174.6	157.4	0	0	109.3	M1293	E1285-M1293 PolarHBondContact N-O 3.3Å; E1285-M1293 VanDerWaalsContact N-O 3.11Å; E1285-M1293 PolarHBondContact O-N 3.27Å
1286	I	34.6	Very low	31.9	Very low	48 Å²	48	87.6 Å²	87.6	25%	0.246	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	82.6	179.6	-53.2	-177.7	0	0	0	110	T1284 R1288 F1999	T1284-I1286 HydrophobicContact CG2-CG1 4.19Å; I1286-R1288 HydrophobicContact CG2-CG 4.32Å; I1286-R1288 PolarHBondContact O-N 3.03Å; I1286-F1999 HydrophobicContact CD1-CE1 3.88Å; I1286-F1999 HydrophobicContact CD1-CZ 4.1Å
1287	N	34.9	Very low	32.3	Very low	52 Å²	52	82.6 Å²	82.6	28%	0.278	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	107.9	167.1	-162.9	-52	0	0	0	109.9	T1289 T1290 G1291	N1287-T1289 PolarHBondContact O-N 2.8Å; N1287-T1289 PolarHBondContact OD1-N 2.91Å; N1287-T1290 PolarHBondContact O-N 3.36Å; N1287-G1291 PolarHBondContact O-N 2.91Å; N1287-G1291 VanDerWaalsContact O-N 3.09Å
1288	R	35.6	Very low	32.6	Very low	189 Å²	189	80.7 Å²	80.7	71%	0.713	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	2.3	-173.2	-76.6	-167.4	175.9	-159.2	1	115.6	I1286	I1286-R1288 HydrophobicContact CG2-CG 4.32Å; I1286-R1288 PolarHBondContact O-N 3.03Å
1289	T	39.4	Very low	32.7	Very low	124 Å²	124	79.3 Å²	79.3	76%	0.761	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-32.9	171.7	-50.5	0	0	0	0	113.5	N1287	N1287-T1289 PolarHBondContact O-N 2.8Å; N1287-T1289 PolarHBondContact OD1-N 2.91Å
1290	T	36.3	Very low	32.8	Very low	114 Å²	114	77.5 Å²	77.5	70%	0.699	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-9.9	-174	49.8	0	0	0	0	114.3	N1287	N1287-T1290 PolarHBondContact O-N 3.36Å
1291	G	33.7	Very low	32.6	Very low	40 Å²	40	78.1 Å²	78.1	41%	0.412	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	86	-177.6	-178.2	0	0	0	0	0	113.6	N1287	N1287-G1291 PolarHBondContact O-N 2.91Å; N1287-G1291 VanDerWaalsContact O-N 3.09Å
1292	T	31.1	Very low	32.5	Very low	105 Å²	105	80 Å²	80	64%	0.644	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	130.8	-166.8	-44.1	0	0	0	0	113.3	T1284	T1284-T1292 HydrophobicContact CG2-CG2 3.34Å
1293	M	33.2	Very low	32.2	Very low	82 Å²	82	82.2 Å²	82.2	40%	0.404	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	130	156.1	-152.9	167.9	79.8	0	0	111.7	E1285 N1305	E1285-M1293 PolarHBondContact N-O 3.3Å; E1285-M1293 VanDerWaalsContact N-O 3.11Å; E1285-M1293 PolarHBondContact O-N 3.27Å; M1293-N1305 HydrophobicContact CE-CB 4.31Å; M1293-N1305 HydrophobicContact SD-CB 3.9Å; M1293-N1305 PolarHBondContact SD-ND2 3.18Å
1294	T	32.3	Very low	31.9	Very low	56 Å²	56	83.7 Å²	83.7	34%	0.344	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.7	-179.6	-58.2	0	0	0	0	109	T1282 T1284	T1282-T1294 HydrophobicContact CG2-CG2 3.51Å; T1284-T1294 PolarHBondContact OG1-OG1 2.93Å
1295	V	38.2	Very low	31.5	Very low	68 Å²	68	87 Å²	87	41%	0.412	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-21	-170.4	-175.4	0	0	0	0	112.4	L1283 L1301	L1283-V1295 PolarHBondContact O-N 3.35Å; L1283-V1295 VanDerWaalsContact O-N 3.1Å; V1295-L1301 HydrophobicContact CG1-CD1 3.96Å; V1295-L1301 WeakPolarHBondContact O-CD1 3.46Å
1296	Y	26	Very low	31.1	Very low	117 Å²	117	87.4 Å²	87.4	46%	0.459	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.8	175	-93	-86.5	0	0	0	113.1	L1283 L1301	L1283-Y1296 PolarHBondContact N-O 3.23Å; Y1296-L1301 HydrophobicContact CD2-CD1 4.04Å; Y1296-L1301 HydrophobicContact CE1-CB 4.39Å; Y1296-L1301 HydrophobicContact CE1-CD1 4.4Å; Y1296-L1301 HydrophobicContact CE2-CD1 3.51Å
1297	S	32	Very low	30.4	Very low	46 Å²	46	88.2 Å²	88.2	32%	0.322	55%	0.547	S	S	.	.	B	Isolated β-bridge	trans	-149.8	157.8	168.7	157.9	0	0	0	0	107.7	E1280 G1299 V1300	E1280-S1297 WeakPolarHBondContact OE1-CB 3.48Å; E1280-S1297 PolarHBondContact OE1-OG 3.06Å; S1297-G1299 PolarHBondContact O-N 2.89Å; S1297-V1300 PolarHBondContact O-N 3.1Å; S1297-V1300 VanDerWaalsContact O-O 3.06Å
1298	G	32.4	Very low	29.9	Very low	62 Å²	62	92.2 Å²	92.2	64%	0.639	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	64	5.3	168.8	0	0	0	0	0	118.1	E1280 V1300	E1280-G1298 PolarHBondContact OE1-N 3.39Å; G1298-V1300 VanDerWaalsContact C-N 3.28Å; G1298-V1300 PolarHBondContact O-N 3.11Å
1299	G	27.5	Very low	29.4	Very low	75 Å²	75	86 Å²	86	77%	0.773	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.5	9.4	-178.6	0	0	0	0	0	115.3	S1297	S1297-G1299 PolarHBondContact O-N 2.89Å
1300	V	28.3	Very low	28.5	Very low	92 Å²	92	85.9 Å²	85.9	56%	0.558	55%	0.55	S	S	*	*	B	Isolated β-bridge	trans	-131	140.7	175.1	176.6	0	0	0	0	108.2	S1297 G1298 T1302	S1297-V1300 PolarHBondContact O-N 3.1Å; S1297-V1300 VanDerWaalsContact O-O 3.06Å; G1298-V1300 VanDerWaalsContact C-N 3.28Å; G1298-V1300 PolarHBondContact O-N 3.11Å; V1300-T1302 HydrophobicContact CB-CG2 3.95Å; V1300-T1302 HydrophobicContact CG1-CG2 4.03Å; V1300-T1302 PolarHBondContact O-N 2.92Å
1301	L	26	Very low	27.8	Very low	81 Å²	81	82.8 Å²	82.8	42%	0.424	53%	0.529	S	S	.	.			trans	-72.5	78.4	170.8	-170.6	83.7	0	0	0	109.1	V1295 Y1296 T1303 V1304	V1295-L1301 HydrophobicContact CG1-CD1 3.96Å; V1295-L1301 WeakPolarHBondContact O-CD1 3.46Å; Y1296-L1301 HydrophobicContact CD2-CD1 4.04Å; Y1296-L1301 HydrophobicContact CE1-CB 4.39Å; Y1296-L1301 HydrophobicContact CE1-CD1 4.4Å; Y1296-L1301 HydrophobicContact CE2-CD1 3.51Å; L1301-T1303 PolarHBondContact O-N 2.57Å; L1301-V1304 HydrophobicContact CD2-CG2 4.13Å
1302	T	30.5	Very low	27.3	Very low	95 Å²	95	84 Å²	84	58%	0.583	52%	0.524	S	S	*	.			trans	-72.6	-27.6	-161.6	40.1	0	0	0	0	115.3	V1300	V1300-T1302 HydrophobicContact CB-CG2 3.95Å; V1300-T1302 HydrophobicContact CG1-CG2 4.03Å; V1300-T1302 PolarHBondContact O-N 2.92Å
1303	T	25.9	Very low	26.9	Very low	101 Å²	101	81.7 Å²	81.7	62%	0.62	51%	0.508	S	S	*	.			trans	-143.3	111.6	177	51.7	0	0	0	0	112.7	L1301 N1305	L1301-T1303 PolarHBondContact O-N 2.57Å; T1303-N1305 VanDerWaalsContact C-N 3.27Å; T1303-N1305 PolarHBondContact O-N 3.02Å
1304	V	25.4	Very low	26.4	Very low	103 Å²	103	81 Å²	81	62%	0.624	51%	0.512	S	S	*	.			trans	-75.5	82.8	162.5	-177.6	0	0	0	0	108	L1301 S1306 T1309	L1301-V1304 HydrophobicContact CD2-CG2 4.13Å; V1304-S1306 PolarHBondContact O-N 3.3Å; V1304-S1306 VanDerWaalsContact O-N 3.09Å; V1304-T1309 HydrophobicContact CG1-CG2 3.83Å
1305	N	26.7	Very low	26	Very low	88 Å²	88	87.2 Å²	87.2	47%	0.471	53%	0.529	S	S	.	.			trans	-81.5	91.7	-176.6	-173.9	30.9	0	0	0	112	M1293 T1303 G1307	M1293-N1305 HydrophobicContact CE-CB 4.31Å; M1293-N1305 HydrophobicContact SD-CB 3.9Å; M1293-N1305 PolarHBondContact SD-ND2 3.18Å; T1303-N1305 VanDerWaalsContact C-N 3.27Å; T1303-N1305 PolarHBondContact O-N 3.02Å; N1305-G1307 PolarHBondContact O-N 3.13Å
1306	S	22.9	Very low	25.3	Very low	98 Å²	98	87.8 Å²	87.8	69%	0.685	53%	0.527	S	S	*	.	S	Bend	trans	52.8	2	135.9	-34.2	0	0	0	0	121.2	V1304	V1304-S1306 PolarHBondContact O-N 3.3Å; V1304-S1306 VanDerWaalsContact O-N 3.09Å
1307	G	20.9	Very low	25.3	Very low	64 Å²	64	90.5 Å²	90.5	66%	0.66	54%	0.538	S	S	*	.	S	Bend	trans	-110.1	-21.1	-171.3	0	0	0	0	0	115.6	N1305	N1305-G1307 PolarHBondContact O-N 3.13Å
1308	N	23.3	Very low	24.7	Very low	137 Å²	137	95.3 Å²	95.3	73%	0.733	56%	0.559	S	S	*	*	S	Bend	trans	-164	66.2	164.1	-138.1	25.4	0	0	0	108.7
1309	T	24.6	Very low	24.3	Very low	58 Å²	58	97.1 Å²	97.1	36%	0.356	55%	0.551	S	S	.	*			trans	-57.4	136.8	168.3	27.2	0	0	0	0	109.2	V1304 D1311	V1304-T1309 HydrophobicContact CG1-CG2 3.83Å; T1309-D1311 PolarHBondContact O-N 2.78Å; T1309-D1311 PolarHBondContact OG1-OD2 3.12Å
1310	V	20.8	Very low	23.9	Very low	121 Å²	121	102.9 Å²	102.9	73%	0.733	55%	0.55	S	S	*	*	S	Bend	trans	-79	65.7	166.8	-169	0	0	0	0	109.1
1311	D	22.3	Very low	23.4	Very low	49 Å²	49	101.3 Å²	101.3	26%	0.262	54%	0.536	S	S	.	.	S	Bend	trans	-65.9	175.4	130.7	61.8	57.4	0	0	0	107.6	T1309 N1313 S1314	T1309-D1311 PolarHBondContact O-N 2.78Å; T1309-D1311 PolarHBondContact OG1-OD2 3.12Å; D1311-N1313 WeakPolarHBondContact OD1-CA 3.47Å; D1311-N1313 PolarHBondContact OD1-N 3.26Å; D1311-S1314 PolarHBondContact O-N 3.41Å
1312	E	22.4	Very low	23.2	Very low	66 Å²	66	99.5 Å²	99.5	31%	0.308	53%	0.527	S	S	.	.	S	Bend	cis	68.9	34.3	23	-39.1	-44	103.3	0	0	116.4	R1315 Q1316 Y1317	E1312-R1315 WeakPolarHBondContact OE1-CB 3.48Å; E1312-R1315 WeakPolarHBondContact OE1-CD 3.45Å; E1312-R1315 WeakPolarHBondContact OE1-CG 3.49Å; E1312-R1315 IonicContact OE1-CZ 2.61Å; E1312-R1315 IonicContact OE1-NE 2.78Å; E1312-R1315 IonicContact OE1-NH1 2.67Å; E1312-R1315 PolarHBondContact OE1-NH1 2.91Å; E1312-R1315 WeakPolarHBondContact OE2-CB 3.45Å; E1312-R1315 WeakPolarHBondContact OE2-CD 3.41Å; E1312-Q1316 HydrophobicContact CB-CG 3.88Å; E1312-Y1317 WeakPolarHBondContact O-CD2 3.48Å; E1312-Y1317 PolarHBondContact O-N 3.06Å
1313	N	22.8	Very low	22.8	Very low	56 Å²	56	97.1 Å²	97.1	30%	0.299	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	cis	-103.4	99.1	28.4	-151	-44.9	0	0	0	115.8	D1311 R1315 Q1316 L1318	D1311-N1313 WeakPolarHBondContact OD1-CA 3.47Å; D1311-N1313 PolarHBondContact OD1-N 3.26Å; N1313-R1315 VanDerWaalsContact CA-N 3.3Å; N1313-R1315 VanDerWaalsContact CG-C 3.48Å; N1313-R1315 VanDerWaalsContact ND2-C 3.32Å; N1313-R1315 PolarHBondContact ND2-O 3.1Å; N1313-R1315 PolarHBondContact OD1-N 3.32Å; N1313-Q1316 PolarHBondContact ND2-N 3.41Å; N1313-Q1316 PolarHBondContact ND2-O 3.3Å; N1313-L1318 WeakPolarHBondContact ND2-CB 3.31Å; N1313-L1318 PolarHBondContact ND2-N 3.41Å; N1313-L1318 PolarHBondContact ND2-O 2.82Å
1314	S	24.2	Very low	22.5	Very low	69 Å²	69	93.4 Å²	93.4	48%	0.483	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn		-107.3	24	99.3	-62.7	0	0	0	0	113.2	D1311	D1311-S1314 PolarHBondContact O-N 3.41Å
1315	R	23	Very low	22.4	Very low	185 Å²	185	94 Å²	94	70%	0.698	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-69.1	158.6	-69.1	-170.1	179.5	75.6	3.2	117	E1312 N1313	E1312-R1315 WeakPolarHBondContact OE1-CB 3.48Å; E1312-R1315 WeakPolarHBondContact OE1-CD 3.45Å; E1312-R1315 WeakPolarHBondContact OE1-CG 3.49Å; E1312-R1315 IonicContact OE1-CZ 2.61Å; E1312-R1315 IonicContact OE1-NE 2.78Å; E1312-R1315 IonicContact OE1-NH1 2.67Å; E1312-R1315 PolarHBondContact OE1-NH1 2.91Å; E1312-R1315 WeakPolarHBondContact OE2-CB 3.45Å; E1312-R1315 WeakPolarHBondContact OE2-CD 3.41Å; N1313-R1315 VanDerWaalsContact CA-N 3.3Å; N1313-R1315 VanDerWaalsContact CG-C 3.48Å; N1313-R1315 VanDerWaalsContact ND2-C 3.32Å; N1313-R1315 PolarHBondContact ND2-O 3.1Å; N1313-R1315 PolarHBondContact OD1-N 3.32Å
1316	Q	23.4	Very low	22.1	Very low	80 Å²	80	92 Å²	92	37%	0.374	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	cis	145.8	-151	-1.4	167.6	164.8	62.2	0	0	107.3	E1312 N1313 L1318 E1319	E1312-Q1316 HydrophobicContact CB-CG 3.88Å; N1313-Q1316 PolarHBondContact ND2-N 3.41Å; N1313-Q1316 PolarHBondContact ND2-O 3.3Å; Q1316-L1318 VanDerWaalsContact C-N 3.33Å; Q1316-L1318 CarbonylContact O-C 3.35Å; Q1316-L1318 WeakPolarHBondContact O-CA 3.4Å; Q1316-L1318 PolarHBondContact O-N 3.35Å; Q1316-E1319 HydrophobicContact CB-CG 4.45Å; Q1316-E1319 HydrophobicContact CG-CG 4.5Å; Q1316-E1319 PolarHBondContact NE2-OE1 2.74Å; Q1316-E1319 WeakPolarHBondContact O-CA 3.44Å; Q1316-E1319 PolarHBondContact O-N 2.85Å
1317	Y	26.4	Very low	22.1	Very low	175 Å²	175	93.2 Å²	93.2	69%	0.686	49%	0.486	S	S	*	.	S	Bend	trans	-4.3	-51.7	171.2	-90.9	-58.8	0	0	0	121.1	E1312 E1319	E1312-Y1317 WeakPolarHBondContact O-CD2 3.48Å; E1312-Y1317 PolarHBondContact O-N 3.06Å; Y1317-E1319 WeakPolarHBondContact O-CB 3.43Å; Y1317-E1319 PolarHBondContact O-N 3.44Å
1318	L	19.9	Very low	22.1	Very low	146 Å²	146	93.3 Å²	93.3	76%	0.764	49%	0.487	S	S	*	.	S	Bend	trans	-71.9	75.4	155.3	-123.9	-174.7	0	0	0	109	N1313 Q1316	N1313-L1318 WeakPolarHBondContact ND2-CB 3.31Å; N1313-L1318 PolarHBondContact ND2-N 3.41Å; N1313-L1318 PolarHBondContact ND2-O 2.82Å; Q1316-L1318 VanDerWaalsContact C-N 3.33Å; Q1316-L1318 CarbonylContact O-C 3.35Å; Q1316-L1318 WeakPolarHBondContact O-CA 3.4Å; Q1316-L1318 PolarHBondContact O-N 3.35Å
1319	E	22.5	Very low	22.1	Very low	101 Å²	101	92.9 Å²	92.9	47%	0.472	48%	0.483	S	S	.	.			trans	-89	-171.5	-148.5	-150.3	155.3	-120.2	0	0	112.7	Q1316 Y1317 K1321	Q1316-E1319 HydrophobicContact CB-CG 4.45Å; Q1316-E1319 HydrophobicContact CG-CG 4.5Å; Q1316-E1319 PolarHBondContact NE2-OE1 2.74Å; Q1316-E1319 WeakPolarHBondContact O-CA 3.44Å; Q1316-E1319 PolarHBondContact O-N 2.85Å; Y1317-E1319 WeakPolarHBondContact O-CB 3.43Å; Y1317-E1319 PolarHBondContact O-N 3.44Å; E1319-K1321 PolarHBondContact O-N 2.88Å
1320	Y	19.2	Very low	21.9	Very low	195 Å²	195	91.5 Å²	91.5	77%	0.765	48%	0.48	S	S	*	.	S	Bend	trans	-60.1	81.5	163	-84.2	-100.4	0	0	0	110.5
1321	K	19	Very low	22.2	Very low	59 Å²	59	93.2 Å²	93.2	26%	0.257	49%	0.485	S	S	.	.	S	Bend	trans	-172.4	66.2	170	-113.3	170.8	-175.7	174.2	0	114.2	E1319 I1807 R1808	E1319-K1321 PolarHBondContact O-N 2.88Å; K1321-I1807 HydrophobicContact CD-CG1 4.36Å; K1321-I1807 HydrophobicContact CG-CG2 4.28Å; K1321-R1808 PolarHBondContact O-N 3.17Å
1322	D	21.7	Very low	22.4	Very low	43 Å²	43	98.6 Å²	98.6	23%	0.23	51%	0.513	C	S	.	.	S	Bend	cis	-137.4	159	-0.2	-66	-70.9	0	0	0	104.5	I1807 R1808	D1322-I1807 WeakPolarHBondContact OD2-CG2 3.33Å; D1322-R1808 PolarHBondContact N-O 3.1Å
1323	F	20.8	Very low	22.5	Very low	45 Å²	45	97.4 Å²	97.4	20%	0.197	51%	0.508	C	S	.	.				-136.9	152	60.8	-105.2	-120.9	0	0	0	110.8	M1809 D1810 T1811 I1813 I1814	F1323-M1809 VanDerWaalsContact CD2-C 3.49Å; F1323-M1809 HydrophobicContact CD2-CB 4.41Å; F1323-M1809 VanDerWaalsContact CE2-C 3.45Å; F1323-M1809 HydrophobicContact CE2-CB 3.38Å; F1323-M1809 HydrophobicContact CE2-CG 3.74Å; F1323-M1809 HydrophobicContact CE2-SD 4.45Å; F1323-D1810 HydrophobicContact CB-CB 3.75Å; F1323-D1810 WeakPolarHBondContact CB-O 3.45Å; F1323-D1810 VanDerWaalsContact CB-OD2 3.26Å; F1323-D1810 WeakPolarHBondContact CB-OD2 3.23Å; F1323-D1810 HydrophobicContact CD1-CB 4.17Å; F1323-D1810 WeakPolarHBondContact CD1-O 3.37Å; F1323-D1810 HydrophobicContact CD2-CB 3.04Å; F1323-D1810 WeakPolarHBondContact CD2-O 3.4Å; F1323-D1810 WeakPolarHBondContact CE1-O 3.1Å; F1323-D1810 HydrophobicContact CE2-CB 4.08Å; F1323-D1810 WeakPolarHBondContact CE2-O 3.47Å; F1323-D1810 HydrophobicContact CG-CB 3.08Å; F1323-D1810 WeakPolarHBondContact CG-O 3.47Å; F1323-D1810 VanDerWaalsContact CG-OD2 3.24Å; F1323-D1810 WeakPolarHBondContact CG-OD2 3.38Å; F1323-D1810 WeakPolarHBondContact CZ-O 3.4Å; F1323-T1811 HydrophobicContact CE1-CG2 4.26Å; F1323-T1811 WeakPolarHBondContact CE1-O 3.34Å; F1323-T1811 HydrophobicContact CE2-CG2 3.85Å; F1323-T1811 VanDerWaalsContact CG-N 3.26Å; F1323-T1811 HydrophobicContact CZ-CG2 3.13Å; F1323-I1813 HydrophobicContact CE1-CB 4.45Å; F1323-I1814 HydrophobicContact CE1-CB 4.15Å; F1323-I1814 HydrophobicContact CE1-CG1 3.98Å; F1323-I1814 VanDerWaalsContact CE1-N 3.26Å; F1323-I1814 HydrophobicContact CE2-CD1 4.29Å; F1323-I1814 HydrophobicContact CZ-CB 3.52Å; F1323-I1814 HydrophobicContact CZ-CD1 4.07Å; F1323-I1814 HydrophobicContact CZ-CG1 3.73Å
1324	G	21	Very low	22.6	Very low	24 Å²	24	98 Å²	98	25%	0.247	51%	0.511	C	S	.	.			cis	115.3	-14.5	15	0	0	0	0	0	112.3	I1813	G1324-I1813 WeakPolarHBondContact O-CB 3.39Å
1325	V	21.7	Very low	23	Very low	114 Å²	114	102 Å²	102	69%	0.691	53%	0.527	S	S	*	.			trans	69.3	-177.2	172	-174.8	0	0	0	0	112.6	I1813	V1325-I1813 HydrophobicContact CB-CD1 3.8Å; V1325-I1813 HydrophobicContact CG1-CD1 3.93Å
1326	S	21.5	Very low	23.3	Very low	47 Å²	47	96 Å²	96	33%	0.329	51%	0.506	S	S	.	.			trans	-31.7	128.3	-159.5	64.8	0	0	0	0	119.6	A1812 I1813	S1326-A1812 CarbonylContact O-C 3.6Å; S1326-I1813 WeakPolarHBondContact O-CG1 3.27Å; S1326-I1813 PolarHBondContact O-N 3.32Å; S1326-I1813 VanDerWaalsContact O-N 3.14Å; S1326-I1813 WeakPolarHBondContact OG-CD1 3.48Å; S1326-I1813 VanDerWaalsContact OG-CG1 3.27Å; S1326-I1813 WeakPolarHBondContact OG-CG1 3.39Å
1327	N	22.4	Very low	23.7	Very low	124 Å²	124	95.3 Å²	95.3	66%	0.663	51%	0.507	S	S	*	.	S	Bend		-162.5	54.4	92	-89.5	-48.4	0	0	0	110.9	A1812	N1327-A1812 HydrophobicContact CB-CB 3.62Å; N1327-A1812 PolarHBondContact ND2-O 3.18Å
1328	G	20.7	Very low	23.9	Very low	65 Å²	65	89.8 Å²	89.8	67%	0.67	49%	0.494	S	S	*	.			trans	-116	-7.4	176.6	0	0	0	0	0	115.1	G1330	G1328-G1330 PolarHBondContact O-N 2.87Å
1329	I	23.9	Very low	24.2	Very low	128 Å²	128	87.4 Å²	87.4	66%	0.656	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	35	178.5	-45.9	-179.4	0	0	0	110.5
1330	G	21	Very low	24.7	Very low	29 Å²	29	90.9 Å²	90.9	30%	0.299	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-38	175.3	0	0	0	0	0	112.7	G1328	G1328-G1330 PolarHBondContact O-N 2.87Å
1331	N	27.1	Very low	25.1	Very low	157 Å²	157	86.4 Å²	86.4	84%	0.84	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	2.7	-163.6	-63.2	22.8	0	0	0	114.7
1332	I	25.9	Very low	25.6	Very low	163 Å²	163	87.4 Å²	87.4	84%	0.836	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-6.3	167.6	-63	178.1	0	0	0	110.8	D1334	I1332-D1334 PolarHBondContact O-N 3.39Å
1333	L	24.8	Very low	26	Very low	40 Å²	40	93.8 Å²	93.8	21%	0.209	52%	0.518	C	S	.	.	S	Bend	trans	-78.2	107.7	151.8	-66.5	168.5	0	0	0	106.9	D1335 V1337 L1339 L1342	L1333-D1335 PolarHBondContact O-N 3.11Å; L1333-V1337 HydrophobicContact CD2-CB 4.22Å; L1333-V1337 HydrophobicContact CD2-CG1 4.04Å; L1333-L1339 HydrophobicContact CD1-CD1 3.63Å; L1333-L1342 HydrophobicContact CD1-CD1 4.48Å; L1333-L1342 HydrophobicContact CD1-CD2 4.29Å; L1333-L1342 HydrophobicContact CD2-CD1 3.92Å
1334	D	24.3	Very low	26.5	Very low	69 Å²	69	97.5 Å²	97.5	37%	0.369	54%	0.544	S	S	.	.			trans	-43.4	139	164.7	170.4	32.1	0	0	0	109.2	I1332 K1336 V1337	I1332-D1334 PolarHBondContact O-N 3.39Å; D1334-K1336 PolarHBondContact O-N 3.45Å; D1334-K1336 WeakPolarHBondContact OD1-CD 3.48Å; D1334-K1336 WeakPolarHBondContact OD1-CE 3.41Å; D1334-K1336 WeakPolarHBondContact OD2-CD 3.46Å; D1334-V1337 PolarHBondContact O-N 2.98Å
1335	D	32.9	Very low	27	Very low	153 Å²	153	101.2 Å²	101.2	82%	0.818	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	22	-152.1	-171.4	45.2	0	0	0	115.5	L1333	L1333-D1335 PolarHBondContact O-N 3.11Å
1336	K	29.5	Very low	27.6	Very low	60 Å²	60	100.8 Å²	100.8	26%	0.261	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-143.6	-10	-169	-44.3	102.4	-165.5	-61.1	0	113.4	P488 D1334 S1338	P488-K1336 HydrophobicContact CB-CB 3.48Å; P488-K1336 VanDerWaalsContact CB-CB 3.48Å; P488-K1336 HydrophobicContact CB-CD 3.99Å; P488-K1336 HydrophobicContact CB-CG 3.68Å; P488-K1336 HydrophobicContact CG-CB 3.52Å; P488-K1336 HydrophobicContact CG-CD 4.34Å; P488-K1336 HydrophobicContact CG-CG 4.21Å; D1334-K1336 PolarHBondContact O-N 3.45Å; D1334-K1336 WeakPolarHBondContact OD1-CD 3.48Å; D1334-K1336 WeakPolarHBondContact OD1-CE 3.41Å; D1334-K1336 WeakPolarHBondContact OD2-CD 3.46Å; K1336-S1338 PolarHBondContact O-N 2.95Å
1337	V	31.8	Very low	28	Very low	65 Å²	65	104.4 Å²	104.4	39%	0.394	57%	0.565	S	S	.	*	S	Bend	trans	-84.9	93.7	159.9	-179.7	0	0	0	0	106.9	L1333 D1334 L1339 L1342	L1333-V1337 HydrophobicContact CD2-CB 4.22Å; L1333-V1337 HydrophobicContact CD2-CG1 4.04Å; D1334-V1337 PolarHBondContact O-N 2.98Å; V1337-L1339 PolarHBondContact O-N 3.14Å; V1337-L1342 HydrophobicContact CG1-CD1 4.18Å
1338	S	30.8	Very low	28.5	Very low	58 Å²	58	101 Å²	101	41%	0.406	55%	0.554	S	S	.	*			trans	-62.8	138.3	-176.8	87.7	0	0	0	0	110.2	K1336 K1340 D1341	K1336-S1338 PolarHBondContact O-N 2.95Å; S1338-K1340 PolarHBondContact O-N 3.31Å; S1338-D1341 PolarHBondContact O-N 2.81Å; S1338-D1341 PolarHBondContact OG-OD2 3.34Å
1339	L	26.5	Very low	28.9	Very low	97 Å²	97	101.9 Å²	101.9	51%	0.508	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-8.2	-177.3	-141.3	84.2	0	0	0	114.2	L1333 V1337	L1333-L1339 HydrophobicContact CD1-CD1 3.63Å; V1337-L1339 PolarHBondContact O-N 3.14Å
1340	K	31.4	Very low	29.4	Very low	174 Å²	174	100.4 Å²	100.4	76%	0.757	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-30	174.9	-163.8	173.9	-175.8	176.9	0	112.8	S1338	S1338-K1340 PolarHBondContact O-N 3.31Å
1341	D	29.3	Very low	29.8	Very low	100 Å²	100	105.5 Å²	105.5	54%	0.535	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-19.3	-173.5	-53.3	-55.8	0	0	0	112.5	S1338 T1344	S1338-D1341 PolarHBondContact O-N 2.81Å; S1338-D1341 PolarHBondContact OG-OD2 3.34Å; D1341-T1344 PolarHBondContact O-OG1 3.27Å; D1341-T1344 VanDerWaalsContact O-OG1 3.13Å
1342	L	29.7	Very low	30.1	Very low	81 Å²	81	103.1 Å²	103.1	42%	0.424	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-81.7	-21.8	176.8	-132.7	87.4	0	0	0	113.7	L1333 V1337 T1344 M1345	L1333-L1342 HydrophobicContact CD1-CD1 4.48Å; L1333-L1342 HydrophobicContact CD1-CD2 4.29Å; L1333-L1342 HydrophobicContact CD2-CD1 3.92Å; V1337-L1342 HydrophobicContact CG1-CD1 4.18Å; L1342-T1344 PolarHBondContact O-N 3.34Å; L1342-T1344 VanDerWaalsContact O-N 3.13Å; L1342-M1345 PolarHBondContact O-N 2.94Å
1343	K	29	Very low	30.4	Very low	176 Å²	176	100.2 Å²	100.2	77%	0.765	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-76.7	9.7	-178.3	-75.5	-167.1	173.6	-170.3	0	114.5
1344	T	31.9	Very low	30.6	Very low	123 Å²	123	101.7 Å²	101.7	76%	0.755	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-112.9	8.3	175.4	46.9	0	0	0	0	113.8	D1341 L1342	D1341-T1344 PolarHBondContact O-OG1 3.27Å; D1341-T1344 VanDerWaalsContact O-OG1 3.13Å; L1342-T1344 PolarHBondContact O-N 3.34Å; L1342-T1344 VanDerWaalsContact O-N 3.13Å
1345	M	31.2	Very low	31	Very low	102 Å²	102	102.7 Å²	102.7	50%	0.502	53%	0.526	S	S	.	.	S	Bend	trans	-97.9	147.3	167.7	-77.5	-178	64.7	0	0	111.5	L1342 D1349 M1353	L1342-M1345 PolarHBondContact O-N 2.94Å; M1345-D1349 HydrophobicContact CE-CB 3.88Å; M1345-M1353 HydrophobicContact CE-SD 4.32Å
1346	D	35.1	Very low	31.1	Very low	105 Å²	105	99.5 Å²	99.5	56%	0.561	51%	0.512	S	S	*	.			trans	-74	152.6	178.5	-158.7	-50.8	0	0	0	111.4	A1348 D1349 Y1350	D1346-A1348 HydrophobicContact CB-CB 4.39Å; D1346-A1348 PolarHBondContact O-N 2.91Å; D1346-A1348 PolarHBondContact OD1-N 3.5Å; D1346-D1349 PolarHBondContact O-N 2.91Å; D1346-Y1350 PolarHBondContact O-N 3.5Å
1347	L	29.6	Very low	31.2	Very low	123 Å²	123	100.5 Å²	100.5	64%	0.644	52%	0.52	S	S	*	.	H	α-helix	trans	-62.5	-29.4	168.1	-107.4	73.2	0	0	0	111.7	Y1350 Y1351	L1347-Y1350 PolarHBondContact O-N 3.42Å; L1347-Y1351 HydrophobicContact CD2-CE2 4.42Å; L1347-Y1351 WeakPolarHBondContact O-CD2 3.43Å; L1347-Y1351 PolarHBondContact O-N 2.93Å
1348	A	32.1	Very low	31.2	Very low	52 Å²	52	102.3 Å²	102.3	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-59.2	-53.2	174.8	0	0	0	0	0	111.4	D1346 Y1350 Y1351 I1352	D1346-A1348 HydrophobicContact CB-CB 4.39Å; D1346-A1348 PolarHBondContact O-N 2.91Å; D1346-A1348 PolarHBondContact OD1-N 3.5Å; A1348-Y1350 VanDerWaalsContact C-N 3.28Å; A1348-Y1350 PolarHBondContact O-N 3.34Å; A1348-Y1351 PolarHBondContact O-N 2.84Å; A1348-I1352 WeakPolarHBondContact O-CB 3.38Å; A1348-I1352 VanDerWaalsContact O-CG1 3.28Å; A1348-I1352 WeakPolarHBondContact O-CG1 3.12Å; A1348-I1352 PolarHBondContact O-N 3.11Å
1349	D	29.3	Very low	31.2	Very low	84 Å²	84	102.1 Å²	102.1	45%	0.449	52%	0.523	S	S	.	.	H	α-helix	trans	-59.9	-39.8	176.3	-69.4	-34.1	0	0	0	111.6	M1345 D1346 M1353	M1345-D1349 HydrophobicContact CE-CB 3.88Å; D1346-D1349 PolarHBondContact O-N 2.91Å; D1349-M1353 WeakPolarHBondContact O-CB 3.46Å; D1349-M1353 PolarHBondContact O-N 3.23Å
1350	Y	33.9	Very low	31.5	Very low	98 Å²	98	104.7 Å²	104.7	38%	0.384	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-44.4	178.3	-175.4	-100.7	0	0	0	112.7	D1346 L1347 A1348 M1353 Q1354	D1346-Y1350 PolarHBondContact O-N 3.5Å; L1347-Y1350 PolarHBondContact O-N 3.42Å; A1348-Y1350 VanDerWaalsContact C-N 3.28Å; A1348-Y1350 PolarHBondContact O-N 3.34Å; Y1350-M1353 WeakPolarHBondContact O-CB 3.2Å; Y1350-M1353 PolarHBondContact O-N 3.46Å; Y1350-Q1354 HydrophobicContact CE1-CG 4.2Å; Y1350-Q1354 PolarHBondContact O-N 3.39Å; Y1350-Q1354 PolarHBondContact OH-NE2 3.33Å; Y1350-Q1354 VanDerWaalsContact OH-NE2 3.09Å
1351	Y	29.4	Very low	31.4	Very low	136 Å²	136	104.8 Å²	104.8	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-72.9	-36.6	177.7	-90.5	-74.3	0	0	0	112.9	L1347 A1348 M1353 Q1354 V1355	L1347-Y1351 HydrophobicContact CD2-CE2 4.42Å; L1347-Y1351 WeakPolarHBondContact O-CD2 3.43Å; L1347-Y1351 PolarHBondContact O-N 2.93Å; A1348-Y1351 PolarHBondContact O-N 2.84Å; Y1351-M1353 VanDerWaalsContact C-N 3.33Å; Y1351-Q1354 PolarHBondContact O-N 3.44Å; Y1351-V1355 WeakPolarHBondContact O-CG2 3.42Å; Y1351-V1355 PolarHBondContact O-N 3.27Å
1352	I	33.9	Very low	31.4	Very low	107 Å²	107	106.4 Å²	106.4	55%	0.549	53%	0.525	S	S	.	.	H	α-helix	trans	-59.6	-46.7	170.9	-69.3	166.2	0	0	0	109.5	A1348 Q1354 V1355 V1356	A1348-I1352 WeakPolarHBondContact O-CB 3.38Å; A1348-I1352 VanDerWaalsContact O-CG1 3.28Å; A1348-I1352 WeakPolarHBondContact O-CG1 3.12Å; A1348-I1352 PolarHBondContact O-N 3.11Å; I1352-Q1354 PolarHBondContact O-N 3.41Å; I1352-V1355 PolarHBondContact O-N 2.8Å; I1352-V1356 HydrophobicContact CG2-CG2 4.4Å; I1352-V1356 WeakPolarHBondContact O-CB 3.24Å; I1352-V1356 VanDerWaalsContact O-CG2 3.25Å; I1352-V1356 WeakPolarHBondContact O-CG2 3.46Å; I1352-V1356 PolarHBondContact O-N 2.96Å
1353	M	31.3	Very low	31.5	Very low	102 Å²	102	107.2 Å²	107.2	50%	0.502	53%	0.53	S	S	.	.	H	α-helix	trans	-57.6	-44.3	172.6	-87.2	-175.1	56.1	0	0	112.6	M1345 D1349 Y1350 Y1351 L1357	M1345-M1353 HydrophobicContact CE-SD 4.32Å; D1349-M1353 WeakPolarHBondContact O-CB 3.46Å; D1349-M1353 PolarHBondContact O-N 3.23Å; Y1350-M1353 WeakPolarHBondContact O-CB 3.2Å; Y1350-M1353 PolarHBondContact O-N 3.46Å; Y1351-M1353 VanDerWaalsContact C-N 3.33Å; M1353-L1357 HydrophobicContact CE-CD1 4.46Å; M1353-L1357 VanDerWaalsContact O-CB 3.24Å; M1353-L1357 WeakPolarHBondContact O-CB 3.42Å; M1353-L1357 WeakPolarHBondContact O-CD1 3.23Å; M1353-L1357 WeakPolarHBondContact O-CG 2.99Å; M1353-L1357 PolarHBondContact O-N 2.97Å
1354	Q	30.1	Very low	31.8	Very low	70 Å²	70	102.2 Å²	102.2	33%	0.327	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-47.5	178.9	-76.4	-160.4	-3.1	0	0	112.7	Y1350 Y1351 I1352 L1357 I1358	Y1350-Q1354 HydrophobicContact CE1-CG 4.2Å; Y1350-Q1354 PolarHBondContact O-N 3.39Å; Y1350-Q1354 PolarHBondContact OH-NE2 3.33Å; Y1350-Q1354 VanDerWaalsContact OH-NE2 3.09Å; Y1351-Q1354 PolarHBondContact O-N 3.44Å; I1352-Q1354 PolarHBondContact O-N 3.41Å; Q1354-L1357 PolarHBondContact O-N 3.44Å; Q1354-I1358 VanDerWaalsContact O-CG1 3.28Å; Q1354-I1358 WeakPolarHBondContact O-CG1 3.46Å; Q1354-I1358 PolarHBondContact O-N 2.78Å
1355	V	32.3	Very low	31.8	Very low	90 Å²	90	103.1 Å²	103.1	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-45	179.5	175.3	0	0	0	0	110.6	Y1351 I1352 L1357 I1358 V1359	Y1351-V1355 WeakPolarHBondContact O-CG2 3.42Å; Y1351-V1355 PolarHBondContact O-N 3.27Å; I1352-V1355 PolarHBondContact O-N 2.8Å; V1355-L1357 VanDerWaalsContact C-N 3.35Å; V1355-L1357 PolarHBondContact O-N 3.26Å; V1355-I1358 PolarHBondContact O-N 3.33Å; V1355-V1359 HydrophobicContact CG1-CG2 4.41Å; V1355-V1359 WeakPolarHBondContact O-CG2 3.29Å; V1355-V1359 PolarHBondContact O-N 2.81Å
1356	V	34.4	Very low	32	Very low	86 Å²	86	103.1 Å²	103.1	52%	0.521	51%	0.509	S	S	.	.	H	α-helix	trans	-59.2	-44.3	174.9	169.8	0	0	0	0	111.2	I1352 R1360	I1352-V1356 HydrophobicContact CG2-CG2 4.4Å; I1352-V1356 WeakPolarHBondContact O-CB 3.24Å; I1352-V1356 VanDerWaalsContact O-CG2 3.25Å; I1352-V1356 WeakPolarHBondContact O-CG2 3.46Å; I1352-V1356 PolarHBondContact O-N 2.96Å; V1356-R1360 WeakPolarHBondContact O-CB 3.49Å; V1356-R1360 PolarHBondContact O-N 3.01Å
1357	L	31.2	Very low	31.8	Very low	82 Å²	82	99.4 Å²	99.4	43%	0.429	49%	0.49	S	S	.	.	H	α-helix	trans	-65.8	-37.2	178.5	-76.8	166.5	0	0	0	113	M1353 Q1354 V1355 R1361	M1353-L1357 HydrophobicContact CE-CD1 4.46Å; M1353-L1357 VanDerWaalsContact O-CB 3.24Å; M1353-L1357 WeakPolarHBondContact O-CB 3.42Å; M1353-L1357 WeakPolarHBondContact O-CD1 3.23Å; M1353-L1357 WeakPolarHBondContact O-CG 2.99Å; M1353-L1357 PolarHBondContact O-N 2.97Å; Q1354-L1357 PolarHBondContact O-N 3.44Å; V1355-L1357 VanDerWaalsContact C-N 3.35Å; V1355-L1357 PolarHBondContact O-N 3.26Å; L1357-R1361 VanDerWaalsContact O-CB 3.27Å; L1357-R1361 WeakPolarHBondContact O-CB 3.32Å; L1357-R1361 PolarHBondContact O-N 3.11Å
1358	I	33	Very low	32.1	Very low	103 Å²	103	98 Å²	98	53%	0.528	48%	0.48	S	S	.	.	H	α-helix	trans	-70.6	-50.2	179.1	-69.5	164.5	0	0	0	110.8	Q1354 V1355 R1360 R1361 Q1362	Q1354-I1358 VanDerWaalsContact O-CG1 3.28Å; Q1354-I1358 WeakPolarHBondContact O-CG1 3.46Å; Q1354-I1358 PolarHBondContact O-N 2.78Å; V1355-I1358 PolarHBondContact O-N 3.33Å; I1358-R1360 VanDerWaalsContact C-N 3.32Å; I1358-R1360 PolarHBondContact O-N 3.36Å; I1358-R1361 PolarHBondContact O-N 3.32Å; I1358-Q1362 PolarHBondContact O-N 3.06Å
1359	V	31.5	Very low	32.2	Very low	54 Å²	54	97.7 Å²	97.7	33%	0.327	47%	0.471	S	S	.	.	H	α-helix	trans	-61.4	-42.9	178.1	173.3	0	0	0	0	110.6	V1355 R1361 Q1362 N1363	V1355-V1359 HydrophobicContact CG1-CG2 4.41Å; V1355-V1359 WeakPolarHBondContact O-CG2 3.29Å; V1355-V1359 PolarHBondContact O-N 2.81Å; V1359-R1361 PolarHBondContact O-N 3.27Å; V1359-Q1362 PolarHBondContact O-N 3.42Å; V1359-N1363 PolarHBondContact O-N 3.17Å
1360	R	30.9	Very low	32.5	Very low	150 Å²	150	95.3 Å²	95.3	57%	0.566	46%	0.463	S	S	*	.	H	α-helix	trans	-58.9	-47.2	175	-178.9	174.1	-174.1	157.1	10.6	111.9	V1356 I1358 Q1362 N1363 E1364	V1356-R1360 WeakPolarHBondContact O-CB 3.49Å; V1356-R1360 PolarHBondContact O-N 3.01Å; I1358-R1360 VanDerWaalsContact C-N 3.32Å; I1358-R1360 PolarHBondContact O-N 3.36Å; R1360-Q1362 VanDerWaalsContact C-N 3.34Å; R1360-Q1362 PolarHBondContact O-N 2.91Å; R1360-N1363 PolarHBondContact O-N 3.09Å; R1360-E1364 HydrophobicContact CG-CG 4.34Å; R1360-E1364 WeakPolarHBondContact CG-OE1 3.3Å; R1360-E1364 IonicContact CZ-OE1 2.67Å; R1360-E1364 IonicContact NE-OE1 2.67Å; R1360-E1364 PolarHBondContact NE-OE1 3.31Å; R1360-E1364 IonicContact NH2-OE1 3.95Å; R1360-E1364 WeakPolarHBondContact O-CB 3.23Å; R1360-E1364 VanDerWaalsContact O-CG 3.29Å; R1360-E1364 WeakPolarHBondContact O-CG 3.33Å; R1360-E1364 PolarHBondContact O-N 3.41Å
1361	R	30.7	Very low	32.8	Very low	177 Å²	177	92.4 Å²	92.4	67%	0.668	46%	0.455	S	S	*	.	H	α-helix	trans	-68.2	-30.6	-179.4	-160.6	178.7	-67.6	-172.4	-1.8	112.8	L1357 I1358 V1359 F1365	L1357-R1361 VanDerWaalsContact O-CB 3.27Å; L1357-R1361 WeakPolarHBondContact O-CB 3.32Å; L1357-R1361 PolarHBondContact O-N 3.11Å; I1358-R1361 PolarHBondContact O-N 3.32Å; V1359-R1361 PolarHBondContact O-N 3.27Å; R1361-F1365 WeakPolarHBondContact O-CB 3.32Å; R1361-F1365 PolarHBondContact O-N 2.8Å
1362	Q	28.3	Very low	33.5	Very low	133 Å²	133	92.4 Å²	92.4	62%	0.621	46%	0.455	S	S	*	.	H	α-helix	trans	-67.2	-47.8	169.9	-82.6	-172.6	-41.6	0	0	112.1	I1358 V1359 R1360 E1364 F1365 V1366	I1358-Q1362 PolarHBondContact O-N 3.06Å; V1359-Q1362 PolarHBondContact O-N 3.42Å; R1360-Q1362 VanDerWaalsContact C-N 3.34Å; R1360-Q1362 PolarHBondContact O-N 2.91Å; Q1362-E1364 VanDerWaalsContact C-N 3.35Å; Q1362-E1364 PolarHBondContact O-N 3.38Å; Q1362-F1365 PolarHBondContact O-N 3.48Å; Q1362-V1366 WeakPolarHBondContact O-CG2 3.33Å; Q1362-V1366 PolarHBondContact O-N 2.81Å
1363	N	33.1	Very low	33.6	Very low	99 Å²	99	91.4 Å²	91.4	53%	0.529	45%	0.448	S	S	.	.	H	α-helix	trans	-60.8	-43.1	175.6	-86.6	-11.2	0	0	0	112	V1359 R1360 T1367	V1359-N1363 PolarHBondContact O-N 3.17Å; R1360-N1363 PolarHBondContact O-N 3.09Å; N1363-T1367 VanDerWaalsContact O-CB 3.25Å; N1363-T1367 WeakPolarHBondContact O-CB 3.48Å; N1363-T1367 PolarHBondContact O-N 3.46Å; N1363-T1367 PolarHBondContact O-OG1 2.89Å
1364	E	33.7	Very low	34.2	Very low	71 Å²	71	87.9 Å²	87.9	33%	0.332	43%	0.431	S	S	.	.	H	α-helix	trans	-60.5	-47.3	176.7	-74.6	164.9	173	0	0	111	R1360 Q1362 T1367 E1368	R1360-E1364 HydrophobicContact CG-CG 4.34Å; R1360-E1364 WeakPolarHBondContact CG-OE1 3.3Å; R1360-E1364 IonicContact CZ-OE1 2.67Å; R1360-E1364 IonicContact NE-OE1 2.67Å; R1360-E1364 PolarHBondContact NE-OE1 3.31Å; R1360-E1364 IonicContact NH2-OE1 3.95Å; R1360-E1364 WeakPolarHBondContact O-CB 3.23Å; R1360-E1364 VanDerWaalsContact O-CG 3.29Å; R1360-E1364 WeakPolarHBondContact O-CG 3.33Å; R1360-E1364 PolarHBondContact O-N 3.41Å; Q1362-E1364 VanDerWaalsContact C-N 3.35Å; Q1362-E1364 PolarHBondContact O-N 3.38Å; E1364-T1367 PolarHBondContact O-N 2.89Å; E1364-E1368 WeakPolarHBondContact O-CG 3.27Å; E1364-E1368 PolarHBondContact O-N 3.42Å
1365	F	33.4	Very low	34.9	Very low	142 Å²	142	89 Å²	89	62%	0.623	44%	0.439	S	S	*	.	H	α-helix	trans	-68.4	-37.4	-179.9	-171.2	-97.8	0	0	0	114.1	R1361 Q1362 N1369	R1361-F1365 WeakPolarHBondContact O-CB 3.32Å; R1361-F1365 PolarHBondContact O-N 2.8Å; Q1362-F1365 PolarHBondContact O-N 3.48Å; F1365-N1369 VanDerWaalsContact CE1-ND2 3.32Å; F1365-N1369 WeakPolarHBondContact CE1-ND2 3.38Å; F1365-N1369 WeakPolarHBondContact CZ-ND2 2.96Å; F1365-N1369 PolarHBondContact O-N 3.29Å; F1365-N1369 PolarHBondContact O-ND2 3.19Å
1366	V	33.9	Very low	35.5	Very low	102 Å²	102	88.1 Å²	88.1	62%	0.618	43%	0.434	S	S	*	.	H	α-helix	trans	-66.3	-44.3	174	172.6	0	0	0	0	110.3	Q1362 A1370	Q1362-V1366 WeakPolarHBondContact O-CG2 3.33Å; Q1362-V1366 PolarHBondContact O-N 2.81Å; V1366-A1370 PolarHBondContact O-N 3.29Å; V1366-A1370 VanDerWaalsContact O-N 3.16Å
1367	T	31.9	Very low	35.9	Very low	27 Å²	27	84.5 Å²	84.5	17%	0.166	41%	0.411	C	S	.	.	H	α-helix	trans	-59.9	-52.2	177	-59.5	0	0	0	0	111.6	N1363 E1364 N1369 A1370 V1371 A1634	N1363-T1367 VanDerWaalsContact O-CB 3.25Å; N1363-T1367 WeakPolarHBondContact O-CB 3.48Å; N1363-T1367 PolarHBondContact O-N 3.46Å; N1363-T1367 PolarHBondContact O-OG1 2.89Å; E1364-T1367 PolarHBondContact O-N 2.89Å; T1367-N1369 VanDerWaalsContact C-N 3.27Å; T1367-N1369 PolarHBondContact O-N 3.21Å; T1367-A1370 PolarHBondContact O-N 3.19Å; T1367-A1370 VanDerWaalsContact O-N 3.09Å; T1367-V1371 HydrophobicContact CG2-CG2 3.94Å; T1367-V1371 WeakPolarHBondContact O-CG2 3.48Å; T1367-V1371 PolarHBondContact O-N 3.37Å; T1367-A1634 HydrophobicContact CG2-CB 3.29Å; T1367-A1634 WeakPolarHBondContact OG1-CB 3.25Å
1368	E	35.1	Very low	36.5	Very low	92 Å²	92	81.6 Å²	81.6	43%	0.43	40%	0.396	S	S	.	.	H	α-helix	trans	-68.2	-27.3	-172.5	-70.7	-168.6	159.8	0	0	112.9	E1364 R1372 K1635	E1364-E1368 WeakPolarHBondContact O-CG 3.27Å; E1364-E1368 PolarHBondContact O-N 3.42Å; E1368-R1372 WeakPolarHBondContact O-CB 3.32Å; E1368-R1372 PolarHBondContact O-N 3.42Å; E1368-R1372 VanDerWaalsContact O-N 3.1Å; E1368-K1635 IonicContact OE1-NZ 3.31Å; E1368-K1635 PolarHBondContact OE1-NZ 2.82Å
1369	N	34.5	Very low	37.2	Very low	47 Å²	47	79.6 Å²	79.6	25%	0.251	39%	0.392	S	S	.	.	H	α-helix	trans	-70.1	-43.5	169.1	-78.7	-67.2	0	0	0	112.5	F1365 T1367 R1372 Q1373	F1365-N1369 VanDerWaalsContact CE1-ND2 3.32Å; F1365-N1369 WeakPolarHBondContact CE1-ND2 3.38Å; F1365-N1369 WeakPolarHBondContact CZ-ND2 2.96Å; F1365-N1369 PolarHBondContact O-N 3.29Å; F1365-N1369 PolarHBondContact O-ND2 3.19Å; T1367-N1369 VanDerWaalsContact C-N 3.27Å; T1367-N1369 PolarHBondContact O-N 3.21Å; N1369-R1372 PolarHBondContact OD1-NH2 3Å; N1369-Q1373 WeakPolarHBondContact O-CG 3.39Å; N1369-Q1373 PolarHBondContact O-N 3.22Å; N1369-Q1373 VanDerWaalsContact O-N 3.16Å
1370	A	36.6	Very low	37.8	Very low	33 Å²	33	82.3 Å²	82.3	27%	0.273	40%	0.399	S	S	.	.	H	α-helix	trans	-63	-50.1	176.5	0	0	0	0	0	111.8	V1366 T1367 R1372 Q1373 I1374	V1366-A1370 PolarHBondContact O-N 3.29Å; V1366-A1370 VanDerWaalsContact O-N 3.16Å; T1367-A1370 PolarHBondContact O-N 3.19Å; T1367-A1370 VanDerWaalsContact O-N 3.09Å; A1370-R1372 PolarHBondContact O-N 3.19Å; A1370-Q1373 PolarHBondContact O-N 3.2Å; A1370-I1374 VanDerWaalsContact O-CG1 3.28Å; A1370-I1374 WeakPolarHBondContact O-CG1 3.35Å; A1370-I1374 PolarHBondContact O-N 3.01Å
1371	V	40.5	Very low	38.6	Very low	37 Å²	37	75.3 Å²	75.3	22%	0.224	37%	0.373	C	S	.	.	H	α-helix	trans	-58.1	-48.3	178.4	171.9	0	0	0	0	111	T1367 Q1373 I1374 D1375	T1367-V1371 HydrophobicContact CG2-CG2 3.94Å; T1367-V1371 WeakPolarHBondContact O-CG2 3.48Å; T1367-V1371 PolarHBondContact O-N 3.37Å; V1371-Q1373 VanDerWaalsContact C-N 3.3Å; V1371-Q1373 PolarHBondContact O-N 2.9Å; V1371-I1374 PolarHBondContact O-N 3.3Å; V1371-I1374 VanDerWaalsContact O-N 3.09Å; V1371-D1375 PolarHBondContact O-N 3.08Å
1372	R	42.8	Very low	39.5	Very low	137 Å²	137	69.3 Å²	69.3	52%	0.517	35%	0.354	S	S	.	.	H	α-helix	trans	-60.3	-36.3	178.8	176.8	165.9	53.7	-139.2	-3.7	113.2	E1368 N1369 A1370 T1376	E1368-R1372 WeakPolarHBondContact O-CB 3.32Å; E1368-R1372 PolarHBondContact O-N 3.42Å; E1368-R1372 VanDerWaalsContact O-N 3.1Å; N1369-R1372 PolarHBondContact OD1-NH2 3Å; A1370-R1372 PolarHBondContact O-N 3.19Å; R1372-T1376 WeakPolarHBondContact O-CB 3.43Å; R1372-T1376 PolarHBondContact O-N 3.48Å; R1372-T1376 PolarHBondContact O-OG1 2.56Å
1373	Q	36.3	Very low	40.5	Very low	86 Å²	86	69.1 Å²	69.1	40%	0.402	35%	0.353	S	S	.	.	H	α-helix	trans	-70.4	-39.5	174.4	-72	-179.9	7.3	0	0	112	N1369 A1370 V1371 T1376 F1377	N1369-Q1373 WeakPolarHBondContact O-CG 3.39Å; N1369-Q1373 PolarHBondContact O-N 3.22Å; N1369-Q1373 VanDerWaalsContact O-N 3.16Å; A1370-Q1373 PolarHBondContact O-N 3.2Å; V1371-Q1373 VanDerWaalsContact C-N 3.3Å; V1371-Q1373 PolarHBondContact O-N 2.9Å; Q1373-T1376 PolarHBondContact O-N 2.9Å; Q1373-F1377 PolarHBondContact O-N 3.02Å
1374	I	43.5	Very low	40.9	Very low	28 Å²	28	64.9 Å²	64.9	14%	0.144	33%	0.331	C	S	.	.	H	α-helix	trans	-69.5	-39.1	178.5	-63.4	162.9	0	0	0	111.8	A1370 V1371 T1376 F1377 T1378 A1627	A1370-I1374 VanDerWaalsContact O-CG1 3.28Å; A1370-I1374 WeakPolarHBondContact O-CG1 3.35Å; A1370-I1374 PolarHBondContact O-N 3.01Å; V1371-I1374 PolarHBondContact O-N 3.3Å; V1371-I1374 VanDerWaalsContact O-N 3.09Å; I1374-T1376 VanDerWaalsContact C-N 3.34Å; I1374-F1377 WeakPolarHBondContact O-CB 3.43Å; I1374-F1377 PolarHBondContact O-N 3.37Å; I1374-T1378 WeakPolarHBondContact O-CB 3.42Å; I1374-T1378 PolarHBondContact O-N 3.44Å; I1374-T1378 PolarHBondContact O-OG1 2.78Å; I1374-A1627 HydrophobicContact CG2-CB 3.43Å; I1374-A1627 VanDerWaalsContact CG2-CB 3.43Å
1375	D	46.3	Very low	41.4	Very low	94 Å²	94	62.7 Å²	62.7	50%	0.503	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-42.3	172.8	-80.2	-32.1	0	0	0	111.1	V1371 F1377 T1378 S1379	V1371-D1375 PolarHBondContact O-N 3.08Å; D1375-F1377 VanDerWaalsContact C-N 3.33Å; D1375-F1377 PolarHBondContact O-N 3.25Å; D1375-T1378 PolarHBondContact O-N 2.96Å; D1375-S1379 WeakPolarHBondContact O-CB 3.21Å; D1375-S1379 PolarHBondContact O-N 2.72Å
1376	T	43.3	Very low	42.1	Very low	71 Å²	71	60.4 Å²	60.4	44%	0.436	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-36.5	176.4	-54.1	0	0	0	0	112.1	R1372 Q1373 I1374 K1380	R1372-T1376 WeakPolarHBondContact O-CB 3.43Å; R1372-T1376 PolarHBondContact O-N 3.48Å; R1372-T1376 PolarHBondContact O-OG1 2.56Å; Q1373-T1376 PolarHBondContact O-N 2.9Å; I1374-T1376 VanDerWaalsContact C-N 3.34Å; T1376-K1380 PolarHBondContact O-N 3.14Å
1377	F	43.5	Very low	42.6	Very low	10 Å²	10	57.7 Å²	57.7	4%	0.044	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-54	171.3	171	-150.3	0	0	0	111.2	Q1373 I1374 D1375 S1379 K1380 F1381 F1572 L1575 L1579 L1584 L1623	Q1373-F1377 PolarHBondContact O-N 3.02Å; I1374-F1377 WeakPolarHBondContact O-CB 3.43Å; I1374-F1377 PolarHBondContact O-N 3.37Å; D1375-F1377 VanDerWaalsContact C-N 3.33Å; D1375-F1377 PolarHBondContact O-N 3.25Å; F1377-S1379 PolarHBondContact O-N 3.16Å; F1377-K1380 PolarHBondContact O-N 3Å; F1377-F1381 HydrophobicContact CD2-CB 4.01Å; F1377-F1381 HydrophobicContact CE2-CB 3.76Å; F1377-F1381 HydrophobicContact CE2-CD2 4.39Å; F1377-F1381 HydrophobicContact CE2-CG 4.21Å; F1377-F1381 WeakPolarHBondContact O-CB 3.34Å; F1377-F1381 PolarHBondContact O-N 2.91Å; F1377-F1572 HydrophobicContact CE2-CD1 4.17Å; F1377-F1572 AromaticContact CE2-CE1 3.96Å; F1377-F1572 HydrophobicContact CE2-CE1 3.96Å; F1377-F1572 HydrophobicContact CZ-CD1 4.4Å; F1377-F1572 AromaticContact CZ-CE1 3.98Å; F1377-F1572 HydrophobicContact CZ-CE1 3.98Å; F1377-L1575 HydrophobicContact CB-CD1 4.17Å; F1377-L1575 HydrophobicContact CB-CD2 3.81Å; F1377-L1575 HydrophobicContact CD2-CD1 3.4Å; F1377-L1575 HydrophobicContact CD2-CD2 4.46Å; F1377-L1575 HydrophobicContact CD2-CG 4.43Å; F1377-L1575 HydrophobicContact CE2-CD1 4.1Å; F1377-L1575 HydrophobicContact CG-CD1 4.04Å; F1377-L1575 HydrophobicContact CG-CD2 4.28Å; F1377-L1579 HydrophobicContact CD1-CD1 3.99Å; F1377-L1579 HydrophobicContact CE1-CD1 4.49Å; F1377-L1579 HydrophobicContact CG-CD1 4.37Å; F1377-L1584 HydrophobicContact CE1-CD1 4.07Å; F1377-L1623 HydrophobicContact CE1-CD1 3.98Å; F1377-L1623 HydrophobicContact CE1-CD2 3.82Å; F1377-L1623 HydrophobicContact CZ-CD1 3.9Å; F1377-L1623 HydrophobicContact CZ-CD2 4.45Å
1378	T	44.7	Very low	43.1	Very low	20 Å²	20	56.9 Å²	56.9	12%	0.123	30%	0.298	C	S	.	.	H	α-helix	trans	-55.7	-42.1	-177.5	-55.9	0	0	0	0	110.9	I1374 D1375 N1382	I1374-T1378 WeakPolarHBondContact O-CB 3.42Å; I1374-T1378 PolarHBondContact O-N 3.44Å; I1374-T1378 PolarHBondContact O-OG1 2.78Å; D1375-T1378 PolarHBondContact O-N 2.96Å; T1378-N1382 VanDerWaalsContact O-CB 3.32Å; T1378-N1382 WeakPolarHBondContact O-CB 3.5Å; T1378-N1382 PolarHBondContact O-N 2.97Å; T1378-N1382 PolarHBondContact O-ND2 3.17Å; T1378-N1382 PolarHBondContact O-OD1 3.27Å
1379	S	46	Very low	43.4	Very low	61 Å²	61	54.3 Å²	54.3	43%	0.427	29%	0.29	S	S	.	.	H	α-helix	trans	-54.5	-53.8	173	173.2	0	0	0	0	113.1	D1375 F1377 Q1383	D1375-S1379 WeakPolarHBondContact O-CB 3.21Å; D1375-S1379 PolarHBondContact O-N 2.72Å; F1377-S1379 PolarHBondContact O-N 3.16Å; S1379-Q1383 WeakPolarHBondContact O-CG 3.33Å; S1379-Q1383 PolarHBondContact O-N 3.34Å
1380	K	45.9	Very low	43.7	Very low	111 Å²	111	57.7 Å²	57.7	48%	0.483	31%	0.308	S	S	.	.	H	α-helix	trans	-72.8	-35.3	-176.8	-69.5	-177.3	176.9	-178.2	0	113.3	T1376 F1377 T1384 V1571	T1376-K1380 PolarHBondContact O-N 3.14Å; F1377-K1380 PolarHBondContact O-N 3Å; K1380-T1384 PolarHBondContact O-N 2.86Å; K1380-T1384 PolarHBondContact O-OG1 3.3Å; K1380-V1571 HydrophobicContact CB-CG1 4.09Å
1381	F	47.3	Very low	44	Very low	3 Å²	3	56.6 Å²	56.6	1%	0.013	30%	0.298	C	S	.	.	H	α-helix	trans	-63.8	-46.7	175.5	178.5	-109	0	0	0	110.9	F1377 T1384 M1385 L1568 F1572 L1619 P1620 L1623	F1377-F1381 HydrophobicContact CD2-CB 4.01Å; F1377-F1381 HydrophobicContact CE2-CB 3.76Å; F1377-F1381 HydrophobicContact CE2-CD2 4.39Å; F1377-F1381 HydrophobicContact CE2-CG 4.21Å; F1377-F1381 WeakPolarHBondContact O-CB 3.34Å; F1377-F1381 PolarHBondContact O-N 2.91Å; F1381-T1384 PolarHBondContact O-N 3.01Å; F1381-M1385 HydrophobicContact CD1-CG 4.35Å; F1381-M1385 HydrophobicContact CD2-CG 4.32Å; F1381-M1385 HydrophobicContact CE1-CG 3.78Å; F1381-M1385 HydrophobicContact CE2-CG 3.73Å; F1381-M1385 HydrophobicContact CE2-SD 4.26Å; F1381-M1385 HydrophobicContact CZ-CG 3.42Å; F1381-M1385 VanDerWaalsContact CZ-CG 3.42Å; F1381-M1385 HydrophobicContact CZ-SD 4.03Å; F1381-M1385 PolarHBondContact O-N 3.13Å; F1381-L1568 HydrophobicContact CD2-CD1 4.21Å; F1381-L1568 HydrophobicContact CE2-CD1 4.05Å; F1381-F1572 AromaticContact CD2-CE1 3.91Å; F1381-F1572 HydrophobicContact CD2-CE1 3.91Å; F1381-F1572 AromaticContact CD2-CZ 3.77Å; F1381-F1572 HydrophobicContact CD2-CZ 3.77Å; F1381-F1572 HydrophobicContact CE2-CE1 4.07Å; F1381-F1572 HydrophobicContact CE2-CE2 4.33Å; F1381-F1572 AromaticContact CE2-CZ 3.5Å; F1381-F1572 HydrophobicContact CE2-CZ 3.5Å; F1381-F1572 VanDerWaalsContact CE2-CZ 3.5Å; F1381-L1619 HydrophobicContact CE1-CB 4.24Å; F1381-L1619 HydrophobicContact CE1-CD2 4.29Å; F1381-L1619 HydrophobicContact CZ-CB 4.29Å; F1381-L1619 HydrophobicContact CZ-CD2 3.76Å; F1381-P1620 HydrophobicContact CD1-CG 4.36Å; F1381-P1620 HydrophobicContact CE1-CG 3.9Å; F1381-L1623 HydrophobicContact CD1-CD1 3.91Å; F1381-L1623 HydrophobicContact CE1-CD1 4.01Å; F1381-L1623 HydrophobicContact CG-CD1 4.46Å
1382	N	48.9	Very low	44	Very low	51 Å²	51	56.1 Å²	56.1	27%	0.273	30%	0.298	S	S	.	.	H	α-helix	trans	-59.6	-51.1	177.9	-66.8	0.9	0	0	0	111.2	T1378 T1384 M1385 D1386 P1620	T1378-N1382 VanDerWaalsContact O-CB 3.32Å; T1378-N1382 WeakPolarHBondContact O-CB 3.5Å; T1378-N1382 PolarHBondContact O-N 2.97Å; T1378-N1382 PolarHBondContact O-ND2 3.17Å; T1378-N1382 PolarHBondContact O-OD1 3.27Å; N1382-T1384 PolarHBondContact O-N 3.1Å; N1382-T1384 VanDerWaalsContact O-N 3.1Å; N1382-M1385 CarbonylContact O-C 3.6Å; N1382-M1385 PolarHBondContact O-N 3.32Å; N1382-D1386 PolarHBondContact O-N 3.49Å; N1382-P1620 WeakPolarHBondContact OD1-CB 3.45Å
1383	Q	48.7	Very low	43.8	Very low	129 Å²	129	54 Å²	54	60%	0.603	30%	0.3	S	S	*	.	H	α-helix	trans	-53.2	-35.8	176.7	-74.3	176	-18.4	0	0	113.3	S1379 A1387	S1379-Q1383 WeakPolarHBondContact O-CG 3.33Å; S1379-Q1383 PolarHBondContact O-N 3.34Å; Q1383-A1387 PolarHBondContact O-N 3.33Å
1384	T	43	Very low	44	Very low	11 Å²	11	52.1 Å²	52.1	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-80.5	-34.7	179.9	-43.6	0	0	0	0	112.1	K1380 F1381 N1382 A1387 L1388 L1567 L1568	K1380-T1384 PolarHBondContact O-N 2.86Å; K1380-T1384 PolarHBondContact O-OG1 3.3Å; F1381-T1384 PolarHBondContact O-N 3.01Å; N1382-T1384 PolarHBondContact O-N 3.1Å; N1382-T1384 VanDerWaalsContact O-N 3.1Å; T1384-A1387 PolarHBondContact O-N 2.79Å; T1384-L1388 PolarHBondContact O-N 2.72Å; T1384-L1567 HydrophobicContact CG2-CB 4.26Å; T1384-L1568 HydrophobicContact CG2-CB 3.96Å; T1384-L1568 HydrophobicContact CG2-CD1 3.73Å; T1384-L1568 HydrophobicContact CG2-CG 4.49Å
1385	M	44.3	Very low	43.9	Very low	24 Å²	24	55 Å²	55	12%	0.118	32%	0.316	C	S	.	.	H	α-helix	trans	-68.4	-35	171.6	-80.2	-59.1	-54.1	0	0	112.7	F1381 N1382 L1388 S1389 F1616	F1381-M1385 HydrophobicContact CD1-CG 4.35Å; F1381-M1385 HydrophobicContact CD2-CG 4.32Å; F1381-M1385 HydrophobicContact CE1-CG 3.78Å; F1381-M1385 HydrophobicContact CE2-CG 3.73Å; F1381-M1385 HydrophobicContact CE2-SD 4.26Å; F1381-M1385 HydrophobicContact CZ-CG 3.42Å; F1381-M1385 VanDerWaalsContact CZ-CG 3.42Å; F1381-M1385 HydrophobicContact CZ-SD 4.03Å; F1381-M1385 PolarHBondContact O-N 3.13Å; N1382-M1385 CarbonylContact O-C 3.6Å; N1382-M1385 PolarHBondContact O-N 3.32Å; M1385-L1388 PolarHBondContact O-N 3.5Å; M1385-L1388 HydrophobicContact SD-CD1 4.2Å; M1385-S1389 WeakPolarHBondContact O-CB 2.95Å; M1385-S1389 PolarHBondContact O-N 2.93Å; M1385-F1616 HydrophobicContact CE-CB 4.45Å
1386	D	47	Very low	43.6	Very low	94 Å²	94	51.5 Å²	51.5	50%	0.503	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-41.6	174.5	-65.3	-33.6	0	0	0	110.6	N1382 S1389 N1390	N1382-D1386 PolarHBondContact O-N 3.49Å; D1386-S1389 PolarHBondContact O-N 2.78Å; D1386-N1390 WeakPolarHBondContact O-CB 3.26Å; D1386-N1390 VanDerWaalsContact O-CG 3.31Å; D1386-N1390 PolarHBondContact O-N 3.48Å; D1386-N1390 PolarHBondContact O-ND2 2.94Å; D1386-N1390 VanDerWaalsContact O-ND2 3.09Å
1387	A	43.7	Very low	43.5	Very low	45 Å²	45	50.3 Å²	50.3	37%	0.372	30%	0.298	S	S	.	.	H	α-helix	trans	-62.7	-42.6	172.8	0	0	0	0	0	112.6	Q1383 T1384 S1391	Q1383-A1387 PolarHBondContact O-N 3.33Å; T1384-A1387 PolarHBondContact O-N 2.79Å; A1387-S1391 WeakPolarHBondContact O-CB 3.34Å; A1387-S1391 PolarHBondContact O-N 3.07Å; A1387-S1391 PolarHBondContact O-OG 3.17Å
1388	L	43.1	Very low	43.1	Very low	11 Å²	11	59.4 Å²	59.4	6%	0.058	33%	0.332	C	S	.	.	H	α-helix	trans	-65.4	-39.1	173.8	-81.8	165.8	0	0	0	112.7	T1384 M1385 S1391 A1392 Y1561 S1564 L1568 M1595	T1384-L1388 PolarHBondContact O-N 2.72Å; M1385-L1388 PolarHBondContact O-N 3.5Å; M1385-L1388 HydrophobicContact SD-CD1 4.2Å; L1388-S1391 WeakPolarHBondContact CA-OG 3.32Å; L1388-S1391 PolarHBondContact O-OG 3Å; L1388-A1392 WeakPolarHBondContact O-CB 2.97Å; L1388-A1392 PolarHBondContact O-N 3.41Å; L1388-Y1561 HydrophobicContact CD2-CD2 4.47Å; L1388-Y1561 HydrophobicContact CD2-CE2 4.38Å; L1388-S1564 VanDerWaalsContact CD2-CB 3.5Å; L1388-L1568 HydrophobicContact CD1-CB 4.19Å; L1388-L1568 HydrophobicContact CD1-CD1 4.1Å; L1388-L1568 HydrophobicContact CD1-CD2 3.81Å; L1388-L1568 HydrophobicContact CD1-CG 4.25Å; L1388-M1595 HydrophobicContact CD2-CE 4.47Å
1389	S	41.3	Very low	42.9	Very low	37 Å²	37	59.1 Å²	59.1	26%	0.259	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-50.2	177.2	-173.1	0	0	0	0	111.1	M1385 D1386 V1393	M1385-S1389 WeakPolarHBondContact O-CB 2.95Å; M1385-S1389 PolarHBondContact O-N 2.93Å; D1386-S1389 PolarHBondContact O-N 2.78Å; S1389-V1393 WeakPolarHBondContact O-CB 3.33Å; S1389-V1393 PolarHBondContact O-N 3.22Å
1390	N	42.1	Very low	42.4	Very low	119 Å²	119	59.4 Å²	59.4	64%	0.636	34%	0.336	S	S	*	.	H	α-helix	trans	-68.3	-35.7	-178.2	-70.3	-34.4	0	0	0	113.3	D1386	D1386-N1390 WeakPolarHBondContact O-CB 3.26Å; D1386-N1390 VanDerWaalsContact O-CG 3.31Å; D1386-N1390 PolarHBondContact O-N 3.48Å; D1386-N1390 PolarHBondContact O-ND2 2.94Å; D1386-N1390 VanDerWaalsContact O-ND2 3.09Å
1391	S	42.9	Very low	41.9	Very low	9 Å²	9	58.1 Å²	58.1	6%	0.063	35%	0.346	C	S	.	.	H	α-helix	trans	-78	-45.5	176.3	55.5	0	0	0	0	112.7	A1387 L1388 K1395	A1387-S1391 WeakPolarHBondContact O-CB 3.34Å; A1387-S1391 PolarHBondContact O-N 3.07Å; A1387-S1391 PolarHBondContact O-OG 3.17Å; L1388-S1391 WeakPolarHBondContact CA-OG 3.32Å; L1388-S1391 PolarHBondContact O-OG 3Å; S1391-K1395 WeakPolarHBondContact O-CB 3.21Å
1392	A	39.8	Very low	41.3	Very low	27 Å²	27	61.8 Å²	61.8	22%	0.223	38%	0.377	C	S	.	.	H	α-helix	trans	-79.7	-54.6	-173.8	0	0	0	0	0	113.1	L1388 F1396 Y1561	L1388-A1392 WeakPolarHBondContact O-CB 2.97Å; L1388-A1392 PolarHBondContact O-N 3.41Å; A1392-F1396 WeakPolarHBondContact O-CB 3.36Å; A1392-F1396 PolarHBondContact O-N 3.48Å; A1392-Y1561 HydrophobicContact CB-CD2 4.06Å; A1392-Y1561 HydrophobicContact CB-CE2 4.04Å
1393	V	39.1	Very low	40.6	Very low	92 Å²	92	60 Å²	60	56%	0.558	37%	0.368	S	S	*	.	H	α-helix	trans	-74	-49.8	-167	-174.9	0	0	0	0	111.2	S1389 G1397	S1389-V1393 WeakPolarHBondContact O-CB 3.33Å; S1389-V1393 PolarHBondContact O-N 3.22Å; V1393-G1397 PolarHBondContact O-N 2.68Å
1394	G	39.1	Very low	40.1	Very low	48 Å²	48	55.9 Å²	55.9	50%	0.495	36%	0.36	S	S	.	.	H	α-helix	trans	-69.7	-36.3	-175	0	0	0	0	0	114.4
1395	K	41.7	Very low	39.7	Very low	89 Å²	89	61.2 Å²	61.2	39%	0.387	40%	0.398	S	S	.	.	H	α-helix	trans	-91.2	-46	-174.4	-60.8	-176.3	177.6	-172.1	0	113.2	S1391 G1397 R1398 V1399 L1557 D1560	S1391-K1395 WeakPolarHBondContact O-CB 3.21Å; K1395-G1397 PolarHBondContact O-N 2.77Å; K1395-R1398 WeakPolarHBondContact O-CB 3.32Å; K1395-R1398 PolarHBondContact O-N 2.9Å; K1395-R1398 VanDerWaalsContact O-N 3.1Å; K1395-V1399 PolarHBondContact O-N 3.4Å; K1395-L1557 HydrophobicContact CB-CD1 3.43Å; K1395-L1557 VanDerWaalsContact CB-CD1 3.43Å; K1395-L1557 HydrophobicContact CB-CD2 3.93Å; K1395-L1557 HydrophobicContact CB-CG 4.26Å; K1395-L1557 HydrophobicContact CD-CD1 3.77Å; K1395-L1557 HydrophobicContact CG-CD1 4.24Å; K1395-D1560 IonicContact NZ-OD2 2.73Å; K1395-D1560 PolarHBondContact NZ-OD2 3.14Å
1396	F	40.6	Very low	39.6	Very low	20 Å²	20	62.7 Å²	62.7	9%	0.088	41%	0.414	C	S	.	.	H	α-helix	trans	-66.5	-25.4	176.2	-76.5	-75.9	0	0	0	113	A1392 R1398 V1399 A1400 I1409 M1413 L1557 Y1561	A1392-F1396 WeakPolarHBondContact O-CB 3.36Å; A1392-F1396 PolarHBondContact O-N 3.48Å; F1396-R1398 VanDerWaalsContact C-N 3.29Å; F1396-R1398 PolarHBondContact O-N 3.5Å; F1396-V1399 WeakPolarHBondContact O-CB 3.47Å; F1396-V1399 PolarHBondContact O-N 3.01Å; F1396-A1400 PolarHBondContact O-N 3.48Å; F1396-I1409 HydrophobicContact CD1-CG2 4.11Å; F1396-I1409 HydrophobicContact CE1-CG2 4.19Å; F1396-M1413 HydrophobicContact CE1-CG 3.97Å; F1396-M1413 HydrophobicContact CE1-SD 4.33Å; F1396-M1413 HydrophobicContact CZ-CG 4.15Å; F1396-M1413 HydrophobicContact CZ-SD 3.99Å; F1396-L1557 HydrophobicContact CD1-CD2 4.22Å; F1396-L1557 HydrophobicContact CD2-CD1 4.1Å; F1396-L1557 HydrophobicContact CE1-CD2 4.3Å; F1396-L1557 HydrophobicContact CE1-CG 4.41Å; F1396-L1557 HydrophobicContact CE2-CD1 3.93Å; F1396-L1557 HydrophobicContact CE2-CG 4.36Å; F1396-L1557 HydrophobicContact CG-CD2 4.42Å; F1396-L1557 HydrophobicContact CZ-CD1 4.3Å; F1396-L1557 HydrophobicContact CZ-CG 4.23Å; F1396-Y1561 HydrophobicContact CE2-CD1 4.5Å; F1396-Y1561 HydrophobicContact CE2-CD2 4.21Å; F1396-Y1561 HydrophobicContact CE2-CG 4.03Å
1397	G	40	Very low	39.2	Very low	45 Å²	45	61.9 Å²	61.9	46%	0.464	41%	0.406	S	S	.	.	H	α-helix	trans	-59.4	-38.6	170.9	0	0	0	0	0	113	V1393 K1395 A1401	V1393-G1397 PolarHBondContact O-N 2.68Å; K1395-G1397 PolarHBondContact O-N 2.77Å; G1397-A1401 PolarHBondContact O-N 2.95Å
1398	R	36.8	Very low	39.4	Very low	202 Å²	202	61.5 Å²	61.5	76%	0.762	40%	0.401	S	S	*	.	H	α-helix	trans	-68.5	-41.9	174.3	-68.8	-177.5	170.2	-162.6	-3.5	112.1	K1395 F1396 A1401 A1402	K1395-R1398 WeakPolarHBondContact O-CB 3.32Å; K1395-R1398 PolarHBondContact O-N 2.9Å; K1395-R1398 VanDerWaalsContact O-N 3.1Å; F1396-R1398 VanDerWaalsContact C-N 3.29Å; F1396-R1398 PolarHBondContact O-N 3.5Å; R1398-A1401 PolarHBondContact O-N 2.84Å; R1398-A1402 VanDerWaalsContact O-CB 3.32Å; R1398-A1402 WeakPolarHBondContact O-CB 3.02Å; R1398-A1402 PolarHBondContact O-N 3.5Å
1399	V	39.6	Very low	39.7	Very low	14 Å²	14	63.8 Å²	63.8	9%	0.085	41%	0.413	C	S	.	.	H	α-helix	trans	-57	-49.8	174.1	165.2	0	0	0	0	111.4	K1395 F1396 A1401 A1402 V1403 Y1412 L1557	K1395-V1399 PolarHBondContact O-N 3.4Å; F1396-V1399 WeakPolarHBondContact O-CB 3.47Å; F1396-V1399 PolarHBondContact O-N 3.01Å; V1399-A1401 VanDerWaalsContact C-N 3.27Å; V1399-A1401 PolarHBondContact O-N 3.01Å; V1399-A1402 PolarHBondContact O-N 3.46Å; V1399-A1402 VanDerWaalsContact O-N 3.16Å; V1399-V1403 HydrophobicContact CG1-CG2 4.19Å; V1399-V1403 WeakPolarHBondContact O-CB 3.4Å; V1399-V1403 WeakPolarHBondContact O-CG2 3.37Å; V1399-V1403 PolarHBondContact O-N 3.18Å; V1399-Y1412 HydrophobicContact CB-CE1 4.21Å; V1399-Y1412 HydrophobicContact CG1-CD1 3.43Å; V1399-Y1412 VanDerWaalsContact CG1-CD1 3.43Å; V1399-Y1412 HydrophobicContact CG1-CD2 3.92Å; V1399-Y1412 HydrophobicContact CG1-CE1 3.29Å; V1399-Y1412 HydrophobicContact CG1-CE2 3.81Å; V1399-Y1412 HydrophobicContact CG1-CG 3.7Å; V1399-Y1412 VanDerWaalsContact CG1-CZ 3.46Å; V1399-Y1412 HydrophobicContact CG2-CE1 3.84Å; V1399-L1557 HydrophobicContact CG2-CD2 3.63Å
1400	A	36.5	Very low	40.2	Very low	66 Å²	66	65.3 Å²	65.3	55%	0.545	42%	0.415	S	S	.	.	H	α-helix	trans	-60.4	-37.5	-179.3	0	0	0	0	0	112.2	F1396	F1396-A1400 PolarHBondContact O-N 3.48Å
1401	A	35	Very low	40.9	Very low	84 Å²	84	60.7 Å²	60.7	69%	0.694	40%	0.395	S	S	*	.	H	α-helix	trans	-70.6	-41	174.1	0	0	0	0	0	113	G1397 R1398 V1399	G1397-A1401 PolarHBondContact O-N 2.95Å; R1398-A1401 PolarHBondContact O-N 2.84Å; V1399-A1401 VanDerWaalsContact C-N 3.27Å; V1399-A1401 PolarHBondContact O-N 3.01Å
1402	A	34	Very low	41.7	Very low	80 Å²	80	60.7 Å²	60.7	66%	0.661	39%	0.393	S	S	*	.	H	α-helix	trans	-76	-31	-175.8	0	0	0	0	0	114.1	R1398 V1399	R1398-A1402 VanDerWaalsContact O-CB 3.32Å; R1398-A1402 WeakPolarHBondContact O-CB 3.02Å; R1398-A1402 PolarHBondContact O-N 3.5Å; V1399-A1402 PolarHBondContact O-N 3.46Å; V1399-A1402 VanDerWaalsContact O-N 3.16Å
1403	V	35.6	Very low	42.5	Very low	13 Å²	13	60.5 Å²	60.5	8%	0.079	39%	0.388	C	S	.	.	H	α-helix	trans	-92.2	-10.8	-173.2	179.1	0	0	0	0	112.9	V1399 F1407 Y1412	V1399-V1403 HydrophobicContact CG1-CG2 4.19Å; V1399-V1403 WeakPolarHBondContact O-CB 3.4Å; V1399-V1403 WeakPolarHBondContact O-CG2 3.37Å; V1399-V1403 PolarHBondContact O-N 3.18Å; V1403-F1407 HydrophobicContact CG1-CD2 3.74Å; V1403-F1407 HydrophobicContact CG1-CE2 4.47Å; V1403-Y1412 HydrophobicContact CG1-CD2 4.22Å; V1403-Y1412 HydrophobicContact CG2-CD2 3.86Å; V1403-Y1412 HydrophobicContact CG2-CE2 3.57Å
1404	G	37.4	Very low	43.7	Very low	44 Å²	44	60 Å²	60	45%	0.454	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	62	161.7	0	0	0	0	0	115.2	A1406	G1404-A1406 PolarHBondContact O-N 3.17Å
1405	S	35.6	Very low	44.9	Very low	122 Å²	122	58.1 Å²	58.1	85%	0.853	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	16.8	169	73.1	0	0	0	0	117.2
1406	A	40.1	Very low	46.2	Very low	56 Å²	56	53.9 Å²	53.9	46%	0.463	34%	0.342	S	S	.	.	S	Bend	trans	-90.8	-16	-178.6	0	0	0	0	0	113.7	G1404	G1404-A1406 PolarHBondContact O-N 3.17Å
1407	F	39.8	Very low	47.5	Very low	77 Å²	77	58.4 Å²	58.4	34%	0.338	36%	0.362	S	S	.	.	S	Bend	trans	-145.4	141.4	-175.3	-60.5	-89	0	0	0	110.8	V1403 K1415 M1547	V1403-F1407 HydrophobicContact CG1-CD2 3.74Å; V1403-F1407 HydrophobicContact CG1-CE2 4.47Å; F1407-K1415 HydrophobicContact CE1-CD 4.43Å; F1407-K1415 HydrophobicContact CE2-CD 4.35Å; F1407-K1415 HydrophobicContact CZ-CD 4.1Å; F1407-M1547 WeakPolarHBondContact CE2-O 3.1Å
1408	S	47.1	Very low	48.7	Very low	36 Å²	36	60.2 Å²	60.2	25%	0.252	36%	0.358	S	S	.	.			trans	-67.6	165.8	162.1	67.1	0	0	0	0	110.6	K1410 G1411 Y1412	S1408-K1410 PolarHBondContact O-N 3.37Å; S1408-G1411 PolarHBondContact O-N 2.86Å; S1408-G1411 PolarHBondContact OG-N 3.34Å; S1408-G1411 VanDerWaalsContact OG-N 3.17Å; S1408-Y1412 PolarHBondContact O-N 2.72Å
1409	I	50.8	Low	50.2	Low	60 Å²	60	50.6 Å²	50.6	31%	0.308	32%	0.322	S	S	.	.	H	α-helix	trans	-55.2	-38.9	177.7	-59.8	175.3	0	0	0	110.7	F1396 Y1412 M1413	F1396-I1409 HydrophobicContact CD1-CG2 4.11Å; F1396-I1409 HydrophobicContact CE1-CG2 4.19Å; I1409-Y1412 PolarHBondContact O-N 3.36Å; I1409-M1413 HydrophobicContact CG2-CE 4.28Å; I1409-M1413 WeakPolarHBondContact O-CG 3.46Å; I1409-M1413 PolarHBondContact O-N 3.38Å
1410	K	51.9	Low	51.6	Low	69 Å²	69	52 Å²	52	30%	0.3	33%	0.326	S	S	.	.	H	α-helix	trans	-64.4	-51.5	173.1	-179.3	175.9	178.8	-178.2	0	112	S1408 Y1412 M1413 D1414 I1599 N1600	S1408-K1410 PolarHBondContact O-N 3.37Å; K1410-Y1412 PolarHBondContact O-N 2.86Å; K1410-Y1412 VanDerWaalsContact O-N 3.15Å; K1410-M1413 PolarHBondContact O-N 3.49Å; K1410-D1414 WeakPolarHBondContact CE-OD2 3.48Å; K1410-D1414 WeakPolarHBondContact CG-OD2 3.44Å; K1410-D1414 WeakPolarHBondContact O-CB 3.31Å; K1410-D1414 VanDerWaalsContact O-CG 3.25Å; K1410-D1414 PolarHBondContact O-N 3.12Å; K1410-I1599 HydrophobicContact CB-CG2 4.36Å; K1410-I1599 WeakPolarHBondContact CB-O 3.44Å; K1410-I1599 HydrophobicContact CD-CG2 4.21Å; K1410-I1599 WeakPolarHBondContact CD-O 3.32Å; K1410-I1599 HydrophobicContact CG-CG2 4.29Å; K1410-N1600 PolarHBondContact NZ-OD1 2.86Å
1411	G	56.4	Low	53	Low	21 Å²	21	52.4 Å²	52.4	22%	0.216	32%	0.319	C	S	.	.	H	α-helix	trans	-58.8	-29	179	0	0	0	0	0	113.4	S1408 K1415	S1408-G1411 PolarHBondContact O-N 2.86Å; S1408-G1411 PolarHBondContact OG-N 3.34Å; S1408-G1411 VanDerWaalsContact OG-N 3.17Å; G1411-K1415 WeakPolarHBondContact O-CB 3.36Å; G1411-K1415 PolarHBondContact O-N 3.33Å; G1411-K1415 VanDerWaalsContact O-N 3.09Å
1412	Y	58.9	Low	54.4	Low	9 Å²	9	49 Å²	49	4%	0.035	29%	0.289	C	S	.	.	H	α-helix	trans	-75.7	-45.9	171.4	-179.2	-96	0	0	0	113.2	V1399 V1403 S1408 I1409 K1410 D1414 K1415 V1416 D1554	V1399-Y1412 HydrophobicContact CB-CE1 4.21Å; V1399-Y1412 HydrophobicContact CG1-CD1 3.43Å; V1399-Y1412 VanDerWaalsContact CG1-CD1 3.43Å; V1399-Y1412 HydrophobicContact CG1-CD2 3.92Å; V1399-Y1412 HydrophobicContact CG1-CE1 3.29Å; V1399-Y1412 HydrophobicContact CG1-CE2 3.81Å; V1399-Y1412 HydrophobicContact CG1-CG 3.7Å; V1399-Y1412 VanDerWaalsContact CG1-CZ 3.46Å; V1399-Y1412 HydrophobicContact CG2-CE1 3.84Å; V1403-Y1412 HydrophobicContact CG1-CD2 4.22Å; V1403-Y1412 HydrophobicContact CG2-CD2 3.86Å; V1403-Y1412 HydrophobicContact CG2-CE2 3.57Å; S1408-Y1412 PolarHBondContact O-N 2.72Å; I1409-Y1412 PolarHBondContact O-N 3.36Å; K1410-Y1412 PolarHBondContact O-N 2.86Å; K1410-Y1412 VanDerWaalsContact O-N 3.15Å; Y1412-D1414 VanDerWaalsContact C-N 3.29Å; Y1412-D1414 PolarHBondContact O-N 3.39Å; Y1412-K1415 PolarHBondContact O-N 2.95Å; Y1412-K1415 VanDerWaalsContact O-N 3.17Å; Y1412-V1416 HydrophobicContact CD1-CG2 3.89Å; Y1412-V1416 HydrophobicContact CD2-CG2 4.43Å; Y1412-V1416 HydrophobicContact CE1-CG2 3.39Å; Y1412-V1416 HydrophobicContact CE2-CG2 3.99Å; Y1412-V1416 HydrophobicContact CG-CG2 4.41Å; Y1412-V1416 VanDerWaalsContact CZ-CG2 3.48Å; Y1412-V1416 WeakPolarHBondContact O-CG2 3.34Å; Y1412-V1416 PolarHBondContact O-N 3.46Å; Y1412-D1554 WeakPolarHBondContact OH-CB 3.3Å; Y1412-D1554 PolarHBondContact OH-OD1 2.75Å; Y1412-D1554 PolarHBondContact OH-OD2 3.18Å
1413	M	57.3	Low	55.9	Low	23 Å²	23	46.4 Å²	46.4	11%	0.113	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-40.2	174.6	-72	-172.4	-57.4	0	0	111.8	F1396 I1409 K1410 V1416 K1417 V1558 I1599	F1396-M1413 HydrophobicContact CE1-CG 3.97Å; F1396-M1413 HydrophobicContact CE1-SD 4.33Å; F1396-M1413 HydrophobicContact CZ-CG 4.15Å; F1396-M1413 HydrophobicContact CZ-SD 3.99Å; I1409-M1413 HydrophobicContact CG2-CE 4.28Å; I1409-M1413 WeakPolarHBondContact O-CG 3.46Å; I1409-M1413 PolarHBondContact O-N 3.38Å; K1410-M1413 PolarHBondContact O-N 3.49Å; M1413-V1416 PolarHBondContact O-N 2.93Å; M1413-K1417 WeakPolarHBondContact O-CB 3.4Å; M1413-K1417 PolarHBondContact O-N 3.05Å; M1413-V1558 HydrophobicContact CG-CG2 4.18Å; M1413-I1599 HydrophobicContact CE-CG1 4.28Å; M1413-I1599 HydrophobicContact CE-CG2 3.96Å
1414	D	64.6	Low	57.3	Low	83 Å²	83	50.6 Å²	50.6	44%	0.444	29%	0.286	S	S	.	.	H	α-helix	trans	-60.6	-46.8	173.8	-67.9	-18.4	0	0	0	109.7	K1410 Y1412 K1417 E1418	K1410-D1414 WeakPolarHBondContact CE-OD2 3.48Å; K1410-D1414 WeakPolarHBondContact CG-OD2 3.44Å; K1410-D1414 WeakPolarHBondContact O-CB 3.31Å; K1410-D1414 VanDerWaalsContact O-CG 3.25Å; K1410-D1414 PolarHBondContact O-N 3.12Å; Y1412-D1414 VanDerWaalsContact C-N 3.29Å; Y1412-D1414 PolarHBondContact O-N 3.39Å; D1414-K1417 PolarHBondContact O-N 3.14Å; D1414-E1418 WeakPolarHBondContact O-CB 3.26Å; D1414-E1418 PolarHBondContact O-N 3.23Å
1415	K	63.7	Low	58.4	Low	7 Å²	7	53 Å²	53	3%	0.03	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-42.1	174.7	-171.6	-176.3	-173.5	179.9	0	113.5	F1407 G1411 Y1412 K1417 E1418 V1419 N1439 M1547 G1548 V1550	F1407-K1415 HydrophobicContact CE1-CD 4.43Å; F1407-K1415 HydrophobicContact CE2-CD 4.35Å; F1407-K1415 HydrophobicContact CZ-CD 4.1Å; G1411-K1415 WeakPolarHBondContact O-CB 3.36Å; G1411-K1415 PolarHBondContact O-N 3.33Å; G1411-K1415 VanDerWaalsContact O-N 3.09Å; Y1412-K1415 PolarHBondContact O-N 2.95Å; Y1412-K1415 VanDerWaalsContact O-N 3.17Å; K1415-K1417 VanDerWaalsContact C-N 3.28Å; K1415-K1417 PolarHBondContact O-N 3.11Å; K1415-E1418 PolarHBondContact O-N 3.32Å; K1415-V1419 HydrophobicContact CG-CG2 4.42Å; K1415-V1419 WeakPolarHBondContact O-CG2 3.36Å; K1415-V1419 PolarHBondContact O-N 2.9Å; K1415-N1439 PolarHBondContact NZ-OD1 3.26Å; K1415-M1547 PolarHBondContact NZ-O 3.45Å; K1415-G1548 PolarHBondContact NZ-O 2.93Å; K1415-V1550 HydrophobicContact CD-CG2 4.28Å; K1415-V1550 HydrophobicContact CG-CG2 4.13Å
1416	V	69.1	Low	59.7	Low	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.2	-35.3	177.2	169.9	0	0	0	0	110.9	Y1412 M1413 R1420 V1550 D1554 V1555 V1558	Y1412-V1416 HydrophobicContact CD1-CG2 3.89Å; Y1412-V1416 HydrophobicContact CD2-CG2 4.43Å; Y1412-V1416 HydrophobicContact CE1-CG2 3.39Å; Y1412-V1416 HydrophobicContact CE2-CG2 3.99Å; Y1412-V1416 HydrophobicContact CG-CG2 4.41Å; Y1412-V1416 VanDerWaalsContact CZ-CG2 3.48Å; Y1412-V1416 WeakPolarHBondContact O-CG2 3.34Å; Y1412-V1416 PolarHBondContact O-N 3.46Å; M1413-V1416 PolarHBondContact O-N 2.93Å; V1416-R1420 VanDerWaalsContact O-CB 3.22Å; V1416-R1420 WeakPolarHBondContact O-CB 3.25Å; V1416-R1420 PolarHBondContact O-N 2.61Å; V1416-V1550 HydrophobicContact CB-CG1 4.43Å; V1416-V1550 HydrophobicContact CG1-CG1 4.39Å; V1416-V1550 HydrophobicContact CG2-CG1 4.06Å; V1416-V1550 HydrophobicContact CG2-CG2 4.03Å; V1416-D1554 HydrophobicContact CG2-CB 4.14Å; V1416-V1555 HydrophobicContact CG1-CB 4.44Å; V1416-V1555 HydrophobicContact CG1-CG2 3.86Å; V1416-V1558 HydrophobicContact CB-CG2 4.17Å; V1416-V1558 HydrophobicContact CG1-CB 4.24Å; V1416-V1558 HydrophobicContact CG1-CG2 3.76Å
