A0A077ZDB7_TRITR Loading...

P-type Ca(2+) transporter

AlphaFold DB , UniProt , Accession A0A077ZDB7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 980 aa.

						>A0A077ZDB7_TRITR|A0A077ZDB7
MKSKIYSVTEKIPPPAVELTKQDKGYGLSPALAARLDADAVACRLNADLSNGLSSSDAAKRIRLHGYNEFLVDTKEPLLKKYVDQFRNPLILLLLGSAFISIIMGQYDDAISITTAIVIVVTVAFVQEYRSEKSLDELTKLVPPVCTCLRDRREVSFAARELVPGDVVLLTMGDRVPADLRLLEAVELQIDESSLTGETEPAKKSACIISCSENLKTVSQLKNIAFMGTLVRVGKGKGVVISTGHSSEFGNVFSMMKTEESPKTPLQKSMDHLGKQLSCYSFAVIALIFTVGIAQGRNALEMFTIAVSLAVAAIPEGLPVIVTVTLALGVIRMARNRVIVKKLPTVETLGCVNVICSDKTGTLTKNEMTAVRLVAADGTQADVSGVGYSEVGGLCAVGGEAVLGFSHPSISKMIEIGVVCNNSDVVDGNLRGQPTEGALVVLAKKVGDMDLNICVFILLFTRQAKLADRRRNFEILQEIPFSSDTKWMAVLCNNRSSNGDPVYYVKGAVSSVLEMCAYYLDGTSEQKLTKAEMGSFNLEARRLGCTGLRVLAVAYGLSLTQLVYAGVIGILDPPRPGTRESIEVVRSSGVKVKMITGDSLETALCVANRLGMNTDSSGALSGEELEKMDQVQLERVIDHVIVFYRASPRHKLKIVKTLSCEDYIASFTYFSLVKIFGQQFHNLITLNSNFLFFTGFIVAMTGDGVNDAVALKKADIGISMGSTGTDVSREAADMILLNDDFYAIRSAIVEGKGIYNNIRNFVRFQLSTSIAALTLVAVSTLFKLPNPLNAMQILFINMIMDGPPAQSLGVEPVDPDIIKQPPRNVREPMITRSVITSIALAAGTILCGTLWVFMREISDSGMTPRVTTMTFTCFVFFDMWNALSCRSQKLIFEIGLFRNRMFLLAVTFSIIILVLVIFFPPLQSLFQTEALRISDFIFLSFLTSSVFLLSECRKLVEQYLTTRHRQFDLAPMHCIKCEPH
					

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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	36.4	Very low	34	Very low	238 Å²	238	163.8 Å²	163.8	100%	1.172	83%	0.826	S	S	*	*				0	152.1	0	-73.2	178.7	170.9	0	0	108.9
2	K	32.5	Very low	33.9	Very low	201 Å²	201	162.9 Å²	162.9	87%	0.874	82%	0.822	S	S	*	*			trans	17.2	139.5	158.7	-57	175.2	179.8	177.8	0	119.2
3	S	34	Very low	34	Very low	105 Å²	105	158.5 Å²	158.5	73%	0.734	81%	0.811	S	S	*	*			cis	167.9	149.9	-13.4	48.7	0	0	0	0	105.9
4	K	35.3	Very low	34.3	Very low	164 Å²	164	155.5 Å²	155.5	71%	0.713	81%	0.808	S	S	*	*			cis	-128.4	-179.9	20.6	-79.4	170.2	171.7	170.7	0	109.4	Y6	K4-Y6 HydrophobicContact CD-CE2 4.22Å
5	I	33.7	Very low	34.4	Very low	145 Å²	145	153.4 Å²	153.4	74%	0.744	81%	0.808	S	S	*	*			cis	85.4	141.7	22.1	-58.1	174.4	0	0	0	115.2
6	Y	36.8	Very low	34.3	Very low	195 Å²	195	150.3 Å²	150.3	77%	0.765	81%	0.811	S	S	*	*			trans	89	130	-172	-55.5	-68.7	0	0	0	115.5	K4	K4-Y6 HydrophobicContact CD-CE2 4.22Å
7	S	35.3	Very low	34.3	Very low	103 Å²	103	149.3 Å²	149.3	72%	0.72	81%	0.81	S	S	*	*			cis	-158.4	116	-10.6	51.4	0	0	0	0	114.5
8	V	31.5	Very low	33.9	Very low	125 Å²	125	151.3 Å²	151.3	76%	0.758	81%	0.813	S	S	*	*			trans	9	127.9	143.8	-178.5	0	0	0	0	119.9
9	T	33.8	Very low	33.7	Very low	145 Å²	145	151.1 Å²	151.1	89%	0.89	81%	0.811	S	S	*	*				-162.8	140.6	125.2	6.3	0	0	0	0	110.6
10	E	30	Very low	33.6	Very low	170 Å²	170	148.3 Å²	148.3	79%	0.794	80%	0.8	S	S	*	*			trans	-104.4	149.1	-168.2	-63.1	169.2	106.9	0	0	113.8
11	K	35.4	Very low	33.4	Very low	211 Å²	211	150.1 Å²	150.1	92%	0.917	80%	0.801	S	S	*	*			trans	-139.4	136.4	147.6	-81.6	-167.7	175.5	178.4	0	109.8
12	I	32.2	Very low	33.3	Very low	153 Å²	153	147.5 Å²	147.5	79%	0.785	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-89.8	136.3	-170.1	-60	162.7	0	0	0	110.1
13	P	35.5	Very low	33.5	Very low	105 Å²	105	142.8 Å²	142.8	68%	0.682	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-80.9	146.5	171.6	32.8	-34	0	0	0	112.3
14	P	38.6	Very low	33.7	Very low	117 Å²	117	146.1 Å²	146.1	76%	0.76	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-67.8	160.7	169.4	30.2	-34.6	0	0	0	111.8
15	P	34.8	Very low	34.5	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-70.6	151.3	-169.4	28.6	-36.2	0	0	0	113.8
16	A	32.8	Very low	35.7	Very low	104 Å²	104	137.2 Å²	137.2	86%	0.86	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-70.8	136.8	176.7	0	0	0	0	0	112.1
17	V	35.5	Very low	37.2	Very low	133 Å²	133	130 Å²	130	81%	0.806	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-91	137	169.6	178.8	0	0	0	0	108.7	L19	V17-L19 PolarHBondContact O-N 3.34Å
18	E	27.1	Very low	39.4	Very low	185 Å²	185	125.9 Å²	125.9	86%	0.864	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-66.9	122.1	179	-68.3	-174.5	105.5	0	0	111.9
19	L	28.8	Very low	41.8	Very low	148 Å²	148	123 Å²	123	78%	0.775	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-79.3	125.6	175.1	-72.9	166.3	0	0	0	110.7	V17 D23	V17-L19 PolarHBondContact O-N 3.34Å; L19-D23 HydrophobicContact CD2-CB 4.19Å
20	T	31.4	Very low	44.2	Very low	95 Å²	95	116.3 Å²	116.3	58%	0.583	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-78.9	158.4	178.9	67.4	0	0	0	0	111.4	Q22 D23	T20-Q22 PolarHBondContact O-N 3.08Å; T20-D23 PolarHBondContact O-N 3.18Å; T20-D23 VanDerWaalsContact O-N 3.08Å
21	K	30.9	Very low	46.7	Very low	187 Å²	187	109.8 Å²	109.8	81%	0.813	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-9.6	-168.4	-74	-179.2	179.3	172.6	0	115.9
22	Q	33.4	Very low	49.1	Very low	183 Å²	183	102.9 Å²	102.9	86%	0.855	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-24.9	175.7	-74.4	-179.3	-41	0	0	113.2	T20 K24	T20-Q22 PolarHBondContact O-N 3.08Å; Q22-K24 PolarHBondContact O-N 3.44Å
23	D	37.8	Very low	51.6	Low	102 Å²	102	95.6 Å²	95.6	55%	0.545	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	22.9	-180	-59.8	-58.9	0	0	0	113.8	L19 T20	L19-D23 HydrophobicContact CD2-CB 4.19Å; T20-D23 PolarHBondContact O-N 3.18Å; T20-D23 VanDerWaalsContact O-N 3.08Å
24	K	36.7	Very low	54	Low	175 Å²	175	90.6 Å²	90.6	76%	0.761	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-0.8	-176.3	-76.3	-161	169.5	-161.5	0	115.3	Q22	Q22-K24 PolarHBondContact O-N 3.44Å
25	G	52.1	Low	56.2	Low	45 Å²	45	90.9 Å²	90.9	46%	0.464	50%	0.501	S	S	.	.	S	Bend	trans	-105.4	127.6	169.6	0	0	0	0	0	110.5	G27	G25-G27 PolarHBondContact O-N 3.01Å
26	Y	59.1	Low	58.6	Low	77 Å²	77	86.5 Å²	86.5	30%	0.302	47%	0.471	S	S	.	.			trans	-72.6	34.2	176.4	-64.1	-77.1	0	0	0	113.6	L45 N46 H65 P164	Y26-L45 WeakPolarHBondContact O-CD2 3.22Å; Y26-N46 HydrophobicContact CE1-CB 4.09Å; Y26-H65 AromaticContact CD2-NE2 3.77Å; Y26-H65 PolarHBondContact N-CE1 2.9Å; Y26-H65 VanDerWaalsContact N-CE1 3.33Å; Y26-H65 PolarHBondContact N-NE2 2.93Å; Y26-P164 WeakPolarHBondContact O-CB 3.29Å
27	G	69	Low	61.2	Low	42 Å²	42	85.3 Å²	85.3	43%	0.433	45%	0.45	S	S	.	.			trans	-107.6	141.9	-179.4	0	0	0	0	0	112.1	G25 I241	G25-G27 PolarHBondContact O-N 3.01Å; G27-I241 WeakPolarHBondContact CA-O 3.47Å
28	L	81.5	Confident	63.5	Low	17 Å²	17	79.8 Å²	79.8	9%	0.089	42%	0.418	C	S	.	.			trans	-124.8	135.4	174.4	-72.4	166.5	0	0	0	110	L32 A33 V41 R44 L45 I241	L28-L32 HydrophobicContact CD2-CD2 4.06Å; L28-A33 HydrophobicContact CB-CB 4.46Å; L28-V41 HydrophobicContact CD1-CB 4.42Å; L28-V41 HydrophobicContact CD1-CG1 3.87Å; L28-V41 HydrophobicContact CD1-CG2 4.36Å; L28-R44 HydrophobicContact CD1-CB 4.15Å; L28-L45 HydrophobicContact CD1-CD1 4.46Å; L28-L45 HydrophobicContact CD1-CD2 3.98Å; L28-L45 HydrophobicContact CD1-CG 3.99Å; L28-L45 HydrophobicContact CG-CD2 4.27Å; L28-I241 HydrophobicContact CB-CB 4.22Å; L28-I241 HydrophobicContact CB-CG2 4.41Å; L28-I241 PolarHBondContact N-O 3.22Å
29	S	82.6	Confident	66.3	Low	66 Å²	66	76 Å²	76	46%	0.462	40%	0.404	S	S	.	.			trans	-69.8	140.4	173	59.2	0	0	0	0	110.7	A31 L32 A33	S29-A31 VanDerWaalsContact C-N 3.29Å; S29-A31 PolarHBondContact O-N 3.3Å; S29-L32 WeakPolarHBondContact O-CA 3.45Å; S29-L32 WeakPolarHBondContact O-CB 3.33Å; S29-L32 PolarHBondContact O-N 3.11Å; S29-L32 WeakPolarHBondContact OG-CB 3.49Å; S29-A33 PolarHBondContact O-N 3.08Å
30	P	84	Confident	69.1	Low	3 Å²	3	70.8 Å²	70.8	2%	0.019	38%	0.383	C	S	.	.	H	α-helix	trans	-53.2	-41.5	179.9	-34.6	41.3	0	0	0	114.4	L32 A33 A34 L221 I224 F226 I241 E248	P30-L32 PolarHBondContact O-N 3.39Å; P30-A33 PolarHBondContact O-N 3.13Å; P30-A34 VanDerWaalsContact O-CB 3.26Å; P30-A34 WeakPolarHBondContact O-CB 3.43Å; P30-A34 PolarHBondContact O-N 3.42Å; P30-L221 HydrophobicContact CB-CD1 4.2Å; P30-I224 HydrophobicContact CB-CG1 4.31Å; P30-I224 HydrophobicContact CB-CG2 4.24Å; P30-F226 HydrophobicContact CB-CE1 4.12Å; P30-I241 HydrophobicContact CB-CD1 4.15Å; P30-I241 HydrophobicContact CG-CD1 3.89Å; P30-E248 HydrophobicContact CB-CG 4.45Å; P30-E248 HydrophobicContact CG-CG 4.03Å
31	A	82.1	Confident	71.8	Confident	34 Å²	34	66.3 Å²	66.3	28%	0.281	36%	0.355	S	S	.	.	H	α-helix	trans	-65.6	-20.2	176.8	0	0	0	0	0	114.5	S29 R35	S29-A31 VanDerWaalsContact C-N 3.29Å; S29-A31 PolarHBondContact O-N 3.3Å; A31-R35 WeakPolarHBondContact O-CD 3.36Å; A31-R35 WeakPolarHBondContact O-CG 3.42Å; A31-R35 PolarHBondContact O-NE 3.35Å
32	L	84.6	Confident	74.4	Confident	65 Å²	65	57.8 Å²	57.8	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-90	-45.3	173	-179	60.5	0	0	0	111	L28 S29 P30 A34 R35 L36	L28-L32 HydrophobicContact CD2-CD2 4.06Å; S29-L32 WeakPolarHBondContact O-CA 3.45Å; S29-L32 WeakPolarHBondContact O-CB 3.33Å; S29-L32 PolarHBondContact O-N 3.11Å; S29-L32 WeakPolarHBondContact OG-CB 3.49Å; P30-L32 PolarHBondContact O-N 3.39Å; L32-A34 VanDerWaalsContact C-N 3.27Å; L32-A34 PolarHBondContact O-N 3.46Å; L32-R35 PolarHBondContact O-N 2.92Å; L32-R35 VanDerWaalsContact O-N 3.15Å; L32-L36 HydrophobicContact CG-CD1 4.27Å; L32-L36 WeakPolarHBondContact O-CG 3.26Å; L32-L36 PolarHBondContact O-N 2.86Å
33	A	85.8	Confident	77	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.1	-34	177.2	0	0	0	0	0	112.9	L28 S29 P30 R35 L36 V41 R181 I224 I241	L28-A33 HydrophobicContact CB-CB 4.46Å; S29-A33 PolarHBondContact O-N 3.08Å; P30-A33 PolarHBondContact O-N 3.13Å; A33-R35 VanDerWaalsContact C-N 3.26Å; A33-R35 PolarHBondContact O-N 3.34Å; A33-L36 PolarHBondContact O-N 3.46Å; A33-V41 HydrophobicContact CB-CG2 4.37Å; A33-R181 HydrophobicContact CB-CB 4.47Å; A33-R181 WeakPolarHBondContact O-CD 3.2Å; A33-R181 PolarHBondContact O-NE 3.09Å; A33-R181 VanDerWaalsContact O-NE 3.07Å; A33-I224 HydrophobicContact CB-CD1 4.11Å; A33-I241 HydrophobicContact CB-CB 4.46Å; A33-I241 HydrophobicContact CB-CD1 3.74Å; A33-I241 HydrophobicContact CB-CG2 3.9Å
34	A	85.9	Confident	79.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-25	176.6	0	0	0	0	0	114.3	P30 L32 I209 L221 N223 I224	P30-A34 VanDerWaalsContact O-CB 3.26Å; P30-A34 WeakPolarHBondContact O-CB 3.43Å; P30-A34 PolarHBondContact O-N 3.42Å; L32-A34 VanDerWaalsContact C-N 3.27Å; L32-A34 PolarHBondContact O-N 3.46Å; A34-I209 PolarHBondContact O-N 2.98Å; A34-I209 VanDerWaalsContact O-N 3.15Å; A34-L221 HydrophobicContact CB-CD2 3.81Å; A34-N223 VanDerWaalsContact CA-OD1 3.29Å; A34-N223 WeakPolarHBondContact CA-OD1 3.44Å; A34-N223 WeakPolarHBondContact CB-OD1 3.23Å; A34-N223 PolarHBondContact O-ND2 3.31Å; A34-I224 HydrophobicContact CB-CD1 4.26Å; A34-I224 HydrophobicContact CB-CG1 4.08Å
35	R	85.1	Confident	81.6	Confident	124 Å²	124	46.8 Å²	46.8	47%	0.468	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-11.6	178.7	-60.2	176.9	-169.6	-152	-1.8	113.1	A31 L32 A33 I208 L215	A31-R35 WeakPolarHBondContact O-CD 3.36Å; A31-R35 WeakPolarHBondContact O-CG 3.42Å; A31-R35 PolarHBondContact O-NE 3.35Å; L32-R35 PolarHBondContact O-N 2.92Å; L32-R35 VanDerWaalsContact O-N 3.15Å; A33-R35 VanDerWaalsContact C-N 3.26Å; A33-R35 PolarHBondContact O-N 3.34Å; R35-I208 WeakPolarHBondContact O-CG2 3.25Å; R35-L215 HydrophobicContact CG-CD1 4.37Å
36	L	85.5	Confident	83.2	Confident	31 Å²	31	49.7 Å²	49.7	16%	0.162	28%	0.276	C	S	.	.	S	Bend	trans	-100.4	154.1	-178	-68.1	171.7	0	0	0	110.6	L32 A33 A40 V41 R181	L32-L36 HydrophobicContact CG-CD1 4.27Å; L32-L36 WeakPolarHBondContact O-CG 3.26Å; L32-L36 PolarHBondContact O-N 2.86Å; A33-L36 PolarHBondContact O-N 3.46Å; L36-A40 HydrophobicContact CB-CB 4.39Å; L36-A40 HydrophobicContact CD2-CB 4.4Å; L36-V41 HydrophobicContact CB-CG2 3.66Å; L36-V41 HydrophobicContact CD1-CG2 4.17Å; L36-R181 PolarHBondContact O-NE 2.69Å; L36-R181 PolarHBondContact O-NH2 2.93Å
37	D	86.1	Confident	84.4	Confident	79 Å²	79	46.8 Å²	46.8	42%	0.422	27%	0.268	S	S	.	.			trans	-74.1	160.7	169.6	-160.6	10.9	0	0	0	111.8	D39 A40 V41 I208	D37-D39 PolarHBondContact O-N 3.32Å; D37-A40 HydrophobicContact CB-CB 4.33Å; D37-A40 PolarHBondContact O-N 3.01Å; D37-V41 WeakPolarHBondContact O-CG2 3.27Å; D37-V41 PolarHBondContact O-N 2.92Å; D37-I208 HydrophobicContact CB-CD1 3.7Å; D37-I208 HydrophobicContact CB-CG1 4.33Å
38	A	84.1	Confident	85.3	Confident	17 Å²	17	47.8 Å²	47.8	14%	0.14	26%	0.263	C	S	.	.	H	α-helix	trans	-54.8	-49.5	180	0	0	0	0	0	112.1	A40 V41 A42 L49 L183	A38-A40 VanDerWaalsContact C-N 3.34Å; A38-A40 PolarHBondContact O-N 2.69Å; A38-V41 PolarHBondContact O-N 2.89Å; A38-A42 WeakPolarHBondContact O-CB 3.33Å; A38-A42 PolarHBondContact O-N 2.98Å; A38-L49 HydrophobicContact CB-CD1 4.2Å; A38-L183 HydrophobicContact CB-CD2 3.83Å
39	D	86	Confident	85.4	Confident	105 Å²	105	48.3 Å²	48.3	56%	0.561	27%	0.266	S	S	*	.	H	α-helix	trans	-66.8	-34.8	178.9	-69.7	-22	0	0	0	112.4	D37 V41 A42 C43	D37-D39 PolarHBondContact O-N 3.32Å; D39-V41 VanDerWaalsContact C-N 3.34Å; D39-A42 WeakPolarHBondContact O-CB 3.46Å; D39-A42 PolarHBondContact O-N 2.72Å; D39-C43 WeakPolarHBondContact O-CB 3.25Å; D39-C43 PolarHBondContact O-N 2.94Å; D39-C43 PolarHBondContact O-SG 3.23Å
40	A	87.9	Confident	85.5	Confident	40 Å²	40	49 Å²	49	33%	0.331	27%	0.271	S	S	.	.	H	α-helix	trans	-68.6	-33.3	176.3	0	0	0	0	0	112.2	L36 D37 A38 R44	L36-A40 HydrophobicContact CB-CB 4.39Å; L36-A40 HydrophobicContact CD2-CB 4.4Å; D37-A40 HydrophobicContact CB-CB 4.33Å; D37-A40 PolarHBondContact O-N 3.01Å; A38-A40 VanDerWaalsContact C-N 3.34Å; A38-A40 PolarHBondContact O-N 2.69Å; A40-R44 WeakPolarHBondContact O-CG 3.32Å; A40-R44 PolarHBondContact O-N 3.16Å
41	V	87.2	Confident	85.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69.6	-45.3	169.7	169.9	0	0	0	0	110.4	L28 A33 L36 D37 A38 D39 C43 R44 L45 R181 V239 I241	L28-V41 HydrophobicContact CD1-CB 4.42Å; L28-V41 HydrophobicContact CD1-CG1 3.87Å; L28-V41 HydrophobicContact CD1-CG2 4.36Å; A33-V41 HydrophobicContact CB-CG2 4.37Å; L36-V41 HydrophobicContact CB-CG2 3.66Å; L36-V41 HydrophobicContact CD1-CG2 4.17Å; D37-V41 WeakPolarHBondContact O-CG2 3.27Å; D37-V41 PolarHBondContact O-N 2.92Å; A38-V41 PolarHBondContact O-N 2.89Å; D39-V41 VanDerWaalsContact C-N 3.34Å; V41-C43 PolarHBondContact O-N 3.46Å; V41-R44 PolarHBondContact O-N 2.98Å; V41-L45 HydrophobicContact CG1-CD1 3.64Å; V41-L45 HydrophobicContact CG1-CG 4.27Å; V41-L45 WeakPolarHBondContact O-CG 3.31Å; V41-L45 PolarHBondContact O-N 3.36Å; V41-R181 HydrophobicContact CG1-CB 4.34Å; V41-R181 HydrophobicContact CG1-CG 4.46Å; V41-R181 HydrophobicContact CG2-CG 4.26Å; V41-V239 HydrophobicContact CG1-CG1 3.72Å; V41-I241 HydrophobicContact CG1-CG2 3.93Å