1417	K	66.7	Low	60.5	Low	115 Å²	115	54.5 Å²	54.5	50%	0.5	26%	0.262	S	S	.	.	H	α-helix	trans	-69.9	-47.9	171.9	-170.3	-171.2	173.3	-163	0	111.3	M1413 D1414 K1415 V1419 R1420 D1421	M1413-K1417 WeakPolarHBondContact O-CB 3.4Å; M1413-K1417 PolarHBondContact O-N 3.05Å; D1414-K1417 PolarHBondContact O-N 3.14Å; K1415-K1417 VanDerWaalsContact C-N 3.28Å; K1415-K1417 PolarHBondContact O-N 3.11Å; K1417-V1419 PolarHBondContact O-N 3.11Å; K1417-R1420 CarbonylContact O-C 2.84Å; K1417-R1420 WeakPolarHBondContact O-CB 3.47Å; K1417-R1420 PolarHBondContact O-N 2.83Å; K1417-R1420 VanDerWaalsContact O-N 3.09Å; K1417-D1421 VanDerWaalsContact CE-OD2 3.25Å; K1417-D1421 WeakPolarHBondContact CE-OD2 3.44Å; K1417-D1421 IonicContact NZ-OD2 3.35Å; K1417-D1421 WeakPolarHBondContact O-CB 3.32Å; K1417-D1421 VanDerWaalsContact O-CG 3.24Å; K1417-D1421 PolarHBondContact O-N 3.07Å
1418	E	66.5	Low	61.4	Low	84 Å²	84	57.7 Å²	57.7	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-59.9	-45.7	-178.5	-172.4	162.5	-144.9	0	0	112.1	D1414 K1415 R1420 D1421 I1422 E1448	D1414-E1418 WeakPolarHBondContact O-CB 3.26Å; D1414-E1418 PolarHBondContact O-N 3.23Å; K1415-E1418 PolarHBondContact O-N 3.32Å; E1418-R1420 VanDerWaalsContact C-N 3.32Å; E1418-R1420 PolarHBondContact O-N 3.26Å; E1418-D1421 PolarHBondContact O-N 3.04Å; E1418-I1422 HydrophobicContact CG-CD1 4.3Å; E1418-I1422 WeakPolarHBondContact O-CB 3.36Å; E1418-I1422 WeakPolarHBondContact O-CD1 3.28Å; E1418-I1422 WeakPolarHBondContact O-CG1 3.47Å; E1418-I1422 PolarHBondContact O-N 3.07Å; E1418-E1448 VanDerWaalsContact CD-CD 3.42Å; E1418-E1448 VanDerWaalsContact CD-OE2 3.28Å
1419	V	67.4	Low	62.4	Low	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-33.7	174.9	176	0	0	0	0	112.1	K1415 K1417 N1423 L1431 I1434 V1550	K1415-V1419 HydrophobicContact CG-CG2 4.42Å; K1415-V1419 WeakPolarHBondContact O-CG2 3.36Å; K1415-V1419 PolarHBondContact O-N 2.9Å; K1417-V1419 PolarHBondContact O-N 3.11Å; V1419-N1423 WeakPolarHBondContact O-CB 3.38Å; V1419-N1423 PolarHBondContact O-N 3.02Å; V1419-L1431 HydrophobicContact CG1-CD2 3.86Å; V1419-I1434 HydrophobicContact CG1-CB 4.5Å; V1419-I1434 HydrophobicContact CG1-CG2 4.14Å; V1419-V1550 HydrophobicContact CB-CB 4.26Å; V1419-V1550 HydrophobicContact CB-CG1 4.29Å; V1419-V1550 HydrophobicContact CB-CG2 4.4Å; V1419-V1550 HydrophobicContact CG1-CB 4.14Å; V1419-V1550 HydrophobicContact CG1-CG1 4.22Å; V1419-V1550 HydrophobicContact CG2-CB 4.34Å; V1419-V1550 HydrophobicContact CG2-CG2 4.12Å
1420	R	68.5	Low	63.3	Low	44 Å²	44	56.7 Å²	56.7	17%	0.166	28%	0.279	C	S	.	.	H	α-helix	trans	-69.2	-48.4	174.7	177	-150.6	-55.6	-150.1	-8.8	112	V1416 K1417 E1418 I1422 N1423 D1424 V1555 N1559	V1416-R1420 VanDerWaalsContact O-CB 3.22Å; V1416-R1420 WeakPolarHBondContact O-CB 3.25Å; V1416-R1420 PolarHBondContact O-N 2.61Å; K1417-R1420 CarbonylContact O-C 2.84Å; K1417-R1420 WeakPolarHBondContact O-CB 3.47Å; K1417-R1420 PolarHBondContact O-N 2.83Å; K1417-R1420 VanDerWaalsContact O-N 3.09Å; E1418-R1420 VanDerWaalsContact C-N 3.32Å; E1418-R1420 PolarHBondContact O-N 3.26Å; R1420-I1422 PolarHBondContact O-N 3.24Å; R1420-N1423 CarbonylContact O-C 3.59Å; R1420-N1423 WeakPolarHBondContact O-CA 3.43Å; R1420-N1423 WeakPolarHBondContact O-CB 3.27Å; R1420-N1423 PolarHBondContact O-N 3.24Å; R1420-D1424 PolarHBondContact O-N 2.67Å; R1420-V1555 HydrophobicContact CB-CG2 4.27Å; R1420-V1555 HydrophobicContact CG-CG1 4.42Å; R1420-V1555 PolarHBondContact NH2-O 3.33Å; R1420-N1559 PolarHBondContact NH1-OD1 2.87Å; R1420-N1559 PolarHBondContact NH2-OD1 2.78Å
1421	D	67	Low	64.1	Low	74 Å²	74	53.9 Å²	53.9	40%	0.396	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-28.7	177.4	-66	0.5	0	0	0	110.5	K1417 E1418	K1417-D1421 VanDerWaalsContact CE-OD2 3.25Å; K1417-D1421 WeakPolarHBondContact CE-OD2 3.44Å; K1417-D1421 IonicContact NZ-OD2 3.35Å; K1417-D1421 WeakPolarHBondContact O-CB 3.32Å; K1417-D1421 VanDerWaalsContact O-CG 3.24Å; K1417-D1421 PolarHBondContact O-N 3.07Å; E1418-D1421 PolarHBondContact O-N 3.04Å
1422	I	64.3	Low	65	Low	13 Å²	13	54.8 Å²	54.8	7%	0.067	27%	0.272	C	S	.	.	H	α-helix	trans	-75.5	-39.5	169.3	-67.4	164.7	0	0	0	112	E1418 R1420 D1424 I1425 F1426 I1434 I1438 E1448 T1452	E1418-I1422 HydrophobicContact CG-CD1 4.3Å; E1418-I1422 WeakPolarHBondContact O-CB 3.36Å; E1418-I1422 WeakPolarHBondContact O-CD1 3.28Å; E1418-I1422 WeakPolarHBondContact O-CG1 3.47Å; E1418-I1422 PolarHBondContact O-N 3.07Å; R1420-I1422 PolarHBondContact O-N 3.24Å; I1422-D1424 PolarHBondContact O-N 2.88Å; I1422-I1425 WeakPolarHBondContact O-CB 3.35Å; I1422-I1425 PolarHBondContact O-N 3.16Å; I1422-F1426 HydrophobicContact CG2-CD2 3.67Å; I1422-F1426 HydrophobicContact CG2-CE2 3.66Å; I1422-F1426 VanDerWaalsContact O-CD2 3.24Å; I1422-F1426 WeakPolarHBondContact O-CD2 3.38Å; I1422-F1426 PolarHBondContact O-N 3.19Å; I1422-I1434 HydrophobicContact CB-CG2 4.38Å; I1422-I1434 HydrophobicContact CG2-CG2 3.63Å; I1422-I1438 HydrophobicContact CD1-CD1 3.71Å; I1422-E1448 HydrophobicContact CD1-CG 4.31Å; I1422-T1452 WeakPolarHBondContact CD1-OG1 3.27Å; I1422-T1452 HydrophobicContact CG1-CG2 4.18Å; I1422-T1452 HydrophobicContact CG2-CG2 4.22Å
1423	N	66.4	Low	65.7	Low	24 Å²	24	58.2 Å²	58.2	13%	0.128	29%	0.289	C	S	.	.	H	α-helix	trans	-64.7	-35.8	177.5	-166.5	96.6	0	0	0	113	V1419 R1420 I1425 F1426 R1427 L1429 L1431 I1434	V1419-N1423 WeakPolarHBondContact O-CB 3.38Å; V1419-N1423 PolarHBondContact O-N 3.02Å; R1420-N1423 CarbonylContact O-C 3.59Å; R1420-N1423 WeakPolarHBondContact O-CA 3.43Å; R1420-N1423 WeakPolarHBondContact O-CB 3.27Å; R1420-N1423 PolarHBondContact O-N 3.24Å; N1423-I1425 PolarHBondContact O-N 3.08Å; N1423-F1426 CarbonylContact O-C 3.46Å; N1423-F1426 WeakPolarHBondContact O-CA 3.2Å; N1423-F1426 PolarHBondContact O-N 2.97Å; N1423-R1427 PolarHBondContact O-N 2.7Å; N1423-L1429 PolarHBondContact OD1-O 2.89Å; N1423-L1429 VanDerWaalsContact OD1-O 3.1Å; N1423-L1431 HydrophobicContact CB-CD2 3.5Å; N1423-L1431 VanDerWaalsContact CB-CD2 3.5Å; N1423-L1431 HydrophobicContact CB-CG 4.26Å; N1423-L1431 WeakPolarHBondContact OD1-CG 3.38Å; N1423-L1431 PolarHBondContact OD1-N 3.43Å; N1423-I1434 HydrophobicContact CB-CD1 4.03Å; N1423-I1434 WeakPolarHBondContact OD1-CD1 3.39Å
1424	D	63.2	Low	66.5	Low	102 Å²	102	57.2 Å²	57.2	55%	0.545	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.8	176.2	-73.4	-22.4	0	0	0	112.9	R1420 I1422	R1420-D1424 PolarHBondContact O-N 2.67Å; I1422-D1424 PolarHBondContact O-N 2.88Å
1425	I	61.8	Low	67.1	Low	94 Å²	94	53.3 Å²	53.3	48%	0.482	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-36.1	169.7	-58.6	171.1	0	0	0	111.1	I1422 N1423	I1422-I1425 WeakPolarHBondContact O-CB 3.35Å; I1422-I1425 PolarHBondContact O-N 3.16Å; N1423-I1425 PolarHBondContact O-N 3.08Å
1426	F	62.9	Low	68	Low	5 Å²	5	54.5 Å²	54.5	2%	0.022	27%	0.27	C	S	.	.	S	Bend	trans	-109.2	55.6	-177.6	-60.4	-65.8	0	0	0	111.7	I1422 N1423 D1428 L1429 I1434 T1452 L1455 K1456 Q1459	I1422-F1426 HydrophobicContact CG2-CD2 3.67Å; I1422-F1426 HydrophobicContact CG2-CE2 3.66Å; I1422-F1426 VanDerWaalsContact O-CD2 3.24Å; I1422-F1426 WeakPolarHBondContact O-CD2 3.38Å; I1422-F1426 PolarHBondContact O-N 3.19Å; N1423-F1426 CarbonylContact O-C 3.46Å; N1423-F1426 WeakPolarHBondContact O-CA 3.2Å; N1423-F1426 PolarHBondContact O-N 2.97Å; F1426-D1428 PolarHBondContact O-N 3Å; F1426-L1429 HydrophobicContact CB-CB 4.18Å; F1426-L1429 HydrophobicContact CB-CD1 3.8Å; F1426-L1429 HydrophobicContact CB-CG 3.97Å; F1426-L1429 HydrophobicContact CD1-CD1 4.31Å; F1426-L1429 HydrophobicContact CG-CD1 4.04Å; F1426-L1429 PolarHBondContact O-N 3.11Å; F1426-I1434 HydrophobicContact CB-CD1 4.33Å; F1426-I1434 HydrophobicContact CD2-CD1 4.47Å; F1426-T1452 HydrophobicContact CE2-CG2 4.32Å; F1426-L1455 HydrophobicContact CE1-CB 3.85Å; F1426-L1455 HydrophobicContact CE2-CB 3.81Å; F1426-L1455 HydrophobicContact CE2-CD1 4.25Å; F1426-L1455 HydrophobicContact CZ-CB 3.26Å; F1426-K1456 HydrophobicContact CE1-CB 4.45Å; F1426-K1456 HydrophobicContact CE1-CG 3.92Å; F1426-K1456 HydrophobicContact CZ-CB 4.34Å; F1426-K1456 HydrophobicContact CZ-CG 3.63Å; F1426-Q1459 VanDerWaalsContact CD1-OE1 3.28Å
1427	R	56	Low	68.7	Low	205 Å²	205	55.2 Å²	55.2	77%	0.774	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	-28.5	-165.1	-74.2	-174.5	162.9	-158.7	-7.8	117.1	N1423	N1423-R1427 PolarHBondContact O-N 2.7Å
1428	D	59.9	Low	69.5	Low	144 Å²	144	49.8 Å²	49.8	77%	0.77	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-1.7	-174.7	-44.3	-67.3	0	0	0	113.9	F1426	F1426-D1428 PolarHBondContact O-N 3Å
1429	L	66.8	Low	70.2	Confident	8 Å²	8	45.8 Å²	45.8	4%	0.042	23%	0.231	C	C	.	.	S	Bend	trans	-90.2	145.3	177.7	-65.7	-170.8	0	0	0	112.5	N1423 F1426 L1431 I1434 D1489 P1491	N1423-L1429 PolarHBondContact OD1-O 2.89Å; N1423-L1429 VanDerWaalsContact OD1-O 3.1Å; F1426-L1429 HydrophobicContact CB-CB 4.18Å; F1426-L1429 HydrophobicContact CB-CD1 3.8Å; F1426-L1429 HydrophobicContact CB-CG 3.97Å; F1426-L1429 HydrophobicContact CD1-CD1 4.31Å; F1426-L1429 HydrophobicContact CG-CD1 4.04Å; F1426-L1429 PolarHBondContact O-N 3.11Å; L1429-L1431 PolarHBondContact O-N 3.17Å; L1429-I1434 HydrophobicContact CB-CD1 3.91Å; L1429-I1434 HydrophobicContact CB-CG1 4.18Å; L1429-I1434 HydrophobicContact CD1-CG1 4.21Å; L1429-D1489 HydrophobicContact CD2-CB 3.7Å; L1429-P1491 HydrophobicContact CD1-CG 4.22Å; L1429-P1491 HydrophobicContact CD2-CG 4Å
1430	P	69.6	Low	71	Confident	67 Å²	67	46.7 Å²	46.7	44%	0.435	24%	0.235	S	C	.	.			trans	-70.7	125.9	169.8	-18.5	31.7	0	0	0	113.1	A1432 Q1433 I1434	P1430-A1432 PolarHBondContact O-N 3.39Å; P1430-Q1433 HydrophobicContact CB-CG 4.33Å; P1430-Q1433 HydrophobicContact CG-CG 4.41Å; P1430-Q1433 WeakPolarHBondContact O-CB 3.42Å; P1430-Q1433 PolarHBondContact O-N 2.97Å; P1430-I1434 PolarHBondContact O-N 3.27Å
1431	L	68.3	Low	71.7	Confident	9 Å²	9	44.6 Å²	44.6	5%	0.047	23%	0.227	C	C	.	.	H	α-helix	trans	-38.4	-44.5	171.1	-78.9	165.9	0	0	0	114.3	V1419 N1423 L1429 Q1433 I1434 S1435 Q1552 V1555	V1419-L1431 HydrophobicContact CG1-CD2 3.86Å; N1423-L1431 HydrophobicContact CB-CD2 3.5Å; N1423-L1431 VanDerWaalsContact CB-CD2 3.5Å; N1423-L1431 HydrophobicContact CB-CG 4.26Å; N1423-L1431 WeakPolarHBondContact OD1-CG 3.38Å; N1423-L1431 PolarHBondContact OD1-N 3.43Å; L1429-L1431 PolarHBondContact O-N 3.17Å; L1431-Q1433 PolarHBondContact O-N 3.08Å; L1431-I1434 PolarHBondContact O-N 2.98Å; L1431-S1435 PolarHBondContact O-N 2.81Å; L1431-Q1552 HydrophobicContact CD1-CB 4.12Å; L1431-Q1552 VanDerWaalsContact CD1-OE1 3.25Å; L1431-V1555 HydrophobicContact CD1-CB 4.36Å; L1431-V1555 HydrophobicContact CD1-CG2 3.75Å; L1431-V1555 HydrophobicContact CD2-CG2 4.3Å
1432	A	75.2	Confident	72.1	Confident	40 Å²	40	44.4 Å²	44.4	33%	0.331	22%	0.222	S	C	.	.	H	α-helix	trans	-65.6	-35.7	-177.9	0	0	0	0	0	112.9	P1430 D1436 I1549 V1550	P1430-A1432 PolarHBondContact O-N 3.39Å; A1432-D1436 WeakPolarHBondContact O-CB 3.41Å; A1432-D1436 PolarHBondContact O-N 3.27Å; A1432-I1549 HydrophobicContact CB-CG2 3.9Å; A1432-I1549 WeakPolarHBondContact O-CG2 3.25Å; A1432-V1550 WeakPolarHBondContact CA-O 3.45Å; A1432-V1550 PolarHBondContact N-O 2.73Å
1433	Q	73.6	Confident	72.7	Confident	82 Å²	82	46.6 Å²	46.6	38%	0.383	23%	0.234	S	C	.	.	H	α-helix	trans	-71.1	-40.4	174.7	-69.5	-176.8	-13.5	0	0	111.3	P1430 L1431 D1436 F1437	P1430-Q1433 HydrophobicContact CB-CG 4.33Å; P1430-Q1433 HydrophobicContact CG-CG 4.41Å; P1430-Q1433 WeakPolarHBondContact O-CB 3.42Å; P1430-Q1433 PolarHBondContact O-N 2.97Å; L1431-Q1433 PolarHBondContact O-N 3.08Å; Q1433-D1436 PolarHBondContact O-N 3.37Å; Q1433-F1437 WeakPolarHBondContact O-CB 3.33Å; Q1433-F1437 PolarHBondContact O-N 3.06Å
1434	I	75.5	Confident	73.2	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-52.5	174.7	-66.7	163.3	0	0	0	109.9	V1419 I1422 N1423 F1426 L1429 P1430 L1431 D1436 F1437 I1438	V1419-I1434 HydrophobicContact CG1-CB 4.5Å; V1419-I1434 HydrophobicContact CG1-CG2 4.14Å; I1422-I1434 HydrophobicContact CB-CG2 4.38Å; I1422-I1434 HydrophobicContact CG2-CG2 3.63Å; N1423-I1434 HydrophobicContact CB-CD1 4.03Å; N1423-I1434 WeakPolarHBondContact OD1-CD1 3.39Å; F1426-I1434 HydrophobicContact CB-CD1 4.33Å; F1426-I1434 HydrophobicContact CD2-CD1 4.47Å; L1429-I1434 HydrophobicContact CB-CD1 3.91Å; L1429-I1434 HydrophobicContact CB-CG1 4.18Å; L1429-I1434 HydrophobicContact CD1-CG1 4.21Å; P1430-I1434 PolarHBondContact O-N 3.27Å; L1431-I1434 PolarHBondContact O-N 2.98Å; I1434-D1436 PolarHBondContact O-N 2.76Å; I1434-F1437 PolarHBondContact O-N 3.48Å; I1434-I1438 HydrophobicContact CG2-CD1 3.67Å; I1434-I1438 VanDerWaalsContact O-CG1 3.31Å; I1434-I1438 WeakPolarHBondContact O-CG1 3.38Å; I1434-I1438 PolarHBondContact O-N 2.87Å
1435	S	77.3	Confident	73.9	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-38.1	179.6	-177.7	0	0	0	0	112.9	L1431 N1439 V1550	L1431-S1435 PolarHBondContact O-N 2.81Å; S1435-N1439 VanDerWaalsContact O-CB 3.27Å; S1435-N1439 WeakPolarHBondContact O-CB 3.15Å; S1435-N1439 PolarHBondContact O-N 2.99Å; S1435-N1439 PolarHBondContact O-ND2 3.19Å; S1435-V1550 PolarHBondContact OG-N 2.99Å
1436	D	82.8	Confident	74.6	Confident	32 Å²	32	41 Å²	41	17%	0.171	22%	0.223	C	C	.	.	H	α-helix	trans	-68.6	-40.5	177.3	-175.8	39.4	0	0	0	111.3	A1432 Q1433 I1434 N1439 K1440 S1544 I1549	A1432-D1436 WeakPolarHBondContact O-CB 3.41Å; A1432-D1436 PolarHBondContact O-N 3.27Å; Q1433-D1436 PolarHBondContact O-N 3.37Å; I1434-D1436 PolarHBondContact O-N 2.76Å; D1436-N1439 PolarHBondContact O-N 2.94Å; D1436-K1440 VanDerWaalsContact O-CG 3.27Å; D1436-K1440 WeakPolarHBondContact O-CG 3.42Å; D1436-K1440 PolarHBondContact O-N 3.21Å; D1436-K1440 WeakPolarHBondContact OD1-CE 3.31Å; D1436-K1440 IonicContact OD1-NZ 2.8Å; D1436-K1440 WeakPolarHBondContact OD2-CE 3.26Å; D1436-K1440 IonicContact OD2-NZ 2.89Å; D1436-K1440 PolarHBondContact OD2-NZ 3.45Å; D1436-S1544 PolarHBondContact O-OG 3.47Å; D1436-S1544 VanDerWaalsContact OD1-CB 3.26Å; D1436-S1544 WeakPolarHBondContact OD1-CB 3.4Å; D1436-S1544 PolarHBondContact OD1-OG 2.89Å; D1436-I1549 HydrophobicContact CB-CD1 4Å; D1436-I1549 HydrophobicContact CB-CG1 4.28Å
1437	F	83.5	Confident	75.2	Confident	15 Å²	15	44.1 Å²	44.1	7%	0.066	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-47.2	175.7	-175.3	-101.6	0	0	0	112.2	Q1433 I1434 N1439 K1440 I1441 A1451 F1454 L1455 I1494 L1526 Y1529	Q1433-F1437 WeakPolarHBondContact O-CB 3.33Å; Q1433-F1437 PolarHBondContact O-N 3.06Å; I1434-F1437 PolarHBondContact O-N 3.48Å; F1437-N1439 VanDerWaalsContact C-N 3.34Å; F1437-N1439 PolarHBondContact O-N 3.24Å; F1437-K1440 WeakPolarHBondContact O-CB 3.47Å; F1437-K1440 PolarHBondContact O-N 3.33Å; F1437-K1440 VanDerWaalsContact O-N 3.13Å; F1437-I1441 HydrophobicContact CD1-CG1 4.25Å; F1437-I1441 HydrophobicContact CE1-CD1 4.33Å; F1437-I1441 HydrophobicContact CE1-CG1 3.64Å; F1437-I1441 HydrophobicContact CE2-CD1 4.05Å; F1437-I1441 HydrophobicContact CE2-CG1 4.11Å; F1437-I1441 HydrophobicContact CZ-CD1 3.7Å; F1437-I1441 HydrophobicContact CZ-CG1 3.53Å; F1437-I1441 PolarHBondContact O-N 3.34Å; F1437-A1451 HydrophobicContact CD1-CB 4.2Å; F1437-A1451 HydrophobicContact CE1-CB 3.97Å; F1437-F1454 AromaticContact CE1-CD1 3.82Å; F1437-F1454 HydrophobicContact CE1-CD1 3.82Å; F1437-F1454 HydrophobicContact CE1-CE1 4.49Å; F1437-F1454 HydrophobicContact CE2-CD1 4.42Å; F1437-F1454 HydrophobicContact CE2-CE1 4.31Å; F1437-F1454 AromaticContact CZ-CD1 3.43Å; F1437-F1454 HydrophobicContact CZ-CD1 3.43Å; F1437-F1454 VanDerWaalsContact CZ-CD1 3.43Å; F1437-F1454 AromaticContact CZ-CE1 3.71Å; F1437-F1454 HydrophobicContact CZ-CE1 3.71Å; F1437-L1455 HydrophobicContact CD1-CD1 3.77Å; F1437-L1455 HydrophobicContact CD1-CD2 4.29Å; F1437-L1455 HydrophobicContact CD1-CG 3.93Å; F1437-L1455 HydrophobicContact CE1-CD1 4.4Å; F1437-L1455 HydrophobicContact CE1-CG 4.13Å; F1437-I1494 HydrophobicContact CE2-CG2 4.3Å; F1437-L1526 HydrophobicContact CZ-CD2 4.12Å; F1437-Y1529 HydrophobicContact CE2-CD1 4.35Å; F1437-Y1529 AromaticContact CE2-CE1 3.91Å; F1437-Y1529 HydrophobicContact CE2-CE1 3.91Å; F1437-Y1529 HydrophobicContact CE2-CE2 4.19Å; F1437-Y1529 AromaticContact CE2-CZ 3.82Å
1438	I	82.3	Confident	75.8	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-43.9	177.8	-66.4	163.2	0	0	0	111.2	I1422 I1434 K1440 I1441 K1442 E1448 A1451	I1422-I1438 HydrophobicContact CD1-CD1 3.71Å; I1434-I1438 HydrophobicContact CG2-CD1 3.67Å; I1434-I1438 VanDerWaalsContact O-CG1 3.31Å; I1434-I1438 WeakPolarHBondContact O-CG1 3.38Å; I1434-I1438 PolarHBondContact O-N 2.87Å; I1438-K1440 VanDerWaalsContact C-N 3.3Å; I1438-K1440 PolarHBondContact O-N 2.92Å; I1438-I1441 PolarHBondContact O-N 3.33Å; I1438-K1442 HydrophobicContact CG2-CD 3.97Å; I1438-K1442 HydrophobicContact CG2-CG 4.38Å; I1438-K1442 WeakPolarHBondContact O-CG 3.37Å; I1438-K1442 PolarHBondContact O-N 3.04Å; I1438-E1448 HydrophobicContact CD1-CG 4.5Å; I1438-E1448 HydrophobicContact CG2-CB 4.29Å; I1438-E1448 HydrophobicContact CG2-CG 3.83Å; I1438-E1448 VanDerWaalsContact CG2-OE1 3.26Å; I1438-E1448 WeakPolarHBondContact CG2-OE1 3.34Å; I1438-A1451 HydrophobicContact CG1-CB 4.06Å
1439	N	81.5	Confident	76.4	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-56	-43.7	174.3	-80.1	-12.3	0	0	0	111.6	K1415 S1435 D1436 F1437 L1443 S1544 M1547 G1548	K1415-N1439 PolarHBondContact NZ-OD1 3.26Å; S1435-N1439 VanDerWaalsContact O-CB 3.27Å; S1435-N1439 WeakPolarHBondContact O-CB 3.15Å; S1435-N1439 PolarHBondContact O-N 2.99Å; S1435-N1439 PolarHBondContact O-ND2 3.19Å; D1436-N1439 PolarHBondContact O-N 2.94Å; F1437-N1439 VanDerWaalsContact C-N 3.34Å; F1437-N1439 PolarHBondContact O-N 3.24Å; N1439-L1443 WeakPolarHBondContact O-CB 3.26Å; N1439-L1443 WeakPolarHBondContact O-CD1 3.43Å; N1439-L1443 WeakPolarHBondContact O-CG 3.43Å; N1439-L1443 PolarHBondContact O-N 3.4Å; N1439-S1544 WeakPolarHBondContact CB-OG 3.48Å; N1439-S1544 PolarHBondContact ND2-O 3.23Å; N1439-M1547 HydrophobicContact CB-CE 3.57Å; N1439-M1547 VanDerWaalsContact O-CE 3.23Å; N1439-M1547 WeakPolarHBondContact O-CE 3.48Å; N1439-G1548 PolarHBondContact ND2-O 3.13Å
1440	K	83.6	Confident	76.8	Confident	19 Å²	19	39.1 Å²	39.1	8%	0.083	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-44.7	177.3	-72.4	173	-148.2	-175.9	0	112.7	D1436 F1437 I1438 L1443 L1444 Y1529 M1537 L1540 N1541	D1436-K1440 VanDerWaalsContact O-CG 3.27Å; D1436-K1440 WeakPolarHBondContact O-CG 3.42Å; D1436-K1440 PolarHBondContact O-N 3.21Å; D1436-K1440 WeakPolarHBondContact OD1-CE 3.31Å; D1436-K1440 IonicContact OD1-NZ 2.8Å; D1436-K1440 WeakPolarHBondContact OD2-CE 3.26Å; D1436-K1440 IonicContact OD2-NZ 2.89Å; D1436-K1440 PolarHBondContact OD2-NZ 3.45Å; F1437-K1440 WeakPolarHBondContact O-CB 3.47Å; F1437-K1440 PolarHBondContact O-N 3.33Å; F1437-K1440 VanDerWaalsContact O-N 3.13Å; I1438-K1440 VanDerWaalsContact C-N 3.3Å; I1438-K1440 PolarHBondContact O-N 2.92Å; K1440-L1443 PolarHBondContact O-N 3.05Å; K1440-L1444 WeakPolarHBondContact O-CG 3.47Å; K1440-L1444 PolarHBondContact O-N 3Å; K1440-Y1529 HydrophobicContact CB-CD2 4.44Å; K1440-Y1529 HydrophobicContact CB-CE2 4Å; K1440-Y1529 HydrophobicContact CD-CE2 3.9Å; K1440-M1537 HydrophobicContact CD-SD 4.4Å; K1440-L1540 HydrophobicContact CB-CD2 3.66Å; K1440-L1540 HydrophobicContact CB-CG 4.1Å; K1440-L1540 HydrophobicContact CD-CD2 4.44Å; K1440-L1540 HydrophobicContact CG-CD2 3.88Å; K1440-L1540 HydrophobicContact CG-CG 3.97Å; K1440-N1541 WeakPolarHBondContact CE-OD1 3.5Å; K1440-N1541 PolarHBondContact NZ-OD1 3.24Å
1441	I	84.6	Confident	77.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.5	-42.3	179.5	-61.1	-48.3	0	0	0	111.4	F1437 I1438 L1443 L1444 G1445 G1446 A1451 L1526 Y1529	F1437-I1441 HydrophobicContact CD1-CG1 4.25Å; F1437-I1441 HydrophobicContact CE1-CD1 4.33Å; F1437-I1441 HydrophobicContact CE1-CG1 3.64Å; F1437-I1441 HydrophobicContact CE2-CD1 4.05Å; F1437-I1441 HydrophobicContact CE2-CG1 4.11Å; F1437-I1441 HydrophobicContact CZ-CD1 3.7Å; F1437-I1441 HydrophobicContact CZ-CG1 3.53Å; F1437-I1441 PolarHBondContact O-N 3.34Å; I1438-I1441 PolarHBondContact O-N 3.33Å; I1441-L1443 VanDerWaalsContact C-N 3.3Å; I1441-L1443 PolarHBondContact O-N 2.65Å; I1441-L1444 PolarHBondContact O-N 2.98Å; I1441-G1445 PolarHBondContact O-N 3.4Å; I1441-G1446 WeakPolarHBondContact O-CA 3.36Å; I1441-G1446 PolarHBondContact O-N 2.8Å; I1441-A1451 HydrophobicContact CB-CB 3.92Å; I1441-A1451 HydrophobicContact CG1-CB 3.97Å; I1441-A1451 HydrophobicContact CG2-CB 4.04Å; I1441-L1526 HydrophobicContact CD1-CD2 3.72Å; I1441-L1526 HydrophobicContact CG1-CD2 4.19Å; I1441-Y1529 HydrophobicContact CD1-CD2 3.8Å; I1441-Y1529 HydrophobicContact CD1-CG 3.92Å
1442	K	76	Confident	77.3	Confident	69 Å²	69	36.1 Å²	36.1	30%	0.3	20%	0.204	S	C	.	.	H	α-helix	trans	-54.7	-44.5	171	-75	174.3	173.5	171.9	0	111.8	I1438 L1444 G1445 E1448 M1547	I1438-K1442 HydrophobicContact CG2-CD 3.97Å; I1438-K1442 HydrophobicContact CG2-CG 4.38Å; I1438-K1442 WeakPolarHBondContact O-CG 3.37Å; I1438-K1442 PolarHBondContact O-N 3.04Å; K1442-L1444 PolarHBondContact O-N 2.85Å; K1442-G1445 PolarHBondContact O-N 2.66Å; K1442-G1445 VanDerWaalsContact O-N 3.09Å; K1442-E1448 WeakPolarHBondContact CE-OE2 3.34Å; K1442-E1448 IonicContact NZ-OE1 2.65Å; K1442-E1448 PolarHBondContact NZ-OE1 2.87Å; K1442-E1448 IonicContact NZ-OE2 2.67Å; K1442-E1448 PolarHBondContact NZ-OE2 3.14Å; K1442-M1547 HydrophobicContact CB-CE 4.35Å
1443	L	76.4	Confident	77.3	Confident	59 Å²	59	35.5 Å²	35.5	31%	0.309	20%	0.202	S	C	.	.	H	α-helix	trans	-66.8	-17.3	177.9	-77.9	163.1	0	0	0	115	N1439 K1440 I1441 L1540 K1543 M1547	N1439-L1443 WeakPolarHBondContact O-CB 3.26Å; N1439-L1443 WeakPolarHBondContact O-CD1 3.43Å; N1439-L1443 WeakPolarHBondContact O-CG 3.43Å; N1439-L1443 PolarHBondContact O-N 3.4Å; K1440-L1443 PolarHBondContact O-N 3.05Å; I1441-L1443 VanDerWaalsContact C-N 3.3Å; I1441-L1443 PolarHBondContact O-N 2.65Å; L1443-L1540 HydrophobicContact CB-CD1 3.58Å; L1443-L1540 HydrophobicContact CD1-CD1 4.36Å; L1443-K1543 HydrophobicContact CD1-CB 3.62Å; L1443-K1543 HydrophobicContact CD2-CB 4.14Å; L1443-K1543 HydrophobicContact CD2-CD 4.47Å; L1443-M1547 HydrophobicContact CD1-CE 3.81Å; L1443-M1547 HydrophobicContact CD1-CG 4.48Å; L1443-M1547 HydrophobicContact CD1-SD 4.12Å; L1443-M1547 HydrophobicContact CD2-CE 4.34Å; L1443-M1547 HydrophobicContact CD2-SD 3.78Å; L1443-M1547 HydrophobicContact CG-CE 3.65Å; L1443-M1547 HydrophobicContact CG-SD 3.78Å
1444	L	76.7	Confident	77.5	Confident	26 Å²	26	31.7 Å²	31.7	14%	0.136	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	3.1	173.9	-65.1	174.8	0	0	0	113.5	K1440 I1441 K1442 R1528 Y1529 L1532 L1540	K1440-L1444 WeakPolarHBondContact O-CG 3.47Å; K1440-L1444 PolarHBondContact O-N 3Å; I1441-L1444 PolarHBondContact O-N 2.98Å; K1442-L1444 PolarHBondContact O-N 2.85Å; L1444-R1528 HydrophobicContact CD1-CB 4.41Å; L1444-R1528 PolarHBondContact O-NH1 3.4Å; L1444-Y1529 HydrophobicContact CD1-CD2 3.88Å; L1444-Y1529 HydrophobicContact CD1-CG 4.29Å; L1444-L1532 HydrophobicContact CD1-CD1 4.05Å; L1444-L1532 HydrophobicContact CD2-CD1 4.07Å; L1444-L1532 HydrophobicContact CD2-CD2 4.49Å; L1444-L1540 HydrophobicContact CD1-CD2 3.81Å; L1444-L1540 HydrophobicContact CD2-CD1 3.89Å; L1444-L1540 HydrophobicContact CD2-CD2 4.19Å; L1444-L1540 HydrophobicContact CG-CD1 4.01Å; L1444-L1540 HydrophobicContact CG-CD2 3.92Å
1445	G	77.8	Confident	77.6	Confident	67 Å²	67	31.8 Å²	31.8	69%	0.691	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	85	20.3	-176.8	0	0	0	0	0	114.1	I1441 K1442	I1441-G1445 PolarHBondContact O-N 3.4Å; K1442-G1445 PolarHBondContact O-N 2.66Å; K1442-G1445 VanDerWaalsContact O-N 3.09Å
1446	G	76	Confident	77.5	Confident	11 Å²	11	35.9 Å²	35.9	11%	0.113	20%	0.202	C	C	.	.			trans	-93.7	173.2	172.5	0	0	0	0	0	113.8	I1441 E1450	I1441-G1446 WeakPolarHBondContact O-CA 3.36Å; I1441-G1446 PolarHBondContact O-N 2.8Å; G1446-E1450 WeakPolarHBondContact CA-OE2 3.37Å
1447	T	76	Confident	77.2	Confident	70 Å²	70	38.6 Å²	38.6	43%	0.429	22%	0.217	S	C	.	.			trans	-99.1	165.5	177.2	75.8	0	0	0	0	112.5	E1449 E1450 A1451	T1447-E1449 VanDerWaalsContact C-N 3.31Å; T1447-E1449 PolarHBondContact OG1-N 2.97Å; T1447-E1450 PolarHBondContact N-OE2 3.31Å; T1447-E1450 PolarHBondContact O-N 3.41Å; T1447-E1450 WeakPolarHBondContact OG1-CG 3.42Å; T1447-E1450 PolarHBondContact OG1-N 2.87Å; T1447-A1451 PolarHBondContact O-N 2.81Å; T1447-A1451 VanDerWaalsContact O-N 3.12Å
1448	E	68.8	Low	76.8	Confident	25 Å²	25	38 Å²	38	12%	0.117	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-32.6	172.3	-169.5	143.7	-133	0	0	112.2	E1418 I1422 I1438 K1442 A1451 T1452	E1418-E1448 VanDerWaalsContact CD-CD 3.42Å; E1418-E1448 VanDerWaalsContact CD-OE2 3.28Å; I1422-E1448 HydrophobicContact CD1-CG 4.31Å; I1438-E1448 HydrophobicContact CD1-CG 4.5Å; I1438-E1448 HydrophobicContact CG2-CB 4.29Å; I1438-E1448 HydrophobicContact CG2-CG 3.83Å; I1438-E1448 VanDerWaalsContact CG2-OE1 3.26Å; I1438-E1448 WeakPolarHBondContact CG2-OE1 3.34Å; K1442-E1448 WeakPolarHBondContact CE-OE2 3.34Å; K1442-E1448 IonicContact NZ-OE1 2.65Å; K1442-E1448 PolarHBondContact NZ-OE1 2.87Å; K1442-E1448 IonicContact NZ-OE2 2.67Å; K1442-E1448 PolarHBondContact NZ-OE2 3.14Å; E1448-A1451 PolarHBondContact O-N 3.26Å; E1448-T1452 VanDerWaalsContact O-CB 3.26Å; E1448-T1452 WeakPolarHBondContact O-CB 3.11Å; E1448-T1452 PolarHBondContact O-N 2.91Å; E1448-T1452 PolarHBondContact O-OG1 3.38Å
1449	E	72.9	Confident	76.5	Confident	166 Å²	166	40.2 Å²	40.2	78%	0.776	22%	0.224	S	C	*	.	H	α-helix	trans	-68.3	-39.5	174.5	-167.3	172.1	-155.4	0	0	111.4	T1447 G1453	T1447-E1449 VanDerWaalsContact C-N 3.31Å; T1447-E1449 PolarHBondContact OG1-N 2.97Å; E1449-G1453 PolarHBondContact O-N 3.09Å
1450	E	74.2	Confident	76	Confident	60 Å²	60	43.2 Å²	43.2	28%	0.28	25%	0.245	S	C	.	.	H	α-helix	trans	-60.2	-48.2	169.7	-76	173.9	172.7	0	0	111.6	G1446 T1447 F1454 V1523 S1525	G1446-E1450 WeakPolarHBondContact CA-OE2 3.37Å; T1447-E1450 PolarHBondContact N-OE2 3.31Å; T1447-E1450 PolarHBondContact O-N 3.41Å; T1447-E1450 WeakPolarHBondContact OG1-CG 3.42Å; T1447-E1450 PolarHBondContact OG1-N 2.87Å; E1450-F1454 WeakPolarHBondContact O-CB 2.97Å; E1450-F1454 PolarHBondContact O-N 3.45Å; E1450-V1523 HydrophobicContact CB-CG1 4.17Å; E1450-V1523 HydrophobicContact CG-CG1 3.84Å; E1450-S1525 PolarHBondContact OE2-OG 2.82Å
1451	A	75.5	Confident	75.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.9	-44.3	179.9	0	0	0	0	0	112.2	F1437 I1438 I1441 T1447 E1448 F1454 L1455	F1437-A1451 HydrophobicContact CD1-CB 4.2Å; F1437-A1451 HydrophobicContact CE1-CB 3.97Å; I1438-A1451 HydrophobicContact CG1-CB 4.06Å; I1441-A1451 HydrophobicContact CB-CB 3.92Å; I1441-A1451 HydrophobicContact CG1-CB 3.97Å; I1441-A1451 HydrophobicContact CG2-CB 4.04Å; T1447-A1451 PolarHBondContact O-N 2.81Å; T1447-A1451 VanDerWaalsContact O-N 3.12Å; E1448-A1451 PolarHBondContact O-N 3.26Å; A1451-F1454 PolarHBondContact O-N 3.44Å; A1451-L1455 PolarHBondContact O-N 2.93Å; A1451-L1455 VanDerWaalsContact O-N 3.11Å
1452	T	72.6	Confident	75	Confident	13 Å²	13	43.7 Å²	43.7	8%	0.08	25%	0.252	C	S	.	.	H	α-helix	trans	-70.6	-41.6	-179.6	-56.4	0	0	0	0	111.6	I1422 F1426 E1448 F1454 L1455 K1456	I1422-T1452 WeakPolarHBondContact CD1-OG1 3.27Å; I1422-T1452 HydrophobicContact CG1-CG2 4.18Å; I1422-T1452 HydrophobicContact CG2-CG2 4.22Å; F1426-T1452 HydrophobicContact CE2-CG2 4.32Å; E1448-T1452 VanDerWaalsContact O-CB 3.26Å; E1448-T1452 WeakPolarHBondContact O-CB 3.11Å; E1448-T1452 PolarHBondContact O-N 2.91Å; E1448-T1452 PolarHBondContact O-OG1 3.38Å; T1452-F1454 VanDerWaalsContact C-N 3.31Å; T1452-F1454 PolarHBondContact O-N 2.94Å; T1452-L1455 PolarHBondContact O-N 3.49Å; T1452-K1456 WeakPolarHBondContact O-CG 3.15Å; T1452-K1456 PolarHBondContact O-N 3.26Å
1453	G	76	Confident	74.8	Confident	27 Å²	27	43.5 Å²	43.5	28%	0.278	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-37.7	174.5	0	0	0	0	0	112.3	E1449 K1456 N1457	E1449-G1453 PolarHBondContact O-N 3.09Å; G1453-K1456 PolarHBondContact O-N 3.16Å; G1453-N1457 VanDerWaalsContact O-CG 3.25Å; G1453-N1457 PolarHBondContact O-N 3.23Å; G1453-N1457 PolarHBondContact O-OD1 2.86Å
1454	F	78.7	Confident	74.4	Confident	3 Å²	3	46.2 Å²	46.2	1%	0.013	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-48	175.4	178	-122.5	0	0	0	113.1	F1437 E1450 A1451 T1452 K1456 N1457 M1458 I1494 L1520 L1526 M1530	F1437-F1454 AromaticContact CE1-CD1 3.82Å; F1437-F1454 HydrophobicContact CE1-CD1 3.82Å; F1437-F1454 HydrophobicContact CE1-CE1 4.49Å; F1437-F1454 HydrophobicContact CE2-CD1 4.42Å; F1437-F1454 HydrophobicContact CE2-CE1 4.31Å; F1437-F1454 AromaticContact CZ-CD1 3.43Å; F1437-F1454 HydrophobicContact CZ-CD1 3.43Å; F1437-F1454 VanDerWaalsContact CZ-CD1 3.43Å; F1437-F1454 AromaticContact CZ-CE1 3.71Å; F1437-F1454 HydrophobicContact CZ-CE1 3.71Å; E1450-F1454 WeakPolarHBondContact O-CB 2.97Å; E1450-F1454 PolarHBondContact O-N 3.45Å; A1451-F1454 PolarHBondContact O-N 3.44Å; T1452-F1454 VanDerWaalsContact C-N 3.31Å; T1452-F1454 PolarHBondContact O-N 2.94Å; F1454-K1456 VanDerWaalsContact C-N 3.28Å; F1454-K1456 PolarHBondContact O-N 2.78Å; F1454-N1457 PolarHBondContact O-N 3.45Å; F1454-N1457 VanDerWaalsContact O-N 3.16Å; F1454-M1458 HydrophobicContact CD2-CG 3.8Å; F1454-M1458 HydrophobicContact CE1-CG 4.23Å; F1454-M1458 HydrophobicContact CE2-CE 4.02Å; F1454-M1458 HydrophobicContact CE2-CG 3.38Å; F1454-M1458 HydrophobicContact CE2-SD 3.73Å; F1454-M1458 HydrophobicContact CG-CG 4.39Å; F1454-M1458 HydrophobicContact CZ-CG 3.66Å; F1454-M1458 HydrophobicContact CZ-SD 4.08Å; F1454-M1458 WeakPolarHBondContact O-CG 3.07Å; F1454-M1458 PolarHBondContact O-N 3.1Å; F1454-I1494 HydrophobicContact CD1-CD1 3.97Å; F1454-I1494 HydrophobicContact CE1-CB 4.42Å; F1454-I1494 HydrophobicContact CE1-CD1 3.44Å; F1454-I1494 VanDerWaalsContact CE1-CD1 3.44Å; F1454-I1494 HydrophobicContact CE1-CG1 3.58Å; F1454-I1494 HydrophobicContact CE1-CG2 3.93Å; F1454-I1494 HydrophobicContact CZ-CD1 4.06Å; F1454-I1494 HydrophobicContact CZ-CG1 3.73Å; F1454-I1494 HydrophobicContact CZ-CG2 4.32Å; F1454-L1520 HydrophobicContact CD2-CD1 4.34Å; F1454-L1520 HydrophobicContact CD2-CD2 3.42Å; F1454-L1520 VanDerWaalsContact CD2-CD2 3.42Å; F1454-L1520 HydrophobicContact CE2-CD1 3.56Å; F1454-L1520 HydrophobicContact CE2-CD2 3.52Å; F1454-L1520 HydrophobicContact CE2-CG 4.19Å; F1454-L1520 HydrophobicContact CZ-CD1 4.34Å; F1454-L1526 HydrophobicContact CB-CD1 3.63Å; F1454-L1526 HydrophobicContact CB-CD2 4.03Å; F1454-L1526 HydrophobicContact CD1-CD1 4.44Å; F1454-L1526 HydrophobicContact CD1-CD2 3.6Å; F1454-L1526 HydrophobicContact CD2-CD1 3.95Å; F1454-L1526 HydrophobicContact CD2-CD2 4.45Å; F1454-L1526 HydrophobicContact CE1-CD2 4.06Å; F1454-L1526 HydrophobicContact CG-CD1 3.76Å; F1454-L1526 HydrophobicContact CG-CD2 3.77Å; F1454-L1526 HydrophobicContact CG-CG 4.43Å; F1454-M1530 HydrophobicContact CZ-SD 4.3Å
1455	L	77.7	Confident	74.1	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-57.9	-41.6	175.2	-74.6	168.3	0	0	0	111.2	F1426 F1437 A1451 T1452 N1457 M1458 Q1459 I1494	F1426-L1455 HydrophobicContact CE1-CB 3.85Å; F1426-L1455 HydrophobicContact CE2-CB 3.81Å; F1426-L1455 HydrophobicContact CE2-CD1 4.25Å; F1426-L1455 HydrophobicContact CZ-CB 3.26Å; F1437-L1455 HydrophobicContact CD1-CD1 3.77Å; F1437-L1455 HydrophobicContact CD1-CD2 4.29Å; F1437-L1455 HydrophobicContact CD1-CG 3.93Å; F1437-L1455 HydrophobicContact CE1-CD1 4.4Å; F1437-L1455 HydrophobicContact CE1-CG 4.13Å; A1451-L1455 PolarHBondContact O-N 2.93Å; A1451-L1455 VanDerWaalsContact O-N 3.11Å; T1452-L1455 PolarHBondContact O-N 3.49Å; L1455-N1457 PolarHBondContact O-N 2.85Å; L1455-M1458 PolarHBondContact O-N 3.32Å; L1455-Q1459 WeakPolarHBondContact O-CB 3.17Å; L1455-Q1459 PolarHBondContact O-N 3.47Å; L1455-I1494 HydrophobicContact CD2-CD1 3.7Å
1456	K	75	Confident	73.7	Confident	86 Å²	86	46.7 Å²	46.7	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-58.2	-47	174.7	-78.2	171.3	178.9	168.4	0	111.8	F1426 T1452 G1453 F1454 S1460	F1426-K1456 HydrophobicContact CE1-CB 4.45Å; F1426-K1456 HydrophobicContact CE1-CG 3.92Å; F1426-K1456 HydrophobicContact CZ-CB 4.34Å; F1426-K1456 HydrophobicContact CZ-CG 3.63Å; T1452-K1456 WeakPolarHBondContact O-CG 3.15Å; T1452-K1456 PolarHBondContact O-N 3.26Å; G1453-K1456 PolarHBondContact O-N 3.16Å; F1454-K1456 VanDerWaalsContact C-N 3.28Å; F1454-K1456 PolarHBondContact O-N 2.78Å; K1456-S1460 VanDerWaalsContact O-CB 3.3Å; K1456-S1460 WeakPolarHBondContact O-CB 3.21Å; K1456-S1460 PolarHBondContact O-N 3.39Å; K1456-S1460 PolarHBondContact O-OG 2.82Å
1457	N	74.7	Confident	73.2	Confident	89 Å²	89	48.8 Å²	48.8	48%	0.476	28%	0.276	S	S	.	.	H	α-helix	trans	-68.4	-41.2	-179.2	-69.5	-8.9	0	0	0	112	G1453 F1454 L1455 S1460 A1461	G1453-N1457 VanDerWaalsContact O-CG 3.25Å; G1453-N1457 PolarHBondContact O-N 3.23Å; G1453-N1457 PolarHBondContact O-OD1 2.86Å; F1454-N1457 PolarHBondContact O-N 3.45Å; F1454-N1457 VanDerWaalsContact O-N 3.16Å; L1455-N1457 PolarHBondContact O-N 2.85Å; N1457-S1460 PolarHBondContact O-N 3.3Å; N1457-A1461 VanDerWaalsContact O-CB 3.31Å; N1457-A1461 WeakPolarHBondContact O-CB 3.27Å; N1457-A1461 PolarHBondContact O-N 3.4Å
1458	M	76.7	Confident	72.7	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-67.9	-42.2	178	-69.3	-65.3	98.5	0	0	112.4	F1454 L1455 S1460 A1461 L1462 A1490 L1493 I1494 L1497 L1518	F1454-M1458 HydrophobicContact CD2-CG 3.8Å; F1454-M1458 HydrophobicContact CE1-CG 4.23Å; F1454-M1458 HydrophobicContact CE2-CE 4.02Å; F1454-M1458 HydrophobicContact CE2-CG 3.38Å; F1454-M1458 HydrophobicContact CE2-SD 3.73Å; F1454-M1458 HydrophobicContact CG-CG 4.39Å; F1454-M1458 HydrophobicContact CZ-CG 3.66Å; F1454-M1458 HydrophobicContact CZ-SD 4.08Å; F1454-M1458 WeakPolarHBondContact O-CG 3.07Å; F1454-M1458 PolarHBondContact O-N 3.1Å; L1455-M1458 PolarHBondContact O-N 3.32Å; M1458-S1460 VanDerWaalsContact C-N 3.35Å; M1458-A1461 PolarHBondContact O-N 2.81Å; M1458-L1462 WeakPolarHBondContact O-CB 3.26Å; M1458-L1462 PolarHBondContact O-N 3.14Å; M1458-A1490 HydrophobicContact CB-CB 4.1Å; M1458-L1493 HydrophobicContact CB-CD2 4.41Å; M1458-L1493 HydrophobicContact SD-CD2 4.21Å; M1458-I1494 HydrophobicContact CB-CD1 4.22Å; M1458-I1494 HydrophobicContact CB-CG1 4.25Å; M1458-I1494 HydrophobicContact CG-CD1 4.06Å; M1458-I1494 HydrophobicContact CG-CG1 3.84Å; M1458-L1497 HydrophobicContact SD-CD1 4.2Å; M1458-L1518 HydrophobicContact CE-CD2 4.45Å
1459	Q	75.9	Confident	72	Confident	47 Å²	47	54.7 Å²	54.7	22%	0.22	31%	0.314	C	S	.	.	H	α-helix	trans	-68.2	-35.5	176.5	-160.3	150.3	-18.6	0	0	111.8	F1426 L1455 A1463 A1490	F1426-Q1459 VanDerWaalsContact CD1-OE1 3.28Å; L1455-Q1459 WeakPolarHBondContact O-CB 3.17Å; L1455-Q1459 PolarHBondContact O-N 3.47Å; Q1459-A1463 WeakPolarHBondContact O-CB 3.34Å; Q1459-A1463 PolarHBondContact O-N 3Å; Q1459-A1490 HydrophobicContact CB-CB 3.85Å; Q1459-A1490 HydrophobicContact CG-CB 4.36Å
1460	S	70.1	Confident	71.2	Confident	64 Å²	64	50.5 Å²	50.5	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-66	-39.4	172.1	-58.7	0	0	0	0	112.7	K1456 N1457 M1458 Q1464	K1456-S1460 VanDerWaalsContact O-CB 3.3Å; K1456-S1460 WeakPolarHBondContact O-CB 3.21Å; K1456-S1460 PolarHBondContact O-N 3.39Å; K1456-S1460 PolarHBondContact O-OG 2.82Å; N1457-S1460 PolarHBondContact O-N 3.3Å; M1458-S1460 VanDerWaalsContact C-N 3.35Å; S1460-Q1464 WeakPolarHBondContact O-CG 3.42Å; S1460-Q1464 PolarHBondContact O-N 2.8Å
1461	A	72.3	Confident	70.8	Confident	22 Å²	22	48.9 Å²	48.9	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-70.4	-39.2	177.2	0	0	0	0	0	112	N1457 M1458 Q1464 F1465 L1473	N1457-A1461 VanDerWaalsContact O-CB 3.31Å; N1457-A1461 WeakPolarHBondContact O-CB 3.27Å; N1457-A1461 PolarHBondContact O-N 3.4Å; M1458-A1461 PolarHBondContact O-N 2.81Å; A1461-Q1464 PolarHBondContact O-N 2.96Å; A1461-F1465 WeakPolarHBondContact O-CB 3.21Å; A1461-F1465 PolarHBondContact O-N 2.77Å; A1461-L1473 HydrophobicContact CB-CB 4.41Å; A1461-L1473 HydrophobicContact CB-CD2 3.99Å
1462	L	74.6	Confident	70.4	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-61.7	-47	173.3	-178.2	60.6	0	0	0	111.3	M1458 Q1464 F1465 N1466 I1487 D1489 L1493	M1458-L1462 WeakPolarHBondContact O-CB 3.26Å; M1458-L1462 PolarHBondContact O-N 3.14Å; L1462-Q1464 VanDerWaalsContact C-N 3.28Å; L1462-Q1464 PolarHBondContact O-N 3.5Å; L1462-F1465 PolarHBondContact O-N 3.33Å; L1462-F1465 VanDerWaalsContact O-N 3.12Å; L1462-N1466 VanDerWaalsContact CD1-OD1 3.3Å; L1462-N1466 WeakPolarHBondContact CD1-OD1 3.18Å; L1462-N1466 PolarHBondContact O-N 2.92Å; L1462-N1466 PolarHBondContact O-OD1 3.06Å; L1462-I1487 HydrophobicContact CD1-CB 3.77Å; L1462-I1487 HydrophobicContact CD1-CG2 3.84Å; L1462-I1487 HydrophobicContact CD2-CG2 4.14Å; L1462-D1489 VanDerWaalsContact CD2-C 3.42Å; L1462-D1489 WeakPolarHBondContact CD2-O 3.32Å; L1462-L1493 HydrophobicContact CB-CD2 4.18Å
1463	A	71.7	Confident	70.5	Confident	64 Å²	64	52.2 Å²	52.2	53%	0.529	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-34.6	177.1	0	0	0	0	0	112.9	Q1459 A1467	Q1459-A1463 WeakPolarHBondContact O-CB 3.34Å; Q1459-A1463 PolarHBondContact O-N 3Å; A1463-A1467 WeakPolarHBondContact O-CB 3.47Å; A1463-A1467 PolarHBondContact O-N 3.39Å
1464	Q	68.8	Low	70.3	Confident	116 Å²	116	51.8 Å²	51.8	54%	0.542	33%	0.329	S	S	.	.	H	α-helix	trans	-70.7	-39.5	173.2	-71.4	173.7	30.5	0	0	112.5	S1460 A1461 L1462 K1469	S1460-Q1464 WeakPolarHBondContact O-CG 3.42Å; S1460-Q1464 PolarHBondContact O-N 2.8Å; A1461-Q1464 PolarHBondContact O-N 2.96Å; L1462-Q1464 VanDerWaalsContact C-N 3.28Å; L1462-Q1464 PolarHBondContact O-N 3.5Å; Q1464-K1469 PolarHBondContact O-N 3.02Å; Q1464-K1469 VanDerWaalsContact O-N 3.13Å
1465	F	69.8	Low	70	Confident	31 Å²	31	56.3 Å²	56.3	14%	0.136	35%	0.353	C	S	.	.	H	α-helix	trans	-66.3	-51.4	178.3	176.5	-99.1	0	0	0	112	A1461 L1462 A1467 G1468 L1473 A1474 M1477 V1484	A1461-F1465 WeakPolarHBondContact O-CB 3.21Å; A1461-F1465 PolarHBondContact O-N 2.77Å; L1462-F1465 PolarHBondContact O-N 3.33Å; L1462-F1465 VanDerWaalsContact O-N 3.12Å; F1465-A1467 VanDerWaalsContact C-N 3.28Å; F1465-A1467 PolarHBondContact O-N 3.41Å; F1465-G1468 PolarHBondContact O-N 3.04Å; F1465-L1473 HydrophobicContact CB-CD2 4.01Å; F1465-L1473 HydrophobicContact CG-CD2 4.36Å; F1465-A1474 HydrophobicContact CD2-CB 3.8Å; F1465-A1474 HydrophobicContact CE2-CB 3.87Å; F1465-M1477 HydrophobicContact CE1-CE 3.81Å; F1465-M1477 HydrophobicContact CE2-CE 4.33Å; F1465-M1477 HydrophobicContact CZ-CE 3.54Å; F1465-V1484 HydrophobicContact CE1-CG1 4.41Å; F1465-V1484 HydrophobicContact CE2-CG1 4.28Å; F1465-V1484 HydrophobicContact CZ-CB 4.48Å; F1465-V1484 HydrophobicContact CZ-CG1 3.62Å
1466	N	69.7	Low	69.9	Low	72 Å²	72	56.2 Å²	56.2	39%	0.385	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-36.2	177.7	-66.7	13	0	0	0	111.2	L1462 G1468	L1462-N1466 VanDerWaalsContact CD1-OD1 3.3Å; L1462-N1466 WeakPolarHBondContact CD1-OD1 3.18Å; L1462-N1466 PolarHBondContact O-N 2.92Å; L1462-N1466 PolarHBondContact O-OD1 3.06Å; N1466-G1468 PolarHBondContact O-N 3.35Å
1467	A	66.3	Low	70	Confident	55 Å²	55	52.2 Å²	52.2	46%	0.455	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	16.4	174	0	0	0	0	0	114.7	A1463 F1465 K1469	A1463-A1467 WeakPolarHBondContact O-CB 3.47Å; A1463-A1467 PolarHBondContact O-N 3.39Å; F1465-A1467 VanDerWaalsContact C-N 3.28Å; F1465-A1467 PolarHBondContact O-N 3.41Å; A1467-K1469 PolarHBondContact O-N 2.85Å
1468	G	64.2	Low	69.9	Low	67 Å²	67	52.8 Å²	52.8	69%	0.691	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	4.8	177.3	0	0	0	0	0	115.5	F1465 N1466 G1470	F1465-G1468 PolarHBondContact O-N 3.04Å; N1466-G1468 PolarHBondContact O-N 3.35Å; G1468-G1470 PolarHBondContact O-N 3Å
1469	K	53.9	Low	69.6	Low	152 Å²	152	58.5 Å²	58.5	66%	0.661	37%	0.369	S	S	*	.			trans	-82.5	87.5	-174.7	-73.8	168.2	-173.7	168.6	0	109.3	Q1464 A1467 G1471	Q1464-K1469 PolarHBondContact O-N 3.02Å; Q1464-K1469 VanDerWaalsContact O-N 3.13Å; A1467-K1469 PolarHBondContact O-N 2.85Å; K1469-G1471 PolarHBondContact O-N 2.99Å
1470	G	56.5	Low	69.6	Low	79 Å²	79	57.7 Å²	57.7	81%	0.814	37%	0.366	S	S	*	.			trans	-40.4	110.3	179.3	0	0	0	0	0	112.4	G1468	G1468-G1470 PolarHBondContact O-N 3Å
1471	G	65.3	Low	69.6	Low	26 Å²	26	57.9 Å²	57.9	27%	0.268	38%	0.378	S	S	.	.			trans	-147.4	-177.4	-170.2	0	0	0	0	0	111.4	K1469 L1473 A1474 N1475	K1469-G1471 PolarHBondContact O-N 2.99Å; G1471-L1473 VanDerWaalsContact C-N 3.26Å; G1471-L1473 PolarHBondContact O-N 3.49Å; G1471-A1474 WeakPolarHBondContact O-CB 3.26Å; G1471-A1474 PolarHBondContact O-N 3.46Å; G1471-N1475 PolarHBondContact O-N 2.9Å
1472	V	68.7	Low	69.7	Low	74 Å²	74	58.5 Å²	58.5	45%	0.448	38%	0.378	S	S	.	.	H	α-helix	trans	-60.5	-35.6	-167.1	-168.9	0	0	0	0	112.7	A1474 N1475 V1476 D1517	V1472-A1474 VanDerWaalsContact C-N 3.32Å; V1472-A1474 PolarHBondContact O-N 2.88Å; V1472-N1475 PolarHBondContact O-N 3.12Å; V1472-V1476 HydrophobicContact CG1-CG2 4.45Å; V1472-V1476 WeakPolarHBondContact O-CG2 3.45Å; V1472-V1476 PolarHBondContact O-N 2.58Å; V1472-D1517 HydrophobicContact CG1-CB 3.54Å; V1472-D1517 VanDerWaalsContact CG1-O 3.27Å; V1472-D1517 WeakPolarHBondContact CG1-O 3.32Å
1473	L	74.2	Confident	69.2	Low	8 Å²	8	60.6 Å²	60.6	4%	0.042	40%	0.402	C	S	.	.	H	α-helix	trans	-62.1	-36.1	176.5	-172	62.2	0	0	0	113.1	A1461 F1465 G1471 V1476 M1477 L1493 L1497 L1518	A1461-L1473 HydrophobicContact CB-CB 4.41Å; A1461-L1473 HydrophobicContact CB-CD2 3.99Å; F1465-L1473 HydrophobicContact CB-CD2 4.01Å; F1465-L1473 HydrophobicContact CG-CD2 4.36Å; G1471-L1473 VanDerWaalsContact C-N 3.26Å; G1471-L1473 PolarHBondContact O-N 3.49Å; L1473-V1476 PolarHBondContact O-N 2.94Å; L1473-M1477 HydrophobicContact CD1-CG 4.4Å; L1473-M1477 HydrophobicContact CG-CG 4.3Å; L1473-M1477 WeakPolarHBondContact O-CB 3.26Å; L1473-M1477 WeakPolarHBondContact O-CG 3.3Å; L1473-M1477 PolarHBondContact O-N 2.98Å; L1473-L1493 HydrophobicContact CD1-CD1 4.18Å; L1473-L1493 HydrophobicContact CD1-CD2 4.19Å; L1473-L1493 HydrophobicContact CD2-CD1 4.06Å; L1473-L1493 HydrophobicContact CD2-CD2 3.55Å; L1473-L1493 HydrophobicContact CD2-CG 4.45Å; L1473-L1497 HydrophobicContact CD1-CD1 4.19Å; L1473-L1518 HydrophobicContact CD1-CD2 3.82Å
1474	A	71.8	Confident	68.6	Low	19 Å²	19	62 Å²	62	16%	0.157	40%	0.404	C	S	.	.	H	α-helix	trans	-65.2	-42.4	176.8	0	0	0	0	0	111.6	F1465 G1471 V1472 M1477 N1478	F1465-A1474 HydrophobicContact CD2-CB 3.8Å; F1465-A1474 HydrophobicContact CE2-CB 3.87Å; G1471-A1474 WeakPolarHBondContact O-CB 3.26Å; G1471-A1474 PolarHBondContact O-N 3.46Å; V1472-A1474 VanDerWaalsContact C-N 3.32Å; V1472-A1474 PolarHBondContact O-N 2.88Å; A1474-M1477 PolarHBondContact O-N 3.24Å; A1474-N1478 WeakPolarHBondContact O-CB 3.43Å; A1474-N1478 VanDerWaalsContact O-CG 3.29Å; A1474-N1478 PolarHBondContact O-N 3.03Å; A1474-N1478 PolarHBondContact O-ND2 3.43Å
1475	N	71.6	Confident	68.3	Low	98 Å²	98	58.6 Å²	58.6	52%	0.524	40%	0.399	S	S	.	.	H	α-helix	trans	-63.6	-43	175.5	-66.3	-18.9	0	0	0	111	G1471 V1472 N1479	G1471-N1475 PolarHBondContact O-N 2.9Å; V1472-N1475 PolarHBondContact O-N 3.12Å; N1475-N1479 VanDerWaalsContact O-CB 3.22Å; N1475-N1479 WeakPolarHBondContact O-CB 3.41Å; N1475-N1479 PolarHBondContact O-N 2.81Å; N1475-N1479 PolarHBondContact O-ND2 2.79Å; N1475-N1479 VanDerWaalsContact O-ND2 3.14Å
1476	V	76.6	Confident	67.9	Low	1 Å²	1	62.9 Å²	62.9	1%	0.006	42%	0.423	C	S	.	.	H	α-helix	trans	-62.9	-49.1	176.6	168	0	0	0	0	111.6	V1472 L1473 N1478 N1479 L1480 L1497 I1514 D1517 L1518	V1472-V1476 HydrophobicContact CG1-CG2 4.45Å; V1472-V1476 WeakPolarHBondContact O-CG2 3.45Å; V1472-V1476 PolarHBondContact O-N 2.58Å; L1473-V1476 PolarHBondContact O-N 2.94Å; V1476-N1478 PolarHBondContact O-N 3.13Å; V1476-N1479 PolarHBondContact O-N 3.42Å; V1476-L1480 HydrophobicContact CG1-CD1 3.68Å; V1476-L1480 HydrophobicContact CG1-CG 4.38Å; V1476-L1480 WeakPolarHBondContact O-CB 3.46Å; V1476-L1480 VanDerWaalsContact O-CG 3.23Å; V1476-L1480 WeakPolarHBondContact O-CG 3.46Å; V1476-L1480 PolarHBondContact O-N 2.89Å; V1476-L1497 HydrophobicContact CG1-CD2 3.83Å; V1476-I1514 HydrophobicContact CB-CG2 4.44Å; V1476-I1514 HydrophobicContact CG1-CD1 4.44Å; V1476-I1514 HydrophobicContact CG1-CG2 3.58Å; V1476-I1514 HydrophobicContact CG2-CG1 4.42Å; V1476-I1514 HydrophobicContact CG2-CG2 3.99Å; V1476-D1517 HydrophobicContact CG2-CB 4.25Å; V1476-L1518 HydrophobicContact CB-CD2 4.35Å; V1476-L1518 HydrophobicContact CG1-CD1 4.3Å; V1476-L1518 HydrophobicContact CG1-CD2 4.24Å; V1476-L1518 HydrophobicContact CG1-CG 4.4Å; V1476-L1518 HydrophobicContact CG2-CD2 4.09Å; V1476-L1518 HydrophobicContact CG2-CG 4.2Å
1477	M	75.9	Confident	67.8	Low	1 Å²	1	59.5 Å²	59.5	1%	0.005	41%	0.405	C	S	.	.	H	α-helix	trans	-57	-50.1	177.7	-73.4	-97.4	-74.6	0	0	111.7	F1465 L1473 A1474 N1479 L1480 G1481 L1482 I1487 L1493	F1465-M1477 HydrophobicContact CE1-CE 3.81Å; F1465-M1477 HydrophobicContact CE2-CE 4.33Å; F1465-M1477 HydrophobicContact CZ-CE 3.54Å; L1473-M1477 HydrophobicContact CD1-CG 4.4Å; L1473-M1477 HydrophobicContact CG-CG 4.3Å; L1473-M1477 WeakPolarHBondContact O-CB 3.26Å; L1473-M1477 WeakPolarHBondContact O-CG 3.3Å; L1473-M1477 PolarHBondContact O-N 2.98Å; A1474-M1477 PolarHBondContact O-N 3.24Å; M1477-N1479 PolarHBondContact O-N 3.38Å; M1477-L1480 PolarHBondContact O-N 3.28Å; M1477-G1481 PolarHBondContact O-N 2.98Å; M1477-L1482 HydrophobicContact CB-CB 4.37Å; M1477-L1482 HydrophobicContact CE-CB 4.47Å; M1477-L1482 PolarHBondContact O-N 3.05Å; M1477-L1482 HydrophobicContact SD-CB 3.69Å; M1477-L1482 HydrophobicContact SD-CD1 3.92Å; M1477-L1482 HydrophobicContact SD-CG 4.47Å; M1477-I1487 HydrophobicContact CE-CD1 3.52Å; M1477-I1487 HydrophobicContact SD-CD1 3.84Å; M1477-L1493 HydrophobicContact SD-CD1 4.29Å
1478	N	72.7	Confident	67.9	Low	101 Å²	101	65.4 Å²	65.4	54%	0.54	42%	0.421	S	S	.	.	H	α-helix	trans	-61.7	-44.6	177.8	-73.4	-25.7	0	0	0	112.1	A1474 V1476 L1480 G1481	A1474-N1478 WeakPolarHBondContact O-CB 3.43Å; A1474-N1478 VanDerWaalsContact O-CG 3.29Å; A1474-N1478 PolarHBondContact O-N 3.03Å; A1474-N1478 PolarHBondContact O-ND2 3.43Å; V1476-N1478 PolarHBondContact O-N 3.13Å; N1478-L1480 VanDerWaalsContact C-N 3.26Å; N1478-L1480 PolarHBondContact O-N 3.41Å; N1478-G1481 PolarHBondContact O-N 2.65Å; N1478-G1481 VanDerWaalsContact O-N 3.14Å
1479	N	71.3	Confident	68.3	Low	124 Å²	124	64.2 Å²	64.2	66%	0.663	40%	0.399	S	S	*	.	H	α-helix	trans	-66	-25.9	177.6	-73.9	-23.9	0	0	0	113.3	N1475 V1476 M1477	N1475-N1479 VanDerWaalsContact O-CB 3.22Å; N1475-N1479 WeakPolarHBondContact O-CB 3.41Å; N1475-N1479 PolarHBondContact O-N 2.81Å; N1475-N1479 PolarHBondContact O-ND2 2.79Å; N1475-N1479 VanDerWaalsContact O-ND2 3.14Å; V1476-N1479 PolarHBondContact O-N 3.42Å; M1477-N1479 PolarHBondContact O-N 3.38Å
1480	L	75.6	Confident	69.3	Low	30 Å²	30	57 Å²	57	16%	0.157	37%	0.367	C	S	.	.	H	α-helix	trans	-87.6	-10.3	175.3	-69.4	175.4	0	0	0	113.4	V1476 M1477 N1478 L1482 L1497 A1500 L1501 L1506 I1514	V1476-L1480 HydrophobicContact CG1-CD1 3.68Å; V1476-L1480 HydrophobicContact CG1-CG 4.38Å; V1476-L1480 WeakPolarHBondContact O-CB 3.46Å; V1476-L1480 VanDerWaalsContact O-CG 3.23Å; V1476-L1480 WeakPolarHBondContact O-CG 3.46Å; V1476-L1480 PolarHBondContact O-N 2.89Å; M1477-L1480 PolarHBondContact O-N 3.28Å; N1478-L1480 VanDerWaalsContact C-N 3.26Å; N1478-L1480 PolarHBondContact O-N 3.41Å; L1480-L1482 VanDerWaalsContact C-N 3.26Å; L1480-L1482 HydrophobicContact CB-CD1 4.22Å; L1480-L1482 HydrophobicContact CB-CG 4.07Å; L1480-L1482 HydrophobicContact CD1-CD1 4.1Å; L1480-L1497 HydrophobicContact CD1-CD2 3.68Å; L1480-A1500 HydrophobicContact CB-CB 4.13Å; L1480-A1500 HydrophobicContact CD1-CB 3.95Å; L1480-A1500 HydrophobicContact CD2-CB 4.21Å; L1480-A1500 HydrophobicContact CG-CB 4.32Å; L1480-L1501 HydrophobicContact CD2-CD2 4.13Å; L1480-L1506 HydrophobicContact CD2-CD1 3.56Å; L1480-L1506 HydrophobicContact CD2-CD2 4.03Å; L1480-L1506 HydrophobicContact CD2-CG 4.41Å; L1480-I1514 HydrophobicContact CD1-CD1 4.29Å; L1480-I1514 HydrophobicContact CD2-CD1 3.62Å; L1480-I1514 HydrophobicContact CG-CD1 3.84Å
1481	G	70.5	Confident	70.1	Confident	67 Å²	67	54.6 Å²	54.6	69%	0.691	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	24.2	-171.9	0	0	0	0	0	113.4	M1477 N1478	M1477-G1481 PolarHBondContact O-N 2.98Å; N1478-G1481 PolarHBondContact O-N 2.65Å; N1478-G1481 VanDerWaalsContact O-N 3.14Å
1482	L	73.2	Confident	70.6	Confident	35 Å²	35	55.9 Å²	55.9	18%	0.183	34%	0.336	C	S	.	.			trans	-79.1	123.5	171.8	-70	174.2	0	0	0	108.9	M1477 L1480 R1496 L1497 A1500	M1477-L1482 HydrophobicContact CB-CB 4.37Å; M1477-L1482 HydrophobicContact CE-CB 4.47Å; M1477-L1482 PolarHBondContact O-N 3.05Å; M1477-L1482 HydrophobicContact SD-CB 3.69Å; M1477-L1482 HydrophobicContact SD-CD1 3.92Å; M1477-L1482 HydrophobicContact SD-CG 4.47Å; L1480-L1482 VanDerWaalsContact C-N 3.26Å; L1480-L1482 HydrophobicContact CB-CD1 4.22Å; L1480-L1482 HydrophobicContact CB-CG 4.07Å; L1480-L1482 HydrophobicContact CD1-CD1 4.1Å; L1482-R1496 HydrophobicContact CD1-CB 4.41Å; L1482-R1496 HydrophobicContact CD2-CB 4.35Å; L1482-L1497 HydrophobicContact CD1-CD2 3.91Å; L1482-A1500 HydrophobicContact CD1-CB 4Å; L1482-A1500 HydrophobicContact CD2-CB 4.17Å; L1482-A1500 HydrophobicContact CG-CB 4.15Å
1483	G	64.4	Low	71	Confident	52 Å²	52	52.3 Å²	52.3	54%	0.536	32%	0.315	S	S	.	.			trans	-60.6	140.6	-179.2	0	0	0	0	0	112.2	G1485	G1483-G1485 PolarHBondContact O-N 3.26Å; G1483-G1485 VanDerWaalsContact O-N 3.14Å
1484	V	58.8	Low	71.4	Confident	95 Å²	95	52.1 Å²	52.1	58%	0.576	31%	0.314	S	S	*	.			trans	-66.9	-11.1	-177.5	-157.5	0	0	0	0	112.9	F1465	F1465-V1484 HydrophobicContact CE1-CG1 4.41Å; F1465-V1484 HydrophobicContact CE2-CG1 4.28Å; F1465-V1484 HydrophobicContact CZ-CB 4.48Å; F1465-V1484 HydrophobicContact CZ-CG1 3.62Å
1485	G	62.5	Low	71.7	Confident	43 Å²	43	56.1 Å²	56.1	44%	0.443	33%	0.329	S	S	.	.	S	Bend	trans	-66.1	145.7	-177.6	0	0	0	0	0	113.9	G1483 R1496	G1483-G1485 PolarHBondContact O-N 3.26Å; G1483-G1485 VanDerWaalsContact O-N 3.14Å; G1485-R1496 PolarHBondContact O-NH1 3.39Å
1486	D	62.3	Low	72.1	Confident	121 Å²	121	55 Å²	55	65%	0.647	32%	0.318	S	S	*	.			trans	-41	126.5	-158.6	-34	-44.9	0	0	0	113.9	R1496	D1486-R1496 PolarHBondContact O-NH2 3.5Å
1487	I	66.7	Low	72.3	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	32%	0.317	C	S	.	.			trans	-107.4	119.8	170.8	-66.1	176.9	0	0	0	106.2	L1462 M1477 D1489 E1492 L1493	L1462-I1487 HydrophobicContact CD1-CB 3.77Å; L1462-I1487 HydrophobicContact CD1-CG2 3.84Å; L1462-I1487 HydrophobicContact CD2-CG2 4.14Å; M1477-I1487 HydrophobicContact CE-CD1 3.52Å; M1477-I1487 HydrophobicContact SD-CD1 3.84Å; I1487-D1489 WeakPolarHBondContact CG2-O 3.32Å; I1487-E1492 HydrophobicContact CG2-CB 4.12Å; I1487-E1492 HydrophobicContact CG2-CG 4.13Å; I1487-L1493 HydrophobicContact CD1-CD1 3.58Å; I1487-L1493 HydrophobicContact CG2-CB 3.86Å; I1487-L1493 HydrophobicContact CG2-CD1 4.47Å
1488	K	69.6	Low	72.7	Confident	180 Å²	180	55.4 Å²	55.4	78%	0.783	32%	0.319	S	S	*	.			trans	-74.6	-37.6	-168	-63	178.1	-178.8	-178.8	0	112.3	E1492	K1488-E1492 PolarHBondContact N-OE2 2.99Å
1489	D	72.7	Confident	72.9	Confident	41 Å²	41	56.3 Å²	56.3	22%	0.219	32%	0.319	C	S	.	.	S	Bend	trans	-152.6	169.3	-170.1	61.1	52.4	0	0	0	112.9	L1429 L1462 I1487 P1491 E1492 L1493	L1429-D1489 HydrophobicContact CD2-CB 3.7Å; L1462-D1489 VanDerWaalsContact CD2-C 3.42Å; L1462-D1489 WeakPolarHBondContact CD2-O 3.32Å; I1487-D1489 WeakPolarHBondContact CG2-O 3.32Å; D1489-P1491 WeakPolarHBondContact OD1-CB 3.14Å; D1489-P1491 VanDerWaalsContact OD1-CD 3.22Å; D1489-P1491 WeakPolarHBondContact OD1-CD 3.23Å; D1489-E1492 PolarHBondContact O-N 2.67Å; D1489-E1492 WeakPolarHBondContact OD1-CB 3.34Å; D1489-E1492 PolarHBondContact OD1-N 3.05Å; D1489-L1493 PolarHBondContact O-N 2.95Å; D1489-L1493 VanDerWaalsContact O-N 3.12Å
1490	A	74.4	Confident	73.2	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66	-40.1	-180	0	0	0	0	0	113.6	M1458 Q1459 E1492 L1493 I1494	M1458-A1490 HydrophobicContact CB-CB 4.1Å; Q1459-A1490 HydrophobicContact CB-CB 3.85Å; Q1459-A1490 HydrophobicContact CG-CB 4.36Å; A1490-E1492 PolarHBondContact O-N 3.26Å; A1490-L1493 WeakPolarHBondContact O-CB 3.4Å; A1490-L1493 PolarHBondContact O-N 3.05Å; A1490-I1494 WeakPolarHBondContact O-CB 3.48Å; A1490-I1494 WeakPolarHBondContact O-CD1 3.47Å; A1490-I1494 WeakPolarHBondContact O-CG1 3.47Å; A1490-I1494 PolarHBondContact O-N 3.16Å
1491	P	73.3	Confident	73.4	Confident	30 Å²	30	50.1 Å²	50.1	20%	0.195	29%	0.288	C	S	.	.	H	α-helix	trans	-53.3	-45.6	169.9	-30.1	36.9	0	0	0	114.4	L1429 D1489 I1494 E1495	L1429-P1491 HydrophobicContact CD1-CG 4.22Å; L1429-P1491 HydrophobicContact CD2-CG 4Å; D1489-P1491 WeakPolarHBondContact OD1-CB 3.14Å; D1489-P1491 VanDerWaalsContact OD1-CD 3.22Å; D1489-P1491 WeakPolarHBondContact OD1-CD 3.23Å; P1491-I1494 PolarHBondContact O-N 3.24Å; P1491-E1495 PolarHBondContact O-N 3.1Å
1492	E	74.9	Confident	73.3	Confident	52 Å²	52	48.5 Å²	48.5	24%	0.243	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-42.9	176.2	-178.2	176.9	-156.9	0	0	111.3	I1487 K1488 D1489 A1490 I1494 E1495 R1496	I1487-E1492 HydrophobicContact CG2-CB 4.12Å; I1487-E1492 HydrophobicContact CG2-CG 4.13Å; K1488-E1492 PolarHBondContact N-OE2 2.99Å; D1489-E1492 PolarHBondContact O-N 2.67Å; D1489-E1492 WeakPolarHBondContact OD1-CB 3.34Å; D1489-E1492 PolarHBondContact OD1-N 3.05Å; A1490-E1492 PolarHBondContact O-N 3.26Å; E1492-I1494 VanDerWaalsContact C-N 3.32Å; E1492-I1494 PolarHBondContact O-N 3.13Å; E1492-E1495 PolarHBondContact O-N 2.91Å; E1492-R1496 HydrophobicContact CG-CG 4.3Å; E1492-R1496 WeakPolarHBondContact O-CB 3.2Å; E1492-R1496 WeakPolarHBondContact O-CG 3.44Å; E1492-R1496 PolarHBondContact O-N 3.18Å; E1492-R1496 IonicContact OE1-CZ 2.62Å; E1492-R1496 VanDerWaalsContact OE1-CZ 3.29Å; E1492-R1496 IonicContact OE1-NE 3.53Å; E1492-R1496 PolarHBondContact OE1-NE 2.87Å; E1492-R1496 VanDerWaalsContact OE1-NE 3.09Å; E1492-R1496 IonicContact OE1-NH2 3.45Å; E1492-R1496 PolarHBondContact OE1-NH2 3.46Å; E1492-R1496 IonicContact OE2-NH2 3.25Å
1493	L	78.6	Confident	73.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.1	-47.5	174.2	-176.4	62.8	0	0	0	111.3	M1458 L1462 L1473 M1477 I1487 D1489 A1490 E1495 R1496 L1497	M1458-L1493 HydrophobicContact CB-CD2 4.41Å; M1458-L1493 HydrophobicContact SD-CD2 4.21Å; L1462-L1493 HydrophobicContact CB-CD2 4.18Å; L1473-L1493 HydrophobicContact CD1-CD1 4.18Å; L1473-L1493 HydrophobicContact CD1-CD2 4.19Å; L1473-L1493 HydrophobicContact CD2-CD1 4.06Å; L1473-L1493 HydrophobicContact CD2-CD2 3.55Å; L1473-L1493 HydrophobicContact CD2-CG 4.45Å; M1477-L1493 HydrophobicContact SD-CD1 4.29Å; I1487-L1493 HydrophobicContact CD1-CD1 3.58Å; I1487-L1493 HydrophobicContact CG2-CB 3.86Å; I1487-L1493 HydrophobicContact CG2-CD1 4.47Å; D1489-L1493 PolarHBondContact O-N 2.95Å; D1489-L1493 VanDerWaalsContact O-N 3.12Å; A1490-L1493 WeakPolarHBondContact O-CB 3.4Å; A1490-L1493 PolarHBondContact O-N 3.05Å; L1493-E1495 PolarHBondContact O-N 3.09Å; L1493-R1496 PolarHBondContact O-N 3.07Å; L1493-L1497 HydrophobicContact CD1-CD1 4.16Å; L1493-L1497 HydrophobicContact CD1-CG 4.31Å; L1493-L1497 HydrophobicContact CG-CD1 3.91Å; L1493-L1497 HydrophobicContact CG-CG 4.45Å; L1493-L1497 WeakPolarHBondContact O-CB 3.37Å; L1493-L1497 VanDerWaalsContact O-CG 3.27Å; L1493-L1497 WeakPolarHBondContact O-CG 3.44Å; L1493-L1497 PolarHBondContact O-N 3.15Å
1494	I	82	Confident	73.2	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-42.7	-179.3	-69.8	162.2	0	0	0	110.7	F1437 F1454 L1455 M1458 A1490 P1491 E1492 Q1498 Y1529 M1530	F1437-I1494 HydrophobicContact CE2-CG2 4.3Å; F1454-I1494 HydrophobicContact CD1-CD1 3.97Å; F1454-I1494 HydrophobicContact CE1-CB 4.42Å; F1454-I1494 HydrophobicContact CE1-CD1 3.44Å; F1454-I1494 VanDerWaalsContact CE1-CD1 3.44Å; F1454-I1494 HydrophobicContact CE1-CG1 3.58Å; F1454-I1494 HydrophobicContact CE1-CG2 3.93Å; F1454-I1494 HydrophobicContact CZ-CD1 4.06Å; F1454-I1494 HydrophobicContact CZ-CG1 3.73Å; F1454-I1494 HydrophobicContact CZ-CG2 4.32Å; L1455-I1494 HydrophobicContact CD2-CD1 3.7Å; M1458-I1494 HydrophobicContact CB-CD1 4.22Å; M1458-I1494 HydrophobicContact CB-CG1 4.25Å; M1458-I1494 HydrophobicContact CG-CD1 4.06Å; M1458-I1494 HydrophobicContact CG-CG1 3.84Å; A1490-I1494 WeakPolarHBondContact O-CB 3.48Å; A1490-I1494 WeakPolarHBondContact O-CD1 3.47Å; A1490-I1494 WeakPolarHBondContact O-CG1 3.47Å; A1490-I1494 PolarHBondContact O-N 3.16Å; P1491-I1494 PolarHBondContact O-N 3.24Å; E1492-I1494 VanDerWaalsContact C-N 3.32Å; E1492-I1494 PolarHBondContact O-N 3.13Å; I1494-Q1498 VanDerWaalsContact O-CB 3.23Å; I1494-Q1498 WeakPolarHBondContact O-CB 3.43Å; I1494-Q1498 PolarHBondContact O-N 3.24Å; I1494-Y1529 HydrophobicContact CG2-CE1 3.83Å; I1494-M1530 HydrophobicContact CG2-SD 4.43Å
1495	E	77.8	Confident	73.6	Confident	103 Å²	103	54.8 Å²	54.8	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-68.3	-43.3	178.3	-166.3	-178.4	144.4	0	0	112.1	P1491 E1492 L1493 L1497 Q1498 K1499	P1491-E1495 PolarHBondContact O-N 3.1Å; E1492-E1495 PolarHBondContact O-N 2.91Å; L1493-E1495 PolarHBondContact O-N 3.09Å; E1495-L1497 PolarHBondContact O-N 2.89Å; E1495-Q1498 PolarHBondContact O-N 3.48Å; E1495-K1499 HydrophobicContact CG-CD 4.29Å; E1495-K1499 WeakPolarHBondContact O-CB 3.34Å; E1495-K1499 WeakPolarHBondContact O-CG 3.43Å; E1495-K1499 PolarHBondContact O-N 2.85Å; E1495-K1499 WeakPolarHBondContact OE1-CE 3.34Å; E1495-K1499 IonicContact OE1-NZ 3.19Å; E1495-K1499 PolarHBondContact OE1-NZ 2.88Å
1496	R	80.1	Confident	73.6	Confident	74 Å²	74	55 Å²	55	28%	0.279	29%	0.286	S	S	.	.	H	α-helix	trans	-60.3	-44.7	174.5	-71.9	-179.5	-178.2	-162.7	16.5	111	L1482 G1485 D1486 E1492 L1493 A1500	L1482-R1496 HydrophobicContact CD1-CB 4.41Å; L1482-R1496 HydrophobicContact CD2-CB 4.35Å; G1485-R1496 PolarHBondContact O-NH1 3.39Å; D1486-R1496 PolarHBondContact O-NH2 3.5Å; E1492-R1496 HydrophobicContact CG-CG 4.3Å; E1492-R1496 WeakPolarHBondContact O-CB 3.2Å; E1492-R1496 WeakPolarHBondContact O-CG 3.44Å; E1492-R1496 PolarHBondContact O-N 3.18Å; E1492-R1496 IonicContact OE1-CZ 2.62Å; E1492-R1496 VanDerWaalsContact OE1-CZ 3.29Å; E1492-R1496 IonicContact OE1-NE 3.53Å; E1492-R1496 PolarHBondContact OE1-NE 2.87Å; E1492-R1496 VanDerWaalsContact OE1-NE 3.09Å; E1492-R1496 IonicContact OE1-NH2 3.45Å; E1492-R1496 PolarHBondContact OE1-NH2 3.46Å; E1492-R1496 IonicContact OE2-NH2 3.25Å; L1493-R1496 PolarHBondContact O-N 3.07Å; R1496-A1500 WeakPolarHBondContact O-CB 3.5Å; R1496-A1500 PolarHBondContact O-N 2.95Å; R1496-A1500 VanDerWaalsContact O-N 3.11Å
1497	L	80.8	Confident	74	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.8	-43.1	176.5	-72.6	173.2	0	0	0	112.9	M1458 L1473 V1476 L1480 L1482 L1493 E1495 A1500 L1501 L1518 M1530	M1458-L1497 HydrophobicContact SD-CD1 4.2Å; L1473-L1497 HydrophobicContact CD1-CD1 4.19Å; V1476-L1497 HydrophobicContact CG1-CD2 3.83Å; L1480-L1497 HydrophobicContact CD1-CD2 3.68Å; L1482-L1497 HydrophobicContact CD1-CD2 3.91Å; L1493-L1497 HydrophobicContact CD1-CD1 4.16Å; L1493-L1497 HydrophobicContact CD1-CG 4.31Å; L1493-L1497 HydrophobicContact CG-CD1 3.91Å; L1493-L1497 HydrophobicContact CG-CG 4.45Å; L1493-L1497 WeakPolarHBondContact O-CB 3.37Å; L1493-L1497 VanDerWaalsContact O-CG 3.27Å; L1493-L1497 WeakPolarHBondContact O-CG 3.44Å; L1493-L1497 PolarHBondContact O-N 3.15Å; E1495-L1497 PolarHBondContact O-N 2.89Å; L1497-A1500 PolarHBondContact O-N 2.78Å; L1497-L1501 WeakPolarHBondContact O-CB 3.34Å; L1497-L1501 WeakPolarHBondContact O-CG 3.25Å; L1497-L1501 PolarHBondContact O-N 3.36Å; L1497-L1518 HydrophobicContact CD1-CD1 4.16Å; L1497-M1530 HydrophobicContact CB-CE 3.59Å
1498	Q	84.1	Confident	73.9	Confident	11 Å²	11	59 Å²	59	5%	0.051	31%	0.308	C	S	.	.	H	α-helix	trans	-65.2	-41.1	179.5	177.9	-89.4	-22.1	0	0	111.4	I1494 E1495 S1502 Y1529 M1530 L1532 M1537	I1494-Q1498 VanDerWaalsContact O-CB 3.23Å; I1494-Q1498 WeakPolarHBondContact O-CB 3.43Å; I1494-Q1498 PolarHBondContact O-N 3.24Å; E1495-Q1498 PolarHBondContact O-N 3.48Å; Q1498-S1502 VanDerWaalsContact O-CB 3.26Å; Q1498-S1502 WeakPolarHBondContact O-CB 3.44Å; Q1498-S1502 PolarHBondContact O-N 3.01Å; Q1498-S1502 PolarHBondContact O-OG 3.17Å; Q1498-Y1529 HydrophobicContact CG-CE1 4.4Å; Q1498-Y1529 WeakPolarHBondContact CG-O 3.37Å; Q1498-M1530 HydrophobicContact CB-CE 3.92Å; Q1498-M1530 HydrophobicContact CB-SD 4.05Å; Q1498-L1532 PolarHBondContact NE2-O 3.43Å; Q1498-M1537 HydrophobicContact CG-CE 4.26Å
1499	K	77.4	Confident	74	Confident	120 Å²	120	58.8 Å²	58.8	52%	0.522	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-37.7	172.9	-73.5	175.4	-179.8	173	0	112.7	E1495 S1502 S1503	E1495-K1499 HydrophobicContact CG-CD 4.29Å; E1495-K1499 WeakPolarHBondContact O-CB 3.34Å; E1495-K1499 WeakPolarHBondContact O-CG 3.43Å; E1495-K1499 PolarHBondContact O-N 2.85Å; E1495-K1499 WeakPolarHBondContact OE1-CE 3.34Å; E1495-K1499 IonicContact OE1-NZ 3.19Å; E1495-K1499 PolarHBondContact OE1-NZ 2.88Å; K1499-S1502 PolarHBondContact O-OG 3.02Å; K1499-S1503 PolarHBondContact O-N 2.91Å
1500	A	78.2	Confident	73.9	Confident	14 Å²	14	57.9 Å²	57.9	12%	0.116	31%	0.308	C	S	.	.	H	α-helix	trans	-69.6	-45.1	176.8	0	0	0	0	0	112.6	L1480 L1482 R1496 L1497 S1503	L1480-A1500 HydrophobicContact CB-CB 4.13Å; L1480-A1500 HydrophobicContact CD1-CB 3.95Å; L1480-A1500 HydrophobicContact CD2-CB 4.21Å; L1480-A1500 HydrophobicContact CG-CB 4.32Å; L1482-A1500 HydrophobicContact CD1-CB 4Å; L1482-A1500 HydrophobicContact CD2-CB 4.17Å; L1482-A1500 HydrophobicContact CG-CB 4.15Å; R1496-A1500 WeakPolarHBondContact O-CB 3.5Å; R1496-A1500 PolarHBondContact O-N 2.95Å; R1496-A1500 VanDerWaalsContact O-N 3.11Å; L1497-A1500 PolarHBondContact O-N 2.78Å; A1500-S1503 VanDerWaalsContact O-CB 3.31Å; A1500-S1503 WeakPolarHBondContact O-CB 3.13Å; A1500-S1503 PolarHBondContact O-N 2.55Å; A1500-S1503 PolarHBondContact O-OG 3.31Å
1501	L	78.3	Confident	73.9	Confident	11 Å²	11	58.3 Å²	58.3	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-72.5	-36.3	-178.4	-72.4	169.8	0	0	0	113.2	L1480 L1497 S1503 L1506 F1511 I1514 M1515 M1530	L1480-L1501 HydrophobicContact CD2-CD2 4.13Å; L1497-L1501 WeakPolarHBondContact O-CB 3.34Å; L1497-L1501 WeakPolarHBondContact O-CG 3.25Å; L1497-L1501 PolarHBondContact O-N 3.36Å; L1501-S1503 VanDerWaalsContact C-N 3.26Å; L1501-S1503 PolarHBondContact O-N 3.22Å; L1501-L1506 HydrophobicContact CD2-CD2 4.27Å; L1501-F1511 HydrophobicContact CB-CD2 4.07Å; L1501-F1511 HydrophobicContact CB-CE2 3.99Å; L1501-F1511 HydrophobicContact CD1-CE2 4.25Å; L1501-F1511 HydrophobicContact CD2-CD2 3.9Å; L1501-F1511 HydrophobicContact CD2-CE2 4.37Å; L1501-F1511 HydrophobicContact CG-CD2 4.41Å; L1501-F1511 HydrophobicContact CG-CE2 4.44Å; L1501-I1514 HydrophobicContact CD1-CG2 4.38Å; L1501-I1514 HydrophobicContact CD2-CB 4.28Å; L1501-I1514 HydrophobicContact CD2-CD1 4.29Å; L1501-I1514 HydrophobicContact CD2-CG2 4Å; L1501-M1515 HydrophobicContact CD1-SD 4.07Å; L1501-M1530 HydrophobicContact CD1-CB 4.26Å; L1501-M1530 HydrophobicContact CD1-CE 4.04Å
1502	S	70.3	Confident	73.8	Confident	33 Å²	33	60.8 Å²	60.8	23%	0.231	32%	0.319	C	S	.	.	H	α-helix	trans	-75.3	-8.8	175.1	61.5	0	0	0	0	114.1	Q1498 K1499 G1504	Q1498-S1502 VanDerWaalsContact O-CB 3.26Å; Q1498-S1502 WeakPolarHBondContact O-CB 3.44Å; Q1498-S1502 PolarHBondContact O-N 3.01Å; Q1498-S1502 PolarHBondContact O-OG 3.17Å; K1499-S1502 PolarHBondContact O-OG 3.02Å; S1502-G1504 PolarHBondContact O-N 2.89Å
1503	S	67.3	Low	73.8	Confident	59 Å²	59	62.2 Å²	62.2	41%	0.413	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-4.7	-176.7	72.6	0	0	0	0	116	K1499 A1500 L1501 K1505	K1499-S1503 PolarHBondContact O-N 2.91Å; A1500-S1503 VanDerWaalsContact O-CB 3.31Å; A1500-S1503 WeakPolarHBondContact O-CB 3.13Å; A1500-S1503 PolarHBondContact O-N 2.55Å; A1500-S1503 PolarHBondContact O-OG 3.31Å; L1501-S1503 VanDerWaalsContact C-N 3.26Å; L1501-S1503 PolarHBondContact O-N 3.22Å; S1503-K1505 PolarHBondContact O-N 3.04Å; S1503-K1505 VanDerWaalsContact O-N 3.11Å
1504	G	66.6	Low	73.6	Confident	67 Å²	67	62.6 Å²	62.6	69%	0.691	33%	0.333	S	S	*	.	S	Bend	trans	70.6	-2.6	-177.5	0	0	0	0	0	115.1	S1502 L1506	S1502-G1504 PolarHBondContact O-N 2.89Å; G1504-L1506 VanDerWaalsContact C-N 3.3Å; G1504-L1506 PolarHBondContact O-N 3.5Å