42	A	86.7	Confident	85.7	Confident	8 Å²	8	49.4 Å²	49.4	7%	0.066	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-44.6	177.9	0	0	0	0	0	113	A38 D39 R44 L45 N46 A47 L49	A38-A42 WeakPolarHBondContact O-CB 3.33Å; A38-A42 PolarHBondContact O-N 2.98Å; D39-A42 WeakPolarHBondContact O-CB 3.46Å; D39-A42 PolarHBondContact O-N 2.72Å; A42-R44 PolarHBondContact O-N 3.05Å; A42-L45 CarbonylContact O-C 3.54Å; A42-L45 PolarHBondContact O-N 3.5Å; A42-N46 PolarHBondContact O-N 3.03Å; A42-A47 PolarHBondContact O-N 3.3Å; A42-L49 HydrophobicContact CB-CD1 3.81Å; A42-L49 HydrophobicContact CB-CD2 3.71Å; A42-L49 HydrophobicContact CB-CG 3.58Å
43	C	87.1	Confident	85.9	Confident	94 Å²	94	46.7 Å²	46.7	64%	0.635	26%	0.256	S	S	*	.	H	α-helix	trans	-62	-40.8	176.4	-68.3	0	0	0	0	112.2	D39 V41 N46	D39-C43 WeakPolarHBondContact O-CB 3.25Å; D39-C43 PolarHBondContact O-N 2.94Å; D39-C43 PolarHBondContact O-SG 3.23Å; V41-C43 PolarHBondContact O-N 3.46Å; C43-N46 PolarHBondContact O-N 3.39Å; C43-N46 PolarHBondContact O-OD1 3.09Å
44	R	86.5	Confident	86.1	Confident	135 Å²	135	48.2 Å²	48.2	51%	0.509	27%	0.266	S	S	.	.	H	α-helix	trans	-69.5	-32.4	176.3	-71.5	-178.4	-174.4	-148.9	0.6	112.9	L28 A40 V41 A42 N46	L28-R44 HydrophobicContact CD1-CB 4.15Å; A40-R44 WeakPolarHBondContact O-CG 3.32Å; A40-R44 PolarHBondContact O-N 3.16Å; V41-R44 PolarHBondContact O-N 2.98Å; A42-R44 PolarHBondContact O-N 3.05Å; R44-N46 VanDerWaalsContact C-N 3.34Å
45	L	85.3	Confident	86.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-85.1	-3.8	177.4	-63	176.2	0	0	0	113.3	Y26 L28 V41 A42 A47 R61 P164 V239 V240 I241	Y26-L45 WeakPolarHBondContact O-CD2 3.22Å; L28-L45 HydrophobicContact CD1-CD1 4.46Å; L28-L45 HydrophobicContact CD1-CD2 3.98Å; L28-L45 HydrophobicContact CD1-CG 3.99Å; L28-L45 HydrophobicContact CG-CD2 4.27Å; V41-L45 HydrophobicContact CG1-CD1 3.64Å; V41-L45 HydrophobicContact CG1-CG 4.27Å; V41-L45 WeakPolarHBondContact O-CG 3.31Å; V41-L45 PolarHBondContact O-N 3.36Å; A42-L45 CarbonylContact O-C 3.54Å; A42-L45 PolarHBondContact O-N 3.5Å; L45-A47 VanDerWaalsContact C-N 3.28Å; L45-A47 HydrophobicContact CB-CB 4.03Å; L45-A47 PolarHBondContact O-N 2.92Å; L45-R61 PolarHBondContact O-NH1 3.37Å; L45-R61 PolarHBondContact O-NH2 2.99Å; L45-P164 HydrophobicContact CD2-CB 4.46Å; L45-V239 HydrophobicContact CD1-CG1 4.21Å; L45-V239 HydrophobicContact CD1-CG2 3.69Å; L45-V240 WeakPolarHBondContact CD1-O 3.36Å; L45-I241 HydrophobicContact CD1-CG2 4.33Å
46	N	85.3	Confident	86.3	Confident	106 Å²	106	48.3 Å²	48.3	57%	0.567	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.6	54.1	-166.7	-76.6	-28.4	0	0	0	111.4	Y26 A42 C43 R44 R61	Y26-N46 HydrophobicContact CE1-CB 4.09Å; A42-N46 PolarHBondContact O-N 3.03Å; C43-N46 PolarHBondContact O-N 3.39Å; C43-N46 PolarHBondContact O-OD1 3.09Å; R44-N46 VanDerWaalsContact C-N 3.34Å; N46-R61 PolarHBondContact O-NH2 2.96Å
47	A	84.2	Confident	86.4	Confident	16 Å²	16	49.8 Å²	49.8	13%	0.132	29%	0.294	C	S	.	.			trans	-120.8	143	-173.8	0	0	0	0	0	111.8	A42 L45 L53 G165 V239	A42-A47 PolarHBondContact O-N 3.3Å; L45-A47 VanDerWaalsContact C-N 3.28Å; L45-A47 HydrophobicContact CB-CB 4.03Å; L45-A47 PolarHBondContact O-N 2.92Å; A47-L53 HydrophobicContact CB-CD2 4.31Å; A47-G165 WeakPolarHBondContact CB-O 3.37Å; A47-V239 HydrophobicContact CB-CG2 4.38Å
48	D	87.3	Confident	86.5	Confident	64 Å²	64	46 Å²	46	34%	0.342	27%	0.274	S	S	.	.			trans	-97.1	107.7	174.7	-175.6	-28.4	0	0	0	109.8	S50 N51 G52	D48-S50 PolarHBondContact O-N 2.87Å; D48-S50 WeakPolarHBondContact OD1-CA 3.44Å; D48-S50 WeakPolarHBondContact OD1-CB 3.04Å; D48-S50 PolarHBondContact OD1-N 2.91Å; D48-S50 PolarHBondContact OD1-OG 2.94Å; D48-N51 HydrophobicContact CB-CB 4.4Å; D48-N51 PolarHBondContact OD1-N 3.06Å; D48-N51 WeakPolarHBondContact OD2-CB 3.16Å; D48-N51 PolarHBondContact OD2-ND2 2.91Å; D48-G52 WeakPolarHBondContact O-CA 3.44Å; D48-G52 PolarHBondContact O-N 3.22Å
49	L	84.7	Confident	86.7	Confident	28 Å²	28	47.5 Å²	47.5	15%	0.147	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-18.4	-179.1	-57.9	-175.6	0	0	0	114.1	A38 A42 V167 L183 V239	A38-L49 HydrophobicContact CB-CD1 4.2Å; A42-L49 HydrophobicContact CB-CD1 3.81Å; A42-L49 HydrophobicContact CB-CD2 3.71Å; A42-L49 HydrophobicContact CB-CG 3.58Å; L49-V167 HydrophobicContact CD2-CG2 4.44Å; L49-L183 HydrophobicContact CB-CD1 4.38Å; L49-L183 HydrophobicContact CD1-CD2 3.96Å; L49-L183 HydrophobicContact CD2-CD1 3.81Å; L49-L183 HydrophobicContact CD2-CD2 3.8Å; L49-L183 HydrophobicContact CD2-CG 4.47Å; L49-L183 HydrophobicContact CG-CD2 4.46Å; L49-V239 HydrophobicContact CD2-CB 4.11Å; L49-V239 HydrophobicContact CD2-CG1 4.42Å; L49-V239 HydrophobicContact CD2-CG2 4.31Å
50	S	83.8	Confident	86.8	Confident	81 Å²	81	47.7 Å²	47.7	57%	0.566	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-34.2	-177.1	73.4	0	0	0	0	112.8	D48	D48-S50 PolarHBondContact O-N 2.87Å; D48-S50 WeakPolarHBondContact OD1-CA 3.44Å; D48-S50 WeakPolarHBondContact OD1-CB 3.04Å; D48-S50 PolarHBondContact OD1-N 2.91Å; D48-S50 PolarHBondContact OD1-OG 2.94Å
51	N	83.1	Confident	86.8	Confident	36 Å²	36	46.6 Å²	46.6	19%	0.193	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-13.9	-171.1	-59.6	-52.2	0	0	0	114.1	D48 R152	D48-N51 HydrophobicContact CB-CB 4.4Å; D48-N51 PolarHBondContact OD1-N 3.06Å; D48-N51 WeakPolarHBondContact OD2-CB 3.16Å; D48-N51 PolarHBondContact OD2-ND2 2.91Å; N51-R152 HydrophobicContact CB-CG 3.76Å; N51-R152 VanDerWaalsContact CG-NE 3.27Å; N51-R152 PolarHBondContact ND2-NH2 2.98Å; N51-R152 VanDerWaalsContact ND2-NH2 3.2Å; N51-R152 WeakPolarHBondContact O-CA 3.36Å; N51-R152 PolarHBondContact O-N 3.13Å; N51-R152 WeakPolarHBondContact OD1-CG 3.46Å; N51-R152 PolarHBondContact OD1-NE 3.01Å; N51-R152 PolarHBondContact OD1-NH2 3.31Å
52	G	87.7	Confident	86.7	Confident	8 Å²	8	48 Å²	48	8%	0.082	28%	0.276	C	S	.	.			trans	77.7	178.9	-170.7	0	0	0	0	0	112.9	D48 L149	D48-G52 WeakPolarHBondContact O-CA 3.44Å; D48-G52 PolarHBondContact O-N 3.22Å; G52-L149 VanDerWaalsContact CA-O 3.27Å; G52-L149 WeakPolarHBondContact CA-O 3.06Å
53	L	89.3	Confident	86.6	Confident	9 Å²	9	58.3 Å²	58.3	5%	0.047	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-73.6	155.3	170.6	-67.9	-179.4	0	0	0	110.9	A47 R150 D151 V163 G165	A47-L53 HydrophobicContact CB-CD2 4.31Å; L53-R150 VanDerWaalsContact O-CA 3.27Å; L53-R150 WeakPolarHBondContact O-CA 3.3Å; L53-D151 PolarHBondContact O-N 3.46Å; L53-V163 HydrophobicContact CD1-CG2 3.88Å; L53-G165 WeakPolarHBondContact CG-O 3.4Å
54	S	89.1	Confident	86.4	Confident	31 Å²	31	60 Å²	60	22%	0.217	32%	0.316	C	S	.	.			trans	-73.3	145.9	165.5	89.2	0	0	0	0	110.1	S56 D57 A58 D151	S54-S56 PolarHBondContact O-N 3.41Å; S54-S56 VanDerWaalsContact O-N 3.12Å; S54-S56 PolarHBondContact OG-N 3.12Å; S54-S56 PolarHBondContact OG-OG 2.94Å; S54-D57 WeakPolarHBondContact CB-OD2 3.3Å; S54-D57 PolarHBondContact O-N 3.31Å; S54-D57 PolarHBondContact OG-N 2.9Å; S54-D57 PolarHBondContact OG-OD2 3.02Å; S54-A58 PolarHBondContact O-N 3.15Å; S54-D151 VanDerWaalsContact CA-OD1 3.25Å; S54-D151 WeakPolarHBondContact CA-OD1 3.43Å; S54-D151 WeakPolarHBondContact CB-OD1 3.39Å
55	S	86.5	Confident	85.9	Confident	64 Å²	64	56.7 Å²	56.7	45%	0.448	31%	0.306	S	S	.	.	H	α-helix	trans	-57.9	-27	173.5	-63.5	0	0	0	0	112	A59 D151	S55-A59 WeakPolarHBondContact O-CB 3.48Å; S55-A59 PolarHBondContact O-N 3.28Å; S55-A59 VanDerWaalsContact O-N 3.09Å; S55-D151 WeakPolarHBondContact CB-OD2 3.34Å; S55-D151 PolarHBondContact N-OD1 3.26Å; S55-D151 PolarHBondContact N-OD2 2.95Å; S55-D151 PolarHBondContact OG-OD2 3.39Å
56	S	88.1	Confident	85.7	Confident	63 Å²	63	58.3 Å²	58.3	44%	0.441	32%	0.323	S	S	.	.	H	α-helix	trans	-69	-36.9	174.4	91.1	0	0	0	0	112.5	S54 K60	S54-S56 PolarHBondContact O-N 3.41Å; S54-S56 VanDerWaalsContact O-N 3.12Å; S54-S56 PolarHBondContact OG-N 3.12Å; S54-S56 PolarHBondContact OG-OG 2.94Å; S56-K60 WeakPolarHBondContact O-CE 3.5Å; S56-K60 VanDerWaalsContact O-CG 3.27Å; S56-K60 WeakPolarHBondContact O-CG 3.32Å; S56-K60 PolarHBondContact O-N 2.93Å; S56-K60 VanDerWaalsContact O-N 3.15Å; S56-K60 PolarHBondContact OG-NZ 3.3Å; S56-K60 VanDerWaalsContact OG-NZ 3.08Å
57	D	88.4	Confident	85.6	Confident	61 Å²	61	58.4 Å²	58.4	33%	0.326	32%	0.316	S	S	.	.	H	α-helix	trans	-81.5	-34.6	-179.3	-64.9	-56.9	0	0	0	111.7	S54 K60 R61	S54-D57 WeakPolarHBondContact CB-OD2 3.3Å; S54-D57 PolarHBondContact O-N 3.31Å; S54-D57 PolarHBondContact OG-N 2.9Å; S54-D57 PolarHBondContact OG-OD2 3.02Å; D57-K60 PolarHBondContact O-N 3.41Å; D57-K60 IonicContact OD1-NZ 3.55Å; D57-K60 PolarHBondContact OD1-NZ 3.1Å; D57-R61 WeakPolarHBondContact O-CG 3.49Å; D57-R61 PolarHBondContact O-N 2.97Å
58	A	87.7	Confident	85.5	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.008	31%	0.313	C	S	.	.	H	α-helix	trans	-56.3	-49.7	166.8	0	0	0	0	0	111	S54 K60 R61 I62 V163	S54-A58 PolarHBondContact O-N 3.15Å; A58-K60 VanDerWaalsContact C-N 3.28Å; A58-K60 PolarHBondContact O-N 3.42Å; A58-R61 PolarHBondContact O-N 3.37Å; A58-R61 VanDerWaalsContact O-N 3.07Å; A58-I62 WeakPolarHBondContact O-CG1 3.46Å; A58-I62 PolarHBondContact O-N 3.25Å; A58-V163 HydrophobicContact CB-CG2 4.24Å
59	A	88.4	Confident	84.9	Confident	48 Å²	48	59.5 Å²	59.5	40%	0.397	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-29.9	177	0	0	0	0	0	113.9	S55 R63	S55-A59 WeakPolarHBondContact O-CB 3.48Å; S55-A59 PolarHBondContact O-N 3.28Å; S55-A59 VanDerWaalsContact O-N 3.09Å; A59-R63 WeakPolarHBondContact O-CG 3.42Å
60	K	87.7	Confident	83.9	Confident	109 Å²	109	60.6 Å²	60.6	47%	0.474	32%	0.32	S	S	.	.	H	α-helix	trans	-70.6	-44.9	170.6	-67.9	161.7	-146	157.5	0	111.2	S56 D57 A58 R63 L64	S56-K60 WeakPolarHBondContact O-CE 3.5Å; S56-K60 VanDerWaalsContact O-CG 3.27Å; S56-K60 WeakPolarHBondContact O-CG 3.32Å; S56-K60 PolarHBondContact O-N 2.93Å; S56-K60 VanDerWaalsContact O-N 3.15Å; S56-K60 PolarHBondContact OG-NZ 3.3Å; S56-K60 VanDerWaalsContact OG-NZ 3.08Å; D57-K60 PolarHBondContact O-N 3.41Å; D57-K60 IonicContact OD1-NZ 3.55Å; D57-K60 PolarHBondContact OD1-NZ 3.1Å; A58-K60 VanDerWaalsContact C-N 3.28Å; A58-K60 PolarHBondContact O-N 3.42Å; K60-R63 PolarHBondContact O-N 2.89Å; K60-L64 PolarHBondContact O-N 2.91Å
61	R	88.4	Confident	82.5	Confident	17 Å²	17	62.7 Å²	62.7	6%	0.064	33%	0.325	C	S	.	.	H	α-helix	trans	-65.1	-39.1	-179.7	-71.5	175.9	-165.5	-132.5	-2.1	112.4	L45 N46 D57 A58 R63 L64 H65 V163 P164	L45-R61 PolarHBondContact O-NH1 3.37Å; L45-R61 PolarHBondContact O-NH2 2.99Å; N46-R61 PolarHBondContact O-NH2 2.96Å; D57-R61 WeakPolarHBondContact O-CG 3.49Å; D57-R61 PolarHBondContact O-N 2.97Å; A58-R61 PolarHBondContact O-N 3.37Å; A58-R61 VanDerWaalsContact O-N 3.07Å; R61-R63 PolarHBondContact O-N 3.27Å; R61-L64 PolarHBondContact O-N 3.34Å; R61-H65 PolarHBondContact O-N 3.1Å; R61-V163 HydrophobicContact CB-CB 3.81Å; R61-V163 HydrophobicContact CB-CG1 3.76Å; R61-V163 HydrophobicContact CB-CG2 3.91Å; R61-P164 WeakPolarHBondContact CD-O 3.46Å; R61-P164 PolarHBondContact NH1-O 3.48Å
62	I	85.9	Confident	81.2	Confident	28 Å²	28	66.8 Å²	66.8	14%	0.144	35%	0.351	C	S	.	.	H	α-helix	trans	-57.1	-39	174.3	-66.9	171.9	0	0	0	110.9	A58 L64 G66 Y67 E161 V163	A58-I62 WeakPolarHBondContact O-CG1 3.46Å; A58-I62 PolarHBondContact O-N 3.25Å; I62-L64 PolarHBondContact O-N 3Å; I62-G66 CarbonylContact O-C 3.59Å; I62-G66 VanDerWaalsContact O-CA 3.23Å; I62-G66 WeakPolarHBondContact O-CA 3.22Å; I62-G66 PolarHBondContact O-N 3.42Å; I62-Y67 HydrophobicContact CG2-CD1 3.87Å; I62-Y67 HydrophobicContact CG2-CE1 3.62Å; I62-Y67 HydrophobicContact CG2-CE2 4.43Å; I62-Y67 HydrophobicContact CG2-CG 4.39Å; I62-E161 HydrophobicContact CD1-CB 4.37Å; I62-V163 HydrophobicContact CB-CG1 4.4Å; I62-V163 HydrophobicContact CG1-CG1 3.47Å; I62-V163 VanDerWaalsContact CG1-CG1 3.47Å
63	R	84.6	Confident	79.7	Confident	226 Å²	226	72.6 Å²	72.6	85%	0.853	38%	0.379	S	S	*	.	H	α-helix	trans	-71.9	-13.5	177.1	-64.8	179	-174.3	-168.8	1.6	114.4	A59 K60 R61	A59-R63 WeakPolarHBondContact O-CG 3.42Å; K60-R63 PolarHBondContact O-N 2.89Å; R61-R63 PolarHBondContact O-N 3.27Å
64	L	82	Confident	77.8	Confident	129 Å²	129	78.5 Å²	78.5	68%	0.675	42%	0.416	S	S	*	.	H	α-helix	trans	-104.3	-36.2	-179.3	-67.1	171.3	0	0	0	112.6	K60 R61 I62	K60-L64 PolarHBondContact O-N 2.91Å; R61-L64 PolarHBondContact O-N 3.34Å; I62-L64 PolarHBondContact O-N 3Å
65	H	76.2	Confident	76.4	Confident	65 Å²	65	83.7 Å²	83.7	30%	0.301	44%	0.435	S	S	.	.	H	α-helix	trans	-103.5	-15	-176.8	-73.6	-90	0	0	0	114	Y26 R61	Y26-H65 AromaticContact CD2-NE2 3.77Å; Y26-H65 PolarHBondContact N-CE1 2.9Å; Y26-H65 VanDerWaalsContact N-CE1 3.33Å; Y26-H65 PolarHBondContact N-NE2 2.93Å; R61-H65 PolarHBondContact O-N 3.1Å
66	G	82.1	Confident	75.4	Confident	34 Å²	34	84.9 Å²	84.9	35%	0.351	43%	0.434	S	S	.	.			trans	81.6	-167.5	-165.9	0	0	0	0	0	112.4	I62	I62-G66 CarbonylContact O-C 3.59Å; I62-G66 VanDerWaalsContact O-CA 3.23Å; I62-G66 WeakPolarHBondContact O-CA 3.22Å; I62-G66 PolarHBondContact O-N 3.42Å
67	Y	83.2	Confident	75	Confident	109 Å²	109	86.2 Å²	86.2	43%	0.427	44%	0.44	S	S	.	.			trans	-87.3	154.4	172.6	-67.2	-76.7	0	0	0	110.9	I62 E69 R160 E161	I62-Y67 HydrophobicContact CG2-CD1 3.87Å; I62-Y67 HydrophobicContact CG2-CE1 3.62Å; I62-Y67 HydrophobicContact CG2-CE2 4.43Å; I62-Y67 HydrophobicContact CG2-CG 4.39Å; Y67-E69 PolarHBondContact O-N 3.39Å; Y67-R160 CarbonylContact C-O 3.49Å; Y67-R160 WeakPolarHBondContact CA-O 3.44Å; Y67-R160 WeakPolarHBondContact CB-O 3.48Å; Y67-R160 HydrophobicContact CD1-CG 4.28Å; Y67-R160 WeakPolarHBondContact CD1-O 3.42Å; Y67-E161 HydrophobicContact CD1-CG 4.39Å; Y67-E161 HydrophobicContact CE1-CG 4.37Å
68	N	82.1	Confident	74.7	Confident	13 Å²	13	87.3 Å²	87.3	7%	0.07	45%	0.446	C	S	.	.	S	Bend	trans	-75.9	58.9	170.7	-178.8	50.1	0	0	0	111	A159 R160 L162 P177 T243 G244	N68-A159 WeakPolarHBondContact CB-O 3.46Å; N68-A159 PolarHBondContact ND2-O 2.92Å; N68-R160 PolarHBondContact N-O 3.11Å; N68-R160 WeakPolarHBondContact O-CA 3.31Å; N68-L162 HydrophobicContact CB-CB 4.31Å; N68-P177 PolarHBondContact ND2-O 3Å; N68-T243 HydrophobicContact CB-CG2 4.09Å; N68-T243 VanDerWaalsContact OD1-CA 3.31Å; N68-T243 WeakPolarHBondContact OD1-CA 3.16Å; N68-T243 VanDerWaalsContact OD1-CB 3.24Å; N68-T243 WeakPolarHBondContact OD1-CB 3.32Å; N68-G244 PolarHBondContact OD1-N 2.82Å
69	E	73.8	Confident	74.4	Confident	89 Å²	89	93.7 Å²	93.7	42%	0.416	48%	0.479	S	S	.	.	S	Bend	trans	-135.5	161	178	68.9	-166	-177.3	0	0	110.6	Y67 R160	Y67-E69 PolarHBondContact O-N 3.39Å; E69-R160 HydrophobicContact CB-CB 4.24Å
70	F	64.9	Low	74.2	Confident	52 Å²	52	95.4 Å²	95.4	23%	0.228	48%	0.478	C	S	.	.			trans	-88.7	135.8	171.7	-55.7	-61.3	0	0	0	109.7	V72 M227 F249 F253	F70-V72 PolarHBondContact O-N 3.4Å; F70-M227 HydrophobicContact CE1-CE 3.92Å; F70-M227 HydrophobicContact CE2-CE 4.31Å; F70-M227 HydrophobicContact CZ-CE 3.37Å; F70-F249 HydrophobicContact CE2-CD1 4.26Å; F70-F249 AromaticContact CE2-CE1 3.83Å; F70-F249 HydrophobicContact CE2-CE1 3.83Å; F70-F249 AromaticContact CZ-CD1 3.61Å; F70-F249 HydrophobicContact CZ-CD1 3.61Å; F70-F249 AromaticContact CZ-CE1 3.67Å; F70-F249 HydrophobicContact CZ-CE1 3.67Å; F70-F253 HydrophobicContact CB-CD1 4.22Å; F70-F253 HydrophobicContact CB-CE1 3.63Å; F70-F253 HydrophobicContact CB-CZ 4.01Å; F70-F253 AromaticContact CD1-CD1 3.72Å; F70-F253 HydrophobicContact CD1-CD1 3.72Å; F70-F253 HydrophobicContact CD1-CE1 4.03Å; F70-F253 HydrophobicContact CD1-CG 4.2Å; F70-F253 HydrophobicContact CD2-CE1 4.39Å; F70-F253 HydrophobicContact CD2-CE2 4.45Å; F70-F253 HydrophobicContact CD2-CZ 4.34Å; F70-F253 HydrophobicContact CE1-CB 4.33Å; F70-F253 HydrophobicContact CE1-CD1 4.2Å; F70-F253 HydrophobicContact CE1-CG 4.27Å; F70-F253 AromaticContact CG-CD1 3.91Å; F70-F253 HydrophobicContact CG-CD1 3.91Å; F70-F253 AromaticContact CG-CE1 3.76Å; F70-F253 HydrophobicContact CG-CE1 3.76Å; F70-F253 HydrophobicContact CG-CG 4.4Å; F70-F253 HydrophobicContact CG-CZ 4.13Å
71	L	53.7	Low	73.8	Confident	125 Å²	125	91.9 Å²	91.9	65%	0.654	46%	0.462	S	S	*	.			trans	-65.7	102.3	175.7	-68.6	169.2	0	0	0	110.1	H245 K257	L71-H245 PolarHBondContact N-NE2 3.42Å; L71-K257 PolarHBondContact O-NZ 3.43Å
72	V	56.2	Low	73.6	Confident	122 Å²	122	94.2 Å²	94.2	74%	0.739	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-81.4	133.4	169.5	-178.8	0	0	0	0	108.7	F70 T74	F70-V72 PolarHBondContact O-N 3.4Å; V72-T74 PolarHBondContact O-N 3.49Å
73	D	54.9	Low	73.7	Confident	129 Å²	129	96.3 Å²	96.3	69%	0.69	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-65.9	123.2	-175.1	-54.7	-78	0	0	0	110.7	K75 K257	D73-K75 PolarHBondContact O-N 2.91Å; D73-K257 IonicContact OD1-NZ 3.64Å; D73-K257 IonicContact OD2-NZ 2.69Å; D73-K257 PolarHBondContact OD2-NZ 2.89Å
74	T	50.4	Low	73.5	Confident	134 Å²	134	87.6 Å²	87.6	82%	0.822	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-69.8	123.1	-172.5	52.8	0	0	0	0	111.2	V72 E76	V72-T74 PolarHBondContact O-N 3.49Å; T74-E76 PolarHBondContact O-N 3.03Å
75	K	58.5	Low	73.4	Confident	139 Å²	139	83.3 Å²	83.3	60%	0.604	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-56.8	132.6	177.9	-66.1	176.4	-179.1	175.7	0	111.6	D73 D136	D73-K75 PolarHBondContact O-N 2.91Å; K75-D136 WeakPolarHBondContact CE-OD1 3.3Å; K75-D136 IonicContact NZ-OD1 3.34Å; K75-D136 PolarHBondContact NZ-OD1 2.97Å; K75-D136 IonicContact NZ-OD2 3.82Å; K75-D136 PolarHBondContact NZ-OD2 3.44Å
76	E	67.4	Low	73.6	Confident	90 Å²	90	83 Å²	83	42%	0.421	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-67.3	141.7	178.7	-54.7	-160.6	118.5	0	0	112	T74 K80 K81	T74-E76 PolarHBondContact O-N 3.03Å; E76-K80 IonicContact OE1-NZ 2.85Å; E76-K80 PolarHBondContact OE1-NZ 2.8Å; E76-K80 IonicContact OE2-NZ 3.81Å; E76-K81 HydrophobicContact CB-CG 4.47Å
77	P	79.3	Confident	73.5	Confident	90 Å²	90	89.7 Å²	89.7	58%	0.584	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-68.4	137.5	-178.7	26.8	-33.1	0	0	0	111.5	L79 K80 K81	P77-L79 PolarHBondContact O-N 3.21Å; P77-L79 VanDerWaalsContact O-N 3.11Å; P77-K80 HydrophobicContact CG-CB 3.99Å; P77-K80 WeakPolarHBondContact O-CA 3.46Å; P77-K80 VanDerWaalsContact O-CB 3.29Å; P77-K80 WeakPolarHBondContact O-CB 3.25Å; P77-K80 PolarHBondContact O-N 3.44Å; P77-K81 PolarHBondContact O-N 3.48Å
78	L	80.7	Confident	72.9	Confident	85 Å²	85	87.2 Å²	87.2	45%	0.445	44%	0.439	S	S	.	.	H	α-helix	trans	-54.4	-36.4	-172.4	-59.6	177.9	0	0	0	114.1	K80 K81 Y82 Y129	L78-K80 VanDerWaalsContact C-N 3.3Å; L78-K80 PolarHBondContact O-N 3.39Å; L78-K81 PolarHBondContact O-N 2.89Å; L78-Y82 PolarHBondContact O-N 2.85Å; L78-Y129 HydrophobicContact CD1-CE2 4.03Å; L78-Y129 HydrophobicContact CD2-CD2 3.8Å; L78-Y129 HydrophobicContact CD2-CE2 3.71Å
79	L	81.9	Confident	72.3	Confident	134 Å²	134	91.2 Å²	91.2	70%	0.702	47%	0.466	S	S	*	.	H	α-helix	trans	-63.6	-35.3	177	-174.6	65.5	0	0	0	112.2	P77 V83	P77-L79 PolarHBondContact O-N 3.21Å; P77-L79 VanDerWaalsContact O-N 3.11Å; L79-V83 VanDerWaalsContact O-CG2 3.32Å; L79-V83 WeakPolarHBondContact O-CG2 3.37Å; L79-V83 PolarHBondContact O-N 3.04Å
80	K	85.1	Confident	72	Confident	84 Å²	84	88.5 Å²	88.5	37%	0.365	45%	0.454	S	S	.	.	H	α-helix	trans	-64.7	-47.1	175.5	-169.7	-150.6	172.9	-148	0	110.1	E76 P77 L78 Y82 V83 D84	E76-K80 IonicContact OE1-NZ 2.85Å; E76-K80 PolarHBondContact OE1-NZ 2.8Å; E76-K80 IonicContact OE2-NZ 3.81Å; P77-K80 HydrophobicContact CG-CB 3.99Å; P77-K80 WeakPolarHBondContact O-CA 3.46Å; P77-K80 VanDerWaalsContact O-CB 3.29Å; P77-K80 WeakPolarHBondContact O-CB 3.25Å; P77-K80 PolarHBondContact O-N 3.44Å; L78-K80 VanDerWaalsContact C-N 3.3Å; L78-K80 PolarHBondContact O-N 3.39Å; K80-Y82 PolarHBondContact O-N 3.46Å; K80-V83 CarbonylContact O-C 3.37Å; K80-V83 PolarHBondContact O-N 3.43Å; K80-V83 VanDerWaalsContact O-N 3.14Å; K80-D84 WeakPolarHBondContact CE-OD2 3.22Å; K80-D84 WeakPolarHBondContact CG-OD2 3.47Å; K80-D84 IonicContact NZ-OD2 3.83Å; K80-D84 PolarHBondContact NZ-OD2 3.41Å; K80-D84 WeakPolarHBondContact O-CB 3.48Å; K80-D84 PolarHBondContact O-N 3.42Å
81	K	79	Confident	72.5	Confident	36 Å²	36	86.3 Å²	86.3	16%	0.157	45%	0.445	C	S	.	.	H	α-helix	trans	-58.7	-44.7	177.5	-62.5	-163.6	179.1	-172.1	0	112.4	E76 P77 L78 V83 D84 Q85 F125 E132	E76-K81 HydrophobicContact CB-CG 4.47Å; P77-K81 PolarHBondContact O-N 3.48Å; L78-K81 PolarHBondContact O-N 2.89Å; K81-V83 VanDerWaalsContact C-N 3.34Å; K81-V83 PolarHBondContact O-N 2.68Å; K81-D84 PolarHBondContact O-N 3Å; K81-Q85 PolarHBondContact O-N 3.2Å; K81-F125 HydrophobicContact CB-CE2 4.29Å; K81-E132 IonicContact NZ-OE1 2.86Å; K81-E132 PolarHBondContact NZ-OE1 3.33Å; K81-E132 IonicContact NZ-OE2 2.67Å; K81-E132 PolarHBondContact NZ-OE2 2.99Å
82	Y	84.5	Confident	73.6	Confident	66 Å²	66	85.7 Å²	85.7	26%	0.259	44%	0.441	S	S	.	.	H	α-helix	trans	-61.4	-40	175.7	-173.4	-103.1	0	0	0	112.8	L78 K80 F86 V121 F125	L78-Y82 PolarHBondContact O-N 2.85Å; K80-Y82 PolarHBondContact O-N 3.46Å; Y82-F86 HydrophobicContact CD1-CE2 4.27Å; Y82-F86 AromaticContact CE1-CE2 3.75Å; Y82-F86 HydrophobicContact CE1-CE2 3.75Å; Y82-F86 HydrophobicContact CE1-CZ 4.47Å; Y82-F86 WeakPolarHBondContact O-CD2 3.4Å; Y82-V121 HydrophobicContact CE2-CG1 3.99Å; Y82-F125 HydrophobicContact CD2-CB 3.88Å; Y82-F125 AromaticContact CD2-CD1 3.8Å; Y82-F125 HydrophobicContact CD2-CD1 3.8Å; Y82-F125 AromaticContact CD2-CD2 3.99Å; Y82-F125 HydrophobicContact CD2-CD2 3.99Å; Y82-F125 HydrophobicContact CD2-CE1 4.33Å; Y82-F125 HydrophobicContact CD2-CE2 4.49Å; Y82-F125 AromaticContact CD2-CG 3.61Å; Y82-F125 HydrophobicContact CD2-CG 3.61Å; Y82-F125 HydrophobicContact CE2-CB 4.31Å; Y82-F125 HydrophobicContact CE2-CD1 4.42Å; Y82-F125 HydrophobicContact CE2-CG 4.39Å
83	V	86.3	Confident	74.2	Confident	71 Å²	71	82.9 Å²	82.9	43%	0.43	42%	0.422	S	S	.	.	H	α-helix	trans	-72.3	-34.7	176.4	171.4	0	0	0	0	112.3	L79 K80 K81 Q85 F86	L79-V83 VanDerWaalsContact O-CG2 3.32Å; L79-V83 WeakPolarHBondContact O-CG2 3.37Å; L79-V83 PolarHBondContact O-N 3.04Å; K80-V83 CarbonylContact O-C 3.37Å; K80-V83 PolarHBondContact O-N 3.43Å; K80-V83 VanDerWaalsContact O-N 3.14Å; K81-V83 VanDerWaalsContact C-N 3.34Å; K81-V83 PolarHBondContact O-N 2.68Å; V83-Q85 VanDerWaalsContact C-N 3.28Å; V83-Q85 PolarHBondContact O-N 3.45Å; V83-F86 WeakPolarHBondContact O-CB 3.47Å; V83-F86 PolarHBondContact O-N 2.94Å; V83-F86 VanDerWaalsContact O-N 3.13Å
84	D	82.3	Confident	75.1	Confident	43 Å²	43	77.9 Å²	77.9	23%	0.23	40%	0.395	C	S	.	.	H	α-helix	trans	-67.7	-25.9	178.7	-78	-28.1	0	0	0	112.3	K80 K81 F86 R87	K80-D84 WeakPolarHBondContact CE-OD2 3.22Å; K80-D84 WeakPolarHBondContact CG-OD2 3.47Å; K80-D84 IonicContact NZ-OD2 3.83Å; K80-D84 PolarHBondContact NZ-OD2 3.41Å; K80-D84 WeakPolarHBondContact O-CB 3.48Å; K80-D84 PolarHBondContact O-N 3.42Å; K81-D84 PolarHBondContact O-N 3Å; D84-F86 VanDerWaalsContact C-N 3.28Å; D84-F86 PolarHBondContact O-N 2.69Å; D84-R87 VanDerWaalsContact O-CB 3.31Å; D84-R87 WeakPolarHBondContact O-CB 3.38Å; D84-R87 PolarHBondContact O-N 3.09Å; D84-R87 WeakPolarHBondContact OD1-CD 3.32Å; D84-R87 IonicContact OD1-CZ 3.54Å; D84-R87 IonicContact OD1-NE 2.69Å; D84-R87 IonicContact OD1-NH1 3.75Å; D84-R87 PolarHBondContact OD1-NH1 3.27Å
85	Q	78.4	Confident	76.5	Confident	39 Å²	39	74.6 Å²	74.6	18%	0.182	37%	0.372	C	S	.	.	H	α-helix	trans	-60.2	-35.3	169.9	-69.5	-66.7	-11	0	0	112.5	K81 V83 R87 N88 I91 V121 E128	K81-Q85 PolarHBondContact O-N 3.2Å; V83-Q85 VanDerWaalsContact C-N 3.28Å; V83-Q85 PolarHBondContact O-N 3.45Å; Q85-R87 PolarHBondContact O-N 3.28Å; Q85-N88 VanDerWaalsContact O-CB 3.31Å; Q85-N88 WeakPolarHBondContact O-CB 3.36Å; Q85-N88 PolarHBondContact O-N 2.94Å; Q85-I91 WeakPolarHBondContact O-CD1 3.38Å; Q85-V121 HydrophobicContact CB-CG1 4.08Å; Q85-E128 PolarHBondContact NE2-OE2 3.45Å
86	F	81.7	Confident	77.7	Confident	59 Å²	59	69.5 Å²	69.5	26%	0.259	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-11.1	173.7	-70.2	-86.3	0	0	0	113.9	Y82 V83 D84 N88 I91 L95 I117 V121	Y82-F86 HydrophobicContact CD1-CE2 4.27Å; Y82-F86 AromaticContact CE1-CE2 3.75Å; Y82-F86 HydrophobicContact CE1-CE2 3.75Å; Y82-F86 HydrophobicContact CE1-CZ 4.47Å; Y82-F86 WeakPolarHBondContact O-CD2 3.4Å; V83-F86 WeakPolarHBondContact O-CB 3.47Å; V83-F86 PolarHBondContact O-N 2.94Å; V83-F86 VanDerWaalsContact O-N 3.13Å; D84-F86 VanDerWaalsContact C-N 3.28Å; D84-F86 PolarHBondContact O-N 2.69Å; F86-N88 VanDerWaalsContact C-N 3.31Å; F86-I91 HydrophobicContact CD1-CG2 3.94Å; F86-L95 HydrophobicContact CD1-CD1 4.26Å; F86-I117 HydrophobicContact CE1-CG2 4.2Å; F86-V121 HydrophobicContact CD1-CG2 4.39Å; F86-V121 HydrophobicContact CD2-CG1 4.19Å; F86-V121 HydrophobicContact CE1-CG1 4.43Å; F86-V121 HydrophobicContact CE1-CG2 4.11Å; F86-V121 HydrophobicContact CE2-CG1 3.68Å; F86-V121 HydrophobicContact CZ-CB 4.28Å; F86-V121 HydrophobicContact CZ-CG1 3.82Å; F86-V121 HydrophobicContact CZ-CG2 4.29Å
87	R	79.4	Confident	78	Confident	175 Å²	175	65.2 Å²	65.2	66%	0.66	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.7	173.7	-61.9	-178.7	168	163.5	-10.1	113.3	D84 Q85 P89	D84-R87 VanDerWaalsContact O-CB 3.31Å; D84-R87 WeakPolarHBondContact O-CB 3.38Å; D84-R87 PolarHBondContact O-N 3.09Å; D84-R87 WeakPolarHBondContact OD1-CD 3.32Å; D84-R87 IonicContact OD1-CZ 3.54Å; D84-R87 IonicContact OD1-NE 2.69Å; D84-R87 IonicContact OD1-NH1 3.75Å; D84-R87 PolarHBondContact OD1-NH1 3.27Å; Q85-R87 PolarHBondContact O-N 3.28Å; R87-P89 WeakPolarHBondContact O-CD 3.25Å
88	N	71.1	Confident	78.1	Confident	57 Å²	57	61 Å²	61	31%	0.305	31%	0.312	S	S	.	.	S	Bend	trans	-58.2	123.9	169.9	-177.8	-24	0	0	0	109.4	Q85 F86 L90 I91 L92	Q85-N88 VanDerWaalsContact O-CB 3.31Å; Q85-N88 WeakPolarHBondContact O-CB 3.36Å; Q85-N88 PolarHBondContact O-N 2.94Å; F86-N88 VanDerWaalsContact C-N 3.31Å; N88-L90 PolarHBondContact O-N 3.45Å; N88-L90 PolarHBondContact OD1-N 3.02Å; N88-L90 VanDerWaalsContact OD1-N 3.1Å; N88-I91 HydrophobicContact CB-CB 4.41Å; N88-I91 HydrophobicContact CB-CD1 4Å; N88-I91 HydrophobicContact CB-CG1 4.5Å; N88-I91 PolarHBondContact O-N 3.09Å; N88-L92 PolarHBondContact O-N 2.93Å
89	P	69.4	Low	78.3	Confident	97 Å²	97	63.4 Å²	63.4	63%	0.63	32%	0.319	S	S	*	.	H	α-helix	trans	-54.2	-28	-177.4	-29.3	36.3	0	0	0	114.8	R87 L93	R87-P89 WeakPolarHBondContact O-CD 3.25Å; P89-L93 VanDerWaalsContact O-CB 3.23Å; P89-L93 WeakPolarHBondContact O-CB 3.21Å; P89-L93 PolarHBondContact O-N 2.87Å
90	L	67.5	Low	78.3	Confident	32 Å²	32	59.7 Å²	59.7	17%	0.168	30%	0.299	C	S	.	.	H	α-helix	trans	-71.4	-43.6	178	-56.7	175.4	0	0	0	112	N88 L93 L94 I314	N88-L90 PolarHBondContact O-N 3.45Å; N88-L90 PolarHBondContact OD1-N 3.02Å; N88-L90 VanDerWaalsContact OD1-N 3.1Å; L90-L93 PolarHBondContact O-N 3.21Å; L90-L94 PolarHBondContact O-N 3.21Å; L90-I314 HydrophobicContact CD1-CB 4.47Å; L90-I314 HydrophobicContact CD1-CD1 3.56Å; L90-I314 HydrophobicContact CD1-CG2 4.07Å; L90-I314 HydrophobicContact CD2-CD1 3.55Å; L90-I314 HydrophobicContact CG-CD1 4.21Å
91	I	74.5	Confident	77.8	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-68.5	-38.4	176.6	-72.3	158.2	0	0	0	110.3	Q85 F86 N88 L93 L94 L95 I117 V121	Q85-I91 WeakPolarHBondContact O-CD1 3.38Å; F86-I91 HydrophobicContact CD1-CG2 3.94Å; N88-I91 HydrophobicContact CB-CB 4.41Å; N88-I91 HydrophobicContact CB-CD1 4Å; N88-I91 HydrophobicContact CB-CG1 4.5Å; N88-I91 PolarHBondContact O-N 3.09Å; I91-L93 VanDerWaalsContact C-N 3.32Å; I91-L93 PolarHBondContact O-N 2.85Å; I91-L94 PolarHBondContact O-N 3.21Å; I91-L95 HydrophobicContact CG2-CD1 4.18Å; I91-L95 WeakPolarHBondContact O-CB 3.5Å; I91-L95 VanDerWaalsContact O-CG 3.32Å; I91-L95 WeakPolarHBondContact O-CG 3.34Å; I91-L95 PolarHBondContact O-N 2.98Å; I91-I117 HydrophobicContact CG2-CG2 3.93Å; I91-V121 HydrophobicContact CD1-CG2 3.59Å; I91-V121 HydrophobicContact CG1-CG2 4.27Å; I91-V121 HydrophobicContact CG2-CG2 4.33Å