1505	K	68	Low	73	Confident	187 Å²	187	62.5 Å²	62.5	81%	0.813	33%	0.332	S	S	*	.			trans	-70.3	-23.3	179.9	-68.3	-178.6	178.5	178.9	0	113.8	S1503	S1503-K1505 PolarHBondContact O-N 3.04Å; S1503-K1505 VanDerWaalsContact O-N 3.11Å
1506	L	63.4	Low	72.8	Confident	48 Å²	48	60.9 Å²	60.9	25%	0.251	33%	0.332	S	S	.	.	S	Bend	trans	-92.5	139.9	179.1	-73	91.3	0	0	0	111.3	L1480 L1501 G1504 I1514	L1480-L1506 HydrophobicContact CD2-CD1 3.56Å; L1480-L1506 HydrophobicContact CD2-CD2 4.03Å; L1480-L1506 HydrophobicContact CD2-CG 4.41Å; L1501-L1506 HydrophobicContact CD2-CD2 4.27Å; G1504-L1506 VanDerWaalsContact C-N 3.3Å; G1504-L1506 PolarHBondContact O-N 3.5Å; L1506-I1514 HydrophobicContact CD2-CD1 3.55Å; L1506-I1514 HydrophobicContact CD2-CG1 4.41Å
1507	T	69.5	Low	72.3	Confident	102 Å²	102	60.9 Å²	60.9	63%	0.626	34%	0.338	S	S	*	.			trans	-65.2	155.7	163.6	65.4	0	0	0	0	110.1	K1509 G1510 F1511	T1507-K1509 PolarHBondContact O-N 2.98Å; T1507-K1509 VanDerWaalsContact O-N 3.12Å; T1507-G1510 WeakPolarHBondContact O-CA 3.49Å; T1507-G1510 PolarHBondContact O-N 2.8Å; T1507-G1510 PolarHBondContact OG1-N 3.05Å; T1507-F1511 PolarHBondContact O-N 2.86Å
1508	E	65.3	Low	71.7	Confident	105 Å²	105	61.8 Å²	61.8	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-48.7	-40.4	173.2	179.5	59.7	-142.9	0	0	111.8	Q1512 R1531	E1508-Q1512 WeakPolarHBondContact O-CG 3.13Å; E1508-Q1512 PolarHBondContact O-N 3.47Å; E1508-Q1512 PolarHBondContact OE1-NE2 2.87Å; E1508-R1531 IonicContact OE1-CZ 3.2Å; E1508-R1531 IonicContact OE1-NH1 2.74Å; E1508-R1531 PolarHBondContact OE1-NH1 3.32Å; E1508-R1531 IonicContact OE1-NH2 3.9Å; E1508-R1531 PolarHBondContact OE1-NH2 3.4Å; E1508-R1531 IonicContact OE2-CZ 2.63Å; E1508-R1531 IonicContact OE2-NH1 3.08Å; E1508-R1531 PolarHBondContact OE2-NH1 3.26Å; E1508-R1531 IonicContact OE2-NH2 3.82Å; E1508-R1531 PolarHBondContact OE2-NH2 3.12Å
1509	K	71.2	Confident	71.1	Confident	174 Å²	174	63.4 Å²	63.4	76%	0.757	36%	0.362	S	S	*	.	H	α-helix	trans	-64.6	-42.6	173.7	-75.5	-170.6	174.5	-175	0	113.3	T1507 Q1512 V1513	T1507-K1509 PolarHBondContact O-N 2.98Å; T1507-K1509 VanDerWaalsContact O-N 3.12Å; K1509-Q1512 PolarHBondContact O-N 2.69Å; K1509-V1513 WeakPolarHBondContact O-CG2 3.45Å; K1509-V1513 PolarHBondContact O-N 2.91Å
1510	G	70.7	Confident	70.6	Confident	22 Å²	22	57.9 Å²	57.9	23%	0.227	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-42	178.2	0	0	0	0	0	112.4	T1507 V1513 I1514	T1507-G1510 WeakPolarHBondContact O-CA 3.49Å; T1507-G1510 PolarHBondContact O-N 2.8Å; T1507-G1510 PolarHBondContact OG1-N 3.05Å; G1510-V1513 PolarHBondContact O-N 3.42Å; G1510-I1514 PolarHBondContact O-N 3.03Å
1511	F	74	Confident	69.9	Low	10 Å²	10	60 Å²	60	4%	0.044	35%	0.352	C	S	.	.	H	α-helix	trans	-60	-48.1	172	178.9	-78.4	0	0	0	111.4	L1501 T1507 V1513 I1514 M1515 M1530 R1531	L1501-F1511 HydrophobicContact CB-CD2 4.07Å; L1501-F1511 HydrophobicContact CB-CE2 3.99Å; L1501-F1511 HydrophobicContact CD1-CE2 4.25Å; L1501-F1511 HydrophobicContact CD2-CD2 3.9Å; L1501-F1511 HydrophobicContact CD2-CE2 4.37Å; L1501-F1511 HydrophobicContact CG-CD2 4.41Å; L1501-F1511 HydrophobicContact CG-CE2 4.44Å; T1507-F1511 PolarHBondContact O-N 2.86Å; F1511-V1513 VanDerWaalsContact C-N 3.31Å; F1511-V1513 PolarHBondContact O-N 2.89Å; F1511-I1514 PolarHBondContact O-N 3.36Å; F1511-M1515 HydrophobicContact CD1-CG 3.8Å; F1511-M1515 HydrophobicContact CE1-CB 4.29Å; F1511-M1515 HydrophobicContact CE1-CG 3.29Å; F1511-M1515 HydrophobicContact CE1-SD 4.41Å; F1511-M1515 HydrophobicContact CE2-CG 4.2Å; F1511-M1515 HydrophobicContact CG-CG 4.45Å; F1511-M1515 HydrophobicContact CZ-CE 4.27Å; F1511-M1515 HydrophobicContact CZ-CG 3.5Å; F1511-M1515 HydrophobicContact CZ-SD 4.04Å; F1511-M1515 WeakPolarHBondContact O-CG 3.36Å; F1511-M1515 PolarHBondContact O-N 3.13Å; F1511-M1530 HydrophobicContact CE2-CB 4.29Å; F1511-M1530 HydrophobicContact CZ-CB 4.28Å; F1511-R1531 HydrophobicContact CD2-CG 4.17Å; F1511-R1531 HydrophobicContact CE1-CG 4.16Å; F1511-R1531 VanDerWaalsContact CE1-NH2 3.32Å; F1511-R1531 HydrophobicContact CE2-CG 3.4Å; F1511-R1531 HydrophobicContact CZ-CG 3.41Å; F1511-R1531 VanDerWaalsContact CZ-CG 3.41Å; F1511-R1531 VanDerWaalsContact CZ-NE 3.31Å
1512	Q	71.5	Confident	69.3	Low	82 Å²	82	65.8 Å²	65.8	38%	0.383	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-35	-179.4	-66.5	-72	-7.8	0	0	112.5	E1508 K1509 S1516	E1508-Q1512 WeakPolarHBondContact O-CG 3.13Å; E1508-Q1512 PolarHBondContact O-N 3.47Å; E1508-Q1512 PolarHBondContact OE1-NE2 2.87Å; K1509-Q1512 PolarHBondContact O-N 2.69Å; Q1512-S1516 VanDerWaalsContact O-CB 3.32Å; Q1512-S1516 WeakPolarHBondContact O-CB 3.29Å; Q1512-S1516 PolarHBondContact O-N 2.98Å
1513	V	74.4	Confident	69.2	Low	82 Å²	82	65.3 Å²	65.3	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-64	-52.3	171.8	169.9	0	0	0	0	110.4	K1509 G1510 F1511 M1515 S1516 D1517	K1509-V1513 WeakPolarHBondContact O-CG2 3.45Å; K1509-V1513 PolarHBondContact O-N 2.91Å; G1510-V1513 PolarHBondContact O-N 3.42Å; F1511-V1513 VanDerWaalsContact C-N 3.31Å; F1511-V1513 PolarHBondContact O-N 2.89Å; V1513-M1515 VanDerWaalsContact C-N 3.33Å; V1513-M1515 PolarHBondContact O-N 3.22Å; V1513-S1516 CarbonylContact O-C 3.57Å; V1513-S1516 WeakPolarHBondContact O-CA 3.5Å; V1513-S1516 WeakPolarHBondContact O-CB 3.47Å; V1513-S1516 PolarHBondContact O-N 3.19Å; V1513-D1517 WeakPolarHBondContact O-CB 3.33Å; V1513-D1517 VanDerWaalsContact O-CG 3.3Å; V1513-D1517 PolarHBondContact O-N 3.41Å
1514	I	74.6	Confident	69.4	Low	8 Å²	8	65.6 Å²	65.6	4%	0.041	39%	0.385	C	S	.	.	H	α-helix	trans	-61.8	-38.8	-179.9	-69.2	-177.1	0	0	0	112.2	V1476 L1480 L1501 L1506 G1510 F1511 S1516 D1517 L1518	V1476-I1514 HydrophobicContact CB-CG2 4.44Å; V1476-I1514 HydrophobicContact CG1-CD1 4.44Å; V1476-I1514 HydrophobicContact CG1-CG2 3.58Å; V1476-I1514 HydrophobicContact CG2-CG1 4.42Å; V1476-I1514 HydrophobicContact CG2-CG2 3.99Å; L1480-I1514 HydrophobicContact CD1-CD1 4.29Å; L1480-I1514 HydrophobicContact CD2-CD1 3.62Å; L1480-I1514 HydrophobicContact CG-CD1 3.84Å; L1501-I1514 HydrophobicContact CD1-CG2 4.38Å; L1501-I1514 HydrophobicContact CD2-CB 4.28Å; L1501-I1514 HydrophobicContact CD2-CD1 4.29Å; L1501-I1514 HydrophobicContact CD2-CG2 4Å; L1506-I1514 HydrophobicContact CD2-CD1 3.55Å; L1506-I1514 HydrophobicContact CD2-CG1 4.41Å; G1510-I1514 PolarHBondContact O-N 3.03Å; F1511-I1514 PolarHBondContact O-N 3.36Å; I1514-S1516 VanDerWaalsContact C-N 3.32Å; I1514-S1516 PolarHBondContact O-N 3.07Å; I1514-D1517 PolarHBondContact O-N 2.81Å; I1514-L1518 HydrophobicContact CG2-CD1 3.86Å; I1514-L1518 HydrophobicContact CG2-CG 4.23Å; I1514-L1518 WeakPolarHBondContact O-CB 3.37Å; I1514-L1518 VanDerWaalsContact O-CG 3.31Å; I1514-L1518 WeakPolarHBondContact O-CG 3.29Å; I1514-L1518 PolarHBondContact O-N 3.33Å
1515	M	70.6	Confident	69.7	Low	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-70.9	-27.6	175.1	-66.1	-59.7	-81.5	0	0	112.8	L1501 F1511 V1513 G1519 L1520 S1521 N1527 M1530	L1501-M1515 HydrophobicContact CD1-SD 4.07Å; F1511-M1515 HydrophobicContact CD1-CG 3.8Å; F1511-M1515 HydrophobicContact CE1-CB 4.29Å; F1511-M1515 HydrophobicContact CE1-CG 3.29Å; F1511-M1515 HydrophobicContact CE1-SD 4.41Å; F1511-M1515 HydrophobicContact CE2-CG 4.2Å; F1511-M1515 HydrophobicContact CG-CG 4.45Å; F1511-M1515 HydrophobicContact CZ-CE 4.27Å; F1511-M1515 HydrophobicContact CZ-CG 3.5Å; F1511-M1515 HydrophobicContact CZ-SD 4.04Å; F1511-M1515 WeakPolarHBondContact O-CG 3.36Å; F1511-M1515 PolarHBondContact O-N 3.13Å; V1513-M1515 VanDerWaalsContact C-N 3.33Å; V1513-M1515 PolarHBondContact O-N 3.22Å; M1515-G1519 PolarHBondContact O-N 2.97Å; M1515-L1520 HydrophobicContact CB-CB 4.49Å; M1515-L1520 HydrophobicContact CE-CB 3.5Å; M1515-L1520 HydrophobicContact CE-CD1 3.73Å; M1515-L1520 HydrophobicContact CE-CG 4.27Å; M1515-L1520 CarbonylContact O-C 3.11Å; M1515-L1520 WeakPolarHBondContact O-CA 3.42Å; M1515-L1520 PolarHBondContact O-N 2.92Å; M1515-L1520 HydrophobicContact SD-CB 4.19Å; M1515-L1520 HydrophobicContact SD-CD1 3.83Å; M1515-S1521 PolarHBondContact O-N 2.93Å; M1515-N1527 WeakPolarHBondContact CE-OD1 3.29Å; M1515-M1530 HydrophobicContact CE-CB 4.1Å; M1515-M1530 HydrophobicContact CE-CG 3.73Å; M1515-M1530 HydrophobicContact SD-CB 4.3Å; M1515-M1530 HydrophobicContact SD-CG 4.15Å
1516	S	72.3	Confident	70	Confident	69 Å²	69	53.8 Å²	53.8	48%	0.483	32%	0.315	S	S	.	.	H	α-helix	trans	-70.1	-44.5	169.9	-170.8	0	0	0	0	111.3	Q1512 V1513 I1514 G1519	Q1512-S1516 VanDerWaalsContact O-CB 3.32Å; Q1512-S1516 WeakPolarHBondContact O-CB 3.29Å; Q1512-S1516 PolarHBondContact O-N 2.98Å; V1513-S1516 CarbonylContact O-C 3.57Å; V1513-S1516 WeakPolarHBondContact O-CA 3.5Å; V1513-S1516 WeakPolarHBondContact O-CB 3.47Å; V1513-S1516 PolarHBondContact O-N 3.19Å; I1514-S1516 VanDerWaalsContact C-N 3.32Å; I1514-S1516 PolarHBondContact O-N 3.07Å; S1516-G1519 PolarHBondContact O-N 2.85Å
1517	D	70.6	Confident	70.5	Confident	74 Å²	74	52.5 Å²	52.5	40%	0.396	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-43	179.7	-76.1	-8.8	0	0	0	111.6	V1472 V1476 V1513 I1514 G1519	V1472-D1517 HydrophobicContact CG1-CB 3.54Å; V1472-D1517 VanDerWaalsContact CG1-O 3.27Å; V1472-D1517 WeakPolarHBondContact CG1-O 3.32Å; V1476-D1517 HydrophobicContact CG2-CB 4.25Å; V1513-D1517 WeakPolarHBondContact O-CB 3.33Å; V1513-D1517 VanDerWaalsContact O-CG 3.3Å; V1513-D1517 PolarHBondContact O-N 3.41Å; I1514-D1517 PolarHBondContact O-N 2.81Å; D1517-G1519 PolarHBondContact O-N 3.42Å
1518	L	68.7	Low	70.8	Confident	19 Å²	19	52.6 Å²	52.6	10%	0.099	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-3.9	173.3	-65.3	175.9	0	0	0	113.9	M1458 L1473 V1476 L1497 I1514 L1520	M1458-L1518 HydrophobicContact CE-CD2 4.45Å; L1473-L1518 HydrophobicContact CD1-CD2 3.82Å; V1476-L1518 HydrophobicContact CB-CD2 4.35Å; V1476-L1518 HydrophobicContact CG1-CD1 4.3Å; V1476-L1518 HydrophobicContact CG1-CD2 4.24Å; V1476-L1518 HydrophobicContact CG1-CG 4.4Å; V1476-L1518 HydrophobicContact CG2-CD2 4.09Å; V1476-L1518 HydrophobicContact CG2-CG 4.2Å; L1497-L1518 HydrophobicContact CD1-CD1 4.16Å; I1514-L1518 HydrophobicContact CG2-CD1 3.86Å; I1514-L1518 HydrophobicContact CG2-CG 4.23Å; I1514-L1518 WeakPolarHBondContact O-CB 3.37Å; I1514-L1518 VanDerWaalsContact O-CG 3.31Å; I1514-L1518 WeakPolarHBondContact O-CG 3.29Å; I1514-L1518 PolarHBondContact O-N 3.33Å; L1518-L1520 HydrophobicContact CB-CD1 3.67Å; L1518-L1520 HydrophobicContact CB-CG 3.72Å; L1518-L1520 HydrophobicContact CD1-CD1 3.98Å; L1518-L1520 WeakPolarHBondContact O-CG 3.35Å
1519	G	70.3	Confident	71.7	Confident	45 Å²	45	48.4 Å²	48.4	46%	0.464	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	26	-179.8	0	0	0	0	0	115.1	M1515 S1516 D1517	M1515-G1519 PolarHBondContact O-N 2.97Å; S1516-G1519 PolarHBondContact O-N 2.85Å; D1517-G1519 PolarHBondContact O-N 3.42Å
1520	L	67.4	Low	72.1	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	24%	0.241	C	C	.	.			trans	-111.2	-8.4	-170.8	-50.3	178.6	0	0	0	114	F1454 M1515 L1518 N1522 V1523 N1527	F1454-L1520 HydrophobicContact CD2-CD1 4.34Å; F1454-L1520 HydrophobicContact CD2-CD2 3.42Å; F1454-L1520 VanDerWaalsContact CD2-CD2 3.42Å; F1454-L1520 HydrophobicContact CE2-CD1 3.56Å; F1454-L1520 HydrophobicContact CE2-CD2 3.52Å; F1454-L1520 HydrophobicContact CE2-CG 4.19Å; F1454-L1520 HydrophobicContact CZ-CD1 4.34Å; M1515-L1520 HydrophobicContact CB-CB 4.49Å; M1515-L1520 HydrophobicContact CE-CB 3.5Å; M1515-L1520 HydrophobicContact CE-CD1 3.73Å; M1515-L1520 HydrophobicContact CE-CG 4.27Å; M1515-L1520 CarbonylContact O-C 3.11Å; M1515-L1520 WeakPolarHBondContact O-CA 3.42Å; M1515-L1520 PolarHBondContact O-N 2.92Å; M1515-L1520 HydrophobicContact SD-CB 4.19Å; M1515-L1520 HydrophobicContact SD-CD1 3.83Å; L1518-L1520 HydrophobicContact CB-CD1 3.67Å; L1518-L1520 HydrophobicContact CB-CG 3.72Å; L1518-L1520 HydrophobicContact CD1-CD1 3.98Å; L1518-L1520 WeakPolarHBondContact O-CG 3.35Å; L1520-N1522 PolarHBondContact O-N 3.42Å; L1520-V1523 PolarHBondContact O-N 3.26Å; L1520-V1523 VanDerWaalsContact O-N 3.14Å; L1520-N1527 PolarHBondContact O-ND2 3.26Å
1521	S	64	Low	72.4	Confident	59 Å²	59	43.3 Å²	43.3	41%	0.413	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.2	-172.3	56.3	0	0	0	0	114.8	M1515	M1515-S1521 PolarHBondContact O-N 2.93Å
1522	N	65.4	Low	72.5	Confident	132 Å²	132	44 Å²	44	71%	0.706	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-15.2	179.8	57.4	-17.2	0	0	0	114.8	L1520	L1520-N1522 PolarHBondContact O-N 3.42Å
1523	V	67.1	Low	72.6	Confident	24 Å²	24	42.9 Å²	42.9	15%	0.145	25%	0.249	C	C	.	.			trans	-105	108.1	-174.1	-177.3	0	0	0	0	111.5	E1450 L1520 S1525 L1526 N1527	E1450-V1523 HydrophobicContact CB-CG1 4.17Å; E1450-V1523 HydrophobicContact CG-CG1 3.84Å; L1520-V1523 PolarHBondContact O-N 3.26Å; L1520-V1523 VanDerWaalsContact O-N 3.14Å; V1523-S1525 WeakPolarHBondContact CG1-OG 3.31Å; V1523-S1525 PolarHBondContact O-N 3.16Å; V1523-L1526 HydrophobicContact CB-CB 4.2Å; V1523-L1526 HydrophobicContact CB-CD1 3.83Å; V1523-L1526 HydrophobicContact CB-CG 4.2Å; V1523-L1526 HydrophobicContact CG1-CB 3.96Å; V1523-L1526 HydrophobicContact CG1-CD1 3.61Å; V1523-L1526 HydrophobicContact CG1-CG 3.62Å; V1523-L1526 HydrophobicContact CG2-CD1 4.21Å; V1523-N1527 WeakPolarHBondContact O-CB 3.47Å; V1523-N1527 PolarHBondContact O-N 3.35Å; V1523-N1527 PolarHBondContact O-ND2 3.37Å
1524	A	71.4	Confident	72.4	Confident	64 Å²	64	42.7 Å²	42.7	53%	0.529	25%	0.252	S	S	.	.	H	α-helix	trans	-67.9	-32.8	-173.5	0	0	0	0	0	113.9	R1528	A1524-R1528 WeakPolarHBondContact O-CG 3.42Å; A1524-R1528 PolarHBondContact O-N 2.93Å
1525	S	73.6	Confident	71.9	Confident	4 Å²	4	45 Å²	45	3%	0.028	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-46.6	178.1	58.1	0	0	0	0	111.9	E1450 V1523 R1528 Y1529	E1450-S1525 PolarHBondContact OE2-OG 2.82Å; V1523-S1525 WeakPolarHBondContact CG1-OG 3.31Å; V1523-S1525 PolarHBondContact O-N 3.16Å; S1525-R1528 WeakPolarHBondContact O-CB 3.39Å; S1525-R1528 PolarHBondContact O-N 3.32Å; S1525-Y1529 PolarHBondContact O-N 3.29Å
1526	L	73.7	Confident	72	Confident	3 Å²	3	49 Å²	49	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-67	-42.1	174.2	-62.3	172.3	0	0	0	111.8	F1437 I1441 F1454 V1523 R1528 Y1529 M1530	F1437-L1526 HydrophobicContact CZ-CD2 4.12Å; I1441-L1526 HydrophobicContact CD1-CD2 3.72Å; I1441-L1526 HydrophobicContact CG1-CD2 4.19Å; F1454-L1526 HydrophobicContact CB-CD1 3.63Å; F1454-L1526 HydrophobicContact CB-CD2 4.03Å; F1454-L1526 HydrophobicContact CD1-CD1 4.44Å; F1454-L1526 HydrophobicContact CD1-CD2 3.6Å; F1454-L1526 HydrophobicContact CD2-CD1 3.95Å; F1454-L1526 HydrophobicContact CD2-CD2 4.45Å; F1454-L1526 HydrophobicContact CE1-CD2 4.06Å; F1454-L1526 HydrophobicContact CG-CD1 3.76Å; F1454-L1526 HydrophobicContact CG-CD2 3.77Å; F1454-L1526 HydrophobicContact CG-CG 4.43Å; V1523-L1526 HydrophobicContact CB-CB 4.2Å; V1523-L1526 HydrophobicContact CB-CD1 3.83Å; V1523-L1526 HydrophobicContact CB-CG 4.2Å; V1523-L1526 HydrophobicContact CG1-CB 3.96Å; V1523-L1526 HydrophobicContact CG1-CD1 3.61Å; V1523-L1526 HydrophobicContact CG1-CG 3.62Å; V1523-L1526 HydrophobicContact CG2-CD1 4.21Å; L1526-R1528 PolarHBondContact O-N 3.08Å; L1526-Y1529 WeakPolarHBondContact O-CB 3.32Å; L1526-Y1529 PolarHBondContact O-N 2.97Å; L1526-Y1529 VanDerWaalsContact O-N 3.08Å; L1526-M1530 WeakPolarHBondContact O-CG 3.43Å; L1526-M1530 PolarHBondContact O-N 3.41Å
1527	N	74.1	Confident	72.1	Confident	21 Å²	21	46.5 Å²	46.5	11%	0.112	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-31.7	173.8	-84.1	-71.5	0	0	0	113.1	M1515 L1520 V1523 R1531	M1515-N1527 WeakPolarHBondContact CE-OD1 3.29Å; L1520-N1527 PolarHBondContact O-ND2 3.26Å; V1523-N1527 WeakPolarHBondContact O-CB 3.47Å; V1523-N1527 PolarHBondContact O-N 3.35Å; V1523-N1527 PolarHBondContact O-ND2 3.37Å; N1527-R1531 WeakPolarHBondContact O-CD 3.5Å; N1527-R1531 VanDerWaalsContact O-CG 3.31Å; N1527-R1531 WeakPolarHBondContact O-CG 3.17Å
1528	R	76	Confident	72.1	Confident	104 Å²	104	47.3 Å²	47.3	39%	0.392	27%	0.268	S	S	.	.	H	α-helix	trans	-69.3	-52.7	168.4	-71.5	165.5	177.8	173.6	-1	110.7	L1444 A1524 S1525 L1526 M1530 R1531 L1532	L1444-R1528 HydrophobicContact CD1-CB 4.41Å; L1444-R1528 PolarHBondContact O-NH1 3.4Å; A1524-R1528 WeakPolarHBondContact O-CG 3.42Å; A1524-R1528 PolarHBondContact O-N 2.93Å; S1525-R1528 WeakPolarHBondContact O-CB 3.39Å; S1525-R1528 PolarHBondContact O-N 3.32Å; L1526-R1528 PolarHBondContact O-N 3.08Å; R1528-M1530 VanDerWaalsContact C-N 3.34Å; R1528-M1530 PolarHBondContact O-N 3.05Å; R1528-R1531 PolarHBondContact O-N 3.13Å; R1528-L1532 WeakPolarHBondContact O-CG 3.31Å; R1528-L1532 PolarHBondContact O-N 3.03Å; R1528-L1532 VanDerWaalsContact O-N 3.11Å
1529	Y	83.3	Confident	72.1	Confident	17 Å²	17	50.4 Å²	50.4	7%	0.067	29%	0.287	C	S	.	.	H	α-helix	trans	-51.8	-48.8	-177.8	-172.7	-90.6	0	0	0	112.7	F1437 K1440 I1441 L1444 I1494 Q1498 S1525 L1526 R1531 L1532 M1537 L1540	F1437-Y1529 HydrophobicContact CE2-CD1 4.35Å; F1437-Y1529 AromaticContact CE2-CE1 3.91Å; F1437-Y1529 HydrophobicContact CE2-CE1 3.91Å; F1437-Y1529 HydrophobicContact CE2-CE2 4.19Å; F1437-Y1529 AromaticContact CE2-CZ 3.82Å; K1440-Y1529 HydrophobicContact CB-CD2 4.44Å; K1440-Y1529 HydrophobicContact CB-CE2 4Å; K1440-Y1529 HydrophobicContact CD-CE2 3.9Å; I1441-Y1529 HydrophobicContact CD1-CD2 3.8Å; I1441-Y1529 HydrophobicContact CD1-CG 3.92Å; L1444-Y1529 HydrophobicContact CD1-CD2 3.88Å; L1444-Y1529 HydrophobicContact CD1-CG 4.29Å; I1494-Y1529 HydrophobicContact CG2-CE1 3.83Å; Q1498-Y1529 HydrophobicContact CG-CE1 4.4Å; Q1498-Y1529 WeakPolarHBondContact CG-O 3.37Å; S1525-Y1529 PolarHBondContact O-N 3.29Å; L1526-Y1529 WeakPolarHBondContact O-CB 3.32Å; L1526-Y1529 PolarHBondContact O-N 2.97Å; L1526-Y1529 VanDerWaalsContact O-N 3.08Å; Y1529-R1531 PolarHBondContact O-N 3.16Å; Y1529-R1531 VanDerWaalsContact O-N 3.15Å; Y1529-L1532 PolarHBondContact O-N 3.26Å; Y1529-M1537 HydrophobicContact CD1-CE 4.38Å; Y1529-M1537 HydrophobicContact CD2-CE 3.85Å; Y1529-M1537 HydrophobicContact CD2-SD 4.44Å; Y1529-M1537 HydrophobicContact CE1-CE 4.08Å; Y1529-M1537 HydrophobicContact CE2-CE 3.53Å; Y1529-M1537 HydrophobicContact CE2-SD 3.73Å; Y1529-M1537 HydrophobicContact CG-CE 4.27Å; Y1529-L1540 HydrophobicContact CD2-CD2 4.09Å; Y1529-L1540 HydrophobicContact CE2-CD2 4.24Å
1530	M	80.3	Confident	72.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-8.9	-179.9	-56.8	-53.1	-74.1	0	0	114.3	F1454 I1494 L1497 Q1498 L1501 F1511 M1515 L1526 R1528	F1454-M1530 HydrophobicContact CZ-SD 4.3Å; I1494-M1530 HydrophobicContact CG2-SD 4.43Å; L1497-M1530 HydrophobicContact CB-CE 3.59Å; Q1498-M1530 HydrophobicContact CB-CE 3.92Å; Q1498-M1530 HydrophobicContact CB-SD 4.05Å; L1501-M1530 HydrophobicContact CD1-CB 4.26Å; L1501-M1530 HydrophobicContact CD1-CE 4.04Å; F1511-M1530 HydrophobicContact CE2-CB 4.29Å; F1511-M1530 HydrophobicContact CZ-CB 4.28Å; M1515-M1530 HydrophobicContact CE-CB 4.1Å; M1515-M1530 HydrophobicContact CE-CG 3.73Å; M1515-M1530 HydrophobicContact SD-CB 4.3Å; M1515-M1530 HydrophobicContact SD-CG 4.15Å; L1526-M1530 WeakPolarHBondContact O-CG 3.43Å; L1526-M1530 PolarHBondContact O-N 3.41Å; R1528-M1530 VanDerWaalsContact C-N 3.34Å; R1528-M1530 PolarHBondContact O-N 3.05Å
1531	R	77.5	Confident	72.9	Confident	89 Å²	89	50.1 Å²	50.1	34%	0.336	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-16.3	177.2	-71.2	-179	-178.6	-134.2	5.3	114.5	E1508 F1511 N1527 R1528 Y1529 T1533	E1508-R1531 IonicContact OE1-CZ 3.2Å; E1508-R1531 IonicContact OE1-NH1 2.74Å; E1508-R1531 PolarHBondContact OE1-NH1 3.32Å; E1508-R1531 IonicContact OE1-NH2 3.9Å; E1508-R1531 PolarHBondContact OE1-NH2 3.4Å; E1508-R1531 IonicContact OE2-CZ 2.63Å; E1508-R1531 IonicContact OE2-NH1 3.08Å; E1508-R1531 PolarHBondContact OE2-NH1 3.26Å; E1508-R1531 IonicContact OE2-NH2 3.82Å; E1508-R1531 PolarHBondContact OE2-NH2 3.12Å; F1511-R1531 HydrophobicContact CD2-CG 4.17Å; F1511-R1531 HydrophobicContact CE1-CG 4.16Å; F1511-R1531 VanDerWaalsContact CE1-NH2 3.32Å; F1511-R1531 HydrophobicContact CE2-CG 3.4Å; F1511-R1531 HydrophobicContact CZ-CG 3.41Å; F1511-R1531 VanDerWaalsContact CZ-CG 3.41Å; F1511-R1531 VanDerWaalsContact CZ-NE 3.31Å; N1527-R1531 WeakPolarHBondContact O-CD 3.5Å; N1527-R1531 VanDerWaalsContact O-CG 3.31Å; N1527-R1531 WeakPolarHBondContact O-CG 3.17Å; R1528-R1531 PolarHBondContact O-N 3.13Å; Y1529-R1531 PolarHBondContact O-N 3.16Å; Y1529-R1531 VanDerWaalsContact O-N 3.15Å; R1531-T1533 PolarHBondContact O-N 3.25Å
1532	L	77	Confident	73	Confident	23 Å²	23	52 Å²	52	12%	0.12	28%	0.28	C	S	.	.			trans	-56.4	131.9	-176.6	-66	-177.1	0	0	0	110.1	L1444 Q1498 R1528 Y1529 E1536 M1537 L1540	L1444-L1532 HydrophobicContact CD1-CD1 4.05Å; L1444-L1532 HydrophobicContact CD2-CD1 4.07Å; L1444-L1532 HydrophobicContact CD2-CD2 4.49Å; Q1498-L1532 PolarHBondContact NE2-O 3.43Å; R1528-L1532 WeakPolarHBondContact O-CG 3.31Å; R1528-L1532 PolarHBondContact O-N 3.03Å; R1528-L1532 VanDerWaalsContact O-N 3.11Å; Y1529-L1532 PolarHBondContact O-N 3.26Å; L1532-E1536 HydrophobicContact CB-CB 4.13Å; L1532-E1536 HydrophobicContact CD2-CB 4.08Å; L1532-M1537 HydrophobicContact CB-CE 4.04Å; L1532-M1537 HydrophobicContact CD1-CE 3.87Å; L1532-M1537 HydrophobicContact CG-CE 4.47Å; L1532-L1540 HydrophobicContact CD1-CD2 3.73Å
1533	T	73.1	Confident	73.1	Confident	59 Å²	59	51.1 Å²	51.1	36%	0.362	27%	0.27	S	S	.	.			trans	-66.3	159.9	169.9	59	0	0	0	0	110.4	R1531 D1535 E1536 M1537	R1531-T1533 PolarHBondContact O-N 3.25Å; T1533-D1535 PolarHBondContact O-N 3.18Å; T1533-E1536 WeakPolarHBondContact CB-OE2 3.41Å; T1533-E1536 PolarHBondContact N-OE2 2.89Å; T1533-E1536 PolarHBondContact O-N 2.82Å; T1533-E1536 VanDerWaalsContact OG1-CD 3.26Å; T1533-E1536 WeakPolarHBondContact OG1-CG 3.41Å; T1533-E1536 PolarHBondContact OG1-OE2 3.14Å; T1533-M1537 PolarHBondContact O-N 2.97Å
1534	S	68.7	Low	73.3	Confident	79 Å²	79	50 Å²	50	55%	0.552	26%	0.263	S	S	*	.	H	α-helix	trans	-49.6	-44.4	-179.5	-45.9	0	0	0	0	112.8	M1537 D1538	S1534-M1537 WeakPolarHBondContact O-CB 3.08Å; S1534-M1537 PolarHBondContact O-N 3.36Å; S1534-D1538 PolarHBondContact O-N 3.13Å
1535	D	64.1	Low	72.9	Confident	56 Å²	56	53.1 Å²	53.1	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-70.4	-32.6	-179.7	-1.6	-66.8	0	0	0	113.3	K333 T1533 D1538 V1539	K333-D1535 HydrophobicContact CD-CB 4.19Å; K333-D1535 WeakPolarHBondContact CD-OD1 3.45Å; K333-D1535 IonicContact NZ-OD1 2.67Å; K333-D1535 PolarHBondContact NZ-OD1 3.43Å; K333-D1535 IonicContact NZ-OD2 3.64Å; K333-D1535 PolarHBondContact NZ-OD2 3.25Å; T1533-D1535 PolarHBondContact O-N 3.18Å; D1535-D1538 PolarHBondContact O-N 2.8Å; D1535-V1539 WeakPolarHBondContact O-CG2 3.26Å; D1535-V1539 PolarHBondContact O-N 3.3Å
1536	E	72.7	Confident	71.8	Confident	85 Å²	85	62.8 Å²	62.8	40%	0.397	30%	0.301	S	S	.	.	H	α-helix	trans	-72.1	-34.6	173.4	-68	167.3	133.4	0	0	111.3	L1532 T1533 V1539 L1540	L1532-E1536 HydrophobicContact CB-CB 4.13Å; L1532-E1536 HydrophobicContact CD2-CB 4.08Å; T1533-E1536 WeakPolarHBondContact CB-OE2 3.41Å; T1533-E1536 PolarHBondContact N-OE2 2.89Å; T1533-E1536 PolarHBondContact O-N 2.82Å; T1533-E1536 VanDerWaalsContact OG1-CD 3.26Å; T1533-E1536 WeakPolarHBondContact OG1-CG 3.41Å; T1533-E1536 PolarHBondContact OG1-OE2 3.14Å; E1536-V1539 PolarHBondContact O-N 3.36Å; E1536-L1540 WeakPolarHBondContact O-CB 3.42Å; E1536-L1540 PolarHBondContact O-N 3.32Å
1537	M	74.4	Confident	71.1	Confident	16 Å²	16	64.7 Å²	64.7	8%	0.079	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-40.5	171.1	-168.4	57.2	67.7	0	0	111.2	K1440 Q1498 Y1529 L1532 T1533 S1534 L1540 N1541	K1440-M1537 HydrophobicContact CD-SD 4.4Å; Q1498-M1537 HydrophobicContact CG-CE 4.26Å; Y1529-M1537 HydrophobicContact CD1-CE 4.38Å; Y1529-M1537 HydrophobicContact CD2-CE 3.85Å; Y1529-M1537 HydrophobicContact CD2-SD 4.44Å; Y1529-M1537 HydrophobicContact CE1-CE 4.08Å; Y1529-M1537 HydrophobicContact CE2-CE 3.53Å; Y1529-M1537 HydrophobicContact CE2-SD 3.73Å; Y1529-M1537 HydrophobicContact CG-CE 4.27Å; L1532-M1537 HydrophobicContact CB-CE 4.04Å; L1532-M1537 HydrophobicContact CD1-CE 3.87Å; L1532-M1537 HydrophobicContact CG-CE 4.47Å; T1533-M1537 PolarHBondContact O-N 2.97Å; S1534-M1537 WeakPolarHBondContact O-CB 3.08Å; S1534-M1537 PolarHBondContact O-N 3.36Å; M1537-L1540 CarbonylContact O-C 3.57Å; M1537-L1540 WeakPolarHBondContact O-CB 3.43Å; M1537-L1540 PolarHBondContact O-N 3.49Å; M1537-L1540 VanDerWaalsContact O-N 3.11Å; M1537-L1540 HydrophobicContact SD-CD2 4.19Å; M1537-N1541 WeakPolarHBondContact O-CB 3.34Å; M1537-N1541 PolarHBondContact O-N 2.61Å; M1537-N1541 PolarHBondContact O-ND2 3.3Å
1538	D	70.8	Confident	70.5	Confident	91 Å²	91	64 Å²	64	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-66.2	-36.8	174.7	-78.5	-26.5	0	0	0	113.1	S1534 D1535 L1540 N1541 N1542	S1534-D1538 PolarHBondContact O-N 3.13Å; D1535-D1538 PolarHBondContact O-N 2.8Å; D1538-L1540 VanDerWaalsContact C-N 3.3Å; D1538-L1540 PolarHBondContact O-N 2.81Å; D1538-N1541 PolarHBondContact OD1-ND2 3.35Å; D1538-N1542 WeakPolarHBondContact O-CB 3.41Å; D1538-N1542 VanDerWaalsContact O-CG 3.32Å; D1538-N1542 PolarHBondContact O-N 2.97Å; D1538-N1542 PolarHBondContact O-ND2 2.98Å
1539	V	68.5	Low	70.4	Confident	84 Å²	84	61.4 Å²	61.4	51%	0.509	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-39	169.5	170.6	0	0	0	0	111.1	D1535 E1536 K1543	D1535-V1539 WeakPolarHBondContact O-CG2 3.26Å; D1535-V1539 PolarHBondContact O-N 3.3Å; E1536-V1539 PolarHBondContact O-N 3.36Å; V1539-K1543 HydrophobicContact CG1-CD 4.42Å; V1539-K1543 WeakPolarHBondContact O-CG 3.45Å; V1539-K1543 PolarHBondContact O-N 3.25Å
1540	L	78.7	Confident	69.7	Low	10 Å²	10	60.7 Å²	60.7	5%	0.052	30%	0.299	C	S	.	.	H	α-helix	trans	-70.5	-42.8	178.2	-162.1	71.5	0	0	0	112.2	K1440 L1443 L1444 Y1529 L1532 E1536 M1537 D1538 N1542 K1543 S1544	K1440-L1540 HydrophobicContact CB-CD2 3.66Å; K1440-L1540 HydrophobicContact CB-CG 4.1Å; K1440-L1540 HydrophobicContact CD-CD2 4.44Å; K1440-L1540 HydrophobicContact CG-CD2 3.88Å; K1440-L1540 HydrophobicContact CG-CG 3.97Å; L1443-L1540 HydrophobicContact CB-CD1 3.58Å; L1443-L1540 HydrophobicContact CD1-CD1 4.36Å; L1444-L1540 HydrophobicContact CD1-CD2 3.81Å; L1444-L1540 HydrophobicContact CD2-CD1 3.89Å; L1444-L1540 HydrophobicContact CD2-CD2 4.19Å; L1444-L1540 HydrophobicContact CG-CD1 4.01Å; L1444-L1540 HydrophobicContact CG-CD2 3.92Å; Y1529-L1540 HydrophobicContact CD2-CD2 4.09Å; Y1529-L1540 HydrophobicContact CE2-CD2 4.24Å; L1532-L1540 HydrophobicContact CD1-CD2 3.73Å; E1536-L1540 WeakPolarHBondContact O-CB 3.42Å; E1536-L1540 PolarHBondContact O-N 3.32Å; M1537-L1540 CarbonylContact O-C 3.57Å; M1537-L1540 WeakPolarHBondContact O-CB 3.43Å; M1537-L1540 PolarHBondContact O-N 3.49Å; M1537-L1540 VanDerWaalsContact O-N 3.11Å; M1537-L1540 HydrophobicContact SD-CD2 4.19Å; D1538-L1540 VanDerWaalsContact C-N 3.3Å; D1538-L1540 PolarHBondContact O-N 2.81Å; L1540-N1542 VanDerWaalsContact C-N 3.33Å; L1540-N1542 PolarHBondContact O-N 3.39Å; L1540-K1543 PolarHBondContact O-N 2.66Å; L1540-S1544 WeakPolarHBondContact O-CB 3.28Å; L1540-S1544 PolarHBondContact O-N 2.89Å
1541	N	76.7	Confident	69.2	Low	33 Å²	33	63 Å²	63	18%	0.176	31%	0.313	C	S	.	.	H	α-helix	trans	-56.1	-46.7	173.2	-70.8	-29.4	0	0	0	110.9	K1440 M1537 D1538 S1544 K1545	K1440-N1541 WeakPolarHBondContact CE-OD1 3.5Å; K1440-N1541 PolarHBondContact NZ-OD1 3.24Å; M1537-N1541 WeakPolarHBondContact O-CB 3.34Å; M1537-N1541 PolarHBondContact O-N 2.61Å; M1537-N1541 PolarHBondContact O-ND2 3.3Å; D1538-N1541 PolarHBondContact OD1-ND2 3.35Å; N1541-S1544 PolarHBondContact O-N 3.5Å; N1541-K1545 WeakPolarHBondContact O-CG 3.38Å; N1541-K1545 PolarHBondContact O-N 2.85Å; N1541-K1545 VanDerWaalsContact O-N 3.12Å
1542	N	65.1	Low	68.5	Low	97 Å²	97	63.6 Å²	63.6	52%	0.519	32%	0.32	S	S	.	.	H	α-helix	trans	-70.9	-29.9	179.5	-73.1	-44.4	0	0	0	113.1	D1538 L1540 R1546	D1538-N1542 WeakPolarHBondContact O-CB 3.41Å; D1538-N1542 VanDerWaalsContact O-CG 3.32Å; D1538-N1542 PolarHBondContact O-N 2.97Å; D1538-N1542 PolarHBondContact O-ND2 2.98Å; L1540-N1542 VanDerWaalsContact C-N 3.33Å; L1540-N1542 PolarHBondContact O-N 3.39Å; N1542-R1546 WeakPolarHBondContact O-CG 3.38Å
1543	K	68.7	Low	67.8	Low	115 Å²	115	70.2 Å²	70.2	50%	0.5	35%	0.35	S	S	.	.	H	α-helix	trans	-73.4	-39	169.5	-74.4	179	179.5	-177.8	0	112.4	L1443 V1539 L1540 R1546 M1547	L1443-K1543 HydrophobicContact CD1-CB 3.62Å; L1443-K1543 HydrophobicContact CD2-CB 4.14Å; L1443-K1543 HydrophobicContact CD2-CD 4.47Å; V1539-K1543 HydrophobicContact CG1-CD 4.42Å; V1539-K1543 WeakPolarHBondContact O-CG 3.45Å; V1539-K1543 PolarHBondContact O-N 3.25Å; L1540-K1543 PolarHBondContact O-N 2.66Å; K1543-R1546 WeakPolarHBondContact O-CB 3.24Å; K1543-R1546 PolarHBondContact O-N 3Å; K1543-R1546 VanDerWaalsContact O-N 3.12Å; K1543-M1547 PolarHBondContact O-N 3.13Å
1544	S	72	Confident	67.4	Low	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.1	-48.8	178.6	174.3	0	0	0	0	111.8	D1436 N1439 L1540 N1541 R1546 M1547	D1436-S1544 PolarHBondContact O-OG 3.47Å; D1436-S1544 VanDerWaalsContact OD1-CB 3.26Å; D1436-S1544 WeakPolarHBondContact OD1-CB 3.4Å; D1436-S1544 PolarHBondContact OD1-OG 2.89Å; N1439-S1544 WeakPolarHBondContact CB-OG 3.48Å; N1439-S1544 PolarHBondContact ND2-O 3.23Å; L1540-S1544 WeakPolarHBondContact O-CB 3.28Å; L1540-S1544 PolarHBondContact O-N 2.89Å; N1541-S1544 PolarHBondContact O-N 3.5Å; S1544-R1546 PolarHBondContact O-N 2.67Å; S1544-R1546 VanDerWaalsContact O-N 3.16Å; S1544-M1547 PolarHBondContact O-N 3.37Å
1545	K	61.8	Low	67.2	Low	129 Å²	129	65.2 Å²	65.2	56%	0.561	32%	0.315	S	S	*	.	H	α-helix	trans	-54.2	-34.6	175.2	-71.4	171.3	-179.3	178	0	112.7	N1541 M1547 G1548 I1549	N1541-K1545 WeakPolarHBondContact O-CG 3.38Å; N1541-K1545 PolarHBondContact O-N 2.85Å; N1541-K1545 VanDerWaalsContact O-N 3.12Å; K1545-M1547 VanDerWaalsContact C-N 3.3Å; K1545-M1547 PolarHBondContact O-N 3.21Å; K1545-G1548 PolarHBondContact O-N 3.19Å; K1545-I1549 HydrophobicContact CG-CD1 3.8Å
1546	R	50.5	Low	67.2	Low	208 Å²	208	66.2 Å²	66.2	79%	0.785	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-4.4	177.5	-69.5	-178.7	61.9	167	1.1	115	N1542 K1543 S1544	N1542-R1546 WeakPolarHBondContact O-CG 3.38Å; K1543-R1546 WeakPolarHBondContact O-CB 3.24Å; K1543-R1546 PolarHBondContact O-N 3Å; K1543-R1546 VanDerWaalsContact O-N 3.12Å; S1544-R1546 PolarHBondContact O-N 2.67Å; S1544-R1546 VanDerWaalsContact O-N 3.16Å
1547	M	58.4	Low	66.5	Low	43 Å²	43	62.6 Å²	62.6	21%	0.212	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	9.6	172	-55.6	-156.2	-51.1	0	0	113	F1407 K1415 N1439 K1442 L1443 K1543 S1544 K1545	F1407-M1547 WeakPolarHBondContact CE2-O 3.1Å; K1415-M1547 PolarHBondContact NZ-O 3.45Å; N1439-M1547 HydrophobicContact CB-CE 3.57Å; N1439-M1547 VanDerWaalsContact O-CE 3.23Å; N1439-M1547 WeakPolarHBondContact O-CE 3.48Å; K1442-M1547 HydrophobicContact CB-CE 4.35Å; L1443-M1547 HydrophobicContact CD1-CE 3.81Å; L1443-M1547 HydrophobicContact CD1-CG 4.48Å; L1443-M1547 HydrophobicContact CD1-SD 4.12Å; L1443-M1547 HydrophobicContact CD2-CE 4.34Å; L1443-M1547 HydrophobicContact CD2-SD 3.78Å; L1443-M1547 HydrophobicContact CG-CE 3.65Å; L1443-M1547 HydrophobicContact CG-SD 3.78Å; K1543-M1547 PolarHBondContact O-N 3.13Å; S1544-M1547 PolarHBondContact O-N 3.37Å; K1545-M1547 VanDerWaalsContact C-N 3.3Å; K1545-M1547 PolarHBondContact O-N 3.21Å
1548	G	63.3	Low	66.1	Low	7 Å²	7	62 Å²	62	7%	0.072	30%	0.301	C	S	.	.			trans	71.9	124.5	-172.4	0	0	0	0	0	112.3	K1415 N1439 K1545	K1415-G1548 PolarHBondContact NZ-O 2.93Å; N1439-G1548 PolarHBondContact ND2-O 3.13Å; K1545-G1548 PolarHBondContact O-N 3.19Å
1549	I	72.1	Confident	65.7	Low	49 Å²	49	59.8 Å²	59.8	25%	0.251	29%	0.289	S	S	.	.			trans	-100.3	125	170.2	-65	171.4	0	0	0	106.8	A1432 D1436 K1545	A1432-I1549 HydrophobicContact CB-CG2 3.9Å; A1432-I1549 WeakPolarHBondContact O-CG2 3.25Å; D1436-I1549 HydrophobicContact CB-CD1 4Å; D1436-I1549 HydrophobicContact CB-CG1 4.28Å; K1545-I1549 HydrophobicContact CG-CD1 3.8Å
1550	V	69.5	Low	65.1	Low	1 Å²	1	58.5 Å²	58.5	1%	0.006	28%	0.279	C	S	.	.			trans	-74	132.9	177.7	174.1	0	0	0	0	110.1	K1415 V1416 V1419 A1432 S1435 D1554 V1555	K1415-V1550 HydrophobicContact CD-CG2 4.28Å; K1415-V1550 HydrophobicContact CG-CG2 4.13Å; V1416-V1550 HydrophobicContact CB-CG1 4.43Å; V1416-V1550 HydrophobicContact CG1-CG1 4.39Å; V1416-V1550 HydrophobicContact CG2-CG1 4.06Å; V1416-V1550 HydrophobicContact CG2-CG2 4.03Å; V1419-V1550 HydrophobicContact CB-CB 4.26Å; V1419-V1550 HydrophobicContact CB-CG1 4.29Å; V1419-V1550 HydrophobicContact CB-CG2 4.4Å; V1419-V1550 HydrophobicContact CG1-CB 4.14Å; V1419-V1550 HydrophobicContact CG1-CG1 4.22Å; V1419-V1550 HydrophobicContact CG2-CB 4.34Å; V1419-V1550 HydrophobicContact CG2-CG2 4.12Å; A1432-V1550 WeakPolarHBondContact CA-O 3.45Å; A1432-V1550 PolarHBondContact N-O 2.73Å; S1435-V1550 PolarHBondContact OG-N 2.99Å; V1550-D1554 HydrophobicContact CG1-CB 4.4Å; V1550-V1555 HydrophobicContact CG1-CG2 4.33Å
1551	T	69.9	Low	63.9	Low	49 Å²	49	59.2 Å²	59.2	30%	0.301	28%	0.282	S	S	.	.			trans	-114.3	173.1	179.7	71.8	0	0	0	0	111.9	E1553 D1554 V1555	T1551-E1553 VanDerWaalsContact C-N 3.32Å; T1551-E1553 PolarHBondContact OG1-N 3.03Å; T1551-D1554 WeakPolarHBondContact CB-OD2 3.41Å; T1551-D1554 PolarHBondContact N-OD2 3.21Å; T1551-D1554 PolarHBondContact O-N 3.1Å; T1551-D1554 PolarHBondContact OG1-N 3.12Å; T1551-D1554 PolarHBondContact OG1-OD2 3.41Å; T1551-V1555 PolarHBondContact O-N 2.57Å
1552	Q	62.8	Low	62.9	Low	102 Å²	102	62.5 Å²	62.5	48%	0.477	30%	0.296	S	S	.	.	H	α-helix	trans	-67.4	-31.4	173.7	-172.4	62.2	64.3	0	0	112.6	L1431 D1554 V1555 N1556	L1431-Q1552 HydrophobicContact CD1-CB 4.12Å; L1431-Q1552 VanDerWaalsContact CD1-OE1 3.25Å; Q1552-D1554 VanDerWaalsContact C-N 3.29Å; Q1552-D1554 PolarHBondContact O-N 3.15Å; Q1552-V1555 PolarHBondContact O-N 3.11Å; Q1552-N1556 PolarHBondContact NE2-OD1 3.32Å; Q1552-N1556 PolarHBondContact O-N 3.31Å; Q1552-N1556 PolarHBondContact O-ND2 2.84Å; Q1552-N1556 PolarHBondContact O-OD1 2.91Å
1553	E	63	Low	62.2	Low	161 Å²	161	64.2 Å²	64.2	75%	0.752	30%	0.301	S	S	*	.	H	α-helix	trans	-64.9	-36.5	176.1	-63.1	-163.9	128.8	0	0	111.5	T1551 N1556 L1557	T1551-E1553 VanDerWaalsContact C-N 3.32Å; T1551-E1553 PolarHBondContact OG1-N 3.03Å; E1553-N1556 PolarHBondContact O-N 3.2Å; E1553-L1557 WeakPolarHBondContact O-CB 3.39Å; E1553-L1557 PolarHBondContact O-N 3.24Å
1554	D	63.4	Low	61.1	Low	26 Å²	26	59.5 Å²	59.5	14%	0.139	28%	0.283	C	S	.	.	H	α-helix	trans	-67.6	-41.6	177.8	-56	-40.2	0	0	0	112.2	Y1412 V1416 V1550 T1551 Q1552 N1556 L1557 V1558	Y1412-D1554 WeakPolarHBondContact OH-CB 3.3Å; Y1412-D1554 PolarHBondContact OH-OD1 2.75Å; Y1412-D1554 PolarHBondContact OH-OD2 3.18Å; V1416-D1554 HydrophobicContact CG2-CB 4.14Å; V1550-D1554 HydrophobicContact CG1-CB 4.4Å; T1551-D1554 WeakPolarHBondContact CB-OD2 3.41Å; T1551-D1554 PolarHBondContact N-OD2 3.21Å; T1551-D1554 PolarHBondContact O-N 3.1Å; T1551-D1554 PolarHBondContact OG1-N 3.12Å; T1551-D1554 PolarHBondContact OG1-OD2 3.41Å; Q1552-D1554 VanDerWaalsContact C-N 3.29Å; Q1552-D1554 PolarHBondContact O-N 3.15Å; D1554-N1556 VanDerWaalsContact C-N 3.3Å; D1554-N1556 PolarHBondContact O-N 3.43Å; D1554-L1557 PolarHBondContact O-N 2.93Å; D1554-V1558 PolarHBondContact O-N 2.99Å; D1554-V1558 VanDerWaalsContact O-N 3.11Å
1555	V	65.3	Low	60	Low	8 Å²	8	61.8 Å²	61.8	5%	0.048	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-43.2	172.6	166.2	0	0	0	0	110.6	V1416 R1420 L1431 V1550 T1551 Q1552 V1558 N1559	V1416-V1555 HydrophobicContact CG1-CB 4.44Å; V1416-V1555 HydrophobicContact CG1-CG2 3.86Å; R1420-V1555 HydrophobicContact CB-CG2 4.27Å; R1420-V1555 HydrophobicContact CG-CG1 4.42Å; R1420-V1555 PolarHBondContact NH2-O 3.33Å; L1431-V1555 HydrophobicContact CD1-CB 4.36Å; L1431-V1555 HydrophobicContact CD1-CG2 3.75Å; L1431-V1555 HydrophobicContact CD2-CG2 4.3Å; V1550-V1555 HydrophobicContact CG1-CG2 4.33Å; T1551-V1555 PolarHBondContact O-N 2.57Å; Q1552-V1555 PolarHBondContact O-N 3.11Å; V1555-V1558 PolarHBondContact O-N 2.76Å; V1555-N1559 VanDerWaalsContact O-CG 3.23Å; V1555-N1559 PolarHBondContact O-N 3.21Å; V1555-N1559 PolarHBondContact O-ND2 3.47Å; V1555-N1559 PolarHBondContact O-OD1 3.11Å
1556	N	64.1	Low	59.4	Low	76 Å²	76	60 Å²	60	41%	0.406	29%	0.294	S	S	.	.	H	α-helix	trans	-67.2	-41.6	178.9	-64	-5.6	0	0	0	111.6	Q1552 E1553 D1554 V1558 N1559 D1560	Q1552-N1556 PolarHBondContact NE2-OD1 3.32Å; Q1552-N1556 PolarHBondContact O-N 3.31Å; Q1552-N1556 PolarHBondContact O-ND2 2.84Å; Q1552-N1556 PolarHBondContact O-OD1 2.91Å; E1553-N1556 PolarHBondContact O-N 3.2Å; D1554-N1556 VanDerWaalsContact C-N 3.3Å; D1554-N1556 PolarHBondContact O-N 3.43Å; N1556-V1558 PolarHBondContact O-N 2.8Å; N1556-N1559 WeakPolarHBondContact O-CB 3.29Å; N1556-N1559 PolarHBondContact O-N 3.37Å; N1556-N1559 VanDerWaalsContact O-N 3.11Å; N1556-D1560 PolarHBondContact O-N 3.09Å
1557	L	58.2	Low	59.3	Low	9 Å²	9	54.8 Å²	54.8	5%	0.047	28%	0.281	C	S	.	.	H	α-helix	trans	-54.8	-49.2	172.9	161.9	57.8	0	0	0	112.4	K1395 F1396 V1399 E1553 D1554 N1559 D1560 Y1561	K1395-L1557 HydrophobicContact CB-CD1 3.43Å; K1395-L1557 VanDerWaalsContact CB-CD1 3.43Å; K1395-L1557 HydrophobicContact CB-CD2 3.93Å; K1395-L1557 HydrophobicContact CB-CG 4.26Å; K1395-L1557 HydrophobicContact CD-CD1 3.77Å; K1395-L1557 HydrophobicContact CG-CD1 4.24Å; F1396-L1557 HydrophobicContact CD1-CD2 4.22Å; F1396-L1557 HydrophobicContact CD2-CD1 4.1Å; F1396-L1557 HydrophobicContact CE1-CD2 4.3Å; F1396-L1557 HydrophobicContact CE1-CG 4.41Å; F1396-L1557 HydrophobicContact CE2-CD1 3.93Å; F1396-L1557 HydrophobicContact CE2-CG 4.36Å; F1396-L1557 HydrophobicContact CG-CD2 4.42Å; F1396-L1557 HydrophobicContact CZ-CD1 4.3Å; F1396-L1557 HydrophobicContact CZ-CG 4.23Å; V1399-L1557 HydrophobicContact CG2-CD2 3.63Å; E1553-L1557 WeakPolarHBondContact O-CB 3.39Å; E1553-L1557 PolarHBondContact O-N 3.24Å; D1554-L1557 PolarHBondContact O-N 2.93Å; L1557-N1559 PolarHBondContact O-N 3.47Å; L1557-D1560 PolarHBondContact O-N 3.47Å; L1557-Y1561 PolarHBondContact O-N 3.31Å; L1557-Y1561 VanDerWaalsContact O-N 3.1Å
1558	V	65.2	Low	58.6	Low	3 Å²	3	52.9 Å²	52.9	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-33.5	178.9	173.8	0	0	0	0	111.1	M1413 V1416 D1554 V1555 N1556 Q1562	M1413-V1558 HydrophobicContact CG-CG2 4.18Å; V1416-V1558 HydrophobicContact CB-CG2 4.17Å; V1416-V1558 HydrophobicContact CG1-CB 4.24Å; V1416-V1558 HydrophobicContact CG1-CG2 3.76Å; D1554-V1558 PolarHBondContact O-N 2.99Å; D1554-V1558 VanDerWaalsContact O-N 3.11Å; V1555-V1558 PolarHBondContact O-N 2.76Å; N1556-V1558 PolarHBondContact O-N 2.8Å; V1558-Q1562 WeakPolarHBondContact O-CG 3.45Å; V1558-Q1562 PolarHBondContact O-N 2.86Å; V1558-Q1562 VanDerWaalsContact O-N 3.1Å
1559	N	62.7	Low	57.8	Low	45 Å²	45	55.4 Å²	55.4	24%	0.241	28%	0.284	C	S	.	.	H	α-helix	trans	-71	-45.3	175.7	-65.1	-16.5	0	0	0	112.6	R1420 V1555 N1556 L1557 Y1561 Q1562 Q1563	R1420-N1559 PolarHBondContact NH1-OD1 2.87Å; R1420-N1559 PolarHBondContact NH2-OD1 2.78Å; V1555-N1559 VanDerWaalsContact O-CG 3.23Å; V1555-N1559 PolarHBondContact O-N 3.21Å; V1555-N1559 PolarHBondContact O-ND2 3.47Å; V1555-N1559 PolarHBondContact O-OD1 3.11Å; N1556-N1559 WeakPolarHBondContact O-CB 3.29Å; N1556-N1559 PolarHBondContact O-N 3.37Å; N1556-N1559 VanDerWaalsContact O-N 3.11Å; L1557-N1559 PolarHBondContact O-N 3.47Å; N1559-Y1561 VanDerWaalsContact C-N 3.25Å; N1559-Y1561 PolarHBondContact O-N 3.05Å; N1559-Q1562 PolarHBondContact O-N 3.32Å; N1559-Q1563 WeakPolarHBondContact O-CB 3.33Å; N1559-Q1563 WeakPolarHBondContact O-CG 3.32Å; N1559-Q1563 PolarHBondContact O-N 3.18Å
1560	D	55.6	Low	56.5	Low	57 Å²	57	53.7 Å²	53.7	31%	0.305	28%	0.278	S	S	.	.	H	α-helix	trans	-53.2	-45.6	174.9	-70.3	-10.5	0	0	0	110.9	K1395 N1556 L1557 S1564	K1395-D1560 IonicContact NZ-OD2 2.73Å; K1395-D1560 PolarHBondContact NZ-OD2 3.14Å; N1556-D1560 PolarHBondContact O-N 3.09Å; L1557-D1560 PolarHBondContact O-N 3.47Å; D1560-S1564 WeakPolarHBondContact O-CB 3.4Å; D1560-S1564 PolarHBondContact O-N 3.36Å; D1560-S1564 PolarHBondContact O-OG 3.33Å
1561	Y	54.3	Low	55.2	Low	25 Å²	25	54.4 Å²	54.4	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-46	-179.8	179.2	-104.7	0	0	0	112.1	L1388 A1392 F1396 L1557 N1559 S1564 L1565 I1599	L1388-Y1561 HydrophobicContact CD2-CD2 4.47Å; L1388-Y1561 HydrophobicContact CD2-CE2 4.38Å; A1392-Y1561 HydrophobicContact CB-CD2 4.06Å; A1392-Y1561 HydrophobicContact CB-CE2 4.04Å; F1396-Y1561 HydrophobicContact CE2-CD1 4.5Å; F1396-Y1561 HydrophobicContact CE2-CD2 4.21Å; F1396-Y1561 HydrophobicContact CE2-CG 4.03Å; L1557-Y1561 PolarHBondContact O-N 3.31Å; L1557-Y1561 VanDerWaalsContact O-N 3.1Å; N1559-Y1561 VanDerWaalsContact C-N 3.25Å; N1559-Y1561 PolarHBondContact O-N 3.05Å; Y1561-S1564 PolarHBondContact O-N 2.96Å; Y1561-L1565 PolarHBondContact O-N 3.11Å; Y1561-I1599 HydrophobicContact CE1-CD1 4.46Å
1562	Q	54.9	Low	53.8	Low	103 Å²	103	52.3 Å²	52.3	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-63.2	-42.8	176.8	-75.3	178.5	-6.6	0	0	112.2	V1558 N1559 S1564 L1565 V1566	V1558-Q1562 WeakPolarHBondContact O-CG 3.45Å; V1558-Q1562 PolarHBondContact O-N 2.86Å; V1558-Q1562 VanDerWaalsContact O-N 3.1Å; N1559-Q1562 PolarHBondContact O-N 3.32Å; Q1562-S1564 VanDerWaalsContact C-N 3.35Å; Q1562-S1564 PolarHBondContact O-N 2.99Å; Q1562-L1565 WeakPolarHBondContact O-CB 3.5Å; Q1562-L1565 PolarHBondContact O-N 3.01Å; Q1562-V1566 WeakPolarHBondContact O-CG2 3.44Å; Q1562-V1566 PolarHBondContact O-N 3.02Å; Q1562-V1566 VanDerWaalsContact O-N 3.12Å
1563	Q	50	Low	52.7	Low	133 Å²	133	52.8 Å²	52.8	62%	0.621	27%	0.271	S	S	*	.	H	α-helix	trans	-62.5	-42	175	-71.7	-176.3	15.1	0	0	111.6	N1559 L1565 V1566 L1567	N1559-Q1563 WeakPolarHBondContact O-CB 3.33Å; N1559-Q1563 WeakPolarHBondContact O-CG 3.32Å; N1559-Q1563 PolarHBondContact O-N 3.18Å; Q1563-L1565 VanDerWaalsContact C-N 3.31Å; Q1563-L1565 PolarHBondContact O-N 3.38Å; Q1563-V1566 PolarHBondContact O-N 3.49Å; Q1563-L1567 WeakPolarHBondContact O-CB 3.34Å; Q1563-L1567 PolarHBondContact O-N 2.73Å
1564	S	45.8	Very low	51.5	Low	16 Å²	16	54.5 Å²	54.5	11%	0.112	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-37.3	176.9	-59.1	0	0	0	0	112.4	L1388 D1560 Y1561 Q1562 L1567 L1568	L1388-S1564 VanDerWaalsContact CD2-CB 3.5Å; D1560-S1564 WeakPolarHBondContact O-CB 3.4Å; D1560-S1564 PolarHBondContact O-N 3.36Å; D1560-S1564 PolarHBondContact O-OG 3.33Å; Y1561-S1564 PolarHBondContact O-N 2.96Å; Q1562-S1564 VanDerWaalsContact C-N 3.35Å; Q1562-S1564 PolarHBondContact O-N 2.99Å; S1564-L1567 PolarHBondContact O-N 2.7Å; S1564-L1568 PolarHBondContact O-N 2.74Å
1565	L	48.8	Very low	50.2	Low	47 Å²	47	55 Å²	55	25%	0.246	27%	0.274	C	S	.	.	H	α-helix	trans	-64	-44.7	174.5	-157	83.5	0	0	0	112	Y1561 Q1562 Q1563 L1567 L1568 N1569 M1595	Y1561-L1565 PolarHBondContact O-N 3.11Å; Q1562-L1565 WeakPolarHBondContact O-CB 3.5Å; Q1562-L1565 PolarHBondContact O-N 3.01Å; Q1563-L1565 VanDerWaalsContact C-N 3.31Å; Q1563-L1565 PolarHBondContact O-N 3.38Å; L1565-L1567 VanDerWaalsContact C-N 3.35Å; L1565-L1568 PolarHBondContact O-N 3.25Å; L1565-N1569 PolarHBondContact O-N 2.84Å; L1565-N1569 VanDerWaalsContact O-N 3.11Å; L1565-M1595 HydrophobicContact CD1-CB 4.37Å; L1565-M1595 HydrophobicContact CD1-CE 3.34Å; L1565-M1595 HydrophobicContact CD1-SD 3.59Å; L1565-M1595 VanDerWaalsContact CD1-SD 3.59Å
1566	V	50.5	Low	48.7	Very low	93 Å²	93	55 Å²	55	56%	0.564	28%	0.275	S	S	*	.	H	α-helix	trans	-64.7	-39.5	175.9	172.8	0	0	0	0	111	Q1562 Q1563 G1570	Q1562-V1566 WeakPolarHBondContact O-CG2 3.44Å; Q1562-V1566 PolarHBondContact O-N 3.02Å; Q1562-V1566 VanDerWaalsContact O-N 3.12Å; Q1563-V1566 PolarHBondContact O-N 3.49Å; V1566-G1570 PolarHBondContact O-N 2.83Å
1567	L	47.3	Very low	47.1	Very low	98 Å²	98	59.9 Å²	59.9	51%	0.513	30%	0.295	S	S	.	.	H	α-helix	trans	-62.6	-41.7	175.5	-119.5	153.6	0	0	0	111.7	T1384 Q1563 S1564 L1565 G1570 V1571	T1384-L1567 HydrophobicContact CG2-CB 4.26Å; Q1563-L1567 WeakPolarHBondContact O-CB 3.34Å; Q1563-L1567 PolarHBondContact O-N 2.73Å; S1564-L1567 PolarHBondContact O-N 2.7Å; L1565-L1567 VanDerWaalsContact C-N 3.35Å; L1567-G1570 CarbonylContact O-C 3.54Å; L1567-G1570 PolarHBondContact O-N 3.45Å; L1567-V1571 WeakPolarHBondContact O-CG2 3.33Å; L1567-V1571 PolarHBondContact O-N 2.78Å
1568	L	44.8	Very low	46	Very low	3 Å²	3	63.4 Å²	63.4	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-50.9	176.5	-167.2	75.4	0	0	0	111.9	F1381 T1384 L1388 S1564 L1565 G1570 V1571 F1572 I1591 M1595	F1381-L1568 HydrophobicContact CD2-CD1 4.21Å; F1381-L1568 HydrophobicContact CE2-CD1 4.05Å; T1384-L1568 HydrophobicContact CG2-CB 3.96Å; T1384-L1568 HydrophobicContact CG2-CD1 3.73Å; T1384-L1568 HydrophobicContact CG2-CG 4.49Å; L1388-L1568 HydrophobicContact CD1-CB 4.19Å; L1388-L1568 HydrophobicContact CD1-CD1 4.1Å; L1388-L1568 HydrophobicContact CD1-CD2 3.81Å; L1388-L1568 HydrophobicContact CD1-CG 4.25Å; S1564-L1568 PolarHBondContact O-N 2.74Å; L1565-L1568 PolarHBondContact O-N 3.25Å; L1568-G1570 VanDerWaalsContact C-N 3.3Å; L1568-G1570 PolarHBondContact O-N 3.37Å; L1568-V1571 PolarHBondContact O-N 3.12Å; L1568-F1572 HydrophobicContact CD1-CE2 4.07Å; L1568-F1572 HydrophobicContact CD2-CE2 3.93Å; L1568-F1572 HydrophobicContact CG-CD2 3.97Å; L1568-F1572 HydrophobicContact CG-CE2 3.66Å; L1568-F1572 VanDerWaalsContact O-CD2 3.3Å; L1568-F1572 WeakPolarHBondContact O-CD2 3.3Å; L1568-F1572 PolarHBondContact O-N 2.86Å; L1568-I1591 HydrophobicContact CD2-CG2 4.14Å; L1568-M1595 HydrophobicContact CD2-SD 4.44Å
1569	N	44.8	Very low	44.4	Very low	60 Å²	60	63.9 Å²	63.9	32%	0.321	32%	0.319	S	S	.	.	H	α-helix	trans	-55.4	-46.4	172.6	-101.1	-10.1	0	0	0	111	L1565 V1571 F1572 E1573 T1592	L1565-N1569 PolarHBondContact O-N 2.84Å; L1565-N1569 VanDerWaalsContact O-N 3.11Å; N1569-V1571 VanDerWaalsContact C-N 3.31Å; N1569-V1571 PolarHBondContact O-N 3.36Å; N1569-F1572 PolarHBondContact O-N 2.81Å; N1569-E1573 PolarHBondContact O-N 3.25Å; N1569-T1592 PolarHBondContact OD1-OG1 2.83Å
1570	G	45	Very low	42.8	Very low	12 Å²	12	66.4 Å²	66.4	12%	0.124	33%	0.331	C	S	.	.	H	α-helix	trans	-70.2	-18.8	-179.2	0	0	0	0	0	115	V1566 L1567 L1568 R1574	V1566-G1570 PolarHBondContact O-N 2.83Å; L1567-G1570 CarbonylContact O-C 3.54Å; L1567-G1570 PolarHBondContact O-N 3.45Å; L1568-G1570 VanDerWaalsContact C-N 3.3Å; L1568-G1570 PolarHBondContact O-N 3.37Å; G1570-R1574 PolarHBondContact O-NE 2.7Å; G1570-R1574 PolarHBondContact O-NH2 3.31Å
1571	V	43.1	Very low	41.8	Very low	16 Å²	16	74.7 Å²	74.7	10%	0.097	36%	0.358	C	S	.	.	H	α-helix	trans	-78.2	-47.8	167	166.2	0	0	0	0	109.3	K1380 L1567 L1568 N1569 R1574 L1575	K1380-V1571 HydrophobicContact CB-CG1 4.09Å; L1567-V1571 WeakPolarHBondContact O-CG2 3.33Å; L1567-V1571 PolarHBondContact O-N 2.78Å; L1568-V1571 PolarHBondContact O-N 3.12Å; N1569-V1571 VanDerWaalsContact C-N 3.31Å; N1569-V1571 PolarHBondContact O-N 3.36Å; V1571-R1574 PolarHBondContact O-N 3.2Å; V1571-L1575 HydrophobicContact CG1-CD1 3.91Å; V1571-L1575 PolarHBondContact O-N 2.97Å
1572	F	41.2	Very low	41.2	Very low	5 Å²	5	76.1 Å²	76.1	2%	0.022	37%	0.367	C	S	.	.	H	α-helix	trans	-61.4	-45.2	179.7	-76.7	-48.7	0	0	0	113.6	F1377 F1381 L1568 N1569 R1574 L1575 G1576 I1588 I1591	F1377-F1572 HydrophobicContact CE2-CD1 4.17Å; F1377-F1572 AromaticContact CE2-CE1 3.96Å; F1377-F1572 HydrophobicContact CE2-CE1 3.96Å; F1377-F1572 HydrophobicContact CZ-CD1 4.4Å; F1377-F1572 AromaticContact CZ-CE1 3.98Å; F1377-F1572 HydrophobicContact CZ-CE1 3.98Å; F1381-F1572 AromaticContact CD2-CE1 3.91Å; F1381-F1572 HydrophobicContact CD2-CE1 3.91Å; F1381-F1572 AromaticContact CD2-CZ 3.77Å; F1381-F1572 HydrophobicContact CD2-CZ 3.77Å; F1381-F1572 HydrophobicContact CE2-CE1 4.07Å; F1381-F1572 HydrophobicContact CE2-CE2 4.33Å; F1381-F1572 AromaticContact CE2-CZ 3.5Å; F1381-F1572 HydrophobicContact CE2-CZ 3.5Å; F1381-F1572 VanDerWaalsContact CE2-CZ 3.5Å; L1568-F1572 HydrophobicContact CD1-CE2 4.07Å; L1568-F1572 HydrophobicContact CD2-CE2 3.93Å; L1568-F1572 HydrophobicContact CG-CD2 3.97Å; L1568-F1572 HydrophobicContact CG-CE2 3.66Å; L1568-F1572 VanDerWaalsContact O-CD2 3.3Å; L1568-F1572 WeakPolarHBondContact O-CD2 3.3Å; L1568-F1572 PolarHBondContact O-N 2.86Å; N1569-F1572 PolarHBondContact O-N 2.81Å; F1572-R1574 VanDerWaalsContact C-N 3.34Å; F1572-R1574 PolarHBondContact O-N 2.79Å; F1572-L1575 PolarHBondContact O-N 3.38Å; F1572-G1576 PolarHBondContact O-N 3.49Å; F1572-I1588 HydrophobicContact CB-CB 4.48Å; F1572-I1588 HydrophobicContact CB-CD1 3.94Å; F1572-I1588 HydrophobicContact CB-CG1 3.99Å; F1572-I1588 HydrophobicContact CB-CG2 3.67Å; F1572-I1588 HydrophobicContact CD1-CD1 3.89Å; F1572-I1588 HydrophobicContact CD1-CG1 3.61Å; F1572-I1588 HydrophobicContact CD2-CG1 4.27Å; F1572-I1588 HydrophobicContact CD2-CG2 4.03Å; F1572-I1588 HydrophobicContact CE1-CG1 4.02Å; F1572-I1588 HydrophobicContact CG-CB 4.42Å; F1572-I1588 HydrophobicContact CG-CD1 4.12Å; F1572-I1588 HydrophobicContact CG-CG1 3.74Å; F1572-I1588 HydrophobicContact CG-CG2 3.94Å; F1572-I1588 HydrophobicContact CZ-CG1 4.5Å; F1572-I1591 HydrophobicContact CE2-CD1 4.2Å; F1572-I1591 HydrophobicContact CE2-CG2 4.42Å; F1572-I1591 HydrophobicContact CZ-CD1 3.87Å
1573	E	39.5	Very low	40.7	Very low	113 Å²	113	71.3 Å²	71.3	53%	0.528	35%	0.345	S	S	.	.	H	α-helix	trans	-60.8	-41	177.6	-75.5	-161.1	136.2	0	0	112.6	N1569 L1575 G1576	N1569-E1573 PolarHBondContact O-N 3.25Å; E1573-L1575 VanDerWaalsContact C-N 3.26Å; E1573-L1575 PolarHBondContact O-N 3.4Å; E1573-G1576 PolarHBondContact O-N 2.9Å; E1573-G1576 VanDerWaalsContact O-N 3.16Å
1574	R	36.1	Very low	40.4	Very low	197 Å²	197	66.8 Å²	66.8	74%	0.743	33%	0.325	S	S	*	.	H	α-helix	trans	-68	-24.7	179.8	-86.9	180	-80.5	-137.8	-6.2	113.5	G1570 V1571 F1572	G1570-R1574 PolarHBondContact O-NE 2.7Å; G1570-R1574 PolarHBondContact O-NH2 3.31Å; V1571-R1574 PolarHBondContact O-N 3.2Å; F1572-R1574 VanDerWaalsContact C-N 3.34Å; F1572-R1574 PolarHBondContact O-N 2.79Å
1575	L	36.9	Very low	40.3	Very low	37 Å²	37	70.3 Å²	70.3	19%	0.194	34%	0.338	C	S	.	.	H	α-helix	trans	-89.9	-25.3	172.1	-81.5	148.6	0	0	0	112.6	F1377 V1571 F1572 E1573 Q1577 T1578 L1579	F1377-L1575 HydrophobicContact CB-CD1 4.17Å; F1377-L1575 HydrophobicContact CB-CD2 3.81Å; F1377-L1575 HydrophobicContact CD2-CD1 3.4Å; F1377-L1575 HydrophobicContact CD2-CD2 4.46Å; F1377-L1575 HydrophobicContact CD2-CG 4.43Å; F1377-L1575 HydrophobicContact CE2-CD1 4.1Å; F1377-L1575 HydrophobicContact CG-CD1 4.04Å; F1377-L1575 HydrophobicContact CG-CD2 4.28Å; V1571-L1575 HydrophobicContact CG1-CD1 3.91Å; V1571-L1575 PolarHBondContact O-N 2.97Å; F1572-L1575 PolarHBondContact O-N 3.38Å; E1573-L1575 VanDerWaalsContact C-N 3.26Å; E1573-L1575 PolarHBondContact O-N 3.4Å; L1575-Q1577 VanDerWaalsContact C-N 3.32Å; L1575-Q1577 PolarHBondContact O-N 2.95Å; L1575-T1578 PolarHBondContact O-N 2.91Å; L1575-L1579 HydrophobicContact CB-CD1 4.37Å; L1575-L1579 HydrophobicContact CD2-CD1 4.09Å; L1575-L1579 PolarHBondContact O-N 3.29Å
1576	G	34.3	Very low	40.2	Very low	7 Å²	7	69.3 Å²	69.3	7%	0.072	33%	0.334	C	S	.	.	H	α-helix	trans	-55.8	-38	-179.3	0	0	0	0	0	113.9	F1572 E1573 T1578 L1579 M1580	F1572-G1576 PolarHBondContact O-N 3.49Å; E1573-G1576 PolarHBondContact O-N 2.9Å; E1573-G1576 VanDerWaalsContact O-N 3.16Å; G1576-T1578 VanDerWaalsContact C-N 3.25Å; G1576-T1578 PolarHBondContact O-N 2.82Å; G1576-L1579 PolarHBondContact O-N 2.83Å; G1576-M1580 WeakPolarHBondContact O-CA 3.43Å; G1576-M1580 WeakPolarHBondContact O-CB 3.38Å; G1576-M1580 WeakPolarHBondContact O-CG 3.42Å; G1576-M1580 PolarHBondContact O-N 2.84Å
1577	Q	29.8	Very low	39.9	Very low	179 Å²	179	66.3 Å²	66.3	84%	0.836	32%	0.315	S	S	*	.	H	α-helix	trans	-64.6	-26.8	-177.1	-66.9	-150.5	0.8	0	0	114.4	L1575	L1575-Q1577 VanDerWaalsContact C-N 3.32Å; L1575-Q1577 PolarHBondContact O-N 2.95Å
1578	T	36	Very low	39.9	Very low	83 Å²	83	62.8 Å²	62.8	51%	0.509	30%	0.296	S	S	.	.	H	α-helix	trans	-94	-40.5	172.2	-44.6	0	0	0	0	111.8	L1575 G1576	L1575-T1578 PolarHBondContact O-N 2.91Å; G1576-T1578 VanDerWaalsContact C-N 3.25Å; G1576-T1578 PolarHBondContact O-N 2.82Å
1579	L	31.9	Very low	40.1	Very low	12 Å²	12	65.2 Å²	65.2	6%	0.063	31%	0.309	C	S	.	.	H	α-helix	trans	-90.8	-8.2	-172.4	-63.2	179.5	0	0	0	115.4	F1377 L1575 G1576 R1581 I1582 G1583 L1584	F1377-L1579 HydrophobicContact CD1-CD1 3.99Å; F1377-L1579 HydrophobicContact CE1-CD1 4.49Å; F1377-L1579 HydrophobicContact CG-CD1 4.37Å; L1575-L1579 HydrophobicContact CB-CD1 4.37Å; L1575-L1579 HydrophobicContact CD2-CD1 4.09Å; L1575-L1579 PolarHBondContact O-N 3.29Å; G1576-L1579 PolarHBondContact O-N 2.83Å; L1579-R1581 PolarHBondContact O-N 2.99Å; L1579-I1582 HydrophobicContact CD2-CD1 3.82Å; L1579-I1582 HydrophobicContact CD2-CG1 4.46Å; L1579-I1582 CarbonylContact O-C 3.51Å; L1579-I1582 WeakPolarHBondContact O-CA 3.42Å; L1579-I1582 PolarHBondContact O-N 2.91Å; L1579-G1583 PolarHBondContact O-N 2.95Å; L1579-L1584 HydrophobicContact CB-CD1 4.28Å; L1579-L1584 HydrophobicContact CD1-CD1 4.14Å
1580	M	29	Very low	40.3	Very low	98 Å²	98	62.4 Å²	62.4	48%	0.483	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-67.3	-20.2	171.9	-79.4	-162.2	-61.3	0	0	112.8	G1576 I1582 G1583 K1585	G1576-M1580 WeakPolarHBondContact O-CA 3.43Å; G1576-M1580 WeakPolarHBondContact O-CB 3.38Å; G1576-M1580 WeakPolarHBondContact O-CG 3.42Å; G1576-M1580 PolarHBondContact O-N 2.84Å; M1580-I1582 PolarHBondContact O-N 2.84Å; M1580-G1583 PolarHBondContact O-N 2.96Å; M1580-K1585 HydrophobicContact CG-CB 3.94Å; M1580-K1585 HydrophobicContact CG-CG 4.21Å; M1580-K1585 HydrophobicContact SD-CB 4.03Å; M1580-K1585 HydrophobicContact SD-CD 3.77Å; M1580-K1585 HydrophobicContact SD-CG 3.68Å
1581	R	34.5	Very low	40.3	Very low	231 Å²	231	62 Å²	62	87%	0.872	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-72	-9.8	166.7	-78.8	-170.7	173.1	-168.1	-1.6	113.7	L1579	L1579-R1581 PolarHBondContact O-N 2.99Å
1582	I	42.1	Very low	40.4	Very low	55 Å²	55	62.5 Å²	62.5	28%	0.282	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-115.9	27.6	175.6	-34.2	-175.5	0	0	0	109.6	L1579 M1580 L1584 L1710 V1713	L1579-I1582 HydrophobicContact CD2-CD1 3.82Å; L1579-I1582 HydrophobicContact CD2-CG1 4.46Å; L1579-I1582 CarbonylContact O-C 3.51Å; L1579-I1582 WeakPolarHBondContact O-CA 3.42Å; L1579-I1582 PolarHBondContact O-N 2.91Å; M1580-I1582 PolarHBondContact O-N 2.84Å; I1582-L1584 VanDerWaalsContact C-N 3.27Å; I1582-L1584 PolarHBondContact O-N 3.42Å; I1582-L1710 HydrophobicContact CG2-CD1 3.94Å; I1582-V1713 HydrophobicContact CG2-CG1 4.44Å; I1582-V1713 HydrophobicContact CG2-CG2 4.33Å
1583	G	43.9	Very low	40.8	Very low	2 Å²	2	67.2 Å²	67.2	2%	0.021	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	16.1	163.2	0	0	0	0	0	117.7	L1579 M1580 K1585 P1586 S1706 D1709	L1579-G1583 PolarHBondContact O-N 2.95Å; M1580-G1583 PolarHBondContact O-N 2.96Å; G1583-K1585 VanDerWaalsContact C-N 3.27Å; G1583-K1585 PolarHBondContact O-N 3.36Å; G1583-P1586 WeakPolarHBondContact O-CD 3.45Å; G1583-S1706 VanDerWaalsContact O-CA 3.27Å; G1583-S1706 WeakPolarHBondContact O-CA 3.3Å; G1583-S1706 WeakPolarHBondContact O-CB 3.24Å; G1583-S1706 PolarHBondContact O-OG 3.13Å; G1583-S1706 VanDerWaalsContact O-OG 3.08Å; G1583-D1709 VanDerWaalsContact CA-CB 3.44Å; G1583-D1709 WeakPolarHBondContact CA-OD2 3.48Å
1584	L	42.1	Very low	41.2	Very low	38 Å²	38	62 Å²	62	20%	0.199	29%	0.289	C	S	.	.			trans	-78.9	-8.4	-180	-72.5	175.1	0	0	0	113.8	F1377 L1579 I1582 P1586 I1587 I1588	F1377-L1584 HydrophobicContact CE1-CD1 4.07Å; L1579-L1584 HydrophobicContact CB-CD1 4.28Å; L1579-L1584 HydrophobicContact CD1-CD1 4.14Å; I1582-L1584 VanDerWaalsContact C-N 3.27Å; I1582-L1584 PolarHBondContact O-N 3.42Å; L1584-P1586 VanDerWaalsContact C-CD 3.48Å; L1584-I1587 HydrophobicContact CD2-CD1 4.16Å; L1584-I1587 PolarHBondContact O-N 2.83Å; L1584-I1588 HydrophobicContact CB-CD1 4.5Å; L1584-I1588 WeakPolarHBondContact O-CD1 3.45Å; L1584-I1588 VanDerWaalsContact O-CG1 3.31Å; L1584-I1588 WeakPolarHBondContact O-CG1 2.99Å; L1584-I1588 PolarHBondContact O-N 3.36Å; L1584-I1588 VanDerWaalsContact O-N 3.13Å
1585	K	44.2	Very low	41.6	Very low	91 Å²	91	53.9 Å²	53.9	40%	0.396	26%	0.26	S	S	.	.	H	α-helix	trans	-55.4	-44.7	178.7	-158.3	-157.7	-178	-62.5	0	113.7	M1580 G1583 I1588 D1589	M1580-K1585 HydrophobicContact CG-CB 3.94Å; M1580-K1585 HydrophobicContact CG-CG 4.21Å; M1580-K1585 HydrophobicContact SD-CB 4.03Å; M1580-K1585 HydrophobicContact SD-CD 3.77Å; M1580-K1585 HydrophobicContact SD-CG 3.68Å; G1583-K1585 VanDerWaalsContact C-N 3.27Å; G1583-K1585 PolarHBondContact O-N 3.36Å; K1585-I1588 WeakPolarHBondContact O-CB 3.36Å; K1585-I1588 PolarHBondContact O-N 2.87Å; K1585-I1588 VanDerWaalsContact O-N 3.16Å; K1585-D1589 IonicContact NZ-OD1 2.68Å; K1585-D1589 PolarHBondContact NZ-OD1 2.7Å; K1585-D1589 IonicContact NZ-OD2 3.79Å; K1585-D1589 PolarHBondContact NZ-OD2 2.96Å; K1585-D1589 PolarHBondContact O-N 2.71Å
1586	P	47.1	Very low	41.8	Very low	25 Å²	25	57.4 Å²	57.4	16%	0.162	28%	0.276	C	S	.	.	H	α-helix	trans	-67.4	-38.2	-178	-17.7	33.3	0	0	0	112	G1583 L1584 I1588 G1590 G1702 Q1705	G1583-P1586 WeakPolarHBondContact O-CD 3.45Å; L1584-P1586 VanDerWaalsContact C-CD 3.48Å; P1586-I1588 VanDerWaalsContact C-N 3.3Å; P1586-I1588 PolarHBondContact O-N 3.47Å; P1586-G1590 WeakPolarHBondContact O-CA 3.46Å; P1586-G1590 PolarHBondContact O-N 3.03Å; P1586-G1702 WeakPolarHBondContact O-CA 3.49Å; P1586-Q1705 HydrophobicContact CB-CB 3.69Å; P1586-Q1705 HydrophobicContact CB-CG 4.04Å; P1586-Q1705 HydrophobicContact CG-CB 3.71Å; P1586-Q1705 HydrophobicContact CG-CG 3.5Å; P1586-Q1705 VanDerWaalsContact CG-CG 3.5Å
1587	I	44.3	Very low	42.4	Very low	31 Å²	31	60.7 Å²	60.7	16%	0.159	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-44	169.3	-89.2	164.8	0	0	0	110.8	L1584 G1590 I1591 G1702 L1703 S1706	L1584-I1587 HydrophobicContact CD2-CD1 4.16Å; L1584-I1587 PolarHBondContact O-N 2.83Å; I1587-G1590 PolarHBondContact O-N 3.32Å; I1587-I1591 HydrophobicContact CG2-CD1 3.79Å; I1587-I1591 WeakPolarHBondContact O-CB 3.24Å; I1587-I1591 VanDerWaalsContact O-CG1 3.28Å; I1587-I1591 WeakPolarHBondContact O-CG1 3.18Å; I1587-I1591 PolarHBondContact O-N 2.84Å; I1587-G1702 PolarHBondContact N-O 2.91Å; I1587-L1703 HydrophobicContact CD1-CD2 3.99Å; I1587-L1703 HydrophobicContact CD1-CG 4.31Å; I1587-L1703 HydrophobicContact CG1-CD2 4.35Å; I1587-L1703 HydrophobicContact CG1-CG 4.11Å; I1587-S1706 VanDerWaalsContact CD1-CB 3.49Å; I1587-S1706 VanDerWaalsContact CG1-OG 3.24Å; I1587-S1706 WeakPolarHBondContact CG1-OG 3.36Å; I1587-S1706 PolarHBondContact N-OG 2.9Å
1588	I	46.6	Very low	43.1	Very low	23 Å²	23	53.8 Å²	53.8	12%	0.118	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-53.8	-179.8	-66.1	162.5	0	0	0	110.7	F1572 L1584 K1585 P1586 G1590 I1591 T1592	F1572-I1588 HydrophobicContact CB-CB 4.48Å; F1572-I1588 HydrophobicContact CB-CD1 3.94Å; F1572-I1588 HydrophobicContact CB-CG1 3.99Å; F1572-I1588 HydrophobicContact CB-CG2 3.67Å; F1572-I1588 HydrophobicContact CD1-CD1 3.89Å; F1572-I1588 HydrophobicContact CD1-CG1 3.61Å; F1572-I1588 HydrophobicContact CD2-CG1 4.27Å; F1572-I1588 HydrophobicContact CD2-CG2 4.03Å; F1572-I1588 HydrophobicContact CE1-CG1 4.02Å; F1572-I1588 HydrophobicContact CG-CB 4.42Å; F1572-I1588 HydrophobicContact CG-CD1 4.12Å; F1572-I1588 HydrophobicContact CG-CG1 3.74Å; F1572-I1588 HydrophobicContact CG-CG2 3.94Å; F1572-I1588 HydrophobicContact CZ-CG1 4.5Å; L1584-I1588 HydrophobicContact CB-CD1 4.5Å; L1584-I1588 WeakPolarHBondContact O-CD1 3.45Å; L1584-I1588 VanDerWaalsContact O-CG1 3.31Å; L1584-I1588 WeakPolarHBondContact O-CG1 2.99Å; L1584-I1588 PolarHBondContact O-N 3.36Å; L1584-I1588 VanDerWaalsContact O-N 3.13Å; K1585-I1588 WeakPolarHBondContact O-CB 3.36Å; K1585-I1588 PolarHBondContact O-N 2.87Å; K1585-I1588 VanDerWaalsContact O-N 3.16Å; P1586-I1588 VanDerWaalsContact C-N 3.3Å; P1586-I1588 PolarHBondContact O-N 3.47Å; I1588-G1590 PolarHBondContact O-N 3.06Å; I1588-I1591 PolarHBondContact O-N 2.78Å; I1588-T1592 PolarHBondContact O-N 3.05Å; I1588-T1592 PolarHBondContact O-OG1 2.69Å
1589	D	49.2	Very low	43.4	Very low	54 Å²	54	51.7 Å²	51.7	29%	0.289	24%	0.239	S	C	.	.	H	α-helix	trans	-56.6	-37.7	175	-78	22.2	0	0	0	111.5	K1585 K1593	K1585-D1589 IonicContact NZ-OD1 2.68Å; K1585-D1589 PolarHBondContact NZ-OD1 2.7Å; K1585-D1589 IonicContact NZ-OD2 3.79Å; K1585-D1589 PolarHBondContact NZ-OD2 2.96Å; K1585-D1589 PolarHBondContact O-N 2.71Å; D1589-K1593 WeakPolarHBondContact O-CB 3.5Å; D1589-K1593 WeakPolarHBondContact O-CD 3.45Å; D1589-K1593 WeakPolarHBondContact O-CG 3.43Å; D1589-K1593 PolarHBondContact O-N 2.8Å; D1589-K1593 IonicContact OD2-NZ 2.77Å
1590	G	49.5	Very low	44	Very low	2 Å²	2	55.8 Å²	55.8	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-71.5	-38.6	-179.5	0	0	0	0	0	113.5	P1586 I1587 I1588 G1594 P1698 I1699	P1586-G1590 WeakPolarHBondContact O-CA 3.46Å; P1586-G1590 PolarHBondContact O-N 3.03Å; I1587-G1590 PolarHBondContact O-N 3.32Å; I1588-G1590 PolarHBondContact O-N 3.06Å; G1590-G1594 VanDerWaalsContact O-CA 3.28Å; G1590-G1594 WeakPolarHBondContact O-CA 3.32Å; G1590-G1594 PolarHBondContact O-N 2.88Å; G1590-P1698 WeakPolarHBondContact CA-O 3.48Å; G1590-P1698 CarbonylContact O-C 3.6Å; G1590-I1699 VanDerWaalsContact O-CG1 3.22Å; G1590-I1699 WeakPolarHBondContact O-CG1 3.43Å; G1590-I1699 PolarHBondContact O-N 2.85Å
1591	I	45.6	Very low	44.5	Very low	4 Å²	4	53.4 Å²	53.4	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-62.5	-53.1	171.5	-74.8	164.6	0	0	0	109.7	L1568 F1572 I1587 I1588 G1594 M1595 F1616 L1619	L1568-I1591 HydrophobicContact CD2-CG2 4.14Å; F1572-I1591 HydrophobicContact CE2-CD1 4.2Å; F1572-I1591 HydrophobicContact CE2-CG2 4.42Å; F1572-I1591 HydrophobicContact CZ-CD1 3.87Å; I1587-I1591 HydrophobicContact CG2-CD1 3.79Å; I1587-I1591 WeakPolarHBondContact O-CB 3.24Å; I1587-I1591 VanDerWaalsContact O-CG1 3.28Å; I1587-I1591 WeakPolarHBondContact O-CG1 3.18Å; I1587-I1591 PolarHBondContact O-N 2.84Å; I1588-I1591 PolarHBondContact O-N 2.78Å; I1591-G1594 CarbonylContact O-C 3.52Å; I1591-G1594 WeakPolarHBondContact O-CA 3.31Å; I1591-G1594 PolarHBondContact O-N 2.98Å; I1591-M1595 HydrophobicContact CG2-SD 4.23Å; I1591-M1595 WeakPolarHBondContact O-CG 3.45Å; I1591-M1595 PolarHBondContact O-N 3.44Å; I1591-F1616 HydrophobicContact CG1-CE1 4.12Å; I1591-F1616 HydrophobicContact CG1-CZ 4.49Å; I1591-F1616 HydrophobicContact CG2-CE1 3.95Å; I1591-F1616 HydrophobicContact CG2-CZ 4.36Å; I1591-L1619 HydrophobicContact CD1-CD2 3.71Å
1592	T	44.8	Very low	44.7	Very low	26 Å²	26	47 Å²	47	16%	0.16	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-49.7	-176	-58.9	0	0	0	0	111.2	N1569 I1588 G1594 M1595 E1596	N1569-T1592 PolarHBondContact OD1-OG1 2.83Å; I1588-T1592 PolarHBondContact O-N 3.05Å; I1588-T1592 PolarHBondContact O-OG1 2.69Å; T1592-G1594 PolarHBondContact O-N 3.29Å; T1592-M1595 PolarHBondContact O-N 3.2Å; T1592-E1596 PolarHBondContact O-N 3.23Å; T1592-E1596 VanDerWaalsContact O-N 3.11Å
1593	K	48.7	Very low	44.4	Very low	104 Å²	104	49.6 Å²	49.6	45%	0.452	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-29.9	172.5	-68.7	167	-172	161.9	0	112.5	D1589 W1597 P1698	D1589-K1593 WeakPolarHBondContact O-CB 3.5Å; D1589-K1593 WeakPolarHBondContact O-CD 3.45Å; D1589-K1593 WeakPolarHBondContact O-CG 3.43Å; D1589-K1593 PolarHBondContact O-N 2.8Å; D1589-K1593 IonicContact OD2-NZ 2.77Å; K1593-W1597 WeakPolarHBondContact O-CB 3.43Å; K1593-W1597 PolarHBondContact O-N 2.88Å; K1593-P1698 HydrophobicContact CB-CB 3.45Å; K1593-P1698 VanDerWaalsContact CB-CB 3.45Å; K1593-P1698 HydrophobicContact CB-CG 3.8Å; K1593-P1698 HydrophobicContact CD-CB 4.43Å
1594	G	48.5	Very low	43.9	Very low	2 Å²	2	53.8 Å²	53.8	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-68.4	-37.9	177.3	0	0	0	0	0	112.9	G1590 I1591 T1592 W1597 F1598	G1590-G1594 VanDerWaalsContact O-CA 3.28Å; G1590-G1594 WeakPolarHBondContact O-CA 3.32Å; G1590-G1594 PolarHBondContact O-N 2.88Å; I1591-G1594 CarbonylContact O-C 3.52Å; I1591-G1594 WeakPolarHBondContact O-CA 3.31Å; I1591-G1594 PolarHBondContact O-N 2.98Å; T1592-G1594 PolarHBondContact O-N 3.29Å; G1594-W1597 PolarHBondContact O-N 3.11Å; G1594-F1598 WeakPolarHBondContact O-CB 3.49Å; G1594-F1598 PolarHBondContact O-N 3.37Å