92	L	76.8	Confident	78.1	Confident	111 Å²	111	58 Å²	58	58%	0.581	30%	0.295	S	S	*	.	H	α-helix	trans	-62.7	-38.5	174	-170.3	66.8	0	0	0	112.2	N88 L95 G96	N88-L92 PolarHBondContact O-N 2.93Å; L92-L95 PolarHBondContact O-N 3.32Å; L92-G96 PolarHBondContact O-N 3.32Å
93	L	69.1	Low	78.2	Confident	64 Å²	64	60.7 Å²	60.7	34%	0.335	31%	0.312	S	S	.	.	H	α-helix	trans	-69.8	-39.3	176.3	-179.5	154.4	0	0	0	112	P89 L90 I91 G96 S97 V307	P89-L93 VanDerWaalsContact O-CB 3.23Å; P89-L93 WeakPolarHBondContact O-CB 3.21Å; P89-L93 PolarHBondContact O-N 2.87Å; L90-L93 PolarHBondContact O-N 3.21Å; I91-L93 VanDerWaalsContact C-N 3.32Å; I91-L93 PolarHBondContact O-N 2.85Å; L93-G96 PolarHBondContact O-N 3.5Å; L93-S97 PolarHBondContact O-N 3.48Å; L93-V307 HydrophobicContact CD2-CB 4.14Å; L93-V307 HydrophobicContact CD2-CG1 3.58Å; L93-V307 HydrophobicContact CD2-CG2 3.86Å
94	L	72.8	Confident	77.8	Confident	24 Å²	24	61 Å²	61	13%	0.126	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-46.1	170.3	-85.8	175.9	0	0	0	112.7	L90 I91 G96 S97 A98 I113 I117 V307 V311	L90-L94 PolarHBondContact O-N 3.21Å; I91-L94 PolarHBondContact O-N 3.21Å; L94-G96 VanDerWaalsContact C-N 3.26Å; L94-G96 PolarHBondContact O-N 3.33Å; L94-S97 PolarHBondContact O-N 3.41Å; L94-S97 VanDerWaalsContact O-N 3.09Å; L94-A98 PolarHBondContact O-N 2.92Å; L94-I113 HydrophobicContact CD2-CG2 4.08Å; L94-I117 HydrophobicContact CB-CD1 3.78Å; L94-I117 HydrophobicContact CB-CG1 3.93Å; L94-I117 HydrophobicContact CD1-CG1 3.89Å; L94-I117 HydrophobicContact CG-CG1 4.49Å; L94-V307 HydrophobicContact CD2-CG1 3.96Å; L94-V311 HydrophobicContact CD1-CG1 4.26Å; L94-V311 HydrophobicContact CD1-CG2 3.72Å; L94-V311 HydrophobicContact CD2-CG2 3.8Å; L94-V311 HydrophobicContact CG-CG2 3.6Å
95	L	81.7	Confident	77.6	Confident	65 Å²	65	60.7 Å²	60.7	34%	0.34	32%	0.317	S	S	.	.	H	α-helix	trans	-60	-38.6	175	-74	170.4	0	0	0	111.3	F86 I91 L92 A98 F99 I117	F86-L95 HydrophobicContact CD1-CD1 4.26Å; I91-L95 HydrophobicContact CG2-CD1 4.18Å; I91-L95 WeakPolarHBondContact O-CB 3.5Å; I91-L95 VanDerWaalsContact O-CG 3.32Å; I91-L95 WeakPolarHBondContact O-CG 3.34Å; I91-L95 PolarHBondContact O-N 2.98Å; L92-L95 PolarHBondContact O-N 3.32Å; L95-A98 PolarHBondContact O-N 2.97Å; L95-F99 VanDerWaalsContact O-CB 3.3Å; L95-F99 WeakPolarHBondContact O-CB 3.45Å; L95-F99 PolarHBondContact O-N 3.4Å; L95-I117 HydrophobicContact CD2-CD1 3.76Å; L95-I117 HydrophobicContact CG-CD1 4.03Å
96	G	81.9	Confident	77.5	Confident	31 Å²	31	62.2 Å²	62.2	32%	0.32	32%	0.324	S	S	.	.	H	α-helix	trans	-59.1	-43.5	171.5	0	0	0	0	0	112.9	L92 L93 L94 F99 I100	L92-G96 PolarHBondContact O-N 3.32Å; L93-G96 PolarHBondContact O-N 3.5Å; L94-G96 VanDerWaalsContact C-N 3.26Å; L94-G96 PolarHBondContact O-N 3.33Å; G96-F99 PolarHBondContact O-N 3.07Å; G96-I100 WeakPolarHBondContact O-CD1 3.47Å; G96-I100 VanDerWaalsContact O-CG1 3.3Å; G96-I100 WeakPolarHBondContact O-CG1 3.28Å; G96-I100 PolarHBondContact O-N 2.87Å
97	S	74.7	Confident	77.4	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-67.2	-43.1	175.7	-167.7	0	0	0	0	112.7	L93 L94 F99 I100 S101	L93-S97 PolarHBondContact O-N 3.48Å; L94-S97 PolarHBondContact O-N 3.41Å; L94-S97 VanDerWaalsContact O-N 3.09Å; S97-F99 VanDerWaalsContact C-N 3.3Å; S97-F99 PolarHBondContact O-N 3.23Å; S97-I100 PolarHBondContact O-N 2.89Å; S97-S101 PolarHBondContact O-N 3.34Å; S97-S101 PolarHBondContact O-OG 3.23Å
98	A	80.3	Confident	76.9	Confident	3 Å²	3	64 Å²	64	3%	0.025	34%	0.34	C	S	.	.	H	α-helix	trans	-60.5	-41.6	175.8	0	0	0	0	0	111.5	L94 L95 S101 I102 I113	L94-A98 PolarHBondContact O-N 2.92Å; L95-A98 PolarHBondContact O-N 2.97Å; A98-S101 PolarHBondContact O-N 3.09Å; A98-I102 WeakPolarHBondContact O-CG1 3.42Å; A98-I102 PolarHBondContact O-N 3.04Å; A98-I113 HydrophobicContact CB-CB 4.26Å; A98-I113 HydrophobicContact CB-CG2 3.87Å
99	F	85.5	Confident	76.6	Confident	135 Å²	135	64.8 Å²	64.8	59%	0.592	34%	0.344	S	S	*	.	H	α-helix	trans	-63.4	-39.8	175.4	-176.3	-109.7	0	0	0	112.7	L95 G96 S97 I102 I103	L95-F99 VanDerWaalsContact O-CB 3.3Å; L95-F99 WeakPolarHBondContact O-CB 3.45Å; L95-F99 PolarHBondContact O-N 3.4Å; G96-F99 PolarHBondContact O-N 3.07Å; S97-F99 VanDerWaalsContact C-N 3.3Å; S97-F99 PolarHBondContact O-N 3.23Å; F99-I102 PolarHBondContact O-N 3.02Å; F99-I103 HydrophobicContact CD1-CD1 3.88Å; F99-I103 HydrophobicContact CE1-CD1 3.51Å; F99-I103 HydrophobicContact CZ-CD1 3.87Å; F99-I103 WeakPolarHBondContact O-CG1 3.44Å; F99-I103 PolarHBondContact O-N 3.43Å; F99-I103 VanDerWaalsContact O-N 3.08Å
100	I	81.7	Confident	76.9	Confident	56 Å²	56	60.4 Å²	60.4	29%	0.287	32%	0.316	S	S	.	.	H	α-helix	trans	-64.2	-45.4	173.2	-70	162.8	0	0	0	110.9	G96 S97 I102 I103 M104 L300 F303	G96-I100 WeakPolarHBondContact O-CD1 3.47Å; G96-I100 VanDerWaalsContact O-CG1 3.3Å; G96-I100 WeakPolarHBondContact O-CG1 3.28Å; G96-I100 PolarHBondContact O-N 2.87Å; S97-I100 PolarHBondContact O-N 2.89Å; I100-I102 VanDerWaalsContact C-N 3.3Å; I100-I102 PolarHBondContact O-N 3.45Å; I100-I103 PolarHBondContact O-N 2.73Å; I100-I103 VanDerWaalsContact O-N 3.11Å; I100-M104 HydrophobicContact CG2-CG 4.49Å; I100-M104 WeakPolarHBondContact O-CG 3.26Å; I100-M104 PolarHBondContact O-N 2.95Å; I100-L300 HydrophobicContact CG2-CD2 4.24Å; I100-F303 HydrophobicContact CD1-CD1 4.44Å; I100-F303 HydrophobicContact CD1-CE1 3.68Å; I100-F303 HydrophobicContact CD1-CZ 4.13Å
101	S	76	Confident	77.6	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.007	33%	0.334	C	S	.	.	H	α-helix	trans	-60.3	-36.6	176.1	-65.3	0	0	0	0	112.7	S97 A98 M104 G105 Q106	S97-S101 PolarHBondContact O-N 3.34Å; S97-S101 PolarHBondContact O-OG 3.23Å; A98-S101 PolarHBondContact O-N 3.09Å; S101-M104 PolarHBondContact O-N 3.17Å; S101-G105 PolarHBondContact O-N 2.97Å; S101-Q106 PolarHBondContact O-N 3.21Å
102	I	85.1	Confident	77.4	Confident	82 Å²	82	65.7 Å²	65.7	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-46.1	172.2	-68	166.1	0	0	0	111.2	A98 F99 I100 M104 G105 A110	A98-I102 WeakPolarHBondContact O-CG1 3.42Å; A98-I102 PolarHBondContact O-N 3.04Å; F99-I102 PolarHBondContact O-N 3.02Å; I100-I102 VanDerWaalsContact C-N 3.3Å; I100-I102 PolarHBondContact O-N 3.45Å; I102-M104 PolarHBondContact O-N 2.93Å; I102-G105 PolarHBondContact O-N 2.86Å; I102-G105 VanDerWaalsContact O-N 3.08Å; I102-A110 HydrophobicContact CD1-CB 4.4Å; I102-A110 HydrophobicContact CG1-CB 3.61Å
103	I	86.4	Confident	77.2	Confident	123 Å²	123	61.5 Å²	61.5	63%	0.631	33%	0.325	S	S	*	.	H	α-helix	trans	-62.1	-32.7	177	-70.4	168.5	0	0	0	111.5	F99 I100 G105	F99-I103 HydrophobicContact CD1-CD1 3.88Å; F99-I103 HydrophobicContact CE1-CD1 3.51Å; F99-I103 HydrophobicContact CZ-CD1 3.87Å; F99-I103 WeakPolarHBondContact O-CG1 3.44Å; F99-I103 PolarHBondContact O-N 3.43Å; F99-I103 VanDerWaalsContact O-N 3.08Å; I100-I103 PolarHBondContact O-N 2.73Å; I100-I103 VanDerWaalsContact O-N 3.11Å; I103-G105 VanDerWaalsContact C-N 3.32Å
104	M	77.1	Confident	77.7	Confident	78 Å²	78	61.1 Å²	61.1	38%	0.384	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.6	175.6	-70.4	-153.7	70.4	0	0	114.9	I100 S101 I102 Q106 L300	I100-M104 HydrophobicContact CG2-CG 4.49Å; I100-M104 WeakPolarHBondContact O-CG 3.26Å; I100-M104 PolarHBondContact O-N 2.95Å; S101-M104 PolarHBondContact O-N 3.17Å; I102-M104 PolarHBondContact O-N 2.93Å; M104-Q106 HydrophobicContact CB-CG 4.21Å; M104-Q106 PolarHBondContact O-N 3.45Å; M104-L300 HydrophobicContact CE-CB 4.31Å; M104-L300 HydrophobicContact CE-CD1 3.67Å; M104-L300 HydrophobicContact CE-CG 4.46Å; M104-L300 HydrophobicContact SD-CB 3.74Å; M104-L300 HydrophobicContact SD-CD1 3.69Å; M104-L300 HydrophobicContact SD-CD2 3.87Å; M104-L300 HydrophobicContact SD-CG 3.94Å
105	G	78.7	Confident	77.9	Confident	37 Å²	37	63.5 Å²	63.5	38%	0.381	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	11.2	-171.8	0	0	0	0	0	114.4	S101 I102 I103 Y107	S101-G105 PolarHBondContact O-N 2.97Å; I102-G105 PolarHBondContact O-N 2.86Å; I102-G105 VanDerWaalsContact O-N 3.08Å; I103-G105 VanDerWaalsContact C-N 3.32Å; G105-Y107 WeakPolarHBondContact O-CD2 3.39Å; G105-Y107 PolarHBondContact O-N 3.37Å
106	Q	75.9	Confident	77.3	Confident	70 Å²	70	61.2 Å²	61.2	33%	0.327	33%	0.332	S	S	.	.			trans	-81.7	68.3	173.5	-67.1	-177.3	-70.3	0	0	109.8	S101 M104 D108 D109 A110	S101-Q106 PolarHBondContact O-N 3.21Å; M104-Q106 HydrophobicContact CB-CG 4.21Å; M104-Q106 PolarHBondContact O-N 3.45Å; Q106-D108 VanDerWaalsContact C-N 3.33Å; Q106-D108 PolarHBondContact O-N 2.78Å; Q106-D109 HydrophobicContact CB-CB 4.33Å; Q106-D109 PolarHBondContact NE2-OD2 3.26Å; Q106-D109 PolarHBondContact O-N 3.3Å; Q106-A110 WeakPolarHBondContact O-CB 3.32Å; Q106-A110 PolarHBondContact O-N 3.01Å; Q106-A110 VanDerWaalsContact O-N 3.09Å
107	Y	79.9	Confident	77.1	Confident	143 Å²	143	59.9 Å²	59.9	56%	0.561	32%	0.317	S	S	*	.	H	α-helix	trans	-63.6	-36.2	-174.7	-64.2	-70.2	0	0	0	112.9	G105 A110 I111	G105-Y107 WeakPolarHBondContact O-CD2 3.39Å; G105-Y107 PolarHBondContact O-N 3.37Å; Y107-A110 PolarHBondContact O-N 3.49Å; Y107-I111 WeakPolarHBondContact O-CB 3.47Å; Y107-I111 WeakPolarHBondContact O-CD1 3.14Å; Y107-I111 WeakPolarHBondContact O-CG1 3.29Å; Y107-I111 PolarHBondContact O-N 3.14Å
108	D	69.8	Low	77.5	Confident	130 Å²	130	63.3 Å²	63.3	70%	0.695	34%	0.338	S	S	*	.	H	α-helix	trans	-64	-44.4	-179.8	-57.1	-59.5	0	0	0	112	Q106 S112	Q106-D108 VanDerWaalsContact C-N 3.33Å; Q106-D108 PolarHBondContact O-N 2.78Å; D108-S112 VanDerWaalsContact O-CB 3.31Å; D108-S112 WeakPolarHBondContact O-CB 3.25Å; D108-S112 PolarHBondContact O-N 2.88Å; D108-S112 PolarHBondContact O-OG 2.8Å
109	D	64.4	Low	77.4	Confident	73 Å²	73	67 Å²	67	39%	0.39	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-46	174	-67.4	-43	0	0	0	110.9	Q106 I111 S112 I113	Q106-D109 HydrophobicContact CB-CB 4.33Å; Q106-D109 PolarHBondContact NE2-OD2 3.26Å; Q106-D109 PolarHBondContact O-N 3.3Å; D109-I111 PolarHBondContact O-N 2.68Å; D109-S112 PolarHBondContact O-N 2.76Å; D109-I113 WeakPolarHBondContact O-CB 3.46Å; D109-I113 VanDerWaalsContact O-CG1 3.25Å; D109-I113 WeakPolarHBondContact O-CG1 3.41Å; D109-I113 PolarHBondContact O-N 3.48Å
110	A	76	Confident	76.7	Confident	4 Å²	4	61.7 Å²	61.7	3%	0.033	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-42.9	179.8	0	0	0	0	0	113.1	I102 Q106 Y107 T114	I102-A110 HydrophobicContact CD1-CB 4.4Å; I102-A110 HydrophobicContact CG1-CB 3.61Å; Q106-A110 WeakPolarHBondContact O-CB 3.32Å; Q106-A110 PolarHBondContact O-N 3.01Å; Q106-A110 VanDerWaalsContact O-N 3.09Å; Y107-A110 PolarHBondContact O-N 3.49Å; A110-T114 VanDerWaalsContact O-CB 3.26Å; A110-T114 WeakPolarHBondContact O-CB 3.32Å; A110-T114 PolarHBondContact O-N 2.88Å; A110-T114 PolarHBondContact O-OG1 3.36Å
111	I	81.6	Confident	76.6	Confident	106 Å²	106	59 Å²	59	54%	0.544	32%	0.321	S	S	.	.	H	α-helix	trans	-66.7	-41.5	176.9	-70.1	164.6	0	0	0	110	Y107 D109 T114 T115	Y107-I111 WeakPolarHBondContact O-CB 3.47Å; Y107-I111 WeakPolarHBondContact O-CD1 3.14Å; Y107-I111 WeakPolarHBondContact O-CG1 3.29Å; Y107-I111 PolarHBondContact O-N 3.14Å; D109-I111 PolarHBondContact O-N 2.68Å; I111-T114 PolarHBondContact O-N 3.3Å; I111-T115 VanDerWaalsContact O-CB 3.27Å; I111-T115 WeakPolarHBondContact O-CB 3.37Å; I111-T115 PolarHBondContact O-N 3.07Å; I111-T115 PolarHBondContact O-OG1 3.34Å
112	S	69.2	Low	76.8	Confident	44 Å²	44	61.6 Å²	61.6	31%	0.308	34%	0.337	S	S	.	.	H	α-helix	trans	-62.3	-50.1	177.8	-60.3	0	0	0	0	111.6	D108 D109 T115 A116	D108-S112 VanDerWaalsContact O-CB 3.31Å; D108-S112 WeakPolarHBondContact O-CB 3.25Å; D108-S112 PolarHBondContact O-N 2.88Å; D108-S112 PolarHBondContact O-OG 2.8Å; D109-S112 PolarHBondContact O-N 2.76Å; S112-T115 PolarHBondContact O-N 2.9Å; S112-A116 WeakPolarHBondContact O-CB 3.35Å; S112-A116 PolarHBondContact O-N 3.4Å
113	I	73.1	Confident	76.2	Confident	23 Å²	23	60.4 Å²	60.4	12%	0.118	33%	0.333	C	S	.	.	H	α-helix	trans	-62.1	-46.6	177.5	-65.4	164.5	0	0	0	110.9	L94 A98 D109 T115 A116 I117	L94-I113 HydrophobicContact CD2-CG2 4.08Å; A98-I113 HydrophobicContact CB-CB 4.26Å; A98-I113 HydrophobicContact CB-CG2 3.87Å; D109-I113 WeakPolarHBondContact O-CB 3.46Å; D109-I113 VanDerWaalsContact O-CG1 3.25Å; D109-I113 WeakPolarHBondContact O-CG1 3.41Å; D109-I113 PolarHBondContact O-N 3.48Å; I113-T115 VanDerWaalsContact C-N 3.33Å; I113-T115 PolarHBondContact O-N 3.33Å; I113-A116 WeakPolarHBondContact O-CB 3.22Å; I113-A116 PolarHBondContact O-N 3.4Å; I113-I117 HydrophobicContact CG2-CD1 3.94Å; I113-I117 HydrophobicContact CG2-CG1 4.45Å; I113-I117 VanDerWaalsContact O-CG1 3.3Å; I113-I117 WeakPolarHBondContact O-CG1 3.44Å; I113-I117 PolarHBondContact O-N 3.26Å
114	T	79.8	Confident	75.3	Confident	56 Å²	56	56 Å²	56	34%	0.344	32%	0.316	S	S	.	.	H	α-helix	trans	-62.3	-41.8	-179.7	-56.6	0	0	0	0	111.6	A110 I111 I117 V118	A110-T114 VanDerWaalsContact O-CB 3.26Å; A110-T114 WeakPolarHBondContact O-CB 3.32Å; A110-T114 PolarHBondContact O-N 2.88Å; A110-T114 PolarHBondContact O-OG1 3.36Å; I111-T114 PolarHBondContact O-N 3.3Å; T114-I117 PolarHBondContact O-N 2.94Å; T114-V118 WeakPolarHBondContact O-CG2 3.24Å; T114-V118 PolarHBondContact O-N 3.41Å; T114-V118 VanDerWaalsContact O-N 3.1Å
115	T	77.3	Confident	75.3	Confident	73 Å²	73	54.1 Å²	54.1	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-43.2	176.8	-56.5	0	0	0	0	111.4	I111 S112 I113 V118 I119	I111-T115 VanDerWaalsContact O-CB 3.27Å; I111-T115 WeakPolarHBondContact O-CB 3.37Å; I111-T115 PolarHBondContact O-N 3.07Å; I111-T115 PolarHBondContact O-OG1 3.34Å; S112-T115 PolarHBondContact O-N 2.9Å; I113-T115 VanDerWaalsContact C-N 3.33Å; I113-T115 PolarHBondContact O-N 3.33Å; T115-V118 PolarHBondContact O-N 2.97Å; T115-I119 HydrophobicContact CG2-CD1 4.07Å; T115-I119 WeakPolarHBondContact O-CG1 3.46Å; T115-I119 PolarHBondContact O-N 3.17Å; T115-I119 VanDerWaalsContact O-N 3.11Å