1595	M	43.6	Very low	43.6	Very low	27 Å²	27	54.1 Å²	54.1	13%	0.133	28%	0.275	C	S	.	.	H	α-helix	trans	-70.4	-43.9	173.4	-64.6	179.3	81.8	0	0	110.8	L1388 L1565 L1568 I1591 T1592 W1597 F1598 I1599 F1616	L1388-M1595 HydrophobicContact CD2-CE 4.47Å; L1565-M1595 HydrophobicContact CD1-CB 4.37Å; L1565-M1595 HydrophobicContact CD1-CE 3.34Å; L1565-M1595 HydrophobicContact CD1-SD 3.59Å; L1565-M1595 VanDerWaalsContact CD1-SD 3.59Å; L1568-M1595 HydrophobicContact CD2-SD 4.44Å; I1591-M1595 HydrophobicContact CG2-SD 4.23Å; I1591-M1595 WeakPolarHBondContact O-CG 3.45Å; I1591-M1595 PolarHBondContact O-N 3.44Å; T1592-M1595 PolarHBondContact O-N 3.2Å; M1595-W1597 VanDerWaalsContact C-N 3.31Å; M1595-W1597 PolarHBondContact O-N 3.15Å; M1595-F1598 PolarHBondContact O-N 2.66Å; M1595-I1599 WeakPolarHBondContact O-CD1 3.47Å; M1595-I1599 VanDerWaalsContact O-CG1 3.28Å; M1595-I1599 WeakPolarHBondContact O-CG1 3.32Å; M1595-I1599 PolarHBondContact O-N 2.76Å; M1595-F1616 HydrophobicContact CG-CZ 4.45Å
1596	E	42.4	Very low	43	Very low	112 Å²	112	50.4 Å²	50.4	52%	0.523	26%	0.259	S	S	.	.	H	α-helix	trans	-58	-41.8	170.5	-67.5	177.8	150	0	0	112.2	T1592 N1600	T1592-E1596 PolarHBondContact O-N 3.23Å; T1592-E1596 VanDerWaalsContact O-N 3.11Å; E1596-N1600 PolarHBondContact O-N 2.79Å; E1596-N1600 PolarHBondContact O-ND2 3.18Å
1597	W	46.6	Very low	42.1	Very low	75 Å²	75	54.7 Å²	54.7	28%	0.284	28%	0.277	S	S	.	.	H	α-helix	trans	-67.3	-43.6	178.5	177	87.2	0	0	0	111.9	K1593 G1594 M1595 N1600 Q1601 I1609 P1698	K1593-W1597 WeakPolarHBondContact O-CB 3.43Å; K1593-W1597 PolarHBondContact O-N 2.88Å; G1594-W1597 PolarHBondContact O-N 3.11Å; M1595-W1597 VanDerWaalsContact C-N 3.31Å; M1595-W1597 PolarHBondContact O-N 3.15Å; W1597-N1600 CarbonylContact O-C 3.58Å; W1597-N1600 PolarHBondContact O-N 3Å; W1597-N1600 VanDerWaalsContact O-N 3.13Å; W1597-Q1601 HydrophobicContact CD2-CG 4.15Å; W1597-Q1601 HydrophobicContact CE3-CG 4.22Å; W1597-Q1601 HydrophobicContact CH2-CG 4.28Å; W1597-Q1601 HydrophobicContact CZ2-CG 4.19Å; W1597-Q1601 HydrophobicContact CZ3-CG 4.3Å; W1597-Q1601 WeakPolarHBondContact O-CG 3.23Å; W1597-Q1601 PolarHBondContact O-N 3.34Å; W1597-Q1601 VanDerWaalsContact O-N 3.09Å; W1597-Q1601 PolarHBondContact O-NE2 2.96Å; W1597-I1609 HydrophobicContact CE3-CD1 4.19Å; W1597-I1609 HydrophobicContact CH2-CD1 3.63Å; W1597-I1609 HydrophobicContact CH2-CG1 4.36Å; W1597-I1609 HydrophobicContact CZ3-CD1 3.34Å; W1597-I1609 HydrophobicContact CZ3-CG1 4.09Å; W1597-P1698 HydrophobicContact CB-CG 4.22Å; W1597-P1698 HydrophobicContact CG-CG 4.45Å
1598	F	45	Very low	41.4	Very low	35 Å²	35	55.9 Å²	55.9	15%	0.154	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-44.3	175.8	172.1	-114.2	0	0	0	112.4	G1594 M1595 N1600 Q1601 Q1606 I1609 L1610	G1594-F1598 WeakPolarHBondContact O-CB 3.49Å; G1594-F1598 PolarHBondContact O-N 3.37Å; M1595-F1598 PolarHBondContact O-N 2.66Å; F1598-N1600 PolarHBondContact O-N 3.27Å; F1598-Q1601 PolarHBondContact O-N 3.37Å; F1598-Q1601 VanDerWaalsContact O-N 3.1Å; F1598-Q1606 HydrophobicContact CD2-CG 4.25Å; F1598-Q1606 HydrophobicContact CE2-CB 4.02Å; F1598-Q1606 HydrophobicContact CE2-CG 3.97Å; F1598-Q1606 PolarHBondContact O-NE2 3.31Å; F1598-I1609 HydrophobicContact CD2-CB 3.74Å; F1598-I1609 HydrophobicContact CD2-CD1 4.05Å; F1598-I1609 HydrophobicContact CD2-CG2 3.32Å; F1598-I1609 HydrophobicContact CE2-CB 3.84Å; F1598-I1609 HydrophobicContact CE2-CG2 3.7Å; F1598-I1609 HydrophobicContact CG-CG2 4.17Å; F1598-L1610 HydrophobicContact CZ-CD1 4.4Å
1599	I	42	Very low	40.7	Very low	39 Å²	39	55.5 Å²	55.5	20%	0.2	29%	0.289	C	S	.	.	H	α-helix	trans	-57.6	-33.9	174.4	-70.4	165.2	0	0	0	111	K1410 M1413 Y1561 M1595	K1410-I1599 HydrophobicContact CB-CG2 4.36Å; K1410-I1599 WeakPolarHBondContact CB-O 3.44Å; K1410-I1599 HydrophobicContact CD-CG2 4.21Å; K1410-I1599 WeakPolarHBondContact CD-O 3.32Å; K1410-I1599 HydrophobicContact CG-CG2 4.29Å; M1413-I1599 HydrophobicContact CE-CG1 4.28Å; M1413-I1599 HydrophobicContact CE-CG2 3.96Å; Y1561-I1599 HydrophobicContact CE1-CD1 4.46Å; M1595-I1599 WeakPolarHBondContact O-CD1 3.47Å; M1595-I1599 VanDerWaalsContact O-CG1 3.28Å; M1595-I1599 WeakPolarHBondContact O-CG1 3.32Å; M1595-I1599 PolarHBondContact O-N 2.76Å
1600	N	44.3	Very low	39.8	Very low	97 Å²	97	57.6 Å²	57.6	52%	0.519	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	3.7	179.2	-70.9	-66.7	0	0	0	115.2	K1410 E1596 W1597 F1598	K1410-N1600 PolarHBondContact NZ-OD1 2.86Å; E1596-N1600 PolarHBondContact O-N 2.79Å; E1596-N1600 PolarHBondContact O-ND2 3.18Å; W1597-N1600 CarbonylContact O-C 3.58Å; W1597-N1600 PolarHBondContact O-N 3Å; W1597-N1600 VanDerWaalsContact O-N 3.13Å; F1598-N1600 PolarHBondContact O-N 3.27Å
1601	Q	40.1	Very low	38.8	Very low	48 Å²	48	59.3 Å²	59.3	22%	0.224	32%	0.317	C	S	.	.	S	Bend	trans	-79.2	154.6	173.5	-69.4	-35.7	-73.4	0	0	112.7	W1597 F1598 T1605 Q1606 I1609	W1597-Q1601 HydrophobicContact CD2-CG 4.15Å; W1597-Q1601 HydrophobicContact CE3-CG 4.22Å; W1597-Q1601 HydrophobicContact CH2-CG 4.28Å; W1597-Q1601 HydrophobicContact CZ2-CG 4.19Å; W1597-Q1601 HydrophobicContact CZ3-CG 4.3Å; W1597-Q1601 WeakPolarHBondContact O-CG 3.23Å; W1597-Q1601 PolarHBondContact O-N 3.34Å; W1597-Q1601 VanDerWaalsContact O-N 3.09Å; W1597-Q1601 PolarHBondContact O-NE2 2.96Å; F1598-Q1601 PolarHBondContact O-N 3.37Å; F1598-Q1601 VanDerWaalsContact O-N 3.1Å; Q1601-T1605 HydrophobicContact CG-CG2 4.31Å; Q1601-Q1606 HydrophobicContact CB-CG 3.95Å; Q1601-Q1606 PolarHBondContact O-NE2 3.12Å; Q1601-I1609 HydrophobicContact CB-CD1 4.23Å; Q1601-I1609 HydrophobicContact CG-CD1 3.66Å
1602	N	37.7	Very low	38.1	Very low	96 Å²	96	62.5 Å²	62.5	51%	0.513	33%	0.334	S	S	.	.			trans	-76.2	160.7	173.2	61.5	18	0	0	0	111.9	S1604 T1605 Q1606	N1602-S1604 VanDerWaalsContact C-N 3.33Å; N1602-S1604 PolarHBondContact O-N 3.07Å; N1602-S1604 PolarHBondContact OD1-OG 2.62Å; N1602-T1605 CarbonylContact O-C 3.53Å; N1602-T1605 PolarHBondContact O-N 3.28Å; N1602-T1605 VanDerWaalsContact OD1-CB 3.28Å; N1602-T1605 WeakPolarHBondContact OD1-CB 3.38Å; N1602-T1605 PolarHBondContact OD1-N 2.98Å; N1602-T1605 PolarHBondContact OD1-OG1 3.04Å; N1602-Q1606 PolarHBondContact O-N 2.96Å
1603	E	36.2	Very low	37.4	Very low	110 Å²	110	63.6 Å²	63.6	51%	0.514	34%	0.34	S	S	.	.	H	α-helix	trans	-56	-41.7	-170.5	-63.5	-179.7	127.4	0	0	113.9	T1605 Q1606 Q1607	E1603-T1605 PolarHBondContact O-N 3.43Å; E1603-Q1606 PolarHBondContact O-N 3.31Å; E1603-Q1607 WeakPolarHBondContact O-CB 2.91Å; E1603-Q1607 WeakPolarHBondContact O-CG 3.48Å; E1603-Q1607 PolarHBondContact O-N 3Å
1604	S	34.3	Very low	36.4	Very low	90 Å²	90	60.5 Å²	60.5	63%	0.629	33%	0.334	S	S	*	.	H	α-helix	trans	-62.3	-31.1	177.7	53	0	0	0	0	112.9	N1602	N1602-S1604 VanDerWaalsContact C-N 3.33Å; N1602-S1604 PolarHBondContact O-N 3.07Å; N1602-S1604 PolarHBondContact OD1-OG 2.62Å
1605	T	34.1	Very low	35.6	Very low	46 Å²	46	62.9 Å²	62.9	28%	0.282	35%	0.354	S	S	.	.	H	α-helix	trans	-88.1	-32.2	176.5	-43.9	0	0	0	0	111.1	Q1601 N1602 E1603 Q1607 A1608 I1609	Q1601-T1605 HydrophobicContact CG-CG2 4.31Å; N1602-T1605 CarbonylContact O-C 3.53Å; N1602-T1605 PolarHBondContact O-N 3.28Å; N1602-T1605 VanDerWaalsContact OD1-CB 3.28Å; N1602-T1605 WeakPolarHBondContact OD1-CB 3.38Å; N1602-T1605 PolarHBondContact OD1-N 2.98Å; N1602-T1605 PolarHBondContact OD1-OG1 3.04Å; E1603-T1605 PolarHBondContact O-N 3.43Å; T1605-Q1607 PolarHBondContact O-N 2.81Å; T1605-A1608 WeakPolarHBondContact O-CB 3.26Å; T1605-A1608 PolarHBondContact O-N 2.99Å; T1605-A1608 VanDerWaalsContact O-N 3.17Å; T1605-I1609 HydrophobicContact CG2-CD1 3.72Å; T1605-I1609 HydrophobicContact CG2-CG1 4.26Å; T1605-I1609 WeakPolarHBondContact O-CB 3.45Å; T1605-I1609 WeakPolarHBondContact O-CD1 3.38Å; T1605-I1609 WeakPolarHBondContact O-CG1 3.45Å; T1605-I1609 PolarHBondContact O-N 3.27Å
1606	Q	33.4	Very low	35	Very low	13 Å²	13	63.4 Å²	63.4	6%	0.061	36%	0.355	C	S	.	.	H	α-helix	trans	-62.3	-40.9	171.4	-72.3	-175.3	-25.2	0	0	111.9	F1598 Q1601 N1602 E1603 A1608 I1609 L1610	F1598-Q1606 HydrophobicContact CD2-CG 4.25Å; F1598-Q1606 HydrophobicContact CE2-CB 4.02Å; F1598-Q1606 HydrophobicContact CE2-CG 3.97Å; F1598-Q1606 PolarHBondContact O-NE2 3.31Å; Q1601-Q1606 HydrophobicContact CB-CG 3.95Å; Q1601-Q1606 PolarHBondContact O-NE2 3.12Å; N1602-Q1606 PolarHBondContact O-N 2.96Å; E1603-Q1606 PolarHBondContact O-N 3.31Å; Q1606-A1608 VanDerWaalsContact C-N 3.33Å; Q1606-A1608 PolarHBondContact O-N 2.7Å; Q1606-I1609 PolarHBondContact O-N 3.03Å; Q1606-L1610 PolarHBondContact O-N 3.06Å
1607	Q	26.8	Very low	34.6	Very low	115 Å²	115	62.5 Å²	62.5	54%	0.537	35%	0.354	S	S	.	.	H	α-helix	trans	-57.5	-42.3	170.5	-76.5	-81.2	4	0	0	112.3	E1603 T1605	E1603-Q1607 WeakPolarHBondContact O-CB 2.91Å; E1603-Q1607 WeakPolarHBondContact O-CG 3.48Å; E1603-Q1607 PolarHBondContact O-N 3Å; T1605-Q1607 PolarHBondContact O-N 2.81Å
1608	A	30.1	Very low	33.9	Very low	55 Å²	55	62.3 Å²	62.3	46%	0.455	36%	0.355	S	S	.	.	H	α-helix	trans	-68.4	-43.8	175.9	0	0	0	0	0	112.3	T1605 Q1606 L1610 G1611	T1605-A1608 WeakPolarHBondContact O-CB 3.26Å; T1605-A1608 PolarHBondContact O-N 2.99Å; T1605-A1608 VanDerWaalsContact O-N 3.17Å; Q1606-A1608 VanDerWaalsContact C-N 3.33Å; Q1606-A1608 PolarHBondContact O-N 2.7Å; A1608-L1610 VanDerWaalsContact C-N 3.29Å; A1608-L1610 PolarHBondContact O-N 2.95Å; A1608-G1611 PolarHBondContact O-N 3.46Å
1609	I	31.5	Very low	33.5	Very low	15 Å²	15	62 Å²	62	8%	0.077	36%	0.355	C	S	.	.	H	α-helix	trans	-72	-19.2	-179.3	-62.4	158.8	0	0	0	112	W1597 F1598 Q1601 T1605 Q1606 G1611 I1612 T1613	W1597-I1609 HydrophobicContact CE3-CD1 4.19Å; W1597-I1609 HydrophobicContact CH2-CD1 3.63Å; W1597-I1609 HydrophobicContact CH2-CG1 4.36Å; W1597-I1609 HydrophobicContact CZ3-CD1 3.34Å; W1597-I1609 HydrophobicContact CZ3-CG1 4.09Å; F1598-I1609 HydrophobicContact CD2-CB 3.74Å; F1598-I1609 HydrophobicContact CD2-CD1 4.05Å; F1598-I1609 HydrophobicContact CD2-CG2 3.32Å; F1598-I1609 HydrophobicContact CE2-CB 3.84Å; F1598-I1609 HydrophobicContact CE2-CG2 3.7Å; F1598-I1609 HydrophobicContact CG-CG2 4.17Å; Q1601-I1609 HydrophobicContact CB-CD1 4.23Å; Q1601-I1609 HydrophobicContact CG-CD1 3.66Å; T1605-I1609 HydrophobicContact CG2-CD1 3.72Å; T1605-I1609 HydrophobicContact CG2-CG1 4.26Å; T1605-I1609 WeakPolarHBondContact O-CB 3.45Å; T1605-I1609 WeakPolarHBondContact O-CD1 3.38Å; T1605-I1609 WeakPolarHBondContact O-CG1 3.45Å; T1605-I1609 PolarHBondContact O-N 3.27Å; Q1606-I1609 PolarHBondContact O-N 3.03Å; I1609-G1611 PolarHBondContact O-N 3.36Å; I1609-G1611 VanDerWaalsContact O-N 3.17Å; I1609-I1612 HydrophobicContact CG1-CD1 4.33Å; I1609-I1612 HydrophobicContact CG2-CB 4.19Å; I1609-I1612 CarbonylContact O-C 3.47Å; I1609-I1612 VanDerWaalsContact O-CA 3.27Å; I1609-I1612 WeakPolarHBondContact O-CA 3.43Å; I1609-I1612 WeakPolarHBondContact O-CB 3.5Å; I1609-I1612 PolarHBondContact O-N 3.07Å; I1609-T1613 PolarHBondContact O-N 3.08Å; I1609-T1613 PolarHBondContact O-OG1 2.95Å
1610	L	30.4	Very low	33.2	Very low	98 Å²	98	61.5 Å²	61.5	51%	0.513	35%	0.354	S	S	.	.	H	α-helix	trans	-57	-32.3	170.3	-138.4	84	0	0	0	111.9	F1598 Q1606 A1608 I1612 T1613 A1614	F1598-L1610 HydrophobicContact CZ-CD1 4.4Å; Q1606-L1610 PolarHBondContact O-N 3.06Å; A1608-L1610 VanDerWaalsContact C-N 3.29Å; A1608-L1610 PolarHBondContact O-N 2.95Å; L1610-I1612 VanDerWaalsContact C-N 3.27Å; L1610-I1612 PolarHBondContact O-N 2.97Å; L1610-T1613 WeakPolarHBondContact O-CB 3.32Å; L1610-T1613 PolarHBondContact O-N 3.11Å; L1610-A1614 PolarHBondContact O-N 3.28Å; L1610-A1614 VanDerWaalsContact O-N 3.12Å
1611	G	28.1	Very low	32.8	Very low	38 Å²	38	62.4 Å²	62.4	39%	0.392	35%	0.353	S	S	.	.	H	α-helix	trans	-72.3	-14.6	170.7	0	0	0	0	0	114.9	A1608 I1609	A1608-G1611 PolarHBondContact O-N 3.46Å; I1609-G1611 PolarHBondContact O-N 3.36Å; I1609-G1611 VanDerWaalsContact O-N 3.17Å
1612	I	30.9	Very low	32.5	Very low	71 Å²	71	64 Å²	64	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-94.1	-26.7	171.1	-54.6	176.4	0	0	0	110.2	I1609 L1610 A1614 A1615 F1616	I1609-I1612 HydrophobicContact CG1-CD1 4.33Å; I1609-I1612 HydrophobicContact CG2-CB 4.19Å; I1609-I1612 CarbonylContact O-C 3.47Å; I1609-I1612 VanDerWaalsContact O-CA 3.27Å; I1609-I1612 WeakPolarHBondContact O-CA 3.43Å; I1609-I1612 WeakPolarHBondContact O-CB 3.5Å; I1609-I1612 PolarHBondContact O-N 3.07Å; L1610-I1612 VanDerWaalsContact C-N 3.27Å; L1610-I1612 PolarHBondContact O-N 2.97Å; I1612-A1614 PolarHBondContact O-N 3.31Å; I1612-A1615 CarbonylContact O-C 3.59Å; I1612-A1615 VanDerWaalsContact O-CA 3.3Å; I1612-A1615 WeakPolarHBondContact O-CA 3.31Å; I1612-A1615 VanDerWaalsContact O-CB 3.26Å; I1612-A1615 WeakPolarHBondContact O-CB 3.47Å; I1612-A1615 PolarHBondContact O-N 3.3Å; I1612-F1616 PolarHBondContact O-N 2.94Å
1613	T	30.8	Very low	32.4	Very low	49 Å²	49	60.7 Å²	60.7	30%	0.301	35%	0.348	S	S	.	.	H	α-helix	trans	-62.8	-32.2	163.9	-46.1	0	0	0	0	111	I1609 L1610 A1615 F1616 L1617	I1609-T1613 PolarHBondContact O-N 3.08Å; I1609-T1613 PolarHBondContact O-OG1 2.95Å; L1610-T1613 WeakPolarHBondContact O-CB 3.32Å; L1610-T1613 PolarHBondContact O-N 3.11Å; T1613-A1615 PolarHBondContact O-N 3.15Å; T1613-F1616 WeakPolarHBondContact O-CB 3.4Å; T1613-F1616 PolarHBondContact O-N 3.41Å; T1613-L1617 PolarHBondContact O-N 3.43Å
1614	A	28.2	Very low	32.3	Very low	39 Å²	39	57.1 Å²	57.1	32%	0.322	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-26.5	165.8	0	0	0	0	0	113.2	L1610 I1612 F1618	L1610-A1614 PolarHBondContact O-N 3.28Å; L1610-A1614 VanDerWaalsContact O-N 3.12Å; I1612-A1614 PolarHBondContact O-N 3.31Å; A1614-F1618 VanDerWaalsContact O-CD2 3.23Å; A1614-F1618 WeakPolarHBondContact O-CD2 3.43Å; A1614-F1618 WeakPolarHBondContact O-CE2 3.45Å
1615	A	31.2	Very low	32.3	Very low	52 Å²	52	58.1 Å²	58.1	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-79.4	-29.3	172.3	0	0	0	0	0	113.2	I1612 T1613 L1617 F1618	I1612-A1615 CarbonylContact O-C 3.59Å; I1612-A1615 VanDerWaalsContact O-CA 3.3Å; I1612-A1615 WeakPolarHBondContact O-CA 3.31Å; I1612-A1615 VanDerWaalsContact O-CB 3.26Å; I1612-A1615 WeakPolarHBondContact O-CB 3.47Å; I1612-A1615 PolarHBondContact O-N 3.3Å; T1613-A1615 PolarHBondContact O-N 3.15Å; A1615-L1617 PolarHBondContact O-N 3.11Å; A1615-F1618 PolarHBondContact O-N 3.09Å
1616	F	31.4	Very low	32.1	Very low	39 Å²	39	58.2 Å²	58.2	17%	0.171	34%	0.335	C	S	.	.	H	α-helix	trans	-56.2	-38.3	170.8	-99	-84.7	0	0	0	112.2	M1385 I1591 M1595 I1612 T1613 F1618 L1619 I1699	M1385-F1616 HydrophobicContact CE-CB 4.45Å; I1591-F1616 HydrophobicContact CG1-CE1 4.12Å; I1591-F1616 HydrophobicContact CG1-CZ 4.49Å; I1591-F1616 HydrophobicContact CG2-CE1 3.95Å; I1591-F1616 HydrophobicContact CG2-CZ 4.36Å; M1595-F1616 HydrophobicContact CG-CZ 4.45Å; I1612-F1616 PolarHBondContact O-N 2.94Å; T1613-F1616 WeakPolarHBondContact O-CB 3.4Å; T1613-F1616 PolarHBondContact O-N 3.41Å; F1616-F1618 PolarHBondContact O-N 2.92Å; F1616-F1618 VanDerWaalsContact O-N 3.13Å; F1616-L1619 WeakPolarHBondContact O-CB 3.39Å; F1616-L1619 PolarHBondContact O-N 3.26Å; F1616-L1619 VanDerWaalsContact O-N 3.14Å; F1616-I1699 HydrophobicContact CE2-CD1 3.52Å; F1616-I1699 HydrophobicContact CZ-CD1 3.67Å; F1616-I1699 HydrophobicContact CZ-CG1 4.49Å
1617	L	34.7	Very low	32.1	Very low	93 Å²	93	58.2 Å²	58.2	49%	0.487	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16	174.5	-80.9	155.9	0	0	0	113.9	T1613 A1615	T1613-L1617 PolarHBondContact O-N 3.43Å; A1615-L1617 PolarHBondContact O-N 3.11Å
1618	F	31.9	Very low	32.3	Very low	70 Å²	70	55 Å²	55	31%	0.307	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-4.6	177.2	-55.7	-50.3	0	0	0	114.4	E448 A1614 A1615 F1616 P1620 K1621 V1622	E448-F1618 VanDerWaalsContact CD-CZ 3.43Å; E448-F1618 HydrophobicContact CG-CE1 3.55Å; E448-F1618 HydrophobicContact CG-CE2 4.49Å; E448-F1618 HydrophobicContact CG-CZ 3.43Å; E448-F1618 VanDerWaalsContact CG-CZ 3.43Å; E448-F1618 WeakPolarHBondContact OE2-CE1 3.5Å; A1614-F1618 VanDerWaalsContact O-CD2 3.23Å; A1614-F1618 WeakPolarHBondContact O-CD2 3.43Å; A1614-F1618 WeakPolarHBondContact O-CE2 3.45Å; A1615-F1618 PolarHBondContact O-N 3.09Å; F1616-F1618 PolarHBondContact O-N 2.92Å; F1616-F1618 VanDerWaalsContact O-N 3.13Å; F1618-P1620 VanDerWaalsContact C-CD 3.47Å; F1618-P1620 VanDerWaalsContact C-N 3.3Å; F1618-K1621 HydrophobicContact CD1-CD 4.14Å; F1618-K1621 WeakPolarHBondContact O-CA 3.2Å; F1618-K1621 WeakPolarHBondContact O-CB 3.44Å; F1618-K1621 PolarHBondContact O-N 3.02Å; F1618-V1622 PolarHBondContact O-N 3.29Å
1619	L	35.1	Very low	32.4	Very low	30 Å²	30	54.3 Å²	54.3	16%	0.157	33%	0.329	C	S	.	.	H	α-helix	trans	-56.6	-37.8	172.1	-146.7	79.5	0	0	0	113	F1381 I1591 F1616 K1621 V1622 L1623	F1381-L1619 HydrophobicContact CE1-CB 4.24Å; F1381-L1619 HydrophobicContact CE1-CD2 4.29Å; F1381-L1619 HydrophobicContact CZ-CB 4.29Å; F1381-L1619 HydrophobicContact CZ-CD2 3.76Å; I1591-L1619 HydrophobicContact CD1-CD2 3.71Å; F1616-L1619 WeakPolarHBondContact O-CB 3.39Å; F1616-L1619 PolarHBondContact O-N 3.26Å; F1616-L1619 VanDerWaalsContact O-N 3.14Å; L1619-K1621 VanDerWaalsContact C-N 3.29Å; L1619-K1621 PolarHBondContact O-N 3.24Å; L1619-V1622 PolarHBondContact O-N 3.33Å; L1619-L1623 PolarHBondContact O-N 2.84Å
1620	P	36.5	Very low	32.3	Very low	28 Å²	28	57.1 Å²	57.1	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-55	-37.8	168	-30.8	38.9	0	0	0	114.6	F1381 N1382 F1618 G1624	F1381-P1620 HydrophobicContact CD1-CG 4.36Å; F1381-P1620 HydrophobicContact CE1-CG 3.9Å; N1382-P1620 WeakPolarHBondContact OD1-CB 3.45Å; F1618-P1620 VanDerWaalsContact C-CD 3.47Å; F1618-P1620 VanDerWaalsContact C-N 3.3Å; P1620-G1624 PolarHBondContact O-N 3.25Å
1621	K	35.1	Very low	32.2	Very low	116 Å²	116	53.4 Å²	53.4	50%	0.504	33%	0.326	S	S	.	.	H	α-helix	trans	-75.5	-36	179.1	-63.6	-168.2	-179.7	-176.4	0	111.8	E448 F1618 L1619 F1625	E448-K1621 IonicContact OE2-NZ 2.64Å; E448-K1621 PolarHBondContact OE2-NZ 2.92Å; F1618-K1621 HydrophobicContact CD1-CD 4.14Å; F1618-K1621 WeakPolarHBondContact O-CA 3.2Å; F1618-K1621 WeakPolarHBondContact O-CB 3.44Å; F1618-K1621 PolarHBondContact O-N 3.02Å; L1619-K1621 VanDerWaalsContact C-N 3.29Å; L1619-K1621 PolarHBondContact O-N 3.24Å; K1621-F1625 VanDerWaalsContact O-CB 3.31Å; K1621-F1625 WeakPolarHBondContact O-CB 3.43Å; K1621-F1625 PolarHBondContact O-N 2.75Å
1622	V	34.1	Very low	32.1	Very low	81 Å²	81	53.4 Å²	53.4	49%	0.491	33%	0.326	S	S	.	.	H	α-helix	trans	-64.8	-48.9	173.1	178	0	0	0	0	110.6	F1618 L1619 F1625 V1626	F1618-V1622 PolarHBondContact O-N 3.29Å; L1619-V1622 PolarHBondContact O-N 3.33Å; V1622-F1625 WeakPolarHBondContact O-CB 3.42Å; V1622-F1625 PolarHBondContact O-N 2.97Å; V1622-F1625 VanDerWaalsContact O-N 3.17Å; V1622-V1626 WeakPolarHBondContact O-CG2 3.35Å; V1622-V1626 PolarHBondContact O-N 3.35Å
1623	L	34.9	Very low	31.9	Very low	26 Å²	26	55.3 Å²	55.3	14%	0.136	34%	0.341	C	S	.	.	H	α-helix	trans	-62.8	-42.9	176.3	-77.7	168.2	0	0	0	112.2	F1377 F1381 L1619 F1625 V1626 A1627	F1377-L1623 HydrophobicContact CE1-CD1 3.98Å; F1377-L1623 HydrophobicContact CE1-CD2 3.82Å; F1377-L1623 HydrophobicContact CZ-CD1 3.9Å; F1377-L1623 HydrophobicContact CZ-CD2 4.45Å; F1381-L1623 HydrophobicContact CD1-CD1 3.91Å; F1381-L1623 HydrophobicContact CE1-CD1 4.01Å; F1381-L1623 HydrophobicContact CG-CD1 4.46Å; L1619-L1623 PolarHBondContact O-N 2.84Å; L1623-F1625 VanDerWaalsContact C-N 3.28Å; L1623-F1625 PolarHBondContact O-N 2.67Å; L1623-V1626 PolarHBondContact O-N 2.67Å; L1623-A1627 WeakPolarHBondContact O-CB 3.35Å; L1623-A1627 PolarHBondContact O-N 3.23Å
1624	G	35.2	Very low	31.6	Very low	36 Å²	36	55 Å²	55	37%	0.371	34%	0.344	S	S	.	.	H	α-helix	trans	-63.6	-29.5	173.7	0	0	0	0	0	113.9	P1620 G1628	P1620-G1624 PolarHBondContact O-N 3.25Å; G1624-G1628 PolarHBondContact O-N 3.21Å
1625	F	34.8	Very low	31.5	Very low	111 Å²	111	60 Å²	60	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-73.5	-41.6	172.4	-177.3	-96.6	0	0	0	111.9	K1621 V1622 L1623 G1628 A1629 L1658	K1621-F1625 VanDerWaalsContact O-CB 3.31Å; K1621-F1625 WeakPolarHBondContact O-CB 3.43Å; K1621-F1625 PolarHBondContact O-N 2.75Å; V1622-F1625 WeakPolarHBondContact O-CB 3.42Å; V1622-F1625 PolarHBondContact O-N 2.97Å; V1622-F1625 VanDerWaalsContact O-N 3.17Å; L1623-F1625 VanDerWaalsContact C-N 3.28Å; L1623-F1625 PolarHBondContact O-N 2.67Å; F1625-G1628 CarbonylContact O-C 3.55Å; F1625-G1628 PolarHBondContact O-N 3.11Å; F1625-A1629 WeakPolarHBondContact O-CB 3.27Å; F1625-A1629 PolarHBondContact O-N 3.28Å; F1625-L1658 HydrophobicContact CD1-CD2 4.05Å; F1625-L1658 HydrophobicContact CE1-CD2 3.53Å; F1625-L1658 HydrophobicContact CE2-CD2 4.31Å; F1625-L1658 HydrophobicContact CZ-CD2 3.68Å
1626	V	30.4	Very low	31.1	Very low	47 Å²	47	59.6 Å²	59.6	29%	0.285	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-42.9	173.1	174.3	0	0	0	0	110.9	V1622 L1623 G1628 A1629 F1630	V1622-V1626 WeakPolarHBondContact O-CG2 3.35Å; V1622-V1626 PolarHBondContact O-N 3.35Å; L1623-V1626 PolarHBondContact O-N 2.67Å; V1626-G1628 PolarHBondContact O-N 3.23Å; V1626-A1629 PolarHBondContact O-N 2.92Å; V1626-F1630 HydrophobicContact CG1-CD2 4.19Å; V1626-F1630 HydrophobicContact CG1-CE2 4.4Å; V1626-F1630 PolarHBondContact O-N 2.85Å
1627	A	32.8	Very low	30.6	Very low	14 Å²	14	63.9 Å²	63.9	12%	0.116	39%	0.388	C	S	.	.	H	α-helix	trans	-57.7	-47.4	172.4	0	0	0	0	0	111.9	I1374 L1623 A1629 F1630 G1631	I1374-A1627 HydrophobicContact CG2-CB 3.43Å; I1374-A1627 VanDerWaalsContact CG2-CB 3.43Å; L1623-A1627 WeakPolarHBondContact O-CB 3.35Å; L1623-A1627 PolarHBondContact O-N 3.23Å; A1627-A1629 PolarHBondContact O-N 3.45Å; A1627-F1630 PolarHBondContact O-N 2.79Å; A1627-G1631 PolarHBondContact O-N 2.9Å
1628	G	31	Very low	30	Very low	46 Å²	46	65.1 Å²	65.1	47%	0.474	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-34.6	176.8	0	0	0	0	0	113.8	G1624 F1625 V1626 G1632	G1624-G1628 PolarHBondContact O-N 3.21Å; F1625-G1628 CarbonylContact O-C 3.55Å; F1625-G1628 PolarHBondContact O-N 3.11Å; V1626-G1628 PolarHBondContact O-N 3.23Å; G1628-G1632 PolarHBondContact O-N 3.06Å
1629	A	31.8	Very low	29.5	Very low	41 Å²	41	65 Å²	65	34%	0.339	42%	0.417	S	S	.	.	H	α-helix	trans	-67.5	-48.3	176.2	0	0	0	0	0	111.3	F1625 V1626 A1627 G1631 G1632 V1633	F1625-A1629 WeakPolarHBondContact O-CB 3.27Å; F1625-A1629 PolarHBondContact O-N 3.28Å; V1626-A1629 PolarHBondContact O-N 2.92Å; A1627-A1629 PolarHBondContact O-N 3.45Å; A1629-G1631 PolarHBondContact O-N 3.1Å; A1629-G1632 PolarHBondContact O-N 3.43Å; A1629-V1633 WeakPolarHBondContact O-CG2 3.31Å; A1629-V1633 PolarHBondContact O-N 3.29Å
1630	F	29.2	Very low	28.9	Very low	74 Å²	74	68.8 Å²	68.8	33%	0.325	44%	0.441	S	S	.	.	H	α-helix	trans	-60.6	-43.2	174.1	-92.6	-90	0	0	0	112.2	V1626 A1627 G1632 L1710 I1714	V1626-F1630 HydrophobicContact CG1-CD2 4.19Å; V1626-F1630 HydrophobicContact CG1-CE2 4.4Å; V1626-F1630 PolarHBondContact O-N 2.85Å; A1627-F1630 PolarHBondContact O-N 2.79Å; F1630-G1632 VanDerWaalsContact C-N 3.33Å; F1630-G1632 PolarHBondContact O-N 2.82Å; F1630-L1710 HydrophobicContact CE2-CD1 4.19Å; F1630-L1710 HydrophobicContact CZ-CD1 4.5Å; F1630-I1714 HydrophobicContact CZ-CG1 4.31Å
1631	G	27.4	Very low	28.3	Very low	21 Å²	21	73.9 Å²	73.9	22%	0.216	47%	0.466	C	S	.	.	H	α-helix	trans	-65.5	-32.9	174.5	0	0	0	0	0	114	A1627 A1629	A1627-G1631 PolarHBondContact O-N 2.9Å; A1629-G1631 PolarHBondContact O-N 3.1Å
1632	G	27.9	Very low	27.5	Very low	38 Å²	38	74 Å²	74	39%	0.392	48%	0.482	S	S	.	.	H	α-helix	trans	-76.2	-46.7	-178.5	0	0	0	0	0	113.7	G1628 A1629 F1630 A1634 K1635 G1636	G1628-G1632 PolarHBondContact O-N 3.06Å; A1629-G1632 PolarHBondContact O-N 3.43Å; F1630-G1632 VanDerWaalsContact C-N 3.33Å; F1630-G1632 PolarHBondContact O-N 2.82Å; G1632-A1634 PolarHBondContact O-N 3.47Å; G1632-K1635 PolarHBondContact O-N 3.46Å; G1632-G1636 PolarHBondContact O-N 2.99Å; G1632-G1636 VanDerWaalsContact O-N 3.16Å
1633	V	26	Very low	26.9	Very low	110 Å²	110	73.8 Å²	73.8	67%	0.667	49%	0.488	S	S	*	.	H	α-helix	trans	-55.5	-37.5	177.3	169.3	0	0	0	0	111.1	A1629	A1629-V1633 WeakPolarHBondContact O-CG2 3.31Å; A1629-V1633 PolarHBondContact O-N 3.29Å
1634	A	25.2	Very low	26.4	Very low	43 Å²	43	79.3 Å²	79.3	36%	0.355	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-13	178.6	0	0	0	0	0	115.5	T1367 G1632	T1367-A1634 HydrophobicContact CG2-CB 3.29Å; T1367-A1634 WeakPolarHBondContact OG1-CB 3.25Å; G1632-A1634 PolarHBondContact O-N 3.47Å
1635	K	24.6	Very low	25.7	Very low	143 Å²	143	84.8 Å²	84.8	62%	0.622	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.1	0.5	-171	-65.2	-164.6	174.2	-171.7	0	116.6	E1368 G1632	E1368-K1635 IonicContact OE1-NZ 3.31Å; E1368-K1635 PolarHBondContact OE1-NZ 2.82Å; G1632-K1635 PolarHBondContact O-N 3.46Å
1636	G	22.6	Very low	25	Very low	44 Å²	44	84.8 Å²	84.8	45%	0.454	55%	0.546	S	S	.	.			trans	-175.2	81.2	173.1	0	0	0	0	0	119.7	G1632 V1638	G1632-G1636 PolarHBondContact O-N 2.99Å; G1632-G1636 VanDerWaalsContact O-N 3.16Å; G1636-V1638 PolarHBondContact O-N 3.37Å
1637	V	21.5	Very low	24.7	Very low	130 Å²	130	88 Å²	88	79%	0.788	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-19.8	175.5	173.3	0	0	0	0	114.5
1638	V	22.1	Very low	24.2	Very low	119 Å²	119	93.3 Å²	93.3	72%	0.721	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-15.8	-167.5	-174	0	0	0	0	114	G1636 V1640	G1636-V1638 PolarHBondContact O-N 3.37Å; V1638-V1640 PolarHBondContact O-N 2.87Å
1639	G	21.5	Very low	23.7	Very low	66 Å²	66	94.7 Å²	94.7	68%	0.68	61%	0.606	S	S	*	*	S	Bend	trans	-79.1	-17.1	-169.2	0	0	0	0	0	116.6
1640	V	23.2	Very low	23.3	Very low	110 Å²	110	99.3 Å²	99.3	67%	0.667	62%	0.624	S	S	*	*	S	Bend	trans	-89.2	-20	-166.6	-176.1	0	0	0	0	113.2	V1638 S1642 A1643	V1638-V1640 PolarHBondContact O-N 2.87Å; V1640-S1642 VanDerWaalsContact C-N 3.31Å; V1640-S1642 PolarHBondContact O-N 3.06Å; V1640-S1642 VanDerWaalsContact O-N 3.13Å; V1640-A1643 PolarHBondContact O-N 3.28Å
1641	I	23.4	Very low	22.9	Very low	135 Å²	135	102.4 Å²	102.4	69%	0.692	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-59.6	-32.8	-163.7	-62.4	172.5	0	0	0	113.8
1642	S	18.9	Very low	22.8	Very low	120 Å²	120	110.9 Å²	110.9	84%	0.839	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-90	-2.4	-171.6	62.2	0	0	0	0	116	V1640	V1640-S1642 VanDerWaalsContact C-N 3.31Å; V1640-S1642 PolarHBondContact O-N 3.06Å; V1640-S1642 VanDerWaalsContact O-N 3.13Å
1643	A	21.5	Very low	22.7	Very low	76 Å²	76	111.7 Å²	111.7	63%	0.628	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-95.8	-1.3	-175.1	0	0	0	0	0	114.6	V1640	V1640-A1643 PolarHBondContact O-N 3.28Å
1644	F	23.2	Very low	22.7	Very low	142 Å²	142	111.3 Å²	111.3	62%	0.623	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-78.1	-28.6	-157	-158.8	-105.5	0	0	0	115.8	A1666	F1644-A1666 HydrophobicContact CE2-CB 4.32Å; F1644-A1666 HydrophobicContact CZ-CB 4.33Å
1645	N	21.4	Very low	23	Very low	151 Å²	151	113.5 Å²	113.5	81%	0.807	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-95.9	9.5	-157.4	-73.5	-5.6	0	0	0	117.2
1646	S	20.2	Very low	23.1	Very low	111 Å²	111	108.3 Å²	108.3	78%	0.776	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-117.8	-1.7	-177.7	57.1	0	0	0	0	115.8	V1648	S1646-V1648 PolarHBondContact O-N 3.04Å
1647	L	22.5	Very low	23.4	Very low	115 Å²	115	109.1 Å²	109.1	60%	0.602	66%	0.66	S	S	*	*			trans	-101.3	36.6	-169.6	-156.5	72.4	0	0	0	114.7
1648	V	22.4	Very low	23.7	Very low	124 Å²	124	107.6 Å²	107.6	75%	0.752	65%	0.647	S	S	*	*			trans	-84	-14.9	-172.8	-178.4	0	0	0	0	113.7	S1646	S1646-V1648 PolarHBondContact O-N 3.04Å
1649	G	21.8	Very low	24.1	Very low	75 Å²	75	105.9 Å²	105.9	77%	0.773	64%	0.636	S	S	*	*	S	Bend	trans	-88.4	-9.1	-164.9	0	0	0	0	0	118.9	L1651	G1649-L1651 PolarHBondContact O-N 3.39Å
1650	L	22.4	Very low	24.4	Very low	139 Å²	139	106.1 Å²	106.1	73%	0.728	62%	0.621	S	S	*	*			trans	-100.4	45.4	-165.2	-81.2	165.1	0	0	0	114.8	F1652	L1650-F1652 PolarHBondContact O-N 3Å
1651	L	21.8	Very low	24.6	Very low	139 Å²	139	105.2 Å²	105.2	73%	0.728	61%	0.612	S	S	*	*			trans	-69.7	-0.7	-166.9	-127.4	144.7	0	0	0	116.5	G1649	G1649-L1651 PolarHBondContact O-N 3.39Å
1652	F	25.4	Very low	24.8	Very low	199 Å²	199	100.4 Å²	100.4	87%	0.873	60%	0.596	S	S	*	*	S	Bend	trans	-138.7	52.2	-168.8	-67.3	-74.4	0	0	0	114.9	L1650	L1650-F1652 PolarHBondContact O-N 3Å
1653	S	24.5	Very low	25.2	Very low	55 Å²	55	99 Å²	99	39%	0.385	58%	0.582	S	S	.	*	S	Bend	trans	-147.2	156.8	164.1	82.5	0	0	0	0	113.4	I1655 G1656	S1653-I1655 PolarHBondContact O-N 2.97Å; S1653-G1656 PolarHBondContact O-N 3.33Å
1654	P	27.6	Very low	25.4	Very low	102 Å²	102	96.5 Å²	96.5	66%	0.662	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-3	-176.4	-25.4	35.8	0	0	0	116.5	G1656	P1654-G1656 PolarHBondContact O-N 3.18Å
1655	I	31.2	Very low	25.6	Very low	88 Å²	88	94.9 Å²	94.9	45%	0.451	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	-9.9	172.4	-65.3	171.4	0	0	0	111.3	S1653 L1657 L1658	S1653-I1655 PolarHBondContact O-N 2.97Å; I1655-L1657 PolarHBondContact O-N 3.04Å; I1655-L1658 HydrophobicContact CG2-CB 4.42Å; I1655-L1658 HydrophobicContact CG2-CD1 4.29Å; I1655-L1658 WeakPolarHBondContact O-CB 3.49Å; I1655-L1658 PolarHBondContact O-N 3.3Å
1656	G	26.7	Very low	26	Very low	35 Å²	35	89.3 Å²	89.3	36%	0.361	53%	0.53	S	S	.	.	H	α-helix	trans	-52.1	-30.7	-179.6	0	0	0	0	0	115.7	S1653 P1654 L1658 V1659 I1660	S1653-G1656 PolarHBondContact O-N 3.33Å; P1654-G1656 PolarHBondContact O-N 3.18Å; G1656-L1658 PolarHBondContact O-N 2.82Å; G1656-V1659 WeakPolarHBondContact O-CA 3.47Å; G1656-V1659 VanDerWaalsContact O-CB 3.31Å; G1656-V1659 WeakPolarHBondContact O-CB 3.45Å; G1656-V1659 PolarHBondContact O-N 3.22Å; G1656-I1660 PolarHBondContact O-N 3.45Å; G1656-I1660 VanDerWaalsContact O-N 3.12Å
1657	L	28.5	Very low	26.2	Very low	61 Å²	61	85.4 Å²	85.4	32%	0.319	51%	0.507	S	S	.	.	H	α-helix	trans	-69.8	-30.1	177.7	-160	90.9	0	0	0	113.4	I1655 V1659 I1660 L1661 F1686	I1655-L1657 PolarHBondContact O-N 3.04Å; L1657-V1659 PolarHBondContact O-N 3.3Å; L1657-I1660 HydrophobicContact CD1-CD1 4.18Å; L1657-I1660 PolarHBondContact O-N 2.89Å; L1657-I1660 VanDerWaalsContact O-N 3.12Å; L1657-L1661 PolarHBondContact O-N 3.17Å; L1657-F1686 HydrophobicContact CD1-CB 4.14Å; L1657-F1686 HydrophobicContact CD1-CD2 3.77Å; L1657-F1686 HydrophobicContact CD1-CG 4.34Å; L1657-F1686 HydrophobicContact CD2-CD2 3.26Å; L1657-F1686 HydrophobicContact CD2-CE2 3.4Å; L1657-F1686 HydrophobicContact CD2-CG 4.11Å; L1657-F1686 HydrophobicContact CD2-CZ 4.34Å; L1657-F1686 HydrophobicContact CG-CD2 4.15Å
1658	L	28.6	Very low	26.4	Very low	98 Å²	98	82 Å²	82	51%	0.513	49%	0.491	S	S	.	.	H	α-helix	trans	-64.4	-23	170.7	-85.5	162.3	0	0	0	111.8	F1625 I1655 G1656	F1625-L1658 HydrophobicContact CD1-CD2 4.05Å; F1625-L1658 HydrophobicContact CE1-CD2 3.53Å; F1625-L1658 HydrophobicContact CE2-CD2 4.31Å; F1625-L1658 HydrophobicContact CZ-CD2 3.68Å; I1655-L1658 HydrophobicContact CG2-CB 4.42Å; I1655-L1658 HydrophobicContact CG2-CD1 4.29Å; I1655-L1658 WeakPolarHBondContact O-CB 3.49Å; I1655-L1658 PolarHBondContact O-N 3.3Å; G1656-L1658 PolarHBondContact O-N 2.82Å
1659	V	30.4	Very low	26.7	Very low	82 Å²	82	80.1 Å²	80.1	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-79.5	-40	171.2	-172.2	0	0	0	0	110.7	G1656 L1657 L1661 G1662 V1663	G1656-V1659 WeakPolarHBondContact O-CA 3.47Å; G1656-V1659 VanDerWaalsContact O-CB 3.31Å; G1656-V1659 WeakPolarHBondContact O-CB 3.45Å; G1656-V1659 PolarHBondContact O-N 3.22Å; L1657-V1659 PolarHBondContact O-N 3.3Å; V1659-L1661 VanDerWaalsContact C-N 3.34Å; V1659-L1661 PolarHBondContact O-N 3.41Å; V1659-G1662 CarbonylContact O-C 3.57Å; V1659-G1662 WeakPolarHBondContact O-CA 3.45Å; V1659-G1662 PolarHBondContact O-N 2.92Å; V1659-V1663 HydrophobicContact CG1-CG2 4.46Å; V1659-V1663 WeakPolarHBondContact O-CG2 3.39Å; V1659-V1663 PolarHBondContact O-N 3.46Å
1660	I	26.8	Very low	27	Very low	71 Å²	71	81.6 Å²	81.6	36%	0.364	48%	0.483	S	S	.	.	H	α-helix	trans	-59.5	-42.3	176.7	-70.6	167.5	0	0	0	111.6	G1656 L1657 G1662 V1663 L1664 A1682	G1656-I1660 PolarHBondContact O-N 3.45Å; G1656-I1660 VanDerWaalsContact O-N 3.12Å; L1657-I1660 HydrophobicContact CD1-CD1 4.18Å; L1657-I1660 PolarHBondContact O-N 2.89Å; L1657-I1660 VanDerWaalsContact O-N 3.12Å; I1660-G1662 PolarHBondContact O-N 3.24Å; I1660-V1663 WeakPolarHBondContact O-CB 3.34Å; I1660-V1663 PolarHBondContact O-N 3.49Å; I1660-V1663 VanDerWaalsContact O-N 3.16Å; I1660-L1664 PolarHBondContact O-N 3.16Å; I1660-A1682 HydrophobicContact CG2-CB 3.98Å
1661	L	27.2	Very low	27.1	Very low	91 Å²	91	80.9 Å²	80.9	48%	0.476	48%	0.48	S	S	.	.	H	α-helix	trans	-64.6	-29.9	174.2	-146.6	76.2	0	0	0	112.5	L1657 V1659 L1664 I1665	L1657-L1661 PolarHBondContact O-N 3.17Å; V1659-L1661 VanDerWaalsContact C-N 3.34Å; V1659-L1661 PolarHBondContact O-N 3.41Å; L1661-L1664 WeakPolarHBondContact O-CB 3.41Å; L1661-I1665 WeakPolarHBondContact O-CG1 3.46Å; L1661-I1665 PolarHBondContact O-N 3.41Å
1662	G	28.7	Very low	27.5	Very low	35 Å²	35	78.1 Å²	78.1	36%	0.361	46%	0.462	S	S	.	.	H	α-helix	trans	-73.5	-35.7	171.8	0	0	0	0	0	113.9	V1659 I1660 L1664 I1665 A1666	V1659-G1662 CarbonylContact O-C 3.57Å; V1659-G1662 WeakPolarHBondContact O-CA 3.45Å; V1659-G1662 PolarHBondContact O-N 2.92Å; I1660-G1662 PolarHBondContact O-N 3.24Å; G1662-L1664 VanDerWaalsContact C-N 3.3Å; G1662-I1665 PolarHBondContact O-N 3.33Å; G1662-A1666 PolarHBondContact O-N 3.4Å
1663	V	27.8	Very low	27.8	Very low	89 Å²	89	72.4 Å²	72.4	54%	0.539	46%	0.459	S	S	.	.	H	α-helix	trans	-62.5	-40.4	171.6	170.3	0	0	0	0	110	V1659 I1660 I1665 A1666 G1667	V1659-V1663 HydrophobicContact CG1-CG2 4.46Å; V1659-V1663 WeakPolarHBondContact O-CG2 3.39Å; V1659-V1663 PolarHBondContact O-N 3.46Å; I1660-V1663 WeakPolarHBondContact O-CB 3.34Å; I1660-V1663 PolarHBondContact O-N 3.49Å; I1660-V1663 VanDerWaalsContact O-N 3.16Å; V1663-I1665 PolarHBondContact O-N 3Å; V1663-A1666 CarbonylContact O-C 3.53Å; V1663-A1666 WeakPolarHBondContact O-CB 3.38Å; V1663-A1666 PolarHBondContact O-N 3.44Å; V1663-A1666 VanDerWaalsContact O-N 3.14Å; V1663-G1667 PolarHBondContact O-N 2.91Å
1664	L	25.4	Very low	28.3	Very low	25 Å²	25	71.3 Å²	71.3	13%	0.131	46%	0.456	C	S	.	.	H	α-helix	trans	-59	-46.5	173.7	-112.8	164.1	0	0	0	112.3	I1660 L1661 G1662 A1666 G1667 V1668 L1679 A1682	I1660-L1664 PolarHBondContact O-N 3.16Å; L1661-L1664 WeakPolarHBondContact O-CB 3.41Å; G1662-L1664 VanDerWaalsContact C-N 3.3Å; L1664-A1666 VanDerWaalsContact C-N 3.29Å; L1664-A1666 PolarHBondContact O-N 3.12Å; L1664-G1667 WeakPolarHBondContact O-CA 3.16Å; L1664-G1667 PolarHBondContact O-N 3.12Å; L1664-V1668 WeakPolarHBondContact O-CG2 3.44Å; L1664-V1668 PolarHBondContact O-N 3.23Å; L1664-V1668 VanDerWaalsContact O-N 3.16Å; L1664-L1679 HydrophobicContact CD1-CD1 3.57Å; L1664-L1679 HydrophobicContact CD2-CB 3.98Å; L1664-L1679 HydrophobicContact CD2-CD1 3.88Å; L1664-L1679 HydrophobicContact CG-CD1 4.37Å; L1664-A1682 HydrophobicContact CD1-CB 3.71Å
1665	I	27.4	Very low	28.7	Very low	107 Å²	107	67.5 Å²	67.5	55%	0.549	43%	0.43	S	S	.	.	H	α-helix	trans	-64.5	-32	175.1	-65.7	170.3	0	0	0	111.8	L1661 G1662 V1663 G1667 V1668	L1661-I1665 WeakPolarHBondContact O-CG1 3.46Å; L1661-I1665 PolarHBondContact O-N 3.41Å; G1662-I1665 PolarHBondContact O-N 3.33Å; V1663-I1665 PolarHBondContact O-N 3Å; I1665-G1667 VanDerWaalsContact C-N 3.34Å; I1665-V1668 WeakPolarHBondContact O-CB 3.5Å; I1665-V1668 PolarHBondContact O-N 3.41Å
1666	A	28.6	Very low	28.9	Very low	35 Å²	35	67.2 Å²	67.2	29%	0.289	43%	0.427	S	S	.	.	H	α-helix	trans	-69.7	-30.2	170.8	0	0	0	0	0	112.8	F1644 G1662 V1663 L1664 A1669 T1670	F1644-A1666 HydrophobicContact CE2-CB 4.32Å; F1644-A1666 HydrophobicContact CZ-CB 4.33Å; G1662-A1666 PolarHBondContact O-N 3.4Å; V1663-A1666 CarbonylContact O-C 3.53Å; V1663-A1666 WeakPolarHBondContact O-CB 3.38Å; V1663-A1666 PolarHBondContact O-N 3.44Å; V1663-A1666 VanDerWaalsContact O-N 3.14Å; L1664-A1666 VanDerWaalsContact C-N 3.29Å; L1664-A1666 PolarHBondContact O-N 3.12Å; A1666-A1669 PolarHBondContact O-N 3.31Å; A1666-T1670 PolarHBondContact O-OG1 3.24Å
1667	G	25.3	Very low	29.5	Very low	29 Å²	29	71.3 Å²	71.3	30%	0.299	44%	0.44	S	S	.	.	H	α-helix	trans	-62.4	-41.6	171.1	0	0	0	0	0	113	V1663 L1664 I1665 A1669 T1670 N1671	V1663-G1667 PolarHBondContact O-N 2.91Å; L1664-G1667 WeakPolarHBondContact O-CA 3.16Å; L1664-G1667 PolarHBondContact O-N 3.12Å; I1665-G1667 VanDerWaalsContact C-N 3.34Å; G1667-A1669 PolarHBondContact O-N 2.76Å; G1667-A1669 VanDerWaalsContact O-N 3.13Å; G1667-T1670 PolarHBondContact O-N 3.45Å; G1667-T1670 VanDerWaalsContact O-N 3.08Å; G1667-T1670 PolarHBondContact O-OG1 3.17Å; G1667-N1671 PolarHBondContact O-N 2.94Å
1668	V	27.1	Very low	30.1	Very low	43 Å²	43	70.7 Å²	70.7	26%	0.261	44%	0.444	S	S	.	.	H	α-helix	trans	-51.9	-36.6	174.5	-173.6	0	0	0	0	111.8	L1664 I1665 T1670 F1672 M1675	L1664-V1668 WeakPolarHBondContact O-CG2 3.44Å; L1664-V1668 PolarHBondContact O-N 3.23Å; L1664-V1668 VanDerWaalsContact O-N 3.16Å; I1665-V1668 WeakPolarHBondContact O-CB 3.5Å; I1665-V1668 PolarHBondContact O-N 3.41Å; V1668-T1670 PolarHBondContact O-N 2.89Å; V1668-F1672 HydrophobicContact CG1-CE1 3.96Å; V1668-F1672 HydrophobicContact CG1-CZ 4.31Å; V1668-M1675 HydrophobicContact CB-CE 4.43Å; V1668-M1675 HydrophobicContact CB-SD 4.1Å; V1668-M1675 HydrophobicContact CG1-CE 4.36Å; V1668-M1675 HydrophobicContact CG1-SD 3.88Å; V1668-M1675 HydrophobicContact CG2-CE 3.63Å; V1668-M1675 HydrophobicContact CG2-SD 3.94Å
1669	A	26.8	Very low	30.6	Very low	85 Å²	85	67.1 Å²	67.1	70%	0.702	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-11.9	-175.7	0	0	0	0	0	114.8	A1666 G1667	A1666-A1669 PolarHBondContact O-N 3.31Å; G1667-A1669 PolarHBondContact O-N 2.76Å; G1667-A1669 VanDerWaalsContact O-N 3.13Å
1670	T	28.4	Very low	31.3	Very low	105 Å²	105	66.9 Å²	66.9	64%	0.644	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	-36	-166.8	50	0	0	0	0	115.9	A1666 G1667 V1668	A1666-T1670 PolarHBondContact O-OG1 3.24Å; G1667-T1670 PolarHBondContact O-N 3.45Å; G1667-T1670 VanDerWaalsContact O-N 3.08Å; G1667-T1670 PolarHBondContact O-OG1 3.17Å; V1668-T1670 PolarHBondContact O-N 2.89Å
1671	N	26	Very low	32.2	Very low	125 Å²	125	70.2 Å²	70.2	67%	0.668	44%	0.435	S	S	*	.			trans	-150.5	92.6	174.7	-79.4	-70.6	0	0	0	111.8	G1667 G1673 G1674	G1667-N1671 PolarHBondContact O-N 2.94Å; N1671-G1673 PolarHBondContact O-N 3.44Å; N1671-G1674 PolarHBondContact O-N 2.87Å
1672	F	29.4	Very low	32.9	Very low	80 Å²	80	66.9 Å²	66.9	35%	0.351	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-55.3	-23	178.8	-81.1	-76.5	0	0	0	114.9	V1668 M1675 N1722	V1668-F1672 HydrophobicContact CG1-CE1 3.96Å; V1668-F1672 HydrophobicContact CG1-CZ 4.31Å; F1672-M1675 HydrophobicContact CD1-SD 3.79Å; F1672-M1675 HydrophobicContact CE1-SD 4.16Å; F1672-N1722 WeakPolarHBondContact CD1-OD1 3.25Å
1673	G	32.6	Very low	33.6	Very low	80 Å²	80	66.8 Å²	66.8	83%	0.825	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-73.9	-22	175.5	0	0	0	0	0	115.2	N1671	N1671-G1673 PolarHBondContact O-N 3.44Å
1674	G	34.3	Very low	34.7	Very low	31 Å²	31	66.6 Å²	66.6	32%	0.32	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-96.7	4	179.3	0	0	0	0	0	114.4	N1671 H1676 A1678	N1671-G1674 PolarHBondContact O-N 2.87Å; G1674-H1676 VanDerWaalsContact C-N 3.33Å; G1674-H1676 PolarHBondContact O-N 3.12Å; G1674-A1678 WeakPolarHBondContact O-CB 3.22Å; G1674-A1678 PolarHBondContact O-N 3.12Å
1675	M	35.9	Very low	35.6	Very low	23 Å²	23	69.7 Å²	69.7	11%	0.113	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.8	-172.6	-89.8	-161.8	65.1	0	0	115	V1668 F1672 L1679 I1718	V1668-M1675 HydrophobicContact CB-CE 4.43Å; V1668-M1675 HydrophobicContact CB-SD 4.1Å; V1668-M1675 HydrophobicContact CG1-CE 4.36Å; V1668-M1675 HydrophobicContact CG1-SD 3.88Å; V1668-M1675 HydrophobicContact CG2-CE 3.63Å; V1668-M1675 HydrophobicContact CG2-SD 3.94Å; F1672-M1675 HydrophobicContact CD1-SD 3.79Å; F1672-M1675 HydrophobicContact CE1-SD 4.16Å; M1675-L1679 WeakPolarHBondContact O-CB 3.48Å; M1675-I1718 HydrophobicContact CE-CD1 3.62Å; M1675-I1718 HydrophobicContact CE-CG1 4.29Å; M1675-I1718 HydrophobicContact CE-CG2 3.83Å; M1675-I1718 HydrophobicContact SD-CG2 3.93Å
1676	H	35.2	Very low	36.4	Very low	82 Å²	82	65.6 Å²	65.6	38%	0.38	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-57.1	178	-131.7	-67.8	0	0	0	109.6	G1674 A1678 L1679 D1680 K1719	G1674-H1676 VanDerWaalsContact C-N 3.33Å; G1674-H1676 PolarHBondContact O-N 3.12Å; H1676-A1678 VanDerWaalsContact C-N 3.32Å; H1676-A1678 PolarHBondContact O-N 3.47Å; H1676-L1679 WeakPolarHBondContact O-CA 3.25Å; H1676-L1679 WeakPolarHBondContact O-CB 3.25Å; H1676-L1679 PolarHBondContact O-N 2.99Å; H1676-D1680 IonicContact CE1-OD2 3.25Å; H1676-D1680 IonicContact CG-OD2 2.88Å; H1676-D1680 IonicContact ND1-OD1 2.87Å; H1676-D1680 IonicContact ND1-OD2 2.7Å; H1676-D1680 PolarHBondContact ND1-OD2 3.27Å; H1676-D1680 PolarHBondContact O-N 2.94Å; H1676-K1719 WeakPolarHBondContact NE2-CE 3.48Å; H1676-K1719 PolarHBondContact NE2-NZ 3.07Å
1677	D	39.7	Very low	37.3	Very low	120 Å²	120	65.7 Å²	65.7	64%	0.642	40%	0.398	S	S	*	.	H	α-helix	trans	-51.8	-45.9	-180	-52.7	0.7	0	0	0	112.8	L1679 D1680 E1681	D1677-L1679 VanDerWaalsContact C-N 3.3Å; D1677-L1679 PolarHBondContact O-N 3.06Å; D1677-D1680 PolarHBondContact O-N 3.2Å; D1677-E1681 WeakPolarHBondContact O-CB 3.26Å; D1677-E1681 PolarHBondContact O-N 3.05Å
1678	A	40.5	Very low	38.7	Very low	48 Å²	48	69.1 Å²	69.1	40%	0.397	41%	0.405	S	S	.	.	H	α-helix	trans	-72.4	-19.9	178.9	0	0	0	0	0	114.1	G1674 H1676 A1682	G1674-A1678 WeakPolarHBondContact O-CB 3.22Å; G1674-A1678 PolarHBondContact O-N 3.12Å; H1676-A1678 VanDerWaalsContact C-N 3.32Å; H1676-A1678 PolarHBondContact O-N 3.47Å; A1678-A1682 WeakPolarHBondContact O-CB 3.46Å
1679	L	40.2	Very low	39.4	Very low	23 Å²	23	72.4 Å²	72.4	12%	0.12	41%	0.413	C	S	.	.	H	α-helix	trans	-81.8	-46.2	173.9	-174.2	57.3	0	0	0	109.9	L1664 M1675 H1676 D1677 A1682 I1683 V1711	L1664-L1679 HydrophobicContact CD1-CD1 3.57Å; L1664-L1679 HydrophobicContact CD2-CB 3.98Å; L1664-L1679 HydrophobicContact CD2-CD1 3.88Å; L1664-L1679 HydrophobicContact CG-CD1 4.37Å; M1675-L1679 WeakPolarHBondContact O-CB 3.48Å; H1676-L1679 WeakPolarHBondContact O-CA 3.25Å; H1676-L1679 WeakPolarHBondContact O-CB 3.25Å; H1676-L1679 PolarHBondContact O-N 2.99Å; D1677-L1679 VanDerWaalsContact C-N 3.3Å; D1677-L1679 PolarHBondContact O-N 3.06Å; L1679-A1682 PolarHBondContact O-N 3.42Å; L1679-I1683 HydrophobicContact CD1-CD1 4.42Å; L1679-I1683 HydrophobicContact CG-CD1 4.16Å; L1679-I1683 WeakPolarHBondContact O-CD1 3.42Å; L1679-I1683 WeakPolarHBondContact O-CG1 3.47Å; L1679-I1683 PolarHBondContact O-N 2.88Å; L1679-I1683 VanDerWaalsContact O-N 3.07Å; L1679-V1711 HydrophobicContact CD1-CG2 4.17Å; L1679-V1711 HydrophobicContact CD2-CG1 3.87Å; L1679-V1711 HydrophobicContact CG-CG1 4.02Å
1680	D	43.6	Very low	40.1	Very low	78 Å²	78	68.6 Å²	68.6	42%	0.417	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-41.4	177.6	-65.3	-43.8	0	0	0	111.9	H1676 D1677 I1683 D1684	H1676-D1680 IonicContact CE1-OD2 3.25Å; H1676-D1680 IonicContact CG-OD2 2.88Å; H1676-D1680 IonicContact ND1-OD1 2.87Å; H1676-D1680 IonicContact ND1-OD2 2.7Å; H1676-D1680 PolarHBondContact ND1-OD2 3.27Å; H1676-D1680 PolarHBondContact O-N 2.94Å; D1677-D1680 PolarHBondContact O-N 3.2Å; D1680-I1683 PolarHBondContact O-N 2.95Å; D1680-D1684 PolarHBondContact O-N 2.95Å
1681	E	45.9	Very low	41.1	Very low	141 Å²	141	67 Å²	67	66%	0.659	37%	0.368	S	S	*	.	H	α-helix	trans	-66.3	-40.1	176.4	-171.8	171.2	-129	0	0	112.6	D1677 I1683 D1684 D1685	D1677-E1681 WeakPolarHBondContact O-CB 3.26Å; D1677-E1681 PolarHBondContact O-N 3.05Å; E1681-I1683 VanDerWaalsContact C-N 3.33Å; E1681-I1683 PolarHBondContact O-N 3.06Å; E1681-D1684 PolarHBondContact O-N 3.4Å; E1681-D1685 PolarHBondContact O-N 2.89Å
1682	A	41.5	Very low	41.7	Very low	20 Å²	20	66.2 Å²	66.2	17%	0.165	37%	0.368	C	S	.	.	H	α-helix	trans	-68.3	-31.1	176.4	0	0	0	0	0	113	I1660 L1664 A1678 L1679 F1686	I1660-A1682 HydrophobicContact CG2-CB 3.98Å; L1664-A1682 HydrophobicContact CD1-CB 3.71Å; A1678-A1682 WeakPolarHBondContact O-CB 3.46Å; L1679-A1682 PolarHBondContact O-N 3.42Å; A1682-F1686 WeakPolarHBondContact O-CB 3.34Å; A1682-F1686 PolarHBondContact O-N 3.47Å
1683	I	45.2	Very low	42.1	Very low	34 Å²	34	66.8 Å²	66.8	17%	0.174	37%	0.374	C	S	.	.	H	α-helix	trans	-69.8	-41.5	173	-68.9	158.4	0	0	0	110.5	L1679 D1680 E1681 F1686 N1687 V1711	L1679-I1683 HydrophobicContact CD1-CD1 4.42Å; L1679-I1683 HydrophobicContact CG-CD1 4.16Å; L1679-I1683 WeakPolarHBondContact O-CD1 3.42Å; L1679-I1683 WeakPolarHBondContact O-CG1 3.47Å; L1679-I1683 PolarHBondContact O-N 2.88Å; L1679-I1683 VanDerWaalsContact O-N 3.07Å; D1680-I1683 PolarHBondContact O-N 2.95Å; E1681-I1683 VanDerWaalsContact C-N 3.33Å; E1681-I1683 PolarHBondContact O-N 3.06Å; I1683-F1686 PolarHBondContact O-N 3.45Å; I1683-N1687 WeakPolarHBondContact O-CB 3.44Å; I1683-N1687 PolarHBondContact O-N 3.43Å; I1683-N1687 PolarHBondContact O-ND2 3.19Å; I1683-N1687 VanDerWaalsContact O-ND2 3.13Å; I1683-V1711 HydrophobicContact CD1-CB 4.1Å; I1683-V1711 HydrophobicContact CD1-CG1 3.66Å; I1683-V1711 HydrophobicContact CD1-CG2 3.65Å; I1683-V1711 HydrophobicContact CG1-CG2 4.22Å
1684	D	49.5	Very low	42.3	Very low	85 Å²	85	64.6 Å²	64.6	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-63.8	-41.2	177.9	-166.3	50.8	0	0	0	111.8	D1680 E1681 N1687 K1688	D1680-D1684 PolarHBondContact O-N 2.95Å; E1681-D1684 PolarHBondContact O-N 3.4Å; D1684-N1687 PolarHBondContact O-N 3.19Å; D1684-K1688 WeakPolarHBondContact O-CE 3.47Å; D1684-K1688 VanDerWaalsContact O-CG 3.32Å; D1684-K1688 WeakPolarHBondContact O-CG 3.26Å; D1684-K1688 PolarHBondContact O-N 3.45Å; D1684-K1688 WeakPolarHBondContact OD2-CE 3.29Å; D1684-K1688 IonicContact OD2-NZ 2.7Å; D1684-K1688 PolarHBondContact OD2-NZ 2.96Å
1685	D	45.8	Very low	42.9	Very low	89 Å²	89	68.2 Å²	68.2	48%	0.476	36%	0.363	S	S	.	.	H	α-helix	trans	-68.9	-34.2	173	-90.8	10.8	0	0	0	113.7	E1681 K1688 W1689	E1681-D1685 PolarHBondContact O-N 2.89Å; D1685-K1688 PolarHBondContact O-N 3.02Å; D1685-K1688 WeakPolarHBondContact OD1-CD 3.28Å; D1685-K1688 IonicContact OD1-NZ 3.76Å; D1685-K1688 PolarHBondContact OD1-NZ 3.09Å; D1685-W1689 PolarHBondContact O-N 3.01Å
1686	F	42.8	Very low	43.5	Very low	21 Å²	21	69.4 Å²	69.4	9%	0.092	38%	0.382	C	S	.	.	H	α-helix	trans	-65.7	-40.3	171.3	178	-122.7	0	0	0	112.3	L1657 A1682 I1683 W1689 L1690 L1707	L1657-F1686 HydrophobicContact CD1-CB 4.14Å; L1657-F1686 HydrophobicContact CD1-CD2 3.77Å; L1657-F1686 HydrophobicContact CD1-CG 4.34Å; L1657-F1686 HydrophobicContact CD2-CD2 3.26Å; L1657-F1686 HydrophobicContact CD2-CE2 3.4Å; L1657-F1686 HydrophobicContact CD2-CG 4.11Å; L1657-F1686 HydrophobicContact CD2-CZ 4.34Å; L1657-F1686 HydrophobicContact CG-CD2 4.15Å; A1682-F1686 WeakPolarHBondContact O-CB 3.34Å; A1682-F1686 PolarHBondContact O-N 3.47Å; I1683-F1686 PolarHBondContact O-N 3.45Å; F1686-W1689 AromaticContact CD2-CE3 3.98Å; F1686-W1689 HydrophobicContact CD2-CE3 3.98Å; F1686-W1689 AromaticContact CE2-CE3 3.76Å; F1686-W1689 HydrophobicContact CE2-CE3 3.76Å; F1686-W1689 AromaticContact CE2-CZ3 3.89Å; F1686-W1689 HydrophobicContact CE2-CZ3 3.89Å; F1686-W1689 PolarHBondContact O-N 2.93Å; F1686-L1690 HydrophobicContact CD1-CD1 3.89Å; F1686-L1690 HydrophobicContact CD2-CD1 4.37Å; F1686-L1690 HydrophobicContact CD2-CG 4.36Å; F1686-L1690 HydrophobicContact CE1-CD1 3.38Å; F1686-L1690 HydrophobicContact CE1-CG 4.29Å; F1686-L1690 HydrophobicContact CE2-CD1 3.94Å; F1686-L1690 HydrophobicContact CE2-CD2 4.26Å; F1686-L1690 HydrophobicContact CE2-CG 3.96Å; F1686-L1690 HydrophobicContact CG-CD1 4.37Å; F1686-L1690 HydrophobicContact CZ-CD1 3.44Å; F1686-L1690 VanDerWaalsContact CZ-CD1 3.44Å; F1686-L1690 HydrophobicContact CZ-CD2 4.16Å; F1686-L1690 HydrophobicContact CZ-CG 3.94Å; F1686-L1690 PolarHBondContact O-N 3.16Å; F1686-L1707 HydrophobicContact CD1-CD1 4.16Å; F1686-L1707 HydrophobicContact CE1-CB 4.33Å; F1686-L1707 HydrophobicContact CE1-CD1 3.29Å; F1686-L1707 HydrophobicContact CE1-CG 4.38Å; F1686-L1707 HydrophobicContact CZ-CD1 3.62Å
1687	N	47.4	Very low	44	Very low	38 Å²	38	66.1 Å²	66.1	20%	0.203	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-45.6	174.5	-76.6	-40.7	0	0	0	111.2	I1683 D1684 W1689 L1690 D1691	I1683-N1687 WeakPolarHBondContact O-CB 3.44Å; I1683-N1687 PolarHBondContact O-N 3.43Å; I1683-N1687 PolarHBondContact O-ND2 3.19Å; I1683-N1687 VanDerWaalsContact O-ND2 3.13Å; D1684-N1687 PolarHBondContact O-N 3.19Å; N1687-W1689 VanDerWaalsContact C-N 3.27Å; N1687-W1689 PolarHBondContact O-N 3.05Å; N1687-L1690 PolarHBondContact O-N 2.82Å; N1687-D1691 PolarHBondContact O-N 3.27Å
1688	K	54.7	Low	44.5	Very low	101 Å²	101	61.7 Å²	61.7	44%	0.439	35%	0.345	S	S	.	.	H	α-helix	trans	-57.1	-39.1	173.2	-69.1	163.6	-148.6	152.7	0	112.3	D1684 D1685	D1684-K1688 WeakPolarHBondContact O-CE 3.47Å; D1684-K1688 VanDerWaalsContact O-CG 3.32Å; D1684-K1688 WeakPolarHBondContact O-CG 3.26Å; D1684-K1688 PolarHBondContact O-N 3.45Å; D1684-K1688 WeakPolarHBondContact OD2-CE 3.29Å; D1684-K1688 IonicContact OD2-NZ 2.7Å; D1684-K1688 PolarHBondContact OD2-NZ 2.96Å; D1685-K1688 PolarHBondContact O-N 3.02Å; D1685-K1688 WeakPolarHBondContact OD1-CD 3.28Å; D1685-K1688 IonicContact OD1-NZ 3.76Å; D1685-K1688 PolarHBondContact OD1-NZ 3.09Å
1689	W	43.4	Very low	44.8	Very low	111 Å²	111	60.8 Å²	60.8	42%	0.42	33%	0.333	S	S	.	.	H	α-helix	trans	-67.2	-44.2	176	178.4	71.6	0	0	0	112.4	D1685 F1686 N1687 D1691 T1692 L1693	D1685-W1689 PolarHBondContact O-N 3.01Å; F1686-W1689 AromaticContact CD2-CE3 3.98Å; F1686-W1689 HydrophobicContact CD2-CE3 3.98Å; F1686-W1689 AromaticContact CE2-CE3 3.76Å; F1686-W1689 HydrophobicContact CE2-CE3 3.76Å; F1686-W1689 AromaticContact CE2-CZ3 3.89Å; F1686-W1689 HydrophobicContact CE2-CZ3 3.89Å; F1686-W1689 PolarHBondContact O-N 2.93Å; N1687-W1689 VanDerWaalsContact C-N 3.27Å; N1687-W1689 PolarHBondContact O-N 3.05Å; W1689-D1691 VanDerWaalsContact C-N 3.29Å; W1689-D1691 PolarHBondContact O-N 3.38Å; W1689-T1692 WeakPolarHBondContact O-CB 3.24Å; W1689-T1692 PolarHBondContact O-N 3.36Å; W1689-T1692 PolarHBondContact O-OG1 3.37Å; W1689-L1693 HydrophobicContact CE3-CD1 4.47Å; W1689-L1693 HydrophobicContact CH2-CD1 3.66Å; W1689-L1693 HydrophobicContact CZ2-CD1 3.92Å; W1689-L1693 HydrophobicContact CZ2-CG 4.48Å; W1689-L1693 HydrophobicContact CZ3-CD1 3.94Å
1690	L	41.2	Very low	45.1	Very low	5 Å²	5	60.3 Å²	60.3	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-34.6	177.3	-74	169.4	0	0	0	112.7	F1686 N1687 T1692 L1693 I1700 K1704	F1686-L1690 HydrophobicContact CD1-CD1 3.89Å; F1686-L1690 HydrophobicContact CD2-CD1 4.37Å; F1686-L1690 HydrophobicContact CD2-CG 4.36Å; F1686-L1690 HydrophobicContact CE1-CD1 3.38Å; F1686-L1690 HydrophobicContact CE1-CG 4.29Å; F1686-L1690 HydrophobicContact CE2-CD1 3.94Å; F1686-L1690 HydrophobicContact CE2-CD2 4.26Å; F1686-L1690 HydrophobicContact CE2-CG 3.96Å; F1686-L1690 HydrophobicContact CG-CD1 4.37Å; F1686-L1690 HydrophobicContact CZ-CD1 3.44Å; F1686-L1690 VanDerWaalsContact CZ-CD1 3.44Å; F1686-L1690 HydrophobicContact CZ-CD2 4.16Å; F1686-L1690 HydrophobicContact CZ-CG 3.94Å; F1686-L1690 PolarHBondContact O-N 3.16Å; N1687-L1690 PolarHBondContact O-N 2.82Å; L1690-T1692 PolarHBondContact O-N 3.29Å; L1690-L1693 HydrophobicContact CD2-CD1 4.32Å; L1690-L1693 WeakPolarHBondContact O-CB 3.42Å; L1690-L1693 PolarHBondContact O-N 3.03Å; L1690-I1700 HydrophobicContact CB-CG2 4.1Å; L1690-I1700 HydrophobicContact CD2-CG2 4.11Å; L1690-K1704 HydrophobicContact CD1-CG 3.49Å; L1690-K1704 VanDerWaalsContact CD1-CG 3.49Å
1691	D	48.3	Very low	45.7	Very low	73 Å²	73	60.6 Å²	60.6	39%	0.39	33%	0.329	S	S	.	.	H	α-helix	trans	-59.5	-32.4	172.4	-83.2	33.2	0	0	0	112.3	N1687 W1689 L1693 G1694 N1695 K1704	N1687-D1691 PolarHBondContact O-N 3.27Å; W1689-D1691 VanDerWaalsContact C-N 3.29Å; W1689-D1691 PolarHBondContact O-N 3.38Å; D1691-L1693 PolarHBondContact O-N 3.09Å; D1691-G1694 PolarHBondContact O-N 3.39Å; D1691-G1694 VanDerWaalsContact O-N 3.16Å; D1691-N1695 PolarHBondContact OD1-OD1 2.85Å; D1691-N1695 PolarHBondContact OD2-ND2 2.93Å; D1691-K1704 IonicContact OD1-NZ 2.67Å; D1691-K1704 PolarHBondContact OD1-NZ 3.46Å
1692	T	38.5	Very low	46	Very low	107 Å²	107	54 Å²	54	66%	0.656	30%	0.299	S	S	*	.	H	α-helix	trans	-70.3	-18.1	175.4	73.4	0	0	0	0	114.1	W1689 L1690 G1694	W1689-T1692 WeakPolarHBondContact O-CB 3.24Å; W1689-T1692 PolarHBondContact O-N 3.36Å; W1689-T1692 PolarHBondContact O-OG1 3.37Å; L1690-T1692 PolarHBondContact O-N 3.29Å; T1692-G1694 VanDerWaalsContact C-N 3.3Å
1693	L	38.1	Very low	46.2	Very low	93 Å²	93	55.5 Å²	55.5	49%	0.487	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-3.2	173.6	-66.2	178.2	0	0	0	113.1	W1689 L1690 D1691 I1700	W1689-L1693 HydrophobicContact CE3-CD1 4.47Å; W1689-L1693 HydrophobicContact CH2-CD1 3.66Å; W1689-L1693 HydrophobicContact CZ2-CD1 3.92Å; W1689-L1693 HydrophobicContact CZ2-CG 4.48Å; W1689-L1693 HydrophobicContact CZ3-CD1 3.94Å; L1690-L1693 HydrophobicContact CD2-CD1 4.32Å; L1690-L1693 WeakPolarHBondContact O-CB 3.42Å; L1690-L1693 PolarHBondContact O-N 3.03Å; D1691-L1693 PolarHBondContact O-N 3.09Å; L1693-I1700 HydrophobicContact CB-CD1 3.52Å; L1693-I1700 HydrophobicContact CD1-CD1 4.27Å
1694	G	37.5	Very low	46.6	Very low	34 Å²	34	55.2 Å²	55.2	35%	0.351	30%	0.302	S	S	.	.			trans	101.2	109.2	172.1	0	0	0	0	0	113.6	D1691 T1692	D1691-G1694 PolarHBondContact O-N 3.39Å; D1691-G1694 VanDerWaalsContact O-N 3.16Å; T1692-G1694 VanDerWaalsContact C-N 3.3Å
1695	N	46.4	Very low	46.8	Very low	106 Å²	106	55.3 Å²	55.3	57%	0.567	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	136.4	173.6	-72.3	-18.9	0	0	0	111.7	D1691	D1691-N1695 PolarHBondContact OD1-OD1 2.85Å; D1691-N1695 PolarHBondContact OD2-ND2 2.93Å
1696	G	49	Very low	46.7	Very low	48 Å²	48	51.4 Å²	51.4	50%	0.495	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.5	-1.5	178.1	0	0	0	0	0	116.3	P1698	G1696-P1698 WeakPolarHBondContact O-CD 3.49Å
1697	N	44.8	Very low	46.8	Very low	13 Å²	13	53.1 Å²	53.1	7%	0.07	29%	0.289	C	S	.	.			trans	-73.6	117.4	163.6	177.9	-17.8	0	0	0	109.3	I1699 I1700 E1701	N1697-I1699 PolarHBondContact O-N 3.36Å; N1697-I1699 VanDerWaalsContact O-N 3.16Å; N1697-I1699 WeakPolarHBondContact OD1-CB 3.42Å; N1697-I1699 PolarHBondContact OD1-N 3.38Å; N1697-I1700 HydrophobicContact CB-CB 4.19Å; N1697-I1700 HydrophobicContact CB-CD1 3.97Å; N1697-I1700 HydrophobicContact CB-CG1 4.14Å; N1697-I1700 WeakPolarHBondContact O-CB 3.27Å; N1697-I1700 PolarHBondContact O-N 3.06Å; N1697-E1701 PolarHBondContact O-N 3.24Å
1698	P	51.3	Low	47	Very low	27 Å²	27	54.3 Å²	54.3	18%	0.175	29%	0.294	C	S	.	.	H	α-helix	trans	-62	-28.2	-173.7	-24	35.2	0	0	0	114.4	G1590 K1593 W1597 G1696 I1700 G1702	G1590-P1698 WeakPolarHBondContact CA-O 3.48Å; G1590-P1698 CarbonylContact O-C 3.6Å; K1593-P1698 HydrophobicContact CB-CB 3.45Å; K1593-P1698 VanDerWaalsContact CB-CB 3.45Å; K1593-P1698 HydrophobicContact CB-CG 3.8Å; K1593-P1698 HydrophobicContact CD-CB 4.43Å; W1597-P1698 HydrophobicContact CB-CG 4.22Å; W1597-P1698 HydrophobicContact CG-CG 4.45Å; G1696-P1698 WeakPolarHBondContact O-CD 3.49Å; P1698-I1700 VanDerWaalsContact C-N 3.32Å; P1698-G1702 PolarHBondContact O-N 2.85Å
1699	I	45	Very low	46.4	Very low	30 Å²	30	51.7 Å²	51.7	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-67.4	-37.5	178.5	-50.7	166.6	0	0	0	110.2	G1590 F1616 N1697 G1702 L1703	G1590-I1699 VanDerWaalsContact O-CG1 3.22Å; G1590-I1699 WeakPolarHBondContact O-CG1 3.43Å; G1590-I1699 PolarHBondContact O-N 2.85Å; F1616-I1699 HydrophobicContact CE2-CD1 3.52Å; F1616-I1699 HydrophobicContact CZ-CD1 3.67Å; F1616-I1699 HydrophobicContact CZ-CG1 4.49Å; N1697-I1699 PolarHBondContact O-N 3.36Å; N1697-I1699 VanDerWaalsContact O-N 3.16Å; N1697-I1699 WeakPolarHBondContact OD1-CB 3.42Å; N1697-I1699 PolarHBondContact OD1-N 3.38Å; I1699-G1702 PolarHBondContact O-N 3.3Å; I1699-L1703 HydrophobicContact CG2-CD1 4.48Å; I1699-L1703 WeakPolarHBondContact O-CB 3.5Å; I1699-L1703 PolarHBondContact O-N 2.97Å
1700	I	47.6	Very low	46.3	Very low	13 Å²	13	48 Å²	48	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-70.3	-46.1	-179.9	-72.9	179.4	0	0	0	110.4	L1690 L1693 N1697 P1698 G1702 L1703 K1704	L1690-I1700 HydrophobicContact CB-CG2 4.1Å; L1690-I1700 HydrophobicContact CD2-CG2 4.11Å; L1693-I1700 HydrophobicContact CB-CD1 3.52Å; L1693-I1700 HydrophobicContact CD1-CD1 4.27Å; N1697-I1700 HydrophobicContact CB-CB 4.19Å; N1697-I1700 HydrophobicContact CB-CD1 3.97Å; N1697-I1700 HydrophobicContact CB-CG1 4.14Å; N1697-I1700 WeakPolarHBondContact O-CB 3.27Å; N1697-I1700 PolarHBondContact O-N 3.06Å; P1698-I1700 VanDerWaalsContact C-N 3.32Å; I1700-G1702 VanDerWaalsContact C-N 3.27Å; I1700-G1702 PolarHBondContact O-N 3.47Å; I1700-L1703 PolarHBondContact O-N 3.14Å; I1700-K1704 WeakPolarHBondContact O-CG 3.47Å; I1700-K1704 PolarHBondContact O-N 3.05Å
1701	E	56.6	Low	46.5	Very low	84 Å²	84	48.9 Å²	48.9	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-59.6	-39.4	172.7	-60	-56.9	146.3	0	0	111.6	N1697 K1704 Q1705	N1697-E1701 PolarHBondContact O-N 3.24Å; E1701-K1704 PolarHBondContact O-N 3.28Å; E1701-Q1705 PolarHBondContact O-N 3.41Å
1702	G	51.5	Low	46.3	Very low	3 Å²	3	49.5 Å²	49.5	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-62.1	-44.9	173.6	0	0	0	0	0	113.4	P1586 I1587 P1698 I1699 I1700 S1706	P1586-G1702 WeakPolarHBondContact O-CA 3.49Å; I1587-G1702 PolarHBondContact N-O 2.91Å; P1698-G1702 PolarHBondContact O-N 2.85Å; I1699-G1702 PolarHBondContact O-N 3.3Å; I1700-G1702 VanDerWaalsContact C-N 3.27Å; I1700-G1702 PolarHBondContact O-N 3.47Å; G1702-S1706 WeakPolarHBondContact O-CB 3.44Å; G1702-S1706 PolarHBondContact O-N 3.39Å; G1702-S1706 VanDerWaalsContact O-N 3.08Å; G1702-S1706 PolarHBondContact O-OG 3.16Å
1703	L	46.8	Very low	46.3	Very low	50 Å²	50	46.7 Å²	46.7	26%	0.262	27%	0.265	S	S	.	.	H	α-helix	trans	-64.2	-41.3	176.1	-98.7	160.2	0	0	0	112.6	I1587 I1699 I1700 L1707	I1587-L1703 HydrophobicContact CD1-CD2 3.99Å; I1587-L1703 HydrophobicContact CD1-CG 4.31Å; I1587-L1703 HydrophobicContact CG1-CD2 4.35Å; I1587-L1703 HydrophobicContact CG1-CG 4.11Å; I1699-L1703 HydrophobicContact CG2-CD1 4.48Å; I1699-L1703 WeakPolarHBondContact O-CB 3.5Å; I1699-L1703 PolarHBondContact O-N 2.97Å; I1700-L1703 PolarHBondContact O-N 3.14Å; L1703-L1707 PolarHBondContact O-N 3.47Å
1704	K	53.4	Low	46.4	Very low	29 Å²	29	45.5 Å²	45.5	13%	0.126	26%	0.258	C	S	.	.	H	α-helix	trans	-53	-62.2	174.1	-75.4	-177.4	174.2	172.2	0	110.8	L1690 D1691 I1700 E1701 S1706 L1707 I1708	L1690-K1704 HydrophobicContact CD1-CG 3.49Å; L1690-K1704 VanDerWaalsContact CD1-CG 3.49Å; D1691-K1704 IonicContact OD1-NZ 2.67Å; D1691-K1704 PolarHBondContact OD1-NZ 3.46Å; I1700-K1704 WeakPolarHBondContact O-CG 3.47Å; I1700-K1704 PolarHBondContact O-N 3.05Å; E1701-K1704 PolarHBondContact O-N 3.28Å; K1704-S1706 VanDerWaalsContact C-N 3.33Å; K1704-S1706 PolarHBondContact O-N 2.91Å; K1704-L1707 PolarHBondContact O-N 3.14Å; K1704-I1708 WeakPolarHBondContact O-CG1 3.48Å; K1704-I1708 PolarHBondContact O-N 3.18Å
1705	Q	52.9	Low	46.4	Very low	87 Å²	87	44.2 Å²	44.2	41%	0.407	24%	0.244	S	C	.	.	H	α-helix	trans	-64.4	-38.4	-173.8	-172.7	67.4	59.9	0	0	112	P1586 E1701 L1707 I1708 D1709	P1586-Q1705 HydrophobicContact CB-CB 3.69Å; P1586-Q1705 HydrophobicContact CB-CG 4.04Å; P1586-Q1705 HydrophobicContact CG-CB 3.71Å; P1586-Q1705 HydrophobicContact CG-CG 3.5Å; P1586-Q1705 VanDerWaalsContact CG-CG 3.5Å; E1701-Q1705 PolarHBondContact O-N 3.41Å; Q1705-L1707 VanDerWaalsContact C-N 3.26Å; Q1705-L1707 PolarHBondContact O-N 3.31Å; Q1705-I1708 PolarHBondContact O-N 3.15Å; Q1705-D1709 PolarHBondContact NE2-OD1 3.15Å; Q1705-D1709 VanDerWaalsContact O-CG 3.24Å; Q1705-D1709 PolarHBondContact O-N 2.88Å; Q1705-D1709 VanDerWaalsContact O-OD1 3.13Å
1706	S	44	Very low	46	Very low	7 Å²	7	45.1 Å²	45.1	5%	0.049	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-26.6	179.8	-48.7	0	0	0	0	113.2	G1583 I1587 G1702 K1704 L1710	G1583-S1706 VanDerWaalsContact O-CA 3.27Å; G1583-S1706 WeakPolarHBondContact O-CA 3.3Å; G1583-S1706 WeakPolarHBondContact O-CB 3.24Å; G1583-S1706 PolarHBondContact O-OG 3.13Å; G1583-S1706 VanDerWaalsContact O-OG 3.08Å; I1587-S1706 VanDerWaalsContact CD1-CB 3.49Å; I1587-S1706 VanDerWaalsContact CG1-OG 3.24Å; I1587-S1706 WeakPolarHBondContact CG1-OG 3.36Å; I1587-S1706 PolarHBondContact N-OG 2.9Å; G1702-S1706 WeakPolarHBondContact O-CB 3.44Å; G1702-S1706 PolarHBondContact O-N 3.39Å; G1702-S1706 VanDerWaalsContact O-N 3.08Å; G1702-S1706 PolarHBondContact O-OG 3.16Å; K1704-S1706 VanDerWaalsContact C-N 3.33Å; K1704-S1706 PolarHBondContact O-N 2.91Å; S1706-L1710 VanDerWaalsContact O-CB 3.3Å; S1706-L1710 WeakPolarHBondContact O-CB 3.28Å; S1706-L1710 PolarHBondContact O-N 3Å; S1706-L1710 VanDerWaalsContact O-N 3.14Å
1707	L	44.1	Very low	45.3	Very low	56 Å²	56	46.9 Å²	46.9	29%	0.293	25%	0.247	S	C	.	.	H	α-helix	trans	-79.6	-34.4	174.2	-104.4	158.7	0	0	0	112.7	F1686 L1703 K1704 Q1705 L1710 V1711	F1686-L1707 HydrophobicContact CD1-CD1 4.16Å; F1686-L1707 HydrophobicContact CE1-CB 4.33Å; F1686-L1707 HydrophobicContact CE1-CD1 3.29Å; F1686-L1707 HydrophobicContact CE1-CG 4.38Å; F1686-L1707 HydrophobicContact CZ-CD1 3.62Å; L1703-L1707 PolarHBondContact O-N 3.47Å; K1704-L1707 PolarHBondContact O-N 3.14Å; Q1705-L1707 VanDerWaalsContact C-N 3.26Å; Q1705-L1707 PolarHBondContact O-N 3.31Å; L1707-L1710 HydrophobicContact CD2-CD2 4.38Å; L1707-L1710 PolarHBondContact O-N 3.3Å; L1707-V1711 WeakPolarHBondContact O-CB 3.43Å; L1707-V1711 VanDerWaalsContact O-CG2 3.25Å; L1707-V1711 WeakPolarHBondContact O-CG2 3.22Å; L1707-V1711 PolarHBondContact O-N 3.35Å
1708	I	51.5	Low	44.9	Very low	63 Å²	63	48.3 Å²	48.3	32%	0.323	26%	0.255	S	S	.	.	H	α-helix	trans	-60.3	-51	170.1	-65.1	167.6	0	0	0	109.9	K1704 Q1705 L1710 V1711 D1712	K1704-I1708 WeakPolarHBondContact O-CG1 3.48Å; K1704-I1708 PolarHBondContact O-N 3.18Å; Q1705-I1708 PolarHBondContact O-N 3.15Å; I1708-L1710 VanDerWaalsContact C-N 3.31Å; I1708-L1710 PolarHBondContact O-N 3.13Å; I1708-V1711 WeakPolarHBondContact O-CB 3.31Å; I1708-V1711 PolarHBondContact O-N 3.28Å; I1708-D1712 PolarHBondContact O-N 2.94Å; I1708-D1712 VanDerWaalsContact O-N 3.09Å
1709	D	43.1	Very low	44.1	Very low	46 Å²	46	51.2 Å²	51.2	25%	0.246	27%	0.265	C	S	.	.	H	α-helix	trans	-63.3	-35.8	-179.9	-64.1	5.7	0	0	0	112.2	G1583 Q1705 V1713	G1583-D1709 VanDerWaalsContact CA-CB 3.44Å; G1583-D1709 WeakPolarHBondContact CA-OD2 3.48Å; Q1705-D1709 PolarHBondContact NE2-OD1 3.15Å; Q1705-D1709 VanDerWaalsContact O-CG 3.24Å; Q1705-D1709 PolarHBondContact O-N 2.88Å; Q1705-D1709 VanDerWaalsContact O-OD1 3.13Å; D1709-V1713 WeakPolarHBondContact O-CG2 3.42Å; D1709-V1713 PolarHBondContact O-N 3.03Å
1710	L	41.7	Very low	43.6	Very low	34 Å²	34	52.5 Å²	52.5	18%	0.178	28%	0.28	C	S	.	.	H	α-helix	trans	-67.8	-40.7	175.8	-170.6	76.5	0	0	0	112	I1582 F1630 S1706 L1707 I1708 D1712 V1713 I1714	I1582-L1710 HydrophobicContact CG2-CD1 3.94Å; F1630-L1710 HydrophobicContact CE2-CD1 4.19Å; F1630-L1710 HydrophobicContact CZ-CD1 4.5Å; S1706-L1710 VanDerWaalsContact O-CB 3.3Å; S1706-L1710 WeakPolarHBondContact O-CB 3.28Å; S1706-L1710 PolarHBondContact O-N 3Å; S1706-L1710 VanDerWaalsContact O-N 3.14Å; L1707-L1710 HydrophobicContact CD2-CD2 4.38Å; L1707-L1710 PolarHBondContact O-N 3.3Å; I1708-L1710 VanDerWaalsContact C-N 3.31Å; I1708-L1710 PolarHBondContact O-N 3.13Å; L1710-D1712 VanDerWaalsContact C-N 3.32Å; L1710-V1713 PolarHBondContact O-N 2.94Å; L1710-I1714 HydrophobicContact CD2-CD1 4.31Å; L1710-I1714 HydrophobicContact CG-CD1 3.99Å; L1710-I1714 VanDerWaalsContact O-CG1 3.31Å; L1710-I1714 WeakPolarHBondContact O-CG1 3.34Å; L1710-I1714 PolarHBondContact O-N 2.77Å
1711	V	45.4	Very low	42.9	Very low	23 Å²	23	56.7 Å²	56.7	14%	0.139	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-44.7	175	156.3	0	0	0	0	110.9	L1679 I1683 L1707 I1708 V1713 I1714 S1715	L1679-V1711 HydrophobicContact CD1-CG2 4.17Å; L1679-V1711 HydrophobicContact CD2-CG1 3.87Å; L1679-V1711 HydrophobicContact CG-CG1 4.02Å; I1683-V1711 HydrophobicContact CD1-CB 4.1Å; I1683-V1711 HydrophobicContact CD1-CG1 3.66Å; I1683-V1711 HydrophobicContact CD1-CG2 3.65Å; I1683-V1711 HydrophobicContact CG1-CG2 4.22Å; L1707-V1711 WeakPolarHBondContact O-CB 3.43Å; L1707-V1711 VanDerWaalsContact O-CG2 3.25Å; L1707-V1711 WeakPolarHBondContact O-CG2 3.22Å; L1707-V1711 PolarHBondContact O-N 3.35Å; I1708-V1711 WeakPolarHBondContact O-CB 3.31Å; I1708-V1711 PolarHBondContact O-N 3.28Å; V1711-V1713 VanDerWaalsContact C-N 3.35Å; V1711-V1713 PolarHBondContact O-N 3.16Å; V1711-I1714 PolarHBondContact O-N 2.91Å; V1711-S1715 PolarHBondContact O-N 3.5Å
1712	D	42.8	Very low	41.9	Very low	87 Å²	87	54.6 Å²	54.6	47%	0.465	29%	0.289	S	S	.	.	H	α-helix	trans	-58.3	-47.4	176.9	-106.8	-21.9	0	0	0	111.2	I1708 L1710 I1714 S1715 H1716	I1708-D1712 PolarHBondContact O-N 2.94Å; I1708-D1712 VanDerWaalsContact O-N 3.09Å; L1710-D1712 VanDerWaalsContact C-N 3.32Å; D1712-I1714 PolarHBondContact O-N 2.94Å; D1712-S1715 PolarHBondContact O-N 2.73Å; D1712-S1715 PolarHBondContact O-OG 3.35Å; D1712-H1716 PolarHBondContact O-N 3.24Å; D1712-H1716 PolarHBondContact O-ND1 3.33Å
1713	V	39.6	Very low	41.1	Very low	47 Å²	47	60.4 Å²	60.4	29%	0.285	32%	0.315	S	S	.	.	H	α-helix	trans	-60.6	-42.1	176.6	172.3	0	0	0	0	112	I1582 D1709 L1710 V1711 S1715 H1716 P1717	I1582-V1713 HydrophobicContact CG2-CG1 4.44Å; I1582-V1713 HydrophobicContact CG2-CG2 4.33Å; D1709-V1713 WeakPolarHBondContact O-CG2 3.42Å; D1709-V1713 PolarHBondContact O-N 3.03Å; L1710-V1713 PolarHBondContact O-N 2.94Å; V1711-V1713 VanDerWaalsContact C-N 3.35Å; V1711-V1713 PolarHBondContact O-N 3.16Å; V1713-S1715 VanDerWaalsContact C-N 3.34Å; V1713-H1716 PolarHBondContact O-N 3.17Å; V1713-P1717 WeakPolarHBondContact O-CD 3.48Å
1714	I	38.5	Very low	40.5	Very low	68 Å²	68	62.3 Å²	62.3	35%	0.349	33%	0.325	S	S	.	.	H	α-helix	trans	-65.8	-37	177.5	-68.3	163.5	0	0	0	111.1	F1630 L1710 V1711 D1712 H1716 P1717 I1718	F1630-I1714 HydrophobicContact CZ-CG1 4.31Å; L1710-I1714 HydrophobicContact CD2-CD1 4.31Å; L1710-I1714 HydrophobicContact CG-CD1 3.99Å; L1710-I1714 VanDerWaalsContact O-CG1 3.31Å; L1710-I1714 WeakPolarHBondContact O-CG1 3.34Å; L1710-I1714 PolarHBondContact O-N 2.77Å; V1711-I1714 PolarHBondContact O-N 2.91Å; D1712-I1714 PolarHBondContact O-N 2.94Å; I1714-H1716 VanDerWaalsContact C-N 3.27Å; I1714-H1716 PolarHBondContact O-N 2.94Å; I1714-P1717 WeakPolarHBondContact O-CD 3.28Å; I1714-I1718 HydrophobicContact CG2-CD1 3.9Å; I1714-I1718 WeakPolarHBondContact O-CD1 3.43Å
1715	S	38.9	Very low	39.7	Very low	7 Å²	7	64.7 Å²	64.7	5%	0.049	34%	0.338	C	S	.	.	H	α-helix	trans	-65.8	-26.8	-178.3	85.6	0	0	0	0	113.7	V1711 D1712 V1713 I1718 K1719	V1711-S1715 PolarHBondContact O-N 3.5Å; D1712-S1715 PolarHBondContact O-N 2.73Å; D1712-S1715 PolarHBondContact O-OG 3.35Å; V1713-S1715 VanDerWaalsContact C-N 3.34Å; S1715-I1718 PolarHBondContact O-N 2.68Å; S1715-K1719 WeakPolarHBondContact O-CB 3.22Å; S1715-K1719 WeakPolarHBondContact O-CD 3.46Å; S1715-K1719 VanDerWaalsContact O-CG 3.25Å; S1715-K1719 WeakPolarHBondContact O-CG 3.28Å; S1715-K1719 PolarHBondContact O-N 3.42Å; S1715-K1719 PolarHBondContact OG-NZ 3.3Å
1716	H	38.4	Very low	38.9	Very low	125 Å²	125	67.2 Å²	67.2	58%	0.579	35%	0.35	S	S	*	.	H	α-helix	trans	-66.9	-53.3	-175.2	-80.3	79.2	0	0	0	113.6	D1712 V1713 I1714 I1718 K1719 A1720	D1712-H1716 PolarHBondContact O-N 3.24Å; D1712-H1716 PolarHBondContact O-ND1 3.33Å; V1713-H1716 PolarHBondContact O-N 3.17Å; I1714-H1716 VanDerWaalsContact C-N 3.27Å; I1714-H1716 PolarHBondContact O-N 2.94Å; H1716-I1718 VanDerWaalsContact C-N 3.27Å; H1716-I1718 PolarHBondContact O-N 3.29Å; H1716-K1719 PolarHBondContact O-N 3.01Å; H1716-A1720 PolarHBondContact O-N 2.92Å
1717	P	33.2	Very low	38.4	Very low	86 Å²	86	69.8 Å²	69.8	56%	0.558	37%	0.365	S	S	*	.	H	α-helix	trans	-59.2	-35.2	173.7	-26.7	35.1	0	0	0	113.7	V1713 I1714 A1720 F1721	V1713-P1717 WeakPolarHBondContact O-CD 3.48Å; I1714-P1717 WeakPolarHBondContact O-CD 3.28Å; P1717-A1720 PolarHBondContact O-N 2.9Å; P1717-F1721 WeakPolarHBondContact O-CB 3.48Å; P1717-F1721 PolarHBondContact O-N 2.94Å
1718	I	36.4	Very low	37.9	Very low	43 Å²	43	73.9 Å²	73.9	22%	0.221	38%	0.377	C	S	.	.	H	α-helix	trans	-68.5	-41.6	177.9	-74.4	153.7	0	0	0	111.2	M1675 I1714 S1715 H1716 A1720 F1721 N1722	M1675-I1718 HydrophobicContact CE-CD1 3.62Å; M1675-I1718 HydrophobicContact CE-CG1 4.29Å; M1675-I1718 HydrophobicContact CE-CG2 3.83Å; M1675-I1718 HydrophobicContact SD-CG2 3.93Å; I1714-I1718 HydrophobicContact CG2-CD1 3.9Å; I1714-I1718 WeakPolarHBondContact O-CD1 3.43Å; S1715-I1718 PolarHBondContact O-N 2.68Å; H1716-I1718 VanDerWaalsContact C-N 3.27Å; H1716-I1718 PolarHBondContact O-N 3.29Å; I1718-A1720 VanDerWaalsContact C-N 3.27Å; I1718-A1720 PolarHBondContact O-N 3.03Å; I1718-F1721 PolarHBondContact O-N 3.42Å; I1718-N1722 WeakPolarHBondContact O-CB 3.26Å; I1718-N1722 VanDerWaalsContact O-CG 3.31Å; I1718-N1722 PolarHBondContact O-N 3.26Å; I1718-N1722 PolarHBondContact O-OD1 3.49Å
1719	K	35.6	Very low	37	Very low	88 Å²	88	74.2 Å²	74.2	38%	0.383	38%	0.38	S	S	.	.	H	α-helix	trans	-58.2	-39.1	173	-75.4	160	-177.8	160.6	0	111.5	H1676 S1715 H1716 Q1723	H1676-K1719 WeakPolarHBondContact NE2-CE 3.48Å; H1676-K1719 PolarHBondContact NE2-NZ 3.07Å; S1715-K1719 WeakPolarHBondContact O-CB 3.22Å; S1715-K1719 WeakPolarHBondContact O-CD 3.46Å; S1715-K1719 VanDerWaalsContact O-CG 3.25Å; S1715-K1719 WeakPolarHBondContact O-CG 3.28Å; S1715-K1719 PolarHBondContact O-N 3.42Å; S1715-K1719 PolarHBondContact OG-NZ 3.3Å; H1716-K1719 PolarHBondContact O-N 3.01Å; K1719-Q1723 WeakPolarHBondContact O-CG 3.43Å; K1719-Q1723 PolarHBondContact O-N 3.26Å
1720	A	33.5	Very low	36.7	Very low	57 Å²	57	74.4 Å²	74.4	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-72.4	-37.8	173.8	0	0	0	0	0	113.7	H1716 P1717 I1718 Q1723 L1724	H1716-A1720 PolarHBondContact O-N 2.92Å; P1717-A1720 PolarHBondContact O-N 2.9Å; I1718-A1720 VanDerWaalsContact C-N 3.27Å; I1718-A1720 PolarHBondContact O-N 3.03Å; A1720-Q1723 PolarHBondContact O-N 2.88Å; A1720-L1724 PolarHBondContact O-N 2.81Å; A1720-L1724 VanDerWaalsContact O-N 3.11Å
1721	F	33.7	Very low	36.2	Very low	100 Å²	100	75.9 Å²	75.9	44%	0.439	40%	0.396	S	S	.	.	H	α-helix	trans	-71.3	-35.8	179.6	-165.9	-93.2	0	0	0	112.4	P1717 I1718 Q1723 L1724 M1725	P1717-F1721 WeakPolarHBondContact O-CB 3.48Å; P1717-F1721 PolarHBondContact O-N 2.94Å; I1718-F1721 PolarHBondContact O-N 3.42Å; F1721-Q1723 VanDerWaalsContact C-N 3.35Å; F1721-Q1723 PolarHBondContact O-N 3.44Å; F1721-L1724 WeakPolarHBondContact O-CB 3.43Å; F1721-L1724 PolarHBondContact O-N 2.86Å; F1721-L1724 VanDerWaalsContact O-N 3.15Å; F1721-M1725 HydrophobicContact CD1-CG 3.88Å; F1721-M1725 HydrophobicContact CE1-CG 3.56Å; F1721-M1725 HydrophobicContact CE1-SD 4.15Å; F1721-M1725 HydrophobicContact CZ-CG 4.34Å; F1721-M1725 PolarHBondContact O-N 3.25Å
1722	N	35.8	Very low	35.6	Very low	40 Å²	40	81.4 Å²	81.4	21%	0.214	42%	0.42	C	S	.	.	H	α-helix	trans	-61.2	-43.6	173	-72.8	6.2	0	0	0	111	F1672 I1718 L1724 M1725 E1726	F1672-N1722 WeakPolarHBondContact CD1-OD1 3.25Å; I1718-N1722 WeakPolarHBondContact O-CB 3.26Å; I1718-N1722 VanDerWaalsContact O-CG 3.31Å; I1718-N1722 PolarHBondContact O-N 3.26Å; I1718-N1722 PolarHBondContact O-OD1 3.49Å; N1722-L1724 VanDerWaalsContact C-N 3.3Å; N1722-L1724 PolarHBondContact O-N 3.34Å; N1722-M1725 PolarHBondContact O-N 3.46Å; N1722-E1726 WeakPolarHBondContact O-CG 3.46Å; N1722-E1726 PolarHBondContact O-N 2.89Å
1723	Q	33.2	Very low	35.3	Very low	125 Å²	125	84.5 Å²	84.5	58%	0.584	43%	0.429	S	S	*	.	H	α-helix	trans	-62	-35.7	173.8	-70.3	173.6	-8.4	0	0	112.4	K1719 A1720 F1721 V1727	K1719-Q1723 WeakPolarHBondContact O-CG 3.43Å; K1719-Q1723 PolarHBondContact O-N 3.26Å; A1720-Q1723 PolarHBondContact O-N 2.88Å; F1721-Q1723 VanDerWaalsContact C-N 3.35Å; F1721-Q1723 PolarHBondContact O-N 3.44Å; Q1723-V1727 WeakPolarHBondContact O-CG2 3.45Å; Q1723-V1727 PolarHBondContact O-N 3.24Å
1724	L	35.5	Very low	34.9	Very low	90 Å²	90	84 Å²	84	47%	0.471	43%	0.428	S	S	.	.	H	α-helix	trans	-70.5	-37.7	175.1	-161.6	75	0	0	0	112.3	A1720 F1721 N1722 V1727 Y1728	A1720-L1724 PolarHBondContact O-N 2.81Å; A1720-L1724 VanDerWaalsContact O-N 3.11Å; F1721-L1724 WeakPolarHBondContact O-CB 3.43Å; F1721-L1724 PolarHBondContact O-N 2.86Å; F1721-L1724 VanDerWaalsContact O-N 3.15Å; N1722-L1724 VanDerWaalsContact C-N 3.3Å; N1722-L1724 PolarHBondContact O-N 3.34Å; L1724-V1727 PolarHBondContact O-N 2.9Å; L1724-Y1728 PolarHBondContact O-N 2.88Å
1725	M	35.3	Very low	34.8	Very low	80 Å²	80	86.9 Å²	86.9	39%	0.394	44%	0.444	S	S	.	.	H	α-helix	trans	-66.2	-38	174	-82	-69.7	-63.6	0	0	112.3	F1721 N1722 V1727 Y1728 D1729	F1721-M1725 HydrophobicContact CD1-CG 3.88Å; F1721-M1725 HydrophobicContact CE1-CG 3.56Å; F1721-M1725 HydrophobicContact CE1-SD 4.15Å; F1721-M1725 HydrophobicContact CZ-CG 4.34Å; F1721-M1725 PolarHBondContact O-N 3.25Å; N1722-M1725 PolarHBondContact O-N 3.46Å; M1725-V1727 VanDerWaalsContact C-N 3.32Å; M1725-V1727 PolarHBondContact O-N 3.24Å; M1725-Y1728 PolarHBondContact O-N 2.95Å; M1725-D1729 WeakPolarHBondContact O-CB 3.19Å; M1725-D1729 PolarHBondContact O-N 2.91Å
1726	E	37	Very low	34.8	Very low	140 Å²	140	92.2 Å²	92.2	65%	0.654	48%	0.478	S	S	*	.	H	α-helix	trans	-61.7	-39.7	172.3	-74.6	179	170.2	0	0	111.7	N1722 A1730	N1722-E1726 WeakPolarHBondContact O-CG 3.46Å; N1722-E1726 PolarHBondContact O-N 2.89Å; E1726-A1730 WeakPolarHBondContact O-CB 3.42Å; E1726-A1730 PolarHBondContact O-N 3.19Å
1727	V	34.1	Very low	34.6	Very low	60 Å²	60	90.8 Å²	90.8	36%	0.364	48%	0.482	S	S	.	.	H	α-helix	trans	-64.9	-39.2	172.7	172.9	0	0	0	0	111.6	Q1723 L1724 M1725 L1731 L1747	Q1723-V1727 WeakPolarHBondContact O-CG2 3.45Å; Q1723-V1727 PolarHBondContact O-N 3.24Å; L1724-V1727 PolarHBondContact O-N 2.9Å; M1725-V1727 VanDerWaalsContact C-N 3.32Å; M1725-V1727 PolarHBondContact O-N 3.24Å; V1727-L1731 HydrophobicContact CG1-CD1 4.25Å; V1727-L1731 VanDerWaalsContact O-CG 3.3Å; V1727-L1731 WeakPolarHBondContact O-CG 3.26Å; V1727-L1731 PolarHBondContact O-N 3.1Å; V1727-L1747 HydrophobicContact CG2-CD2 4.42Å
1728	Y	32.5	Very low	34.5	Very low	143 Å²	143	90 Å²	90	56%	0.561	47%	0.473	S	S	*	.	H	α-helix	trans	-66.9	-49.5	178.6	-172	-82.1	0	0	0	112.2	L1724 M1725 A1730 L1731 E1732	L1724-Y1728 PolarHBondContact O-N 2.88Å; M1725-Y1728 PolarHBondContact O-N 2.95Å; Y1728-A1730 VanDerWaalsContact C-N 3.25Å; Y1728-A1730 PolarHBondContact O-N 3.2Å; Y1728-L1731 WeakPolarHBondContact O-CB 3.3Å; Y1728-L1731 PolarHBondContact O-N 2.93Å; Y1728-E1732 WeakPolarHBondContact CE1-OE2 3.43Å; Y1728-E1732 PolarHBondContact O-N 3.25Å
1729	D	33.8	Very low	34.5	Very low	70 Å²	70	91.9 Å²	91.9	37%	0.374	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-31.8	179.4	-162.6	67.8	0	0	0	111.7	M1725 L1731 K1733	M1725-D1729 WeakPolarHBondContact O-CB 3.19Å; M1725-D1729 PolarHBondContact O-N 2.91Å; D1729-L1731 VanDerWaalsContact C-N 3.29Å; D1729-L1731 PolarHBondContact O-N 2.86Å; D1729-K1733 PolarHBondContact O-N 3.14Å; D1729-K1733 IonicContact OD1-NZ 3.15Å; D1729-K1733 PolarHBondContact OD1-NZ 3.1Å; D1729-K1733 IonicContact OD2-NZ 3.44Å; D1729-K1733 PolarHBondContact OD2-NZ 3.34Å
1730	A	35.1	Very low	34.4	Very low	50 Å²	50	93.7 Å²	93.7	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-78.3	-3.8	172.4	0	0	0	0	0	114.9	E1726 Y1728 S1734 K1743	E1726-A1730 WeakPolarHBondContact O-CB 3.42Å; E1726-A1730 PolarHBondContact O-N 3.19Å; Y1728-A1730 VanDerWaalsContact C-N 3.25Å; Y1728-A1730 PolarHBondContact O-N 3.2Å; A1730-S1734 PolarHBondContact O-OG 3.43Å; A1730-K1743 PolarHBondContact O-NZ 2.62Å
1731	L	31.9	Very low	34.2	Very low	65 Å²	65	95.9 Å²	95.9	34%	0.34	50%	0.498	S	S	.	.	H	α-helix	trans	-96.3	-48.5	168	-75	165.6	0	0	0	110.9	V1727 Y1728 D1729 K1733 S1734 F1740	V1727-L1731 HydrophobicContact CG1-CD1 4.25Å; V1727-L1731 VanDerWaalsContact O-CG 3.3Å; V1727-L1731 WeakPolarHBondContact O-CG 3.26Å; V1727-L1731 PolarHBondContact O-N 3.1Å; Y1728-L1731 WeakPolarHBondContact O-CB 3.3Å; Y1728-L1731 PolarHBondContact O-N 2.93Å; D1729-L1731 VanDerWaalsContact C-N 3.29Å; D1729-L1731 PolarHBondContact O-N 2.86Å; L1731-K1733 PolarHBondContact O-N 3.02Å; L1731-K1733 VanDerWaalsContact O-N 3.15Å; L1731-S1734 PolarHBondContact O-N 3.4Å; L1731-S1734 VanDerWaalsContact O-N 3.17Å; L1731-S1734 PolarHBondContact O-OG 2.94Å; L1731-F1740 HydrophobicContact CD1-CE2 4.33Å; L1731-F1740 HydrophobicContact CD2-CD2 3.72Å; L1731-F1740 HydrophobicContact CD2-CE2 4.12Å
1732	E	32.2	Very low	34.2	Very low	139 Å²	139	92.8 Å²	92.8	65%	0.65	49%	0.494	S	S	*	.	H	α-helix	trans	-61	-25.4	-177.7	-172.1	167.9	-164.4	0	0	113.1	Y1728	Y1728-E1732 WeakPolarHBondContact CE1-OE2 3.43Å; Y1728-E1732 PolarHBondContact O-N 3.25Å
1733	K	36.9	Very low	33.9	Very low	152 Å²	152	94.2 Å²	94.2	66%	0.661	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	5.1	-179.4	-69.9	162.5	-179.5	156.6	0	115.1	D1729 L1731	D1729-K1733 PolarHBondContact O-N 3.14Å; D1729-K1733 IonicContact OD1-NZ 3.15Å; D1729-K1733 PolarHBondContact OD1-NZ 3.1Å; D1729-K1733 IonicContact OD2-NZ 3.44Å; D1729-K1733 PolarHBondContact OD2-NZ 3.34Å; L1731-K1733 PolarHBondContact O-N 3.02Å; L1731-K1733 VanDerWaalsContact O-N 3.15Å
1734	S	31.1	Very low	33.7	Very low	37 Å²	37	93 Å²	93	26%	0.259	50%	0.495	S	S	.	.	S	Bend	trans	-101	124.8	175.1	40.6	0	0	0	0	113.2	A1730 L1731 K1743	A1730-S1734 PolarHBondContact O-OG 3.43Å; L1731-S1734 PolarHBondContact O-N 3.4Å; L1731-S1734 VanDerWaalsContact O-N 3.17Å; L1731-S1734 PolarHBondContact O-OG 2.94Å; S1734-K1743 VanDerWaalsContact CB-NZ 3.32Å; S1734-K1743 PolarHBondContact OG-NZ 3.43Å
1735	D	37.8	Very low	33.4	Very low	128 Å²	128	95.4 Å²	95.4	68%	0.684	50%	0.502	S	S	*	.			trans	-58.8	138.2	172.7	-146.2	-17.5	0	0	0	109.9	S1737 D1738	D1735-S1737 PolarHBondContact O-N 3.26Å; D1735-D1738 PolarHBondContact O-N 2.72Å
1736	P	37.3	Very low	33.2	Very low	119 Å²	119	97 Å²	97	77%	0.773	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	6.5	-165.6	-25.9	37	0	0	0	118
1737	S	35.3	Very low	32.7	Very low	94 Å²	94	95.2 Å²	95.2	66%	0.657	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-30.8	175	48	0	0	0	0	114.1	D1735 T1739	D1735-S1737 PolarHBondContact O-N 3.26Å; S1737-T1739 PolarHBondContact O-N 3.37Å
1738	D	31.4	Very low	32.4	Very low	70 Å²	70	100.3 Å²	100.3	37%	0.374	53%	0.526	S	S	.	.	S	Bend	trans	-88.3	89.9	-178.3	-174.3	-12.5	0	0	0	109.6	D1735 F1740	D1735-D1738 PolarHBondContact O-N 2.72Å; D1738-F1740 PolarHBondContact O-N 2.78Å
1739	T	35.8	Very low	32.1	Very low	83 Å²	83	97 Å²	97	51%	0.509	52%	0.523	S	S	.	.			trans	-69.2	134.2	-157.5	65.1	0	0	0	0	114.6	S1737 I1741 G1742	S1737-T1739 PolarHBondContact O-N 3.37Å; T1739-I1741 PolarHBondContact O-N 3.17Å; T1739-G1742 PolarHBondContact O-N 2.95Å
1740	F	33	Very low	31.7	Very low	126 Å²	126	96.6 Å²	96.6	55%	0.553	53%	0.53	S	S	*	.	H	α-helix	trans	-32.5	-39.9	174.8	-177.8	-105.7	0	0	0	116.2	L1731 D1738 G1742 L1744	L1731-F1740 HydrophobicContact CD1-CE2 4.33Å; L1731-F1740 HydrophobicContact CD2-CD2 3.72Å; L1731-F1740 HydrophobicContact CD2-CE2 4.12Å; D1738-F1740 PolarHBondContact O-N 2.78Å; F1740-G1742 VanDerWaalsContact C-N 3.34Å; F1740-G1742 PolarHBondContact O-N 3.27Å; F1740-L1744 HydrophobicContact CE1-CD2 4.39Å; F1740-L1744 PolarHBondContact O-N 2.73Å; F1740-L1744 VanDerWaalsContact O-N 3.16Å
1741	I	29.9	Very low	31.2	Very low	103 Å²	103	104.4 Å²	104.4	53%	0.528	55%	0.55	S	S	.	*	H	α-helix	trans	-67.6	-30.4	-177.5	-63.7	177.6	0	0	0	112.5	T1739 L1744 K1745	T1739-I1741 PolarHBondContact O-N 3.17Å; I1741-L1744 PolarHBondContact O-N 2.62Å; I1741-K1745 HydrophobicContact CG2-CD 4.26Å; I1741-K1745 HydrophobicContact CG2-CG 4.41Å; I1741-K1745 WeakPolarHBondContact O-CG 3.32Å; I1741-K1745 PolarHBondContact O-N 2.76Å
1742	G	34.1	Very low	30.8	Very low	35 Å²	35	108.7 Å²	108.7	36%	0.361	57%	0.571	S	S	.	*	H	α-helix	trans	-63.2	-51.8	177	0	0	0	0	0	112	T1739 F1740 L1744 K1745 N1746	T1739-G1742 PolarHBondContact O-N 2.95Å; F1740-G1742 VanDerWaalsContact C-N 3.34Å; F1740-G1742 PolarHBondContact O-N 3.27Å; G1742-L1744 VanDerWaalsContact C-N 3.35Å; G1742-L1744 PolarHBondContact O-N 3.09Å; G1742-K1745 PolarHBondContact O-N 3.17Å; G1742-N1746 PolarHBondContact O-N 3.28Å
1743	K	29	Very low	30.4	Very low	70 Å²	70	107.5 Å²	107.5	30%	0.304	57%	0.567	S	S	.	*	H	α-helix	trans	-60.6	-42	175	-66.5	176.1	-178.3	172	0	111.7	A1730 S1734 K1745 N1746 L1747	A1730-K1743 PolarHBondContact O-NZ 2.62Å; S1734-K1743 VanDerWaalsContact CB-NZ 3.32Å; S1734-K1743 PolarHBondContact OG-NZ 3.43Å; K1743-K1745 PolarHBondContact O-N 3.44Å; K1743-N1746 PolarHBondContact O-N 2.9Å; K1743-L1747 PolarHBondContact O-N 3.16Å
1744	L	29.8	Very low	29.6	Very low	98 Å²	98	104.8 Å²	104.8	51%	0.513	56%	0.564	S	S	.	*	H	α-helix	trans	-65.1	-39.6	-179.5	-164.3	71.4	0	0	0	113.3	F1740 I1741 G1742 N1746 L1747 H1748	F1740-L1744 HydrophobicContact CE1-CD2 4.39Å; F1740-L1744 PolarHBondContact O-N 2.73Å; F1740-L1744 VanDerWaalsContact O-N 3.16Å; I1741-L1744 PolarHBondContact O-N 2.62Å; G1742-L1744 VanDerWaalsContact C-N 3.35Å; G1742-L1744 PolarHBondContact O-N 3.09Å; L1744-N1746 VanDerWaalsContact C-N 3.3Å; L1744-N1746 PolarHBondContact O-N 3.5Å; L1744-L1747 PolarHBondContact O-N 3.35Å; L1744-H1748 PolarHBondContact O-N 2.63Å
1745	K	28.3	Very low	29.2	Very low	142 Å²	142	110.6 Å²	110.6	62%	0.617	59%	0.592	S	S	*	*	H	α-helix	trans	-64.9	-32.8	175.5	-80.2	-179	175.6	177.5	0	112.7	I1741 G1742 K1743 S1749	I1741-K1745 HydrophobicContact CG2-CD 4.26Å; I1741-K1745 HydrophobicContact CG2-CG 4.41Å; I1741-K1745 WeakPolarHBondContact O-CG 3.32Å; I1741-K1745 PolarHBondContact O-N 2.76Å; G1742-K1745 PolarHBondContact O-N 3.17Å; K1743-K1745 PolarHBondContact O-N 3.44Å; K1745-S1749 WeakPolarHBondContact O-CB 3.15Å; K1745-S1749 PolarHBondContact O-N 3.09Å; K1745-S1749 VanDerWaalsContact O-N 3.12Å; K1745-S1749 PolarHBondContact O-OG 3.33Å
1746	N	31.5	Very low	28.5	Very low	113 Å²	113	114.5 Å²	114.5	60%	0.604	60%	0.603	S	S	*	*	H	α-helix	trans	-70.8	-38.5	176.7	-71	-12.7	0	0	0	111.9	G1742 K1743 L1744 H1748 S1749 A1750	G1742-N1746 PolarHBondContact O-N 3.28Å; K1743-N1746 PolarHBondContact O-N 2.9Å; L1744-N1746 VanDerWaalsContact C-N 3.3Å; L1744-N1746 PolarHBondContact O-N 3.5Å; N1746-H1748 PolarHBondContact O-N 2.93Å; N1746-S1749 PolarHBondContact O-N 2.66Å; N1746-A1750 WeakPolarHBondContact O-CB 3.36Å; N1746-A1750 PolarHBondContact O-N 3.31Å
1747	L	26.8	Very low	27.8	Very low	103 Å²	103	111.8 Å²	111.8	54%	0.539	59%	0.587	S	S	.	*	H	α-helix	trans	-58.4	-46.7	172.3	-104.2	77.5	0	0	0	112.2	V1727 K1743 L1744 S1749 A1750	V1727-L1747 HydrophobicContact CG2-CD2 4.42Å; K1743-L1747 PolarHBondContact O-N 3.16Å; L1744-L1747 PolarHBondContact O-N 3.35Å; L1747-S1749 VanDerWaalsContact C-N 3.26Å; L1747-S1749 PolarHBondContact O-N 3.34Å; L1747-A1750 PolarHBondContact O-N 2.95Å
1748	H	27.6	Very low	27.1	Very low	167 Å²	167	115.3 Å²	115.3	77%	0.773	59%	0.59	S	S	*	*	H	α-helix	trans	-69.2	-25.6	-179.3	-154.4	87.8	0	0	0	112.9	L1744 N1746	L1744-H1748 PolarHBondContact O-N 2.63Å; N1746-H1748 PolarHBondContact O-N 2.93Å
1749	S	26.3	Very low	26.7	Very low	72 Å²	72	119.3 Å²	119.3	50%	0.503	61%	0.612	S	S	.	*	H	α-helix	trans	-77.1	-28	175	-56.1	0	0	0	0	113	K1745 N1746 L1747	K1745-S1749 WeakPolarHBondContact O-CB 3.15Å; K1745-S1749 PolarHBondContact O-N 3.09Å; K1745-S1749 VanDerWaalsContact O-N 3.12Å; K1745-S1749 PolarHBondContact O-OG 3.33Å; N1746-S1749 PolarHBondContact O-N 2.66Å; L1747-S1749 VanDerWaalsContact C-N 3.26Å; L1747-S1749 PolarHBondContact O-N 3.34Å
1750	A	24.9	Very low	25.9	Very low	62 Å²	62	126.2 Å²	126.2	51%	0.512	63%	0.629	S	S	.	*	H	α-helix	trans	-73.5	-33.6	-172.1	0	0	0	0	0	114.3	N1746 L1747 M1752	N1746-A1750 WeakPolarHBondContact O-CB 3.36Å; N1746-A1750 PolarHBondContact O-N 3.31Å; L1747-A1750 PolarHBondContact O-N 2.95Å; A1750-M1752 PolarHBondContact O-N 2.83Å
1751	Y	23.7	Very low	25.2	Very low	214 Å²	214	123.2 Å²	123.2	84%	0.839	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-1.5	-165.2	-137.9	-90	0	0	0	115.8
1752	M	23.3	Very low	24.9	Very low	156 Å²	156	126.1 Å²	126.1	77%	0.768	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	-6.6	-168.8	-71.2	-62.1	-65.8	0	0	117	A1750	A1750-M1752 PolarHBondContact O-N 2.83Å
1753	I	24.2	Very low	24.2	Very low	113 Å²	113	132.3 Å²	132.3	58%	0.579	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.1	-33.4	-170.6	-61.5	-176.3	0	0	0	113.8	S1757	I1753-S1757 PolarHBondContact O-N 3.23Å; I1753-S1757 PolarHBondContact O-OG 2.95Å
1754	T	21.3	Very low	23.9	Very low	95 Å²	95	133.7 Å²	133.7	58%	0.583	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-32.3	-170.3	-27.3	0	0	0	0	113.9	S1757 K1758	T1754-S1757 CarbonylContact O-C 3.57Å; T1754-S1757 PolarHBondContact O-N 3.49Å; T1754-K1758 PolarHBondContact O-N 2.91Å
1755	D	23.1	Very low	23.4	Very low	159 Å²	159	137.7 Å²	137.7	85%	0.85	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	13.1	-175.4	-115.6	-30.2	0	0	0	115.4
1756	F	21.6	Very low	23.1	Very low	211 Å²	211	135.3 Å²	135.3	93%	0.925	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-9.3	150.6	-92.2	-80	0	0	0	112.5
1757	S	22.6	Very low	22.8	Very low	62 Å²	62	138.9 Å²	138.9	43%	0.434	72%	0.724	S	S	.	*	S	Bend	trans	-142.2	92.5	174.9	68.9	0	0	0	0	111.4	I1753 T1754	I1753-S1757 PolarHBondContact O-N 3.23Å; I1753-S1757 PolarHBondContact O-OG 2.95Å; T1754-S1757 CarbonylContact O-C 3.57Å; T1754-S1757 PolarHBondContact O-N 3.49Å
1758	K	21.9	Very low	22.6	Very low	167 Å²	167	140.1 Å²	140.1	73%	0.726	73%	0.731	S	S	*	*			cis	-148.3	167.2	11	-65.1	168.5	-174	161.2	0	110.8	T1754 R1760	T1754-K1758 PolarHBondContact O-N 2.91Å; K1758-R1760 CarbonylContact O-C 3.6Å; K1758-R1760 PolarHBondContact O-N 3.4Å; K1758-R1760 VanDerWaalsContact O-N 3.09Å; K1758-R1760 VanDerWaalsContact O-O 3.14Å
1759	N	21.6	Very low	22.2	Very low	155 Å²	155	138.9 Å²	138.9	83%	0.829	73%	0.727	S	S	*	*	S	Bend	trans	-52.3	114.1	159.2	-162.1	-19.2	0	0	0	109.5
1760	R	19.4	Very low	22.1	Very low	227 Å²	227	139.3 Å²	139.3	86%	0.857	72%	0.724	S	S	*	*			trans	71.8	134.4	-163.1	-42.9	161.1	-160.2	159.2	4.9	113.9	K1758	K1758-R1760 CarbonylContact O-C 3.6Å; K1758-R1760 PolarHBondContact O-N 3.4Å; K1758-R1760 VanDerWaalsContact O-N 3.09Å; K1758-R1760 VanDerWaalsContact O-O 3.14Å
1761	G	19.2	Very low	22.1	Very low	63 Å²	63	144.1 Å²	144.1	65%	0.649	74%	0.741	S	S	*	*			cis	163.4	162.6	-0.8	0	0	0	0	0	111.6
1762	D	22.7	Very low	22	Very low	164 Å²	164	140.3 Å²	140.3	88%	0.877	74%	0.74	S	S	*	*			trans	59.6	114.6	177.5	-50.9	-34.8	0	0	0	115.6	P1764	D1762-P1764 VanDerWaalsContact C-CD 3.43Å; D1762-P1764 WeakPolarHBondContact O-CD 3.36Å
1763	N	19.7	Very low	22.1	Very low	166 Å²	166	138.3 Å²	138.3	89%	0.888	74%	0.736	S	S	*	*			trans	-100.4	99.5	166.6	171.7	9.2	0	0	0	110.2
1764	P	21.8	Very low	22.1	Very low	99 Å²	99	142.5 Å²	142.5	64%	0.643	75%	0.754	S	S	*	*			trans	-121	107.7	163.7	37.1	-27.6	0	0	0	113.6	D1762	D1762-P1764 VanDerWaalsContact C-CD 3.43Å; D1762-P1764 WeakPolarHBondContact O-CD 3.36Å
1765	Q	20.8	Very low	22.2	Very low	181 Å²	181	141 Å²	141	85%	0.846	75%	0.75	S	S	*	*			trans	75.1	117	142.7	-55.3	-170.6	0.9	0	0	121.8
1766	A	21.3	Very low	22.2	Very low	92 Å²	92	139.3 Å²	139.3	76%	0.76	74%	0.742	S	S	*	*				90	157.6	128.9	0	0	0	0	0	121.6
1767	K	24.3	Very low	22.3	Very low	188 Å²	188	138.9 Å²	138.9	82%	0.817	74%	0.74	S	S	*	*			trans	80.9	152.2	167.7	-66.5	-179.1	-178	179.7	0	118.2
1768	N	23.5	Very low	22.3	Very low	129 Å²	129	140.9 Å²	140.9	69%	0.69	75%	0.753	S	S	*	*			cis	-171.6	162.9	-34.1	-116.7	36.9	0	0	0	107.7
1769	M	19.5	Very low	22.3	Very low	142 Å²	142	141.5 Å²	141.5	70%	0.7	76%	0.759	S	S	*	*			trans	31.1	125.5	147.1	-64	171	65.9	0	0	120.8
1770	D	22.8	Very low	22.6	Very low	81 Å²	81	138.9 Å²	138.9	43%	0.433	75%	0.749	S	S	.	*				14.1	128.8	120.7	-48.1	-64.1	0	0	0	119.4
1771	D	25.2	Very low	22.6	Very low	162 Å²	162	136.5 Å²	136.5	87%	0.866	75%	0.751	S	S	*	*			trans	-159.8	32	144.7	-124	-11.9	0	0	0	113.6
1772	V	23.2	Very low	22.8	Very low	134 Å²	134	136.9 Å²	136.9	81%	0.812	76%	0.755	S	S	*	*	S	Bend	trans	-133.3	128.4	169.8	-179.3	0	0	0	0	109.4
1773	T	23.7	Very low	23.2	Very low	114 Å²	114	130.9 Å²	130.9	70%	0.699	73%	0.732	S	S	*	*			trans	-108.2	169.2	-156.1	51.8	0	0	0	0	115.4	A1775	T1773-A1775 VanDerWaalsContact C-N 3.27Å; T1773-A1775 PolarHBondContact O-N 3.01Å
1774	Q	24.7	Very low	24	Very low	202 Å²	202	128.1 Å²	128.1	94%	0.944	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	67.1	179.2	-167.3	-178.3	24.3	0	0	113.7
1775	A	24.5	Very low	24.8	Very low	62 Å²	62	131.4 Å²	131.4	51%	0.512	72%	0.718	S	S	.	*	T	Hydrogen-bonded Turn	trans	-124.9	-37.6	177.2	0	0	0	0	0	114.1	T1773	T1773-A1775 VanDerWaalsContact C-N 3.27Å; T1773-A1775 PolarHBondContact O-N 3.01Å
1776	D	23.1	Very low	25.7	Very low	125 Å²	125	126.3 Å²	126.3	67%	0.668	70%	0.699	S	S	*	*	S	Bend	trans	-91.8	-2.2	-159.2	-69.9	-25.7	0	0	0	116.9
1777	F	22	Very low	26.6	Very low	202 Å²	202	124.2 Å²	124.2	89%	0.886	68%	0.675	S	S	*	*	S	Bend	trans	-135.7	12.3	-172.2	-89	-75.6	0	0	0	117.6
1778	S	22.9	Very low	27.8	Very low	103 Å²	103	118.3 Å²	118.3	72%	0.72	65%	0.652	S	S	*	*	S	Bend	trans	-101.4	-4.9	174.6	56.1	0	0	0	0	115.5
1779	E	22.9	Very low	28.7	Very low	180 Å²	180	114 Å²	114	84%	0.841	63%	0.631	S	S	*	*	S	Bend	trans	-119.9	23.7	-175	-147.5	-179.9	-153.7	0	0	115.1
1780	V	26.4	Very low	29.6	Very low	101 Å²	101	110.8 Å²	110.8	61%	0.612	62%	0.622	S	S	*	*			trans	-121.1	26.4	172.8	-150.9	0	0	0	0	113.8	G1782	V1780-G1782 PolarHBondContact O-N 2.65Å
1781	I	21.1	Very low	30.6	Very low	176 Å²	176	115.3 Å²	115.3	90%	0.903	64%	0.638	S	S	*	*	S	Bend	trans	-82.9	68.9	148.6	-53.8	-178	0	0	0	107
1782	G	22.4	Very low	31.2	Very low	71 Å²	71	111.7 Å²	111.7	73%	0.732	62%	0.618	S	S	*	*	S	Bend	trans	165.7	-5.6	-175	0	0	0	0	0	117.6	V1780	V1780-G1782 PolarHBondContact O-N 2.65Å
1783	G	30.6	Very low	31.4	Very low	39 Å²	39	113.3 Å²	113.3	40%	0.402	62%	0.62	S	S	.	*	S	Bend	trans	-106.4	136.8	-177.7	0	0	0	0	0	114.1	Y1785	G1783-Y1785 PolarHBondContact O-N 3.17Å
1784	N	37.4	Very low	31.7	Very low	107 Å²	107	111.3 Å²	111.3	57%	0.572	62%	0.622	S	S	*	*			trans	-56.3	125.1	179.9	-58.3	-50.8	0	0	0	112.2	T1786	N1784-T1786 PolarHBondContact O-OG1 2.67Å
1785	Y	37.9	Very low	32	Very low	168 Å²	168	103.7 Å²	103.7	66%	0.659	59%	0.594	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-67.3	137.3	-178.8	-131.6	-102.9	0	0	0	111	G1783 I1787 I1819 T1820	G1783-Y1785 PolarHBondContact O-N 3.17Å; Y1785-I1787 HydrophobicContact CD1-CG1 4.48Å; Y1785-I1819 WeakPolarHBondContact O-CA 3.43Å; Y1785-T1820 PolarHBondContact O-N 3.03Å
1786	T	39.3	Very low	32.1	Very low	74 Å²	74	105.6 Å²	105.6	45%	0.454	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.2	119.5	-174.4	-64.6	0	0	0	0	110.4	N1784 T1820 K1822	N1784-T1786 PolarHBondContact O-OG1 2.67Å; T1786-T1820 WeakPolarHBondContact CA-O 3.4Å; T1786-K1822 HydrophobicContact CG2-CB 4.39Å; T1786-K1822 HydrophobicContact CG2-CD 3.55Å; T1786-K1822 HydrophobicContact CG2-CG 3.66Å
1787	I	41.5	Very low	32.6	Very low	49 Å²	49	107 Å²	107	25%	0.251	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.6	115.8	179.8	-57.7	177.7	0	0	0	109.5	Y1785 I1819 T1820 L1821 K1822	Y1785-I1787 HydrophobicContact CD1-CG1 4.48Å; I1787-I1819 HydrophobicContact CD1-CG2 4.37Å; I1787-I1819 HydrophobicContact CG1-CG2 4.48Å; I1787-T1820 PolarHBondContact N-O 3.18Å; I1787-L1821 HydrophobicContact CB-CD2 4.1Å; I1787-K1822 PolarHBondContact O-N 3.01Å
1788	D	49.2	Very low	32.9	Very low	63 Å²	63	101.1 Å²	101.1	34%	0.337	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.6	114.9	172.5	175.7	22	0	0	0	110.8	S1790	D1788-S1790 PolarHBondContact O-N 2.89Å; D1788-S1790 VanDerWaalsContact OD1-CB 3.25Å; D1788-S1790 WeakPolarHBondContact OD1-CB 3.28Å; D1788-S1790 PolarHBondContact OD1-N 3.3Å; D1788-S1790 PolarHBondContact OD1-OG 3.05Å; D1788-S1790 WeakPolarHBondContact OD2-CB 3.39Å; D1788-S1790 PolarHBondContact OD2-OG 3.04Å
1789	T	42.3	Very low	33.4	Very low	39 Å²	39	102.1 Å²	102.1	24%	0.239	59%	0.586	C	S	.	*	G	3₁₀ helix	trans	-79.9	1.2	180	52.5	0	0	0	0	113.9	K1791 I1792 K1822 S1823	T1789-K1791 PolarHBondContact O-N 2.65Å; T1789-I1792 HydrophobicContact CG2-CD1 4.02Å; T1789-I1792 PolarHBondContact O-N 3.03Å; T1789-K1822 PolarHBondContact N-O 3.39Å; T1789-K1822 PolarHBondContact OG1-O 3.36Å; T1789-S1823 WeakPolarHBondContact OG1-CB 3.44Å
1790	S	38.8	Very low	33.8	Very low	75 Å²	75	99 Å²	99	52%	0.524	59%	0.591	S	S	.	*	G	3₁₀ helix	trans	-60.2	-26.7	172.3	80.2	0	0	0	0	113.7	D1788 I1792	D1788-S1790 PolarHBondContact O-N 2.89Å; D1788-S1790 VanDerWaalsContact OD1-CB 3.25Å; D1788-S1790 WeakPolarHBondContact OD1-CB 3.28Å; D1788-S1790 PolarHBondContact OD1-N 3.3Å; D1788-S1790 PolarHBondContact OD1-OG 3.05Å; D1788-S1790 WeakPolarHBondContact OD2-CB 3.39Å; D1788-S1790 PolarHBondContact OD2-OG 3.04Å; S1790-I1792 VanDerWaalsContact C-N 3.3Å; S1790-I1792 PolarHBondContact O-N 2.94Å
1791	K	42.7	Very low	34	Very low	175 Å²	175	100.5 Å²	100.5	76%	0.761	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-82.8	2.1	-175.6	-62.7	-169.1	177.9	-176.4	0	114.8	T1789 I1793	T1789-K1791 PolarHBondContact O-N 2.65Å; K1791-I1793 PolarHBondContact O-N 2.89Å
1792	I	38.2	Very low	34.4	Very low	86 Å²	86	94.9 Å²	94.9	44%	0.441	59%	0.586	S	S	.	*			trans	-82.2	95.9	179.9	-55.9	177.3	0	0	0	109.5	T1789 S1790 A1795	T1789-I1792 HydrophobicContact CG2-CD1 4.02Å; T1789-I1792 PolarHBondContact O-N 3.03Å; S1790-I1792 VanDerWaalsContact C-N 3.3Å; S1790-I1792 PolarHBondContact O-N 2.94Å; I1792-A1795 HydrophobicContact CB-CB 4.31Å; I1792-A1795 HydrophobicContact CG2-CB 4.07Å; I1792-A1795 WeakPolarHBondContact O-CB 3.47Å; I1792-A1795 PolarHBondContact O-N 2.75Å
1793	I	28.2	Very low	34.8	Very low	169 Å²	169	95.4 Å²	95.4	87%	0.867	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	142.1	168.3	-60.8	176.8	0	0	0	108.6	K1791 A1795	K1791-I1793 PolarHBondContact O-N 2.89Å; I1793-A1795 PolarHBondContact O-N 3.19Å
1794	G	29.8	Very low	34.8	Very low	72 Å²	72	99 Å²	99	74%	0.742	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.7	1.5	-179.6	0	0	0	0	0	115	P1796	G1794-P1796 WeakPolarHBondContact O-CD 3.33Å; G1794-P1796 VanDerWaalsContact O-N 3.08Å
1795	A	30.4	Very low	34.5	Very low	42 Å²	42	98.8 Å²	98.8	35%	0.347	60%	0.599	S	S	.	*			trans	-51.7	114.4	172.9	0	0	0	0	0	111.1	I1792 I1793	I1792-A1795 HydrophobicContact CB-CB 4.31Å; I1792-A1795 HydrophobicContact CG2-CB 4.07Å; I1792-A1795 WeakPolarHBondContact O-CB 3.47Å; I1792-A1795 PolarHBondContact O-N 2.75Å; I1793-A1795 PolarHBondContact O-N 3.19Å
1796	P	26.4	Very low	34	Very low	102 Å²	102	94.3 Å²	94.3	66%	0.662	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-57.1	145.3	-179.4	-26.2	35.9	0	0	0	111.4	G1794 P1798	G1794-P1796 WeakPolarHBondContact O-CD 3.33Å; G1794-P1796 VanDerWaalsContact O-N 3.08Å; P1796-P1798 VanDerWaalsContact O-CD 3.31Å; P1796-P1798 WeakPolarHBondContact O-CD 3.45Å
1797	I	34.5	Very low	33.7	Very low	154 Å²	154	93.1 Å²	93.1	79%	0.79	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-68.9	120.5	174.3	-61.9	171.9	0	0	0	106.9	D1799	I1797-D1799 PolarHBondContact O-N 3.28Å
1798	P	28.2	Very low	33.2	Very low	79 Å²	79	95.3 Å²	95.3	51%	0.513	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-65.1	128.6	-178.9	-20.9	33.2	0	0	0	111	P1796	P1796-P1798 VanDerWaalsContact O-CD 3.31Å; P1796-P1798 WeakPolarHBondContact O-CD 3.45Å
1799	D	33.1	Very low	32.2	Very low	124 Å²	124	95.6 Å²	95.6	66%	0.663	59%	0.592	S	S	*	*			trans	-91.1	179.6	158.4	73.1	15.8	0	0	0	110.8	I1797 T1801 G1802	I1797-D1799 PolarHBondContact O-N 3.28Å; D1799-T1801 PolarHBondContact O-N 2.92Å; D1799-G1802 PolarHBondContact O-N 3.09Å
1800	A	32	Very low	31.6	Very low	113 Å²	113	97.9 Å²	97.9	93%	0.934	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	5.4	-156.3	0	0	0	0	0	116.2
1801	T	30.3	Very low	31.2	Very low	134 Å²	134	98.3 Å²	98.3	82%	0.822	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	-5.1	-179.6	19.7	0	0	0	0	115.1	D1799	D1799-T1801 PolarHBondContact O-N 2.92Å
1802	G	29.8	Very low	30.8	Very low	58 Å²	58	92.6 Å²	92.6	60%	0.598	59%	0.588	S	S	*	*			trans	88.6	141	164.8	0	0	0	0	0	116.2	D1799	D1799-G1802 PolarHBondContact O-N 3.09Å
1803	C	30.9	Very low	30.6	Very low	81 Å²	81	92.5 Å²	92.5	55%	0.547	59%	0.588	S	S	.	*			trans	-87.4	119.3	178.9	-57.9	0	0	0	0	111.7	V1805	C1803-V1805 PolarHBondContact O-N 3.31Å
1804	S	30	Very low	30.8	Very low	116 Å²	116	86.2 Å²	86.2	81%	0.811	56%	0.555	S	S	*	*			trans	-77.1	110.1	167.6	53.5	0	0	0	0	110.8
1805	V	30.3	Very low	30.7	Very low	102 Å²	102	86.2 Å²	86.2	62%	0.618	56%	0.555	S	S	*	*			trans	-93.2	107.4	169.1	-179.5	0	0	0	0	108.3	C1803 I1807	C1803-V1805 PolarHBondContact O-N 3.31Å; V1805-I1807 HydrophobicContact CG1-CG1 4.3Å
1806	A	28.2	Very low	30.8	Very low	74 Å²	74	85.8 Å²	85.8	61%	0.612	56%	0.555	S	S	*	*			trans	-74.3	136.2	169.5	0	0	0	0	0	110
1807	I	32.8	Very low	31.1	Very low	48 Å²	48	87.7 Å²	87.7	25%	0.246	56%	0.557	C	S	.	*			trans	-128.5	113.2	171	-64.2	176.3	0	0	0	104.2	K1321 D1322 V1805 M1809 L1821	K1321-I1807 HydrophobicContact CD-CG1 4.36Å; K1321-I1807 HydrophobicContact CG-CG2 4.28Å; D1322-I1807 WeakPolarHBondContact OD2-CG2 3.33Å; V1805-I1807 HydrophobicContact CG1-CG1 4.3Å; I1807-M1809 HydrophobicContact CG2-CE 4.43Å; I1807-L1821 HydrophobicContact CD1-CD1 3.96Å; I1807-L1821 HydrophobicContact CD1-CD2 4.24Å
1808	R	30	Very low	31	Very low	96 Å²	96	82.2 Å²	82.2	36%	0.362	53%	0.532	S	S	.	.			trans	-106.3	93.5	-165.1	-156.9	-166.9	-166.4	-61.5	5.9	110.8	K1321 D1322 T1848 L1850	K1321-R1808 PolarHBondContact O-N 3.17Å; D1322-R1808 PolarHBondContact N-O 3.1Å; R1808-T1848 PolarHBondContact NH2-O 3.35Å; R1808-L1850 HydrophobicContact CG-CB 4.06Å; R1808-L1850 HydrophobicContact CG-CD2 4.14Å; R1808-L1850 PolarHBondContact NE-O 2.89Å; R1808-L1850 PolarHBondContact NH2-O 3.15Å
1809	M	28.8	Very low	31.7	Very low	69 Å²	69	80.5 Å²	80.5	34%	0.34	52%	0.517	S	S	.	.			trans	-72.7	-179.8	-177.2	-71.3	-161.9	158.7	0	0	113.8	F1323 I1807	F1323-M1809 VanDerWaalsContact CD2-C 3.49Å; F1323-M1809 HydrophobicContact CD2-CB 4.41Å; F1323-M1809 VanDerWaalsContact CE2-C 3.45Å; F1323-M1809 HydrophobicContact CE2-CB 3.38Å; F1323-M1809 HydrophobicContact CE2-CG 3.74Å; F1323-M1809 HydrophobicContact CE2-SD 4.45Å; I1807-M1809 HydrophobicContact CG2-CE 4.43Å
1810	D	29.5	Very low	32.1	Very low	87 Å²	87	75.4 Å²	75.4	47%	0.465	49%	0.491	S	S	.	.				123.6	0	-105.1	-143.3	49.7	0	0	0	122.8	F1323	F1323-D1810 HydrophobicContact CB-CB 3.75Å; F1323-D1810 WeakPolarHBondContact CB-O 3.45Å; F1323-D1810 VanDerWaalsContact CB-OD2 3.26Å; F1323-D1810 WeakPolarHBondContact CB-OD2 3.23Å; F1323-D1810 HydrophobicContact CD1-CB 4.17Å; F1323-D1810 WeakPolarHBondContact CD1-O 3.37Å; F1323-D1810 HydrophobicContact CD2-CB 3.04Å; F1323-D1810 WeakPolarHBondContact CD2-O 3.4Å; F1323-D1810 WeakPolarHBondContact CE1-O 3.1Å; F1323-D1810 HydrophobicContact CE2-CB 4.08Å; F1323-D1810 WeakPolarHBondContact CE2-O 3.47Å; F1323-D1810 HydrophobicContact CG-CB 3.08Å; F1323-D1810 WeakPolarHBondContact CG-O 3.47Å; F1323-D1810 VanDerWaalsContact CG-OD2 3.24Å; F1323-D1810 WeakPolarHBondContact CG-OD2 3.38Å; F1323-D1810 WeakPolarHBondContact CZ-O 3.4Å
1811	T	32	Very low	32.5	Very low	84 Å²	84	72.9 Å²	72.9	52%	0.515	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn		0	-48.8	0	53	0	0	0	0	119.2	F1323	F1323-T1811 HydrophobicContact CE1-CG2 4.26Å; F1323-T1811 WeakPolarHBondContact CE1-O 3.34Å; F1323-T1811 HydrophobicContact CE2-CG2 3.85Å; F1323-T1811 VanDerWaalsContact CG-N 3.26Å; F1323-T1811 HydrophobicContact CZ-CG2 3.13Å
1812	A	33.2	Very low	33.2	Very low	55 Å²	55	70.3 Å²	70.3	46%	0.455	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-3.2	-159.4	0	0	0	0	0	117.4	S1326 N1327	S1326-A1812 CarbonylContact O-C 3.6Å; N1327-A1812 HydrophobicContact CB-CB 3.62Å; N1327-A1812 PolarHBondContact ND2-O 3.18Å
1813	I	33.5	Very low	33.7	Very low	84 Å²	84	68 Å²	68	43%	0.431	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-57.6	150.8	-85	-154.6	0	0	0	111.7	F1323 G1324 V1325 S1326 G1815	F1323-I1813 HydrophobicContact CE1-CB 4.45Å; G1324-I1813 WeakPolarHBondContact O-CB 3.39Å; V1325-I1813 HydrophobicContact CB-CD1 3.8Å; V1325-I1813 HydrophobicContact CG1-CD1 3.93Å; S1326-I1813 WeakPolarHBondContact O-CG1 3.27Å; S1326-I1813 PolarHBondContact O-N 3.32Å; S1326-I1813 VanDerWaalsContact O-N 3.14Å; S1326-I1813 WeakPolarHBondContact OG-CD1 3.48Å; S1326-I1813 VanDerWaalsContact OG-CG1 3.27Å; S1326-I1813 WeakPolarHBondContact OG-CG1 3.39Å; I1813-G1815 PolarHBondContact O-N 3.43Å
1814	I	34.1	Very low	34.5	Very low	36 Å²	36	69.5 Å²	69.5	19%	0.185	41%	0.412	C	S	.	.			trans	-81.4	43.7	-171.1	-32.2	176.1	0	0	0	111.9	F1323 G1816 M1817 I1819	F1323-I1814 HydrophobicContact CE1-CB 4.15Å; F1323-I1814 HydrophobicContact CE1-CG1 3.98Å; F1323-I1814 VanDerWaalsContact CE1-N 3.26Å; F1323-I1814 HydrophobicContact CE2-CD1 4.29Å; F1323-I1814 HydrophobicContact CZ-CB 3.52Å; F1323-I1814 HydrophobicContact CZ-CD1 4.07Å; F1323-I1814 HydrophobicContact CZ-CG1 3.73Å; I1814-G1816 PolarHBondContact O-N 3.3Å; I1814-M1817 HydrophobicContact CG2-CB 4.12Å; I1814-M1817 WeakPolarHBondContact CG2-O 3.21Å; I1814-I1819 HydrophobicContact CD1-CD1 4.3Å
1815	G	27.6	Very low	35	Very low	72 Å²	72	71.3 Å²	71.3	74%	0.742	40%	0.401	S	S	*	.	S	Bend	trans	-69.3	72.1	158.8	0	0	0	0	0	110.7	I1813	I1813-G1815 PolarHBondContact O-N 3.43Å
1816	G	32.1	Very low	35.4	Very low	34 Å²	34	72 Å²	72	35%	0.351	40%	0.396	S	S	.	.	S	Bend	trans	108.1	13.5	164.1	0	0	0	0	0	118.6	I1814	I1814-G1816 PolarHBondContact O-N 3.3Å
1817	M	31.8	Very low	35.9	Very low	142 Å²	142	72.3 Å²	72.3	70%	0.7	38%	0.384	S	S	*	.			trans	-92.1	131	167.9	-71.2	-165.8	-179.9	0	0	111.8	I1814	I1814-M1817 HydrophobicContact CG2-CB 4.12Å; I1814-M1817 WeakPolarHBondContact CG2-O 3.21Å
1818	P	32.3	Very low	36	Very low	39 Å²	39	74.1 Å²	74.1	25%	0.253	41%	0.406	S	S	.	.			trans	-82.3	145.8	179.3	33.3	-34.9	0	0	0	112.7
1819	I	43.2	Very low	36.2	Very low	42 Å²	42	76 Å²	76	22%	0.215	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131.9	177.1	-59.4	-175.3	0	0	0	109.5	Y1785 I1787 I1814	Y1785-I1819 WeakPolarHBondContact O-CA 3.43Å; I1787-I1819 HydrophobicContact CD1-CG2 4.37Å; I1787-I1819 HydrophobicContact CG1-CG2 4.48Å; I1814-I1819 HydrophobicContact CD1-CD1 4.3Å
1820	T	41.3	Very low	36.6	Very low	17 Å²	17	78.9 Å²	78.9	10%	0.104	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131.1	177.7	-58.1	0	0	0	0	110.7	Y1785 T1786 I1787 K1822 F1835	Y1785-T1820 PolarHBondContact O-N 3.03Å; T1786-T1820 WeakPolarHBondContact CA-O 3.4Å; I1787-T1820 PolarHBondContact N-O 3.18Å; T1820-K1822 HydrophobicContact CG2-CG 4.43Å; T1820-F1835 HydrophobicContact CG2-CD2 4.5Å
1821	L	39.9	Very low	37.1	Very low	61 Å²	61	77.7 Å²	77.7	32%	0.319	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.4	172.4	-62.7	-179.6	0	0	0	110.1	I1787 I1807	I1787-L1821 HydrophobicContact CB-CD2 4.1Å; I1807-L1821 HydrophobicContact CD1-CD1 3.96Å; I1807-L1821 HydrophobicContact CD1-CD2 4.24Å
1822	K	44.9	Very low	37.2	Very low	80 Å²	80	77 Å²	77	35%	0.348	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	152.4	175	-67.6	-162.9	173.3	-129.6	0	111.4	T1786 I1787 T1789 T1820 D1833	T1786-K1822 HydrophobicContact CG2-CB 4.39Å; T1786-K1822 HydrophobicContact CG2-CD 3.55Å; T1786-K1822 HydrophobicContact CG2-CG 3.66Å; I1787-K1822 PolarHBondContact O-N 3.01Å; T1789-K1822 PolarHBondContact N-O 3.39Å; T1789-K1822 PolarHBondContact OG1-O 3.36Å; T1820-K1822 HydrophobicContact CG2-CG 4.43Å; K1822-D1833 WeakPolarHBondContact CA-OD1 3.19Å; K1822-D1833 WeakPolarHBondContact CB-OD1 3.13Å; K1822-D1833 VanDerWaalsContact CD-OD2 3.31Å; K1822-D1833 WeakPolarHBondContact CD-OD2 3.47Å; K1822-D1833 VanDerWaalsContact CE-OD2 3.3Å; K1822-D1833 WeakPolarHBondContact CE-OD2 3.42Å; K1822-D1833 HydrophobicContact CG-CB 4Å; K1822-D1833 VanDerWaalsContact CG-CG 3.45Å; K1822-D1833 WeakPolarHBondContact CG-OD1 3.38Å; K1822-D1833 IonicContact NZ-OD2 2.82Å; K1822-D1833 PolarHBondContact NZ-OD2 3.28Å
1823	S	41.7	Very low	37.3	Very low	8 Å²	8	76.4 Å²	76.4	6%	0.056	44%	0.435	C	S	.	.			trans	-163.6	135.6	160.1	109.8	0	0	0	0	110.8	T1789 R1825 F1826 K1827 D1833	T1789-S1823 WeakPolarHBondContact OG1-CB 3.44Å; S1823-R1825 PolarHBondContact O-N 2.92Å; S1823-R1825 VanDerWaalsContact O-N 3.11Å; S1823-R1825 WeakPolarHBondContact OG-CB 3.26Å; S1823-R1825 PolarHBondContact OG-N 2.75Å; S1823-R1825 VanDerWaalsContact OG-N 3.11Å; S1823-F1826 PolarHBondContact O-N 2.81Å; S1823-F1826 VanDerWaalsContact O-N 3.1Å; S1823-F1826 WeakPolarHBondContact OG-CD2 3.43Å; S1823-F1826 PolarHBondContact OG-N 2.76Å; S1823-K1827 WeakPolarHBondContact O-CB 3.34Å; S1823-K1827 PolarHBondContact O-N 3.19Å; S1823-D1833 PolarHBondContact N-OD1 2.91Å
1824	E	48.1	Very low	37.4	Very low	113 Å²	113	80.2 Å²	80.2	53%	0.528	45%	0.446	S	S	.	.	H	α-helix	trans	-62.7	-14.6	171.1	-67.7	-62.9	157.7	0	0	112.3	K1827 A1828	E1824-K1827 VanDerWaalsContact CD-NZ 3.31Å; E1824-K1827 IonicContact OE1-NZ 3.58Å; E1824-K1827 PolarHBondContact OE1-NZ 3.05Å; E1824-K1827 WeakPolarHBondContact OE2-CD 3.25Å; E1824-K1827 IonicContact OE2-NZ 3.71Å; E1824-K1827 PolarHBondContact OE2-NZ 2.88Å; E1824-A1828 WeakPolarHBondContact O-CB 3.43Å; E1824-A1828 PolarHBondContact O-N 3.27Å
1825	R	39.5	Very low	37.3	Very low	155 Å²	155	85.8 Å²	85.8	59%	0.585	47%	0.469	S	S	*	.	H	α-helix	trans	-76.9	-42.4	169.9	-74.7	-174.2	174.1	179.7	0	112.7	S1823 K1827 A1828 L1829	S1823-R1825 PolarHBondContact O-N 2.92Å; S1823-R1825 VanDerWaalsContact O-N 3.11Å; S1823-R1825 WeakPolarHBondContact OG-CB 3.26Å; S1823-R1825 PolarHBondContact OG-N 2.75Å; S1823-R1825 VanDerWaalsContact OG-N 3.11Å; R1825-K1827 VanDerWaalsContact C-N 3.34Å; R1825-A1828 PolarHBondContact O-N 3.33Å; R1825-L1829 WeakPolarHBondContact O-CB 3.38Å; R1825-L1829 PolarHBondContact O-N 3.04Å
1826	F	38.9	Very low	37.7	Very low	115 Å²	115	85.9 Å²	85.9	50%	0.504	45%	0.454	S	S	.	.	H	α-helix	trans	-66.5	-39.9	173	-80.3	-61.6	0	0	0	111	S1823 L1829 N1830	S1823-F1826 PolarHBondContact O-N 2.81Å; S1823-F1826 VanDerWaalsContact O-N 3.1Å; S1823-F1826 WeakPolarHBondContact OG-CD2 3.43Å; S1823-F1826 PolarHBondContact OG-N 2.76Å; F1826-L1829 PolarHBondContact O-N 3.48Å; F1826-N1830 PolarHBondContact O-N 3.15Å
1827	K	38.1	Very low	37.5	Very low	81 Å²	81	86.6 Å²	86.6	35%	0.352	46%	0.462	S	S	.	.	H	α-helix	trans	-69.5	-31	176.1	-168.4	172.1	154.5	-151.7	0	112.9	S1823 E1824 R1825 G1831	S1823-K1827 WeakPolarHBondContact O-CB 3.34Å; S1823-K1827 PolarHBondContact O-N 3.19Å; E1824-K1827 VanDerWaalsContact CD-NZ 3.31Å; E1824-K1827 IonicContact OE1-NZ 3.58Å; E1824-K1827 PolarHBondContact OE1-NZ 3.05Å; E1824-K1827 WeakPolarHBondContact OE2-CD 3.25Å; E1824-K1827 IonicContact OE2-NZ 3.71Å; E1824-K1827 PolarHBondContact OE2-NZ 2.88Å; R1825-K1827 VanDerWaalsContact C-N 3.34Å; K1827-G1831 WeakPolarHBondContact O-CA 3.38Å; K1827-G1831 PolarHBondContact O-N 2.83Å
1828	A	36.5	Very low	37.3	Very low	86 Å²	86	82.4 Å²	82.4	71%	0.711	45%	0.447	S	S	*	.	H	α-helix	trans	-73	-33.2	168.8	0	0	0	0	0	113.4	E1824 R1825	E1824-A1828 WeakPolarHBondContact O-CB 3.43Å; E1824-A1828 PolarHBondContact O-N 3.27Å; R1825-A1828 PolarHBondContact O-N 3.33Å
1829	L	33.2	Very low	37.2	Very low	137 Å²	137	87.4 Å²	87.4	72%	0.717	47%	0.465	S	S	*	.	H	α-helix	trans	-77.9	-40.7	178.5	-84.4	161.7	0	0	0	113.5	R1825 F1826	R1825-L1829 WeakPolarHBondContact O-CB 3.38Å; R1825-L1829 PolarHBondContact O-N 3.04Å; F1826-L1829 PolarHBondContact O-N 3.48Å
1830	N	36.8	Very low	36.3	Very low	128 Å²	128	93.6 Å²	93.6	68%	0.684	49%	0.487	S	S	*	.	H	α-helix	trans	-129.2	6.8	-170.7	-81.4	-26.2	0	0	0	114.6	F1826 S1832	F1826-N1830 PolarHBondContact O-N 3.15Å; N1830-S1832 PolarHBondContact O-N 2.89Å; N1830-S1832 VanDerWaalsContact O-N 3.17Å
1831	G	39.8	Very low	35.5	Very low	62 Å²	62	100.8 Å²	100.8	64%	0.639	52%	0.519	S	S	*	.	S	Bend	trans	77.7	-10.4	174.8	0	0	0	0	0	116.3	K1827	K1827-G1831 WeakPolarHBondContact O-CA 3.38Å; K1827-G1831 PolarHBondContact O-N 2.83Å
1832	S	34.8	Very low	34.7	Very low	71 Å²	71	103.3 Å²	103.3	50%	0.497	54%	0.537	S	S	.	.	S	Bend	trans	-148.7	149.5	-176	56.9	0	0	0	0	113.1	N1830	N1830-S1832 PolarHBondContact O-N 2.89Å; N1830-S1832 VanDerWaalsContact O-N 3.17Å
1833	D	35.5	Very low	33.6	Very low	41 Å²	41	102.2 Å²	102.2	22%	0.219	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-64.5	146.8	167.2	-62.2	-56.4	0	0	0	110.7	K1822 S1823	K1822-D1833 WeakPolarHBondContact CA-OD1 3.19Å; K1822-D1833 WeakPolarHBondContact CB-OD1 3.13Å; K1822-D1833 VanDerWaalsContact CD-OD2 3.31Å; K1822-D1833 WeakPolarHBondContact CD-OD2 3.47Å; K1822-D1833 VanDerWaalsContact CE-OD2 3.3Å; K1822-D1833 WeakPolarHBondContact CE-OD2 3.42Å; K1822-D1833 HydrophobicContact CG-CB 4Å; K1822-D1833 VanDerWaalsContact CG-CG 3.45Å; K1822-D1833 WeakPolarHBondContact CG-OD1 3.38Å; K1822-D1833 IonicContact NZ-OD2 2.82Å; K1822-D1833 PolarHBondContact NZ-OD2 3.28Å; S1823-D1833 PolarHBondContact N-OD1 2.91Å
1834	Y	35.7	Very low	32.7	Very low	165 Å²	165	110.6 Å²	110.6	65%	0.647	59%	0.587	S	S	*	*	B	Isolated β-bridge	trans	-97.8	125.9	-173	-156.1	-92.8	0	0	0	112	V1836	Y1834-V1836 HydrophobicContact CD1-CG2 3.95Å; Y1834-V1836 HydrophobicContact CE1-CG2 4.37Å
1835	F	31.9	Very low	31.6	Very low	153 Å²	153	110.8 Å²	110.8	67%	0.671	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-93.7	123.7	-176.2	-150.8	-93.3	0	0	0	110.3	T1820	T1820-F1835 HydrophobicContact CG2-CD2 4.5Å
1836	V	35.1	Very low	30.9	Very low	73 Å²	73	112.4 Å²	112.4	44%	0.442	61%	0.607	S	S	.	*			trans	-119	138.2	176.9	-174.4	0	0	0	0	108.6	Y1834 F1839	Y1834-V1836 HydrophobicContact CD1-CG2 3.95Å; Y1834-V1836 HydrophobicContact CE1-CG2 4.37Å; V1836-F1839 HydrophobicContact CG1-CE2 4.48Å
1837	G	28	Very low	30.2	Very low	50 Å²	50	113.5 Å²	113.5	52%	0.515	62%	0.618	S	S	.	*			trans	-77.8	174.2	-166.5	0	0	0	0	0	116	F1839	G1837-F1839 WeakPolarHBondContact O-CD2 3.43Å; G1837-F1839 VanDerWaalsContact O-CE2 3.26Å; G1837-F1839 WeakPolarHBondContact O-CE2 3.17Å
1838	S	28.2	Very low	29.4	Very low	54 Å²	54	114.1 Å²	114.1	38%	0.378	63%	0.629	S	S	.	*			trans	-67.1	146.1	-179.5	-44	0	0	0	0	113.8	Y1840	S1838-Y1840 VanDerWaalsContact CB-OH 3.23Å; S1838-Y1840 WeakPolarHBondContact CB-OH 3.34Å
1839	F	30.6	Very low	28.6	Very low	143 Å²	143	113 Å²	113	63%	0.627	62%	0.616	S	S	*	*			trans	-113.2	152.4	178	-67.9	-91.5	0	0	0	112.5	V1836 G1837	V1836-F1839 HydrophobicContact CG1-CE2 4.48Å; G1837-F1839 WeakPolarHBondContact O-CD2 3.43Å; G1837-F1839 VanDerWaalsContact O-CE2 3.26Å; G1837-F1839 WeakPolarHBondContact O-CE2 3.17Å
1840	Y	22.8	Very low	28.2	Very low	173 Å²	173	110.1 Å²	110.1	68%	0.678	60%	0.601	S	S	*	*			trans	-151.8	178.6	-170.4	-51.4	-80.9	0	0	0	109.1	S1838	S1838-Y1840 VanDerWaalsContact CB-OH 3.23Å; S1838-Y1840 WeakPolarHBondContact CB-OH 3.34Å
1841	H	25.2	Very low	27.7	Very low	167 Å²	167	108.3 Å²	108.3	77%	0.773	60%	0.595	S	S	*	*			cis	-151.9	-42.5	14.4	39	78.8	0	0	0	115.6
1842	T	23.1	Very low	27.3	Very low	114 Å²	114	111.1 Å²	111.1	70%	0.699	59%	0.594	S	S	*	*			trans	-148.3	163.7	-171.8	59.6	0	0	0	0	107.2
1843	G	21.7	Very low	27.2	Very low	58 Å²	58	116 Å²	116	60%	0.598	61%	0.606	S	S	*	*			cis	110	119.1	24	0	0	0	0	0	108
1844	E	22.7	Very low	27.2	Very low	183 Å²	183	120 Å²	120	86%	0.855	63%	0.627	S	S	*	*			trans	59.7	173.2	-157.6	-57.9	-163.7	140.9	0	0	114.9
1845	T	25.6	Very low	27.4	Very low	118 Å²	118	118.8 Å²	118.8	72%	0.724	63%	0.632	S	S	*	*			trans	65.8	131.5	176.3	62.8	0	0	0	0	113.9
1846	K	23.9	Very low	27.2	Very low	188 Å²	188	116.9 Å²	116.9	82%	0.817	64%	0.638	S	S	*	*				57.6	120.8	53.6	-64.6	-171	175.9	-176.6	0	110.1
1847	D	24.1	Very low	26.8	Very low	138 Å²	138	118 Å²	118	74%	0.738	65%	0.645	S	S	*	*			trans	61.2	157.7	-155.2	-51	-55.6	0	0	0	111.3	S1849	D1847-S1849 PolarHBondContact OD1-OG 3.48Å
1848	T	22.9	Very low	26.7	Very low	95 Å²	95	122.6 Å²	122.6	58%	0.583	65%	0.651	S	S	*	*			cis	-109.6	138	-0.5	44.8	0	0	0	0	110.4	R1808	R1808-T1848 PolarHBondContact NH2-O 3.35Å
1849	S	18.9	Very low	26.5	Very low	62 Å²	62	127 Å²	127	43%	0.434	67%	0.668	S	S	.	*			cis	50.4	33.9	40.2	83.5	0	0	0	0	113.8	D1847 T1851	D1847-S1849 PolarHBondContact OD1-OG 3.48Å; S1849-T1851 WeakPolarHBondContact CA-OG1 3.29Å; S1849-T1851 WeakPolarHBondContact O-CB 3.35Å; S1849-T1851 PolarHBondContact O-OG1 3.29Å
1850	L	24.1	Very low	26.4	Very low	77 Å²	77	129 Å²	129	40%	0.403	68%	0.677	S	S	.	*				-82	97.3	122.6	-102.7	55.2	0	0	0	106.6	R1808	R1808-L1850 HydrophobicContact CG-CB 4.06Å; R1808-L1850 HydrophobicContact CG-CD2 4.14Å; R1808-L1850 PolarHBondContact NE-O 2.89Å; R1808-L1850 PolarHBondContact NH2-O 3.15Å
1851	T	26.1	Very low	26.3	Very low	90 Å²	90	123.8 Å²	123.8	55%	0.552	67%	0.67	S	S	*	*			cis	42.7	108.5	41.5	-34.3	0	0	0	0	107.2	S1849	S1849-T1851 WeakPolarHBondContact CA-OG1 3.29Å; S1849-T1851 WeakPolarHBondContact O-CB 3.35Å; S1849-T1851 PolarHBondContact O-OG1 3.29Å
1852	I	31.3	Very low	26.1	Very low	121 Å²	121	119 Å²	119	62%	0.621	66%	0.655	S	S	*	*				-160.3	108.6	77.3	-76.4	140.2	0	0	0	103.5
1853	K	33.8	Very low	26.1	Very low	172 Å²	172	118.3 Å²	118.3	75%	0.748	64%	0.642	S	S	*	*			trans	73.4	140.4	152.4	-59.5	-173.5	175.2	-164.4	0	117.8
1854	D	36.2	Very low	26.2	Very low	125 Å²	125	119.1 Å²	119.1	67%	0.668	64%	0.636	S	S	*	*			cis	-144.4	152.5	-13.4	-91	-35.4	0	0	0	109.3
1855	D	38.9	Very low	26	Very low	140 Å²	140	115.2 Å²	115.2	75%	0.749	62%	0.617	S	S	*	*			trans	41.3	101.2	155.4	-59.7	-19.6	0	0	0	121.5
1856	S	28.6	Very low	25.9	Very low	114 Å²	114	116.6 Å²	116.6	80%	0.797	62%	0.619	S	S	*	*			trans	74.4	156.5	150.1	83.1	0	0	0	0	117.4
1857	V	26.4	Very low	26	Very low	97 Å²	97	114 Å²	114	59%	0.588	61%	0.61	S	S	*	*			cis	-144.1	162	11.4	-162.1	0	0	0	0	109.5
1858	K	25.2	Very low	25.8	Very low	145 Å²	145	111.2 Å²	111.2	63%	0.63	61%	0.606	S	S	*	*			trans	64.4	106	169.6	-64.4	125.3	-171.6	176.4	0	114.2
1859	I	25.2	Very low	26.5	Very low	147 Å²	147	109.9 Å²	109.9	75%	0.754	60%	0.596	S	S	*	*			cis	60.4	71	21.9	-44.4	-179.8	0	0	0	112.2	A1861	I1859-A1861 HydrophobicContact CB-CB 4.23Å; I1859-A1861 HydrophobicContact CG2-CB 3.45Å; I1859-A1861 VanDerWaalsContact CG2-CB 3.45Å
1860	K	26.8	Very low	26.6	Very low	184 Å²	184	110.9 Å²	110.9	80%	0.8	60%	0.599	S	S	*	*			trans	-146.5	70.2	148.6	-75.7	-166.5	178.7	-174.3	0	106.6
1861	A	22.1	Very low	26.6	Very low	65 Å²	65	107.5 Å²	107.5	54%	0.537	58%	0.582	S	S	.	*			cis	59.6	135.3	35.6	0	0	0	0	0	113.2	I1859	I1859-A1861 HydrophobicContact CB-CB 4.23Å; I1859-A1861 HydrophobicContact CG2-CB 3.45Å; I1859-A1861 VanDerWaalsContact CG2-CB 3.45Å
1862	S	21	Very low	26.4	Very low	65 Å²	65	103.7 Å²	103.7	46%	0.455	56%	0.558	S	S	.	*			trans	62.9	120.8	-162.8	-45.7	0	0	0	0	110.2
1863	K	22.5	Very low	26.1	Very low	101 Å²	101	101.7 Å²	101.7	44%	0.439	55%	0.548	S	S	.	.				34.1	81.5	72.7	-161.4	-164.7	-175.9	-86.9	0	110.1	E1865 N1872	K1863-E1865 WeakPolarHBondContact CE-OE2 3.45Å; K1863-E1865 IonicContact NZ-OE2 3.15Å; K1863-E1865 PolarHBondContact NZ-OE2 3.15Å; K1863-N1872 WeakPolarHBondContact CG-OD1 3.21Å; K1863-N1872 VanDerWaalsContact NZ-CG 3.27Å; K1863-N1872 PolarHBondContact NZ-ND2 3.1Å; K1863-N1872 PolarHBondContact NZ-OD1 3.16Å; K1863-N1872 WeakPolarHBondContact O-CB 3.35Å; K1863-N1872 PolarHBondContact O-OD1 3.14Å
1864	V	23.5	Very low	25.7	Very low	75 Å²	75	94.7 Å²	94.7	46%	0.455	52%	0.522	S	S	.	.			trans	-118.7	99.6	146.1	-177.4	0	0	0	0	103.5	L1866 V1871	V1864-L1866 HydrophobicContact CG1-CD2 4.42Å; V1864-L1866 PolarHBondContact O-N 2.84Å; V1864-V1871 HydrophobicContact CG1-CG1 4.43Å
1865	E	19.3	Very low	25.4	Very low	101 Å²	101	88.8 Å²	88.8	47%	0.472	49%	0.491	S	S	.	.			trans	-60	119	156.3	-72.1	176.1	116.1	0	0	105	K1863 E1867 A1868 N1872	K1863-E1865 WeakPolarHBondContact CE-OE2 3.45Å; K1863-E1865 IonicContact NZ-OE2 3.15Å; K1863-E1865 PolarHBondContact NZ-OE2 3.15Å; E1865-E1867 VanDerWaalsContact C-N 3.32Å; E1865-E1867 PolarHBondContact O-N 3.48Å; E1865-A1868 CarbonylContact C-O 2.81Å; E1865-N1872 PolarHBondContact N-OD1 2.65Å
1866	L	23.4	Very low	24.8	Very low	147 Å²	147	83 Å²	83	77%	0.77	46%	0.464	S	S	*	.			trans	-75.3	91.3	-177.5	-86.4	175.5	0	0	0	109.3	V1864 A1868	V1864-L1866 HydrophobicContact CG1-CD2 4.42Å; V1864-L1866 PolarHBondContact O-N 2.84Å; L1866-A1868 CarbonylContact C-O 2.97Å; L1866-A1868 VanDerWaalsContact C-O 3.29Å; L1866-A1868 PolarHBondContact O-N 3.49Å
1867	E	25.7	Very low	24.7	Very low	133 Å²	133	78.5 Å²	78.5	62%	0.621	44%	0.436	S	S	*	.	S	Bend	trans	40.1	68.5	143.6	-39.6	-169.6	168.8	0	0	113.9	E1865 D1869 V1871	E1865-E1867 VanDerWaalsContact C-N 3.32Å; E1865-E1867 PolarHBondContact O-N 3.48Å; E1867-D1869 WeakPolarHBondContact CA-OD1 3.21Å; E1867-D1869 WeakPolarHBondContact CB-OD2 3.49Å; E1867-D1869 WeakPolarHBondContact CG-OD1 3.41Å; E1867-V1871 HydrophobicContact CG-CG1 4.18Å
1868	A	20.8	Very low	24.7	Very low	80 Å²	80	76 Å²	76	66%	0.661	43%	0.425	S	S	*	.	S	Bend	cis	-46.9	107.1	14.5	0	0	0	0	0	115.5	E1865 L1866	E1865-A1868 CarbonylContact C-O 2.81Å; L1866-A1868 CarbonylContact C-O 2.97Å; L1866-A1868 VanDerWaalsContact C-O 3.29Å; L1866-A1868 PolarHBondContact O-N 3.49Å
1869	D	37	Very low	24.7	Very low	67 Å²	67	70.7 Å²	70.7	36%	0.358	41%	0.412	S	S	.	.	S	Bend	cis	64.9	92.6	27.2	-66.4	3.6	0	0	0	112.3	E1224 E1867 V1871	E1224-D1869 WeakPolarHBondContact OE2-CA 3.49Å; E1224-D1869 WeakPolarHBondContact OE2-CB 3.48Å; E1867-D1869 WeakPolarHBondContact CA-OD1 3.21Å; E1867-D1869 WeakPolarHBondContact CB-OD2 3.49Å; E1867-D1869 WeakPolarHBondContact CG-OD1 3.41Å; D1869-V1871 HydrophobicContact CB-CG2 4.37Å; D1869-V1871 WeakPolarHBondContact OD1-CA 3.47Å; D1869-V1871 WeakPolarHBondContact OD1-CB 3.34Å; D1869-V1871 VanDerWaalsContact OD1-CG1 3.24Å; D1869-V1871 WeakPolarHBondContact OD1-CG1 3.49Å; D1869-V1871 WeakPolarHBondContact OD1-CG2 3.46Å; D1869-V1871 PolarHBondContact OD1-N 2.91Å; D1869-V1871 VanDerWaalsContact OD1-N 3.12Å; D1869-V1871 WeakPolarHBondContact OD2-CG2 3.23Å
1870	T	21.6	Very low	25.3	Very low	83 Å²	83	65.7 Å²	65.7	51%	0.509	39%	0.388	S	S	.	.			cis	-60.2	99	32.1	43.5	0	0	0	0	122.5	E1224 N1872	E1224-T1870 WeakPolarHBondContact OE1-CG2 3.35Å; E1224-T1870 WeakPolarHBondContact OE2-CA 3.47Å; T1870-N1872 PolarHBondContact O-ND2 2.77Å; T1870-N1872 VanDerWaalsContact O-ND2 3.07Å; T1870-N1872 PolarHBondContact O-OD1 3.13Å
1871	V	22.6	Very low	25	Very low	6 Å²	6	58.4 Å²	58.4	4%	0.036	36%	0.363	C	S	.	.			trans	-62	170	177.7	-135.4	0	0	0	0	112.5	E1224 P1225 V1864 E1867 D1869 I1873	E1224-V1871 VanDerWaalsContact C-C 3.47Å; E1224-V1871 CarbonylContact C-O 3.55Å; E1224-V1871 HydrophobicContact CB-CB 3.81Å; E1224-V1871 HydrophobicContact CB-CG2 3.69Å; E1224-V1871 VanDerWaalsContact CB-N 3.28Å; E1224-V1871 VanDerWaalsContact CB-O 3.27Å; E1224-V1871 WeakPolarHBondContact CB-O 3.37Å; E1224-V1871 HydrophobicContact CG-CB 4.46Å; E1224-V1871 HydrophobicContact CG-CG2 3.8Å; E1224-V1871 CarbonylContact O-C 3.09Å; E1224-V1871 WeakPolarHBondContact OE2-CG2 3.42Å; E1224-V1871 PolarHBondContact OE2-N 2.97Å; P1225-V1871 VanDerWaalsContact N-O 3.13Å; V1864-V1871 HydrophobicContact CG1-CG1 4.43Å; E1867-V1871 HydrophobicContact CG-CG1 4.18Å; D1869-V1871 HydrophobicContact CB-CG2 4.37Å; D1869-V1871 WeakPolarHBondContact OD1-CA 3.47Å; D1869-V1871 WeakPolarHBondContact OD1-CB 3.34Å; D1869-V1871 VanDerWaalsContact OD1-CG1 3.24Å; D1869-V1871 WeakPolarHBondContact OD1-CG1 3.49Å; D1869-V1871 WeakPolarHBondContact OD1-CG2 3.46Å; D1869-V1871 PolarHBondContact OD1-N 2.91Å; D1869-V1871 VanDerWaalsContact OD1-N 3.12Å; D1869-V1871 WeakPolarHBondContact OD2-CG2 3.23Å; V1871-I1873 HydrophobicContact CB-CD1 3.86Å; V1871-I1873 HydrophobicContact CB-CG1 4.04Å; V1871-I1873 HydrophobicContact CG1-CD1 3.92Å; V1871-I1873 HydrophobicContact CG1-CG1 4.03Å; V1871-I1873 HydrophobicContact CG2-CD1 4.01Å
1872	N	23.3	Very low	25.2	Very low	10 Å²	10	66.8 Å²	66.8	5%	0.053	38%	0.38	C	S	.	.			trans	-157.4	87.3	-165.5	-51.4	134.1	0	0	0	114.7	E1224 P1225 A1226 K1863 E1865 T1870	E1224-N1872 WeakPolarHBondContact O-CA 3.32Å; E1224-N1872 PolarHBondContact O-N 2.84Å; P1225-N1872 PolarHBondContact O-ND2 2.77Å; A1226-N1872 VanDerWaalsContact CA-CB 3.45Å; A1226-N1872 HydrophobicContact CB-CB 3.58Å; K1863-N1872 WeakPolarHBondContact CG-OD1 3.21Å; K1863-N1872 VanDerWaalsContact NZ-CG 3.27Å; K1863-N1872 PolarHBondContact NZ-ND2 3.1Å; K1863-N1872 PolarHBondContact NZ-OD1 3.16Å; K1863-N1872 WeakPolarHBondContact O-CB 3.35Å; K1863-N1872 PolarHBondContact O-OD1 3.14Å; E1865-N1872 PolarHBondContact N-OD1 2.65Å; T1870-N1872 PolarHBondContact O-ND2 2.77Å; T1870-N1872 VanDerWaalsContact O-ND2 3.07Å; T1870-N1872 PolarHBondContact O-OD1 3.13Å
1873	I	25.2	Very low	25.5	Very low	78 Å²	78	70 Å²	70	40%	0.4	39%	0.391	S	S	.	.	S	Bend	cis	79.1	-2.6	0.7	-0.3	178.4	0	0	0	122.8	V1223 E1224 V1871	V1223-I1873 HydrophobicContact CG1-CB 4.3Å; V1223-I1873 HydrophobicContact CG1-CD1 3.97Å; V1223-I1873 HydrophobicContact CG1-CG2 3.84Å; E1224-I1873 WeakPolarHBondContact O-CA 3.46Å; E1224-I1873 WeakPolarHBondContact O-CB 3.49Å; E1224-I1873 WeakPolarHBondContact O-CG1 3.3Å; V1871-I1873 HydrophobicContact CB-CD1 3.86Å; V1871-I1873 HydrophobicContact CB-CG1 4.04Å; V1871-I1873 HydrophobicContact CG1-CD1 3.92Å; V1871-I1873 HydrophobicContact CG1-CG1 4.03Å; V1871-I1873 HydrophobicContact CG2-CD1 4.01Å
1874	A	23.8	Very low	25.7	Very low	25 Å²	25	68.3 Å²	68.3	21%	0.207	40%	0.402	C	S	.	.			trans	62.4	143	166.5	0	0	0	0	0	118.5	P1225 A1226 N1239 M1240	P1225-A1874 WeakPolarHBondContact CB-O 3.43Å; A1226-A1874 VanDerWaalsContact CB-CA 3.46Å; A1226-A1874 HydrophobicContact CB-CB 4.32Å; N1239-A1874 CarbonylContact O-C 3.56Å; N1239-A1874 WeakPolarHBondContact O-CB 3.29Å; M1240-A1874 WeakPolarHBondContact CG-O 3.25Å
1875	G	30	Very low	25.8	Very low	1 Å²	1	70.6 Å²	70.6	1%	0.01	41%	0.412	C	S	.	.			cis	-165.5	-128.9	15.5	0	0	0	0	0	109.4	S1227 V1228 V1238 N1239	S1227-G1875 VanDerWaalsContact C-C 3.42Å; S1227-G1875 CarbonylContact C-O 3.52Å; S1227-G1875 PolarHBondContact N-O 3.42Å; S1227-G1875 CarbonylContact O-C 3.58Å; V1228-G1875 PolarHBondContact N-O 3.09Å; V1238-G1875 VanDerWaalsContact CA-C 3.48Å; V1238-G1875 WeakPolarHBondContact CA-O 3.33Å; N1239-G1875 VanDerWaalsContact N-C 3.31Å; N1239-G1875 WeakPolarHBondContact O-CA 3.49Å; N1239-G1875 PolarHBondContact O-N 2.89Å
1876	G	27.8	Very low	26	Very low	19 Å²	19	67.9 Å²	67.9	20%	0.196	40%	0.402	C	S	.	.			cis	138.6	-2.4	-15.5	0	0	0	0	0	118.5	S1227 D1229 S1237 V1238 N1239	S1227-G1876 PolarHBondContact O-N 3.08Å; D1229-G1876 WeakPolarHBondContact OD2-CA 3.45Å; S1237-G1876 PolarHBondContact O-N 3.05Å; V1238-G1876 VanDerWaalsContact CA-N 3.31Å; N1239-G1876 WeakPolarHBondContact CB-O 3.33Å; N1239-G1876 VanDerWaalsContact N-N 3.13Å; N1239-G1876 PolarHBondContact ND2-O 3.39Å
1877	G	25	Very low	25.9	Very low	20 Å²	20	65.1 Å²	65.1	21%	0.206	39%	0.391	C	S	.	.	S	Bend	trans	150.3	114.9	-172.8	0	0	0	0	0	115	S1237 V1238 N1239 G1879	S1237-G1877 PolarHBondContact O-N 2.92Å; S1237-G1877 VanDerWaalsContact O-N 3.16Å; S1237-G1877 VanDerWaalsContact OG-CA 3.23Å; S1237-G1877 WeakPolarHBondContact OG-CA 3.44Å; S1237-G1877 PolarHBondContact OG-N 2.99Å; S1237-G1877 VanDerWaalsContact OG-N 3.13Å; V1238-G1877 VanDerWaalsContact C-C 3.46Å; V1238-G1877 CarbonylContact C-O 3.36Å; V1238-G1877 PolarHBondContact N-O 3.15Å; N1239-G1877 WeakPolarHBondContact CA-O 3.4Å; N1239-G1877 PolarHBondContact N-O 3.35Å; N1239-G1877 VanDerWaalsContact N-O 3.12Å; N1239-G1877 WeakPolarHBondContact ND2-CA 3.22Å; G1877-G1879 PolarHBondContact O-N 3.17Å
1878	A	26.2	Very low	26.2	Very low	43 Å²	43	63.7 Å²	63.7	36%	0.355	39%	0.388	S	S	.	.			trans	-37.1	83.9	-152.4	0	0	0	0	0	120.4	S1237 V1880 T1886	S1237-A1878 VanDerWaalsContact CB-N 3.33Å; A1878-V1880 CarbonylContact C-O 3.34Å; A1878-V1880 VanDerWaalsContact CA-O 3.27Å; A1878-V1880 WeakPolarHBondContact CA-O 3.22Å; A1878-T1886 HydrophobicContact CB-CG2 4.07Å
1879	G	26.7	Very low	26.6	Very low	35 Å²	35	62.4 Å²	62.4	36%	0.361	37%	0.371	S	S	.	.	S	Bend	trans	-135.4	63.5	166.7	0	0	0	0	0	112.6	V1238 G1877	V1238-G1879 WeakPolarHBondContact CG1-O 3.22Å; V1238-G1879 CarbonylContact O-C 3.5Å; V1238-G1879 WeakPolarHBondContact O-CA 3.22Å; V1238-G1879 PolarHBondContact O-N 3.35Å; G1877-G1879 PolarHBondContact O-N 3.17Å
1880	V	37.3	Very low	26.4	Very low	41 Å²	41	66.8 Å²	66.8	25%	0.248	40%	0.395	C	S	.	.			cis	-122.1	-102.8	15.1	-155.1	0	0	0	0	111	A1878 I1883 T1886	A1878-V1880 CarbonylContact C-O 3.34Å; A1878-V1880 VanDerWaalsContact CA-O 3.27Å; A1878-V1880 WeakPolarHBondContact CA-O 3.22Å; V1880-I1883 HydrophobicContact CB-CG1 4.02Å; V1880-I1883 HydrophobicContact CG1-CG1 4.13Å; V1880-I1883 HydrophobicContact CG2-CD1 3.98Å; V1880-I1883 HydrophobicContact CG2-CG1 3.81Å; V1880-T1886 WeakPolarHBondContact CG1-O 3.46Å
1881	A	21	Very low	27.3	Very low	32 Å²	32	71.7 Å²	71.7	26%	0.264	41%	0.409	S	S	.	.	S	Bend	cis	55.1	161.4	6.6	0	0	0	0	0	116.2	T1886	A1881-T1886 VanDerWaalsContact CB-OG1 3.28Å; A1881-T1886 WeakPolarHBondContact CB-OG1 3.45Å
1882	R	25.6	Very low	27.6	Very low	241 Å²	241	72.8 Å²	72.8	91%	0.909	42%	0.421	S	S	*	.	S	Bend	cis	51.7	48.3	17	-84.7	-156.7	-177.5	-156.5	2	115.1	G1884	R1882-G1884 CarbonylContact O-C 3.54Å; R1882-G1884 PolarHBondContact O-N 2.96Å; R1882-G1884 VanDerWaalsContact O-N 3.07Å
1883	I	26.5	Very low	28.5	Very low	132 Å²	132	79.4 Å²	79.4	68%	0.677	46%	0.455	S	S	*	.	S	Bend	trans	-57.9	119.3	170.4	-55.1	-179.1	0	0	0	106.6	V1880	V1880-I1883 HydrophobicContact CB-CG1 4.02Å; V1880-I1883 HydrophobicContact CG1-CG1 4.13Å; V1880-I1883 HydrophobicContact CG2-CD1 3.98Å; V1880-I1883 HydrophobicContact CG2-CG1 3.81Å
1884	G	27.1	Very low	28.5	Very low	65 Å²	65	81.9 Å²	81.9	67%	0.67	47%	0.468	S	S	*	.	S	Bend	cis	-47.9	103.2	16.1	0	0	0	0	0	120	R1882	R1882-G1884 CarbonylContact O-C 3.54Å; R1882-G1884 PolarHBondContact O-N 2.96Å; R1882-G1884 VanDerWaalsContact O-N 3.07Å
1885	D	26	Very low	28.3	Very low	124 Å²	124	87 Å²	87	66%	0.663	50%	0.497	S	S	*	.			trans	38.4	105.7	151.6	-44.6	-29	0	0	0	118.2	V1887	D1885-V1887 WeakPolarHBondContact O-CG2 3.41Å
1886	T	22.9	Very low	27.8	Very low	43 Å²	43	90 Å²	90	26%	0.264	53%	0.527	S	S	.	.			trans	-119	76.7	146.7	-56.9	0	0	0	0	106.1	A1878 V1880 A1881	A1878-T1886 HydrophobicContact CB-CG2 4.07Å; V1880-T1886 WeakPolarHBondContact CG1-O 3.46Å; A1881-T1886 VanDerWaalsContact CB-OG1 3.28Å; A1881-T1886 WeakPolarHBondContact CB-OG1 3.45Å
1887	V	22.3	Very low	27.5	Very low	89 Å²	89	93.3 Å²	93.3	54%	0.539	56%	0.562	S	S	.	*				73.8	118.7	87.2	170.1	0	0	0	0	110.1	D1885 V1889	D1885-V1887 WeakPolarHBondContact O-CG2 3.41Å; V1887-V1889 HydrophobicContact CG1-CB 4.4Å; V1887-V1889 HydrophobicContact CG1-CG1 3.8Å; V1887-V1889 HydrophobicContact CG1-CG2 4.46Å; V1887-V1889 PolarHBondContact O-N 2.63Å
1888	D	31.8	Very low	27.3	Very low	103 Å²	103	96.8 Å²	96.8	55%	0.551	58%	0.583	S	S	*	*			trans	-64.3	82.6	159.3	177.9	1.4	0	0	0	109.9	N1890 K1891	D1888-N1890 PolarHBondContact O-N 2.94Å; D1888-N1890 WeakPolarHBondContact OD1-CA 3.46Å; D1888-N1890 PolarHBondContact OD1-N 2.94Å; D1888-K1891 PolarHBondContact O-N 3.4Å; D1888-K1891 PolarHBondContact OD1-N 2.9Å; D1888-K1891 VanDerWaalsContact OD1-N 3.08Å
1889	V	29.5	Very low	27	Very low	53 Å²	53	99.7 Å²	99.7	32%	0.321	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	41.8	161.8	-90.7	0	0	0	0	110.7	V1887 G1892	V1887-V1889 HydrophobicContact CG1-CB 4.4Å; V1887-V1889 HydrophobicContact CG1-CG1 3.8Å; V1887-V1889 HydrophobicContact CG1-CG2 4.46Å; V1887-V1889 PolarHBondContact O-N 2.63Å; V1889-G1892 WeakPolarHBondContact CG1-O 3.4Å
1890	N	31.5	Very low	26.7	Very low	159 Å²	159	106.3 Å²	106.3	85%	0.85	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.1	8.2	151.4	-92.7	-74.5	0	0	0	113.1	D1888	D1888-N1890 PolarHBondContact O-N 2.94Å; D1888-N1890 WeakPolarHBondContact OD1-CA 3.46Å; D1888-N1890 PolarHBondContact OD1-N 2.94Å