116	A	69.5	Low	75.2	Confident	18 Å²	18	56.3 Å²	56.3	15%	0.149	31%	0.311	C	S	.	.	H	α-helix	trans	-59.2	-48.1	174.9	0	0	0	0	0	112.3	S112 I113 V118 I119 V120 L794	S112-A116 WeakPolarHBondContact O-CB 3.35Å; S112-A116 PolarHBondContact O-N 3.4Å; I113-A116 WeakPolarHBondContact O-CB 3.22Å; I113-A116 PolarHBondContact O-N 3.4Å; A116-V118 PolarHBondContact O-N 2.87Å; A116-I119 PolarHBondContact O-N 2.9Å; A116-V120 WeakPolarHBondContact O-CG2 3.38Å; A116-V120 PolarHBondContact O-N 3.4Å; A116-L794 HydrophobicContact CB-CD2 3.56Å
117	I	78.2	Confident	74.6	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.015	31%	0.31	C	S	.	.	H	α-helix	trans	-57	-47.9	177.5	-64	161.3	0	0	0	111	F86 I91 L94 L95 I113 T114 I119 V120 V121	F86-I117 HydrophobicContact CE1-CG2 4.2Å; I91-I117 HydrophobicContact CG2-CG2 3.93Å; L94-I117 HydrophobicContact CB-CD1 3.78Å; L94-I117 HydrophobicContact CB-CG1 3.93Å; L94-I117 HydrophobicContact CD1-CG1 3.89Å; L94-I117 HydrophobicContact CG-CG1 4.49Å; L95-I117 HydrophobicContact CD2-CD1 3.76Å; L95-I117 HydrophobicContact CG-CD1 4.03Å; I113-I117 HydrophobicContact CG2-CD1 3.94Å; I113-I117 HydrophobicContact CG2-CG1 4.45Å; I113-I117 VanDerWaalsContact O-CG1 3.3Å; I113-I117 WeakPolarHBondContact O-CG1 3.44Å; I113-I117 PolarHBondContact O-N 3.26Å; T114-I117 PolarHBondContact O-N 2.94Å; I117-I119 VanDerWaalsContact C-N 3.31Å; I117-I119 PolarHBondContact O-N 3.37Å; I117-V120 PolarHBondContact O-N 3.04Å; I117-V121 HydrophobicContact CG2-CG2 4.12Å; I117-V121 WeakPolarHBondContact O-CB 3.46Å; I117-V121 WeakPolarHBondContact O-CG2 3.25Å; I117-V121 PolarHBondContact O-N 3.1Å
118	V	82.8	Confident	73.9	Confident	72 Å²	72	52.8 Å²	52.8	44%	0.436	30%	0.299	S	S	.	.	H	α-helix	trans	-61.9	-40.2	-178.5	171.1	0	0	0	0	111.3	T114 T115 A116 T122	T114-V118 WeakPolarHBondContact O-CG2 3.24Å; T114-V118 PolarHBondContact O-N 3.41Å; T114-V118 VanDerWaalsContact O-N 3.1Å; T115-V118 PolarHBondContact O-N 2.97Å; A116-V118 PolarHBondContact O-N 2.87Å; V118-T122 VanDerWaalsContact O-CB 3.24Å; V118-T122 WeakPolarHBondContact O-CB 3.36Å; V118-T122 PolarHBondContact O-N 3.46Å; V118-T122 VanDerWaalsContact O-N 3.07Å; V118-T122 PolarHBondContact O-OG1 3.23Å
119	I	77.6	Confident	73.9	Confident	81 Å²	81	50.9 Å²	50.9	42%	0.415	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-52.1	175.2	-67.8	166.6	0	0	0	110.4	T115 A116 I117 V121 T122 V123 M798	T115-I119 HydrophobicContact CG2-CD1 4.07Å; T115-I119 WeakPolarHBondContact O-CG1 3.46Å; T115-I119 PolarHBondContact O-N 3.17Å; T115-I119 VanDerWaalsContact O-N 3.11Å; A116-I119 PolarHBondContact O-N 2.9Å; I117-I119 VanDerWaalsContact C-N 3.31Å; I117-I119 PolarHBondContact O-N 3.37Å; I119-V121 PolarHBondContact O-N 2.95Å; I119-T122 PolarHBondContact O-N 3.3Å; I119-V123 HydrophobicContact CG2-CG2 4.28Å; I119-V123 WeakPolarHBondContact O-CB 3.46Å; I119-V123 VanDerWaalsContact O-CG2 3.23Å; I119-V123 WeakPolarHBondContact O-CG2 3.37Å; I119-V123 PolarHBondContact O-N 3.04Å; I119-M798 HydrophobicContact CG2-CE 4.03Å; I119-M798 HydrophobicContact CG2-SD 4.34Å
120	V	70.7	Confident	74	Confident	22 Å²	22	56.6 Å²	56.6	13%	0.133	30%	0.299	C	S	.	.	H	α-helix	trans	-58.4	-49.7	-178.5	169.5	0	0	0	0	111.6	A116 I117 T122 V123 A124 E316 M798	A116-V120 WeakPolarHBondContact O-CG2 3.38Å; A116-V120 PolarHBondContact O-N 3.4Å; I117-V120 PolarHBondContact O-N 3.04Å; V120-T122 PolarHBondContact O-N 3.1Å; V120-V123 PolarHBondContact O-N 2.76Å; V120-A124 WeakPolarHBondContact O-CB 3.23Å; V120-A124 PolarHBondContact O-N 2.85Å; V120-E316 WeakPolarHBondContact CG1-OE2 3.35Å; V120-M798 HydrophobicContact CG2-SD 4.33Å
121	V	79	Confident	72.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.6	-42.5	179.8	173.8	0	0	0	0	111.8	Y82 Q85 F86 I91 I117 I119 A124 F125	Y82-V121 HydrophobicContact CE2-CG1 3.99Å; Q85-V121 HydrophobicContact CB-CG1 4.08Å; F86-V121 HydrophobicContact CD1-CG2 4.39Å; F86-V121 HydrophobicContact CD2-CG1 4.19Å; F86-V121 HydrophobicContact CE1-CG1 4.43Å; F86-V121 HydrophobicContact CE1-CG2 4.11Å; F86-V121 HydrophobicContact CE2-CG1 3.68Å; F86-V121 HydrophobicContact CZ-CB 4.28Å; F86-V121 HydrophobicContact CZ-CG1 3.82Å; F86-V121 HydrophobicContact CZ-CG2 4.29Å; I91-V121 HydrophobicContact CD1-CG2 3.59Å; I91-V121 HydrophobicContact CG1-CG2 4.27Å; I91-V121 HydrophobicContact CG2-CG2 4.33Å; I117-V121 HydrophobicContact CG2-CG2 4.12Å; I117-V121 WeakPolarHBondContact O-CB 3.46Å; I117-V121 WeakPolarHBondContact O-CG2 3.25Å; I117-V121 PolarHBondContact O-N 3.1Å; I119-V121 PolarHBondContact O-N 2.95Å; V121-A124 PolarHBondContact O-N 3.48Å; V121-F125 WeakPolarHBondContact O-CB 3.39Å; V121-F125 PolarHBondContact O-N 3.35Å
122	T	81.2	Confident	71.9	Confident	56 Å²	56	56.7 Å²	56.7	34%	0.344	30%	0.302	S	S	.	.	H	α-helix	trans	-65.5	-42.7	178.8	-56.5	0	0	0	0	111.2	V118 I119 V120 V126	V118-T122 VanDerWaalsContact O-CB 3.24Å; V118-T122 WeakPolarHBondContact O-CB 3.36Å; V118-T122 PolarHBondContact O-N 3.46Å; V118-T122 VanDerWaalsContact O-N 3.07Å; V118-T122 PolarHBondContact O-OG1 3.23Å; I119-T122 PolarHBondContact O-N 3.3Å; V120-T122 PolarHBondContact O-N 3.1Å; T122-V126 HydrophobicContact CG2-CG2 4.48Å; T122-V126 WeakPolarHBondContact O-CB 3.37Å; T122-V126 VanDerWaalsContact O-CG2 3.25Å; T122-V126 WeakPolarHBondContact O-CG2 3.3Å; T122-V126 PolarHBondContact O-N 2.92Å
123	V	71.9	Confident	71.3	Confident	57 Å²	57	59.5 Å²	59.5	35%	0.345	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-47.1	177.2	168.3	0	0	0	0	110.8	I119 V120 V126 Q127	I119-V123 HydrophobicContact CG2-CG2 4.28Å; I119-V123 WeakPolarHBondContact O-CB 3.46Å; I119-V123 VanDerWaalsContact O-CG2 3.23Å; I119-V123 WeakPolarHBondContact O-CG2 3.37Å; I119-V123 PolarHBondContact O-N 3.04Å; V120-V123 PolarHBondContact O-N 2.76Å; V123-V126 PolarHBondContact O-N 2.68Å; V123-Q127 WeakPolarHBondContact O-CB 3.49Å; V123-Q127 VanDerWaalsContact O-CD 3.31Å; V123-Q127 WeakPolarHBondContact O-CG 3.35Å; V123-Q127 PolarHBondContact O-N 2.89Å; V123-Q127 PolarHBondContact O-OE1 3.47Å
124	A	67.4	Low	69.8	Low	31 Å²	31	62.5 Å²	62.5	26%	0.256	33%	0.331	S	S	.	.	H	α-helix	trans	-60.1	-49.6	177.8	0	0	0	0	0	112.3	V120 V121 V126 Q127 E128	V120-A124 WeakPolarHBondContact O-CB 3.23Å; V120-A124 PolarHBondContact O-N 2.85Å; V121-A124 PolarHBondContact O-N 3.48Å; A124-V126 PolarHBondContact O-N 2.84Å; A124-Q127 PolarHBondContact O-N 2.95Å; A124-E128 WeakPolarHBondContact O-CB 3.4Å; A124-E128 PolarHBondContact O-N 3.31Å
125	F	78.4	Confident	68.4	Low	38 Å²	38	63.2 Å²	63.2	17%	0.167	33%	0.332	C	S	.	.	H	α-helix	trans	-61.6	-41.5	178.4	172.8	-102.3	0	0	0	112.7	K81 Y82 V121 Q127 E128 Y129	K81-F125 HydrophobicContact CB-CE2 4.29Å; Y82-F125 HydrophobicContact CD2-CB 3.88Å; Y82-F125 AromaticContact CD2-CD1 3.8Å; Y82-F125 HydrophobicContact CD2-CD1 3.8Å; Y82-F125 AromaticContact CD2-CD2 3.99Å; Y82-F125 HydrophobicContact CD2-CD2 3.99Å; Y82-F125 HydrophobicContact CD2-CE1 4.33Å; Y82-F125 HydrophobicContact CD2-CE2 4.49Å; Y82-F125 AromaticContact CD2-CG 3.61Å; Y82-F125 HydrophobicContact CD2-CG 3.61Å; Y82-F125 HydrophobicContact CE2-CB 4.31Å; Y82-F125 HydrophobicContact CE2-CD1 4.42Å; Y82-F125 HydrophobicContact CE2-CG 4.39Å; V121-F125 WeakPolarHBondContact O-CB 3.39Å; V121-F125 PolarHBondContact O-N 3.35Å; F125-Q127 VanDerWaalsContact C-N 3.31Å; F125-Q127 PolarHBondContact O-N 2.99Å; F125-E128 PolarHBondContact O-N 3.36Å; F125-Y129 VanDerWaalsContact O-CB 3.28Å; F125-Y129 WeakPolarHBondContact O-CB 3.21Å; F125-Y129 PolarHBondContact O-N 3.49Å
126	V	75	Confident	67.1	Low	83 Å²	83	62.4 Å²	62.4	50%	0.503	33%	0.326	S	S	.	.	H	α-helix	trans	-65.7	-35.4	178	168.3	0	0	0	0	111.5	T122 V123 A124 R130	T122-V126 HydrophobicContact CG2-CG2 4.48Å; T122-V126 WeakPolarHBondContact O-CB 3.37Å; T122-V126 VanDerWaalsContact O-CG2 3.25Å; T122-V126 WeakPolarHBondContact O-CG2 3.3Å; T122-V126 PolarHBondContact O-N 2.92Å; V123-V126 PolarHBondContact O-N 2.68Å; A124-V126 PolarHBondContact O-N 2.84Å; V126-R130 VanDerWaalsContact O-CB 3.26Å; V126-R130 WeakPolarHBondContact O-CB 3.16Å; V126-R130 PolarHBondContact O-N 2.95Å
127	Q	63.8	Low	65.9	Low	65 Å²	65	67.5 Å²	67.5	30%	0.304	35%	0.346	S	S	.	.	H	α-helix	trans	-70.8	-41.8	176	-70.7	163.2	-8.3	0	0	112.2	V123 A124 F125 S131 V320	V123-Q127 WeakPolarHBondContact O-CB 3.49Å; V123-Q127 VanDerWaalsContact O-CD 3.31Å; V123-Q127 WeakPolarHBondContact O-CG 3.35Å; V123-Q127 PolarHBondContact O-N 2.89Å; V123-Q127 PolarHBondContact O-OE1 3.47Å; A124-Q127 PolarHBondContact O-N 2.95Å; F125-Q127 VanDerWaalsContact C-N 3.31Å; F125-Q127 PolarHBondContact O-N 2.99Å; Q127-S131 PolarHBondContact O-N 3.46Å; Q127-S131 PolarHBondContact O-OG 2.9Å; Q127-V320 HydrophobicContact CB-CG1 4.43Å; Q127-V320 VanDerWaalsContact CD-CG1 3.42Å; Q127-V320 HydrophobicContact CG-CG1 4.11Å; Q127-V320 VanDerWaalsContact OE1-CG1 3.31Å
128	E	66.1	Low	63.8	Low	73 Å²	73	72.7 Å²	72.7	34%	0.341	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-56.8	174.5	-177.8	171.1	-122.5	0	0	111.4	Q85 A124 F125 R130 S131 E132	Q85-E128 PolarHBondContact NE2-OE2 3.45Å; A124-E128 WeakPolarHBondContact O-CB 3.4Å; A124-E128 PolarHBondContact O-N 3.31Å; F125-E128 PolarHBondContact O-N 3.36Å; E128-R130 VanDerWaalsContact C-N 3.3Å; E128-R130 PolarHBondContact O-N 3.48Å; E128-S131 WeakPolarHBondContact O-CA 3.49Å; E128-S131 WeakPolarHBondContact O-CB 3.39Å; E128-S131 PolarHBondContact O-N 3.37Å; E128-E132 PolarHBondContact O-N 3.13Å
129	Y	69	Low	61.6	Low	91 Å²	91	74.7 Å²	74.7	36%	0.357	39%	0.386	S	S	.	.	H	α-helix	trans	-57.5	-39.2	-178.5	174.9	-110.6	0	0	0	113.2	L78 F125 S131 E132 K133	L78-Y129 HydrophobicContact CD1-CE2 4.03Å; L78-Y129 HydrophobicContact CD2-CD2 3.8Å; L78-Y129 HydrophobicContact CD2-CE2 3.71Å; F125-Y129 VanDerWaalsContact O-CB 3.28Å; F125-Y129 WeakPolarHBondContact O-CB 3.21Å; F125-Y129 PolarHBondContact O-N 3.49Å; Y129-S131 VanDerWaalsContact C-N 3.31Å; Y129-S131 PolarHBondContact O-N 3.18Å; Y129-E132 PolarHBondContact O-N 3.42Å; Y129-K133 WeakPolarHBondContact O-CB 3.25Å; Y129-K133 PolarHBondContact O-N 3.04Å
130	R	65.4	Low	59.7	Low	193 Å²	193	77.6 Å²	77.6	73%	0.728	40%	0.396	S	S	*	.	H	α-helix	trans	-67.4	-33.4	176.6	-172	176.7	-175.1	179.2	2.7	112.1	V126 E128 S134	V126-R130 VanDerWaalsContact O-CB 3.26Å; V126-R130 WeakPolarHBondContact O-CB 3.16Å; V126-R130 PolarHBondContact O-N 2.95Å; E128-R130 VanDerWaalsContact C-N 3.3Å; E128-R130 PolarHBondContact O-N 3.48Å; R130-S134 PolarHBondContact O-OG 2.7Å
131	S	53.6	Low	57.9	Low	42 Å²	42	83.8 Å²	83.8	29%	0.294	43%	0.427	S	S	.	.	H	α-helix	trans	-69.9	-45.3	176.6	-56.6	0	0	0	0	111	Q127 E128 Y129	Q127-S131 PolarHBondContact O-N 3.46Å; Q127-S131 PolarHBondContact O-OG 2.9Å; E128-S131 WeakPolarHBondContact O-CA 3.49Å; E128-S131 WeakPolarHBondContact O-CB 3.39Å; E128-S131 PolarHBondContact O-N 3.37Å; Y129-S131 VanDerWaalsContact C-N 3.31Å; Y129-S131 PolarHBondContact O-N 3.18Å
132	E	60.1	Low	55.9	Low	70 Å²	70	89.2 Å²	89.2	33%	0.327	46%	0.46	S	S	.	.	H	α-helix	trans	-63.4	-50.5	176.7	-64.7	-165.8	140.9	0	0	112.9	K81 E128 Y129 S134 L135 D136	K81-E132 IonicContact NZ-OE1 2.86Å; K81-E132 PolarHBondContact NZ-OE1 3.33Å; K81-E132 IonicContact NZ-OE2 2.67Å; K81-E132 PolarHBondContact NZ-OE2 2.99Å; E128-E132 PolarHBondContact O-N 3.13Å; Y129-E132 PolarHBondContact O-N 3.42Å; E132-S134 PolarHBondContact O-N 3.44Å; E132-L135 WeakPolarHBondContact O-CB 3.21Å; E132-L135 PolarHBondContact O-N 2.9Å; E132-D136 PolarHBondContact O-N 3.4Å
133	K	56.7	Low	54.1	Low	103 Å²	103	91.7 Å²	91.7	45%	0.448	48%	0.477	S	S	.	.	H	α-helix	trans	-58.4	-29.8	-175.2	-172.2	177.1	178.5	-176.8	0	112.6	Y129 L135 D136	Y129-K133 WeakPolarHBondContact O-CB 3.25Å; Y129-K133 PolarHBondContact O-N 3.04Å; K133-L135 VanDerWaalsContact C-N 3.28Å; K133-L135 PolarHBondContact O-N 3.46Å; K133-D136 PolarHBondContact O-N 3.36Å
134	S	43.4	Very low	53.7	Low	86 Å²	86	91.7 Å²	91.7	60%	0.601	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-21.9	178.6	-55.9	0	0	0	0	113.7	R130 E132	R130-S134 PolarHBondContact O-OG 2.7Å; E132-S134 PolarHBondContact O-N 3.44Å
135	L	48.7	Very low	54.1	Low	70 Å²	70	95 Å²	95	37%	0.366	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-33.1	174.2	-57	173.7	0	0	0	111.3	E132 K133 E137 L138 K341	E132-L135 WeakPolarHBondContact O-CB 3.21Å; E132-L135 PolarHBondContact O-N 2.9Å; K133-L135 VanDerWaalsContact C-N 3.28Å; K133-L135 PolarHBondContact O-N 3.46Å; L135-E137 VanDerWaalsContact C-N 3.26Å; L135-E137 PolarHBondContact O-N 3.3Å; L135-L138 WeakPolarHBondContact O-CB 3.42Å; L135-L138 PolarHBondContact O-N 2.9Å; L135-L138 VanDerWaalsContact O-N 3.14Å; L135-K341 WeakPolarHBondContact CD2-O 3.5Å
136	D	51.8	Low	54.5	Low	57 Å²	57	93.6 Å²	93.6	31%	0.305	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.8	-166.4	-128.2	28.5	0	0	0	115.9	K75 E132 K133 K140	K75-D136 WeakPolarHBondContact CE-OD1 3.3Å; K75-D136 IonicContact NZ-OD1 3.34Å; K75-D136 PolarHBondContact NZ-OD1 2.97Å; K75-D136 IonicContact NZ-OD2 3.82Å; K75-D136 PolarHBondContact NZ-OD2 3.44Å; E132-D136 PolarHBondContact O-N 3.4Å; K133-D136 PolarHBondContact O-N 3.36Å; D136-K140 WeakPolarHBondContact O-CE 3.43Å
137	E	43.1	Very low	55.1	Low	124 Å²	124	91.4 Å²	91.4	58%	0.579	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-18.1	177.5	-64.4	-172	163.8	0	0	112.9	L135	L135-E137 VanDerWaalsContact C-N 3.26Å; L135-E137 PolarHBondContact O-N 3.3Å
138	L	35.2	Very low	56.4	Low	112 Å²	112	88.3 Å²	88.3	59%	0.586	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-20.5	180	-61.7	172.4	0	0	0	113.4	L135	L135-L138 WeakPolarHBondContact O-CB 3.42Å; L135-L138 PolarHBondContact O-N 2.9Å; L135-L138 VanDerWaalsContact O-N 3.14Å
139	T	36.6	Very low	57.6	Low	114 Å²	114	86.3 Å²	86.3	70%	0.699	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	4.6	-170.5	-20.5	0	0	0	0	114.8	L141	T139-L141 PolarHBondContact O-N 2.99Å
140	K	37.1	Very low	58.5	Low	143 Å²	143	83 Å²	83	62%	0.622	44%	0.44	S	S	*	.			trans	-91.5	19.5	-164.4	-65.3	179.6	-178.4	168.2	0	115.7	D136 V142	D136-K140 WeakPolarHBondContact O-CE 3.43Å; K140-V142 PolarHBondContact O-N 3.48Å
141	L	32.4	Very low	59.5	Low	151 Å²	151	77.7 Å²	77.7	79%	0.791	43%	0.427	S	S	*	.			trans	-98.8	86.9	-169.3	-71.8	171.5	0	0	0	114.7	T139	T139-L141 PolarHBondContact O-N 2.99Å
142	V	36.4	Very low	60.9	Low	114 Å²	114	84.3 Å²	84.3	69%	0.691	45%	0.445	S	S	*	.			trans	61.5	114.1	143.6	-170.7	0	0	0	0	119.7	K140	K140-V142 PolarHBondContact O-N 3.48Å
143	P	44.3	Very low	62.1	Low	109 Å²	109	90 Å²	90	71%	0.708	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-85.6	144	149.1	34.2	-30.2	0	0	0	111.3
144	P	63.3	Low	63.6	Low	56 Å²	56	91.6 Å²	91.6	36%	0.364	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-79.1	165.5	-173.8	31.6	-36.1	0	0	0	114.8	A159	P144-A159 HydrophobicContact CG-CB 4.23Å; P144-A159 VanDerWaalsContact O-CB 3.27Å; P144-A159 WeakPolarHBondContact O-CB 3.29Å; P144-A159 PolarHBondContact O-N 2.93Å
145	V	76.9	Confident	65.7	Low	102 Å²	102	90.4 Å²	90.4	62%	0.618	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	149.8	164.9	179	0	0	0	0	109	F157	V145-F157 WeakPolarHBondContact CA-O 3.32Å; V145-F157 WeakPolarHBondContact CG1-O 3.27Å
146	C	85.3	Confident	67.5	Low	8 Å²	8	90.7 Å²	90.7	5%	0.054	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	161.3	171.9	64.6	0	0	0	0	111	S156 F157 A159 L162 P177	C146-S156 CarbonylContact O-C 3.6Å; C146-S156 WeakPolarHBondContact O-CA 3.34Å; C146-F157 PolarHBondContact N-O 3.3Å; C146-F157 PolarHBondContact O-N 3.1Å; C146-F157 PolarHBondContact SG-O 3.1Å; C146-F157 VanDerWaalsContact SG-O 3.37Å; C146-A159 HydrophobicContact CB-CB 4.33Å; C146-L162 HydrophobicContact CB-CD1 4.11Å; C146-P177 HydrophobicContact CB-CB 3.77Å; C146-P177 HydrophobicContact CB-CG 3.82Å
147	T	88.7	Confident	69.2	Low	37 Å²	37	89.4 Å²	89.4	23%	0.227	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.2	172.8	-58.7	0	0	0	0	110.3	E154 S156 L169	T147-E154 HydrophobicContact CG2-CB 4.32Å; T147-S156 PolarHBondContact OG1-OG 3.03Å; T147-L169 PolarHBondContact O-N 3.4Å; T147-L169 VanDerWaalsContact O-N 3.12Å
148	C	90.2	Very high	71.2	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	164.6	175.9	82.9	0	0	0	0	112.4	E154 V155 F157 L162 V167 V168	C148-E154 WeakPolarHBondContact O-CA 3.31Å; C148-V155 PolarHBondContact N-O 3.04Å; C148-V155 PolarHBondContact O-N 3.03Å; C148-F157 WeakPolarHBondContact SG-CE1 3.24Å; C148-F157 WeakPolarHBondContact SG-CZ 3.37Å; C148-L162 HydrophobicContact CB-CD2 4.16Å; C148-V167 CarbonylContact C-O 3.54Å; C148-V167 VanDerWaalsContact CA-O 3.31Å; C148-V167 WeakPolarHBondContact CA-O 3.36Å; C148-V167 VanDerWaalsContact CB-O 3.28Å; C148-V167 WeakPolarHBondContact CB-O 3.46Å; C148-V168 HydrophobicContact CB-CG2 4.04Å
149	L	90.9	Very high	73.5	Confident	31 Å²	31	80.5 Å²	80.5	16%	0.162	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	116.6	174.5	-172.6	69.6	0	0	0	109.4	G52 R153 V167	G52-L149 VanDerWaalsContact CA-O 3.27Å; G52-L149 WeakPolarHBondContact CA-O 3.06Å; L149-R153 WeakPolarHBondContact CA-O 3.36Å; L149-V167 HydrophobicContact CB-CB 4.29Å; L149-V167 PolarHBondContact N-O 3.43Å
150	R	88.8	Confident	75.9	Confident	20 Å²	20	79.9 Å²	79.9	8%	0.075	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.8	170.5	-76.4	179.8	178.4	169.2	0.6	110	L53 R152 R153 E161 D166	L53-R150 VanDerWaalsContact O-CA 3.27Å; L53-R150 WeakPolarHBondContact O-CA 3.3Å; R150-R152 PolarHBondContact O-N 3.24Å; R150-R152 VanDerWaalsContact O-N 3.13Å; R150-R153 PolarHBondContact N-O 2.89Å; R150-R153 PolarHBondContact O-N 3.29Å; R150-E161 PolarHBondContact NH2-O 3.11Å; R150-D166 IonicContact CZ-OD1 2.73Å; R150-D166 IonicContact CZ-OD2 2.71Å; R150-D166 IonicContact NE-OD1 2.86Å; R150-D166 PolarHBondContact NE-OD1 3.43Å; R150-D166 IonicContact NE-OD2 2.68Å; R150-D166 IonicContact NH2-OD1 2.64Å; R150-D166 PolarHBondContact NH2-OD1 3.07Å; R150-D166 IonicContact NH2-OD2 1.78Å; R150-D166 PolarHBondContact NH2-OD2 3.23Å
151	D	86.1	Confident	78.2	Confident	83 Å²	83	75.8 Å²	75.8	44%	0.444	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	40.7	-178.4	-60.2	-64.5	0	0	0	113.8	L53 S54 S55 R153	L53-D151 PolarHBondContact O-N 3.46Å; S54-D151 VanDerWaalsContact CA-OD1 3.25Å; S54-D151 WeakPolarHBondContact CA-OD1 3.43Å; S54-D151 WeakPolarHBondContact CB-OD1 3.39Å; S55-D151 WeakPolarHBondContact CB-OD2 3.34Å; S55-D151 PolarHBondContact N-OD1 3.26Å; S55-D151 PolarHBondContact N-OD2 2.95Å; S55-D151 PolarHBondContact OG-OD2 3.39Å; D151-R153 VanDerWaalsContact C-N 3.27Å; D151-R153 PolarHBondContact O-N 2.79Å
152	R	83.3	Confident	80.9	Confident	181 Å²	181	68.6 Å²	68.6	68%	0.683	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	21.4	-175	-58.8	178.9	164.2	149.5	7.8	115.8	N51 R150	N51-R152 HydrophobicContact CB-CG 3.76Å; N51-R152 VanDerWaalsContact CG-NE 3.27Å; N51-R152 PolarHBondContact ND2-NH2 2.98Å; N51-R152 VanDerWaalsContact ND2-NH2 3.2Å; N51-R152 WeakPolarHBondContact O-CA 3.36Å; N51-R152 PolarHBondContact O-N 3.13Å; N51-R152 WeakPolarHBondContact OD1-CG 3.46Å; N51-R152 PolarHBondContact OD1-NE 3.01Å; N51-R152 PolarHBondContact OD1-NH2 3.31Å; R150-R152 PolarHBondContact O-N 3.24Å; R150-R152 VanDerWaalsContact O-N 3.13Å
153	R	85.3	Confident	83.5	Confident	189 Å²	189	63.2 Å²	63.2	71%	0.713	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.7	143.4	178.5	-62.9	-179.3	-178.8	-173.2	-0.8	110.8	L149 R150 D151 V155	L149-R153 WeakPolarHBondContact CA-O 3.36Å; R150-R153 PolarHBondContact N-O 2.89Å; R150-R153 PolarHBondContact O-N 3.29Å; D151-R153 VanDerWaalsContact C-N 3.27Å; D151-R153 PolarHBondContact O-N 2.79Å; R153-V155 HydrophobicContact CB-CG2 4.23Å; R153-V155 PolarHBondContact O-N 3.04Å
154	E	87.6	Confident	85.7	Confident	136 Å²	136	58.1 Å²	58.1	64%	0.636	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.1	165.3	-67.6	176.2	-170.4	0	0	108	T147 C148	T147-E154 HydrophobicContact CG2-CB 4.32Å; C148-E154 WeakPolarHBondContact O-CA 3.31Å
155	V	87.4	Confident	87	Confident	61 Å²	61	55.5 Å²	55.5	37%	0.37	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.1	-179	-168.9	0	0	0	0	108.6	C148 R153 F157	C148-V155 PolarHBondContact N-O 3.04Å; C148-V155 PolarHBondContact O-N 3.03Å; R153-V155 HydrophobicContact CB-CG2 4.23Å; R153-V155 PolarHBondContact O-N 3.04Å; V155-F157 HydrophobicContact CB-CD1 4.35Å; V155-F157 HydrophobicContact CG1-CD1 4.05Å
156	S	86.3	Confident	87.7	Confident	76 Å²	76	50.6 Å²	50.6	53%	0.531	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.1	175.1	-50.8	0	0	0	0	110.9	C146 T147	C146-S156 CarbonylContact O-C 3.6Å; C146-S156 WeakPolarHBondContact O-CA 3.34Å; T147-S156 PolarHBondContact OG1-OG 3.03Å
157	F	88	Confident	88.1	Confident	30 Å²	30	50.3 Å²	50.3	13%	0.132	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	174.8	179.4	55.3	-100.1	0	0	0	111.3	V145 C146 C148 V155 A159 E161 L162	V145-F157 WeakPolarHBondContact CA-O 3.32Å; V145-F157 WeakPolarHBondContact CG1-O 3.27Å; C146-F157 PolarHBondContact N-O 3.3Å; C146-F157 PolarHBondContact O-N 3.1Å; C146-F157 PolarHBondContact SG-O 3.1Å; C146-F157 VanDerWaalsContact SG-O 3.37Å; C148-F157 WeakPolarHBondContact SG-CE1 3.24Å; C148-F157 WeakPolarHBondContact SG-CZ 3.37Å; V155-F157 HydrophobicContact CB-CD1 4.35Å; V155-F157 HydrophobicContact CG1-CD1 4.05Å; F157-A159 PolarHBondContact O-N 3.31Å; F157-E161 HydrophobicContact CD2-CB 3.82Å; F157-E161 HydrophobicContact CE2-CB 3.95Å; F157-L162 HydrophobicContact CE2-CD2 4.04Å; F157-L162 HydrophobicContact CE2-CG 4.16Å; F157-L162 HydrophobicContact CZ-CD2 3.95Å
158	A	85.5	Confident	88.3	Confident	42 Å²	42	48.7 Å²	48.7	35%	0.347	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	132.5	-177.6	0	0	0	0	0	111.9	R160 E161	A158-R160 HydrophobicContact CB-CG 4.37Å; A158-R160 PolarHBondContact O-N 3.2Å; A158-E161 PolarHBondContact O-N 2.92Å
159	A	83.8	Confident	88.4	Confident	8 Å²	8	51.3 Å²	51.3	7%	0.066	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-55.8	-23.1	-171.5	0	0	0	0	0	114.9	N68 P144 C146 F157 E161 L162 P177	N68-A159 WeakPolarHBondContact CB-O 3.46Å; N68-A159 PolarHBondContact ND2-O 2.92Å; P144-A159 HydrophobicContact CG-CB 4.23Å; P144-A159 VanDerWaalsContact O-CB 3.27Å; P144-A159 WeakPolarHBondContact O-CB 3.29Å; P144-A159 PolarHBondContact O-N 2.93Å; C146-A159 HydrophobicContact CB-CB 4.33Å; F157-A159 PolarHBondContact O-N 3.31Å; A159-E161 PolarHBondContact O-N 3.37Å; A159-L162 PolarHBondContact O-N 3.41Å; A159-P177 HydrophobicContact CB-CB 4.04Å
160	R	85.9	Confident	88.4	Confident	100 Å²	100	50 Å²	50	38%	0.377	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-58.3	-23.2	173.4	80.2	176.7	-172.1	162.1	3.4	114.1	Y67 N68 E69 A158	Y67-R160 CarbonylContact C-O 3.49Å; Y67-R160 WeakPolarHBondContact CA-O 3.44Å; Y67-R160 WeakPolarHBondContact CB-O 3.48Å; Y67-R160 HydrophobicContact CD1-CG 4.28Å; Y67-R160 WeakPolarHBondContact CD1-O 3.42Å; N68-R160 PolarHBondContact N-O 3.11Å; N68-R160 WeakPolarHBondContact O-CA 3.31Å; E69-R160 HydrophobicContact CB-CB 4.24Å; A158-R160 HydrophobicContact CB-CG 4.37Å; A158-R160 PolarHBondContact O-N 3.2Å
161	E	86.8	Confident	88.4	Confident	57 Å²	57	51.4 Å²	51.4	27%	0.266	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-97	7.8	-172.6	-51.3	-172.2	178	0	0	112.9	I62 Y67 R150 F157 A158 A159	I62-E161 HydrophobicContact CD1-CB 4.37Å; Y67-E161 HydrophobicContact CD1-CG 4.39Å; Y67-E161 HydrophobicContact CE1-CG 4.37Å; R150-E161 PolarHBondContact NH2-O 3.11Å; F157-E161 HydrophobicContact CD2-CB 3.82Å; F157-E161 HydrophobicContact CE2-CB 3.95Å; A158-E161 PolarHBondContact O-N 2.92Å; A159-E161 PolarHBondContact O-N 3.37Å
162	L	89	Confident	88.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.257	C	S	.	.			trans	-72.1	147.7	167.7	-72	171.8	0	0	0	111.5	N68 C146 C148 F157 A159 D166 V168 P177 A178	N68-L162 HydrophobicContact CB-CB 4.31Å; C146-L162 HydrophobicContact CB-CD1 4.11Å; C148-L162 HydrophobicContact CB-CD2 4.16Å; F157-L162 HydrophobicContact CE2-CD2 4.04Å; F157-L162 HydrophobicContact CE2-CG 4.16Å; F157-L162 HydrophobicContact CZ-CD2 3.95Å; A159-L162 PolarHBondContact O-N 3.41Å; L162-D166 WeakPolarHBondContact CA-OD2 3.49Å; L162-D166 HydrophobicContact CD2-CB 4.16Å; L162-V168 HydrophobicContact CD1-CG2 4.22Å; L162-V168 HydrophobicContact CD2-CG2 3.81Å; L162-P177 HydrophobicContact CD1-CB 3.6Å; L162-P177 HydrophobicContact CD1-CG 3.51Å; L162-A178 HydrophobicContact CD1-CB 4.37Å
163	V	90.6	Very high	88.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	25%	0.251	C	S	.	.			trans	-132.9	156.1	174.3	-69	0	0	0	0	111.2	L53 A58 R61 I62 G165 D166	L53-V163 HydrophobicContact CD1-CG2 3.88Å; A58-V163 HydrophobicContact CB-CG2 4.24Å; R61-V163 HydrophobicContact CB-CB 3.81Å; R61-V163 HydrophobicContact CB-CG1 3.76Å; R61-V163 HydrophobicContact CB-CG2 3.91Å; I62-V163 HydrophobicContact CB-CG1 4.4Å; I62-V163 HydrophobicContact CG1-CG1 3.47Å; I62-V163 VanDerWaalsContact CG1-CG1 3.47Å; V163-G165 PolarHBondContact O-N 3.42Å; V163-D166 VanDerWaalsContact CG2-OD2 3.28Å; V163-D166 WeakPolarHBondContact CG2-OD2 3.38Å; V163-D166 PolarHBondContact N-OD2 2.87Å; V163-D166 WeakPolarHBondContact O-CB 3.23Å; V163-D166 PolarHBondContact O-N 3.29Å; V163-D166 VanDerWaalsContact O-N 3.08Å
164	P	90.8	Very high	88.2	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.019	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	132.8	170	-25.4	35.4	0	0	0	111.7	Y26 L45 R61 V240 T243	Y26-P164 WeakPolarHBondContact O-CB 3.29Å; L45-P164 HydrophobicContact CD2-CB 4.46Å; R61-P164 WeakPolarHBondContact CD-O 3.46Å; R61-P164 PolarHBondContact NH1-O 3.48Å; P164-V240 WeakPolarHBondContact CA-O 3.45Å; P164-T243 HydrophobicContact CG-CG2 4.18Å
165	G	89.5	Confident	88	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	-10.8	-172.8	0	0	0	0	0	116.2	A47 L53 V163 V240	A47-G165 WeakPolarHBondContact CB-O 3.37Å; L53-G165 WeakPolarHBondContact CG-O 3.4Å; V163-G165 PolarHBondContact O-N 3.42Å; G165-V240 PolarHBondContact N-O 3.06Å
166	D	91.7	Very high	88.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.			trans	-62.7	149.4	166.9	-79.8	-48	0	0	0	110.7	R150 L162 V163 V239 V240	R150-D166 IonicContact CZ-OD1 2.73Å; R150-D166 IonicContact CZ-OD2 2.71Å; R150-D166 IonicContact NE-OD1 2.86Å; R150-D166 PolarHBondContact NE-OD1 3.43Å; R150-D166 IonicContact NE-OD2 2.68Å; R150-D166 IonicContact NH2-OD1 2.64Å; R150-D166 PolarHBondContact NH2-OD1 3.07Å; R150-D166 IonicContact NH2-OD2 1.78Å; R150-D166 PolarHBondContact NH2-OD2 3.23Å; L162-D166 WeakPolarHBondContact CA-OD2 3.49Å; L162-D166 HydrophobicContact CD2-CB 4.16Å; V163-D166 VanDerWaalsContact CG2-OD2 3.28Å; V163-D166 WeakPolarHBondContact CG2-OD2 3.38Å; V163-D166 PolarHBondContact N-OD2 2.87Å; V163-D166 WeakPolarHBondContact O-CB 3.23Å; V163-D166 PolarHBondContact O-N 3.29Å; V163-D166 VanDerWaalsContact O-N 3.08Å; D166-V239 CarbonylContact O-C 3.53Å; D166-V239 WeakPolarHBondContact O-CA 3.11Å; D166-V240 HydrophobicContact CB-CG2 3.98Å; D166-V240 WeakPolarHBondContact O-CG2 3.42Å; D166-V240 PolarHBondContact O-N 3.14Å
167	V	93	Very high	88.2	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	103.3	175.5	179.1	0	0	0	0	109	L49 C148 L149 L183 K237 G238 V239	L49-V167 HydrophobicContact CD2-CG2 4.44Å; C148-V167 CarbonylContact C-O 3.54Å; C148-V167 VanDerWaalsContact CA-O 3.31Å; C148-V167 WeakPolarHBondContact CA-O 3.36Å; C148-V167 VanDerWaalsContact CB-O 3.28Å; C148-V167 WeakPolarHBondContact CB-O 3.46Å; L149-V167 HydrophobicContact CB-CB 4.29Å; L149-V167 PolarHBondContact N-O 3.43Å; V167-L183 HydrophobicContact CG1-CD1 3.96Å; V167-K237 HydrophobicContact CG1-CD 4.35Å; V167-K237 HydrophobicContact CG1-CG 3.83Å; V167-G238 CarbonylContact C-O 3.22Å; V167-G238 WeakPolarHBondContact CA-O 3.29Å; V167-V239 HydrophobicContact CG2-CG2 4.48Å
168	V	93.3	Very high	88.3	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	139	-178.6	171.9	0	0	0	0	110.4	C148 L162 L170 P177 L180 K237 G238 V240	C148-V168 HydrophobicContact CB-CG2 4.04Å; L162-V168 HydrophobicContact CD1-CG2 4.22Å; L162-V168 HydrophobicContact CD2-CG2 3.81Å; V168-L170 HydrophobicContact CG1-CD2 4.07Å; V168-P177 HydrophobicContact CG1-CG 3.9Å; V168-P177 HydrophobicContact CG2-CG 4.33Å; V168-L180 HydrophobicContact CB-CD1 3.84Å; V168-L180 HydrophobicContact CB-CD2 4.03Å; V168-L180 HydrophobicContact CG1-CD1 3.88Å; V168-L180 HydrophobicContact CG2-CD2 4.06Å; V168-K237 WeakPolarHBondContact O-CA 3.22Å; V168-G238 PolarHBondContact N-O 2.95Å; V168-G238 PolarHBondContact O-N 3.23Å; V168-V240 HydrophobicContact CG2-CG2 3.73Å