1891	K	40.3	Very low	26.1	Very low	187 Å²	187	111.3 Å²	111.3	81%	0.813	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.1	0.3	164.5	-72.3	-170.5	176.8	173.8	0	117.3	D1888	D1888-K1891 PolarHBondContact O-N 3.4Å; D1888-K1891 PolarHBondContact OD1-N 2.9Å; D1888-K1891 VanDerWaalsContact OD1-N 3.08Å
1892	G	30.6	Very low	26.3	Very low	28 Å²	28	117.5 Å²	117.5	29%	0.289	67%	0.671	S	S	.	*			trans	-149.8	140.7	169.7	0	0	0	0	0	113.2	V1889	V1889-G1892 WeakPolarHBondContact CG1-O 3.4Å
1893	I	41.2	Very low	26	Very low	149 Å²	149	109.2 Å²	109.2	76%	0.764	65%	0.654	S	S	*	*				75.2	92	53.2	-64.8	168.1	0	0	0	108.9
1894	I	24.5	Very low	25.8	Very low	131 Å²	131	105.7 Å²	105.7	67%	0.672	65%	0.65	S	S	*	*				43.9	128.5	66.2	-44.4	-176.7	0	0	0	113.9
1895	T	20.4	Very low	25.6	Very low	132 Å²	132	108.4 Å²	108.4	81%	0.81	65%	0.649	S	S	*	*			trans	77.9	146.9	-179.8	79.2	0	0	0	0	115.7
1896	G	19.6	Very low	25.7	Very low	63 Å²	63	109 Å²	109	65%	0.649	65%	0.648	S	S	*	*			trans	86.8	86.6	-176.4	0	0	0	0	0	112.6	S1898	G1896-S1898 VanDerWaalsContact C-N 3.3Å
1897	G	21.5	Very low	25.9	Very low	89 Å²	89	113 Å²	113	92%	0.918	67%	0.666	S	S	*	*			cis	79.6	6.9	12.6	0	0	0	0	0	114
1898	S	21.3	Very low	26.1	Very low	94 Å²	94	117.4 Å²	117.4	66%	0.657	68%	0.678	S	S	*	*			trans	-148.5	105.5	173	49.1	0	0	0	0	108.3	G1896	G1896-S1898 VanDerWaalsContact C-N 3.3Å
1899	S	19.4	Very low	25.6	Very low	103 Å²	103	115.6 Å²	115.6	72%	0.72	67%	0.671	S	S	*	*				71.8	95.1	81.2	-66.5	0	0	0	0	112.9
1900	K	21.1	Very low	25.5	Very low	175 Å²	175	114.6 Å²	114.6	76%	0.761	67%	0.671	S	S	*	*	S	Bend	trans	40.4	104.2	150.3	-62.8	-175.7	175.9	-174.9	0	118.3	A1903	K1900-A1903 WeakPolarHBondContact O-CA 3.09Å; K1900-A1903 WeakPolarHBondContact O-CB 3.25Å; K1900-A1903 PolarHBondContact O-N 2.84Å
1901	V	24.1	Very low	25.5	Very low	145 Å²	145	113.4 Å²	113.4	88%	0.879	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.5	-167.4	141.6	-170.6	0	0	0	0	112.9	A1903	V1901-A1903 PolarHBondContact O-N 3.16Å
1902	F	25.4	Very low	24.8	Very low	163 Å²	163	110.2 Å²	110.2	72%	0.715	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	67.8	145.8	-92.3	-107	0	0	0	110.9	G1904 L1905	F1902-G1904 VanDerWaalsContact C-C 3.49Å; F1902-L1905 HydrophobicContact CB-CB 4.17Å; F1902-L1905 HydrophobicContact CB-CG 4.49Å; F1902-L1905 HydrophobicContact CD1-CB 4.17Å; F1902-L1905 HydrophobicContact CD1-CG 4.01Å; F1902-L1905 PolarHBondContact O-N 3.3Å
1903	A	19.9	Very low	24.6	Very low	67 Å²	67	111.8 Å²	111.8	55%	0.554	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.2	71.3	155	0	0	0	0	0	106.9	K1900 V1901	K1900-A1903 WeakPolarHBondContact O-CA 3.09Å; K1900-A1903 WeakPolarHBondContact O-CB 3.25Å; K1900-A1903 PolarHBondContact O-N 2.84Å; V1901-A1903 PolarHBondContact O-N 3.16Å
1904	G	22	Very low	24.2	Very low	58 Å²	58	109.8 Å²	109.8	60%	0.598	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	cis	-86.3	109.9	36.4	0	0	0	0	0	118.8	F1902 E1906	F1902-G1904 VanDerWaalsContact C-C 3.49Å; G1904-E1906 PolarHBondContact O-N 2.78Å
1905	L	23.2	Very low	24.5	Very low	121 Å²	121	105.3 Å²	105.3	63%	0.634	64%	0.635	S	S	*	*			trans	-71.3	72.1	138	-156.5	-176.9	0	0	0	107.4	F1902 I1907	F1902-L1905 HydrophobicContact CB-CB 4.17Å; F1902-L1905 HydrophobicContact CB-CG 4.49Å; F1902-L1905 HydrophobicContact CD1-CB 4.17Å; F1902-L1905 HydrophobicContact CD1-CG 4.01Å; F1902-L1905 PolarHBondContact O-N 3.3Å; L1905-I1907 HydrophobicContact CD2-CD1 4.27Å; L1905-I1907 HydrophobicContact CD2-CG1 4.28Å
1906	E	27.1	Very low	24.7	Very low	138 Å²	138	105.7 Å²	105.7	65%	0.645	63%	0.627	S	S	*	*			trans	-146.9	62.3	-176	-149.9	179.4	-108	0	0	112.6	G1904 K1908	G1904-E1906 PolarHBondContact O-N 2.78Å; E1906-K1908 VanDerWaalsContact C-N 3.32Å; E1906-K1908 PolarHBondContact O-N 3.32Å
1907	I	26.8	Very low	24.9	Very low	127 Å²	127	106.4 Å²	106.4	65%	0.651	62%	0.616	S	S	*	*				24.9	63	128.8	-48.9	-178.7	0	0	0	115.2	L1905 G1910	L1905-I1907 HydrophobicContact CD2-CD1 4.27Å; L1905-I1907 HydrophobicContact CD2-CG1 4.28Å; I1907-G1910 VanDerWaalsContact CG2-CA 3.46Å
1908	K	27.2	Very low	25.4	Very low	180 Å²	180	106.5 Å²	106.5	78%	0.783	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	99.6	167	-80.8	-179.3	-175.8	169.8	0	109.6	E1906	E1906-K1908 VanDerWaalsContact C-N 3.32Å; E1906-K1908 PolarHBondContact O-N 3.32Å
1909	T	22.2	Very low	25.4	Very low	65 Å²	65	111.2 Å²	111.2	40%	0.399	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	cis	-133	92.1	2.7	26	0	0	0	0	110.6	L1911 Q1912 A1913	T1909-L1911 PolarHBondContact O-N 2.82Å; T1909-Q1912 HydrophobicContact CG2-CG 4.24Å; T1909-Q1912 CarbonylContact O-C 3.59Å; T1909-Q1912 WeakPolarHBondContact O-CA 3.3Å; T1909-Q1912 PolarHBondContact O-N 3.31Å; T1909-Q1912 PolarHBondContact OG1-OE1 2.84Å; T1909-A1913 PolarHBondContact O-N 3.16Å
1910	G	26	Very low	25.7	Very low	32 Å²	32	110.8 Å²	110.8	33%	0.33	60%	0.596	S	S	.	*	H	α-helix	trans	-57.8	-23.1	160.1	0	0	0	0	0	111.9	I1907 Q1912 L1914	I1907-G1910 VanDerWaalsContact CG2-CA 3.46Å; G1910-Q1912 VanDerWaalsContact C-N 3.29Å; G1910-Q1912 PolarHBondContact O-N 2.81Å; G1910-L1914 WeakPolarHBondContact O-CA 3.33Å; G1910-L1914 WeakPolarHBondContact O-CB 3.31Å; G1910-L1914 PolarHBondContact O-N 2.92Å
1911	L	31.1	Very low	25.8	Very low	134 Å²	134	112.2 Å²	112.2	70%	0.702	60%	0.596	S	S	*	*	H	α-helix	trans	-83.9	7.1	169.5	-144.4	75	0	0	0	114.6	T1909 A1915	T1909-L1911 PolarHBondContact O-N 2.82Å; L1911-A1915 WeakPolarHBondContact O-CB 3.3Å
1912	Q	26.8	Very low	26	Very low	121 Å²	121	111.3 Å²	111.3	57%	0.565	59%	0.586	S	S	*	*	H	α-helix	trans	-120.9	-23.1	164.8	-68.6	179.7	-60.6	0	0	112.6	T1909 G1910 A1915 Q1916	T1909-Q1912 HydrophobicContact CG2-CG 4.24Å; T1909-Q1912 CarbonylContact O-C 3.59Å; T1909-Q1912 WeakPolarHBondContact O-CA 3.3Å; T1909-Q1912 PolarHBondContact O-N 3.31Å; T1909-Q1912 PolarHBondContact OG1-OE1 2.84Å; G1910-Q1912 VanDerWaalsContact C-N 3.29Å; G1910-Q1912 PolarHBondContact O-N 2.81Å; Q1912-A1915 VanDerWaalsContact C-N 3.34Å; Q1912-A1915 CarbonylContact O-C 3.44Å; Q1912-A1915 WeakPolarHBondContact O-CA 3.29Å; Q1912-A1915 PolarHBondContact O-N 3.49Å; Q1912-A1915 VanDerWaalsContact O-N 3.1Å; Q1912-Q1916 WeakPolarHBondContact O-CB 3.4Å; Q1912-Q1916 PolarHBondContact O-N 3.09Å
1913	A	25.5	Very low	26	Very low	61 Å²	61	107.8 Å²	107.8	50%	0.504	58%	0.582	S	S	.	*	H	α-helix	trans	-62.1	-52	154.9	0	0	0	0	0	109.7	T1909 A1915 Q1916 D1917	T1909-A1913 PolarHBondContact O-N 3.16Å; A1913-A1915 PolarHBondContact O-N 3.13Å; A1913-Q1916 PolarHBondContact O-N 2.89Å; A1913-D1917 VanDerWaalsContact O-CB 3.3Å; A1913-D1917 WeakPolarHBondContact O-CB 3.28Å; A1913-D1917 PolarHBondContact O-N 2.67Å
1914	L	33.5	Very low	26.2	Very low	107 Å²	107	112.5 Å²	112.5	56%	0.56	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	21.7	165.6	-152.4	82.5	0	0	0	113.1	G1910 T1918	G1910-L1914 WeakPolarHBondContact O-CA 3.33Å; G1910-L1914 WeakPolarHBondContact O-CB 3.31Å; G1910-L1914 PolarHBondContact O-N 2.92Å; L1914-T1918 VanDerWaalsContact C-OG1 3.27Å; L1914-T1918 WeakPolarHBondContact CA-OG1 3.29Å; L1914-T1918 WeakPolarHBondContact CG-OG1 3.27Å; L1914-T1918 VanDerWaalsContact O-CB 3.31Å; L1914-T1918 WeakPolarHBondContact O-CB 3.4Å; L1914-T1918 PolarHBondContact O-OG1 3.19Å; L1914-T1918 VanDerWaalsContact O-OG1 3.13Å
1915	A	30.3	Very low	26.3	Very low	36 Å²	36	115.5 Å²	115.5	30%	0.298	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-139.6	22.6	158.1	0	0	0	0	0	112.7	L1911 Q1912 A1913 R1919	L1911-A1915 WeakPolarHBondContact O-CB 3.3Å; Q1912-A1915 VanDerWaalsContact C-N 3.34Å; Q1912-A1915 CarbonylContact O-C 3.44Å; Q1912-A1915 WeakPolarHBondContact O-CA 3.29Å; Q1912-A1915 PolarHBondContact O-N 3.49Å; Q1912-A1915 VanDerWaalsContact O-N 3.1Å; A1913-A1915 PolarHBondContact O-N 3.13Å; A1915-R1919 VanDerWaalsContact O-CB 3.3Å; A1915-R1919 WeakPolarHBondContact O-CB 3.43Å; A1915-R1919 WeakPolarHBondContact O-CD 3.28Å; A1915-R1919 WeakPolarHBondContact O-CG 3.33Å
1916	Q	24	Very low	26.4	Very low	140 Å²	140	119.7 Å²	119.7	65%	0.654	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	-48	171.7	-171.6	164.5	-4.6	0	0	109.8	Q1912 A1913 T1918 R1919 T1920	Q1912-Q1916 WeakPolarHBondContact O-CB 3.4Å; Q1912-Q1916 PolarHBondContact O-N 3.09Å; A1913-Q1916 PolarHBondContact O-N 2.89Å; Q1916-T1918 VanDerWaalsContact C-N 3.26Å; Q1916-T1918 PolarHBondContact O-N 2.84Å; Q1916-R1919 PolarHBondContact O-N 2.83Å; Q1916-T1920 PolarHBondContact O-N 2.91Å; Q1916-T1920 PolarHBondContact O-OG1 2.89Å
1917	D	25.8	Very low	26.3	Very low	78 Å²	78	116.8 Å²	116.8	42%	0.417	63%	0.625	S	S	.	*	H	α-helix	trans	-57.3	-44.4	158.3	-168.3	49.9	0	0	0	109.6	A1913 R1919 R1921	A1913-D1917 VanDerWaalsContact O-CB 3.3Å; A1913-D1917 WeakPolarHBondContact O-CB 3.28Å; A1913-D1917 PolarHBondContact O-N 2.67Å; D1917-R1919 PolarHBondContact O-N 3.31Å; D1917-R1921 WeakPolarHBondContact O-CB 3.47Å; D1917-R1921 WeakPolarHBondContact O-CG 3.29Å; D1917-R1921 PolarHBondContact O-N 3.26Å; D1917-R1921 WeakPolarHBondContact OD1-CD 3.48Å; D1917-R1921 VanDerWaalsContact OD1-CG 3.3Å; D1917-R1921 WeakPolarHBondContact OD1-CG 3.41Å; D1917-R1921 IonicContact OD1-NE 2.59Å; D1917-R1921 IonicContact OD1-NH1 3.93Å; D1917-R1921 IonicContact OD2-NH1 3.81Å
1918	T	30	Very low	26.4	Very low	91 Å²	91	119.6 Å²	119.6	56%	0.558	64%	0.635	S	S	*	*	H	α-helix	trans	-77.8	-12.8	175.3	-44.6	0	0	0	0	114.4	L1914 Q1916	L1914-T1918 VanDerWaalsContact C-OG1 3.27Å; L1914-T1918 WeakPolarHBondContact CA-OG1 3.29Å; L1914-T1918 WeakPolarHBondContact CG-OG1 3.27Å; L1914-T1918 VanDerWaalsContact O-CB 3.31Å; L1914-T1918 WeakPolarHBondContact O-CB 3.4Å; L1914-T1918 PolarHBondContact O-OG1 3.19Å; L1914-T1918 VanDerWaalsContact O-OG1 3.13Å; Q1916-T1918 VanDerWaalsContact C-N 3.26Å; Q1916-T1918 PolarHBondContact O-N 2.84Å
1919	R	21.9	Very low	26.6	Very low	193 Å²	193	116.4 Å²	116.4	73%	0.728	63%	0.627	S	S	*	*	H	α-helix	trans	-94	-28.5	171.7	-84.5	-171.7	178.2	-154.5	-2.9	113.8	A1915 Q1916 D1917	A1915-R1919 VanDerWaalsContact O-CB 3.3Å; A1915-R1919 WeakPolarHBondContact O-CB 3.43Å; A1915-R1919 WeakPolarHBondContact O-CD 3.28Å; A1915-R1919 WeakPolarHBondContact O-CG 3.33Å; Q1916-R1919 PolarHBondContact O-N 2.83Å; D1917-R1919 PolarHBondContact O-N 3.31Å
1920	T	25.4	Very low	26.9	Very low	95 Å²	95	118.5 Å²	118.5	58%	0.583	64%	0.642	S	S	*	*	H	α-helix	trans	-142.1	23.8	-169.5	8.5	0	0	0	0	116.1	Q1916 L1922	Q1916-T1920 PolarHBondContact O-N 2.91Å; Q1916-T1920 PolarHBondContact O-OG1 2.89Å; T1920-L1922 PolarHBondContact O-N 3.12Å
1921	R	24.4	Very low	27	Very low	204 Å²	204	126.4 Å²	126.4	77%	0.77	66%	0.663	S	S	*	*	S	Bend	trans	-67.5	35.5	136.9	-73.4	-174.3	124.4	156.2	-6.5	112.3	D1917	D1917-R1921 WeakPolarHBondContact O-CB 3.47Å; D1917-R1921 WeakPolarHBondContact O-CG 3.29Å; D1917-R1921 PolarHBondContact O-N 3.26Å; D1917-R1921 WeakPolarHBondContact OD1-CD 3.48Å; D1917-R1921 VanDerWaalsContact OD1-CG 3.3Å; D1917-R1921 WeakPolarHBondContact OD1-CG 3.41Å; D1917-R1921 IonicContact OD1-NE 2.59Å; D1917-R1921 IonicContact OD1-NH1 3.93Å; D1917-R1921 IonicContact OD2-NH1 3.81Å
1922	L	28.7	Very low	27.1	Very low	126 Å²	126	125.5 Å²	125.5	66%	0.66	66%	0.659	S	S	*	*	S	Bend	trans	-145.2	95.7	-176.8	-174.6	66.8	0	0	0	107.6	T1920	T1920-L1922 PolarHBondContact O-N 3.12Å
1923	S	24.1	Very low	27.4	Very low	89 Å²	89	128.3 Å²	128.3	62%	0.622	67%	0.669	S	S	*	*			trans	69.9	90.2	165.7	-60.1	0	0	0	0	119
1924	M	24.1	Very low	27.6	Very low	166 Å²	166	132.2 Å²	132.2	82%	0.818	68%	0.682	S	S	*	*				66.5	119.5	108.9	-68.2	154.2	161	0	0	120.3
1925	C	24	Very low	27.5	Very low	122 Å²	122	135.8 Å²	135.8	82%	0.824	70%	0.695	S	S	*	*			trans	63.6	78.5	131.4	-52.1	0	0	0	0	118.3
1926	K	25.9	Very low	27.5	Very low	208 Å²	208	137.6 Å²	137.6	90%	0.904	72%	0.718	S	S	*	*			trans	-128.2	142.9	133.5	-70.4	-177.7	177.8	179.9	0	107.4
1927	G	25.5	Very low	27.6	Very low	77 Å²	77	137.2 Å²	137.2	79%	0.794	72%	0.719	S	S	*	*			cis	130.4	43.8	5.8	0	0	0	0	0	111.1
1928	E	29.1	Very low	27.7	Very low	186 Å²	186	141 Å²	141	87%	0.869	74%	0.739	S	S	*	*			trans	-106.9	169.4	-173.4	-59.6	-168.6	149.2	0	0	110.5	P1930	E1928-P1930 WeakPolarHBondContact O-CD 3.28Å
1929	N	30	Very low	27.6	Very low	113 Å²	113	146.6 Å²	146.6	60%	0.604	75%	0.751	S	S	*	*			trans	-93	114.4	-136.3	-175.8	34	0	0	0	114.5	Y1931 D1932	N1929-Y1931 PolarHBondContact O-N 3.34Å; N1929-D1932 PolarHBondContact O-N 2.87Å
1930	P	29	Very low	27.8	Very low	110 Å²	110	145 Å²	145	71%	0.714	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	32.7	-175.1	36.1	-39.5	0	0	0	114.1	E1928	E1928-P1930 WeakPolarHBondContact O-CD 3.28Å
1931	Y	28	Very low	27.8	Very low	198 Å²	198	148.3 Å²	148.3	78%	0.776	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.6	-2.5	176.5	-68.7	-66.5	0	0	0	113.4	N1929	N1929-Y1931 PolarHBondContact O-N 3.34Å
1932	D	34	Very low	28	Very low	115 Å²	115	144.7 Å²	144.7	62%	0.615	77%	0.767	S	S	*	*			trans	-83.3	154.8	154.1	-142.3	-47.4	0	0	0	109.5	N1929 D1934	N1929-D1932 PolarHBondContact O-N 2.87Å; D1932-D1934 PolarHBondContact OD1-N 3.1Å
1933	K	32.4	Very low	27.9	Very low	179 Å²	179	145.8 Å²	145.8	78%	0.778	77%	0.771	S	S	*	*			trans	-142.2	-3.4	-165.3	46.8	168.4	175.4	157.6	0	112.9
1934	D	30.1	Very low	28	Very low	144 Å²	144	149.5 Å²	149.5	77%	0.77	78%	0.783	S	S	*	*	S	Bend	trans	-90.3	-10.9	177.5	-62	-10.3	0	0	0	111.6	D1932	D1932-D1934 PolarHBondContact OD1-N 3.1Å
1935	E	30.2	Very low	28.2	Very low	181 Å²	181	145.1 Å²	145.1	85%	0.846	78%	0.78	S	S	*	*	S	Bend	trans	-114.6	101.5	167.3	-68.7	-167	161.3	0	0	111.6	I1937	E1935-I1937 PolarHBondContact O-N 3.44Å
1936	G	30.3	Very low	28.5	Very low	74 Å²	74	148.6 Å²	148.6	76%	0.763	78%	0.782	S	S	*	*			trans	-91.4	88.7	-171.2	0	0	0	0	0	115.6
1937	I	27.5	Very low	28.7	Very low	133 Å²	133	148 Å²	148	68%	0.682	78%	0.784	S	S	*	*			trans	42.9	99.3	145.8	-47.8	172.7	0	0	0	116.8	E1935 Y1939	E1935-I1937 PolarHBondContact O-N 3.44Å; I1937-Y1939 HydrophobicContact CG2-CD2 3.59Å; I1937-Y1939 HydrophobicContact CG2-CE2 3.6Å; I1937-Y1939 HydrophobicContact CG2-CG 4.38Å
1938	D	27.2	Very low	28.7	Very low	156 Å²	156	146.8 Å²	146.8	83%	0.834	77%	0.772	S	S	*	*			trans	-90.2	107.9	160.8	60.5	-32.4	0	0	0	111.7	D1940	D1938-D1940 PolarHBondContact O-N 3.41Å
1939	Y	27	Very low	28.6	Very low	209 Å²	209	141.1 Å²	141.1	82%	0.82	76%	0.764	S	S	*	*			trans	-81	111.2	173	-93.6	-71.4	0	0	0	111.4	I1937 N1941	I1937-Y1939 HydrophobicContact CG2-CD2 3.59Å; I1937-Y1939 HydrophobicContact CG2-CE2 3.6Å; I1937-Y1939 HydrophobicContact CG2-CG 4.38Å; Y1939-N1941 PolarHBondContact O-N 3.31Å
1940	D	26.8	Very low	28.8	Very low	160 Å²	160	142 Å²	142	86%	0.856	77%	0.767	S	S	*	*			trans	-46.8	123.5	160.8	-88	-41.9	0	0	0	110.9	D1938	D1938-D1940 PolarHBondContact O-N 3.41Å
1941	N	26.3	Very low	28.8	Very low	165 Å²	165	139.9 Å²	139.9	88%	0.882	76%	0.759	S	S	*	*			trans	-145	104.6	168.6	-158.4	-11.4	0	0	0	110.1	Y1939	Y1939-N1941 PolarHBondContact O-N 3.31Å
1942	D	28.7	Very low	28.8	Very low	128 Å²	128	137.4 Å²	137.4	68%	0.684	75%	0.752	S	S	*	*			trans	-96.7	140.4	-147.3	-166.7	32	0	0	0	115.1	L1944	D1942-L1944 VanDerWaalsContact C-N 3.29Å; D1942-L1944 PolarHBondContact O-N 3.03Å
1943	M	26.5	Very low	28.8	Very low	148 Å²	148	137 Å²	137	73%	0.729	75%	0.75	S	S	*	*	S	Bend	trans	48.1	-14.7	153.7	-76.9	-92	-86.6	0	0	123.4
1944	L	26.1	Very low	28.6	Very low	168 Å²	168	137.1 Å²	137.1	88%	0.88	75%	0.746	S	S	*	*			trans	-105.9	1.5	-171.2	-72.4	175.1	0	0	0	116.2	D1942 K1946	D1942-L1944 VanDerWaalsContact C-N 3.29Å; D1942-L1944 PolarHBondContact O-N 3.03Å; L1944-K1946 PolarHBondContact O-N 3.32Å
1945	G	28	Very low	28.5	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	74%	0.743	S	S	*	*			trans	-79.3	-1.8	178.8	0	0	0	0	0	116.8	M1947	G1945-M1947 PolarHBondContact O-N 2.96Å
1946	K	30.7	Very low	28.6	Very low	195 Å²	195	135 Å²	135	85%	0.848	72%	0.723	S	S	*	*			trans	-77.3	15.2	-167.1	-81.5	-172.9	176	176.8	0	116.6	L1944	L1944-K1946 PolarHBondContact O-N 3.32Å
1947	M	28.9	Very low	28.8	Very low	194 Å²	194	139.1 Å²	139.1	96%	0.956	72%	0.722	S	S	*	*	S	Bend	trans	-124	51.3	177.3	-58.6	-167.1	80.9	0	0	112.4	G1945	G1945-M1947 PolarHBondContact O-N 2.96Å
1948	G	26.2	Very low	29.2	Very low	52 Å²	52	138.1 Å²	138.1	54%	0.536	72%	0.718	S	S	.	*			trans	-149	94.4	176.1	0	0	0	0	0	112.2	I1950	G1948-I1950 PolarHBondContact O-N 3.01Å
1949	G	27.3	Very low	29.5	Very low	68 Å²	68	133.6 Å²	133.6	70%	0.701	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	25.1	-164.6	0	0	0	0	0	118.6
1950	I	33.2	Very low	30	Very low	131 Å²	131	128.3 Å²	128.3	67%	0.672	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-35.6	-178.8	-70.2	175.3	0	0	0	112.1	G1948 F1952 R1954	G1948-I1950 PolarHBondContact O-N 3.01Å; I1950-F1952 PolarHBondContact O-N 2.87Å; I1950-R1954 PolarHBondContact O-N 3.08Å
1951	A	29.7	Very low	30.3	Very low	66 Å²	66	122.6 Å²	122.6	55%	0.545	66%	0.66	S	S	.	*	H	α-helix	trans	-71.3	-27.5	-176.1	0	0	0	0	0	113.9	R1955	A1951-R1955 PolarHBondContact O-N 2.83Å
1952	F	27.8	Very low	30.7	Very low	145 Å²	145	119.9 Å²	119.9	64%	0.636	65%	0.646	S	S	*	*	H	α-helix	trans	-68.7	-48.9	177.5	-167.1	-99.1	0	0	0	111.1	I1950 R1954 R1955 Q1956	I1950-F1952 PolarHBondContact O-N 2.87Å; F1952-R1954 PolarHBondContact O-N 2.91Å; F1952-R1955 PolarHBondContact O-N 2.92Å; F1952-Q1956 HydrophobicContact CD1-CG 4.3Å; F1952-Q1956 HydrophobicContact CE1-CG 4.11Å; F1952-Q1956 WeakPolarHBondContact O-CG 3.31Å; F1952-Q1956 PolarHBondContact O-N 2.6Å
1953	N	33.5	Very low	31	Very low	107 Å²	107	118.5 Å²	118.5	57%	0.572	64%	0.639	S	S	*	*	H	α-helix	trans	-64.7	-40.6	179.5	-65.1	2.5	0	0	0	111.8	R1955 Q1956 H1957	N1953-R1955 VanDerWaalsContact C-N 3.35Å; N1953-R1955 PolarHBondContact O-N 3.41Å; N1953-Q1956 PolarHBondContact O-N 2.66Å; N1953-H1957 PolarHBondContact O-N 2.82Å; N1953-H1957 VanDerWaalsContact O-N 3.11Å
1954	R	29.1	Very low	31.4	Very low	182 Å²	182	119.5 Å²	119.5	69%	0.687	63%	0.634	S	S	*	*	H	α-helix	trans	-67.4	-32.1	177.6	-167.8	172.8	-71.3	-172.2	-2.9	112.8	I1950 F1952 N1958	I1950-R1954 PolarHBondContact O-N 3.08Å; F1952-R1954 PolarHBondContact O-N 2.91Å; R1954-N1958 PolarHBondContact O-N 3.49Å
1955	R	28.1	Very low	32	Very low	188 Å²	188	116.9 Å²	116.9	71%	0.709	62%	0.619	S	S	*	*	H	α-helix	trans	-74.2	-39.2	173.4	-124.9	-174.2	-72.7	-160.9	-2.7	112.3	A1951 F1952 N1953 H1957 N1958 S1959	A1951-R1955 PolarHBondContact O-N 2.83Å; F1952-R1955 PolarHBondContact O-N 2.92Å; N1953-R1955 VanDerWaalsContact C-N 3.35Å; N1953-R1955 PolarHBondContact O-N 3.41Å; R1955-H1957 VanDerWaalsContact C-N 3.26Å; R1955-H1957 PolarHBondContact O-N 3.26Å; R1955-N1958 PolarHBondContact O-N 2.9Å; R1955-S1959 PolarHBondContact O-N 3.18Å; R1955-S1959 PolarHBondContact O-OG 3.09Å
1956	Q	31.2	Very low	32.4	Very low	92 Å²	92	117.5 Å²	117.5	43%	0.43	60%	0.604	S	S	.	*	H	α-helix	trans	-57.5	-37.1	173.5	-74.6	-66.1	-35.2	0	0	112.8	F1952 N1953 H1960	F1952-Q1956 HydrophobicContact CD1-CG 4.3Å; F1952-Q1956 HydrophobicContact CE1-CG 4.11Å; F1952-Q1956 WeakPolarHBondContact O-CG 3.31Å; F1952-Q1956 PolarHBondContact O-N 2.6Å; N1953-Q1956 PolarHBondContact O-N 2.66Å; Q1956-H1960 PolarHBondContact O-ND1 3.35Å; Q1956-H1960 PolarHBondContact OE1-CE1 2.82Å; Q1956-H1960 VanDerWaalsContact OE1-CE1 3.27Å
1957	H	34.9	Very low	33	Very low	160 Å²	160	113.9 Å²	113.9	74%	0.741	59%	0.591	S	S	*	*	H	α-helix	trans	-73.2	-43	175.4	-113.5	-81.8	0	0	0	113.7	N1953 R1955	N1953-H1957 PolarHBondContact O-N 2.82Å; N1953-H1957 VanDerWaalsContact O-N 3.11Å; R1955-H1957 VanDerWaalsContact C-N 3.26Å; R1955-H1957 PolarHBondContact O-N 3.26Å
1958	N	37	Very low	33.4	Very low	113 Å²	113	108.6 Å²	108.6	60%	0.604	57%	0.572	S	S	*	*	H	α-helix	trans	-89.3	-28.1	-171.6	-72.8	40.2	0	0	0	114.4	R1954 R1955 H1960 G1961	R1954-N1958 PolarHBondContact O-N 3.49Å; R1955-N1958 PolarHBondContact O-N 2.9Å; N1958-H1960 VanDerWaalsContact C-N 3.31Å; N1958-H1960 PolarHBondContact O-N 2.65Å; N1958-G1961 PolarHBondContact O-N 2.9Å
1959	S	33.1	Very low	34.2	Very low	61 Å²	61	111.5 Å²	111.5	43%	0.427	57%	0.571	S	S	.	*	H	α-helix	trans	-81.2	-8	178.3	72.2	0	0	0	0	114.3	R1955	R1955-S1959 PolarHBondContact O-N 3.18Å; R1955-S1959 PolarHBondContact O-OG 3.09Å
1960	H	36.4	Very low	35.1	Very low	97 Å²	97	112.9 Å²	112.9	45%	0.449	56%	0.56	S	S	.	*	H	α-helix	trans	-88.9	-6.9	170.3	-74.7	107.4	0	0	0	113.5	Q1956 N1958 R1964	Q1956-H1960 PolarHBondContact O-ND1 3.35Å; Q1956-H1960 PolarHBondContact OE1-CE1 2.82Å; Q1956-H1960 VanDerWaalsContact OE1-CE1 3.27Å; N1958-H1960 VanDerWaalsContact C-N 3.31Å; N1958-H1960 PolarHBondContact O-N 2.65Å; H1960-R1964 WeakPolarHBondContact O-CB 3.4Å; H1960-R1964 WeakPolarHBondContact O-CG 3.29Å
1961	G	34	Very low	36.1	Very low	40 Å²	40	110.4 Å²	110.4	41%	0.412	55%	0.551	S	S	.	*	H	α-helix	trans	-74.5	-72.3	169.3	0	0	0	0	0	111.2	N1958 N1963 R1964 M1965	N1958-G1961 PolarHBondContact O-N 2.9Å; G1961-N1963 PolarHBondContact O-N 3.24Å; G1961-R1964 PolarHBondContact O-N 2.84Å; G1961-R1964 VanDerWaalsContact O-N 3.13Å; G1961-M1965 PolarHBondContact O-N 2.66Å
1962	D	34.2	Very low	36.9	Very low	108 Å²	108	110.6 Å²	110.6	58%	0.578	55%	0.545	S	S	*	.	H	α-helix	trans	-61.9	-41.1	-170.1	-71.1	-28.3	0	0	0	113.9	R1964 M1965 N1966	D1962-R1964 VanDerWaalsContact C-N 3.33Å; D1962-R1964 PolarHBondContact O-N 3.27Å; D1962-M1965 PolarHBondContact O-N 3.4Å; D1962-N1966 WeakPolarHBondContact O-CB 3.02Å; D1962-N1966 PolarHBondContact O-N 2.74Å; D1962-N1966 PolarHBondContact O-ND2 2.7Å
1963	N	36.2	Very low	38	Very low	100 Å²	100	106 Å²	106	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-36	177.7	-86.7	25.8	0	0	0	112.3	G1961 E1967	G1961-N1963 PolarHBondContact O-N 3.24Å; N1963-E1967 VanDerWaalsContact O-CB 3.24Å; N1963-E1967 WeakPolarHBondContact O-CB 3.35Å; N1963-E1967 WeakPolarHBondContact O-CG 3.36Å; N1963-E1967 PolarHBondContact O-N 3.11Å
1964	R	34.5	Very low	39	Very low	168 Å²	168	103.1 Å²	103.1	63%	0.634	51%	0.511	S	S	*	.	H	α-helix	trans	-73.9	-32.8	173.2	-72.1	-169.9	179.7	-158.2	3.5	112.5	H1960 G1961 D1962 C1968	H1960-R1964 WeakPolarHBondContact O-CB 3.4Å; H1960-R1964 WeakPolarHBondContact O-CG 3.29Å; G1961-R1964 PolarHBondContact O-N 2.84Å; G1961-R1964 VanDerWaalsContact O-N 3.13Å; D1962-R1964 VanDerWaalsContact C-N 3.33Å; D1962-R1964 PolarHBondContact O-N 3.27Å; R1964-C1968 WeakPolarHBondContact O-CB 3.14Å; R1964-C1968 PolarHBondContact O-N 2.78Å; R1964-C1968 PolarHBondContact O-SG 3.08Å
1965	M	37.5	Very low	39.9	Very low	113 Å²	113	97.5 Å²	97.5	56%	0.557	50%	0.495	S	S	*	.	H	α-helix	trans	-61.9	-47.6	171.5	-169.7	85.5	84.2	0	0	110	G1961 D1962 C1968 Q1969	G1961-M1965 PolarHBondContact O-N 2.66Å; D1962-M1965 PolarHBondContact O-N 3.4Å; M1965-C1968 PolarHBondContact O-N 3.45Å; M1965-Q1969 VanDerWaalsContact O-CB 3.26Å; M1965-Q1969 WeakPolarHBondContact O-CB 3.38Å; M1965-Q1969 VanDerWaalsContact O-CG 3.25Å; M1965-Q1969 WeakPolarHBondContact O-CG 3.25Å; M1965-Q1969 PolarHBondContact O-N 3.12Å
1966	N	37.7	Very low	40.6	Very low	87 Å²	87	89.1 Å²	89.1	47%	0.465	46%	0.464	S	S	.	.	H	α-helix	trans	-68	-43	179.5	-66.8	-21	0	0	0	111.9	D1962 Q1969 Q1970	D1962-N1966 WeakPolarHBondContact O-CB 3.02Å; D1962-N1966 PolarHBondContact O-N 2.74Å; D1962-N1966 PolarHBondContact O-ND2 2.7Å; N1966-Q1969 PolarHBondContact O-N 3.11Å; N1966-Q1970 WeakPolarHBondContact O-CB 3.1Å; N1966-Q1970 PolarHBondContact O-N 3.09Å
1967	E	42.7	Very low	41.2	Very low	119 Å²	119	89.2 Å²	89.2	56%	0.556	46%	0.464	S	S	*	.	H	α-helix	trans	-64.3	-41.7	174.3	-76	167.1	-163.4	0	0	111.7	N1963 Q1970 V1971	N1963-E1967 VanDerWaalsContact O-CB 3.24Å; N1963-E1967 WeakPolarHBondContact O-CB 3.35Å; N1963-E1967 WeakPolarHBondContact O-CG 3.36Å; N1963-E1967 PolarHBondContact O-N 3.11Å; E1967-Q1970 PolarHBondContact O-N 3.29Å; E1967-V1971 VanDerWaalsContact O-CB 3.31Å; E1967-V1971 WeakPolarHBondContact O-CB 3.14Å; E1967-V1971 VanDerWaalsContact O-CG2 3.25Å; E1967-V1971 WeakPolarHBondContact O-CG2 3.42Å; E1967-V1971 PolarHBondContact O-N 3.4Å
1968	C	37.4	Very low	41.8	Very low	83 Å²	83	90.5 Å²	90.5	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-69.6	-40.5	175.1	-75.7	0	0	0	0	112.3	R1964 M1965 Q1970 V1971 V1972	R1964-C1968 WeakPolarHBondContact O-CB 3.14Å; R1964-C1968 PolarHBondContact O-N 2.78Å; R1964-C1968 PolarHBondContact O-SG 3.08Å; M1965-C1968 PolarHBondContact O-N 3.45Å; C1968-Q1970 VanDerWaalsContact C-N 3.33Å; C1968-V1971 PolarHBondContact O-N 2.77Å; C1968-V1972 VanDerWaalsContact O-CB 3.3Å; C1968-V1972 WeakPolarHBondContact O-CB 3.18Å; C1968-V1972 VanDerWaalsContact O-CG2 3.24Å; C1968-V1972 WeakPolarHBondContact O-CG2 3.18Å; C1968-V1972 PolarHBondContact O-N 3.45Å
1969	Q	42.4	Very low	42	Very low	113 Å²	113	91.7 Å²	91.7	53%	0.528	47%	0.465	S	S	.	.	H	α-helix	trans	-61	-43.6	172.6	-79.5	-178.5	10.7	0	0	110.6	M1965 N1966 V1972 L1973	M1965-Q1969 VanDerWaalsContact O-CB 3.26Å; M1965-Q1969 WeakPolarHBondContact O-CB 3.38Å; M1965-Q1969 VanDerWaalsContact O-CG 3.25Å; M1965-Q1969 WeakPolarHBondContact O-CG 3.25Å; M1965-Q1969 PolarHBondContact O-N 3.12Å; N1966-Q1969 PolarHBondContact O-N 3.11Å; Q1969-V1972 CarbonylContact O-C 3.59Å; Q1969-V1972 PolarHBondContact O-N 2.93Å; Q1969-L1973 WeakPolarHBondContact O-CB 3.4Å; Q1969-L1973 PolarHBondContact O-N 2.8Å
1970	Q	47.2	Very low	42.5	Very low	97 Å²	97	93.7 Å²	93.7	45%	0.453	47%	0.466	S	S	.	.	H	α-helix	trans	-70.3	-41.4	179	-165.2	61	48.7	0	0	111.8	N1966 E1967 C1968 V1972 L1973 D1974	N1966-Q1970 WeakPolarHBondContact O-CB 3.1Å; N1966-Q1970 PolarHBondContact O-N 3.09Å; E1967-Q1970 PolarHBondContact O-N 3.29Å; C1968-Q1970 VanDerWaalsContact C-N 3.33Å; Q1970-V1972 VanDerWaalsContact C-N 3.28Å; Q1970-V1972 PolarHBondContact O-N 2.7Å; Q1970-L1973 CarbonylContact O-C 3.59Å; Q1970-L1973 WeakPolarHBondContact O-CB 3.24Å; Q1970-L1973 PolarHBondContact O-N 3.32Å; Q1970-L1973 VanDerWaalsContact O-N 3.14Å; Q1970-D1974 PolarHBondContact NE2-OD1 3.17Å; Q1970-D1974 VanDerWaalsContact O-CB 3.29Å; Q1970-D1974 WeakPolarHBondContact O-CB 3.46Å; Q1970-D1974 PolarHBondContact O-N 2.62Å; Q1970-D1974 VanDerWaalsContact O-OD1 3.1Å
1971	V	52.9	Low	43.1	Very low	80 Å²	80	91.8 Å²	91.8	49%	0.485	47%	0.473	S	S	.	.	H	α-helix	trans	-62.9	-35.9	172.2	166.7	0	0	0	0	111.2	E1967 C1968 N1975	E1967-V1971 VanDerWaalsContact O-CB 3.31Å; E1967-V1971 WeakPolarHBondContact O-CB 3.14Å; E1967-V1971 VanDerWaalsContact O-CG2 3.25Å; E1967-V1971 WeakPolarHBondContact O-CG2 3.42Å; E1967-V1971 PolarHBondContact O-N 3.4Å; C1968-V1971 PolarHBondContact O-N 2.77Å; V1971-N1975 WeakPolarHBondContact O-CB 3.34Å; V1971-N1975 PolarHBondContact O-N 2.97Å; V1971-N1975 PolarHBondContact O-ND2 3.44Å
1972	V	48	Very low	43.5	Very low	70 Å²	70	92.5 Å²	92.5	42%	0.424	46%	0.463	S	S	.	.	H	α-helix	trans	-67.7	-43.2	171.3	166.6	0	0	0	0	110.8	C1968 Q1969 Q1970 N1975 L1976	C1968-V1972 VanDerWaalsContact O-CB 3.3Å; C1968-V1972 WeakPolarHBondContact O-CB 3.18Å; C1968-V1972 VanDerWaalsContact O-CG2 3.24Å; C1968-V1972 WeakPolarHBondContact O-CG2 3.18Å; C1968-V1972 PolarHBondContact O-N 3.45Å; Q1969-V1972 CarbonylContact O-C 3.59Å; Q1969-V1972 PolarHBondContact O-N 2.93Å; Q1970-V1972 VanDerWaalsContact C-N 3.28Å; Q1970-V1972 PolarHBondContact O-N 2.7Å; V1972-N1975 PolarHBondContact O-N 3.1Å; V1972-L1976 HydrophobicContact CG1-CD1 3.58Å; V1972-L1976 HydrophobicContact CG1-CG 4.31Å; V1972-L1976 WeakPolarHBondContact O-CB 3.49Å; V1972-L1976 VanDerWaalsContact O-CD1 3.28Å; V1972-L1976 WeakPolarHBondContact O-CD1 3.23Å; V1972-L1976 WeakPolarHBondContact O-CG 3.35Å; V1972-L1976 PolarHBondContact O-N 2.98Å
1973	L	49.3	Very low	44.6	Very low	47 Å²	47	91.2 Å²	91.2	25%	0.246	46%	0.459	C	S	.	.	H	α-helix	trans	-58.3	-51.1	174.9	-133.7	80	0	0	0	111.6	Q1969 Q1970 N1975 L1976 Q1977 T1983 N1984	Q1969-L1973 WeakPolarHBondContact O-CB 3.4Å; Q1969-L1973 PolarHBondContact O-N 2.8Å; Q1970-L1973 CarbonylContact O-C 3.59Å; Q1970-L1973 WeakPolarHBondContact O-CB 3.24Å; Q1970-L1973 PolarHBondContact O-N 3.32Å; Q1970-L1973 VanDerWaalsContact O-N 3.14Å; L1973-N1975 VanDerWaalsContact C-N 3.32Å; L1973-N1975 PolarHBondContact O-N 2.77Å; L1973-L1976 CarbonylContact O-C 3.45Å; L1973-L1976 WeakPolarHBondContact O-CB 3.45Å; L1973-L1976 PolarHBondContact O-N 2.87Å; L1973-L1976 VanDerWaalsContact O-N 3.15Å; L1973-Q1977 WeakPolarHBondContact O-CG 3.16Å; L1973-Q1977 PolarHBondContact O-N 2.61Å; L1973-T1983 VanDerWaalsContact CG-O 3.31Å; L1973-T1983 WeakPolarHBondContact CG-O 3.38Å; L1973-N1984 HydrophobicContact CD1-CB 3.76Å
1974	D	56.4	Low	45.2	Very low	47 Å²	47	89 Å²	89	25%	0.251	45%	0.447	S	S	.	.	H	α-helix	trans	-62.3	-39	178.4	-71.9	12.7	0	0	0	110.9	Q1970 R1978	Q1970-D1974 PolarHBondContact NE2-OD1 3.17Å; Q1970-D1974 VanDerWaalsContact O-CB 3.29Å; Q1970-D1974 WeakPolarHBondContact O-CB 3.46Å; Q1970-D1974 PolarHBondContact O-N 2.62Å; Q1970-D1974 VanDerWaalsContact O-OD1 3.1Å; D1974-R1978 VanDerWaalsContact O-CB 3.22Å; D1974-R1978 WeakPolarHBondContact O-CB 3.37Å; D1974-R1978 WeakPolarHBondContact O-CG 3.37Å; D1974-R1978 PolarHBondContact O-N 2.97Å
1975	N	47.3	Very low	46	Very low	64 Å²	64	85.1 Å²	85.1	34%	0.342	44%	0.439	S	S	.	.	H	α-helix	trans	-70.7	-34.9	174.5	-75.2	-29	0	0	0	112.1	V1971 V1972 L1973 R1978 Q1979	V1971-N1975 WeakPolarHBondContact O-CB 3.34Å; V1971-N1975 PolarHBondContact O-N 2.97Å; V1971-N1975 PolarHBondContact O-ND2 3.44Å; V1972-N1975 PolarHBondContact O-N 3.1Å; L1973-N1975 VanDerWaalsContact C-N 3.32Å; L1973-N1975 PolarHBondContact O-N 2.77Å; N1975-R1978 PolarHBondContact O-N 3.1Å; N1975-Q1979 VanDerWaalsContact O-CB 3.27Å; N1975-Q1979 WeakPolarHBondContact O-CB 3.36Å; N1975-Q1979 PolarHBondContact O-N 3.35Å
1976	L	43.5	Very low	46.8	Very low	12 Å²	12	83.3 Å²	83.3	6%	0.063	44%	0.437	C	S	.	.	H	α-helix	trans	-70.1	-36.6	174.6	-71.8	161.2	0	0	0	111.9	V1972 L1973 F1980 G1981 Y1982 L1985 L1988	V1972-L1976 HydrophobicContact CG1-CD1 3.58Å; V1972-L1976 HydrophobicContact CG1-CG 4.31Å; V1972-L1976 WeakPolarHBondContact O-CB 3.49Å; V1972-L1976 VanDerWaalsContact O-CD1 3.28Å; V1972-L1976 WeakPolarHBondContact O-CD1 3.23Å; V1972-L1976 WeakPolarHBondContact O-CG 3.35Å; V1972-L1976 PolarHBondContact O-N 2.98Å; L1973-L1976 CarbonylContact O-C 3.45Å; L1973-L1976 WeakPolarHBondContact O-CB 3.45Å; L1973-L1976 PolarHBondContact O-N 2.87Å; L1973-L1976 VanDerWaalsContact O-N 3.15Å; L1976-F1980 HydrophobicContact CD2-CD2 4.28Å; L1976-F1980 CarbonylContact O-C 3.54Å; L1976-F1980 WeakPolarHBondContact O-CA 3.36Å; L1976-F1980 WeakPolarHBondContact O-CB 3.15Å; L1976-F1980 PolarHBondContact O-N 2.89Å; L1976-F1980 VanDerWaalsContact O-N 3.16Å; L1976-G1981 PolarHBondContact O-N 2.7Å; L1976-Y1982 CarbonylContact C-O 3.11Å; L1976-Y1982 PolarHBondContact O-N 2.71Å; L1976-Y1982 VanDerWaalsContact O-N 3.08Å; L1976-L1985 HydrophobicContact CD1-CB 3.64Å; L1976-L1985 HydrophobicContact CD1-CD1 4.01Å; L1976-L1985 HydrophobicContact CD1-CG 4.4Å; L1976-L1985 HydrophobicContact CD2-CD1 3.84Å; L1976-L1988 HydrophobicContact CD2-CB 4.1Å; L1976-L1988 HydrophobicContact CD2-CD2 3.3Å; L1976-L1988 HydrophobicContact CD2-CG 4.31Å
1977	Q	43.4	Very low	47.7	Very low	94 Å²	94	81.2 Å²	81.2	44%	0.439	43%	0.426	S	S	.	.	H	α-helix	trans	-68	-47.2	170	-73.5	-171	-29.3	0	0	111.4	L1973 G1981 Y1982	L1973-Q1977 WeakPolarHBondContact O-CG 3.16Å; L1973-Q1977 PolarHBondContact O-N 2.61Å; Q1977-G1981 VanDerWaalsContact O-CA 3.25Å; Q1977-G1981 WeakPolarHBondContact O-CA 3.36Å; Q1977-G1981 PolarHBondContact O-N 2.88Å; Q1977-Y1982 WeakPolarHBondContact CG-O 3.27Å; Q1977-Y1982 PolarHBondContact N-O 3.24Å
1978	R	46	Very low	48.2	Very low	187 Å²	187	76 Å²	76	71%	0.706	40%	0.402	S	S	*	.	H	α-helix	trans	-67.7	-48.8	-178.9	-76.7	175.6	-179.2	128.2	5.7	114	D1974 N1975	D1974-R1978 VanDerWaalsContact O-CB 3.22Å; D1974-R1978 WeakPolarHBondContact O-CB 3.37Å; D1974-R1978 WeakPolarHBondContact O-CG 3.37Å; D1974-R1978 PolarHBondContact O-N 2.97Å; N1975-R1978 PolarHBondContact O-N 3.1Å
1979	Q	42	Very low	49.3	Very low	139 Å²	139	76.8 Å²	76.8	65%	0.65	40%	0.399	S	S	*	.	H	α-helix	trans	-85.3	-27.3	-174.1	-65.7	-173.7	-18.3	0	0	113.3	N1975	N1975-Q1979 VanDerWaalsContact O-CB 3.27Å; N1975-Q1979 WeakPolarHBondContact O-CB 3.36Å; N1975-Q1979 PolarHBondContact O-N 3.35Å
1980	F	43.2	Very low	50.2	Low	103 Å²	103	74.7 Å²	74.7	45%	0.452	39%	0.394	S	S	.	.	H	α-helix	trans	-132.8	-16.8	-170.8	-56.2	-71.6	0	0	0	114.7	L1976 Y1982 L1988	L1976-F1980 HydrophobicContact CD2-CD2 4.28Å; L1976-F1980 CarbonylContact O-C 3.54Å; L1976-F1980 WeakPolarHBondContact O-CA 3.36Å; L1976-F1980 WeakPolarHBondContact O-CB 3.15Å; L1976-F1980 PolarHBondContact O-N 2.89Å; L1976-F1980 VanDerWaalsContact O-N 3.16Å; F1980-Y1982 VanDerWaalsContact C-CD2 3.48Å; F1980-Y1982 HydrophobicContact CB-CD2 3.52Å; F1980-Y1982 HydrophobicContact CB-CE2 3.82Å; F1980-Y1982 WeakPolarHBondContact O-CD2 3.33Å; F1980-Y1982 WeakPolarHBondContact O-CE2 3.26Å; F1980-L1988 HydrophobicContact CB-CD1 4.07Å; F1980-L1988 HydrophobicContact CB-CD2 4.44Å; F1980-L1988 HydrophobicContact CD2-CD2 3.9Å; F1980-L1988 HydrophobicContact CE2-CD2 4.4Å; F1980-L1988 HydrophobicContact CG-CD1 4.29Å; F1980-L1988 HydrophobicContact CG-CD2 4.16Å
1981	G	49.6	Very low	51.2	Low	57 Å²	57	73.8 Å²	73.8	59%	0.588	39%	0.389	S	S	*	.			trans	82.7	24.1	-179.9	0	0	0	0	0	115.6	L1976 Q1977	L1976-G1981 PolarHBondContact O-N 2.7Å; Q1977-G1981 VanDerWaalsContact O-CA 3.25Å; Q1977-G1981 WeakPolarHBondContact O-CA 3.36Å; Q1977-G1981 PolarHBondContact O-N 2.88Å
1982	Y	43.2	Very low	51.6	Low	55 Å²	55	74.2 Å²	74.2	22%	0.216	38%	0.384	C	S	.	.			trans	-112.7	134.5	-175.8	-63.5	-86.8	0	0	0	113.1	L1976 Q1977 F1980 N1984 D1987 L1988 K1991	L1976-Y1982 CarbonylContact C-O 3.11Å; L1976-Y1982 PolarHBondContact O-N 2.71Å; L1976-Y1982 VanDerWaalsContact O-N 3.08Å; Q1977-Y1982 WeakPolarHBondContact CG-O 3.27Å; Q1977-Y1982 PolarHBondContact N-O 3.24Å; F1980-Y1982 VanDerWaalsContact C-CD2 3.48Å; F1980-Y1982 HydrophobicContact CB-CD2 3.52Å; F1980-Y1982 HydrophobicContact CB-CE2 3.82Å; F1980-Y1982 WeakPolarHBondContact O-CD2 3.33Å; F1980-Y1982 WeakPolarHBondContact O-CE2 3.26Å; Y1982-N1984 VanDerWaalsContact C-N 3.29Å; Y1982-N1984 PolarHBondContact O-N 2.67Å; Y1982-D1987 HydrophobicContact CD1-CB 4.08Å; Y1982-D1987 WeakPolarHBondContact CD1-O 3.32Å; Y1982-L1988 HydrophobicContact CD1-CB 4.41Å; Y1982-L1988 HydrophobicContact CD2-CB 3.94Å; Y1982-L1988 HydrophobicContact CD2-CD1 3.46Å; Y1982-L1988 VanDerWaalsContact CD2-CD1 3.46Å; Y1982-L1988 HydrophobicContact CD2-CG 4.24Å; Y1982-L1988 HydrophobicContact CE2-CD1 3.43Å; Y1982-L1988 VanDerWaalsContact CE2-CD1 3.43Å; Y1982-L1988 HydrophobicContact CG-CB 3.81Å; Y1982-L1988 HydrophobicContact CG-CD1 4.16Å; Y1982-K1991 HydrophobicContact CD1-CB 4.32Å; Y1982-K1991 HydrophobicContact CD1-CD 4.41Å; Y1982-K1991 HydrophobicContact CE1-CB 3.48Å; Y1982-K1991 VanDerWaalsContact CE1-CB 3.48Å; Y1982-K1991 HydrophobicContact CE1-CD 3.76Å; Y1982-K1991 VanDerWaalsContact CE1-CE 3.44Å; Y1982-K1991 HydrophobicContact CE1-CG 4.11Å
1983	T	55.2	Low	52.2	Low	81 Å²	81	72.2 Å²	72.2	50%	0.497	37%	0.373	S	S	.	.	S	Bend	trans	-71.5	-15.4	-174.8	14.6	0	0	0	0	114.9	L1973 D1987	L1973-T1983 VanDerWaalsContact CG-O 3.31Å; L1973-T1983 WeakPolarHBondContact CG-O 3.38Å; T1983-D1987 VanDerWaalsContact CB-OD2 3.28Å; T1983-D1987 WeakPolarHBondContact CB-OD2 3.3Å; T1983-D1987 PolarHBondContact OG1-OD2 3.13Å
1984	N	49.3	Very low	53	Low	53 Å²	53	75.1 Å²	75.1	28%	0.283	39%	0.386	S	S	.	.	S	Bend	trans	-160.4	174.8	166.4	65.9	75.2	0	0	0	110.5	L1973 Y1982 S1986 D1987 L1988	L1973-N1984 HydrophobicContact CD1-CB 3.76Å; Y1982-N1984 VanDerWaalsContact C-N 3.29Å; Y1982-N1984 PolarHBondContact O-N 2.67Å; N1984-S1986 VanDerWaalsContact C-N 3.34Å; N1984-S1986 WeakPolarHBondContact OD1-CA 3.19Å; N1984-S1986 WeakPolarHBondContact OD1-CB 3.22Å; N1984-S1986 PolarHBondContact OD1-N 3.28Å; N1984-D1987 PolarHBondContact N-OD2 3.03Å; N1984-D1987 PolarHBondContact ND2-OD1 3.09Å; N1984-D1987 PolarHBondContact ND2-OD2 3.08Å; N1984-D1987 PolarHBondContact O-N 2.86Å; N1984-D1987 PolarHBondContact OD1-N 3.05Å; N1984-L1988 PolarHBondContact O-N 2.75Å
1985	L	52.8	Low	53.1	Low	87 Å²	87	75.1 Å²	75.1	46%	0.455	39%	0.387	S	S	.	.	H	α-helix	trans	-68.3	-33.8	-178.9	-175.8	58.8	0	0	0	112.5	L1976 L1988 I1989	L1976-L1985 HydrophobicContact CD1-CB 3.64Å; L1976-L1985 HydrophobicContact CD1-CD1 4.01Å; L1976-L1985 HydrophobicContact CD1-CG 4.4Å; L1976-L1985 HydrophobicContact CD2-CD1 3.84Å; L1985-L1988 HydrophobicContact CD1-CD2 4.47Å; L1985-L1988 PolarHBondContact O-N 2.85Å; L1985-I1989 HydrophobicContact CD1-CD1 4.12Å; L1985-I1989 HydrophobicContact CD1-CG1 4.2Å; L1985-I1989 HydrophobicContact CD2-CD1 4.33Å; L1985-I1989 HydrophobicContact CG-CD1 3.82Å; L1985-I1989 HydrophobicContact CG-CG1 4.3Å; L1985-I1989 WeakPolarHBondContact O-CB 3.37Å; L1985-I1989 WeakPolarHBondContact O-CG1 3.37Å; L1985-I1989 PolarHBondContact O-N 3.39Å
1986	S	53.7	Low	53.1	Low	74 Å²	74	77.3 Å²	77.3	52%	0.517	39%	0.391	S	S	.	.	H	α-helix	trans	-62.2	-43.7	173.1	-154.9	0	0	0	0	110.3	N1984 L1988 I1989 V1990	N1984-S1986 VanDerWaalsContact C-N 3.34Å; N1984-S1986 WeakPolarHBondContact OD1-CA 3.19Å; N1984-S1986 WeakPolarHBondContact OD1-CB 3.22Å; N1984-S1986 PolarHBondContact OD1-N 3.28Å; S1986-L1988 VanDerWaalsContact C-N 3.31Å; S1986-L1988 PolarHBondContact O-N 2.79Å; S1986-I1989 PolarHBondContact O-N 2.73Å; S1986-I1989 VanDerWaalsContact O-N 3.16Å; S1986-V1990 VanDerWaalsContact O-CB 3.22Å; S1986-V1990 WeakPolarHBondContact O-CB 3.24Å; S1986-V1990 VanDerWaalsContact O-CG2 3.24Å; S1986-V1990 WeakPolarHBondContact O-CG2 3.34Å; S1986-V1990 PolarHBondContact O-N 2.67Å
1987	D	56.7	Low	54	Low	43 Å²	43	78.9 Å²	78.9	23%	0.23	40%	0.399	C	S	.	.	H	α-helix	trans	-60.7	-37.5	176.3	-63.9	-8.7	0	0	0	112.8	Y1982 T1983 N1984 K1991	Y1982-D1987 HydrophobicContact CD1-CB 4.08Å; Y1982-D1987 WeakPolarHBondContact CD1-O 3.32Å; T1983-D1987 VanDerWaalsContact CB-OD2 3.28Å; T1983-D1987 WeakPolarHBondContact CB-OD2 3.3Å; T1983-D1987 PolarHBondContact OG1-OD2 3.13Å; N1984-D1987 PolarHBondContact N-OD2 3.03Å; N1984-D1987 PolarHBondContact ND2-OD1 3.09Å; N1984-D1987 PolarHBondContact ND2-OD2 3.08Å; N1984-D1987 PolarHBondContact O-N 2.86Å; N1984-D1987 PolarHBondContact OD1-N 3.05Å; D1987-K1991 VanDerWaalsContact O-CB 3.28Å; D1987-K1991 WeakPolarHBondContact O-CB 3.41Å; D1987-K1991 PolarHBondContact O-N 2.78Å
1988	L	53	Low	54.6	Low	10 Å²	10	81.6 Å²	81.6	5%	0.052	41%	0.41	C	S	.	.	H	α-helix	trans	-69.9	-44.8	174.2	173.7	63.1	0	0	0	111.1	L1976 F1980 Y1982 N1984 L1985 S1986 K1992	L1976-L1988 HydrophobicContact CD2-CB 4.1Å; L1976-L1988 HydrophobicContact CD2-CD2 3.3Å; L1976-L1988 HydrophobicContact CD2-CG 4.31Å; F1980-L1988 HydrophobicContact CB-CD1 4.07Å; F1980-L1988 HydrophobicContact CB-CD2 4.44Å; F1980-L1988 HydrophobicContact CD2-CD2 3.9Å; F1980-L1988 HydrophobicContact CE2-CD2 4.4Å; F1980-L1988 HydrophobicContact CG-CD1 4.29Å; F1980-L1988 HydrophobicContact CG-CD2 4.16Å; Y1982-L1988 HydrophobicContact CD1-CB 4.41Å; Y1982-L1988 HydrophobicContact CD2-CB 3.94Å; Y1982-L1988 HydrophobicContact CD2-CD1 3.46Å; Y1982-L1988 VanDerWaalsContact CD2-CD1 3.46Å; Y1982-L1988 HydrophobicContact CD2-CG 4.24Å; Y1982-L1988 HydrophobicContact CE2-CD1 3.43Å; Y1982-L1988 VanDerWaalsContact CE2-CD1 3.43Å; Y1982-L1988 HydrophobicContact CG-CB 3.81Å; Y1982-L1988 HydrophobicContact CG-CD1 4.16Å; N1984-L1988 PolarHBondContact O-N 2.75Å; L1985-L1988 HydrophobicContact CD1-CD2 4.47Å; L1985-L1988 PolarHBondContact O-N 2.85Å; S1986-L1988 VanDerWaalsContact C-N 3.31Å; S1986-L1988 PolarHBondContact O-N 2.79Å; L1988-K1992 HydrophobicContact CD1-CD 3.97Å; L1988-K1992 HydrophobicContact CD1-CG 4.03Å; L1988-K1992 HydrophobicContact CG-CD 4.2Å; L1988-K1992 VanDerWaalsContact O-CB 3.27Å; L1988-K1992 WeakPolarHBondContact O-CB 3.37Å; L1988-K1992 WeakPolarHBondContact O-CG 3.45Å; L1988-K1992 PolarHBondContact O-N 2.86Å
1989	I	59.7	Low	54.6	Low	99 Å²	99	75.4 Å²	75.4	51%	0.508	39%	0.388	S	S	.	.	H	α-helix	trans	-65.8	-48.8	-179.5	-71	174.4	0	0	0	109.6	L1985 S1986 K1991 K1992 S1993	L1985-I1989 HydrophobicContact CD1-CD1 4.12Å; L1985-I1989 HydrophobicContact CD1-CG1 4.2Å; L1985-I1989 HydrophobicContact CD2-CD1 4.33Å; L1985-I1989 HydrophobicContact CG-CD1 3.82Å; L1985-I1989 HydrophobicContact CG-CG1 4.3Å; L1985-I1989 WeakPolarHBondContact O-CB 3.37Å; L1985-I1989 WeakPolarHBondContact O-CG1 3.37Å; L1985-I1989 PolarHBondContact O-N 3.39Å; S1986-I1989 PolarHBondContact O-N 2.73Å; S1986-I1989 VanDerWaalsContact O-N 3.16Å; I1989-K1991 PolarHBondContact O-N 2.85Å; I1989-K1992 CarbonylContact O-C 3.52Å; I1989-K1992 PolarHBondContact O-N 2.82Å; I1989-S1993 VanDerWaalsContact O-CB 3.3Å; I1989-S1993 WeakPolarHBondContact O-CB 3.42Å; I1989-S1993 PolarHBondContact O-N 3.02Å
1990	V	62.6	Low	54.6	Low	69 Å²	69	75.2 Å²	75.2	42%	0.418	39%	0.385	S	S	.	.	H	α-helix	trans	-59.8	-42.6	175.5	171.9	0	0	0	0	111.3	S1986 S1993 E1994	S1986-V1990 VanDerWaalsContact O-CB 3.22Å; S1986-V1990 WeakPolarHBondContact O-CB 3.24Å; S1986-V1990 VanDerWaalsContact O-CG2 3.24Å; S1986-V1990 WeakPolarHBondContact O-CG2 3.34Å; S1986-V1990 PolarHBondContact O-N 2.67Å; V1990-S1993 CarbonylContact O-C 3.57Å; V1990-S1993 WeakPolarHBondContact O-CA 3.31Å; V1990-S1993 VanDerWaalsContact O-CB 3.31Å; V1990-S1993 WeakPolarHBondContact O-CB 3.5Å; V1990-S1993 PolarHBondContact O-N 2.88Å; V1990-S1993 PolarHBondContact O-OG 3.08Å; V1990-E1994 WeakPolarHBondContact O-CG 3.42Å; V1990-E1994 PolarHBondContact O-N 3.26Å
1991	K	67.2	Low	55.5	Low	79 Å²	79	72.5 Å²	72.5	34%	0.343	39%	0.387	S	S	.	.	H	α-helix	trans	-81.7	-16.8	177.4	-74.7	-173.5	-91	167.7	0	114.8	Y1982 D1987 I1989 V1995	Y1982-K1991 HydrophobicContact CD1-CB 4.32Å; Y1982-K1991 HydrophobicContact CD1-CD 4.41Å; Y1982-K1991 HydrophobicContact CE1-CB 3.48Å; Y1982-K1991 VanDerWaalsContact CE1-CB 3.48Å; Y1982-K1991 HydrophobicContact CE1-CD 3.76Å; Y1982-K1991 VanDerWaalsContact CE1-CE 3.44Å; Y1982-K1991 HydrophobicContact CE1-CG 4.11Å; D1987-K1991 VanDerWaalsContact O-CB 3.28Å; D1987-K1991 WeakPolarHBondContact O-CB 3.41Å; D1987-K1991 PolarHBondContact O-N 2.78Å; I1989-K1991 PolarHBondContact O-N 2.85Å; K1991-V1995 VanDerWaalsContact O-CG2 3.26Å; K1991-V1995 WeakPolarHBondContact O-CG2 3.41Å; K1991-V1995 PolarHBondContact O-N 3.42Å
1992	K	61.5	Low	56.6	Low	88 Å²	88	72.4 Å²	72.4	38%	0.383	37%	0.372	S	S	.	.	H	α-helix	trans	-74.1	-35	160	-83.4	-179.6	168.8	172.7	0	111.2	L1988 I1989 V1995 W1996	L1988-K1992 HydrophobicContact CD1-CD 3.97Å; L1988-K1992 HydrophobicContact CD1-CG 4.03Å; L1988-K1992 HydrophobicContact CG-CD 4.2Å; L1988-K1992 VanDerWaalsContact O-CB 3.27Å; L1988-K1992 WeakPolarHBondContact O-CB 3.37Å; L1988-K1992 WeakPolarHBondContact O-CG 3.45Å; L1988-K1992 PolarHBondContact O-N 2.86Å; I1989-K1992 CarbonylContact O-C 3.52Å; I1989-K1992 PolarHBondContact O-N 2.82Å; K1992-V1995 WeakPolarHBondContact O-CB 3.49Å; K1992-V1995 PolarHBondContact O-N 3.24Å; K1992-W1996 PolarHBondContact O-N 3.28Å
1993	S	59.6	Low	57.8	Low	29 Å²	29	73.3 Å²	73.3	20%	0.203	38%	0.378	C	S	.	.	H	α-helix	trans	-63.3	-56.7	172.7	128	0	0	0	0	109.1	I1989 V1990 V1995 W1996 D1997 S2004	I1989-S1993 VanDerWaalsContact O-CB 3.3Å; I1989-S1993 WeakPolarHBondContact O-CB 3.42Å; I1989-S1993 PolarHBondContact O-N 3.02Å; V1990-S1993 CarbonylContact O-C 3.57Å; V1990-S1993 WeakPolarHBondContact O-CA 3.31Å; V1990-S1993 VanDerWaalsContact O-CB 3.31Å; V1990-S1993 WeakPolarHBondContact O-CB 3.5Å; V1990-S1993 PolarHBondContact O-N 2.88Å; V1990-S1993 PolarHBondContact O-OG 3.08Å; S1993-V1995 CarbonylContact O-C 3.42Å; S1993-V1995 PolarHBondContact O-N 3.45Å; S1993-W1996 CarbonylContact O-C 3.47Å; S1993-W1996 WeakPolarHBondContact O-CA 3.46Å; S1993-W1996 PolarHBondContact O-N 3.1Å; S1993-D1997 VanDerWaalsContact O-CB 3.27Å; S1993-D1997 WeakPolarHBondContact O-CB 3.49Å; S1993-D1997 PolarHBondContact O-N 3.11Å; S1993-D1997 PolarHBondContact OG-OD2 3.36Å; S1993-S2004 WeakPolarHBondContact CA-OG 3.48Å; S1993-S2004 VanDerWaalsContact CB-CB 3.5Å; S1993-S2004 VanDerWaalsContact CB-OG 3.29Å; S1993-S2004 WeakPolarHBondContact CB-OG 3.24Å; S1993-S2004 PolarHBondContact O-OG 2.8Å
1994	E	66.3	Low	58.3	Low	107 Å²	107	70 Å²	70	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-49.7	-25.9	171.2	-73.1	178.4	-159.2	0	0	113.7	V1990 K1998	V1990-E1994 WeakPolarHBondContact O-CG 3.42Å; V1990-E1994 PolarHBondContact O-N 3.26Å; E1994-K1998 WeakPolarHBondContact O-CB 3.42Å; E1994-K1998 PolarHBondContact O-N 3.08Å
1995	V	59	Low	59.6	Low	47 Å²	47	72.7 Å²	72.7	29%	0.285	37%	0.369	S	S	.	.	H	α-helix	trans	-81.1	-47.2	173.2	164.3	0	0	0	0	111.1	K1991 K1992 S1993 K1998 F1999	K1991-V1995 VanDerWaalsContact O-CG2 3.26Å; K1991-V1995 WeakPolarHBondContact O-CG2 3.41Å; K1991-V1995 PolarHBondContact O-N 3.42Å; K1992-V1995 WeakPolarHBondContact O-CB 3.49Å; K1992-V1995 PolarHBondContact O-N 3.24Å; S1993-V1995 CarbonylContact O-C 3.42Å; S1993-V1995 PolarHBondContact O-N 3.45Å; V1995-K1998 PolarHBondContact O-N 2.89Å; V1995-F1999 HydrophobicContact CG1-CD2 3.83Å; V1995-F1999 HydrophobicContact CG1-CE2 4.02Å; V1995-F1999 VanDerWaalsContact O-CD2 3.25Å; V1995-F1999 WeakPolarHBondContact O-CD2 3.48Å; V1995-F1999 PolarHBondContact O-N 2.75Å
1996	W	47	Very low	60.7	Low	111 Å²	111	75.1 Å²	75.1	42%	0.42	37%	0.372	S	S	.	.	H	α-helix	trans	-65.4	-46.5	175.4	-61.4	-22.5	0	0	0	112.2	K1992 S1993 K1998 F1999 F2000 F2003	K1992-W1996 PolarHBondContact O-N 3.28Å; S1993-W1996 CarbonylContact O-C 3.47Å; S1993-W1996 WeakPolarHBondContact O-CA 3.46Å; S1993-W1996 PolarHBondContact O-N 3.1Å; W1996-K1998 PolarHBondContact O-N 3.38Å; W1996-K1998 VanDerWaalsContact O-N 3.09Å; W1996-F1999 PolarHBondContact O-N 2.88Å; W1996-F2000 HydrophobicContact CB-CD2 4.24Å; W1996-F2000 PolarHBondContact O-N 3.4Å; W1996-F2003 HydrophobicContact CB-CD1 3.73Å; W1996-F2003 HydrophobicContact CB-CE1 4.4Å; W1996-F2003 HydrophobicContact CD2-CD1 4.44Å; W1996-F2003 HydrophobicContact CD2-CE1 4.28Å; W1996-F2003 HydrophobicContact CE3-CD1 4.27Å; W1996-F2003 HydrophobicContact CE3-CE1 4.01Å; W1996-F2003 HydrophobicContact CG-CD1 4.29Å; W1996-F2003 HydrophobicContact CG-CE1 4.49Å
1997	D	63.7	Low	61.9	Low	45 Å²	45	75.1 Å²	75.1	24%	0.241	36%	0.363	C	S	.	.	H	α-helix	trans	-56.9	-20.2	172.1	-68.9	-54	0	0	0	113.4	S1993 G2001 N2002 F2003 S2004 E2005	S1993-D1997 VanDerWaalsContact O-CB 3.27Å; S1993-D1997 WeakPolarHBondContact O-CB 3.49Å; S1993-D1997 PolarHBondContact O-N 3.11Å; S1993-D1997 PolarHBondContact OG-OD2 3.36Å; D1997-G2001 CarbonylContact C-O 3.29Å; D1997-G2001 WeakPolarHBondContact CA-O 3.35Å; D1997-G2001 CarbonylContact O-C 3.51Å; D1997-N2002 VanDerWaalsContact OD1-C 3.25Å; D1997-F2003 PolarHBondContact OD1-N 2.82Å; D1997-S2004 WeakPolarHBondContact OD1-CA 3.43Å; D1997-S2004 WeakPolarHBondContact OD1-CB 3.41Å; D1997-S2004 PolarHBondContact OD1-N 2.96Å; D1997-S2004 PolarHBondContact OD1-OG 2.84Å; D1997-S2004 WeakPolarHBondContact OD2-CB 3.29Å; D1997-S2004 PolarHBondContact OD2-OG 3.11Å; D1997-E2005 PolarHBondContact OD1-N 3.34Å
1998	K	55.3	Low	62.9	Low	151 Å²	151	76.5 Å²	76.5	66%	0.657	37%	0.372	S	S	*	.	H	α-helix	trans	-101.9	-15.1	178.8	-173.6	167	-170.2	157.1	0	113.8	E1994 V1995 W1996	E1994-K1998 WeakPolarHBondContact O-CB 3.42Å; E1994-K1998 PolarHBondContact O-N 3.08Å; V1995-K1998 PolarHBondContact O-N 2.89Å; W1996-K1998 PolarHBondContact O-N 3.38Å; W1996-K1998 VanDerWaalsContact O-N 3.09Å
1999	F	45.8	Very low	64.2	Low	56 Å²	56	80.4 Å²	80.4	25%	0.246	39%	0.39	C	S	.	.	H	α-helix	trans	-101.8	-28.6	175.7	-87.4	-65	0	0	0	113.7	T1246 I1286 V1995 W1996	T1246-F1999 HydrophobicContact CG2-CZ 3.99Å; I1286-F1999 HydrophobicContact CD1-CE1 3.88Å; I1286-F1999 HydrophobicContact CD1-CZ 4.1Å; V1995-F1999 HydrophobicContact CG1-CD2 3.83Å; V1995-F1999 HydrophobicContact CG1-CE2 4.02Å; V1995-F1999 VanDerWaalsContact O-CD2 3.25Å; V1995-F1999 WeakPolarHBondContact O-CD2 3.48Å; V1995-F1999 PolarHBondContact O-N 2.75Å; W1996-F1999 PolarHBondContact O-N 2.88Å
2000	F	41.4	Very low	65.3	Low	135 Å²	135	78.6 Å²	78.6	59%	0.592	38%	0.382	S	S	*	.	S	Bend	trans	-122.8	16.9	-167.3	-61.8	-64.2	0	0	0	114.1	W1996 F2003	W1996-F2000 HydrophobicContact CB-CD2 4.24Å; W1996-F2000 PolarHBondContact O-N 3.4Å; F2000-F2003 HydrophobicContact CB-CB 3.48Å; F2000-F2003 VanDerWaalsContact CB-CB 3.48Å; F2000-F2003 HydrophobicContact CB-CD2 4.23Å; F2000-F2003 HydrophobicContact CB-CG 3.99Å; F2000-F2003 HydrophobicContact CD2-CB 4.44Å; F2000-F2003 HydrophobicContact CD2-CG 4.26Å; F2000-F2003 HydrophobicContact CG-CB 4.39Å; F2000-F2003 HydrophobicContact CG-CG 4.45Å
2001	G	62.7	Low	66.1	Low	47 Å²	47	77.1 Å²	77.1	49%	0.485	37%	0.371	S	S	.	.	S	Bend	trans	71.3	-160.5	-160.2	0	0	0	0	0	109.7	D1997 F2003	D1997-G2001 CarbonylContact C-O 3.29Å; D1997-G2001 WeakPolarHBondContact CA-O 3.35Å; D1997-G2001 CarbonylContact O-C 3.51Å; G2001-F2003 PolarHBondContact O-N 2.96Å
2002	N	72.7	Confident	66.6	Low	54 Å²	54	77.6 Å²	77.6	29%	0.289	38%	0.377	S	S	.	.	S	Bend	trans	-70.1	51.6	-179.4	72.1	-42	0	0	0	113.6	D1997 S2004 E2005 R2006	D1997-N2002 VanDerWaalsContact OD1-C 3.25Å; N2002-S2004 PolarHBondContact O-N 3.36Å; N2002-E2005 HydrophobicContact CB-CB 4.09Å; N2002-E2005 WeakPolarHBondContact CB-OE2 3.4Å; N2002-E2005 PolarHBondContact ND2-OE2 3.33Å; N2002-E2005 PolarHBondContact O-N 3.41Å; N2002-R2006 WeakPolarHBondContact O-CB 3.47Å; N2002-R2006 WeakPolarHBondContact O-CG 3.34Å; N2002-R2006 PolarHBondContact O-N 3.3Å; N2002-R2006 PolarHBondContact OD1-NE 2.95Å; N2002-R2006 PolarHBondContact OD1-NH2 2.87Å
2003	F	68.4	Low	67.7	Low	75 Å²	75	75.7 Å²	75.7	33%	0.329	37%	0.371	S	S	.	.	H	α-helix	trans	-67.2	-32.8	-171.5	170.1	-84	0	0	0	113.4	W1996 D1997 F2000 G2001 R2006 F2007	W1996-F2003 HydrophobicContact CB-CD1 3.73Å; W1996-F2003 HydrophobicContact CB-CE1 4.4Å; W1996-F2003 HydrophobicContact CD2-CD1 4.44Å; W1996-F2003 HydrophobicContact CD2-CE1 4.28Å; W1996-F2003 HydrophobicContact CE3-CD1 4.27Å; W1996-F2003 HydrophobicContact CE3-CE1 4.01Å; W1996-F2003 HydrophobicContact CG-CD1 4.29Å; W1996-F2003 HydrophobicContact CG-CE1 4.49Å; D1997-F2003 PolarHBondContact OD1-N 2.82Å; F2000-F2003 HydrophobicContact CB-CB 3.48Å; F2000-F2003 VanDerWaalsContact CB-CB 3.48Å; F2000-F2003 HydrophobicContact CB-CD2 4.23Å; F2000-F2003 HydrophobicContact CB-CG 3.99Å; F2000-F2003 HydrophobicContact CD2-CB 4.44Å; F2000-F2003 HydrophobicContact CD2-CG 4.26Å; F2000-F2003 HydrophobicContact CG-CB 4.39Å; F2000-F2003 HydrophobicContact CG-CG 4.45Å; G2001-F2003 PolarHBondContact O-N 2.96Å; F2003-R2006 CarbonylContact O-C 3.57Å; F2003-F2007 HydrophobicContact CD1-CB 4.36Å; F2003-F2007 HydrophobicContact CE1-CB 4.02Å; F2003-F2007 HydrophobicContact CE1-CG 4.25Å; F2003-F2007 HydrophobicContact CZ-CB 4.27Å; F2003-F2007 HydrophobicContact CZ-CD2 4.09Å; F2003-F2007 HydrophobicContact CZ-CG 4.29Å; F2003-F2007 WeakPolarHBondContact O-CA 3.29Å; F2003-F2007 WeakPolarHBondContact O-CB 3.41Å; F2003-F2007 PolarHBondContact O-N 3.49Å
2004	S	65.8	Low	68.9	Low	11 Å²	11	75.8 Å²	75.8	8%	0.077	37%	0.368	C	S	.	.	H	α-helix	trans	-81.7	-35.5	179	-29.3	0	0	0	0	111	S1993 D1997 N2002 R2006 F2007 V2008	S1993-S2004 WeakPolarHBondContact CA-OG 3.48Å; S1993-S2004 VanDerWaalsContact CB-CB 3.5Å; S1993-S2004 VanDerWaalsContact CB-OG 3.29Å; S1993-S2004 WeakPolarHBondContact CB-OG 3.24Å; S1993-S2004 PolarHBondContact O-OG 2.8Å; D1997-S2004 WeakPolarHBondContact OD1-CA 3.43Å; D1997-S2004 WeakPolarHBondContact OD1-CB 3.41Å; D1997-S2004 PolarHBondContact OD1-N 2.96Å; D1997-S2004 PolarHBondContact OD1-OG 2.84Å; D1997-S2004 WeakPolarHBondContact OD2-CB 3.29Å; D1997-S2004 PolarHBondContact OD2-OG 3.11Å; N2002-S2004 PolarHBondContact O-N 3.36Å; S2004-R2006 VanDerWaalsContact C-N 3.35Å; S2004-F2007 PolarHBondContact O-N 3.44Å; S2004-V2008 WeakPolarHBondContact O-CB 3.24Å; S2004-V2008 WeakPolarHBondContact O-CG2 3.34Å; S2004-V2008 PolarHBondContact O-N 3.44Å
2005	E	76	Confident	69.7	Low	110 Å²	110	77.5 Å²	77.5	51%	0.514	37%	0.374	S	S	.	.	H	α-helix	trans	-56.3	-51.9	167	-168.8	173.4	-122.5	0	0	109.3	D1997 N2002 F2007 V2008 E2009	D1997-E2005 PolarHBondContact OD1-N 3.34Å; N2002-E2005 HydrophobicContact CB-CB 4.09Å; N2002-E2005 WeakPolarHBondContact CB-OE2 3.4Å; N2002-E2005 PolarHBondContact ND2-OE2 3.33Å; N2002-E2005 PolarHBondContact O-N 3.41Å; E2005-F2007 PolarHBondContact O-N 2.59Å; E2005-V2008 CarbonylContact O-C 3.59Å; E2005-V2008 PolarHBondContact O-N 2.86Å; E2005-E2009 WeakPolarHBondContact O-CB 2.89Å; E2005-E2009 WeakPolarHBondContact O-CG 3.2Å; E2005-E2009 PolarHBondContact O-N 2.86Å
2006	R	76.9	Confident	71	Confident	138 Å²	138	78.6 Å²	78.6	52%	0.521	38%	0.38	S	S	.	.	H	α-helix	trans	-65.2	-33.1	172.4	-72.8	-173.6	-156.2	-148.9	-0.4	115	N2002 F2003 S2004 V2008 E2009 D2010	N2002-R2006 WeakPolarHBondContact O-CB 3.47Å; N2002-R2006 WeakPolarHBondContact O-CG 3.34Å; N2002-R2006 PolarHBondContact O-N 3.3Å; N2002-R2006 PolarHBondContact OD1-NE 2.95Å; N2002-R2006 PolarHBondContact OD1-NH2 2.87Å; F2003-R2006 CarbonylContact O-C 3.57Å; S2004-R2006 VanDerWaalsContact C-N 3.35Å; R2006-V2008 VanDerWaalsContact C-N 3.27Å; R2006-E2009 PolarHBondContact O-N 3.04Å; R2006-D2010 WeakPolarHBondContact CB-OD2 3.42Å; R2006-D2010 VanDerWaalsContact O-CA 3.3Å; R2006-D2010 WeakPolarHBondContact O-CA 3.48Å; R2006-D2010 WeakPolarHBondContact O-CB 3.32Å; R2006-D2010 PolarHBondContact O-N 2.97Å
2007	F	77.6	Confident	72.7	Confident	74 Å²	74	73.3 Å²	73.3	33%	0.325	36%	0.36	S	S	.	.	H	α-helix	trans	-73.9	-28.8	179	-172.3	-108.3	0	0	0	110	F2003 S2004 E2005 I2011 L2012	F2003-F2007 HydrophobicContact CD1-CB 4.36Å; F2003-F2007 HydrophobicContact CE1-CB 4.02Å; F2003-F2007 HydrophobicContact CE1-CG 4.25Å; F2003-F2007 HydrophobicContact CZ-CB 4.27Å; F2003-F2007 HydrophobicContact CZ-CD2 4.09Å; F2003-F2007 HydrophobicContact CZ-CG 4.29Å; F2003-F2007 WeakPolarHBondContact O-CA 3.29Å; F2003-F2007 WeakPolarHBondContact O-CB 3.41Å; F2003-F2007 PolarHBondContact O-N 3.49Å; S2004-F2007 PolarHBondContact O-N 3.44Å; E2005-F2007 PolarHBondContact O-N 2.59Å; F2007-I2011 HydrophobicContact CD2-CB 4.1Å; F2007-I2011 HydrophobicContact CD2-CG1 3.74Å; F2007-I2011 HydrophobicContact CE2-CB 4.12Å; F2007-I2011 HydrophobicContact CE2-CG1 3.93Å; F2007-I2011 HydrophobicContact CE2-CG2 4.18Å; F2007-I2011 HydrophobicContact CZ-CG2 4.5Å; F2007-I2011 CarbonylContact O-C 3.58Å; F2007-I2011 WeakPolarHBondContact O-CA 3.29Å; F2007-I2011 VanDerWaalsContact O-CB 3.28Å; F2007-I2011 WeakPolarHBondContact O-CB 3.44Å; F2007-I2011 PolarHBondContact O-N 2.77Å; F2007-L2012 HydrophobicContact CD1-CD1 3.66Å; F2007-L2012 HydrophobicContact CD1-CG 3.89Å; F2007-L2012 HydrophobicContact CE1-CD1 3.66Å; F2007-L2012 HydrophobicContact CE1-CD2 3.92Å; F2007-L2012 HydrophobicContact CE1-CG 3.79Å; F2007-L2012 HydrophobicContact CZ-CD2 4.32Å; F2007-L2012 WeakPolarHBondContact O-CG 3.3Å; F2007-L2012 PolarHBondContact O-N 2.9Å
2008	V	78.4	Confident	73.7	Confident	71 Å²	71	74 Å²	74	43%	0.43	37%	0.366	S	S	.	.	I	π-helix	trans	-69	-62.4	163.8	174.8	0	0	0	0	110.1	S2004 E2005 R2006 D2010 I2011 L2012 D2013	S2004-V2008 WeakPolarHBondContact O-CB 3.24Å; S2004-V2008 WeakPolarHBondContact O-CG2 3.34Å; S2004-V2008 PolarHBondContact O-N 3.44Å; E2005-V2008 CarbonylContact O-C 3.59Å; E2005-V2008 PolarHBondContact O-N 2.86Å; R2006-V2008 VanDerWaalsContact C-N 3.27Å; V2008-D2010 PolarHBondContact O-N 2.89Å; V2008-I2011 PolarHBondContact O-N 3.49Å; V2008-L2012 HydrophobicContact CG2-CD1 4.4Å; V2008-L2012 CarbonylContact O-C 3.58Å; V2008-L2012 PolarHBondContact O-N 3.21Å; V2008-D2013 HydrophobicContact CG1-CB 4.1Å; V2008-D2013 PolarHBondContact O-N 2.82Å
2009	E	80.7	Confident	75	Confident	92 Å²	92	69.5 Å²	69.5	43%	0.43	35%	0.352	S	S	.	.	I	π-helix	trans	-63	-38.5	-173.4	-70.1	-175.3	146.9	0	0	114.5	E2005 R2006 T2016 C2017	E2005-E2009 WeakPolarHBondContact O-CB 2.89Å; E2005-E2009 WeakPolarHBondContact O-CG 3.2Å; E2005-E2009 PolarHBondContact O-N 2.86Å; R2006-E2009 PolarHBondContact O-N 3.04Å; E2009-T2016 WeakPolarHBondContact CA-OG1 3.49Å; E2009-T2016 CarbonylContact O-C 3.56Å; E2009-T2016 WeakPolarHBondContact O-CB 3.3Å; E2009-T2016 PolarHBondContact O-OG1 3.16Å; E2009-T2016 VanDerWaalsContact O-OG1 3.11Å; E2009-C2017 WeakPolarHBondContact O-CA 3.25Å; E2009-C2017 PolarHBondContact O-N 2.84Å
2010	D	83.3	Confident	76.6	Confident	62 Å²	62	69.6 Å²	69.6	33%	0.332	36%	0.363	S	S	.	.	I	π-helix	trans	-88.9	-24.4	-179.9	-62.8	-41.6	0	0	0	112.7	R2006 V2008 C2017 V2018 A2021	R2006-D2010 WeakPolarHBondContact CB-OD2 3.42Å; R2006-D2010 VanDerWaalsContact O-CA 3.3Å; R2006-D2010 WeakPolarHBondContact O-CA 3.48Å; R2006-D2010 WeakPolarHBondContact O-CB 3.32Å; R2006-D2010 PolarHBondContact O-N 2.97Å; V2008-D2010 PolarHBondContact O-N 2.89Å; D2010-C2017 CarbonylContact O-C 3.51Å; D2010-C2017 VanDerWaalsContact O-CA 3.29Å; D2010-C2017 WeakPolarHBondContact O-CA 3.36Å; D2010-C2017 VanDerWaalsContact O-CB 3.23Å; D2010-C2017 WeakPolarHBondContact O-CB 3.48Å; D2010-V2018 HydrophobicContact CB-CG1 4.03Å; D2010-V2018 PolarHBondContact O-N 3.45Å; D2010-A2021 WeakPolarHBondContact O-CB 3.43Å
2011	I	78.1	Confident	78.4	Confident	38 Å²	38	63.3 Å²	63.3	20%	0.195	34%	0.336	C	S	.	.	I	π-helix	trans	-127.9	-53.7	-173.3	-44.2	-69	0	0	0	114.5	F2007 V2008 A2021 Y2025 W2026	F2007-I2011 HydrophobicContact CD2-CB 4.1Å; F2007-I2011 HydrophobicContact CD2-CG1 3.74Å; F2007-I2011 HydrophobicContact CE2-CB 4.12Å; F2007-I2011 HydrophobicContact CE2-CG1 3.93Å; F2007-I2011 HydrophobicContact CE2-CG2 4.18Å; F2007-I2011 HydrophobicContact CZ-CG2 4.5Å; F2007-I2011 CarbonylContact O-C 3.58Å; F2007-I2011 WeakPolarHBondContact O-CA 3.29Å; F2007-I2011 VanDerWaalsContact O-CB 3.28Å; F2007-I2011 WeakPolarHBondContact O-CB 3.44Å; F2007-I2011 PolarHBondContact O-N 2.77Å; V2008-I2011 PolarHBondContact O-N 3.49Å; I2011-A2021 HydrophobicContact CD1-CB 3.89Å; I2011-A2021 HydrophobicContact CG2-CB 4.29Å; I2011-Y2025 HydrophobicContact CG2-CD2 4.21Å; I2011-Y2025 HydrophobicContact CG2-CE2 4.33Å; I2011-W2026 PolarHBondContact O-NE1 2.94Å
2012	L	78.8	Confident	79.5	Confident	89 Å²	89	61 Å²	61	47%	0.466	31%	0.313	S	S	.	.	I	π-helix	trans	-91.7	-18.2	-167.6	-54.7	177.3	0	0	0	116.3	F2007 V2008 W2026	F2007-L2012 HydrophobicContact CD1-CD1 3.66Å; F2007-L2012 HydrophobicContact CD1-CG 3.89Å; F2007-L2012 HydrophobicContact CE1-CD1 3.66Å; F2007-L2012 HydrophobicContact CE1-CD2 3.92Å; F2007-L2012 HydrophobicContact CE1-CG 3.79Å; F2007-L2012 HydrophobicContact CZ-CD2 4.32Å; F2007-L2012 WeakPolarHBondContact O-CG 3.3Å; F2007-L2012 PolarHBondContact O-N 2.9Å; V2008-L2012 HydrophobicContact CG2-CD1 4.4Å; V2008-L2012 CarbonylContact O-C 3.58Å; V2008-L2012 PolarHBondContact O-N 3.21Å; L2012-W2026 WeakPolarHBondContact O-CZ2 3.11Å
2013	D	83.7	Confident	79.9	Confident	47 Å²	47	61 Å²	61	25%	0.251	31%	0.312	S	S	.	.			trans	-97.7	103.5	168.6	173.6	22.8	0	0	0	109	V2008 K2015 T2016 C2017	V2008-D2013 HydrophobicContact CG1-CB 4.1Å; V2008-D2013 PolarHBondContact O-N 2.82Å; D2013-K2015 PolarHBondContact O-N 2.85Å; D2013-K2015 VanDerWaalsContact OD1-CB 3.32Å; D2013-K2015 WeakPolarHBondContact OD1-CB 3.29Å; D2013-K2015 WeakPolarHBondContact OD1-CG 3.34Å; D2013-K2015 PolarHBondContact OD1-N 3.29Å; D2013-T2016 WeakPolarHBondContact CB-OG1 3.4Å; D2013-T2016 PolarHBondContact O-N 2.89Å; D2013-T2016 PolarHBondContact O-OG1 3.46Å; D2013-T2016 PolarHBondContact OD2-OG1 3Å; D2013-C2017 VanDerWaalsContact O-CB 3.3Å; D2013-C2017 WeakPolarHBondContact O-CB 3.19Å; D2013-C2017 PolarHBondContact O-N 2.9Å
2014	F	85.1	Confident	80.4	Confident	32 Å²	32	64.7 Å²	64.7	14%	0.14	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.8	179.5	71.9	-96.9	0	0	0	113.3	L2022 W2026 R2052 I2055 A2056	F2014-L2022 HydrophobicContact CB-CD1 4.23Å; F2014-L2022 WeakPolarHBondContact O-CD1 3.46Å; F2014-W2026 HydrophobicContact CB-CB 4.36Å; F2014-W2026 HydrophobicContact CB-CD2 3.69Å; F2014-W2026 HydrophobicContact CB-CE3 4.21Å; F2014-W2026 HydrophobicContact CB-CG 3.69Å; F2014-W2026 HydrophobicContact CD1-CE3 4.38Å; F2014-W2026 HydrophobicContact CD1-CZ3 4.4Å; F2014-R2052 WeakPolarHBondContact O-CD 3.32Å; F2014-R2052 VanDerWaalsContact O-CG 3.25Å; F2014-R2052 WeakPolarHBondContact O-CG 3.19Å; F2014-R2052 PolarHBondContact O-NH1 3.15Å; F2014-I2055 HydrophobicContact CB-CG2 3.95Å; F2014-I2055 HydrophobicContact CD1-CG2 4.08Å; F2014-I2055 HydrophobicContact CD2-CB 4.13Å; F2014-I2055 HydrophobicContact CD2-CG2 3.51Å; F2014-I2055 HydrophobicContact CE1-CG2 4.48Å; F2014-I2055 HydrophobicContact CE2-CB 4.47Å; F2014-I2055 HydrophobicContact CE2-CG2 3.97Å; F2014-I2055 HydrophobicContact CG-CG2 3.57Å; F2014-I2055 HydrophobicContact CZ-CG2 4.43Å; F2014-A2056 HydrophobicContact CE2-CB 3.83Å; F2014-A2056 HydrophobicContact CZ-CB 4.01Å
2015	K	83.7	Confident	81.1	Confident	143 Å²	143	71.4 Å²	71.4	62%	0.622	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-27.3	176	-59.7	178.1	179.2	-178.8	0	113.2	D2013 R2052	D2013-K2015 PolarHBondContact O-N 2.85Å; D2013-K2015 VanDerWaalsContact OD1-CB 3.32Å; D2013-K2015 WeakPolarHBondContact OD1-CB 3.29Å; D2013-K2015 WeakPolarHBondContact OD1-CG 3.34Å; D2013-K2015 PolarHBondContact OD1-N 3.29Å; K2015-R2052 WeakPolarHBondContact O-CD 3.47Å
2016	T	85.8	Confident	81.6	Confident	69 Å²	69	68.1 Å²	68.1	42%	0.423	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-24.9	-175.6	44.5	0	0	0	0	113	E2009 D2013	E2009-T2016 WeakPolarHBondContact CA-OG1 3.49Å; E2009-T2016 CarbonylContact O-C 3.56Å; E2009-T2016 WeakPolarHBondContact O-CB 3.3Å; E2009-T2016 PolarHBondContact O-OG1 3.16Å; E2009-T2016 VanDerWaalsContact O-OG1 3.11Å; D2013-T2016 WeakPolarHBondContact CB-OG1 3.4Å; D2013-T2016 PolarHBondContact O-N 2.89Å; D2013-T2016 PolarHBondContact O-OG1 3.46Å; D2013-T2016 PolarHBondContact OD2-OG1 3Å
2017	C	83	Confident	81.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-51.1	147.9	-169.6	77	0	0	0	0	114.7	E2009 D2010 D2013 A2021 R2052	E2009-C2017 WeakPolarHBondContact O-CA 3.25Å; E2009-C2017 PolarHBondContact O-N 2.84Å; D2010-C2017 CarbonylContact O-C 3.51Å; D2010-C2017 VanDerWaalsContact O-CA 3.29Å; D2010-C2017 WeakPolarHBondContact O-CA 3.36Å; D2010-C2017 VanDerWaalsContact O-CB 3.23Å; D2010-C2017 WeakPolarHBondContact O-CB 3.48Å; D2013-C2017 VanDerWaalsContact O-CB 3.3Å; D2013-C2017 WeakPolarHBondContact O-CB 3.19Å; D2013-C2017 PolarHBondContact O-N 2.9Å; C2017-A2021 HydrophobicContact CB-CB 4.12Å; C2017-R2052 VanDerWaalsContact O-CZ 3.29Å; C2017-R2052 PolarHBondContact O-NH1 3.47Å; C2017-R2052 PolarHBondContact O-NH2 3.13Å
2018	V	85.4	Confident	82.1	Confident	60 Å²	60	66.7 Å²	66.7	36%	0.364	33%	0.326	S	S	.	.			trans	-59.9	146.8	176.9	-61.4	0	0	0	0	110.2	D2010 A2020 A2021 L2022	D2010-V2018 HydrophobicContact CB-CG1 4.03Å; D2010-V2018 PolarHBondContact O-N 3.45Å; V2018-A2020 PolarHBondContact O-N 3.47Å; V2018-A2021 HydrophobicContact CG2-CB 4.11Å; V2018-A2021 WeakPolarHBondContact O-CB 3.29Å; V2018-A2021 PolarHBondContact O-N 3.09Å; V2018-L2022 PolarHBondContact O-N 2.95Å; V2018-L2022 VanDerWaalsContact O-N 3.12Å
2019	P	81.6	Confident	82.4	Confident	57 Å²	57	69 Å²	69	37%	0.37	34%	0.335	S	S	.	.	H	α-helix	trans	-52.3	-33.4	-174.5	-32.5	38.5	0	0	0	114.8	L2022 D2023 R2034 D2048	P2019-L2022 WeakPolarHBondContact O-CB 3.26Å; P2019-L2022 PolarHBondContact O-N 3.34Å; P2019-D2023 PolarHBondContact O-N 3.31Å; P2019-D2023 VanDerWaalsContact O-N 3.15Å; P2019-R2034 PolarHBondContact O-NH2 3.44Å; P2019-D2048 WeakPolarHBondContact CB-OD1 3.33Å; P2019-D2048 WeakPolarHBondContact CG-OD2 3.47Å
2020	A	78.7	Confident	82.5	Confident	57 Å²	57	67.3 Å²	67.3	47%	0.471	33%	0.325	S	S	.	.	H	α-helix	trans	-64.5	-38.6	175	0	0	0	0	0	113.3	V2018 D2023 Y2024	V2018-A2020 PolarHBondContact O-N 3.47Å; A2020-D2023 PolarHBondContact O-N 2.75Å; A2020-Y2024 HydrophobicContact CB-CD2 4.36Å; A2020-Y2024 WeakPolarHBondContact O-CB 3.31Å; A2020-Y2024 VanDerWaalsContact O-CD2 3.23Å; A2020-Y2024 WeakPolarHBondContact O-CD2 3.49Å; A2020-Y2024 PolarHBondContact O-N 2.79Å