169	L	92.2	Very high	88.6	Confident	56 Å²	56	30.8 Å²	30.8	29%	0.293	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.2	171	-164.1	71.2	0	0	0	109.3	T147 K237	T147-L169 PolarHBondContact O-N 3.4Å; T147-L169 VanDerWaalsContact O-N 3.12Å; L169-K237 HydrophobicContact CD1-CB 4.14Å; L169-K237 HydrophobicContact CD1-CG 4.26Å
170	L	91.8	Very high	89	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.2	-178.7	-68.2	-176.8	0	0	0	110.7	V168 V176 L180 A225 V231 K235 G236	V168-L170 HydrophobicContact CG1-CD2 4.07Å; L170-V176 HydrophobicContact CD1-CG2 4Å; L170-V176 HydrophobicContact CD2-CG2 4.12Å; L170-L180 HydrophobicContact CD1-CD1 3.9Å; L170-L180 HydrophobicContact CD2-CD1 4.28Å; L170-L180 HydrophobicContact CG-CD1 4.07Å; L170-A225 HydrophobicContact CD1-CB 4.25Å; L170-V231 HydrophobicContact CB-CG2 4.17Å; L170-V231 HydrophobicContact CD1-CG2 4.25Å; L170-V231 HydrophobicContact CD2-CG2 4.39Å; L170-K235 WeakPolarHBondContact O-CA 3.38Å; L170-G236 PolarHBondContact N-O 3.34Å; L170-G236 PolarHBondContact O-N 2.58Å
171	T	88.6	Confident	89.4	Confident	51 Å²	51	25.7 Å²	25.7	31%	0.313	14%	0.139	S	C	.	.			trans	-126.6	167.4	176.3	72.2	0	0	0	0	111.2	G173 D174 V231	T171-G173 PolarHBondContact O-N 3.1Å; T171-D174 WeakPolarHBondContact CA-OD2 3.46Å; T171-D174 WeakPolarHBondContact CB-OD2 3.34Å; T171-D174 PolarHBondContact N-OD2 3.36Å; T171-D174 WeakPolarHBondContact O-CB 3.4Å; T171-D174 PolarHBondContact O-N 2.82Å; T171-D174 VanDerWaalsContact O-N 3.08Å; T171-D174 PolarHBondContact OG1-OD2 3Å; T171-V231 WeakPolarHBondContact O-CB 3.39Å; T171-V231 WeakPolarHBondContact O-CG1 3.32Å
172	M	85.3	Confident	89.7	Confident	123 Å²	123	23 Å²	23	61%	0.606	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	124.7	-177.2	-57.4	-170.7	-56.9	0	0	111.4	V233 G234	M172-V233 HydrophobicContact SD-CG1 4.46Å; M172-G234 VanDerWaalsContact CG-O 3.27Å; M172-G234 WeakPolarHBondContact CG-O 3.46Å
173	G	80.5	Confident	89.9	Confident	54 Å²	54	24.1 Å²	24.1	56%	0.557	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	99.1	-14.6	-174.6	0	0	0	0	0	114.6	T171 L230 V231	T171-G173 PolarHBondContact O-N 3.1Å; G173-L230 WeakPolarHBondContact O-CD1 3.23Å; G173-V231 PolarHBondContact N-O 3.39Å
174	D	83.7	Confident	89.8	Confident	52 Å²	52	29 Å²	29	28%	0.278	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-69.8	137.1	175.8	-69.8	-43.9	0	0	0	111.4	T171 V231	T171-D174 WeakPolarHBondContact CA-OD2 3.46Å; T171-D174 WeakPolarHBondContact CB-OD2 3.34Å; T171-D174 PolarHBondContact N-OD2 3.36Å; T171-D174 WeakPolarHBondContact O-CB 3.4Å; T171-D174 PolarHBondContact O-N 2.82Å; T171-D174 VanDerWaalsContact O-N 3.08Å; T171-D174 PolarHBondContact OG1-OD2 3Å; D174-V231 PolarHBondContact O-N 2.98Å
175	R	85.1	Confident	89.7	Confident	124 Å²	124	30.3 Å²	30.3	47%	0.468	17%	0.166	S	C	.	.	B	Isolated β-bridge	trans	-83.8	129.4	162	-76.1	-176.3	173.2	-167.5	-3.6	109	P177 T229 L230 D726	R175-P177 WeakPolarHBondContact O-CD 3.43Å; R175-T229 CarbonylContact C-O 3.59Å; R175-T229 WeakPolarHBondContact CA-O 3.16Å; R175-L230 HydrophobicContact CG-CD1 4.11Å; R175-D726 IonicContact CZ-OD2 3.57Å; R175-D726 IonicContact NH1-OD2 3.58Å; R175-D726 PolarHBondContact NH1-OD2 3.43Å; R175-D726 IonicContact NH2-OD1 2.64Å; R175-D726 IonicContact NH2-OD2 3.37Å; R175-D726 PolarHBondContact NH2-OD2 3.18Å
176	V	89.4	Confident	89.7	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.006	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-63.5	118.7	179.5	178.7	0	0	0	0	109	L170 A178 L180 I190 A225 F226 M227 G228 T229 V231	L170-V176 HydrophobicContact CD1-CG2 4Å; L170-V176 HydrophobicContact CD2-CG2 4.12Å; V176-A178 VanDerWaalsContact CG1-O 3.28Å; V176-A178 WeakPolarHBondContact CG1-O 3.21Å; V176-L180 HydrophobicContact CG1-CD1 4.35Å; V176-L180 HydrophobicContact CG1-CG 4.24Å; V176-I190 HydrophobicContact CG2-CD1 4.29Å; V176-A225 HydrophobicContact CG1-CB 4.05Å; V176-A225 HydrophobicContact CG2-CB 4.27Å; V176-F226 VanDerWaalsContact CB-O 3.31Å; V176-F226 WeakPolarHBondContact CB-O 3.36Å; V176-F226 WeakPolarHBondContact CG1-O 3.41Å; V176-M227 CarbonylContact O-C 3.29Å; V176-M227 WeakPolarHBondContact O-CA 3.44Å; V176-G228 PolarHBondContact O-N 2.98Å; V176-T229 WeakPolarHBondContact CG2-OG1 3.35Å; V176-T229 PolarHBondContact N-O 3.44Å; V176-V231 HydrophobicContact CG2-CG2 4.17Å
177	P	88.8	Confident	89.3	Confident	11 Å²	11	42.5 Å²	42.5	7%	0.071	23%	0.23	C	C	.	.			trans	-92.4	-10.8	-162.1	36.2	-39	0	0	0	114.8	N68 C146 A159 L162 V168 R175	N68-P177 PolarHBondContact ND2-O 3Å; C146-P177 HydrophobicContact CB-CB 3.77Å; C146-P177 HydrophobicContact CB-CG 3.82Å; A159-P177 HydrophobicContact CB-CB 4.04Å; L162-P177 HydrophobicContact CD1-CB 3.6Å; L162-P177 HydrophobicContact CD1-CG 3.51Å; V168-P177 HydrophobicContact CG1-CG 3.9Å; V168-P177 HydrophobicContact CG2-CG 4.33Å; R175-P177 WeakPolarHBondContact O-CD 3.43Å
178	A	89.2	Confident	89	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-159.5	168.2	175.7	0	0	0	0	0	108	L162 V176 L180 V240 T243	L162-A178 HydrophobicContact CD1-CB 4.37Å; V176-A178 VanDerWaalsContact CG1-O 3.28Å; V176-A178 WeakPolarHBondContact CG1-O 3.21Å; A178-L180 HydrophobicContact CB-CD2 4.49Å; A178-L180 WeakPolarHBondContact O-CG 3.47Å; A178-L180 PolarHBondContact O-N 2.83Å; A178-V240 HydrophobicContact CB-CG1 3.71Å; A178-V240 HydrophobicContact CB-CG2 4.31Å; A178-T243 HydrophobicContact CB-CG2 4.18Å
179	D	91.3	Very high	88.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	126.1	175.2	-76.8	-1	0	0	0	109.4	F226 M227 I241 S242 S247 E248	D179-F226 WeakPolarHBondContact OD1-CA 3.4Å; D179-M227 PolarHBondContact OD1-N 2.97Å; D179-I241 HydrophobicContact CB-CD1 4.32Å; D179-I241 HydrophobicContact CB-CG1 3.98Å; D179-I241 WeakPolarHBondContact O-CG1 3.25Å; D179-I241 PolarHBondContact O-N 3.19Å; D179-S242 PolarHBondContact N-O 3.43Å; D179-S242 VanDerWaalsContact N-O 3.15Å; D179-S247 VanDerWaalsContact CG-CB 3.46Å; D179-S247 WeakPolarHBondContact OD2-CA 3.19Å; D179-S247 WeakPolarHBondContact OD2-CB 3.4Å; D179-E248 PolarHBondContact OD2-N 3.25Å
180	L	93.1	Very high	88.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	135.1	-175.8	-47.2	-176.8	0	0	0	111.9	V168 L170 V176 A178 I224 A225 V239 V240	V168-L180 HydrophobicContact CB-CD1 3.84Å; V168-L180 HydrophobicContact CB-CD2 4.03Å; V168-L180 HydrophobicContact CG1-CD1 3.88Å; V168-L180 HydrophobicContact CG2-CD2 4.06Å; L170-L180 HydrophobicContact CD1-CD1 3.9Å; L170-L180 HydrophobicContact CD2-CD1 4.28Å; L170-L180 HydrophobicContact CG-CD1 4.07Å; V176-L180 HydrophobicContact CG1-CD1 4.35Å; V176-L180 HydrophobicContact CG1-CG 4.24Å; A178-L180 HydrophobicContact CB-CD2 4.49Å; A178-L180 WeakPolarHBondContact O-CG 3.47Å; A178-L180 PolarHBondContact O-N 2.83Å; L180-I224 VanDerWaalsContact O-CA 3.31Å; L180-I224 WeakPolarHBondContact O-CA 3.2Å; L180-A225 HydrophobicContact CB-CB 4.43Å; L180-A225 PolarHBondContact N-O 3Å; L180-A225 PolarHBondContact O-N 2.97Å; L180-V239 CarbonylContact C-O 3.6Å; L180-V239 WeakPolarHBondContact CA-O 3.15Å; L180-V240 HydrophobicContact CD2-CB 4.18Å; L180-V240 HydrophobicContact CD2-CG2 3.57Å
181	R	93.9	Very high	88.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	119.7	157.8	174.7	63.7	166.4	93.2	-4.5	108.1	A33 L36 V41 A206 I224 G238 V239 I241	A33-R181 HydrophobicContact CB-CB 4.47Å; A33-R181 WeakPolarHBondContact O-CD 3.2Å; A33-R181 PolarHBondContact O-NE 3.09Å; A33-R181 VanDerWaalsContact O-NE 3.07Å; L36-R181 PolarHBondContact O-NE 2.69Å; L36-R181 PolarHBondContact O-NH2 2.93Å; V41-R181 HydrophobicContact CG1-CB 4.34Å; V41-R181 HydrophobicContact CG1-CG 4.46Å; V41-R181 HydrophobicContact CG2-CG 4.26Å; R181-A206 PolarHBondContact NH1-O 2.91Å; R181-A206 PolarHBondContact NH2-O 3.01Å; R181-I224 HydrophobicContact CB-CD1 4.29Å; R181-G238 CarbonylContact O-C 3.58Å; R181-G238 WeakPolarHBondContact O-CA 3.26Å; R181-V239 HydrophobicContact CB-CG1 4.06Å; R181-V239 PolarHBondContact N-O 3.17Å; R181-V239 PolarHBondContact O-N 2.81Å; R181-I241 HydrophobicContact CB-CG2 3.75Å
182	L	93.9	Very high	87.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	132.6	-179.7	-65.4	169.9	0	0	0	110.8	L188 K204 N223 A225	L182-L188 HydrophobicContact CD1-CD2 3.82Å; L182-L188 HydrophobicContact CD2-CD2 3.72Å; L182-L188 HydrophobicContact CG-CD2 4.44Å; L182-K204 HydrophobicContact CD1-CB 3.62Å; L182-K204 HydrophobicContact CD1-CD 4.43Å; L182-K204 HydrophobicContact CD1-CG 4.12Å; L182-N223 PolarHBondContact N-O 3.47Å; L182-A225 HydrophobicContact CD2-CB 4.18Å; L182-A225 HydrophobicContact CG-CB 4.46Å
183	L	91.3	Very high	87.1	Confident	25 Å²	25	35.3 Å²	35.3	13%	0.131	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-44.1	175.4	-49.7	173.9	0	0	0	109.8	A38 L49 V167 A206 K237 V239	A38-L183 HydrophobicContact CB-CD2 3.83Å; L49-L183 HydrophobicContact CB-CD1 4.38Å; L49-L183 HydrophobicContact CD1-CD2 3.96Å; L49-L183 HydrophobicContact CD2-CD1 3.81Å; L49-L183 HydrophobicContact CD2-CD2 3.8Å; L49-L183 HydrophobicContact CD2-CG 4.47Å; L49-L183 HydrophobicContact CG-CD2 4.46Å; V167-L183 HydrophobicContact CG1-CD1 3.96Å; L183-A206 WeakPolarHBondContact O-CB 3.33Å; L183-K237 WeakPolarHBondContact CB-O 3.43Å; L183-K237 HydrophobicContact CD1-CG 4.37Å; L183-K237 PolarHBondContact N-O 3.21Å; L183-V239 HydrophobicContact CD1-CB 4.46Å; L183-V239 HydrophobicContact CD2-CB 4.29Å; L183-V239 HydrophobicContact CD2-CG1 3.95Å
184	E	89.9	Confident	86.5	Confident	104 Å²	104	33.5 Å²	33.5	49%	0.486	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.5	180	-60.6	161.5	-140.2	0	0	108	G236 K237	E184-G236 WeakPolarHBondContact O-CA 3.3Å; E184-K237 HydrophobicContact CB-CB 4.13Å; E184-K237 PolarHBondContact N-O 2.93Å; E184-K237 PolarHBondContact O-N 3.37Å; E184-K237 WeakPolarHBondContact OE1-CD 3.28Å; E184-K237 IonicContact OE1-NZ 3.49Å; E184-K237 PolarHBondContact OE1-NZ 2.87Å
185	A	89	Confident	85.8	Confident	30 Å²	30	31.8 Å²	31.8	25%	0.248	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	106	179.9	0	0	0	0	0	109.6	L188	A185-L188 HydrophobicContact CB-CB 4.03Å; A185-L188 HydrophobicContact CB-CD2 4.13Å
186	V	88	Confident	85.2	Confident	101 Å²	101	27.8 Å²	27.8	61%	0.612	15%	0.152	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	104.8	179.7	-178.4	0	0	0	0	108	L188 G234 K235	V186-L188 PolarHBondContact O-N 3.47Å; V186-G234 CarbonylContact O-C 3.55Å; V186-G234 WeakPolarHBondContact O-CA 3.25Å; V186-K235 PolarHBondContact N-O 2.91Å; V186-K235 PolarHBondContact O-N 3.42Å
187	E	83.2	Confident	84	Confident	154 Å²	154	28.8 Å²	28.8	72%	0.72	16%	0.163	S	C	*	.	E	Extended strand (participates in β ladder)	trans	52.6	20.4	-175.9	-55.1	-165.2	137.1	0	0	115.2	Q189	E187-Q189 PolarHBondContact O-N 3.36Å; E187-Q189 VanDerWaalsContact O-N 3.14Å
188	L	87.3	Confident	82.9	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	114.6	-169.8	-175	63.8	0	0	0	111.3	L182 A185 V186 I190 K204 V231 V233	L182-L188 HydrophobicContact CD1-CD2 3.82Å; L182-L188 HydrophobicContact CD2-CD2 3.72Å; L182-L188 HydrophobicContact CG-CD2 4.44Å; A185-L188 HydrophobicContact CB-CB 4.03Å; A185-L188 HydrophobicContact CB-CD2 4.13Å; V186-L188 PolarHBondContact O-N 3.47Å; L188-I190 HydrophobicContact CD1-CD1 4.48Å; L188-I190 HydrophobicContact CD1-CG1 4.2Å; L188-I190 HydrophobicContact CD2-CD1 4.2Å; L188-I190 HydrophobicContact CG-CD1 4.26Å; L188-I190 HydrophobicContact CG-CG1 4.08Å; L188-K204 HydrophobicContact CB-CB 4.3Å; L188-K204 HydrophobicContact CD2-CB 4.06Å; L188-K204 HydrophobicContact CG-CB 4.17Å; L188-K204 PolarHBondContact O-N 3.39Å; L188-V231 HydrophobicContact CD1-CG1 3.7Å; L188-V233 WeakPolarHBondContact CA-O 3.19Å
189	Q	88.8	Confident	81.8	Confident	32 Å²	32	35.8 Å²	35.8	15%	0.15	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	120.2	174.5	-70.9	169.8	73.4	0	0	109.1	E187 P201 A202 K203 R232 V233	E187-Q189 PolarHBondContact O-N 3.36Å; E187-Q189 VanDerWaalsContact O-N 3.14Å; Q189-P201 HydrophobicContact CB-CB 4.01Å; Q189-A202 WeakPolarHBondContact CA-O 3.49Å; Q189-K203 HydrophobicContact CG-CG 3.97Å; Q189-R232 PolarHBondContact O-N 2.65Å; Q189-V233 HydrophobicContact CB-CB 4.1Å; Q189-V233 PolarHBondContact N-O 3.34Å; Q189-V233 PolarHBondContact O-N 3.12Å
190	I	87.8	Confident	80.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.1	-176.3	-58.9	-172.6	0	0	0	108.9	V176 L188 E192 P201 A202 K204 A225 T229 V231	V176-I190 HydrophobicContact CG2-CD1 4.29Å; L188-I190 HydrophobicContact CD1-CD1 4.48Å; L188-I190 HydrophobicContact CD1-CG1 4.2Å; L188-I190 HydrophobicContact CD2-CD1 4.2Å; L188-I190 HydrophobicContact CG-CD1 4.26Å; L188-I190 HydrophobicContact CG-CG1 4.08Å; I190-E192 HydrophobicContact CB-CG 4.31Å; I190-E192 HydrophobicContact CG2-CG 3.95Å; I190-E192 PolarHBondContact O-N 3.35Å; I190-P201 CarbonylContact O-C 3.49Å; I190-P201 WeakPolarHBondContact O-CA 3.07Å; I190-A202 PolarHBondContact N-O 3.39Å; I190-A202 VanDerWaalsContact N-O 3.1Å; I190-A202 PolarHBondContact O-N 3.46Å; I190-K204 HydrophobicContact CB-CG 4.42Å; I190-K204 HydrophobicContact CD1-CG 3.99Å; I190-K204 HydrophobicContact CG1-CG 4.02Å; I190-A225 HydrophobicContact CD1-CB 3.5Å; I190-T229 HydrophobicContact CG2-CG2 4.45Å; I190-T229 WeakPolarHBondContact CG2-OG1 3.34Å; I190-V231 HydrophobicContact CG1-CG2 4.42Å
191	D	82.1	Confident	80.2	Confident	17 Å²	17	40.5 Å²	40.5	9%	0.091	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	99.4	172.6	-169.4	-17	0	0	0	109.8	S193 T229 L230 R232	D191-S193 WeakPolarHBondContact OD1-CB 3.17Å; D191-S193 PolarHBondContact OD1-N 3.4Å; D191-S193 PolarHBondContact OD1-OG 3.26Å; D191-T229 WeakPolarHBondContact O-CB 3.25Å; D191-L230 HydrophobicContact CB-CB 4.26Å; D191-L230 WeakPolarHBondContact CB-O 3.41Å; D191-L230 PolarHBondContact N-O 3.06Å; D191-L230 PolarHBondContact O-N 3.37Å; D191-R232 HydrophobicContact CB-CG 3.68Å; D191-R232 IonicContact OD2-CZ 2.66Å; D191-R232 IonicContact OD2-NE 3.78Å; D191-R232 PolarHBondContact OD2-NE 3.49Å; D191-R232 IonicContact OD2-NH2 3.6Å; D191-R232 PolarHBondContact OD2-NH2 3.06Å