2021	A	79.7	Confident	82.5	Confident	3 Å²	3	67.7 Å²	67.7	3%	0.025	34%	0.344	C	S	.	.	H	α-helix	trans	-72.4	-34.1	175	0	0	0	0	0	111.7	D2010 I2011 C2017 V2018 D2023 Y2025 W2026	D2010-A2021 WeakPolarHBondContact O-CB 3.43Å; I2011-A2021 HydrophobicContact CD1-CB 3.89Å; I2011-A2021 HydrophobicContact CG2-CB 4.29Å; C2017-A2021 HydrophobicContact CB-CB 4.12Å; V2018-A2021 HydrophobicContact CG2-CB 4.11Å; V2018-A2021 WeakPolarHBondContact O-CB 3.29Å; V2018-A2021 PolarHBondContact O-N 3.09Å; A2021-D2023 PolarHBondContact O-N 3.07Å; A2021-Y2025 WeakPolarHBondContact O-CB 3.36Å; A2021-Y2025 PolarHBondContact O-N 3.46Å; A2021-W2026 PolarHBondContact O-N 2.93Å
2022	L	85.2	Confident	82.8	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.34	C	S	.	.	I	π-helix	trans	-58.2	-36.9	173.6	-162.1	69.6	0	0	0	111.3	F2014 V2018 P2019 W2026 G2027 D2048 F2051 R2052 I2055	F2014-L2022 HydrophobicContact CB-CD1 4.23Å; F2014-L2022 WeakPolarHBondContact O-CD1 3.46Å; V2018-L2022 PolarHBondContact O-N 2.95Å; V2018-L2022 VanDerWaalsContact O-N 3.12Å; P2019-L2022 WeakPolarHBondContact O-CB 3.26Å; P2019-L2022 PolarHBondContact O-N 3.34Å; L2022-W2026 WeakPolarHBondContact O-CB 3.26Å; L2022-G2027 PolarHBondContact O-N 2.92Å; L2022-D2048 HydrophobicContact CD2-CB 4.36Å; L2022-F2051 HydrophobicContact CD2-CB 4.33Å; L2022-F2051 HydrophobicContact CD2-CD1 3.72Å; L2022-F2051 HydrophobicContact CD2-CG 4.47Å; L2022-F2051 HydrophobicContact CG-CD1 3.8Å; L2022-F2051 HydrophobicContact CG-CE1 4.23Å; L2022-R2052 HydrophobicContact CD1-CG 3.66Å; L2022-R2052 HydrophobicContact CD2-CG 3.77Å; L2022-R2052 HydrophobicContact CG-CG 4.4Å; L2022-I2055 HydrophobicContact CD1-CD1 3.41Å; L2022-I2055 VanDerWaalsContact CD1-CD1 3.41Å; L2022-I2055 HydrophobicContact CG-CD1 3.75Å
2023	D	82.2	Confident	83.1	Confident	52 Å²	52	67.3 Å²	67.3	28%	0.278	35%	0.346	S	S	.	.	I	π-helix	trans	-85.7	-55.8	178.4	-67.2	-2.5	0	0	0	113	P2019 A2020 A2021 R2028 R2034 F2051	P2019-D2023 PolarHBondContact O-N 3.31Å; P2019-D2023 VanDerWaalsContact O-N 3.15Å; A2020-D2023 PolarHBondContact O-N 2.75Å; A2021-D2023 PolarHBondContact O-N 3.07Å; D2023-R2028 PolarHBondContact O-N 2.84Å; D2023-R2034 IonicContact OD1-CZ 2.61Å; D2023-R2034 IonicContact OD1-NE 3.29Å; D2023-R2034 PolarHBondContact OD1-NE 3.47Å; D2023-R2034 IonicContact OD1-NH2 3.11Å; D2023-R2034 PolarHBondContact OD1-NH2 3.26Å; D2023-R2034 IonicContact OD2-CZ 3.45Å; D2023-R2034 IonicContact OD2-NE 2.72Å; D2023-R2034 PolarHBondContact OD2-NE 3.16Å; D2023-R2034 IonicContact OD2-NH2 2.91Å; D2023-F2051 WeakPolarHBondContact OD1-CE1 3.49Å
2024	Y	78.3	Confident	83.2	Confident	153 Å²	153	66.7 Å²	66.7	60%	0.6	34%	0.34	S	S	*	.	I	π-helix	trans	-75	-26	-170.2	-72.9	-64.8	0	0	0	113.9	A2020 R2028	A2020-Y2024 HydrophobicContact CB-CD2 4.36Å; A2020-Y2024 WeakPolarHBondContact O-CB 3.31Å; A2020-Y2024 VanDerWaalsContact O-CD2 3.23Å; A2020-Y2024 WeakPolarHBondContact O-CD2 3.49Å; A2020-Y2024 PolarHBondContact O-N 2.79Å; Y2024-R2028 WeakPolarHBondContact O-CD 3.06Å
2025	Y	79.9	Confident	83.2	Confident	152 Å²	152	68 Å²	68	60%	0.596	35%	0.351	S	S	*	.	I	π-helix	trans	-103.1	-65.3	172	-76.3	-87.5	0	0	0	111.1	I2011 A2021 L2029	I2011-Y2025 HydrophobicContact CG2-CD2 4.21Å; I2011-Y2025 HydrophobicContact CG2-CE2 4.33Å; A2021-Y2025 WeakPolarHBondContact O-CB 3.36Å; A2021-Y2025 PolarHBondContact O-N 3.46Å; Y2025-L2029 WeakPolarHBondContact O-CB 3.39Å; Y2025-L2029 PolarHBondContact O-N 3.38Å
2026	W	87.6	Confident	83.2	Confident	41 Å²	41	62.5 Å²	62.5	16%	0.155	33%	0.327	C	S	.	.	I	π-helix	trans	-72.3	-45.7	-165.7	-68.8	102.4	0	0	0	114.6	I2011 L2012 F2014 A2021 L2022 L2029 Y2030 I2055	I2011-W2026 PolarHBondContact O-NE1 2.94Å; L2012-W2026 WeakPolarHBondContact O-CZ2 3.11Å; F2014-W2026 HydrophobicContact CB-CB 4.36Å; F2014-W2026 HydrophobicContact CB-CD2 3.69Å; F2014-W2026 HydrophobicContact CB-CE3 4.21Å; F2014-W2026 HydrophobicContact CB-CG 3.69Å; F2014-W2026 HydrophobicContact CD1-CE3 4.38Å; F2014-W2026 HydrophobicContact CD1-CZ3 4.4Å; A2021-W2026 PolarHBondContact O-N 2.93Å; L2022-W2026 WeakPolarHBondContact O-CB 3.26Å; W2026-L2029 HydrophobicContact CE3-CD2 4.02Å; W2026-L2029 HydrophobicContact CZ3-CD2 3.81Å; W2026-L2029 PolarHBondContact O-N 3.02Å; W2026-Y2030 HydrophobicContact CE3-CD2 4.32Å; W2026-Y2030 AromaticContact CE3-CE2 3.71Å; W2026-Y2030 HydrophobicContact CE3-CE2 3.71Å; W2026-Y2030 AromaticContact CZ3-CE2 3.92Å; W2026-Y2030 HydrophobicContact CZ3-CE2 3.92Å; W2026-Y2030 PolarHBondContact O-N 2.87Å; W2026-Y2030 VanDerWaalsContact O-N 3.17Å; W2026-I2055 HydrophobicContact CB-CD1 3.91Å; W2026-I2055 HydrophobicContact CB-CG2 4.39Å
2027	G	83.9	Confident	82.9	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.01	33%	0.329	C	S	.	.	I	π-helix	trans	-59.9	-48.4	175.6	0	0	0	0	0	111.8	L2022 L2029 Y2030 G2031 I2032	L2022-G2027 PolarHBondContact O-N 2.92Å; G2027-L2029 PolarHBondContact O-N 2.94Å; G2027-Y2030 CarbonylContact O-C 3.15Å; G2027-Y2030 PolarHBondContact O-N 3.45Å; G2027-G2031 PolarHBondContact O-N 2.67Å; G2027-I2032 CarbonylContact C-O 3.55Å; G2027-I2032 VanDerWaalsContact CA-O 3.26Å; G2027-I2032 WeakPolarHBondContact CA-O 3.46Å; G2027-I2032 PolarHBondContact O-N 2.99Å; G2027-I2032 VanDerWaalsContact O-O 3.05Å
2028	R	81.7	Confident	82.7	Confident	182 Å²	182	63.6 Å²	63.6	69%	0.687	33%	0.331	S	S	*	.	H	α-helix	trans	-61.5	-39.8	175.2	-74.1	-173.2	174.2	179.1	-3.9	113.5	D2023 Y2024 Y2030 G2031	D2023-R2028 PolarHBondContact O-N 2.84Å; Y2024-R2028 WeakPolarHBondContact O-CD 3.06Å; R2028-Y2030 VanDerWaalsContact C-N 3.32Å; R2028-Y2030 PolarHBondContact O-N 3.32Å; R2028-G2031 PolarHBondContact O-N 2.9Å
2029	L	83.2	Confident	81.9	Confident	118 Å²	118	64.6 Å²	64.6	62%	0.618	34%	0.339	S	S	*	.	H	α-helix	trans	-62.8	-37.3	179.1	-179.1	63.5	0	0	0	112.4	Y2025 W2026 G2027	Y2025-L2029 WeakPolarHBondContact O-CB 3.39Å; Y2025-L2029 PolarHBondContact O-N 3.38Å; W2026-L2029 HydrophobicContact CE3-CD2 4.02Å; W2026-L2029 HydrophobicContact CZ3-CD2 3.81Å; W2026-L2029 PolarHBondContact O-N 3.02Å; G2027-L2029 PolarHBondContact O-N 2.94Å
2030	Y	84.6	Confident	81.4	Confident	57 Å²	57	67.1 Å²	67.1	22%	0.224	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	9.6	179.5	-67.7	-60.8	0	0	0	114.6	W2026 G2027 R2028 I2032 I2055 K2058 A2059	W2026-Y2030 HydrophobicContact CE3-CD2 4.32Å; W2026-Y2030 AromaticContact CE3-CE2 3.71Å; W2026-Y2030 HydrophobicContact CE3-CE2 3.71Å; W2026-Y2030 AromaticContact CZ3-CE2 3.92Å; W2026-Y2030 HydrophobicContact CZ3-CE2 3.92Å; W2026-Y2030 PolarHBondContact O-N 2.87Å; W2026-Y2030 VanDerWaalsContact O-N 3.17Å; G2027-Y2030 CarbonylContact O-C 3.15Å; G2027-Y2030 PolarHBondContact O-N 3.45Å; R2028-Y2030 VanDerWaalsContact C-N 3.32Å; R2028-Y2030 PolarHBondContact O-N 3.32Å; Y2030-I2032 PolarHBondContact O-N 2.79Å; Y2030-I2055 HydrophobicContact CD2-CG2 4.02Å; Y2030-I2055 HydrophobicContact CE2-CG2 4.07Å; Y2030-K2058 HydrophobicContact CD1-CB 4.08Å; Y2030-K2058 HydrophobicContact CG-CB 3.97Å; Y2030-A2059 HydrophobicContact CE1-CB 4.4Å; Y2030-A2059 HydrophobicContact CE2-CB 3.97Å; Y2030-A2059 WeakPolarHBondContact OH-CB 3.28Å
2031	G	82.3	Confident	81	Confident	71 Å²	71	68.8 Å²	68.8	73%	0.732	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	30.3	175.5	0	0	0	0	0	114.8	G2027 R2028	G2027-G2031 PolarHBondContact O-N 2.67Å; R2028-G2031 PolarHBondContact O-N 2.9Å
2032	I	85.4	Confident	80.9	Confident	22 Å²	22	72.2 Å²	72.2	11%	0.113	37%	0.366	C	S	.	.			trans	-127	147.4	-175.9	53.8	174.4	0	0	0	112	G2027 Y2030 F2051 I2054 I2055 K2058	G2027-I2032 CarbonylContact C-O 3.55Å; G2027-I2032 VanDerWaalsContact CA-O 3.26Å; G2027-I2032 WeakPolarHBondContact CA-O 3.46Å; G2027-I2032 PolarHBondContact O-N 2.99Å; G2027-I2032 VanDerWaalsContact O-O 3.05Å; Y2030-I2032 PolarHBondContact O-N 2.79Å; I2032-F2051 HydrophobicContact CB-CE2 4.26Å; I2032-F2051 HydrophobicContact CD1-CE2 3.9Å; I2032-F2051 HydrophobicContact CD1-CZ 4.4Å; I2032-F2051 HydrophobicContact CG1-CE2 3.93Å; I2032-F2051 HydrophobicContact CG1-CZ 4.16Å; I2032-I2054 HydrophobicContact CD1-CG2 3.72Å; I2032-I2055 HydrophobicContact CD1-CG1 3.68Å; I2032-K2058 HydrophobicContact CD1-CG 4.18Å
2033	T	84.2	Confident	80.6	Confident	97 Å²	97	77.1 Å²	77.1	60%	0.595	40%	0.395	S	S	*	.			trans	-120.3	140.4	177.8	54.5	0	0	0	0	110.1	T2035	T2033-T2035 WeakPolarHBondContact CB-O 3.38Å; T2033-T2035 PolarHBondContact O-N 3.49Å; T2033-T2035 PolarHBondContact OG1-O 2.84Å
2034	R	85.8	Confident	80.7	Confident	33 Å²	33	76.4 Å²	76.4	13%	0.125	39%	0.391	C	S	.	.	S	Bend	trans	-64.6	-26.1	173.1	70.8	164.6	69.8	-136.4	2.6	112.7	P2019 D2023 T2045 L2046 D2048 F2051	P2019-R2034 PolarHBondContact O-NH2 3.44Å; D2023-R2034 IonicContact OD1-CZ 2.61Å; D2023-R2034 IonicContact OD1-NE 3.29Å; D2023-R2034 PolarHBondContact OD1-NE 3.47Å; D2023-R2034 IonicContact OD1-NH2 3.11Å; D2023-R2034 PolarHBondContact OD1-NH2 3.26Å; D2023-R2034 IonicContact OD2-CZ 3.45Å; D2023-R2034 IonicContact OD2-NE 2.72Å; D2023-R2034 PolarHBondContact OD2-NE 3.16Å; D2023-R2034 IonicContact OD2-NH2 2.91Å; R2034-T2045 HydrophobicContact CG-CG2 4.13Å; R2034-T2045 CarbonylContact O-C 3.59Å; R2034-T2045 WeakPolarHBondContact O-CA 3.39Å; R2034-L2046 HydrophobicContact CB-CB 4.35Å; R2034-L2046 WeakPolarHBondContact O-CG 3.3Å; R2034-L2046 PolarHBondContact O-N 2.93Å; R2034-D2048 IonicContact CZ-OD1 3.47Å; R2034-D2048 IonicContact NH1-OD1 3.31Å; R2034-D2048 PolarHBondContact NH1-OD1 2.82Å; R2034-D2048 IonicContact NH2-OD1 2.7Å; R2034-D2048 PolarHBondContact NH2-OD1 2.83Å; R2034-F2051 HydrophobicContact CB-CB 4.48Å; R2034-F2051 HydrophobicContact CB-CD1 3.91Å; R2034-F2051 HydrophobicContact CB-CD2 4.07Å; R2034-F2051 HydrophobicContact CB-CE1 4.11Å; R2034-F2051 HydrophobicContact CB-CE2 4.26Å; R2034-F2051 HydrophobicContact CB-CG 3.91Å; R2034-F2051 HydrophobicContact CB-CZ 4.28Å
2035	T	85.6	Confident	81.1	Confident	61 Å²	61	73 Å²	73	37%	0.374	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130	179.8	-57	0	0	0	0	109.9	T2033 V2043 I2044 T2045	T2033-T2035 WeakPolarHBondContact CB-O 3.38Å; T2033-T2035 PolarHBondContact O-N 3.49Å; T2033-T2035 PolarHBondContact OG1-O 2.84Å; T2035-V2043 HydrophobicContact CG2-CG1 3.49Å; T2035-V2043 VanDerWaalsContact CG2-CG1 3.49Å; T2035-I2044 CarbonylContact C-O 3.53Å; T2035-I2044 VanDerWaalsContact CA-O 3.28Å; T2035-I2044 WeakPolarHBondContact CA-O 3.25Å; T2035-T2045 WeakPolarHBondContact CG2-OG1 3.28Å; T2035-T2045 WeakPolarHBondContact OG1-CG2 3.5Å; T2035-T2045 PolarHBondContact OG1-OG1 3.4Å
2036	F	83	Confident	81.4	Confident	26 Å²	26	66.1 Å²	66.1	11%	0.114	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	163.2	178.6	52.4	-103.1	0	0	0	111.4	I2044 L2046 L2106 Y2109 L2110 K2114	F2036-I2044 HydrophobicContact CD2-CB 4.15Å; F2036-I2044 HydrophobicContact CE2-CB 3.76Å; F2036-I2044 HydrophobicContact CE2-CD1 4.2Å; F2036-I2044 HydrophobicContact CE2-CG1 4.44Å; F2036-I2044 HydrophobicContact CE2-CG2 3.93Å; F2036-I2044 HydrophobicContact CZ-CB 4.27Å; F2036-I2044 HydrophobicContact CZ-CG2 3.97Å; F2036-I2044 PolarHBondContact N-O 3.21Å; F2036-I2044 PolarHBondContact O-N 2.72Å; F2036-L2046 HydrophobicContact CE1-CD1 3.86Å; F2036-L2046 HydrophobicContact CE1-CD2 4.13Å; F2036-L2046 HydrophobicContact CE1-CG 3.8Å; F2036-L2046 HydrophobicContact CZ-CD1 4.49Å; F2036-L2046 HydrophobicContact CZ-CD2 4.02Å; F2036-L2046 HydrophobicContact CZ-CG 4.21Å; F2036-L2106 HydrophobicContact CE2-CD1 4.47Å; F2036-L2106 HydrophobicContact CZ-CD1 4.17Å; F2036-Y2109 HydrophobicContact CD2-CE1 4.26Å; F2036-Y2109 HydrophobicContact CE2-CD1 4.27Å; F2036-Y2109 HydrophobicContact CE2-CE1 4.1Å; F2036-L2110 HydrophobicContact CE1-CD2 3.69Å; F2036-L2110 HydrophobicContact CE2-CD2 4.4Å; F2036-L2110 HydrophobicContact CZ-CD2 3.45Å; F2036-L2110 VanDerWaalsContact CZ-CD2 3.45Å; F2036-L2110 HydrophobicContact CZ-CG 4.18Å; F2036-K2114 VanDerWaalsContact CD2-CE 3.43Å
2037	L	80.4	Confident	81.5	Confident	89 Å²	89	68.1 Å²	68.1	47%	0.466	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.6	167.6	-62	172.5	0	0	0	110.2	D2041 E2042 V2043 Y2109 K2114	L2037-D2041 HydrophobicContact CD2-CB 4.48Å; L2037-D2041 WeakPolarHBondContact CD2-O 3.39Å; L2037-E2042 CarbonylContact C-O 3.56Å; L2037-E2042 WeakPolarHBondContact CA-O 3.4Å; L2037-V2043 HydrophobicContact CD2-CG2 4.06Å; L2037-Y2109 WeakPolarHBondContact O-CE1 3.49Å; L2037-Y2109 PolarHBondContact O-OH 2.89Å; L2037-K2114 PolarHBondContact O-NZ 3.45Å
2038	G	77.8	Confident	81.6	Confident	3 Å²	3	70.2 Å²	70.2	3%	0.031	39%	0.385	C	S	.	.			trans	-78	-170.8	173.9	0	0	0	0	0	113.3	N2040 D2041 E2042 Y2109	G2038-N2040 VanDerWaalsContact C-N 3.27Å; G2038-N2040 PolarHBondContact O-N 3.17Å; G2038-D2041 PolarHBondContact O-N 3.23Å; G2038-E2042 PolarHBondContact N-O 2.74Å; G2038-Y2109 VanDerWaalsContact C-CZ 3.44Å; G2038-Y2109 PolarHBondContact O-OH 3.15Å
2039	P	69.2	Low	81.8	Confident	81 Å²	81	66.8 Å²	66.8	53%	0.526	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-24.3	177.6	26.3	-34.3	0	0	0	114.2	E2042 Y2109	P2039-E2042 WeakPolarHBondContact CD-OE1 3.31Å; P2039-Y2109 HydrophobicContact CB-CD2 3.77Å; P2039-Y2109 HydrophobicContact CB-CE2 3.86Å; P2039-Y2109 HydrophobicContact CB-CG 4.5Å; P2039-Y2109 HydrophobicContact CG-CD2 4.08Å; P2039-Y2109 HydrophobicContact CG-CE2 4.44Å; P2039-Y2109 HydrophobicContact CG-CG 4.33Å
2040	N	70.1	Confident	81.9	Confident	111 Å²	111	63.2 Å²	63.2	59%	0.594	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	26.6	177.2	-43.3	-70.6	0	0	0	112.6	G2038 E2042	G2038-N2040 VanDerWaalsContact C-N 3.27Å; G2038-N2040 PolarHBondContact O-N 3.17Å; N2040-E2042 WeakPolarHBondContact CB-OE1 3.44Å; N2040-E2042 PolarHBondContact N-OE1 2.71Å; N2040-E2042 PolarHBondContact ND2-OE1 3.32Å; N2040-E2042 VanDerWaalsContact ND2-OE1 3.08Å; N2040-E2042 PolarHBondContact ND2-OE2 3.48Å; N2040-E2042 PolarHBondContact O-N 3.41Å
2041	D	71	Confident	82.3	Confident	92 Å²	92	60.6 Å²	60.6	49%	0.492	35%	0.351	S	S	.	.	S	Bend	trans	53	20.7	-169	-71.8	-51.1	0	0	0	114.6	L2037 G2038	L2037-D2041 HydrophobicContact CD2-CB 4.48Å; L2037-D2041 WeakPolarHBondContact CD2-O 3.39Å; G2038-D2041 PolarHBondContact O-N 3.23Å
2042	E	77.4	Confident	82.7	Confident	75 Å²	75	59 Å²	59	35%	0.35	32%	0.322	S	S	.	.			trans	-70.2	136.8	171.6	65.8	-108.9	118.2	0	0	110.6	L2037 G2038 P2039 N2040 I2044	L2037-E2042 CarbonylContact C-O 3.56Å; L2037-E2042 WeakPolarHBondContact CA-O 3.4Å; G2038-E2042 PolarHBondContact N-O 2.74Å; P2039-E2042 WeakPolarHBondContact CD-OE1 3.31Å; N2040-E2042 WeakPolarHBondContact CB-OE1 3.44Å; N2040-E2042 PolarHBondContact N-OE1 2.71Å; N2040-E2042 PolarHBondContact ND2-OE1 3.32Å; N2040-E2042 VanDerWaalsContact ND2-OE1 3.08Å; N2040-E2042 PolarHBondContact ND2-OE2 3.48Å; N2040-E2042 PolarHBondContact O-N 3.41Å; E2042-I2044 HydrophobicContact CG-CD1 4Å; E2042-I2044 HydrophobicContact CG-CG1 3.66Å; E2042-I2044 PolarHBondContact O-N 2.88Å
2043	V	79.9	Confident	82.8	Confident	103 Å²	103	61.9 Å²	61.9	62%	0.624	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	88.9	177.7	-178.4	0	0	0	0	109.2	T2035 L2037	T2035-V2043 HydrophobicContact CG2-CG1 3.49Å; T2035-V2043 VanDerWaalsContact CG2-CG1 3.49Å; L2037-V2043 HydrophobicContact CD2-CG2 4.06Å
2044	I	82.3	Confident	83	Confident	37 Å²	37	57.6 Å²	57.6	19%	0.19	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	129.6	175.4	-57.9	-176.1	0	0	0	108.1	T2035 F2036 E2042 L2046 L2106	T2035-I2044 CarbonylContact C-O 3.53Å; T2035-I2044 VanDerWaalsContact CA-O 3.28Å; T2035-I2044 WeakPolarHBondContact CA-O 3.25Å; F2036-I2044 HydrophobicContact CD2-CB 4.15Å; F2036-I2044 HydrophobicContact CE2-CB 3.76Å; F2036-I2044 HydrophobicContact CE2-CD1 4.2Å; F2036-I2044 HydrophobicContact CE2-CG1 4.44Å; F2036-I2044 HydrophobicContact CE2-CG2 3.93Å; F2036-I2044 HydrophobicContact CZ-CB 4.27Å; F2036-I2044 HydrophobicContact CZ-CG2 3.97Å; F2036-I2044 PolarHBondContact N-O 3.21Å; F2036-I2044 PolarHBondContact O-N 2.72Å; E2042-I2044 HydrophobicContact CG-CD1 4Å; E2042-I2044 HydrophobicContact CG-CG1 3.66Å; E2042-I2044 PolarHBondContact O-N 2.88Å; I2044-L2046 HydrophobicContact CG2-CD2 4.42Å; I2044-L2106 HydrophobicContact CD1-CD1 4.06Å; I2044-L2106 HydrophobicContact CG2-CD1 3.88Å
2045	T	87.5	Confident	83.2	Confident	81 Å²	81	56 Å²	56	50%	0.497	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.5	168.5	-63.4	0	0	0	0	108.9	R2034 T2035	R2034-T2045 HydrophobicContact CG-CG2 4.13Å; R2034-T2045 CarbonylContact O-C 3.59Å; R2034-T2045 WeakPolarHBondContact O-CA 3.39Å; T2035-T2045 WeakPolarHBondContact CG2-OG1 3.28Å; T2035-T2045 WeakPolarHBondContact OG1-CG2 3.5Å; T2035-T2045 PolarHBondContact OG1-OG1 3.4Å
2046	L	86.8	Confident	83.4	Confident	7 Å²	7	54 Å²	54	4%	0.037	29%	0.292	C	S	.	.			trans	-71.8	145.5	176.8	-58.3	-179.9	0	0	0	111.4	R2034 F2036 I2044 I2050 F2051 I2054 L2106 L2110	R2034-L2046 HydrophobicContact CB-CB 4.35Å; R2034-L2046 WeakPolarHBondContact O-CG 3.3Å; R2034-L2046 PolarHBondContact O-N 2.93Å; F2036-L2046 HydrophobicContact CE1-CD1 3.86Å; F2036-L2046 HydrophobicContact CE1-CD2 4.13Å; F2036-L2046 HydrophobicContact CE1-CG 3.8Å; F2036-L2046 HydrophobicContact CZ-CD1 4.49Å; F2036-L2046 HydrophobicContact CZ-CD2 4.02Å; F2036-L2046 HydrophobicContact CZ-CG 4.21Å; I2044-L2046 HydrophobicContact CG2-CD2 4.42Å; L2046-I2050 HydrophobicContact CD1-CG2 4.18Å; L2046-I2050 HydrophobicContact CD2-CG2 3.99Å; L2046-F2051 HydrophobicContact CB-CB 4.32Å; L2046-F2051 HydrophobicContact CD1-CB 4.47Å; L2046-F2051 HydrophobicContact CD1-CD2 4.15Å; L2046-I2054 HydrophobicContact CD1-CD1 3.35Å; L2046-L2106 HydrophobicContact CD2-CD1 4.25Å; L2046-L2106 HydrophobicContact CD2-CD2 4.03Å; L2046-L2110 HydrophobicContact CD1-CD2 4.38Å; L2046-L2110 HydrophobicContact CD2-CD1 4.28Å
2047	D	89.6	Confident	83.7	Confident	83 Å²	83	52.9 Å²	52.9	44%	0.444	29%	0.288	S	S	.	.			trans	-70.4	167	163.4	68	69.1	0	0	0	111.7	N2049 I2050 F2051	D2047-N2049 VanDerWaalsContact C-N 3.26Å; D2047-N2049 PolarHBondContact O-N 3.06Å; D2047-N2049 WeakPolarHBondContact OD1-CA 3.39Å; D2047-N2049 WeakPolarHBondContact OD1-CB 3.41Å; D2047-N2049 PolarHBondContact OD1-N 3.49Å; D2047-I2050 PolarHBondContact OD1-N 3.26Å; D2047-I2050 VanDerWaalsContact OD2-CD1 3.32Å; D2047-I2050 WeakPolarHBondContact OD2-CD1 3.42Å; D2047-F2051 WeakPolarHBondContact O-CB 3.42Å; D2047-F2051 PolarHBondContact O-N 3.34Å; D2047-F2051 VanDerWaalsContact O-N 3.09Å
2048	D	86	Confident	84.1	Confident	46 Å²	46	50.8 Å²	50.8	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-28.3	-177.3	-67.5	-53.3	0	0	0	113.6	P2019 L2022 R2034 R2052	P2019-D2048 WeakPolarHBondContact CB-OD1 3.33Å; P2019-D2048 WeakPolarHBondContact CG-OD2 3.47Å; L2022-D2048 HydrophobicContact CD2-CB 4.36Å; R2034-D2048 IonicContact CZ-OD1 3.47Å; R2034-D2048 IonicContact NH1-OD1 3.31Å; R2034-D2048 PolarHBondContact NH1-OD1 2.82Å; R2034-D2048 IonicContact NH2-OD1 2.7Å; R2034-D2048 PolarHBondContact NH2-OD1 2.83Å; D2048-R2052 WeakPolarHBondContact O-CB 3.29Å; D2048-R2052 WeakPolarHBondContact O-CD 3.41Å; D2048-R2052 WeakPolarHBondContact O-CG 3.33Å; D2048-R2052 PolarHBondContact O-N 2.96Å; D2048-R2052 PolarHBondContact O-NE 3.19Å
2049	N	85.7	Confident	84.5	Confident	110 Å²	110	51.6 Å²	51.6	59%	0.588	28%	0.281	S	S	*	.	H	α-helix	trans	-75.6	-49.9	-177.6	-62.5	-25.6	0	0	0	110.2	D2047 F2051 R2052 E2053	D2047-N2049 VanDerWaalsContact C-N 3.26Å; D2047-N2049 PolarHBondContact O-N 3.06Å; D2047-N2049 WeakPolarHBondContact OD1-CA 3.39Å; D2047-N2049 WeakPolarHBondContact OD1-CB 3.41Å; D2047-N2049 PolarHBondContact OD1-N 3.49Å; N2049-F2051 VanDerWaalsContact C-N 3.27Å; N2049-F2051 PolarHBondContact O-N 3.48Å; N2049-R2052 WeakPolarHBondContact O-CB 3.42Å; N2049-R2052 PolarHBondContact O-N 3.03Å; N2049-R2052 VanDerWaalsContact O-N 3.16Å; N2049-E2053 PolarHBondContact O-N 3.05Å
2050	I	85.6	Confident	85.4	Confident	43 Å²	43	47.9 Å²	47.9	22%	0.221	26%	0.256	C	S	.	.	H	α-helix	trans	-61	-39.7	177.1	-56.4	174.8	0	0	0	110.1	L2046 D2047 E2053 I2054 L2106 L2110	L2046-I2050 HydrophobicContact CD1-CG2 4.18Å; L2046-I2050 HydrophobicContact CD2-CG2 3.99Å; D2047-I2050 PolarHBondContact OD1-N 3.26Å; D2047-I2050 VanDerWaalsContact OD2-CD1 3.32Å; D2047-I2050 WeakPolarHBondContact OD2-CD1 3.42Å; I2050-E2053 PolarHBondContact O-N 3.31Å; I2050-I2054 HydrophobicContact CG2-CD1 4.19Å; I2050-I2054 WeakPolarHBondContact O-CG1 3.37Å; I2050-I2054 PolarHBondContact O-N 2.66Å; I2050-L2106 HydrophobicContact CD1-CD2 4.42Å; I2050-L2110 HydrophobicContact CG2-CD1 4.37Å
2051	F	91.8	Very high	86.1	Confident	2 Å²	2	44 Å²	44	1%	0.009	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-35.8	178.2	-164.1	-133	0	0	0	112.7	L2022 D2023 I2032 R2034 L2046 D2047 N2049 I2054 I2055	L2022-F2051 HydrophobicContact CD2-CB 4.33Å; L2022-F2051 HydrophobicContact CD2-CD1 3.72Å; L2022-F2051 HydrophobicContact CD2-CG 4.47Å; L2022-F2051 HydrophobicContact CG-CD1 3.8Å; L2022-F2051 HydrophobicContact CG-CE1 4.23Å; D2023-F2051 WeakPolarHBondContact OD1-CE1 3.49Å; I2032-F2051 HydrophobicContact CB-CE2 4.26Å; I2032-F2051 HydrophobicContact CD1-CE2 3.9Å; I2032-F2051 HydrophobicContact CD1-CZ 4.4Å; I2032-F2051 HydrophobicContact CG1-CE2 3.93Å; I2032-F2051 HydrophobicContact CG1-CZ 4.16Å; R2034-F2051 HydrophobicContact CB-CB 4.48Å; R2034-F2051 HydrophobicContact CB-CD1 3.91Å; R2034-F2051 HydrophobicContact CB-CD2 4.07Å; R2034-F2051 HydrophobicContact CB-CE1 4.11Å; R2034-F2051 HydrophobicContact CB-CE2 4.26Å; R2034-F2051 HydrophobicContact CB-CG 3.91Å; R2034-F2051 HydrophobicContact CB-CZ 4.28Å; L2046-F2051 HydrophobicContact CB-CB 4.32Å; L2046-F2051 HydrophobicContact CD1-CB 4.47Å; L2046-F2051 HydrophobicContact CD1-CD2 4.15Å; D2047-F2051 WeakPolarHBondContact O-CB 3.42Å; D2047-F2051 PolarHBondContact O-N 3.34Å; D2047-F2051 VanDerWaalsContact O-N 3.09Å; N2049-F2051 VanDerWaalsContact C-N 3.27Å; N2049-F2051 PolarHBondContact O-N 3.48Å; F2051-I2054 PolarHBondContact O-N 2.92Å; F2051-I2055 HydrophobicContact CD1-CD1 3.97Å; F2051-I2055 HydrophobicContact CE1-CD1 3.94Å; F2051-I2055 HydrophobicContact CG-CD1 4.33Å; F2051-I2055 HydrophobicContact CZ-CD1 4.29Å; F2051-I2055 WeakPolarHBondContact O-CD1 3.34Å; F2051-I2055 VanDerWaalsContact O-CG1 3.31Å; F2051-I2055 WeakPolarHBondContact O-CG1 3.48Å; F2051-I2055 PolarHBondContact O-N 2.78Å
2052	R	90.7	Very high	86.5	Confident	36 Å²	36	44.3 Å²	44.3	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-64.5	-38.9	171.4	-74.1	173.4	-149.2	-89.6	8	113.1	F2014 K2015 C2017 L2022 D2048 N2049 I2055 A2056	F2014-R2052 WeakPolarHBondContact O-CD 3.32Å; F2014-R2052 VanDerWaalsContact O-CG 3.25Å; F2014-R2052 WeakPolarHBondContact O-CG 3.19Å; F2014-R2052 PolarHBondContact O-NH1 3.15Å; K2015-R2052 WeakPolarHBondContact O-CD 3.47Å; C2017-R2052 VanDerWaalsContact O-CZ 3.29Å; C2017-R2052 PolarHBondContact O-NH1 3.47Å; C2017-R2052 PolarHBondContact O-NH2 3.13Å; L2022-R2052 HydrophobicContact CD1-CG 3.66Å; L2022-R2052 HydrophobicContact CD2-CG 3.77Å; L2022-R2052 HydrophobicContact CG-CG 4.4Å; D2048-R2052 WeakPolarHBondContact O-CB 3.29Å; D2048-R2052 WeakPolarHBondContact O-CD 3.41Å; D2048-R2052 WeakPolarHBondContact O-CG 3.33Å; D2048-R2052 PolarHBondContact O-N 2.96Å; D2048-R2052 PolarHBondContact O-NE 3.19Å; N2049-R2052 WeakPolarHBondContact O-CB 3.42Å; N2049-R2052 PolarHBondContact O-N 3.03Å; N2049-R2052 VanDerWaalsContact O-N 3.16Å; R2052-I2055 PolarHBondContact O-N 3.38Å; R2052-A2056 PolarHBondContact O-N 3.33Å
2053	E	88.2	Confident	86.8	Confident	83 Å²	83	48.5 Å²	48.5	39%	0.388	26%	0.263	S	S	.	.	H	α-helix	trans	-63.9	-42.8	175.4	-72.3	175.2	-167.5	0	0	111.3	N2049 I2050 A2056 I2057 L2078	N2049-E2053 PolarHBondContact O-N 3.05Å; I2050-E2053 PolarHBondContact O-N 3.31Å; E2053-A2056 WeakPolarHBondContact O-CB 3.37Å; E2053-A2056 PolarHBondContact O-N 3.29Å; E2053-A2056 VanDerWaalsContact O-N 3.16Å; E2053-I2057 WeakPolarHBondContact O-CG1 3.17Å; E2053-I2057 PolarHBondContact O-N 3.23Å; E2053-L2078 HydrophobicContact CG-CD1 4.4Å
2054	I	88.5	Confident	87	Confident	8 Å²	8	45 Å²	45	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-42.5	174.9	-64.1	168.4	0	0	0	111.4	I2032 L2046 I2050 F2051 A2056 I2057 K2058 L2110 I2116	I2032-I2054 HydrophobicContact CD1-CG2 3.72Å; L2046-I2054 HydrophobicContact CD1-CD1 3.35Å; I2050-I2054 HydrophobicContact CG2-CD1 4.19Å; I2050-I2054 WeakPolarHBondContact O-CG1 3.37Å; I2050-I2054 PolarHBondContact O-N 2.66Å; F2051-I2054 PolarHBondContact O-N 2.92Å; I2054-A2056 VanDerWaalsContact C-N 3.29Å; I2054-A2056 PolarHBondContact O-N 2.87Å; I2054-I2057 PolarHBondContact O-N 2.73Å; I2054-K2058 PolarHBondContact O-N 3.16Å; I2054-L2110 HydrophobicContact CD1-CD1 4.04Å; I2054-L2110 HydrophobicContact CD1-CD2 3.85Å; I2054-I2116 HydrophobicContact CD1-CD1 3.96Å; I2054-I2116 HydrophobicContact CG1-CD1 4.06Å; I2054-I2116 HydrophobicContact CG2-CD1 3.76Å; I2054-I2116 HydrophobicContact CG2-CG1 3.9Å; I2054-I2116 HydrophobicContact CG2-CG2 4.03Å
2055	I	90.3	Very high	86.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.1	-40.1	173.6	-71.2	160.7	0	0	0	110.5	F2014 L2022 W2026 Y2030 I2032 F2051 R2052 I2057 K2058 A2059	F2014-I2055 HydrophobicContact CB-CG2 3.95Å; F2014-I2055 HydrophobicContact CD1-CG2 4.08Å; F2014-I2055 HydrophobicContact CD2-CB 4.13Å; F2014-I2055 HydrophobicContact CD2-CG2 3.51Å; F2014-I2055 HydrophobicContact CE1-CG2 4.48Å; F2014-I2055 HydrophobicContact CE2-CB 4.47Å; F2014-I2055 HydrophobicContact CE2-CG2 3.97Å; F2014-I2055 HydrophobicContact CG-CG2 3.57Å; F2014-I2055 HydrophobicContact CZ-CG2 4.43Å; L2022-I2055 HydrophobicContact CD1-CD1 3.41Å; L2022-I2055 VanDerWaalsContact CD1-CD1 3.41Å; L2022-I2055 HydrophobicContact CG-CD1 3.75Å; W2026-I2055 HydrophobicContact CB-CD1 3.91Å; W2026-I2055 HydrophobicContact CB-CG2 4.39Å; Y2030-I2055 HydrophobicContact CD2-CG2 4.02Å; Y2030-I2055 HydrophobicContact CE2-CG2 4.07Å; I2032-I2055 HydrophobicContact CD1-CG1 3.68Å; F2051-I2055 HydrophobicContact CD1-CD1 3.97Å; F2051-I2055 HydrophobicContact CE1-CD1 3.94Å; F2051-I2055 HydrophobicContact CG-CD1 4.33Å; F2051-I2055 HydrophobicContact CZ-CD1 4.29Å; F2051-I2055 WeakPolarHBondContact O-CD1 3.34Å; F2051-I2055 VanDerWaalsContact O-CG1 3.31Å; F2051-I2055 WeakPolarHBondContact O-CG1 3.48Å; F2051-I2055 PolarHBondContact O-N 2.78Å; R2052-I2055 PolarHBondContact O-N 3.38Å; I2055-I2057 PolarHBondContact O-N 2.94Å; I2055-K2058 PolarHBondContact O-N 2.86Å; I2055-A2059 WeakPolarHBondContact O-CB 3.21Å; I2055-A2059 PolarHBondContact O-N 3.09Å
2056	A	88.6	Confident	86.3	Confident	17 Å²	17	44.9 Å²	44.9	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-41.9	175.3	0	0	0	0	0	112.5	F2014 R2052 E2053 I2054 F2060 F2074	F2014-A2056 HydrophobicContact CE2-CB 3.83Å; F2014-A2056 HydrophobicContact CZ-CB 4.01Å; R2052-A2056 PolarHBondContact O-N 3.33Å; E2053-A2056 WeakPolarHBondContact O-CB 3.37Å; E2053-A2056 PolarHBondContact O-N 3.29Å; E2053-A2056 VanDerWaalsContact O-N 3.16Å; I2054-A2056 VanDerWaalsContact C-N 3.29Å; I2054-A2056 PolarHBondContact O-N 2.87Å; A2056-F2060 WeakPolarHBondContact O-CB 3.37Å; A2056-F2060 PolarHBondContact O-N 3.03Å; A2056-F2074 HydrophobicContact CB-CZ 4.41Å
2057	I	91	Very high	86	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-67	-45.4	178	-60	164.6	0	0	0	110.8	E2053 I2054 I2055 F2060 G2061 F2074 F2075 L2078 F2111 I2116 L2117 P2118	E2053-I2057 WeakPolarHBondContact O-CG1 3.17Å; E2053-I2057 PolarHBondContact O-N 3.23Å; I2054-I2057 PolarHBondContact O-N 2.73Å; I2055-I2057 PolarHBondContact O-N 2.94Å; I2057-F2060 PolarHBondContact O-N 2.94Å; I2057-G2061 PolarHBondContact O-N 2.89Å; I2057-F2074 HydrophobicContact CG1-CE1 4.18Å; I2057-F2074 HydrophobicContact CG1-CZ 4.42Å; I2057-F2075 HydrophobicContact CG1-CE1 4.27Å; I2057-F2075 HydrophobicContact CG2-CE1 4.21Å; I2057-F2075 HydrophobicContact CG2-CZ 4.2Å; I2057-L2078 HydrophobicContact CD1-CD2 3.91Å; I2057-L2078 HydrophobicContact CG1-CD2 3.57Å; I2057-F2111 HydrophobicContact CD1-CE1 4.03Å; I2057-I2116 HydrophobicContact CB-CG2 4.16Å; I2057-I2116 HydrophobicContact CD1-CG2 4.01Å; I2057-I2116 HydrophobicContact CG2-CG2 4Å; I2057-I2116 VanDerWaalsContact CG2-O 3.3Å; I2057-I2116 WeakPolarHBondContact CG2-O 3.48Å; I2057-L2117 HydrophobicContact CG2-CD2 4.36Å; I2057-P2118 HydrophobicContact CG2-CG 4.43Å
2058	K	89	Confident	85.5	Confident	45 Å²	45	45.1 Å²	45.1	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-46.5	175.4	-71.5	-67.8	-162.6	176.6	0	111.6	Y2030 I2032 I2054 I2055 F2060 G2061 C2062 D2115	Y2030-K2058 HydrophobicContact CD1-CB 4.08Å; Y2030-K2058 HydrophobicContact CG-CB 3.97Å; I2032-K2058 HydrophobicContact CD1-CG 4.18Å; I2054-K2058 PolarHBondContact O-N 3.16Å; I2055-K2058 PolarHBondContact O-N 2.86Å; K2058-F2060 VanDerWaalsContact C-N 3.31Å; K2058-F2060 PolarHBondContact O-N 2.68Å; K2058-G2061 PolarHBondContact O-N 2.82Å; K2058-C2062 PolarHBondContact O-N 3.48Å; K2058-C2062 VanDerWaalsContact O-N 3.1Å; K2058-C2062 PolarHBondContact O-SG 3.4Å; K2058-C2062 VanDerWaalsContact O-SG 3.42Å; K2058-D2115 PolarHBondContact NZ-O 3.3Å
2059	A	86.2	Confident	85.3	Confident	19 Å²	19	49.2 Å²	49.2	16%	0.157	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-35.9	177	0	0	0	0	0	112.6	Y2030 I2055	Y2030-A2059 HydrophobicContact CE1-CB 4.4Å; Y2030-A2059 HydrophobicContact CE2-CB 3.97Å; Y2030-A2059 WeakPolarHBondContact OH-CB 3.28Å; I2055-A2059 WeakPolarHBondContact O-CB 3.21Å; I2055-A2059 PolarHBondContact O-N 3.09Å
2060	F	88	Confident	85.2	Confident	3 Å²	3	46.8 Å²	46.8	1%	0.013	25%	0.249	C	C	.	.	H	α-helix	trans	-64.2	-47.8	170.9	173.3	-107.4	0	0	0	111.6	A2056 I2057 K2058 C2062 R2063 W2064 E2070 A2071 F2074 P2118	A2056-F2060 WeakPolarHBondContact O-CB 3.37Å; A2056-F2060 PolarHBondContact O-N 3.03Å; I2057-F2060 PolarHBondContact O-N 2.94Å; K2058-F2060 VanDerWaalsContact C-N 3.31Å; K2058-F2060 PolarHBondContact O-N 2.68Å; F2060-C2062 PolarHBondContact O-N 2.72Å; F2060-R2063 HydrophobicContact CD2-CG 4.42Å; F2060-R2063 VanDerWaalsContact O-CG 3.3Å; F2060-R2063 WeakPolarHBondContact O-CG 3.41Å; F2060-R2063 PolarHBondContact O-N 3.29Å; F2060-W2064 HydrophobicContact CD1-CB 4.44Å; F2060-W2064 HydrophobicContact CE1-CB 3.97Å; F2060-W2064 HydrophobicContact CE1-CD2 4.35Å; F2060-W2064 AromaticContact CE1-CG 3.84Å; F2060-W2064 HydrophobicContact CE1-CG 3.84Å; F2060-W2064 HydrophobicContact CE2-CB 4.12Å; F2060-W2064 HydrophobicContact CE2-CG 4.36Å; F2060-W2064 HydrophobicContact CZ-CB 3.79Å; F2060-W2064 AromaticContact CZ-CD1 3.41Å; F2060-W2064 VanDerWaalsContact CZ-CD1 3.41Å; F2060-W2064 HydrophobicContact CZ-CD2 4.47Å; F2060-W2064 AromaticContact CZ-CG 3.62Å; F2060-W2064 HydrophobicContact CZ-CG 3.62Å; F2060-W2064 WeakPolarHBondContact O-CB 3.33Å; F2060-W2064 PolarHBondContact O-N 3.14Å; F2060-E2070 HydrophobicContact CZ-CB 4.39Å; F2060-A2071 HydrophobicContact CE1-CB 4.35Å; F2060-A2071 HydrophobicContact CZ-CB 4.45Å; F2060-F2074 HydrophobicContact CB-CD1 3.95Å; F2060-F2074 HydrophobicContact CB-CD2 4.06Å; F2060-F2074 HydrophobicContact CB-CE1 3.65Å; F2060-F2074 HydrophobicContact CB-CE2 3.77Å; F2060-F2074 HydrophobicContact CB-CG 4.14Å; F2060-F2074 HydrophobicContact CB-CZ 3.56Å; F2060-F2074 HydrophobicContact CD1-CB 4.3Å; F2060-F2074 AromaticContact CD1-CD1 3.34Å; F2060-F2074 HydrophobicContact CD1-CD1 3.34Å; F2060-F2074 AromaticContact CD1-CE1 3.73Å; F2060-F2074 HydrophobicContact CD1-CE1 3.73Å; F2060-F2074 AromaticContact CD1-CG 3.82Å; F2060-F2074 HydrophobicContact CD1-CG 3.82Å; F2060-F2074 HydrophobicContact CD1-CZ 4.49Å; F2060-F2074 HydrophobicContact CD2-CB 3.86Å; F2060-F2074 HydrophobicContact CD2-CD1 4.03Å; F2060-F2074 AromaticContact CD2-CD2 3.82Å; F2060-F2074 HydrophobicContact CD2-CD2 3.82Å; F2060-F2074 HydrophobicContact CD2-CE2 4.4Å; F2060-F2074 AromaticContact CD2-CG 3.61Å; F2060-F2074 HydrophobicContact CD2-CG 3.61Å; F2060-F2074 HydrophobicContact CE1-CB 4.12Å; F2060-F2074 AromaticContact CE1-CD1 3.83Å; F2060-F2074 HydrophobicContact CE1-CD1 3.83Å; F2060-F2074 HydrophobicContact CE1-CG 4.14Å; F2060-F2074 HydrophobicContact CE2-CB 3.65Å; F2060-F2074 HydrophobicContact CE2-CD1 4.44Å; F2060-F2074 HydrophobicContact CE2-CD2 4.48Å; F2060-F2074 AromaticContact CE2-CG 3.95Å; F2060-F2074 HydrophobicContact CE2-CG 3.95Å; F2060-F2074 HydrophobicContact CG-CB 4.18Å; F2060-F2074 AromaticContact CG-CD1 3.47Å; F2060-F2074 HydrophobicContact CG-CD1 3.47Å; F2060-F2074 VanDerWaalsContact CG-CD1 3.47Å; F2060-F2074 AromaticContact CG-CD2 3.87Å; F2060-F2074 HydrophobicContact CG-CD2 3.87Å; F2060-F2074 AromaticContact CG-CE1 3.72Å; F2060-F2074 HydrophobicContact CG-CE1 3.72Å; F2060-F2074 HydrophobicContact CG-CE2 4.11Å; F2060-F2074 AromaticContact CG-CG 3.54Å; F2060-F2074 HydrophobicContact CG-CG 3.54Å; F2060-F2074 HydrophobicContact CG-CZ 4.04Å; F2060-F2074 HydrophobicContact CZ-CB 3.79Å; F2060-F2074 HydrophobicContact CZ-CD1 4.35Å; F2060-F2074 HydrophobicContact CZ-CG 4.2Å; F2060-P2118 HydrophobicContact CD1-CG 3.83Å; F2060-P2118 HydrophobicContact CE1-CG 4.13Å
2061	G	84.6	Confident	85.2	Confident	29 Å²	29	44.7 Å²	44.7	30%	0.299	24%	0.239	S	C	.	.	H	α-helix	trans	-55.1	-36.4	177.3	0	0	0	0	0	113.5	I2057 K2058 R2063	I2057-G2061 PolarHBondContact O-N 2.89Å; K2058-G2061 PolarHBondContact O-N 2.82Å; G2061-R2063 VanDerWaalsContact C-N 3.3Å; G2061-R2063 PolarHBondContact O-N 3.36Å
2062	C	79.8	Confident	84.9	Confident	99 Å²	99	47 Å²	47	67%	0.669	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.4	176	-64.8	0	0	0	0	115.2	K2058 F2060	K2058-C2062 PolarHBondContact O-N 3.48Å; K2058-C2062 VanDerWaalsContact O-N 3.1Å; K2058-C2062 PolarHBondContact O-SG 3.4Å; K2058-C2062 VanDerWaalsContact O-SG 3.42Å; F2060-C2062 PolarHBondContact O-N 2.72Å
2063	R	82.2	Confident	84.7	Confident	163 Å²	163	50.4 Å²	50.4	62%	0.615	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-5.3	179.1	73.2	169.3	-165.1	82.6	-0.2	114.4	F2060 G2061	F2060-R2063 HydrophobicContact CD2-CG 4.42Å; F2060-R2063 VanDerWaalsContact O-CG 3.3Å; F2060-R2063 WeakPolarHBondContact O-CG 3.41Å; F2060-R2063 PolarHBondContact O-N 3.29Å; G2061-R2063 VanDerWaalsContact C-N 3.3Å; G2061-R2063 PolarHBondContact O-N 3.36Å
2064	W	84	Confident	84.8	Confident	31 Å²	31	48.3 Å²	48.3	12%	0.117	26%	0.258	C	S	.	.			trans	-77.2	136.4	-172.4	173.9	49.7	0	0	0	111.4	F2060 G2066 T2067 A2071 M2087 L2095 P2118	F2060-W2064 HydrophobicContact CD1-CB 4.44Å; F2060-W2064 HydrophobicContact CE1-CB 3.97Å; F2060-W2064 HydrophobicContact CE1-CD2 4.35Å; F2060-W2064 AromaticContact CE1-CG 3.84Å; F2060-W2064 HydrophobicContact CE1-CG 3.84Å; F2060-W2064 HydrophobicContact CE2-CB 4.12Å; F2060-W2064 HydrophobicContact CE2-CG 4.36Å; F2060-W2064 HydrophobicContact CZ-CB 3.79Å; F2060-W2064 AromaticContact CZ-CD1 3.41Å; F2060-W2064 VanDerWaalsContact CZ-CD1 3.41Å; F2060-W2064 HydrophobicContact CZ-CD2 4.47Å; F2060-W2064 AromaticContact CZ-CG 3.62Å; F2060-W2064 HydrophobicContact CZ-CG 3.62Å; F2060-W2064 WeakPolarHBondContact O-CB 3.33Å; F2060-W2064 PolarHBondContact O-N 3.14Å; W2064-G2066 VanDerWaalsContact C-N 3.31Å; W2064-G2066 VanDerWaalsContact CE2-C 3.46Å; W2064-G2066 VanDerWaalsContact CE2-CA 3.48Å; W2064-G2066 VanDerWaalsContact CZ2-O 3.24Å; W2064-G2066 WeakPolarHBondContact CZ2-O 3.48Å; W2064-G2066 PolarHBondContact O-N 2.8Å; W2064-T2067 PolarHBondContact NE1-O 2.85Å; W2064-A2071 HydrophobicContact CZ2-CB 4.09Å; W2064-M2087 HydrophobicContact CH2-CE 3.88Å; W2064-M2087 HydrophobicContact CH2-SD 3.64Å; W2064-M2087 HydrophobicContact CZ2-CE 3.72Å; W2064-M2087 HydrophobicContact CZ2-SD 3.53Å; W2064-M2087 VanDerWaalsContact CZ2-SD 3.53Å; W2064-L2095 HydrophobicContact CH2-CD1 3.94Å; W2064-L2095 HydrophobicContact CZ3-CD1 4.49Å; W2064-P2118 HydrophobicContact CD2-CB 4.38Å; W2064-P2118 HydrophobicContact CE3-CB 3.54Å; W2064-P2118 HydrophobicContact CZ3-CB 3.72Å
2065	N	77.4	Confident	84.8	Confident	93 Å²	93	48 Å²	48	50%	0.497	26%	0.256	S	S	.	.			trans	-89.7	20.6	-176.4	64.5	11.1	0	0	0	114.9	T2067 E2070	N2065-T2067 PolarHBondContact O-N 3.15Å; N2065-T2067 VanDerWaalsContact O-N 3.16Å; N2065-T2067 WeakPolarHBondContact OD1-CB 3.21Å; N2065-T2067 VanDerWaalsContact OD1-CG2 3.32Å; N2065-T2067 WeakPolarHBondContact OD1-CG2 3.37Å; N2065-T2067 PolarHBondContact OD1-N 3.34Å; N2065-T2067 VanDerWaalsContact OD1-N 3.13Å; N2065-T2067 PolarHBondContact OD1-OG1 3.18Å; N2065-E2070 VanDerWaalsContact CG-CD 3.49Å; N2065-E2070 PolarHBondContact ND2-OE1 2.9Å; N2065-E2070 PolarHBondContact OD1-OE2 2.64Å
2066	G	77.4	Confident	84.4	Confident	22 Å²	22	49.5 Å²	49.5	23%	0.227	27%	0.272	C	S	.	.	S	Bend	trans	74.1	-8.3	-177.1	0	0	0	0	0	114.9	W2064 A2068	W2064-G2066 VanDerWaalsContact C-N 3.31Å; W2064-G2066 VanDerWaalsContact CE2-C 3.46Å; W2064-G2066 VanDerWaalsContact CE2-CA 3.48Å; W2064-G2066 VanDerWaalsContact CZ2-O 3.24Å; W2064-G2066 WeakPolarHBondContact CZ2-O 3.48Å; W2064-G2066 PolarHBondContact O-N 2.8Å; G2066-A2068 PolarHBondContact O-N 3.46Å
2067	T	80.9	Confident	84.3	Confident	63 Å²	63	54.4 Å²	54.4	39%	0.387	29%	0.292	S	S	.	.			trans	-78.1	127.9	-177.9	70.2	0	0	0	0	112.3	W2064 N2065 K2069 E2070 A2071	W2064-T2067 PolarHBondContact NE1-O 2.85Å; N2065-T2067 PolarHBondContact O-N 3.15Å; N2065-T2067 VanDerWaalsContact O-N 3.16Å; N2065-T2067 WeakPolarHBondContact OD1-CB 3.21Å; N2065-T2067 VanDerWaalsContact OD1-CG2 3.32Å; N2065-T2067 WeakPolarHBondContact OD1-CG2 3.37Å; N2065-T2067 PolarHBondContact OD1-N 3.34Å; N2065-T2067 VanDerWaalsContact OD1-N 3.13Å; N2065-T2067 PolarHBondContact OD1-OG1 3.18Å; T2067-K2069 PolarHBondContact O-N 2.84Å; T2067-K2069 VanDerWaalsContact O-N 3.07Å; T2067-E2070 PolarHBondContact O-N 3.41Å; T2067-E2070 VanDerWaalsContact O-N 3.15Å; T2067-A2071 PolarHBondContact O-N 3.15Å
2068	A	78.9	Confident	84	Confident	31 Å²	31	56.6 Å²	56.6	26%	0.256	30%	0.304	S	S	.	.	H	α-helix	trans	-54.8	-28.2	174.2	0	0	0	0	0	112.9	G2066 A2071 N2072 M2087	G2066-A2068 PolarHBondContact O-N 3.46Å; A2068-A2071 PolarHBondContact O-N 2.89Å; A2068-N2072 VanDerWaalsContact O-CB 3.29Å; A2068-N2072 WeakPolarHBondContact O-CB 3.38Å; A2068-N2072 PolarHBondContact O-N 2.8Å; A2068-N2072 PolarHBondContact O-ND2 2.85Å; A2068-N2072 PolarHBondContact O-OD1 3.15Å; A2068-M2087 HydrophobicContact CB-CE 3.71Å
2069	K	83.3	Confident	83.8	Confident	133 Å²	133	54.9 Å²	54.9	58%	0.578	30%	0.296	S	S	*	.	H	α-helix	trans	-61.6	-51	176.3	-177.7	-179.7	173.8	-66.4	0	112.1	T2067 A2071 N2072 E2073	T2067-K2069 PolarHBondContact O-N 2.84Å; T2067-K2069 VanDerWaalsContact O-N 3.07Å; K2069-A2071 VanDerWaalsContact C-N 3.34Å; K2069-A2071 PolarHBondContact O-N 2.77Å; K2069-N2072 PolarHBondContact O-N 2.86Å; K2069-E2073 VanDerWaalsContact CE-OE1 3.23Å; K2069-E2073 WeakPolarHBondContact CE-OE1 3.48Å; K2069-E2073 IonicContact NZ-OE1 3.74Å; K2069-E2073 PolarHBondContact NZ-OE1 2.66Å; K2069-E2073 IonicContact NZ-OE2 3.85Å; K2069-E2073 PolarHBondContact NZ-OE2 2.97Å; K2069-E2073 WeakPolarHBondContact O-CG 3.34Å; K2069-E2073 PolarHBondContact O-N 2.85Å
2070	E	83.1	Confident	83.7	Confident	58 Å²	58	59.3 Å²	59.3	27%	0.271	31%	0.312	S	S	.	.	H	α-helix	trans	-66.1	-37.1	178.6	-81.5	-173.7	-165.1	0	0	112.4	F2060 N2065 T2067 N2072 E2073 F2074	F2060-E2070 HydrophobicContact CZ-CB 4.39Å; N2065-E2070 VanDerWaalsContact CG-CD 3.49Å; N2065-E2070 PolarHBondContact ND2-OE1 2.9Å; N2065-E2070 PolarHBondContact OD1-OE2 2.64Å; T2067-E2070 PolarHBondContact O-N 3.41Å; T2067-E2070 VanDerWaalsContact O-N 3.15Å; E2070-N2072 VanDerWaalsContact C-N 3.33Å; E2070-E2073 PolarHBondContact O-N 2.98Å; E2070-F2074 WeakPolarHBondContact O-CB 3.01Å; E2070-F2074 PolarHBondContact O-N 3.15Å
2071	A	84.9	Confident	83.3	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-59.6	-46.6	173.6	0	0	0	0	0	110.6	F2060 W2064 T2067 A2068 K2069 E2073 F2074 F2075 M2087	F2060-A2071 HydrophobicContact CE1-CB 4.35Å; F2060-A2071 HydrophobicContact CZ-CB 4.45Å; W2064-A2071 HydrophobicContact CZ2-CB 4.09Å; T2067-A2071 PolarHBondContact O-N 3.15Å; A2068-A2071 PolarHBondContact O-N 2.89Å; K2069-A2071 VanDerWaalsContact C-N 3.34Å; K2069-A2071 PolarHBondContact O-N 2.77Å; A2071-E2073 PolarHBondContact O-N 2.92Å; A2071-F2074 PolarHBondContact O-N 2.89Å; A2071-F2075 HydrophobicContact CB-CD2 4.21Å; A2071-F2075 HydrophobicContact CB-CE2 4.35Å; A2071-F2075 VanDerWaalsContact O-CB 3.32Å; A2071-F2075 WeakPolarHBondContact O-CB 3.3Å; A2071-F2075 WeakPolarHBondContact O-CD2 3.45Å; A2071-F2075 PolarHBondContact O-N 3.22Å; A2071-M2087 HydrophobicContact CB-CB 4.06Å; A2071-M2087 HydrophobicContact CB-SD 3.59Å; A2071-M2087 VanDerWaalsContact CB-SD 3.59Å
2072	N	86.3	Confident	83.1	Confident	50 Å²	50	69.7 Å²	69.7	27%	0.267	35%	0.353	S	S	.	.	H	α-helix	trans	-70.6	-31	-178.4	-65.3	-9.3	0	0	0	112.8	A2068 K2069 E2070 G2076 Y2086 M2087	A2068-N2072 VanDerWaalsContact O-CB 3.29Å; A2068-N2072 WeakPolarHBondContact O-CB 3.38Å; A2068-N2072 PolarHBondContact O-N 2.8Å; A2068-N2072 PolarHBondContact O-ND2 2.85Å; A2068-N2072 PolarHBondContact O-OD1 3.15Å; K2069-N2072 PolarHBondContact O-N 2.86Å; E2070-N2072 VanDerWaalsContact C-N 3.33Å; N2072-G2076 WeakPolarHBondContact O-CA 3.44Å; N2072-G2076 PolarHBondContact O-N 2.81Å; N2072-Y2086 WeakPolarHBondContact OD1-CA 3.31Å; N2072-M2087 PolarHBondContact ND2-O 3.45Å; N2072-M2087 WeakPolarHBondContact OD1-CA 3.44Å; N2072-M2087 WeakPolarHBondContact OD1-CB 3.47Å; N2072-M2087 PolarHBondContact OD1-N 2.94Å; N2072-M2087 PolarHBondContact OD1-O 3.09Å
2073	E	86.2	Confident	83.1	Confident	107 Å²	107	66 Å²	66	50%	0.5	33%	0.332	S	S	.	.	H	α-helix	trans	-70.9	-39.4	172.3	-73.8	170.6	165.6	0	0	111.7	K2069 E2070 A2071 E2077	K2069-E2073 VanDerWaalsContact CE-OE1 3.23Å; K2069-E2073 WeakPolarHBondContact CE-OE1 3.48Å; K2069-E2073 IonicContact NZ-OE1 3.74Å; K2069-E2073 PolarHBondContact NZ-OE1 2.66Å; K2069-E2073 IonicContact NZ-OE2 3.85Å; K2069-E2073 PolarHBondContact NZ-OE2 2.97Å; K2069-E2073 WeakPolarHBondContact O-CG 3.34Å; K2069-E2073 PolarHBondContact O-N 2.85Å; E2070-E2073 PolarHBondContact O-N 2.98Å; A2071-E2073 PolarHBondContact O-N 2.92Å; E2073-E2077 PolarHBondContact O-N 2.82Å
2074	F	89.3	Confident	83.1	Confident	40 Å²	40	62 Å²	62	18%	0.175	33%	0.326	C	S	.	.	H	α-helix	trans	-69.4	-51.6	174.9	172.8	-104	0	0	0	112.6	A2056 I2057 F2060 E2070 A2071 G2076 E2077 L2078	A2056-F2074 HydrophobicContact CB-CZ 4.41Å; I2057-F2074 HydrophobicContact CG1-CE1 4.18Å; I2057-F2074 HydrophobicContact CG1-CZ 4.42Å; F2060-F2074 HydrophobicContact CB-CD1 3.95Å; F2060-F2074 HydrophobicContact CB-CD2 4.06Å; F2060-F2074 HydrophobicContact CB-CE1 3.65Å; F2060-F2074 HydrophobicContact CB-CE2 3.77Å; F2060-F2074 HydrophobicContact CB-CG 4.14Å; F2060-F2074 HydrophobicContact CB-CZ 3.56Å; F2060-F2074 HydrophobicContact CD1-CB 4.3Å; F2060-F2074 AromaticContact CD1-CD1 3.34Å; F2060-F2074 HydrophobicContact CD1-CD1 3.34Å; F2060-F2074 AromaticContact CD1-CE1 3.73Å; F2060-F2074 HydrophobicContact CD1-CE1 3.73Å; F2060-F2074 AromaticContact CD1-CG 3.82Å; F2060-F2074 HydrophobicContact CD1-CG 3.82Å; F2060-F2074 HydrophobicContact CD1-CZ 4.49Å; F2060-F2074 HydrophobicContact CD2-CB 3.86Å; F2060-F2074 HydrophobicContact CD2-CD1 4.03Å; F2060-F2074 AromaticContact CD2-CD2 3.82Å; F2060-F2074 HydrophobicContact CD2-CD2 3.82Å; F2060-F2074 HydrophobicContact CD2-CE2 4.4Å; F2060-F2074 AromaticContact CD2-CG 3.61Å; F2060-F2074 HydrophobicContact CD2-CG 3.61Å; F2060-F2074 HydrophobicContact CE1-CB 4.12Å; F2060-F2074 AromaticContact CE1-CD1 3.83Å; F2060-F2074 HydrophobicContact CE1-CD1 3.83Å; F2060-F2074 HydrophobicContact CE1-CG 4.14Å; F2060-F2074 HydrophobicContact CE2-CB 3.65Å; F2060-F2074 HydrophobicContact CE2-CD1 4.44Å; F2060-F2074 HydrophobicContact CE2-CD2 4.48Å; F2060-F2074 AromaticContact CE2-CG 3.95Å; F2060-F2074 HydrophobicContact CE2-CG 3.95Å; F2060-F2074 HydrophobicContact CG-CB 4.18Å; F2060-F2074 AromaticContact CG-CD1 3.47Å; F2060-F2074 HydrophobicContact CG-CD1 3.47Å; F2060-F2074 VanDerWaalsContact CG-CD1 3.47Å; F2060-F2074 AromaticContact CG-CD2 3.87Å; F2060-F2074 HydrophobicContact CG-CD2 3.87Å; F2060-F2074 AromaticContact CG-CE1 3.72Å; F2060-F2074 HydrophobicContact CG-CE1 3.72Å; F2060-F2074 HydrophobicContact CG-CE2 4.11Å; F2060-F2074 AromaticContact CG-CG 3.54Å; F2060-F2074 HydrophobicContact CG-CG 3.54Å; F2060-F2074 HydrophobicContact CG-CZ 4.04Å; F2060-F2074 HydrophobicContact CZ-CB 3.79Å; F2060-F2074 HydrophobicContact CZ-CD1 4.35Å; F2060-F2074 HydrophobicContact CZ-CG 4.2Å; E2070-F2074 WeakPolarHBondContact O-CB 3.01Å; E2070-F2074 PolarHBondContact O-N 3.15Å; A2071-F2074 PolarHBondContact O-N 2.89Å; F2074-G2076 VanDerWaalsContact C-N 3.34Å; F2074-G2076 PolarHBondContact O-N 3.19Å; F2074-E2077 PolarHBondContact O-N 3.17Å; F2074-L2078 HydrophobicContact CE1-CD2 4.02Å; F2074-L2078 HydrophobicContact CZ-CD2 4.13Å; F2074-L2078 WeakPolarHBondContact O-CB 3.38Å; F2074-L2078 PolarHBondContact O-N 3.07Å
2075	F	88.6	Confident	83.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-69	-32.2	-179.2	-75	-56.1	0	0	0	112.9	I2057 A2071 E2077 L2078 F2079 L2085 Y2097 L2117 P2118	I2057-F2075 HydrophobicContact CG1-CE1 4.27Å; I2057-F2075 HydrophobicContact CG2-CE1 4.21Å; I2057-F2075 HydrophobicContact CG2-CZ 4.2Å; A2071-F2075 HydrophobicContact CB-CD2 4.21Å; A2071-F2075 HydrophobicContact CB-CE2 4.35Å; A2071-F2075 VanDerWaalsContact O-CB 3.32Å; A2071-F2075 WeakPolarHBondContact O-CB 3.3Å; A2071-F2075 WeakPolarHBondContact O-CD2 3.45Å; A2071-F2075 PolarHBondContact O-N 3.22Å; F2075-E2077 VanDerWaalsContact C-N 3.32Å; F2075-E2077 PolarHBondContact O-N 3.4Å; F2075-L2078 HydrophobicContact CD1-CD2 4.24Å; F2075-L2078 HydrophobicContact CE1-CD2 4.43Å; F2075-L2078 PolarHBondContact O-N 3.19Å; F2075-F2079 HydrophobicContact CD1-CD2 4.17Å; F2075-F2079 AromaticContact CD1-CE2 3.86Å; F2075-F2079 HydrophobicContact CD1-CE2 3.86Å; F2075-F2079 HydrophobicContact CE1-CE2 4.38Å; F2075-F2079 PolarHBondContact O-N 2.84Å; F2075-L2085 HydrophobicContact CB-CB 4.27Å; F2075-L2085 HydrophobicContact CB-CD2 3.76Å; F2075-L2085 HydrophobicContact CB-CG 3.93Å; F2075-L2085 HydrophobicContact CD1-CD2 3.59Å; F2075-L2085 HydrophobicContact CD2-CD2 4.32Å; F2075-L2085 HydrophobicContact CE1-CD2 4.25Å; F2075-L2085 HydrophobicContact CG-CD2 3.63Å; F2075-L2085 HydrophobicContact CG-CG 4.21Å; F2075-Y2097 HydrophobicContact CD2-CE1 4.08Å; F2075-Y2097 HydrophobicContact CE2-CD1 4.41Å; F2075-Y2097 AromaticContact CE2-CE1 3.55Å; F2075-Y2097 HydrophobicContact CE2-CE1 3.55Å; F2075-Y2097 HydrophobicContact CZ-CE1 4.18Å; F2075-L2117 HydrophobicContact CE1-CD2 4.07Å; F2075-L2117 HydrophobicContact CZ-CD2 3.95Å; F2075-P2118 HydrophobicContact CE2-CG 4.5Å; F2075-P2118 HydrophobicContact CZ-CG 4.24Å
2076	G	83.6	Confident	83.4	Confident	32 Å²	32	60.1 Å²	60.1	33%	0.33	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-36.1	172.7	0	0	0	0	0	113	N2072 F2074 K2080	N2072-G2076 WeakPolarHBondContact O-CA 3.44Å; N2072-G2076 PolarHBondContact O-N 2.81Å; F2074-G2076 VanDerWaalsContact C-N 3.34Å; F2074-G2076 PolarHBondContact O-N 3.19Å; G2076-K2080 WeakPolarHBondContact O-CB 3.46Å; G2076-K2080 PolarHBondContact O-N 2.86Å
2077	E	85.2	Confident	83.8	Confident	121 Å²	121	59.3 Å²	59.3	57%	0.565	30%	0.303	S	S	*	.	H	α-helix	trans	-77.1	-39.1	171.9	-96.2	-69.8	140.6	0	0	112.8	E2073 F2074 F2075 K2080	E2073-E2077 PolarHBondContact O-N 2.82Å; F2074-E2077 PolarHBondContact O-N 3.17Å; F2075-E2077 VanDerWaalsContact C-N 3.32Å; F2075-E2077 PolarHBondContact O-N 3.4Å; E2077-K2080 VanDerWaalsContact O-CD 3.3Å; E2077-K2080 WeakPolarHBondContact O-CD 3.36Å; E2077-K2080 WeakPolarHBondContact O-CE 3.31Å; E2077-K2080 WeakPolarHBondContact O-CG 3.19Å; E2077-K2080 IonicContact OE1-NZ 3.19Å; E2077-K2080 IonicContact OE2-NZ 2.8Å; E2077-K2080 PolarHBondContact OE2-NZ 2.91Å
2078	L	85.2	Confident	83.8	Confident	49 Å²	49	58 Å²	58	26%	0.257	30%	0.297	S	S	.	.	H	α-helix	trans	-66.1	-39.9	-177.3	-174.6	63.5	0	0	0	112.9	E2053 I2057 F2074 F2075	E2053-L2078 HydrophobicContact CG-CD1 4.4Å; I2057-L2078 HydrophobicContact CD1-CD2 3.91Å; I2057-L2078 HydrophobicContact CG1-CD2 3.57Å; F2074-L2078 HydrophobicContact CE1-CD2 4.02Å; F2074-L2078 HydrophobicContact CZ-CD2 4.13Å; F2074-L2078 WeakPolarHBondContact O-CB 3.38Å; F2074-L2078 PolarHBondContact O-N 3.07Å; F2075-L2078 HydrophobicContact CD1-CD2 4.24Å; F2075-L2078 HydrophobicContact CE1-CD2 4.43Å; F2075-L2078 PolarHBondContact O-N 3.19Å
2079	F	84.9	Confident	83.5	Confident	9 Å²	9	61.7 Å²	61.7	4%	0.039	31%	0.312	C	S	.	.	S	Bend	trans	-106.2	6.1	-175.4	-68.4	-71.1	0	0	0	115	F2075 D2081 R2082 G2083 L2085 F2099 F2101 F2111	F2075-F2079 HydrophobicContact CD1-CD2 4.17Å; F2075-F2079 AromaticContact CD1-CE2 3.86Å; F2075-F2079 HydrophobicContact CD1-CE2 3.86Å; F2075-F2079 HydrophobicContact CE1-CE2 4.38Å; F2075-F2079 PolarHBondContact O-N 2.84Å; F2079-D2081 PolarHBondContact O-N 3.33Å; F2079-R2082 PolarHBondContact O-N 2.99Å; F2079-G2083 CarbonylContact C-O 3.47Å; F2079-G2083 PolarHBondContact O-N 3.38Å; F2079-L2085 HydrophobicContact CD2-CB 4.14Å; F2079-L2085 HydrophobicContact CD2-CD2 3.6Å; F2079-L2085 HydrophobicContact CE2-CD2 3.56Å; F2079-F2099 HydrophobicContact CE2-CE1 4.3Å; F2079-F2099 HydrophobicContact CZ-CE1 4.31Å; F2079-F2101 HydrophobicContact CB-CE1 3.97Å; F2079-F2101 HydrophobicContact CB-CZ 3.72Å; F2079-F2101 HydrophobicContact CD1-CE2 4.19Å; F2079-F2101 AromaticContact CD1-CZ 3.63Å; F2079-F2101 HydrophobicContact CD1-CZ 3.63Å; F2079-F2101 HydrophobicContact CE1-CZ 4.38Å; F2079-F2101 HydrophobicContact CG-CE1 4.37Å; F2079-F2101 AromaticContact CG-CZ 3.71Å; F2079-F2101 HydrophobicContact CG-CZ 3.71Å; F2079-F2111 HydrophobicContact CZ-CE2 4.47Å; F2079-F2111 AromaticContact CZ-CZ 3.96Å; F2079-F2111 HydrophobicContact CZ-CZ 3.96Å
2080	K	83.3	Confident	82.6	Confident	112 Å²	112	57.7 Å²	57.7	49%	0.487	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46	-38	-173.1	63.3	-166.3	168.5	-168.1	0	115.9	G2076 E2077 R2082	G2076-K2080 WeakPolarHBondContact O-CB 3.46Å; G2076-K2080 PolarHBondContact O-N 2.86Å; E2077-K2080 VanDerWaalsContact O-CD 3.3Å; E2077-K2080 WeakPolarHBondContact O-CD 3.36Å; E2077-K2080 WeakPolarHBondContact O-CE 3.31Å; E2077-K2080 WeakPolarHBondContact O-CG 3.19Å; E2077-K2080 IonicContact OE1-NZ 3.19Å; E2077-K2080 IonicContact OE2-NZ 2.8Å; E2077-K2080 PolarHBondContact OE2-NZ 2.91Å; K2080-R2082 VanDerWaalsContact C-N 3.31Å; K2080-R2082 PolarHBondContact O-N 3.49Å
2081	D	81.3	Confident	81.6	Confident	152 Å²	152	58.1 Å²	58.1	81%	0.813	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-9.5	-176.5	-62.7	-58.2	0	0	0	113.4	F2079	F2079-D2081 PolarHBondContact O-N 3.33Å
2082	R	79.1	Confident	80.5	Confident	98 Å²	98	63.1 Å²	63.1	37%	0.37	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-36.1	177.8	-69	177.9	62.7	-179.5	4.5	113.3	F2079 K2080 F2101 Q2102 E2107	F2079-R2082 PolarHBondContact O-N 2.99Å; K2080-R2082 VanDerWaalsContact C-N 3.31Å; K2080-R2082 PolarHBondContact O-N 3.49Å; R2082-F2101 HydrophobicContact CB-CD2 3.82Å; R2082-F2101 HydrophobicContact CB-CE2 3.83Å; R2082-F2101 HydrophobicContact CB-CG 4.25Å; R2082-F2101 HydrophobicContact CB-CZ 4.26Å; R2082-F2101 WeakPolarHBondContact O-CB 3.29Å; R2082-Q2102 PolarHBondContact NH2-O 3.26Å; R2082-E2107 IonicContact CZ-OE1 2.74Å; R2082-E2107 IonicContact CZ-OE2 2.9Å; R2082-E2107 IonicContact NH1-OE1 3.94Å; R2082-E2107 PolarHBondContact NH1-OE1 3.22Å; R2082-E2107 IonicContact NH1-OE2 3.78Å; R2082-E2107 PolarHBondContact NH1-OE2 3.25Å; R2082-E2107 IonicContact NH2-OE1 3.59Å; R2082-E2107 PolarHBondContact NH2-OE1 2.9Å; R2082-E2107 IonicContact NH2-OE2 2.74Å; R2082-E2107 PolarHBondContact NH2-OE2 3.15Å
2083	G	81	Confident	79.7	Confident	22 Å²	22	62.6 Å²	62.6	23%	0.227	36%	0.358	C	S	.	.			trans	160.1	-165.7	177.8	0	0	0	0	0	112.3	F2079 F2101	F2079-G2083 CarbonylContact C-O 3.47Å; F2079-G2083 PolarHBondContact O-N 3.38Å; G2083-F2101 VanDerWaalsContact CA-CD1 3.5Å
2084	V	81.4	Confident	79.3	Confident	80 Å²	80	59.6 Å²	59.6	49%	0.485	35%	0.347	S	S	.	.			trans	-90.9	129.8	177.9	-176	0	0	0	0	109.3	Y2086 I2100	V2084-Y2086 HydrophobicContact CG1-CD1 4.22Å; V2084-I2100 HydrophobicContact CB-CB 4.37Å; V2084-I2100 HydrophobicContact CB-CD1 3.81Å; V2084-I2100 HydrophobicContact CB-CG1 4.05Å; V2084-I2100 HydrophobicContact CG1-CD1 4.11Å; V2084-I2100 WeakPolarHBondContact O-CG1 3.4Å; V2084-I2100 PolarHBondContact O-N 3.06Å
2085	L	87.2	Confident	79	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.4	159.6	169.2	57.6	0	0	0	107.8	F2075 F2079 Y2097 D2098 F2099 F2101	F2075-L2085 HydrophobicContact CB-CB 4.27Å; F2075-L2085 HydrophobicContact CB-CD2 3.76Å; F2075-L2085 HydrophobicContact CB-CG 3.93Å; F2075-L2085 HydrophobicContact CD1-CD2 3.59Å; F2075-L2085 HydrophobicContact CD2-CD2 4.32Å; F2075-L2085 HydrophobicContact CE1-CD2 4.25Å; F2075-L2085 HydrophobicContact CG-CD2 3.63Å; F2075-L2085 HydrophobicContact CG-CG 4.21Å; F2079-L2085 HydrophobicContact CD2-CB 4.14Å; F2079-L2085 HydrophobicContact CD2-CD2 3.6Å; F2079-L2085 HydrophobicContact CE2-CD2 3.56Å; L2085-Y2097 HydrophobicContact CD1-CD1 4.26Å; L2085-D2098 WeakPolarHBondContact CA-O 3.23Å; L2085-D2098 WeakPolarHBondContact CD1-O 3.18Å; L2085-F2099 HydrophobicContact CB-CD1 4.43Å; L2085-F2099 HydrophobicContact CD1-CD1 3.99Å; L2085-F2099 HydrophobicContact CD1-CD2 3.63Å; L2085-F2099 HydrophobicContact CD1-CE1 4.02Å; L2085-F2099 HydrophobicContact CD1-CE2 3.64Å; L2085-F2099 HydrophobicContact CD1-CG 3.8Å; L2085-F2099 HydrophobicContact CD1-CZ 3.85Å; L2085-F2099 HydrophobicContact CD2-CD1 4.25Å; L2085-F2099 HydrophobicContact CD2-CE1 3.63Å; L2085-F2099 HydrophobicContact CD2-CE2 4.29Å; L2085-F2099 HydrophobicContact CD2-CZ 3.66Å; L2085-F2099 HydrophobicContact CG-CD1 4.46Å; L2085-F2099 HydrophobicContact CG-CE1 4.3Å; L2085-F2099 HydrophobicContact CG-CZ 4.39Å; L2085-F2101 HydrophobicContact CB-CE1 4.34Å
2086	Y	80.7	Confident	78.8	Confident	82 Å²	82	62.3 Å²	62.3	32%	0.322	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.5	165.5	62.6	-89.6	0	0	0	111.8	N2072 V2084 D2098 I2100	N2072-Y2086 WeakPolarHBondContact OD1-CA 3.31Å; V2084-Y2086 HydrophobicContact CG1-CD1 4.22Å; Y2086-D2098 HydrophobicContact CD1-CB 4.12Å; Y2086-D2098 HydrophobicContact CD2-CB 3.91Å; Y2086-D2098 HydrophobicContact CE1-CB 3.67Å; Y2086-D2098 HydrophobicContact CE2-CB 3.43Å; Y2086-D2098 VanDerWaalsContact CE2-CB 3.43Å; Y2086-D2098 VanDerWaalsContact CE2-CG 3.5Å; Y2086-D2098 WeakPolarHBondContact CE2-OD2 3.46Å; Y2086-D2098 HydrophobicContact CG-CB 4.22Å; Y2086-D2098 PolarHBondContact N-O 2.6Å; Y2086-D2098 PolarHBondContact O-N 3.27Å; Y2086-D2098 WeakPolarHBondContact OH-CB 3.2Å; Y2086-I2100 HydrophobicContact CD1-CD1 4.2Å; Y2086-I2100 HydrophobicContact CD1-CG1 4.35Å; Y2086-I2100 HydrophobicContact CE1-CD1 3.75Å; Y2086-I2100 HydrophobicContact CE1-CG1 3.91Å
2087	M	85.6	Confident	79.1	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.025	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	135.5	161.7	-167.4	-164.1	115.6	0	0	109.3	W2064 A2068 A2071 N2072 L2095 R2096 Y2097	W2064-M2087 HydrophobicContact CH2-CE 3.88Å; W2064-M2087 HydrophobicContact CH2-SD 3.64Å; W2064-M2087 HydrophobicContact CZ2-CE 3.72Å; W2064-M2087 HydrophobicContact CZ2-SD 3.53Å; W2064-M2087 VanDerWaalsContact CZ2-SD 3.53Å; A2068-M2087 HydrophobicContact CB-CE 3.71Å; A2071-M2087 HydrophobicContact CB-CB 4.06Å; A2071-M2087 HydrophobicContact CB-SD 3.59Å; A2071-M2087 VanDerWaalsContact CB-SD 3.59Å; N2072-M2087 PolarHBondContact ND2-O 3.45Å; N2072-M2087 WeakPolarHBondContact OD1-CA 3.44Å; N2072-M2087 WeakPolarHBondContact OD1-CB 3.47Å; N2072-M2087 PolarHBondContact OD1-N 2.94Å; N2072-M2087 PolarHBondContact OD1-O 3.09Å; M2087-L2095 HydrophobicContact CE-CD1 4Å; M2087-L2095 HydrophobicContact CE-CD2 3.91Å; M2087-L2095 HydrophobicContact CE-CG 4.44Å; M2087-L2095 HydrophobicContact SD-CD1 4.12Å; M2087-R2096 CarbonylContact C-O 3.52Å; M2087-R2096 VanDerWaalsContact CA-O 3.27Å; M2087-R2096 WeakPolarHBondContact CA-O 3.21Å; M2087-Y2097 HydrophobicContact CB-CD1 3.93Å; M2087-Y2097 HydrophobicContact CB-CE1 3.63Å; M2087-Y2097 HydrophobicContact CG-CD1 4.08Å; M2087-Y2097 HydrophobicContact CG-CE1 3.58Å; M2087-Y2097 HydrophobicContact CG-CE2 4.49Å; M2087-Y2097 HydrophobicContact SD-CE1 4.24Å
2088	S	80.1	Confident	79	Confident	36 Å²	36	55.4 Å²	55.4	25%	0.252	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139	165.7	59.2	0	0	0	0	110.7	R2096 D2098	S2088-R2096 PolarHBondContact N-O 3.39Å; S2088-R2096 PolarHBondContact O-N 2.68Å; S2088-D2098 PolarHBondContact OG-OD2 3.01Å
2089	D	73	Confident	79.2	Confident	107 Å²	107	53 Å²	53	57%	0.572	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	122.7	165.6	177.2	16.6	0	0	0	108.3	G2091 L2095	D2089-G2091 VanDerWaalsContact C-N 3.32Å; D2089-G2091 PolarHBondContact OD1-N 3.47Å; D2089-L2095 HydrophobicContact CB-CD2 4.31Å
2090	S	64.1	Low	79.1	Confident	49 Å²	49	55.1 Å²	55.1	34%	0.343	31%	0.314	S	S	.	.			trans	-80.4	-13.7	177.8	64.1	0	0	0	0	113.2	T2092 V2094	S2090-T2092 PolarHBondContact O-N 2.88Å; S2090-T2092 PolarHBondContact OG-N 3.14Å; S2090-T2092 PolarHBondContact OG-OG1 2.93Å; S2090-V2094 PolarHBondContact OG-O 3.11Å
2091	G	62.1	Low	79.1	Confident	67 Å²	67	50.5 Å²	50.5	69%	0.691	30%	0.295	S	S	*	.	S	Bend	trans	74.1	6.4	-168.9	0	0	0	0	0	114.1	D2089	D2089-G2091 VanDerWaalsContact C-N 3.32Å; D2089-G2091 PolarHBondContact OD1-N 3.47Å
2092	T	63	Low	79.1	Confident	105 Å²	105	48.4 Å²	48.4	64%	0.644	28%	0.28	S	S	*	.	S	Bend	trans	-102.3	3.5	-174.2	68.5	0	0	0	0	115.1	S2090 V2094	S2090-T2092 PolarHBondContact O-N 2.88Å; S2090-T2092 PolarHBondContact OG-N 3.14Å; S2090-T2092 PolarHBondContact OG-OG1 2.93Å; T2092-V2094 VanDerWaalsContact C-N 3.31Å
2093	G	69.6	Low	79.5	Confident	40 Å²	40	44.5 Å²	44.5	41%	0.412	27%	0.266	S	S	.	.	S	Bend	trans	80.2	13.3	-169.8	0	0	0	0	0	113.9	G2124	G2093-G2124 PolarHBondContact O-N 3.47Å; G2093-G2124 VanDerWaalsContact O-N 3.11Å
2094	V	76.5	Confident	79.6	Confident	43 Å²	43	46.9 Å²	46.9	26%	0.261	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	126.1	174.8	-177	0	0	0	0	109.2	S2090 T2092 G2124 E2126	S2090-V2094 PolarHBondContact OG-O 3.11Å; T2092-V2094 VanDerWaalsContact C-N 3.31Å; V2094-G2124 WeakPolarHBondContact CA-O 3.36Å; V2094-E2126 HydrophobicContact CG1-CB 4.19Å; V2094-E2126 HydrophobicContact CG1-CG 4.03Å
2095	L	83.1	Confident	79.5	Confident	10 Å²	10	50.1 Å²	50.1	5%	0.052	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	133.6	172.9	-59	-176.9	0	0	0	110.5	W2064 M2087 D2089 Y2097 I2123 G2124 F2125 E2126	W2064-L2095 HydrophobicContact CH2-CD1 3.94Å; W2064-L2095 HydrophobicContact CZ3-CD1 4.49Å; M2087-L2095 HydrophobicContact CE-CD1 4Å; M2087-L2095 HydrophobicContact CE-CD2 3.91Å; M2087-L2095 HydrophobicContact CE-CG 4.44Å; M2087-L2095 HydrophobicContact SD-CD1 4.12Å; D2089-L2095 HydrophobicContact CB-CD2 4.31Å; L2095-Y2097 HydrophobicContact CB-CE2 4.45Å; L2095-I2123 HydrophobicContact CD1-CG2 4.31Å; L2095-I2123 HydrophobicContact CD2-CG2 4.38Å; L2095-I2123 HydrophobicContact CG-CG2 3.77Å; L2095-G2124 PolarHBondContact N-O 2.86Å; L2095-F2125 HydrophobicContact CB-CB 4.31Å; L2095-F2125 CarbonylContact O-C 3.59Å; L2095-F2125 WeakPolarHBondContact O-CA 3.42Å; L2095-F2125 WeakPolarHBondContact O-CB 3.46Å; L2095-E2126 PolarHBondContact O-N 2.89Å
2096	R	84.3	Confident	79.3	Confident	87 Å²	87	52.3 Å²	52.3	33%	0.328	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.7	175.3	177.4	176.9	-63.2	-170.4	-4.6	110.4	M2087 S2088 D2098 E2126 H2128	M2087-R2096 CarbonylContact C-O 3.52Å; M2087-R2096 VanDerWaalsContact CA-O 3.27Å; M2087-R2096 WeakPolarHBondContact CA-O 3.21Å; S2088-R2096 PolarHBondContact N-O 3.39Å; S2088-R2096 PolarHBondContact O-N 2.68Å; R2096-D2098 WeakPolarHBondContact CD-OD2 3.27Å; R2096-D2098 WeakPolarHBondContact CG-OD2 3.3Å; R2096-E2126 HydrophobicContact CB-CG 3.98Å; R2096-E2126 HydrophobicContact CG-CG 4.17Å; R2096-E2126 IonicContact CZ-OE1 3.46Å; R2096-E2126 IonicContact NE-OE1 2.56Å; R2096-E2126 PolarHBondContact NE-OE1 2.98Å; R2096-E2126 IonicContact NH2-OE1 2.72Å; R2096-E2126 PolarHBondContact NH2-OE1 3.03Å; R2096-H2128 HydrophobicContact CG-CB 4.34Å
2097	Y	89.6	Confident	79.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	101	170.9	-74.8	-76.6	0	0	0	109.9	F2075 L2085 M2087 L2095 F2099 L2117 P2118 F2125 E2126 H2128	F2075-Y2097 HydrophobicContact CD2-CE1 4.08Å; F2075-Y2097 HydrophobicContact CE2-CD1 4.41Å; F2075-Y2097 AromaticContact CE2-CE1 3.55Å; F2075-Y2097 HydrophobicContact CE2-CE1 3.55Å; F2075-Y2097 HydrophobicContact CZ-CE1 4.18Å; L2085-Y2097 HydrophobicContact CD1-CD1 4.26Å; M2087-Y2097 HydrophobicContact CB-CD1 3.93Å; M2087-Y2097 HydrophobicContact CB-CE1 3.63Å; M2087-Y2097 HydrophobicContact CG-CD1 4.08Å; M2087-Y2097 HydrophobicContact CG-CE1 3.58Å; M2087-Y2097 HydrophobicContact CG-CE2 4.49Å; M2087-Y2097 HydrophobicContact SD-CE1 4.24Å; L2095-Y2097 HydrophobicContact CB-CE2 4.45Å; Y2097-F2099 WeakPolarHBondContact O-CD2 3.35Å; Y2097-L2117 HydrophobicContact CD2-CB 4.45Å; Y2097-L2117 HydrophobicContact CD2-CD1 3.77Å; Y2097-L2117 HydrophobicContact CE2-CB 3.97Å; Y2097-L2117 HydrophobicContact CE2-CD1 4.14Å; Y2097-L2117 HydrophobicContact CG-CD1 3.98Å; Y2097-P2118 PolarHBondContact OH-O 3.47Å; Y2097-F2125 HydrophobicContact CD2-CB 4.17Å; Y2097-F2125 HydrophobicContact CD2-CD2 4.26Å; Y2097-F2125 HydrophobicContact CE2-CB 4.15Å; Y2097-E2126 PolarHBondContact N-O 3.24Å; Y2097-H2128 PolarHBondContact O-N 2.85Å
2098	D	84.3	Confident	79.5	Confident	8 Å²	8	52.1 Å²	52.1	4%	0.043	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	105.8	179.6	-72	-77.9	0	0	0	110.8	L2085 Y2086 S2088 R2096 H2128	L2085-D2098 WeakPolarHBondContact CA-O 3.23Å; L2085-D2098 WeakPolarHBondContact CD1-O 3.18Å; Y2086-D2098 HydrophobicContact CD1-CB 4.12Å; Y2086-D2098 HydrophobicContact CD2-CB 3.91Å; Y2086-D2098 HydrophobicContact CE1-CB 3.67Å; Y2086-D2098 HydrophobicContact CE2-CB 3.43Å; Y2086-D2098 VanDerWaalsContact CE2-CB 3.43Å; Y2086-D2098 VanDerWaalsContact CE2-CG 3.5Å; Y2086-D2098 WeakPolarHBondContact CE2-OD2 3.46Å; Y2086-D2098 HydrophobicContact CG-CB 4.22Å; Y2086-D2098 PolarHBondContact N-O 2.6Å; Y2086-D2098 PolarHBondContact O-N 3.27Å; Y2086-D2098 WeakPolarHBondContact OH-CB 3.2Å; S2088-D2098 PolarHBondContact OG-OD2 3.01Å; R2096-D2098 WeakPolarHBondContact CD-OD2 3.27Å; R2096-D2098 WeakPolarHBondContact CG-OD2 3.3Å; D2098-H2128 CarbonylContact C-O 3.53Å; D2098-H2128 WeakPolarHBondContact CA-O 3.49Å; D2098-H2128 IonicContact OD1-CE1 3.97Å; D2098-H2128 IonicContact OD1-CG 3.89Å; D2098-H2128 IonicContact OD1-ND1 3.16Å; D2098-H2128 PolarHBondContact OD1-ND1 3.42Å
2099	F	88.2	Confident	79.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	107.8	174.9	-69.9	-102.9	0	0	0	109.9	F2079 L2085 Y2097 F2101 L2103 F2111 L2127 H2128 V2129 L2130	F2079-F2099 HydrophobicContact CE2-CE1 4.3Å; F2079-F2099 HydrophobicContact CZ-CE1 4.31Å; L2085-F2099 HydrophobicContact CB-CD1 4.43Å; L2085-F2099 HydrophobicContact CD1-CD1 3.99Å; L2085-F2099 HydrophobicContact CD1-CD2 3.63Å; L2085-F2099 HydrophobicContact CD1-CE1 4.02Å; L2085-F2099 HydrophobicContact CD1-CE2 3.64Å; L2085-F2099 HydrophobicContact CD1-CG 3.8Å; L2085-F2099 HydrophobicContact CD1-CZ 3.85Å; L2085-F2099 HydrophobicContact CD2-CD1 4.25Å; L2085-F2099 HydrophobicContact CD2-CE1 3.63Å; L2085-F2099 HydrophobicContact CD2-CE2 4.29Å; L2085-F2099 HydrophobicContact CD2-CZ 3.66Å; L2085-F2099 HydrophobicContact CG-CD1 4.46Å; L2085-F2099 HydrophobicContact CG-CE1 4.3Å; L2085-F2099 HydrophobicContact CG-CZ 4.39Å; Y2097-F2099 WeakPolarHBondContact O-CD2 3.35Å; F2099-F2101 AromaticContact CD1-CE1 3.98Å; F2099-F2101 HydrophobicContact CD1-CE1 3.98Å; F2099-F2101 HydrophobicContact CD1-CE2 4.1Å; F2099-F2101 AromaticContact CD1-CZ 3.59Å; F2099-F2101 HydrophobicContact CD1-CZ 3.59Å; F2099-F2101 HydrophobicContact CE1-CZ 4.22Å; F2099-F2101 PolarHBondContact O-N 3.43Å; F2099-L2103 HydrophobicContact CD1-CD1 3.93Å; F2099-L2103 HydrophobicContact CD1-CD2 3.69Å; F2099-L2103 HydrophobicContact CD1-CG 3.95Å; F2099-L2103 HydrophobicContact CD2-CD1 4.19Å; F2099-L2103 HydrophobicContact CE1-CD1 3.94Å; F2099-L2103 HydrophobicContact CE1-CD2 3.75Å; F2099-L2103 HydrophobicContact CE1-CG 4.26Å; F2099-L2103 HydrophobicContact CE2-CD1 4.22Å; F2099-L2103 HydrophobicContact CG-CD1 4.06Å; F2099-L2103 HydrophobicContact CG-CG 4.29Å; F2099-L2103 HydrophobicContact CZ-CD1 4.09Å; F2099-F2111 HydrophobicContact CE1-CE2 4.08Å; F2099-F2111 HydrophobicContact CZ-CD2 4.02Å; F2099-F2111 AromaticContact CZ-CE2 3.97Å; F2099-F2111 HydrophobicContact CZ-CE2 3.97Å; F2099-L2127 HydrophobicContact CD2-CD1 4.46Å; F2099-L2127 HydrophobicContact CD2-CG 4.16Å; F2099-L2127 HydrophobicContact CE2-CD1 3.61Å; F2099-L2127 HydrophobicContact CE2-CD2 4.33Å; F2099-L2127 HydrophobicContact CE2-CG 3.78Å; F2099-L2127 HydrophobicContact CZ-CD1 4.31Å; F2099-H2128 PolarHBondContact N-O 3.21Å; F2099-V2129 HydrophobicContact CB-CG2 4.44Å; F2099-L2130 PolarHBondContact O-N 3.44Å
2100	I	83.8	Confident	80.3	Confident	52 Å²	52	46.9 Å²	46.9	27%	0.267	28%	0.275	S	S	.	.	S	Bend	trans	-82.8	38.6	175.4	-32.5	-177.2	0	0	0	112	V2084 Y2086 L2130 V2132	V2084-I2100 HydrophobicContact CB-CB 4.37Å; V2084-I2100 HydrophobicContact CB-CD1 3.81Å; V2084-I2100 HydrophobicContact CB-CG1 4.05Å; V2084-I2100 HydrophobicContact CG1-CD1 4.11Å; V2084-I2100 WeakPolarHBondContact O-CG1 3.4Å; V2084-I2100 PolarHBondContact O-N 3.06Å; Y2086-I2100 HydrophobicContact CD1-CD1 4.2Å; Y2086-I2100 HydrophobicContact CD1-CG1 4.35Å; Y2086-I2100 HydrophobicContact CE1-CD1 3.75Å; Y2086-I2100 HydrophobicContact CE1-CG1 3.91Å; I2100-L2130 CarbonylContact C-O 3.6Å; I2100-V2132 HydrophobicContact CG2-CB 4.23Å; I2100-V2132 HydrophobicContact CG2-CG1 3.42Å; I2100-V2132 VanDerWaalsContact CG2-CG1 3.42Å; I2100-V2132 HydrophobicContact CG2-CG2 3.74Å
2101	F	83.8	Confident	81.5	Confident	16 Å²	16	45 Å²	45	7%	0.07	26%	0.261	C	S	.	.	S	Bend	trans	-162.5	159	176	59.9	-85.6	0	0	0	109.9	F2079 R2082 G2083 L2085 F2099 L2103 V2129	F2079-F2101 HydrophobicContact CB-CE1 3.97Å; F2079-F2101 HydrophobicContact CB-CZ 3.72Å; F2079-F2101 HydrophobicContact CD1-CE2 4.19Å; F2079-F2101 AromaticContact CD1-CZ 3.63Å; F2079-F2101 HydrophobicContact CD1-CZ 3.63Å; F2079-F2101 HydrophobicContact CE1-CZ 4.38Å; F2079-F2101 HydrophobicContact CG-CE1 4.37Å; F2079-F2101 AromaticContact CG-CZ 3.71Å; F2079-F2101 HydrophobicContact CG-CZ 3.71Å; R2082-F2101 HydrophobicContact CB-CD2 3.82Å; R2082-F2101 HydrophobicContact CB-CE2 3.83Å; R2082-F2101 HydrophobicContact CB-CG 4.25Å; R2082-F2101 HydrophobicContact CB-CZ 4.26Å; R2082-F2101 WeakPolarHBondContact O-CB 3.29Å; G2083-F2101 VanDerWaalsContact CA-CD1 3.5Å; L2085-F2101 HydrophobicContact CB-CE1 4.34Å; F2099-F2101 AromaticContact CD1-CE1 3.98Å; F2099-F2101 HydrophobicContact CD1-CE1 3.98Å; F2099-F2101 HydrophobicContact CD1-CE2 4.1Å; F2099-F2101 AromaticContact CD1-CZ 3.59Å; F2099-F2101 HydrophobicContact CD1-CZ 3.59Å; F2099-F2101 HydrophobicContact CE1-CZ 4.22Å; F2099-F2101 PolarHBondContact O-N 3.43Å; F2101-L2103 HydrophobicContact CE2-CD2 3.91Å; F2101-V2129 WeakPolarHBondContact O-CG1 3.44Å
2102	Q	81.3	Confident	82.4	Confident	108 Å²	108	44.9 Å²	44.9	51%	0.505	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-71.9	132.7	179	-74.4	-74.5	22.3	0	0	112.3	R2082 D2131	R2082-Q2102 PolarHBondContact NH2-O 3.26Å; Q2102-D2131 HydrophobicContact CG-CB 4.08Å; Q2102-D2131 WeakPolarHBondContact CG-OD2 3.47Å; Q2102-D2131 PolarHBondContact NE2-OD2 2.57Å
2103	L	86.2	Confident	83.3	Confident	16 Å²	16	45.8 Å²	45.8	8%	0.084	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-88.3	157.5	167	-70	-179.4	0	0	0	110.6	F2099 F2101 E2107 V2108 F2111 L2127 V2129	F2099-L2103 HydrophobicContact CD1-CD1 3.93Å; F2099-L2103 HydrophobicContact CD1-CD2 3.69Å; F2099-L2103 HydrophobicContact CD1-CG 3.95Å; F2099-L2103 HydrophobicContact CD2-CD1 4.19Å; F2099-L2103 HydrophobicContact CE1-CD1 3.94Å; F2099-L2103 HydrophobicContact CE1-CD2 3.75Å; F2099-L2103 HydrophobicContact CE1-CG 4.26Å; F2099-L2103 HydrophobicContact CE2-CD1 4.22Å; F2099-L2103 HydrophobicContact CG-CD1 4.06Å; F2099-L2103 HydrophobicContact CG-CG 4.29Å; F2099-L2103 HydrophobicContact CZ-CD1 4.09Å; F2101-L2103 HydrophobicContact CE2-CD2 3.91Å; L2103-E2107 HydrophobicContact CB-CB 4.29Å; L2103-E2107 HydrophobicContact CD2-CB 4.17Å; L2103-V2108 HydrophobicContact CB-CG2 3.82Å; L2103-V2108 HydrophobicContact CD1-CG2 4.29Å; L2103-F2111 HydrophobicContact CD1-CD2 4.01Å; L2103-F2111 HydrophobicContact CD1-CE2 4.17Å; L2103-F2111 HydrophobicContact CD2-CE2 4.12Å; L2103-L2127 HydrophobicContact CD1-CD2 3.67Å; L2103-V2129 HydrophobicContact CD1-CG2 4.01Å; L2103-V2129 HydrophobicContact CG-CG2 4.4Å
2104	T	84.7	Confident	84	Confident	71 Å²	71	46.6 Å²	46.6	44%	0.436	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-83.9	157.1	168.3	61.8	0	0	0	0	110.7	L2106 E2107 V2108	T2104-L2106 PolarHBondContact O-N 3.29Å; T2104-E2107 PolarHBondContact N-OE2 3.05Å; T2104-E2107 WeakPolarHBondContact O-CB 3.36Å; T2104-E2107 PolarHBondContact O-N 3.04Å; T2104-E2107 VanDerWaalsContact OG1-CG 3.24Å; T2104-E2107 WeakPolarHBondContact OG1-CG 3.4Å; T2104-E2107 PolarHBondContact OG1-N 3.34Å; T2104-E2107 PolarHBondContact OG1-OE2 2.89Å; T2104-V2108 PolarHBondContact O-N 2.97Å
2105	D	79.5	Confident	84.2	Confident	148 Å²	148	47.9 Å²	47.9	79%	0.791	24%	0.241	S	C	*	.	H	α-helix	trans	-55.9	-36.4	179.3	-50.9	-45.3	0	0	0	112.1	Y2109	D2105-Y2109 WeakPolarHBondContact O-CB 3.41Å; D2105-Y2109 PolarHBondContact O-N 2.71Å
2106	L	82.7	Confident	84.4	Confident	49 Å²	49	47.6 Å²	47.6	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-60.9	-43.2	173.9	175.5	58.3	0	0	0	112.1	F2036 I2044 L2046 I2050 T2104 Y2109 L2110	F2036-L2106 HydrophobicContact CE2-CD1 4.47Å; F2036-L2106 HydrophobicContact CZ-CD1 4.17Å; I2044-L2106 HydrophobicContact CD1-CD1 4.06Å; I2044-L2106 HydrophobicContact CG2-CD1 3.88Å; L2046-L2106 HydrophobicContact CD2-CD1 4.25Å; L2046-L2106 HydrophobicContact CD2-CD2 4.03Å; I2050-L2106 HydrophobicContact CD1-CD2 4.42Å; T2104-L2106 PolarHBondContact O-N 3.29Å; L2106-Y2109 PolarHBondContact O-N 2.75Å; L2106-L2110 HydrophobicContact CD1-CD1 4.03Å; L2106-L2110 HydrophobicContact CD1-CG 4.11Å; L2106-L2110 HydrophobicContact CG-CD1 3.88Å; L2106-L2110 HydrophobicContact CG-CG 4.42Å; L2106-L2110 VanDerWaalsContact O-CB 3.25Å; L2106-L2110 WeakPolarHBondContact O-CB 3.24Å; L2106-L2110 WeakPolarHBondContact O-CG 3.31Å; L2106-L2110 PolarHBondContact O-N 3.03Å
2107	E	85.9	Confident	84.6	Confident	24 Å²	24	43.6 Å²	43.6	11%	0.112	23%	0.225	C	C	.	.	H	α-helix	trans	-73.5	-40.1	-179.1	-70.1	162	151.2	0	0	112.1	R2082 L2103 T2104 Y2109 L2110 F2111	R2082-E2107 IonicContact CZ-OE1 2.74Å; R2082-E2107 IonicContact CZ-OE2 2.9Å; R2082-E2107 IonicContact NH1-OE1 3.94Å; R2082-E2107 PolarHBondContact NH1-OE1 3.22Å; R2082-E2107 IonicContact NH1-OE2 3.78Å; R2082-E2107 PolarHBondContact NH1-OE2 3.25Å; R2082-E2107 IonicContact NH2-OE1 3.59Å; R2082-E2107 PolarHBondContact NH2-OE1 2.9Å; R2082-E2107 IonicContact NH2-OE2 2.74Å; R2082-E2107 PolarHBondContact NH2-OE2 3.15Å; L2103-E2107 HydrophobicContact CB-CB 4.29Å; L2103-E2107 HydrophobicContact CD2-CB 4.17Å; T2104-E2107 PolarHBondContact N-OE2 3.05Å; T2104-E2107 WeakPolarHBondContact O-CB 3.36Å; T2104-E2107 PolarHBondContact O-N 3.04Å; T2104-E2107 VanDerWaalsContact OG1-CG 3.24Å; T2104-E2107 WeakPolarHBondContact OG1-CG 3.4Å; T2104-E2107 PolarHBondContact OG1-N 3.34Å; T2104-E2107 PolarHBondContact OG1-OE2 2.89Å; E2107-Y2109 VanDerWaalsContact C-N 3.29Å; E2107-Y2109 PolarHBondContact O-N 3.48Å; E2107-L2110 PolarHBondContact O-N 3.02Å; E2107-F2111 HydrophobicContact CB-CD2 4.35Å; E2107-F2111 HydrophobicContact CB-CE2 3.95Å; E2107-F2111 WeakPolarHBondContact O-CB 3.37Å; E2107-F2111 WeakPolarHBondContact O-CD2 3.2Å; E2107-F2111 WeakPolarHBondContact O-CG 3.38Å; E2107-F2111 PolarHBondContact O-N 2.83Å
2108	V	84.2	Confident	84.5	Confident	58 Å²	58	44 Å²	44	35%	0.352	23%	0.228	S	C	.	.	H	α-helix	trans	-56.9	-47.9	171.4	176.2	0	0	0	0	109.4	L2103 T2104 T2112	L2103-V2108 HydrophobicContact CB-CG2 3.82Å; L2103-V2108 HydrophobicContact CD1-CG2 4.29Å; T2104-V2108 PolarHBondContact O-N 2.97Å; V2108-T2112 WeakPolarHBondContact O-CB 3.4Å; V2108-T2112 WeakPolarHBondContact O-CG2 3.37Å; V2108-T2112 PolarHBondContact O-N 2.82Å; V2108-T2112 VanDerWaalsContact O-N 3.11Å; V2108-T2112 PolarHBondContact O-OG1 3.16Å
2109	Y	84.5	Confident	84.5	Confident	30 Å²	30	48.4 Å²	48.4	12%	0.118	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-47.3	177	-177.6	-104.6	0	0	0	113	F2036 L2037 G2038 P2039 D2105 L2106 E2107 T2112 H2113 K2114	F2036-Y2109 HydrophobicContact CD2-CE1 4.26Å; F2036-Y2109 HydrophobicContact CE2-CD1 4.27Å; F2036-Y2109 HydrophobicContact CE2-CE1 4.1Å; L2037-Y2109 WeakPolarHBondContact O-CE1 3.49Å; L2037-Y2109 PolarHBondContact O-OH 2.89Å; G2038-Y2109 VanDerWaalsContact C-CZ 3.44Å; G2038-Y2109 PolarHBondContact O-OH 3.15Å; P2039-Y2109 HydrophobicContact CB-CD2 3.77Å; P2039-Y2109 HydrophobicContact CB-CE2 3.86Å; P2039-Y2109 HydrophobicContact CB-CG 4.5Å; P2039-Y2109 HydrophobicContact CG-CD2 4.08Å; P2039-Y2109 HydrophobicContact CG-CE2 4.44Å; P2039-Y2109 HydrophobicContact CG-CG 4.33Å; D2105-Y2109 WeakPolarHBondContact O-CB 3.41Å; D2105-Y2109 PolarHBondContact O-N 2.71Å; L2106-Y2109 PolarHBondContact O-N 2.75Å; E2107-Y2109 VanDerWaalsContact C-N 3.29Å; E2107-Y2109 PolarHBondContact O-N 3.48Å; Y2109-T2112 PolarHBondContact O-N 3.39Å; Y2109-T2112 PolarHBondContact O-OG1 3.2Å; Y2109-H2113 HydrophobicContact CD2-CB 4.16Å; Y2109-H2113 AromaticContact CD2-CG 3.81Å; Y2109-H2113 AromaticContact CD2-ND1 3.55Å; Y2109-H2113 HydrophobicContact CE2-CB 3.82Å; Y2109-H2113 AromaticContact CE2-CD2 3.93Å; Y2109-H2113 AromaticContact CE2-CG 3.57Å; Y2109-H2113 AromaticContact CE2-ND1 3.79Å; Y2109-H2113 WeakPolarHBondContact O-CB 3.34Å; Y2109-H2113 PolarHBondContact O-N 2.89Å; Y2109-K2114 VanDerWaalsContact CE1-CE 3.42Å; Y2109-K2114 PolarHBondContact OH-NZ 2.95Å
2110	L	85.9	Confident	83.7	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-55	-54.9	177.3	-83.8	169.1	0	0	0	111.9	F2036 L2046 I2050 I2054 L2106 E2107 T2112 K2114 I2116	F2036-L2110 HydrophobicContact CE1-CD2 3.69Å; F2036-L2110 HydrophobicContact CE2-CD2 4.4Å; F2036-L2110 HydrophobicContact CZ-CD2 3.45Å; F2036-L2110 VanDerWaalsContact CZ-CD2 3.45Å; F2036-L2110 HydrophobicContact CZ-CG 4.18Å; L2046-L2110 HydrophobicContact CD1-CD2 4.38Å; L2046-L2110 HydrophobicContact CD2-CD1 4.28Å; I2050-L2110 HydrophobicContact CG2-CD1 4.37Å; I2054-L2110 HydrophobicContact CD1-CD1 4.04Å; I2054-L2110 HydrophobicContact CD1-CD2 3.85Å; L2106-L2110 HydrophobicContact CD1-CD1 4.03Å; L2106-L2110 HydrophobicContact CD1-CG 4.11Å; L2106-L2110 HydrophobicContact CG-CD1 3.88Å; L2106-L2110 HydrophobicContact CG-CG 4.42Å; L2106-L2110 VanDerWaalsContact O-CB 3.25Å; L2106-L2110 WeakPolarHBondContact O-CB 3.24Å; L2106-L2110 WeakPolarHBondContact O-CG 3.31Å; L2106-L2110 PolarHBondContact O-N 3.03Å; E2107-L2110 PolarHBondContact O-N 3.02Å; L2110-T2112 VanDerWaalsContact C-N 3.35Å; L2110-T2112 PolarHBondContact O-N 2.94Å; L2110-K2114 HydrophobicContact CD2-CG 4.21Å; L2110-K2114 WeakPolarHBondContact O-CB 3.27Å; L2110-K2114 PolarHBondContact O-N 3.39Å; L2110-I2116 HydrophobicContact CB-CD1 3.9Å; L2110-I2116 HydrophobicContact CD2-CD1 3.76Å; L2110-I2116 HydrophobicContact CG-CD1 4.41Å
2111	F	88.1	Confident	83.2	Confident	9 Å²	9	56.2 Å²	56.2	4%	0.039	30%	0.298	C	S	.	.	H	α-helix	trans	-68.5	-33	-175.9	-61.1	-37.9	0	0	0	112.6	I2057 F2079 F2099 L2103 E2107 I2116 L2117 F2125 L2127	I2057-F2111 HydrophobicContact CD1-CE1 4.03Å; F2079-F2111 HydrophobicContact CZ-CE2 4.47Å; F2079-F2111 AromaticContact CZ-CZ 3.96Å; F2079-F2111 HydrophobicContact CZ-CZ 3.96Å; F2099-F2111 HydrophobicContact CE1-CE2 4.08Å; F2099-F2111 HydrophobicContact CZ-CD2 4.02Å; F2099-F2111 AromaticContact CZ-CE2 3.97Å; F2099-F2111 HydrophobicContact CZ-CE2 3.97Å; L2103-F2111 HydrophobicContact CD1-CD2 4.01Å; L2103-F2111 HydrophobicContact CD1-CE2 4.17Å; L2103-F2111 HydrophobicContact CD2-CE2 4.12Å; E2107-F2111 HydrophobicContact CB-CD2 4.35Å; E2107-F2111 HydrophobicContact CB-CE2 3.95Å; E2107-F2111 WeakPolarHBondContact O-CB 3.37Å; E2107-F2111 WeakPolarHBondContact O-CD2 3.2Å; E2107-F2111 WeakPolarHBondContact O-CG 3.38Å; E2107-F2111 PolarHBondContact O-N 2.83Å; F2111-I2116 HydrophobicContact CD1-CB 4.25Å; F2111-I2116 HydrophobicContact CD1-CG2 4.06Å; F2111-I2116 HydrophobicContact CE1-CG2 4.18Å; F2111-L2117 HydrophobicContact CB-CD1 4.02Å; F2111-L2117 HydrophobicContact CB-CG 4.23Å; F2111-L2117 HydrophobicContact CD1-CD2 3.98Å; F2111-L2117 HydrophobicContact CD1-CG 4.05Å; F2111-L2117 HydrophobicContact CE1-CD2 4.28Å; F2111-L2117 HydrophobicContact CG-CD1 4.25Å; F2111-L2117 HydrophobicContact CG-CD2 4.42Å; F2111-L2117 HydrophobicContact CG-CG 4.25Å; F2111-F2125 WeakPolarHBondContact O-CE2 3.39Å; F2111-F2125 WeakPolarHBondContact O-CZ 3.39Å; F2111-L2127 HydrophobicContact CB-CD1 3.95Å; F2111-L2127 HydrophobicContact CB-CD2 4.48Å
2112	T	80.7	Confident	82.6	Confident	64 Å²	64	59.4 Å²	59.4	39%	0.393	34%	0.336	S	S	.	.	H	α-helix	trans	-84.6	-34.3	-179.6	53.8	0	0	0	0	114.3	V2108 Y2109 L2110	V2108-T2112 WeakPolarHBondContact O-CB 3.4Å; V2108-T2112 WeakPolarHBondContact O-CG2 3.37Å; V2108-T2112 PolarHBondContact O-N 2.82Å; V2108-T2112 VanDerWaalsContact O-N 3.11Å; V2108-T2112 PolarHBondContact O-OG1 3.16Å; Y2109-T2112 PolarHBondContact O-N 3.39Å; Y2109-T2112 PolarHBondContact O-OG1 3.2Å; L2110-T2112 VanDerWaalsContact C-N 3.35Å; L2110-T2112 PolarHBondContact O-N 2.94Å
2113	H	83.6	Confident	82.5	Confident	125 Å²	125	56.2 Å²	56.2	58%	0.579	32%	0.322	S	S	*	.	H	α-helix	trans	-111	-14.9	-170.3	-66.3	76.1	0	0	0	115.4	Y2109	Y2109-H2113 HydrophobicContact CD2-CB 4.16Å; Y2109-H2113 AromaticContact CD2-CG 3.81Å; Y2109-H2113 AromaticContact CD2-ND1 3.55Å; Y2109-H2113 HydrophobicContact CE2-CB 3.82Å; Y2109-H2113 AromaticContact CE2-CD2 3.93Å; Y2109-H2113 AromaticContact CE2-CG 3.57Å; Y2109-H2113 AromaticContact CE2-ND1 3.79Å; Y2109-H2113 WeakPolarHBondContact O-CB 3.34Å; Y2109-H2113 PolarHBondContact O-N 2.89Å
2114	K	84.1	Confident	82.1	Confident	57 Å²	57	56.8 Å²	56.8	25%	0.248	33%	0.331	C	S	.	.	S	Bend	trans	-110	12.7	-178.6	-48.5	-53.7	-170.4	-159.6	0	114	F2036 L2037 Y2109 L2110 I2116	F2036-K2114 VanDerWaalsContact CD2-CE 3.43Å; L2037-K2114 PolarHBondContact O-NZ 3.45Å; Y2109-K2114 VanDerWaalsContact CE1-CE 3.42Å; Y2109-K2114 PolarHBondContact OH-NZ 2.95Å; L2110-K2114 HydrophobicContact CD2-CG 4.21Å; L2110-K2114 WeakPolarHBondContact O-CB 3.27Å; L2110-K2114 PolarHBondContact O-N 3.39Å; K2114-I2116 VanDerWaalsContact C-N 3.31Å; K2114-I2116 HydrophobicContact CB-CD1 3.93Å; K2114-I2116 HydrophobicContact CB-CG1 4.04Å; K2114-I2116 PolarHBondContact O-N 2.84Å
2115	D	80.7	Confident	82.2	Confident	69 Å²	69	55.6 Å²	55.6	37%	0.369	32%	0.32	S	S	.	.			trans	51.6	43.4	175.3	-156.5	10.4	0	0	0	113.6	K2058 R2119	K2058-D2115 PolarHBondContact NZ-O 3.3Å; D2115-R2119 VanDerWaalsContact CG-NH2 3.28Å; D2115-R2119 IonicContact OD1-CZ 2.58Å; D2115-R2119 IonicContact OD1-NE 2.71Å; D2115-R2119 PolarHBondContact OD1-NE 2.81Å; D2115-R2119 IonicContact OD1-NH2 2.94Å; D2115-R2119 PolarHBondContact OD1-NH2 2.78Å; D2115-R2119 VanDerWaalsContact OD1-NH2 3.15Å; D2115-R2119 IonicContact OD2-CZ 3.7Å; D2115-R2119 IonicContact OD2-NE 3.14Å; D2115-R2119 IonicContact OD2-NH2 2.76Å; D2115-R2119 PolarHBondContact OD2-NH2 3.02Å
2116	I	87.6	Confident	82.4	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	30%	0.299	C	S	.	.			trans	-81.2	-39	-169.6	-71.1	169.2	0	0	0	112.5	I2054 I2057 L2110 F2111 K2114	I2054-I2116 HydrophobicContact CD1-CD1 3.96Å; I2054-I2116 HydrophobicContact CG1-CD1 4.06Å; I2054-I2116 HydrophobicContact CG2-CD1 3.76Å; I2054-I2116 HydrophobicContact CG2-CG1 3.9Å; I2054-I2116 HydrophobicContact CG2-CG2 4.03Å; I2057-I2116 HydrophobicContact CB-CG2 4.16Å; I2057-I2116 HydrophobicContact CD1-CG2 4.01Å; I2057-I2116 HydrophobicContact CG2-CG2 4Å; I2057-I2116 VanDerWaalsContact CG2-O 3.3Å; I2057-I2116 WeakPolarHBondContact CG2-O 3.48Å; L2110-I2116 HydrophobicContact CB-CD1 3.9Å; L2110-I2116 HydrophobicContact CD2-CD1 3.76Å; L2110-I2116 HydrophobicContact CG-CD1 4.41Å; F2111-I2116 HydrophobicContact CD1-CB 4.25Å; F2111-I2116 HydrophobicContact CD1-CG2 4.06Å; F2111-I2116 HydrophobicContact CE1-CG2 4.18Å; K2114-I2116 VanDerWaalsContact C-N 3.31Å; K2114-I2116 HydrophobicContact CB-CD1 3.93Å; K2114-I2116 HydrophobicContact CB-CG1 4.04Å; K2114-I2116 PolarHBondContact O-N 2.84Å
2117	L	88.1	Confident	82.5	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	30%	0.297	C	S	.	.	S	Bend	trans	-74.5	143.5	-174.8	-63.8	177.1	0	0	0	111.6	I2057 F2075 Y2097 F2111 F2125 L2127	I2057-L2117 HydrophobicContact CG2-CD2 4.36Å; F2075-L2117 HydrophobicContact CE1-CD2 4.07Å; F2075-L2117 HydrophobicContact CZ-CD2 3.95Å; Y2097-L2117 HydrophobicContact CD2-CB 4.45Å; Y2097-L2117 HydrophobicContact CD2-CD1 3.77Å; Y2097-L2117 HydrophobicContact CE2-CB 3.97Å; Y2097-L2117 HydrophobicContact CE2-CD1 4.14Å; Y2097-L2117 HydrophobicContact CG-CD1 3.98Å; F2111-L2117 HydrophobicContact CB-CD1 4.02Å; F2111-L2117 HydrophobicContact CB-CG 4.23Å; F2111-L2117 HydrophobicContact CD1-CD2 3.98Å; F2111-L2117 HydrophobicContact CD1-CG 4.05Å; F2111-L2117 HydrophobicContact CE1-CD2 4.28Å; F2111-L2117 HydrophobicContact CG-CD1 4.25Å; F2111-L2117 HydrophobicContact CG-CD2 4.42Å; F2111-L2117 HydrophobicContact CG-CG 4.25Å; L2117-F2125 HydrophobicContact CD1-CD2 4.28Å; L2117-F2125 HydrophobicContact CD1-CE2 4.13Å; L2117-L2127 HydrophobicContact CD1-CD1 3.52Å
2118	P	86.1	Confident	82.2	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.058	31%	0.309	C	S	.	.			trans	-62.1	141.4	178.1	-21	32.5	0	0	0	112.8	I2057 F2060 W2064 F2075 Y2097	I2057-P2118 HydrophobicContact CG2-CG 4.43Å; F2060-P2118 HydrophobicContact CD1-CG 3.83Å; F2060-P2118 HydrophobicContact CE1-CG 4.13Å; W2064-P2118 HydrophobicContact CD2-CB 4.38Å; W2064-P2118 HydrophobicContact CE3-CB 3.54Å; W2064-P2118 HydrophobicContact CZ3-CB 3.72Å; F2075-P2118 HydrophobicContact CE2-CG 4.5Å; F2075-P2118 HydrophobicContact CZ-CG 4.24Å; Y2097-P2118 PolarHBondContact OH-O 3.47Å
2119	R	84.7	Confident	82.1	Confident	99 Å²	99	54.1 Å²	54.1	37%	0.374	31%	0.308	S	S	.	.			trans	-155.8	152.9	171.5	63.4	-159	-178	106.3	-5.3	110.1	D2115 I2123	D2115-R2119 VanDerWaalsContact CG-NH2 3.28Å; D2115-R2119 IonicContact OD1-CZ 2.58Å; D2115-R2119 IonicContact OD1-NE 2.71Å; D2115-R2119 PolarHBondContact OD1-NE 2.81Å; D2115-R2119 IonicContact OD1-NH2 2.94Å; D2115-R2119 PolarHBondContact OD1-NH2 2.78Å; D2115-R2119 VanDerWaalsContact OD1-NH2 3.15Å; D2115-R2119 IonicContact OD2-CZ 3.7Å; D2115-R2119 IonicContact OD2-NE 3.14Å; D2115-R2119 IonicContact OD2-NH2 2.76Å; D2115-R2119 PolarHBondContact OD2-NH2 3.02Å; R2119-I2123 PolarHBondContact NH1-O 3.25Å
2120	E	72.7	Confident	81.6	Confident	105 Å²	105	54.2 Å²	54.2	49%	0.491	31%	0.31	S	S	.	.			trans	-74.1	157.8	172	-55.1	-167.5	150.7	0	0	111	G2122 I2123	E2120-G2122 PolarHBondContact O-N 3.39Å; E2120-I2123 HydrophobicContact CB-CB 4.31Å; E2120-I2123 HydrophobicContact CB-CD1 4Å; E2120-I2123 HydrophobicContact CB-CG1 4.22Å; E2120-I2123 HydrophobicContact CG-CD1 4.39Å; E2120-I2123 PolarHBondContact O-N 3.25Å
2121	A	71.7	Confident	80.8	Confident	112 Å²	112	55.1 Å²	55.1	93%	0.926	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	118.3	-178.2	0	0	0	0	0	111.3
2122	G	72.1	Confident	79.6	Confident	83 Å²	83	59 Å²	59	86%	0.856	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	-5.4	-176.4	0	0	0	0	0	114.9	E2120	E2120-G2122 PolarHBondContact O-N 3.39Å
2123	I	79	Confident	78.7	Confident	41 Å²	41	65 Å²	65	21%	0.21	36%	0.36	C	S	.	.			trans	-89.3	137.8	174.5	-71.3	-168.4	0	0	0	110.4	L2095 R2119 E2120	L2095-I2123 HydrophobicContact CD1-CG2 4.31Å; L2095-I2123 HydrophobicContact CD2-CG2 4.38Å; L2095-I2123 HydrophobicContact CG-CG2 3.77Å; R2119-I2123 PolarHBondContact NH1-O 3.25Å; E2120-I2123 HydrophobicContact CB-CB 4.31Å; E2120-I2123 HydrophobicContact CB-CD1 4Å; E2120-I2123 HydrophobicContact CB-CG1 4.22Å; E2120-I2123 HydrophobicContact CG-CD1 4.39Å; E2120-I2123 PolarHBondContact O-N 3.25Å
2124	G	78	Confident	77.8	Confident	28 Å²	28	65.3 Å²	65.3	29%	0.289	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	171.9	173.1	0	0	0	0	0	112	G2093 V2094 L2095	G2093-G2124 PolarHBondContact O-N 3.47Å; G2093-G2124 VanDerWaalsContact O-N 3.11Å; V2094-G2124 WeakPolarHBondContact CA-O 3.36Å; L2095-G2124 PolarHBondContact N-O 2.86Å
2125	F	85.9	Confident	76.4	Confident	46 Å²	46	65 Å²	65	20%	0.202	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.8	164.3	68.2	-83.5	0	0	0	111.7	L2095 Y2097 F2111 L2117	L2095-F2125 HydrophobicContact CB-CB 4.31Å; L2095-F2125 CarbonylContact O-C 3.59Å; L2095-F2125 WeakPolarHBondContact O-CA 3.42Å; L2095-F2125 WeakPolarHBondContact O-CB 3.46Å; Y2097-F2125 HydrophobicContact CD2-CB 4.17Å; Y2097-F2125 HydrophobicContact CD2-CD2 4.26Å; Y2097-F2125 HydrophobicContact CE2-CB 4.15Å; F2111-F2125 WeakPolarHBondContact O-CE2 3.39Å; F2111-F2125 WeakPolarHBondContact O-CZ 3.39Å; L2117-F2125 HydrophobicContact CD1-CD2 4.28Å; L2117-F2125 HydrophobicContact CD1-CE2 4.13Å
2126	E	83.5	Confident	75	Confident	74 Å²	74	69.8 Å²	69.8	35%	0.346	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	144.8	173.4	62.6	-178.1	-177	0	0	110.5	V2094 L2095 R2096 Y2097	V2094-E2126 HydrophobicContact CG1-CB 4.19Å; V2094-E2126 HydrophobicContact CG1-CG 4.03Å; L2095-E2126 PolarHBondContact O-N 2.89Å; R2096-E2126 HydrophobicContact CB-CG 3.98Å; R2096-E2126 HydrophobicContact CG-CG 4.17Å; R2096-E2126 IonicContact CZ-OE1 3.46Å; R2096-E2126 IonicContact NE-OE1 2.56Å; R2096-E2126 PolarHBondContact NE-OE1 2.98Å; R2096-E2126 IonicContact NH2-OE1 2.72Å; R2096-E2126 PolarHBondContact NH2-OE1 3.03Å; Y2097-E2126 PolarHBondContact N-O 3.24Å
2127	L	85.2	Confident	73.6	Confident	42 Å²	42	70.5 Å²	70.5	22%	0.22	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.1	-179.3	-143	88.6	0	0	0	108.9	F2099 L2103 F2111 L2117 V2129	F2099-L2127 HydrophobicContact CD2-CD1 4.46Å; F2099-L2127 HydrophobicContact CD2-CG 4.16Å; F2099-L2127 HydrophobicContact CE2-CD1 3.61Å; F2099-L2127 HydrophobicContact CE2-CD2 4.33Å; F2099-L2127 HydrophobicContact CE2-CG 3.78Å; F2099-L2127 HydrophobicContact CZ-CD1 4.31Å; L2103-L2127 HydrophobicContact CD1-CD2 3.67Å; F2111-L2127 HydrophobicContact CB-CD1 3.95Å; F2111-L2127 HydrophobicContact CB-CD2 4.48Å; L2117-L2127 HydrophobicContact CD1-CD1 3.52Å; L2127-V2129 HydrophobicContact CD2-CG2 4.34Å
2128	H	81.1	Confident	72	Confident	79 Å²	79	76.3 Å²	76.3	37%	0.366	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	109.4	-174.2	-166	-129.8	0	0	0	109.5	R2096 Y2097 D2098 F2099	R2096-H2128 HydrophobicContact CG-CB 4.34Å; Y2097-H2128 PolarHBondContact O-N 2.85Å; D2098-H2128 CarbonylContact C-O 3.53Å; D2098-H2128 WeakPolarHBondContact CA-O 3.49Å; D2098-H2128 IonicContact OD1-CE1 3.97Å; D2098-H2128 IonicContact OD1-CG 3.89Å; D2098-H2128 IonicContact OD1-ND1 3.16Å; D2098-H2128 PolarHBondContact OD1-ND1 3.42Å; F2099-H2128 PolarHBondContact N-O 3.21Å
2129	V	82	Confident	69.9	Low	53 Å²	53	87.1 Å²	87.1	32%	0.321	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	119.8	-169.4	-175.4	0	0	0	0	110	F2099 F2101 L2103 L2127	F2099-V2129 HydrophobicContact CB-CG2 4.44Å; F2101-V2129 WeakPolarHBondContact O-CG1 3.44Å; L2103-V2129 HydrophobicContact CD1-CG2 4.01Å; L2103-V2129 HydrophobicContact CG-CG2 4.4Å; L2127-V2129 HydrophobicContact CD2-CG2 4.34Å
2130	L	72.4	Confident	68.1	Low	31 Å²	31	86 Å²	86	16%	0.162	48%	0.481	C	S	.	.			trans	-116.8	100.6	-170.1	-58.6	176.5	0	0	0	111	F2099 I2100 V2132 L2143	F2099-L2130 PolarHBondContact O-N 3.44Å; I2100-L2130 CarbonylContact C-O 3.6Å; L2130-V2132 HydrophobicContact CB-CG1 4.46Å; L2130-V2132 PolarHBondContact O-N 2.64Å; L2130-L2143 HydrophobicContact CD2-CD1 3.98Å
2131	D	68.9	Low	67	Low	24 Å²	24	84.3 Å²	84.3	13%	0.128	48%	0.478	C	S	.	.			trans	-76.5	70.4	175.4	-166.2	-20.1	0	0	0	112.1	Q2102 K2133 N2134 T2135	Q2102-D2131 HydrophobicContact CG-CB 4.08Å; Q2102-D2131 WeakPolarHBondContact CG-OD2 3.47Å; Q2102-D2131 PolarHBondContact NE2-OD2 2.57Å; D2131-K2133 PolarHBondContact O-N 2.82Å; D2131-K2133 WeakPolarHBondContact OD1-CB 3.49Å; D2131-K2133 PolarHBondContact OD1-N 3.01Å; D2131-N2134 PolarHBondContact O-N 2.89Å; D2131-N2134 PolarHBondContact OD1-N 3Å; D2131-N2134 PolarHBondContact OD1-ND2 3.17Å; D2131-N2134 PolarHBondContact OD2-ND2 3.32Å; D2131-T2135 WeakPolarHBondContact O-CA 3.41Å; D2131-T2135 WeakPolarHBondContact O-CB 3.43Å; D2131-T2135 PolarHBondContact O-N 3.48Å; D2131-T2135 PolarHBondContact O-OG1 3.01Å
2132	V	63.2	Low	65.9	Low	89 Å²	89	87.1 Å²	87.1	54%	0.539	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-3.7	177	-62.4	0	0	0	0	114.3	I2100 L2130	I2100-V2132 HydrophobicContact CG2-CB 4.23Å; I2100-V2132 HydrophobicContact CG2-CG1 3.42Å; I2100-V2132 VanDerWaalsContact CG2-CG1 3.42Å; I2100-V2132 HydrophobicContact CG2-CG2 3.74Å; L2130-V2132 HydrophobicContact CB-CG1 4.46Å; L2130-V2132 PolarHBondContact O-N 2.64Å
2133	K	62.4	Low	64.8	Low	192 Å²	192	85.2 Å²	85.2	84%	0.835	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-33.8	-179.8	-160.6	175	-173.8	176.3	0	111.9	D2131	D2131-K2133 PolarHBondContact O-N 2.82Å; D2131-K2133 WeakPolarHBondContact OD1-CB 3.49Å; D2131-K2133 PolarHBondContact OD1-N 3.01Å
2134	N	64.6	Low	63.2	Low	131 Å²	131	87.7 Å²	87.7	70%	0.701	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-24.4	177.2	-60.4	-51.6	0	0	0	113.2	D2131	D2131-N2134 PolarHBondContact O-N 2.89Å; D2131-N2134 PolarHBondContact OD1-N 3Å; D2131-N2134 PolarHBondContact OD1-ND2 3.17Å; D2131-N2134 PolarHBondContact OD2-ND2 3.32Å
2135	T	55.6	Low	61.8	Low	49 Å²	49	88.9 Å²	88.9	30%	0.301	46%	0.455	S	S	.	.			trans	-106.3	110	-172.6	-56.4	0	0	0	0	111.5	D2131 L2143 P2145	D2131-T2135 WeakPolarHBondContact O-CA 3.41Å; D2131-T2135 WeakPolarHBondContact O-CB 3.43Å; D2131-T2135 PolarHBondContact O-N 3.48Å; D2131-T2135 PolarHBondContact O-OG1 3.01Å; T2135-L2143 HydrophobicContact CG2-CB 3.9Å; T2135-L2143 WeakPolarHBondContact CG2-O 3.39Å; T2135-P2145 HydrophobicContact CG2-CG 4.32Å
2136	F	51.4	Low	59.5	Low	170 Å²	170	97.3 Å²	97.3	75%	0.746	49%	0.486	S	S	*	.			trans	-106.6	113	171.8	-179.9	-89.3	0	0	0	110.1
2137	G	57.7	Low	57.5	Low	20 Å²	20	99 Å²	99	21%	0.206	51%	0.506	C	S	.	.			trans	-155.7	175.8	178.3	0	0	0	0	0	112.2
2138	F	53.1	Low	55.1	Low	125 Å²	125	103.9 Å²	103.9	55%	0.548	53%	0.528	S	S	.	.			trans	-94.2	149.5	-170.3	-64.9	-84.3	0	0	0	113.1	G2140 T2141	F2138-G2140 PolarHBondContact O-N 3.28Å; F2138-T2141 HydrophobicContact CB-CG2 4.11Å; F2138-T2141 PolarHBondContact N-OG1 3.25Å; F2138-T2141 PolarHBondContact O-N 2.84Å; F2138-T2141 PolarHBondContact O-OG1 3.04Å; F2138-T2141 VanDerWaalsContact O-OG1 3.09Å
2139	Y	43.9	Very low	52.6	Low	236 Å²	236	104.5 Å²	104.5	93%	0.925	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	123.7	174.7	-174.1	-93.5	0	0	0	110.1
2140	G	46.8	Very low	50.2	Low	77 Å²	77	109.3 Å²	109.3	79%	0.794	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	87.2	3.8	-173.7	0	0	0	0	0	115.5	F2138	F2138-G2140 PolarHBondContact O-N 3.28Å
2141	T	48.4	Very low	48.5	Very low	68 Å²	68	110.5 Å²	110.5	42%	0.417	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.5	33.7	173.3	75.9	0	0	0	0	112.2	F2138 L2143 Q2144	F2138-T2141 HydrophobicContact CB-CG2 4.11Å; F2138-T2141 PolarHBondContact N-OG1 3.25Å; F2138-T2141 PolarHBondContact O-N 2.84Å; F2138-T2141 PolarHBondContact O-OG1 3.04Å; F2138-T2141 VanDerWaalsContact O-OG1 3.09Å; T2141-L2143 PolarHBondContact O-N 3.18Å; T2141-Q2144 WeakPolarHBondContact O-CB 3.35Å; T2141-Q2144 WeakPolarHBondContact O-CG 3.26Å; T2141-Q2144 PolarHBondContact O-N 3.31Å
2142	E	48.1	Very low	47.2	Very low	172 Å²	172	113.3 Å²	113.3	80%	0.804	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.3	24.8	180	-62.2	174.4	179.6	0	0	114.4	Q2144	E2142-Q2144 HydrophobicContact CB-CG 4.22Å; E2142-Q2144 PolarHBondContact O-N 3.32Å
2143	L	49.9	Very low	46.5	Very low	43 Å²	43	112.2 Å²	112.2	23%	0.225	61%	0.61	C	S	.	*	T	Hydrogen-bonded Turn	trans	52.3	19	-169.8	-52.1	-173.9	0	0	0	115.2	L2130 T2135 T2141 P2145	L2130-L2143 HydrophobicContact CD2-CD1 3.98Å; T2135-L2143 HydrophobicContact CG2-CB 3.9Å; T2135-L2143 WeakPolarHBondContact CG2-O 3.39Å; T2141-L2143 PolarHBondContact O-N 3.18Å; L2143-P2145 WeakPolarHBondContact O-CD 3.47Å
2144	Q	46	Very low	46.1	Very low	92 Å²	92	107 Å²	107	43%	0.43	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-50.4	122.4	180	-74.1	-71.9	-15.1	0	0	111.9	T2141 E2142	T2141-Q2144 WeakPolarHBondContact O-CB 3.35Å; T2141-Q2144 WeakPolarHBondContact O-CG 3.26Å; T2141-Q2144 PolarHBondContact O-N 3.31Å; E2142-Q2144 HydrophobicContact CB-CG 4.22Å; E2142-Q2144 PolarHBondContact O-N 3.32Å
2145	P	47.8	Very low	45.7	Very low	53 Å²	53	108 Å²	108	34%	0.344	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-61.7	155.9	173.7	-22.8	33.7	0	0	0	112	T2135 L2143 S2147 Q2148	T2135-P2145 HydrophobicContact CG2-CG 4.32Å; L2143-P2145 WeakPolarHBondContact O-CD 3.47Å; P2145-S2147 PolarHBondContact O-N 2.84Å; P2145-S2147 VanDerWaalsContact O-N 3.11Å; P2145-Q2148 PolarHBondContact O-N 2.65Å
2146	W	38.4	Very low	45.9	Very low	224 Å²	224	109.8 Å²	109.8	85%	0.848	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	120.9	178.7	-120.5	81.1	0	0	0	111.6	Q2148	W2146-Q2148 PolarHBondContact O-N 3.34Å
2147	S	41.6	Very low	46.4	Very low	109 Å²	109	102.5 Å²	102.5	76%	0.762	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.6	14.3	173	69.7	0	0	0	0	119.5	P2145	P2145-S2147 PolarHBondContact O-N 2.84Å; P2145-S2147 VanDerWaalsContact O-N 3.11Å
2148	Q	33.5	Very low	46.6	Very low	145 Å²	145	103.6 Å²	103.6	68%	0.678	57%	0.572	S	S	*	*			trans	-102.2	24.6	175.4	-68.5	-155.1	-17.9	0	0	116.3	P2145 W2146 N2150	P2145-Q2148 PolarHBondContact O-N 2.65Å; W2146-Q2148 PolarHBondContact O-N 3.34Å; Q2148-N2150 PolarHBondContact O-N 2.82Å
2149	A	29.2	Very low	46.8	Very low	91 Å²	91	103.7 Å²	103.7	75%	0.752	58%	0.577	S	S	*	*			trans	-72	65.8	163.5	0	0	0	0	0	111.8	A2151	A2149-A2151 PolarHBondContact O-N 2.82Å
2150	N	31.5	Very low	47.4	Very low	154 Å²	154	100 Å²	100	82%	0.824	57%	0.573	S	S	*	*			trans	-84.5	98.6	165.8	-95	-7.3	0	0	0	108.3	Q2148 T2152	Q2148-N2150 PolarHBondContact O-N 2.82Å; N2150-T2152 PolarHBondContact O-N 3.11Å; N2150-T2152 VanDerWaalsContact O-N 3.1Å
2151	A	36.9	Very low	48	Very low	57 Å²	57	102 Å²	102	47%	0.471	56%	0.562	S	S	.	*			trans	-53.6	111.6	-175.8	0	0	0	0	0	113.1	A2149 G2153 E2161	A2149-A2151 PolarHBondContact O-N 2.82Å; A2151-G2153 PolarHBondContact O-N 3.02Å; A2151-E2161 WeakPolarHBondContact CB-OE1 3.35Å
2152	T	41.6	Very low	48.8	Very low	82 Å²	82	100.2 Å²	100.2	50%	0.503	56%	0.557	S	S	.	*			trans	50.6	-45.1	174.4	66.8	0	0	0	0	119.1	N2150 T2154	N2150-T2152 PolarHBondContact O-N 3.11Å; N2150-T2152 VanDerWaalsContact O-N 3.1Å; T2152-T2154 PolarHBondContact O-N 3.19Å; T2152-T2154 VanDerWaalsContact O-N 3.08Å
2153	G	48.3	Very low	49.8	Very low	67 Å²	67	95.3 Å²	95.3	69%	0.691	53%	0.532	S	S	*	.	S	Bend	trans	69.1	-2.1	179.1	0	0	0	0	0	115.8	A2151	A2151-G2153 PolarHBondContact O-N 3.02Å
2154	T	53.9	Low	50.7	Low	81 Å²	81	95.2 Å²	95.2	50%	0.497	53%	0.533	S	S	.	.	S	Bend	trans	-109.6	-2.7	-169.9	50	0	0	0	0	114.6	T2152 L2156	T2152-T2154 PolarHBondContact O-N 3.19Å; T2152-T2154 VanDerWaalsContact O-N 3.08Å; T2154-L2156 PolarHBondContact O-N 3.16Å
2155	Y	56.3	Low	51.8	Low	153 Å²	153	98.8 Å²	98.8	60%	0.6	55%	0.55	S	S	*	*			trans	60.1	16.6	-174.7	-47.9	-75.1	0	0	0	115.3	P2164 V2166	Y2155-P2164 VanDerWaalsContact O-CG 3.27Å; Y2155-P2164 WeakPolarHBondContact O-CG 3.48Å; Y2155-V2166 HydrophobicContact CD1-CG1 3.7Å; Y2155-V2166 HydrophobicContact CG-CG1 4.06Å
2156	L	59.3	Low	52.9	Low	86 Å²	86	97.9 Å²	97.9	45%	0.45	54%	0.543	S	S	.	.			trans	-79.9	152.6	173.3	-60.6	175.7	0	0	0	111	T2154 A2179	T2154-L2156 PolarHBondContact O-N 3.16Å; L2156-A2179 HydrophobicContact CD2-CB 3.9Å
2157	A	62.3	Low	54.3	Low	17 Å²	17	88.2 Å²	88.2	14%	0.14	51%	0.509	C	S	.	.			trans	-83.7	150.2	175.7	0	0	0	0	0	111.6	G2162 Y2163 D2182	A2157-G2162 VanDerWaalsContact CA-O 3.23Å; A2157-G2162 WeakPolarHBondContact CA-O 3.31Å; A2157-G2162 VanDerWaalsContact CB-O 3.27Å; A2157-G2162 WeakPolarHBondContact CB-O 3.26Å; A2157-Y2163 HydrophobicContact CB-CD1 3.6Å; A2157-Y2163 HydrophobicContact CB-CE1 3.82Å; A2157-Y2163 HydrophobicContact CB-CG 4.15Å; A2157-D2182 HydrophobicContact CB-CB 3.97Å; A2157-D2182 WeakPolarHBondContact CB-OD2 3.45Å; A2157-D2182 PolarHBondContact N-OD2 3.34Å
2158	S	61.3	Low	55.6	Low	43 Å²	43	89.7 Å²	89.7	30%	0.301	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-134.4	159.4	177.9	81	0	0	0	0	112.1	N2160 E2161 G2162	S2158-N2160 PolarHBondContact O-N 2.99Å; S2158-N2160 PolarHBondContact OG-N 3.49Å; S2158-E2161 PolarHBondContact OG-N 2.62Å; S2158-G2162 PolarHBondContact N-O 3.06Å; S2158-G2162 VanDerWaalsContact N-O 3.13Å; S2158-G2162 VanDerWaalsContact O-CA 3.3Å; S2158-G2162 WeakPolarHBondContact O-CA 3.46Å; S2158-G2162 PolarHBondContact O-N 2.76Å
2159	I	57.6	Low	57.4	Low	127 Å²	127	85.2 Å²	85.2	65%	0.651	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.6	176.4	-68.3	173.8	0	0	0	111.7	L2189	I2159-L2189 HydrophobicContact CD1-CD2 4.37Å
2160	N	55.9	Low	59.4	Low	158 Å²	158	83.7 Å²	83.7	85%	0.845	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-33.7	-177.4	-70.2	-10.3	0	0	0	113.5	S2158	S2158-N2160 PolarHBondContact O-N 2.99Å; S2158-N2160 PolarHBondContact OG-N 3.49Å
2161	E	61.1	Low	61.2	Low	120 Å²	120	80.4 Å²	80.4	56%	0.561	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	-14	-172.7	-59.1	-176.1	140.8	0	0	113.3	A2151 S2158	A2151-E2161 WeakPolarHBondContact CB-OE1 3.35Å; S2158-E2161 PolarHBondContact OG-N 2.62Å
2162	G	64.7	Low	62.9	Low	31 Å²	31	85 Å²	85	32%	0.32	48%	0.482	S	S	.	.	B	Isolated β-bridge	trans	74.7	-149.1	-176.4	0	0	0	0	0	112.7	A2157 S2158	A2157-G2162 VanDerWaalsContact CA-O 3.23Å; A2157-G2162 WeakPolarHBondContact CA-O 3.31Å; A2157-G2162 VanDerWaalsContact CB-O 3.27Å; A2157-G2162 WeakPolarHBondContact CB-O 3.26Å; S2158-G2162 PolarHBondContact N-O 3.06Å; S2158-G2162 VanDerWaalsContact N-O 3.13Å; S2158-G2162 VanDerWaalsContact O-CA 3.3Å; S2158-G2162 WeakPolarHBondContact O-CA 3.46Å; S2158-G2162 PolarHBondContact O-N 2.76Å
2163	Y	68.5	Low	64.3	Low	69 Å²	69	88.2 Å²	88.2	27%	0.271	49%	0.491	S	S	.	.	S	Bend	trans	-87.4	120	178.9	-71.7	-81	0	0	0	110.3	A2157 M2168 P2178 L2183 M2186	A2157-Y2163 HydrophobicContact CB-CD1 3.6Å; A2157-Y2163 HydrophobicContact CB-CE1 3.82Å; A2157-Y2163 HydrophobicContact CB-CG 4.15Å; Y2163-M2168 HydrophobicContact CG-CE 4.47Å; Y2163-P2178 HydrophobicContact CD1-CB 3.76Å; Y2163-P2178 HydrophobicContact CD1-CG 4.31Å; Y2163-P2178 HydrophobicContact CE1-CB 3.66Å; Y2163-P2178 HydrophobicContact CE1-CG 4.15Å; Y2163-L2183 VanDerWaalsContact OH-CD2 3.25Å; Y2163-L2183 WeakPolarHBondContact OH-CD2 3.22Å; Y2163-M2186 HydrophobicContact CE2-SD 3.99Å; Y2163-M2186 PolarHBondContact OH-SD 3.31Å
2164	P	69.2	Low	64.5	Low	40 Å²	40	87.5 Å²	87.5	26%	0.26	48%	0.483	S	S	.	.			trans	-67.7	149	-179.6	25.5	-31.5	0	0	0	111.3	Y2155 V2166 T2167	Y2155-P2164 VanDerWaalsContact O-CG 3.27Å; Y2155-P2164 WeakPolarHBondContact O-CG 3.48Å; P2164-V2166 PolarHBondContact O-N 2.7Å; P2164-T2167 HydrophobicContact CG-CG2 4.03Å; P2164-T2167 WeakPolarHBondContact O-CB 3.41Å; P2164-T2167 PolarHBondContact O-N 3.26Å; P2164-T2167 PolarHBondContact O-OG1 3.42Å
2165	E	68.7	Low	65.5	Low	168 Å²	168	84.2 Å²	84.2	79%	0.785	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-56.6	-30.4	-166.7	-164.9	167.9	-136.2	0	0	114.1	T2167 M2168 T2169	E2165-T2167 PolarHBondContact O-N 3.09Å; E2165-T2167 VanDerWaalsContact O-N 3.15Å; E2165-M2168 WeakPolarHBondContact O-CA 3.22Å; E2165-M2168 WeakPolarHBondContact O-CB 3.47Å; E2165-M2168 PolarHBondContact O-N 3.42Å; E2165-T2169 PolarHBondContact O-N 2.98Å; E2165-T2169 VanDerWaalsContact O-N 3.11Å; E2165-T2169 PolarHBondContact O-OG1 3.2Å; E2165-T2169 VanDerWaalsContact O-OG1 3.12Å
2166	V	70.4	Confident	65.9	Low	33 Å²	33	80.3 Å²	80.3	20%	0.2	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-60.1	-21.6	173.9	73.2	0	0	0	0	114	Y2155 P2164 M2168 T2169 G2175 V2176	Y2155-V2166 HydrophobicContact CD1-CG1 3.7Å; Y2155-V2166 HydrophobicContact CG-CG1 4.06Å; P2164-V2166 PolarHBondContact O-N 2.7Å; V2166-M2168 VanDerWaalsContact C-N 3.32Å; V2166-T2169 WeakPolarHBondContact CA-OG1 3.38Å; V2166-G2175 CarbonylContact O-C 2.79Å; V2166-G2175 WeakPolarHBondContact O-CA 2.93Å; V2166-V2176 HydrophobicContact CG2-CB 4.38Å; V2166-V2176 HydrophobicContact CG2-CG2 4.12Å; V2166-V2176 PolarHBondContact O-N 3.08Å
2167	T	69.4	Low	66.3	Low	22 Å²	22	81.3 Å²	81.3	14%	0.135	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-82.2	-11.4	173.9	67.2	0	0	0	0	113.5	P2164 E2165 V2176 P2178	P2164-T2167 HydrophobicContact CG-CG2 4.03Å; P2164-T2167 WeakPolarHBondContact O-CB 3.41Å; P2164-T2167 PolarHBondContact O-N 3.26Å; P2164-T2167 PolarHBondContact O-OG1 3.42Å; E2165-T2167 PolarHBondContact O-N 3.09Å; E2165-T2167 VanDerWaalsContact O-N 3.15Å; T2167-V2176 VanDerWaalsContact CA-O 3.25Å; T2167-V2176 WeakPolarHBondContact CA-O 3.41Å; T2167-V2176 WeakPolarHBondContact CG2-O 3.45Å; T2167-P2178 HydrophobicContact CG2-CB 4.14Å
2168	M	67.7	Low	66.7	Low	140 Å²	140	83 Å²	83	69%	0.69	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-13	172.5	-59.5	-70.8	170.9	0	0	112.1	Y2163 E2165 V2166	Y2163-M2168 HydrophobicContact CG-CE 4.47Å; E2165-M2168 WeakPolarHBondContact O-CA 3.22Å; E2165-M2168 WeakPolarHBondContact O-CB 3.47Å; E2165-M2168 PolarHBondContact O-N 3.42Å; V2166-M2168 VanDerWaalsContact C-N 3.32Å
2169	T	71.5	Confident	67	Low	50 Å²	50	82.7 Å²	82.7	31%	0.307	48%	0.479	S	S	.	.	S	Bend	trans	-71.3	142.2	174.6	-51.5	0	0	0	0	111.3	E2165 V2166 E2173	E2165-T2169 PolarHBondContact O-N 2.98Å; E2165-T2169 VanDerWaalsContact O-N 3.11Å; E2165-T2169 PolarHBondContact O-OG1 3.2Å; E2165-T2169 VanDerWaalsContact O-OG1 3.12Å; V2166-T2169 WeakPolarHBondContact CA-OG1 3.38Å; T2169-E2173 HydrophobicContact CG2-CB 3.79Å
2170	P	70.7	Confident	67.2	Low	60 Å²	60	79.4 Å²	79.4	39%	0.39	48%	0.476	S	S	.	.			trans	-58.2	143.1	170.4	-24.1	34.6	0	0	0	112.7	D2172 E2173 G2174 G2175	P2170-D2172 WeakPolarHBondContact CB-OD1 3.37Å; P2170-D2172 PolarHBondContact O-N 3.49Å; P2170-E2173 HydrophobicContact CB-CB 4.35Å; P2170-E2173 HydrophobicContact CB-CG 4.29Å; P2170-E2173 WeakPolarHBondContact CD-OE2 3Å; P2170-E2173 HydrophobicContact CG-CG 4.4Å; P2170-E2173 CarbonylContact O-C 3.47Å; P2170-E2173 WeakPolarHBondContact O-CA 3.48Å; P2170-E2173 PolarHBondContact O-N 3.41Å; P2170-G2174 PolarHBondContact O-N 3.09Å; P2170-G2175 PolarHBondContact O-N 2.91Å
2171	A	69.6	Low	67.6	Low	85 Å²	85	74.4 Å²	74.4	70%	0.702	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-65	-25.7	-177.7	0	0	0	0	0	113.3	G2174	A2171-G2174 PolarHBondContact O-N 2.87Å
2172	D	73.7	Confident	67.6	Low	153 Å²	153	70.4 Å²	70.4	82%	0.818	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-78	-18.6	172.9	54	-41.4	0	0	0	113.7	P2170 G2174	P2170-D2172 WeakPolarHBondContact CB-OD1 3.37Å; P2170-D2172 PolarHBondContact O-N 3.49Å; D2172-G2174 VanDerWaalsContact C-N 3.35Å
2173	E	70.8	Confident	67.7	Low	150 Å²	150	72.4 Å²	72.4	70%	0.701	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-91.4	3.3	167.8	-65.4	-172.5	163.2	0	0	112.6	T2169 P2170	T2169-E2173 HydrophobicContact CG2-CB 3.79Å; P2170-E2173 HydrophobicContact CB-CB 4.35Å; P2170-E2173 HydrophobicContact CB-CG 4.29Å; P2170-E2173 WeakPolarHBondContact CD-OE2 3Å; P2170-E2173 HydrophobicContact CG-CG 4.4Å; P2170-E2173 CarbonylContact O-C 3.47Å; P2170-E2173 WeakPolarHBondContact O-CA 3.48Å; P2170-E2173 PolarHBondContact O-N 3.41Å
2174	G	52.4	Low	67.3	Low	51 Å²	51	74.6 Å²	74.6	53%	0.526	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.4	12.6	178.9	0	0	0	0	0	115.2	P2170 A2171 D2172	P2170-G2174 PolarHBondContact O-N 3.09Å; A2171-G2174 PolarHBondContact O-N 2.87Å; D2172-G2174 VanDerWaalsContact C-N 3.35Å
2175	G	73.5	Confident	67.1	Low	12 Å²	12	74.4 Å²	74.4	12%	0.124	47%	0.469	C	S	.	.			trans	-64.3	150	175.6	0	0	0	0	0	114.3	V2166 P2170	V2166-G2175 CarbonylContact O-C 2.79Å; V2166-G2175 WeakPolarHBondContact O-CA 2.93Å; P2170-G2175 PolarHBondContact O-N 2.91Å
2176	V	65.9	Low	67.1	Low	71 Å²	71	71.1 Å²	71.1	43%	0.43	46%	0.455	S	S	.	.			trans	-122.4	121.8	-176	179.7	0	0	0	0	108.8	V2166 T2167	V2166-V2176 HydrophobicContact CG2-CB 4.38Å; V2166-V2176 HydrophobicContact CG2-CG2 4.12Å; V2166-V2176 PolarHBondContact O-N 3.08Å; T2167-V2176 VanDerWaalsContact CA-O 3.25Å; T2167-V2176 WeakPolarHBondContact CA-O 3.41Å; T2167-V2176 WeakPolarHBondContact CG2-O 3.45Å
2177	P	68	Low	67.2	Low	108 Å²	108	75.9 Å²	75.9	70%	0.701	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-65.2	144.8	-179.3	27.5	-34.6	0	0	0	111.5
2178	P	71.1	Confident	67.3	Low	53 Å²	53	81.8 Å²	81.8	34%	0.344	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-67.1	152	-177.3	28.2	-34.7	0	0	0	112.4	Y2163 T2167	Y2163-P2178 HydrophobicContact CD1-CB 3.76Å; Y2163-P2178 HydrophobicContact CD1-CG 4.31Å; Y2163-P2178 HydrophobicContact CE1-CB 3.66Å; Y2163-P2178 HydrophobicContact CE1-CG 4.15Å; T2167-P2178 HydrophobicContact CG2-CB 4.14Å
2179	A	66.3	Low	67.5	Low	36 Å²	36	78.5 Å²	78.5	30%	0.298	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-74	140.1	-178.5	0	0	0	0	0	111.7	L2156 G2181 D2182	L2156-A2179 HydrophobicContact CD2-CB 3.9Å; A2179-G2181 PolarHBondContact O-N 3Å; A2179-D2182 PolarHBondContact O-N 3.2Å
2180	G	62.9	Low	67.8	Low	58 Å²	58	81 Å²	81	60%	0.598	49%	0.49	S	S	*	.	H	α-helix	trans	-65	-19.3	-179.5	0	0	0	0	0	114.6	N2184	G2180-N2184 PolarHBondContact O-N 3.29Å
2181	G	63.8	Low	68.1	Low	52 Å²	52	81.2 Å²	81.2	54%	0.536	49%	0.493	S	S	.	.	H	α-helix	trans	-66.3	-42.1	173.9	0	0	0	0	0	112.5	A2179 L2183 N2184 G2185	A2179-G2181 PolarHBondContact O-N 3Å; G2181-L2183 PolarHBondContact O-N 3.45Å; G2181-N2184 WeakPolarHBondContact O-CB 3.48Å; G2181-N2184 PolarHBondContact O-N 3.07Å; G2181-G2185 PolarHBondContact O-N 3.47Å
2182	D	60.9	Low	68.4	Low	36 Å²	36	81.9 Å²	81.9	19%	0.193	48%	0.482	C	S	.	.	H	α-helix	trans	-61.1	-45	-176.3	-45.5	-5.6	0	0	0	110.6	A2157 A2179 N2184 G2185 M2186	A2157-D2182 HydrophobicContact CB-CB 3.97Å; A2157-D2182 WeakPolarHBondContact CB-OD2 3.45Å; A2157-D2182 PolarHBondContact N-OD2 3.34Å; A2179-D2182 PolarHBondContact O-N 3.2Å; D2182-N2184 PolarHBondContact O-N 2.91Å; D2182-G2185 PolarHBondContact O-N 3.41Å; D2182-M2186 PolarHBondContact O-N 3.32Å
2183	L	65.8	Low	68.6	Low	73 Å²	73	80.1 Å²	80.1	38%	0.382	47%	0.467	S	S	.	.	H	α-helix	trans	-60	-43.3	172.2	-81	164.7	0	0	0	112.4	Y2163 G2181 M2186 F2187	Y2163-L2183 VanDerWaalsContact OH-CD2 3.25Å; Y2163-L2183 WeakPolarHBondContact OH-CD2 3.22Å; G2181-L2183 PolarHBondContact O-N 3.45Å; L2183-M2186 PolarHBondContact O-N 3.03Å; L2183-F2187 HydrophobicContact CB-CE2 4.46Å; L2183-F2187 HydrophobicContact CD2-CE2 4.29Å; L2183-F2187 WeakPolarHBondContact O-CD2 3.39Å; L2183-F2187 PolarHBondContact O-N 3.44Å; L2183-F2187 VanDerWaalsContact O-N 3.13Å
2184	N	61.9	Low	69	Low	115 Å²	115	80.2 Å²	80.2	62%	0.615	46%	0.462	S	S	*	.	H	α-helix	trans	-67.4	-38.2	-177.3	-160.9	36.2	0	0	0	111.7	G2180 G2181 D2182 M2186 F2187 Y2188	G2180-N2184 PolarHBondContact O-N 3.29Å; G2181-N2184 WeakPolarHBondContact O-CB 3.48Å; G2181-N2184 PolarHBondContact O-N 3.07Å; D2182-N2184 PolarHBondContact O-N 2.91Å; N2184-M2186 PolarHBondContact O-N 3.21Å; N2184-F2187 PolarHBondContact O-N 3.37Å; N2184-Y2188 WeakPolarHBondContact O-CB 3.4Å; N2184-Y2188 PolarHBondContact O-N 3.03Å
2185	G	64.3	Low	70.2	Confident	37 Å²	37	85.6 Å²	85.6	38%	0.381	47%	0.467	S	S	.	.	H	α-helix	trans	-60	-42.9	172.8	0	0	0	0	0	112.9	G2181 D2182 Y2188 L2189	G2181-G2185 PolarHBondContact O-N 3.47Å; D2182-G2185 PolarHBondContact O-N 3.41Å; G2185-Y2188 PolarHBondContact O-N 3.19Å; G2185-L2189 PolarHBondContact O-N 3.04Å
2186	M	69.1	Low	70.4	Confident	99 Å²	99	89.4 Å²	89.4	49%	0.488	48%	0.481	S	S	.	.	H	α-helix	trans	-61	-47.5	174.7	-72.7	178.8	59.3	0	0	112.6	Y2163 D2182 L2183 N2184 Y2188 L2189 L2190	Y2163-M2186 HydrophobicContact CE2-SD 3.99Å; Y2163-M2186 PolarHBondContact OH-SD 3.31Å; D2182-M2186 PolarHBondContact O-N 3.32Å; L2183-M2186 PolarHBondContact O-N 3.03Å; N2184-M2186 PolarHBondContact O-N 3.21Å; M2186-Y2188 VanDerWaalsContact C-N 3.33Å; M2186-Y2188 PolarHBondContact O-N 3.32Å; M2186-L2189 PolarHBondContact O-N 2.96Å; M2186-L2190 WeakPolarHBondContact O-CB 3.15Å; M2186-L2190 PolarHBondContact O-N 3.42Å
2187	F	71.1	Confident	70.9	Confident	133 Å²	133	90 Å²	90	58%	0.583	48%	0.481	S	S	*	.	H	α-helix	trans	-67.1	-33.6	179.9	-69.7	-57.2	0	0	0	112.9	L2183 N2184 S2191	L2183-F2187 HydrophobicContact CB-CE2 4.46Å; L2183-F2187 HydrophobicContact CD2-CE2 4.29Å; L2183-F2187 WeakPolarHBondContact O-CD2 3.39Å; L2183-F2187 PolarHBondContact O-N 3.44Å; L2183-F2187 VanDerWaalsContact O-N 3.13Å; N2184-F2187 PolarHBondContact O-N 3.37Å; F2187-S2191 WeakPolarHBondContact O-CB 3.22Å; F2187-S2191 PolarHBondContact O-N 3.19Å; F2187-S2191 PolarHBondContact O-OG 2.9Å
2188	Y	72.6	Confident	71.1	Confident	145 Å²	145	92.4 Å²	92.4	57%	0.569	48%	0.483	S	S	*	.	H	α-helix	trans	-63.3	-47.8	172.9	-177	-101.4	0	0	0	111.9	N2184 G2185 M2186 L2190 S2191 Q2192	N2184-Y2188 WeakPolarHBondContact O-CB 3.4Å; N2184-Y2188 PolarHBondContact O-N 3.03Å; G2185-Y2188 PolarHBondContact O-N 3.19Å; M2186-Y2188 VanDerWaalsContact C-N 3.33Å; M2186-Y2188 PolarHBondContact O-N 3.32Å; Y2188-L2190 VanDerWaalsContact C-N 3.35Å; Y2188-L2190 PolarHBondContact O-N 3.37Å; Y2188-S2191 PolarHBondContact O-N 3.35Å; Y2188-S2191 PolarHBondContact O-OG 2.75Å; Y2188-Q2192 HydrophobicContact CE1-CG 4.33Å; Y2188-Q2192 PolarHBondContact O-N 3.43Å; Y2188-Q2192 VanDerWaalsContact O-N 3.12Å; Y2188-Q2192 PolarHBondContact OH-NE2 2.93Å
2189	L	71	Confident	70.9	Confident	72 Å²	72	95 Å²	95	38%	0.377	49%	0.494	S	S	.	.	H	α-helix	trans	-62	-42.8	178	-144.6	86.2	0	0	0	111.9	I2159 G2185 M2186 S2191 Q2192 F2193	I2159-L2189 HydrophobicContact CD1-CD2 4.37Å; G2185-L2189 PolarHBondContact O-N 3.04Å; M2186-L2189 PolarHBondContact O-N 2.96Å; L2189-S2191 VanDerWaalsContact C-N 3.34Å; L2189-S2191 PolarHBondContact O-N 3.09Å; L2189-Q2192 PolarHBondContact O-N 3Å; L2189-F2193 HydrophobicContact CD2-CE2 4.09Å; L2189-F2193 HydrophobicContact CG-CE2 4.19Å; L2189-F2193 VanDerWaalsContact O-CD2 3.24Å; L2189-F2193 WeakPolarHBondContact O-CD2 3.43Å; L2189-F2193 PolarHBondContact O-N 2.82Å
2190	L	78	Confident	71	Confident	103 Å²	103	96.5 Å²	96.5	54%	0.539	51%	0.513	S	S	.	.	H	α-helix	trans	-63.4	-40.4	179.5	-151.4	99.5	0	0	0	111.9	M2186 Y2188 F2193 Y2194	M2186-L2190 WeakPolarHBondContact O-CB 3.15Å; M2186-L2190 PolarHBondContact O-N 3.42Å; Y2188-L2190 VanDerWaalsContact C-N 3.35Å; Y2188-L2190 PolarHBondContact O-N 3.37Å; L2190-F2193 PolarHBondContact O-N 2.89Å; L2190-Y2194 HydrophobicContact CD2-CD2 4.33Å; L2190-Y2194 HydrophobicContact CD2-CE2 4.07Å; L2190-Y2194 HydrophobicContact CG-CD2 4.5Å; L2190-Y2194 HydrophobicContact CG-CE2 4.48Å; L2190-Y2194 WeakPolarHBondContact O-CD2 3.39Å; L2190-Y2194 PolarHBondContact O-N 2.85Å; L2190-Y2194 VanDerWaalsContact O-N 3.17Å
2191	S	76.9	Confident	71.4	Confident	64 Å²	64	94.7 Å²	94.7	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-72.4	-30.3	-179.8	49.7	0	0	0	0	113.1	F2187 Y2188 L2189 Y2194 Y2195	F2187-S2191 WeakPolarHBondContact O-CB 3.22Å; F2187-S2191 PolarHBondContact O-N 3.19Å; F2187-S2191 PolarHBondContact O-OG 2.9Å; Y2188-S2191 PolarHBondContact O-N 3.35Å; Y2188-S2191 PolarHBondContact O-OG 2.75Å; L2189-S2191 VanDerWaalsContact C-N 3.34Å; L2189-S2191 PolarHBondContact O-N 3.09Å; S2191-Y2194 PolarHBondContact O-N 3.26Å; S2191-Y2195 WeakPolarHBondContact O-CB 3.46Å; S2191-Y2195 PolarHBondContact O-N 3.39Å
2192	Q	75.6	Confident	72	Confident	99 Å²	99	95.3 Å²	95.3	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-59.9	-47.5	168.5	-73.7	-162	-0.2	0	0	112.3	Y2188 L2189 Y2194 Y2195 F2196	Y2188-Q2192 HydrophobicContact CE1-CG 4.33Å; Y2188-Q2192 PolarHBondContact O-N 3.43Å; Y2188-Q2192 VanDerWaalsContact O-N 3.12Å; Y2188-Q2192 PolarHBondContact OH-NE2 2.93Å; L2189-Q2192 PolarHBondContact O-N 3Å; Q2192-Y2194 VanDerWaalsContact C-N 3.33Å; Q2192-Y2194 PolarHBondContact O-N 2.82Å; Q2192-Y2195 PolarHBondContact O-N 2.64Å; Q2192-Y2195 VanDerWaalsContact O-N 3.13Å; Q2192-F2196 PolarHBondContact O-N 2.82Å
2193	F	78.4	Confident	72.6	Confident	116 Å²	116	97.7 Å²	97.7	51%	0.509	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-35.1	178.1	-68.6	-57.4	0	0	0	112.9	L2189 L2190 N2197 Y2203	L2189-F2193 HydrophobicContact CD2-CE2 4.09Å; L2189-F2193 HydrophobicContact CG-CE2 4.19Å; L2189-F2193 VanDerWaalsContact O-CD2 3.24Å; L2189-F2193 WeakPolarHBondContact O-CD2 3.43Å; L2189-F2193 PolarHBondContact O-N 2.82Å; L2190-F2193 PolarHBondContact O-N 2.89Å; F2193-N2197 PolarHBondContact O-N 3.12Å; F2193-N2197 PolarHBondContact O-ND2 2.94Å; F2193-Y2203 HydrophobicContact CD1-CE1 4.27Å; F2193-Y2203 PolarHBondContact O-OH 3.02Å
2194	Y	79.9	Confident	72.9	Confident	151 Å²	151	99.4 Å²	99.4	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-67.8	-35.8	172	-91.8	-73.4	0	0	0	112.9	L2190 S2191 Q2192 Q2198	L2190-Y2194 HydrophobicContact CD2-CD2 4.33Å; L2190-Y2194 HydrophobicContact CD2-CE2 4.07Å; L2190-Y2194 HydrophobicContact CG-CD2 4.5Å; L2190-Y2194 HydrophobicContact CG-CE2 4.48Å; L2190-Y2194 WeakPolarHBondContact O-CD2 3.39Å; L2190-Y2194 PolarHBondContact O-N 2.85Å; L2190-Y2194 VanDerWaalsContact O-N 3.17Å; S2191-Y2194 PolarHBondContact O-N 3.26Å; Q2192-Y2194 VanDerWaalsContact C-N 3.33Å; Q2192-Y2194 PolarHBondContact O-N 2.82Å; Y2194-Q2198 WeakPolarHBondContact O-CG 3.4Å; Y2194-Q2198 PolarHBondContact O-N 2.77Å; Y2194-Q2198 VanDerWaalsContact O-N 3.1Å
2195	Y	77.1	Confident	73.7	Confident	165 Å²	165	99.3 Å²	99.3	65%	0.647	51%	0.509	S	S	*	.	H	α-helix	trans	-69.2	-41.3	176.8	-171.6	-104.8	0	0	0	112.1	S2191 Q2192 Q2198 N2199	S2191-Y2195 WeakPolarHBondContact O-CB 3.46Å; S2191-Y2195 PolarHBondContact O-N 3.39Å; Q2192-Y2195 PolarHBondContact O-N 2.64Å; Q2192-Y2195 VanDerWaalsContact O-N 3.13Å; Y2195-Q2198 PolarHBondContact O-N 3.36Å; Y2195-N2199 VanDerWaalsContact CE1-ND2 3.34Å; Y2195-N2199 WeakPolarHBondContact CE1-ND2 3.38Å; Y2195-N2199 PolarHBondContact O-N 3.47Å; Y2195-N2199 VanDerWaalsContact O-N 3.14Å; Y2195-N2199 PolarHBondContact O-ND2 3.18Å
2196	F	77.6	Confident	74.2	Confident	92 Å²	92	100.9 Å²	100.9	40%	0.404	51%	0.509	S	S	.	.	H	α-helix	trans	-59.2	-48.9	174.6	179.8	-99.7	0	0	0	112.1	Q2192 Q2198 N2199 G2201 Y2203	Q2192-F2196 PolarHBondContact O-N 2.82Å; F2196-Q2198 PolarHBondContact O-N 3.32Å; F2196-N2199 PolarHBondContact O-N 2.82Å; F2196-G2201 VanDerWaalsContact CE1-O 3.26Å; F2196-G2201 WeakPolarHBondContact CE1-O 3.3Å; F2196-G2201 WeakPolarHBondContact O-CA 3.23Å; F2196-G2201 PolarHBondContact O-N 2.79Å; F2196-Y2203 HydrophobicContact CD1-CD1 4.13Å; F2196-Y2203 AromaticContact CD1-CE1 3.5Å; F2196-Y2203 HydrophobicContact CD1-CE1 3.5Å; F2196-Y2203 HydrophobicContact CD1-CE2 4.41Å; F2196-Y2203 AromaticContact CD1-CZ 3.66Å; F2196-Y2203 AromaticContact CE1-CD1 3.79Å; F2196-Y2203 HydrophobicContact CE1-CD1 3.79Å; F2196-Y2203 AromaticContact CE1-CE1 3.67Å; F2196-Y2203 HydrophobicContact CE1-CE1 3.67Å; F2196-Y2203 HydrophobicContact CE1-CG 4.35Å
2197	N	77.5	Confident	74.4	Confident	82 Å²	82	101.7 Å²	101.7	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-56.3	-46.8	174.6	-85.5	-65.9	0	0	0	112.6	F2193 N2199 G2200 Y2203	F2193-N2197 PolarHBondContact O-N 3.12Å; F2193-N2197 PolarHBondContact O-ND2 2.94Å; N2197-N2199 VanDerWaalsContact C-N 3.28Å; N2197-N2199 PolarHBondContact O-N 3.35Å; N2197-G2200 PolarHBondContact O-N 2.66Å; N2197-Y2203 WeakPolarHBondContact ND2-CE2 3.39Å; N2197-Y2203 PolarHBondContact ND2-OH 3.15Å; N2197-Y2203 WeakPolarHBondContact OD1-CE2 3.25Å
2198	Q	71.4	Confident	74.6	Confident	160 Å²	160	103.3 Å²	103.3	75%	0.748	52%	0.518	S	S	*	.	H	α-helix	trans	-66.2	-28.8	-177.3	-80.4	-175.4	73.4	0	0	113.4	Y2194 Y2195 F2196 G2200	Y2194-Q2198 WeakPolarHBondContact O-CG 3.4Å; Y2194-Q2198 PolarHBondContact O-N 2.77Å; Y2194-Q2198 VanDerWaalsContact O-N 3.1Å; Y2195-Q2198 PolarHBondContact O-N 3.36Å; F2196-Q2198 PolarHBondContact O-N 3.32Å; Q2198-G2200 PolarHBondContact O-N 2.88Å
2199	N	67.8	Low	74.6	Confident	108 Å²	108	100.2 Å²	100.2	58%	0.578	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	12	173.4	-72.2	-76.7	0	0	0	113.4	Y2195 F2196 N2197 G2201	Y2195-N2199 VanDerWaalsContact CE1-ND2 3.34Å; Y2195-N2199 WeakPolarHBondContact CE1-ND2 3.38Å; Y2195-N2199 PolarHBondContact O-N 3.47Å; Y2195-N2199 VanDerWaalsContact O-N 3.14Å; Y2195-N2199 PolarHBondContact O-ND2 3.18Å; F2196-N2199 PolarHBondContact O-N 2.82Å; N2197-N2199 VanDerWaalsContact C-N 3.28Å; N2197-N2199 PolarHBondContact O-N 3.35Å; N2199-G2201 VanDerWaalsContact C-N 3.3Å; N2199-G2201 PolarHBondContact O-N 2.89Å
2200	G	67.4	Low	74.9	Confident	67 Å²	67	97.8 Å²	97.8	69%	0.691	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	14.9	-179.9	0	0	0	0	0	114.2	N2197 Q2198 A2202	N2197-G2200 PolarHBondContact O-N 2.66Å; Q2198-G2200 PolarHBondContact O-N 2.88Å; G2200-A2202 PolarHBondContact O-N 3.08Å
2201	G	72.2	Confident	75	Confident	19 Å²	19	98.8 Å²	98.8	20%	0.196	50%	0.502	C	S	.	.			trans	-67.3	117.9	174.9	0	0	0	0	0	111.5	F2196 N2199	F2196-G2201 VanDerWaalsContact CE1-O 3.26Å; F2196-G2201 WeakPolarHBondContact CE1-O 3.3Å; F2196-G2201 WeakPolarHBondContact O-CA 3.23Å; F2196-G2201 PolarHBondContact O-N 2.79Å; N2199-G2201 VanDerWaalsContact C-N 3.3Å; N2199-G2201 PolarHBondContact O-N 2.89Å
2202	A	75	Confident	74.7	Confident	65 Å²	65	100 Å²	100	54%	0.537	52%	0.515	S	S	.	.			trans	-88.9	139.6	173	0	0	0	0	0	111.2	G2200 T2204	G2200-A2202 PolarHBondContact O-N 3.08Å; A2202-T2204 PolarHBondContact O-N 2.95Å; A2202-T2204 VanDerWaalsContact O-N 3.09Å
2203	Y	74.8	Confident	74.7	Confident	87 Å²	87	99.9 Å²	99.9	34%	0.341	52%	0.517	S	S	.	.			trans	-82.9	82.3	178.3	-65	-70.3	0	0	0	111.6	F2193 F2196 N2197 F2205	F2193-Y2203 HydrophobicContact CD1-CE1 4.27Å; F2193-Y2203 PolarHBondContact O-OH 3.02Å; F2196-Y2203 HydrophobicContact CD1-CD1 4.13Å; F2196-Y2203 AromaticContact CD1-CE1 3.5Å; F2196-Y2203 HydrophobicContact CD1-CE1 3.5Å; F2196-Y2203 HydrophobicContact CD1-CE2 4.41Å; F2196-Y2203 AromaticContact CD1-CZ 3.66Å; F2196-Y2203 AromaticContact CE1-CD1 3.79Å; F2196-Y2203 HydrophobicContact CE1-CD1 3.79Å; F2196-Y2203 AromaticContact CE1-CE1 3.67Å; F2196-Y2203 HydrophobicContact CE1-CE1 3.67Å; F2196-Y2203 HydrophobicContact CE1-CG 4.35Å; N2197-Y2203 WeakPolarHBondContact ND2-CE2 3.39Å; N2197-Y2203 PolarHBondContact ND2-OH 3.15Å; N2197-Y2203 WeakPolarHBondContact OD1-CE2 3.25Å; Y2203-F2205 PolarHBondContact O-N 2.79Å
2204	T	72	Confident	74.7	Confident	109 Å²	109	98 Å²	98	67%	0.669	53%	0.53	S	S	*	.			trans	-49.4	137.3	175.9	58.6	0	0	0	0	112	A2202 N2206	A2202-T2204 PolarHBondContact O-N 2.95Å; A2202-T2204 VanDerWaalsContact O-N 3.09Å; T2204-N2206 PolarHBondContact O-N 3.3Å; T2204-N2206 VanDerWaalsContact O-N 3.1Å
2205	F	77.1	Confident	74.7	Confident	113 Å²	113	92.3 Å²	92.3	50%	0.496	52%	0.518	S	S	.	.			trans	-44.2	115.7	175.6	175.1	-98.1	0	0	0	112.9	Y2203 Q2207 Y2216 L2222	Y2203-F2205 PolarHBondContact O-N 2.79Å; F2205-Q2207 HydrophobicContact CE1-CB 3.86Å; F2205-Q2207 HydrophobicContact CZ-CB 4.18Å; F2205-Y2216 AromaticContact CD2-CD2 3.64Å; F2205-Y2216 HydrophobicContact CD2-CD2 3.64Å; F2205-Y2216 AromaticContact CD2-CE2 3.46Å; F2205-Y2216 HydrophobicContact CD2-CE2 3.46Å; F2205-Y2216 VanDerWaalsContact CD2-CE2 3.46Å; F2205-Y2216 AromaticContact CE2-CD2 3.81Å; F2205-Y2216 HydrophobicContact CE2-CD2 3.81Å; F2205-Y2216 AromaticContact CE2-CE2 3.8Å; F2205-Y2216 HydrophobicContact CE2-CE2 3.8Å; F2205-Y2216 HydrophobicContact CG-CE2 4.34Å; F2205-L2222 HydrophobicContact CB-CD1 4.27Å; F2205-L2222 HydrophobicContact CD2-CD1 4.14Å
2206	N	75.5	Confident	74.7	Confident	69 Å²	69	87.1 Å²	87.1	37%	0.369	50%	0.497	S	S	.	.			trans	-108.8	112.3	172.7	-177.5	-28.5	0	0	0	109.2	T2204 K2208 I2209 S2210 Y2216	T2204-N2206 PolarHBondContact O-N 3.3Å; T2204-N2206 VanDerWaalsContact O-N 3.1Å; N2206-K2208 VanDerWaalsContact C-N 3.3Å; N2206-K2208 PolarHBondContact O-N 3.1Å; N2206-K2208 WeakPolarHBondContact OD1-CB 3.38Å; N2206-K2208 PolarHBondContact OD1-N 2.86Å; N2206-I2209 HydrophobicContact CB-CB 4.13Å; N2206-I2209 HydrophobicContact CB-CD1 3.96Å; N2206-I2209 HydrophobicContact CB-CG1 4.04Å; N2206-I2209 PolarHBondContact O-N 3.23Å; N2206-I2209 VanDerWaalsContact O-N 3.16Å; N2206-I2209 PolarHBondContact OD1-N 3.4Å; N2206-S2210 PolarHBondContact O-N 2.72Å; N2206-Y2216 PolarHBondContact N-OH 3.08Å; N2206-Y2216 VanDerWaalsContact N-OH 3.08Å
2207	Q	73.9	Confident	74.6	Confident	116 Å²	116	87.1 Å²	87.1	54%	0.542	51%	0.506	S	S	.	.	H	α-helix	trans	-57.7	-40.2	-177.6	-177.4	172.9	-19.1	0	0	112.7	F2205 I2209 S2210 E2211	F2205-Q2207 HydrophobicContact CE1-CB 3.86Å; F2205-Q2207 HydrophobicContact CZ-CB 4.18Å; Q2207-I2209 VanDerWaalsContact C-N 3.35Å; Q2207-I2209 PolarHBondContact O-N 3.45Å; Q2207-S2210 WeakPolarHBondContact O-CB 3.49Å; Q2207-S2210 PolarHBondContact O-N 2.71Å; Q2207-E2211 HydrophobicContact CG-CG 4.3Å; Q2207-E2211 WeakPolarHBondContact CG-OE1 3.29Å; Q2207-E2211 PolarHBondContact NE2-OE1 2.95Å; Q2207-E2211 WeakPolarHBondContact O-CB 3.35Å; Q2207-E2211 VanDerWaalsContact O-CG 3.31Å; Q2207-E2211 WeakPolarHBondContact O-CG 3.28Å; Q2207-E2211 PolarHBondContact O-N 3.21Å
2208	K	75.2	Confident	74.5	Confident	167 Å²	167	91.5 Å²	91.5	73%	0.726	52%	0.521	S	S	*	.	H	α-helix	trans	-64.3	-39.4	178.8	-67.5	-175.1	176.2	-177.1	0	112.1	N2206 A2212	N2206-K2208 VanDerWaalsContact C-N 3.3Å; N2206-K2208 PolarHBondContact O-N 3.1Å; N2206-K2208 WeakPolarHBondContact OD1-CB 3.38Å; N2206-K2208 PolarHBondContact OD1-N 2.86Å; K2208-A2212 WeakPolarHBondContact O-CB 3.2Å; K2208-A2212 PolarHBondContact O-N 2.88Å
2209	I	71.9	Confident	74.2	Confident	80 Å²	80	90.1 Å²	90.1	41%	0.41	52%	0.519	S	S	.	.	H	α-helix	trans	-67.2	-46.5	175.4	-64.1	179.3	0	0	0	109.4	N2206 Q2207 E2211 A2212 I2213 Y2216	N2206-I2209 HydrophobicContact CB-CB 4.13Å; N2206-I2209 HydrophobicContact CB-CD1 3.96Å; N2206-I2209 HydrophobicContact CB-CG1 4.04Å; N2206-I2209 PolarHBondContact O-N 3.23Å; N2206-I2209 VanDerWaalsContact O-N 3.16Å; N2206-I2209 PolarHBondContact OD1-N 3.4Å; Q2207-I2209 VanDerWaalsContact C-N 3.35Å; Q2207-I2209 PolarHBondContact O-N 3.45Å; I2209-E2211 VanDerWaalsContact C-N 3.29Å; I2209-E2211 PolarHBondContact O-N 2.61Å; I2209-A2212 PolarHBondContact O-N 3.2Å; I2209-A2212 VanDerWaalsContact O-N 3.16Å; I2209-I2213 HydrophobicContact CG2-CD1 4.21Å; I2209-I2213 HydrophobicContact CG2-CG2 4.39Å; I2209-I2213 WeakPolarHBondContact O-CG1 3.39Å; I2209-I2213 PolarHBondContact O-N 3.09Å; I2209-Y2216 HydrophobicContact CG2-CE1 4.29Å
2210	S	78	Confident	74.1	Confident	21 Å²	21	87.1 Å²	87.1	15%	0.147	51%	0.509	C	S	.	.	H	α-helix	trans	-57	-41.4	176.4	-166.5	0	0	0	0	112.3	N2206 Q2207 G2214 G2215	N2206-S2210 PolarHBondContact O-N 2.72Å; Q2207-S2210 WeakPolarHBondContact O-CB 3.49Å; Q2207-S2210 PolarHBondContact O-N 2.71Å; S2210-G2214 PolarHBondContact O-N 3.26Å; S2210-G2215 WeakPolarHBondContact O-CA 3.3Å; S2210-G2215 PolarHBondContact O-N 2.79Å
2211	E	79.6	Confident	74	Confident	125 Å²	125	90.4 Å²	90.4	58%	0.584	52%	0.516	S	S	*	.	H	α-helix	trans	-67.7	-42.4	176.5	-73.9	166.7	174.8	0	0	111.6	Q2207 I2209	Q2207-E2211 HydrophobicContact CG-CG 4.3Å; Q2207-E2211 WeakPolarHBondContact CG-OE1 3.29Å; Q2207-E2211 PolarHBondContact NE2-OE1 2.95Å; Q2207-E2211 WeakPolarHBondContact O-CB 3.35Å; Q2207-E2211 VanDerWaalsContact O-CG 3.31Å; Q2207-E2211 WeakPolarHBondContact O-CG 3.28Å; Q2207-E2211 PolarHBondContact O-N 3.21Å; I2209-E2211 VanDerWaalsContact C-N 3.29Å; I2209-E2211 PolarHBondContact O-N 2.61Å
2212	A	70.7	Confident	73.5	Confident	89 Å²	89	94 Å²	94	74%	0.736	53%	0.53	S	S	*	.	H	α-helix	trans	-67	-34.9	179.3	0	0	0	0	0	114	K2208 I2209	K2208-A2212 WeakPolarHBondContact O-CB 3.2Å; K2208-A2212 PolarHBondContact O-N 2.88Å; I2209-A2212 PolarHBondContact O-N 3.2Å; I2209-A2212 VanDerWaalsContact O-N 3.16Å
2213	I	74.9	Confident	73.4	Confident	97 Å²	97	95.5 Å²	95.5	50%	0.497	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	1.6	-179.1	74.4	-176	0	0	0	114.2	I2209 Y2216	I2209-I2213 HydrophobicContact CG2-CD1 4.21Å; I2209-I2213 HydrophobicContact CG2-CG2 4.39Å; I2209-I2213 WeakPolarHBondContact O-CG1 3.39Å; I2209-I2213 PolarHBondContact O-N 3.09Å; I2213-Y2216 HydrophobicContact CD1-CD1 4.05Å; I2213-Y2216 HydrophobicContact CD1-CE1 4.4Å; I2213-Y2216 HydrophobicContact CD1-CG 4.43Å
2214	G	78.6	Confident	73.3	Confident	76 Å²	76	95.9 Å²	95.9	78%	0.784	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	20.9	-179.5	0	0	0	0	0	115.1	S2210	S2210-G2214 PolarHBondContact O-N 3.26Å
2215	G	80.4	Confident	73.4	Confident	32 Å²	32	95.2 Å²	95.2	33%	0.33	53%	0.532	S	S	.	.	S	Bend	trans	107.7	137.7	-174.3	0	0	0	0	0	111.8	S2210	S2210-G2215 WeakPolarHBondContact O-CA 3.3Å; S2210-G2215 PolarHBondContact O-N 2.79Å
2216	Y	77.5	Confident	73.2	Confident	56 Å²	56	94.1 Å²	94.1	22%	0.22	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-55.7	140.2	168.3	-74.6	-81.2	0	0	0	110.4	F2205 N2206 I2209 I2213 K2218 L2222	F2205-Y2216 AromaticContact CD2-CD2 3.64Å; F2205-Y2216 HydrophobicContact CD2-CD2 3.64Å; F2205-Y2216 AromaticContact CD2-CE2 3.46Å; F2205-Y2216 HydrophobicContact CD2-CE2 3.46Å; F2205-Y2216 VanDerWaalsContact CD2-CE2 3.46Å; F2205-Y2216 AromaticContact CE2-CD2 3.81Å; F2205-Y2216 HydrophobicContact CE2-CD2 3.81Å; F2205-Y2216 AromaticContact CE2-CE2 3.8Å; F2205-Y2216 HydrophobicContact CE2-CE2 3.8Å; F2205-Y2216 HydrophobicContact CG-CE2 4.34Å; N2206-Y2216 PolarHBondContact N-OH 3.08Å; N2206-Y2216 VanDerWaalsContact N-OH 3.08Å; I2209-Y2216 HydrophobicContact CG2-CE1 4.29Å; I2213-Y2216 HydrophobicContact CD1-CD1 4.05Å; I2213-Y2216 HydrophobicContact CD1-CE1 4.4Å; I2213-Y2216 HydrophobicContact CD1-CG 4.43Å; Y2216-K2218 PolarHBondContact O-N 2.84Å; Y2216-L2222 HydrophobicContact CD1-CD2 3.9Å; Y2216-L2222 HydrophobicContact CD2-CD1 4.38Å; Y2216-L2222 HydrophobicContact CD2-CD2 4.19Å; Y2216-L2222 HydrophobicContact CE1-CD2 3.86Å; Y2216-L2222 HydrophobicContact CE2-CD2 4.15Å; Y2216-L2222 HydrophobicContact CG-CD1 4.5Å; Y2216-L2222 HydrophobicContact CG-CD2 4.05Å
2217	P	75.7	Confident	73	Confident	92 Å²	92	95.7 Å²	95.7	60%	0.597	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-52.6	142	177.5	-27.4	34.9	0	0	0	111.8	D2219 A2220	P2217-D2219 PolarHBondContact O-N 3.32Å; P2217-A2220 HydrophobicContact CB-CB 4.45Å; P2217-A2220 WeakPolarHBondContact O-CB 3.38Å; P2217-A2220 PolarHBondContact O-N 3.07Å
2218	K	74.8	Confident	73	Confident	173 Å²	173	94.3 Å²	94.3	75%	0.752	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	136.3	174.3	-166.1	-161.6	165.5	-101.7	0	109.2	Y2216 A2220	Y2216-K2218 PolarHBondContact O-N 2.84Å; K2218-A2220 PolarHBondContact O-N 3.43Å
2219	D	65.6	Low	72.8	Confident	132 Å²	132	89.1 Å²	89.1	71%	0.706	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	14.8	-177.6	-42.1	-46.1	0	0	0	114.3	P2217	P2217-D2219 PolarHBondContact O-N 3.32Å
2220	A	66.1	Low	72.9	Confident	44 Å²	44	89.8 Å²	89.8	36%	0.364	54%	0.541	S	S	.	.			trans	-65.9	139.7	164.1	0	0	0	0	0	111.5	P2217 K2218	P2217-A2220 HydrophobicContact CB-CB 4.45Å; P2217-A2220 WeakPolarHBondContact O-CB 3.38Å; P2217-A2220 PolarHBondContact O-N 3.07Å; K2218-A2220 PolarHBondContact O-N 3.43Å
2221	V	65.2	Low	72.5	Confident	137 Å²	137	95.6 Å²	95.6	83%	0.83	57%	0.574	S	S	*	*			trans	-86.3	132.7	176.2	-175.8	0	0	0	0	109.3
2222	L	60.4	Low	71.8	Confident	94 Å²	94	92.9 Å²	92.9	49%	0.492	57%	0.573	S	S	.	*			trans	-131.4	0	-175.7	-64	171	0	0	0	110.1	F2205 Y2216	F2205-L2222 HydrophobicContact CB-CD1 4.27Å; F2205-L2222 HydrophobicContact CD2-CD1 4.14Å; Y2216-L2222 HydrophobicContact CD1-CD2 3.9Å; Y2216-L2222 HydrophobicContact CD2-CD1 4.38Å; Y2216-L2222 HydrophobicContact CD2-CD2 4.19Å; Y2216-L2222 HydrophobicContact CE1-CD2 3.86Å; Y2216-L2222 HydrophobicContact CE2-CD2 4.15Å; Y2216-L2222 HydrophobicContact CG-CD1 4.5Å; Y2216-L2222 HydrophobicContact CG-CD2 4.05Å

Retrieved 2,222 of 2,222 residues in 1703.9 ms (Link to these results)

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