192	E	81.5	Confident	79.8	Confident	5 Å²	5	41.8 Å²	41.8	2%	0.023	23%	0.232	C	C	.	.			trans	-98	5.3	179.5	-49.7	-160.4	127.2	0	0	112.1	I190 S194 L195 T196 A202 K204 F226 T229	I190-E192 HydrophobicContact CB-CG 4.31Å; I190-E192 HydrophobicContact CG2-CG 3.95Å; I190-E192 PolarHBondContact O-N 3.35Å; E192-S194 PolarHBondContact O-N 3.03Å; E192-S194 VanDerWaalsContact O-N 3.1Å; E192-L195 PolarHBondContact O-N 3.05Å; E192-T196 HydrophobicContact CB-CG2 4.19Å; E192-T196 PolarHBondContact O-N 3.25Å; E192-T196 PolarHBondContact O-OG1 3.14Å; E192-A202 HydrophobicContact CG-CB 3.98Å; E192-A202 WeakPolarHBondContact OE2-CB 3.4Å; E192-K204 VanDerWaalsContact CD-CE 3.41Å; E192-K204 WeakPolarHBondContact OE1-CE 3.36Å; E192-K204 IonicContact OE1-NZ 2.69Å; E192-K204 PolarHBondContact OE1-NZ 3.27Å; E192-K204 WeakPolarHBondContact OE2-CE 3.41Å; E192-K204 IonicContact OE2-NZ 2.73Å; E192-K204 PolarHBondContact OE2-NZ 2.95Å; E192-F226 VanDerWaalsContact OE1-CD2 3.25Å; E192-F226 WeakPolarHBondContact OE1-CD2 3.31Å; E192-T229 HydrophobicContact CB-CG2 4.36Å; E192-T229 HydrophobicContact CG-CG2 4.17Å
193	S	70.6	Confident	79.4	Confident	31 Å²	31	46.9 Å²	46.9	22%	0.217	25%	0.254	C	S	.	.	H	α-helix	trans	-50.9	-37.9	-179.8	61.7	0	0	0	0	112.4	D191 L195 G197 E198	D191-S193 WeakPolarHBondContact OD1-CB 3.17Å; D191-S193 PolarHBondContact OD1-N 3.4Å; D191-S193 PolarHBondContact OD1-OG 3.26Å; S193-L195 PolarHBondContact O-N 3.02Å; S193-G197 VanDerWaalsContact O-CA 3.26Å; S193-G197 WeakPolarHBondContact O-CA 3.44Å; S193-G197 PolarHBondContact O-N 2.94Å; S193-E198 WeakPolarHBondContact CA-O 3.03Å; S193-E198 WeakPolarHBondContact CB-O 3.5Å
194	S	68.2	Low	79.3	Confident	15 Å²	15	46.4 Å²	46.4	11%	0.105	25%	0.251	C	S	.	.	H	α-helix	trans	-51.1	-49.3	171.9	54.9	0	0	0	0	113	E192 V705	E192-S194 PolarHBondContact O-N 3.03Å; E192-S194 VanDerWaalsContact O-N 3.1Å; S194-V705 WeakPolarHBondContact O-CA 3.47Å; S194-V705 WeakPolarHBondContact O-CB 3.25Å; S194-V705 VanDerWaalsContact O-CG2 3.24Å; S194-V705 WeakPolarHBondContact O-CG2 3.32Å; S194-V705 PolarHBondContact O-N 3.47Å
195	L	70.6	Confident	79.3	Confident	17 Å²	17	43.8 Å²	43.8	9%	0.089	24%	0.244	C	C	.	.	H	α-helix	trans	-90.9	-29.7	-174.5	-172	59.2	0	0	0	113.4	E192 S193 V218 F226 V252	E192-L195 PolarHBondContact O-N 3.05Å; S193-L195 PolarHBondContact O-N 3.02Å; L195-V218 HydrophobicContact CD2-CG1 3.81Å; L195-V218 HydrophobicContact CG-CG1 4.31Å; L195-F226 HydrophobicContact CD2-CB 3.74Å; L195-F226 HydrophobicContact CD2-CD1 4.33Å; L195-F226 HydrophobicContact CD2-CD2 4.02Å; L195-F226 HydrophobicContact CD2-CG 3.77Å; L195-V252 HydrophobicContact CD1-CG2 4.41Å
196	T	71.5	Confident	79.2	Confident	39 Å²	39	43.8 Å²	43.8	24%	0.239	24%	0.244	C	C	.	.	H	α-helix	trans	-107.2	-28.8	-173.1	63	0	0	0	0	114.3	E192 E198	E192-T196 HydrophobicContact CB-CG2 4.19Å; E192-T196 PolarHBondContact O-N 3.25Å; E192-T196 PolarHBondContact O-OG1 3.14Å; T196-E198 VanDerWaalsContact C-N 3.3Å; T196-E198 WeakPolarHBondContact OG1-CB 3.48Å; T196-E198 PolarHBondContact OG1-N 3.3Å
197	G	63.1	Low	79.1	Confident	22 Å²	22	43.2 Å²	43.2	23%	0.227	24%	0.243	C	C	.	.			trans	82.4	-2	-165	0	0	0	0	0	114.7	S193	S193-G197 VanDerWaalsContact O-CA 3.26Å; S193-G197 WeakPolarHBondContact O-CA 3.44Å; S193-G197 PolarHBondContact O-N 2.94Å
198	E	67.6	Low	79.1	Confident	120 Å²	120	39.5 Å²	39.5	56%	0.561	23%	0.228	S	C	*	.			trans	-80.5	129.8	-179.5	-64.3	-70.9	-179.1	0	0	111.3	S193 T196	S193-E198 WeakPolarHBondContact CA-O 3.03Å; S193-E198 WeakPolarHBondContact CB-O 3.5Å; T196-E198 VanDerWaalsContact C-N 3.3Å; T196-E198 WeakPolarHBondContact OG1-CB 3.48Å; T196-E198 PolarHBondContact OG1-N 3.3Å
199	T	65.7	Low	78.7	Confident	38 Å²	38	41.3 Å²	41.3	23%	0.233	24%	0.237	C	C	.	.			trans	-90.1	-12.2	-169.6	68	0	0	0	0	114.1	T360 N366	T199-T360 HydrophobicContact CG2-CG2 3.53Å; T199-N366 WeakPolarHBondContact CB-OD1 3.33Å; T199-N366 WeakPolarHBondContact CG2-OD1 3.28Å
200	E	70.4	Confident	77.4	Confident	78 Å²	78	44.9 Å²	44.9	36%	0.364	27%	0.266	S	S	.	.	S	Bend	trans	-89.9	127.6	173.9	-64.6	-164.2	155.1	0	0	111.1	A202 R549	E200-A202 PolarHBondContact O-N 2.73Å; E200-R549 IonicContact OE1-CZ 2.68Å; E200-R549 IonicContact OE1-NH1 2.65Å; E200-R549 PolarHBondContact OE1-NH1 3.49Å; E200-R549 IonicContact OE1-NH2 3.68Å; E200-R549 PolarHBondContact OE1-NH2 3.2Å; E200-R549 IonicContact OE2-NH2 3.64Å
201	P	79.4	Confident	75.8	Confident	21 Å²	21	50 Å²	50	14%	0.136	30%	0.3	C	S	.	.			trans	-56.1	125.8	175.5	-28.4	36.7	0	0	0	112.7	Q189 I190 K203 R232	Q189-P201 HydrophobicContact CB-CB 4.01Å; I190-P201 CarbonylContact O-C 3.49Å; I190-P201 WeakPolarHBondContact O-CA 3.07Å; P201-K203 PolarHBondContact O-N 3.48Å; P201-R232 HydrophobicContact CG-CG 4.27Å
202	A	85.1	Confident	74.3	Confident	28 Å²	28	53.1 Å²	53.1	23%	0.231	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	115.7	-177.1	0	0	0	0	0	110.7	Q189 I190 E192 E200 K204	Q189-A202 WeakPolarHBondContact CA-O 3.49Å; I190-A202 PolarHBondContact N-O 3.39Å; I190-A202 VanDerWaalsContact N-O 3.1Å; I190-A202 PolarHBondContact O-N 3.46Å; E192-A202 HydrophobicContact CG-CB 3.98Å; E192-A202 WeakPolarHBondContact OE2-CB 3.4Å; E200-A202 PolarHBondContact O-N 2.73Å; A202-K204 PolarHBondContact O-N 3.04Å
203	K	87.4	Confident	72.8	Confident	106 Å²	106	61.6 Å²	61.6	46%	0.461	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	118.4	169.5	-67.6	-173	179.1	-172.4	0	109.8	Q189 P201 F481	Q189-K203 HydrophobicContact CG-CG 3.97Å; P201-K203 PolarHBondContact O-N 3.48Å; K203-F481 PolarHBondContact NZ-O 3.03Å
204	K	89	Confident	71.9	Confident	16 Å²	16	64.3 Å²	64.3	7%	0.07	38%	0.375	C	S	.	.			trans	-101.4	158.2	-179.8	-62.4	-63.7	-177.9	170.6	0	112.3	L182 L188 I190 E192 A202 L221 K222 I224	L182-K204 HydrophobicContact CD1-CB 3.62Å; L182-K204 HydrophobicContact CD1-CD 4.43Å; L182-K204 HydrophobicContact CD1-CG 4.12Å; L188-K204 HydrophobicContact CB-CB 4.3Å; L188-K204 HydrophobicContact CD2-CB 4.06Å; L188-K204 HydrophobicContact CG-CB 4.17Å; L188-K204 PolarHBondContact O-N 3.39Å; I190-K204 HydrophobicContact CB-CG 4.42Å; I190-K204 HydrophobicContact CD1-CG 3.99Å; I190-K204 HydrophobicContact CG1-CG 4.02Å; E192-K204 VanDerWaalsContact CD-CE 3.41Å; E192-K204 WeakPolarHBondContact OE1-CE 3.36Å; E192-K204 IonicContact OE1-NZ 2.69Å; E192-K204 PolarHBondContact OE1-NZ 3.27Å; E192-K204 WeakPolarHBondContact OE2-CE 3.41Å; E192-K204 IonicContact OE2-NZ 2.73Å; E192-K204 PolarHBondContact OE2-NZ 2.95Å; A202-K204 PolarHBondContact O-N 3.04Å; K204-L221 PolarHBondContact NZ-O 2.68Å; K204-K222 CarbonylContact C-O 3.58Å; K204-K222 VanDerWaalsContact CA-O 3.23Å; K204-K222 WeakPolarHBondContact CA-O 3.29Å; K204-K222 WeakPolarHBondContact CB-O 3.36Å; K204-K222 VanDerWaalsContact CD-O 3.23Å; K204-K222 WeakPolarHBondContact CD-O 3.28Å; K204-I224 WeakPolarHBondContact CD-O 3.45Å; K204-I224 VanDerWaalsContact CE-O 3.26Å; K204-I224 WeakPolarHBondContact CE-O 3.1Å; K204-I224 PolarHBondContact NZ-O 3.46Å
205	S	88.1	Confident	71.3	Confident	49 Å²	49	64.9 Å²	64.9	34%	0.343	38%	0.376	S	S	.	.			trans	-152.1	150.1	179	174.4	0	0	0	0	110.8	C207 K222 N223	S205-C207 VanDerWaalsContact C-N 3.29Å; S205-C207 PolarHBondContact O-N 3.28Å; S205-C207 PolarHBondContact OG-N 3.43Å; S205-C207 PolarHBondContact OG-SG 3.06Å; S205-C207 VanDerWaalsContact OG-SG 3.39Å; S205-K222 PolarHBondContact N-O 3.3Å; S205-N223 WeakPolarHBondContact O-CA 3.3Å; S205-N223 WeakPolarHBondContact O-CB 3.13Å
206	A	88.2	Confident	70.6	Confident	29 Å²	29	72.1 Å²	72.1	24%	0.24	41%	0.407	C	S	.	.	S	Bend	trans	-76.5	-11.4	176.5	0	0	0	0	0	114.2	R181 L183	R181-A206 PolarHBondContact NH1-O 2.91Å; R181-A206 PolarHBondContact NH2-O 3.01Å; L183-A206 WeakPolarHBondContact O-CB 3.33Å
207	C	85.4	Confident	70.4	Confident	90 Å²	90	73.8 Å²	73.8	61%	0.608	42%	0.418	S	S	*	.	S	Bend	trans	-59.2	151.4	-175.4	-62.8	0	0	0	0	113.6	S205 N223	S205-C207 VanDerWaalsContact C-N 3.29Å; S205-C207 PolarHBondContact O-N 3.28Å; S205-C207 PolarHBondContact OG-N 3.43Å; S205-C207 PolarHBondContact OG-SG 3.06Å; S205-C207 VanDerWaalsContact OG-SG 3.39Å; C207-N223 WeakPolarHBondContact O-CB 3.49Å; C207-N223 PolarHBondContact O-ND2 3.45Å
208	I	84	Confident	70.9	Confident	76 Å²	76	74.9 Å²	74.9	39%	0.39	42%	0.42	S	S	.	.			trans	-70.2	139.9	174.7	-55.1	171.3	0	0	0	109.8	R35 D37	R35-I208 WeakPolarHBondContact O-CG2 3.25Å; D37-I208 HydrophobicContact CB-CD1 3.7Å; D37-I208 HydrophobicContact CB-CG1 4.33Å
209	I	79.1	Confident	71.2	Confident	39 Å²	39	71.5 Å²	71.5	20%	0.2	41%	0.409	C	S	.	.			trans	-97.4	93.9	176.8	-61.2	173.4	0	0	0	109.1	A34 L215 K222 N223	A34-I209 PolarHBondContact O-N 2.98Å; A34-I209 VanDerWaalsContact O-N 3.15Å; I209-L215 HydrophobicContact CG2-CD1 4.49Å; I209-L215 HydrophobicContact CG2-CD2 4.17Å; I209-K222 HydrophobicContact CD1-CB 4.38Å; I209-N223 HydrophobicContact CD1-CB 4.4Å; I209-N223 WeakPolarHBondContact CD1-OD1 3.4Å
210	S	60.2	Low	71.7	Confident	107 Å²	107	73.9 Å²	73.9	75%	0.748	42%	0.418	S	S	*	.			trans	-107.3	59.6	-172.3	63	0	0	0	0	113.4
211	C	54.7	Low	72.4	Confident	106 Å²	106	70.6 Å²	70.6	72%	0.716	40%	0.403	S	S	*	.			trans	-161.6	154.5	168	-139.2	0	0	0	0	114.9
212	S	51.5	Low	72.8	Confident	83 Å²	83	75.5 Å²	75.5	58%	0.58	42%	0.422	S	S	*	.			trans	65.1	133.5	173.2	-163.5	0	0	0	0	118.4	N214	S212-N214 PolarHBondContact O-N 3.39Å
213	E	49	Very low	73.1	Confident	183 Å²	183	74.2 Å²	74.2	86%	0.855	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-17.3	177.7	-59.6	-178.5	128.7	0	0	113.2	L215	E213-L215 PolarHBondContact O-N 3.06Å
214	N	51.1	Low	73.3	Confident	88 Å²	88	69.2 Å²	69.2	47%	0.471	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	40.3	-176.5	-77.6	-72	0	0	0	114	S212 K216	S212-N214 PolarHBondContact O-N 3.39Å; N214-K216 PolarHBondContact O-N 3.39Å; N214-K216 WeakPolarHBondContact OD1-CE 3.1Å; N214-K216 PolarHBondContact OD1-NZ 3.15Å
215	L	56	Low	73.4	Confident	27 Å²	27	68.4 Å²	68.4	14%	0.141	39%	0.386	C	S	.	.			trans	-66.8	71.8	164	-78.8	166.2	0	0	0	110.6	R35 I209 E213 Q220 L221	R35-L215 HydrophobicContact CG-CD1 4.37Å; I209-L215 HydrophobicContact CG2-CD1 4.49Å; I209-L215 HydrophobicContact CG2-CD2 4.17Å; E213-L215 PolarHBondContact O-N 3.06Å; L215-Q220 HydrophobicContact CD2-CB 4.2Å; L215-L221 HydrophobicContact CD2-CD2 4.12Å
216	K	56.8	Low	73.5	Confident	169 Å²	169	66.1 Å²	66.1	74%	0.735	37%	0.37	S	S	*	.			trans	-107.6	-18.5	-177.4	-72.5	173.7	174.5	162.5	0	113.5	N214	N214-K216 PolarHBondContact O-N 3.39Å; N214-K216 WeakPolarHBondContact OD1-CE 3.1Å; N214-K216 PolarHBondContact OD1-NZ 3.15Å
217	T	66	Low	73.3	Confident	75 Å²	75	65.5 Å²	65.5	46%	0.46	36%	0.362	S	S	.	.			trans	-107.3	123.2	-172.5	-45.4	0	0	0	0	110.8	S219 Q220	T217-S219 VanDerWaalsContact C-N 3.25Å; T217-S219 WeakPolarHBondContact CG2-OG 3.28Å; T217-S219 PolarHBondContact O-N 3.1Å; T217-Q220 WeakPolarHBondContact O-CB 3.39Å; T217-Q220 PolarHBondContact O-N 2.91Å
218	V	74.9	Confident	73	Confident	44 Å²	44	62.5 Å²	62.5	27%	0.267	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-50.3	-42.1	-176.4	179	0	0	0	0	112.7	L195 Q220 L221 F226	L195-V218 HydrophobicContact CD2-CG1 3.81Å; L195-V218 HydrophobicContact CG-CG1 4.31Å; V218-Q220 PolarHBondContact O-N 3.37Å; V218-L221 WeakPolarHBondContact O-CB 3.23Å; V218-L221 PolarHBondContact O-N 3.38Å; V218-F226 HydrophobicContact CG1-CD2 3.93Å; V218-F226 HydrophobicContact CG1-CE1 4.03Å; V218-F226 HydrophobicContact CG1-CE2 3.39Å; V218-F226 HydrophobicContact CG1-CG 4.47Å; V218-F226 HydrophobicContact CG1-CZ 3.44Å; V218-F226 VanDerWaalsContact CG1-CZ 3.44Å
219	S	73	Confident	73	Confident	50 Å²	50	58.9 Å²	58.9	35%	0.35	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-62.6	-13.1	179.9	56.4	0	0	0	0	115.3	T217	T217-S219 VanDerWaalsContact C-N 3.25Å; T217-S219 WeakPolarHBondContact CG2-OG 3.28Å; T217-S219 PolarHBondContact O-N 3.1Å
220	Q	77.3	Confident	73.3	Confident	87 Å²	87	59.6 Å²	59.6	41%	0.407	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-80.2	-19.5	175.1	-64.1	176.4	-12.9	0	0	112.8	L215 T217 V218 K222	L215-Q220 HydrophobicContact CD2-CB 4.2Å; T217-Q220 WeakPolarHBondContact O-CB 3.39Å; T217-Q220 PolarHBondContact O-N 2.91Å; V218-Q220 PolarHBondContact O-N 3.37Å; Q220-K222 VanDerWaalsContact C-N 3.26Å; Q220-K222 PolarHBondContact O-N 2.93Å
221	L	84.6	Confident	74.6	Confident	10 Å²	10	54.5 Å²	54.5	5%	0.052	30%	0.296	C	S	.	.			trans	-82.4	65.2	-173.3	-56.1	-176.7	0	0	0	111.8	P30 A34 K204 L215 V218 N223 I224 F226	P30-L221 HydrophobicContact CB-CD1 4.2Å; A34-L221 HydrophobicContact CB-CD2 3.81Å; K204-L221 PolarHBondContact NZ-O 2.68Å; L215-L221 HydrophobicContact CD2-CD2 4.12Å; V218-L221 WeakPolarHBondContact O-CB 3.23Å; V218-L221 PolarHBondContact O-N 3.38Å; L221-N223 PolarHBondContact O-N 3.28Å; L221-I224 HydrophobicContact CB-CB 4.25Å; L221-I224 HydrophobicContact CB-CG1 4.09Å; L221-I224 PolarHBondContact O-N 2.87Å; L221-I224 VanDerWaalsContact O-N 3.11Å; L221-F226 HydrophobicContact CB-CZ 3.93Å; L221-F226 HydrophobicContact CD1-CE1 4.37Å; L221-F226 HydrophobicContact CD1-CZ 3.97Å; L221-F226 HydrophobicContact CG-CZ 4.45Å
222	K	87.1	Confident	75.9	Confident	124 Å²	124	55.3 Å²	55.3	54%	0.539	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-10.2	-177.3	-65.4	-175.8	179.5	-179.1	0	115.5	K204 S205 I209 Q220	K204-K222 CarbonylContact C-O 3.58Å; K204-K222 VanDerWaalsContact CA-O 3.23Å; K204-K222 WeakPolarHBondContact CA-O 3.29Å; K204-K222 WeakPolarHBondContact CB-O 3.36Å; K204-K222 VanDerWaalsContact CD-O 3.23Å; K204-K222 WeakPolarHBondContact CD-O 3.28Å; S205-K222 PolarHBondContact N-O 3.3Å; I209-K222 HydrophobicContact CD1-CB 4.38Å; Q220-K222 VanDerWaalsContact C-N 3.26Å; Q220-K222 PolarHBondContact O-N 2.93Å
223	N	91.2	Very high	77.5	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	5.1	177.7	66.7	-1.1	0	0	0	114.6	A34 L182 S205 C207 I209 L221	A34-N223 VanDerWaalsContact CA-OD1 3.29Å; A34-N223 WeakPolarHBondContact CA-OD1 3.44Å; A34-N223 WeakPolarHBondContact CB-OD1 3.23Å; A34-N223 PolarHBondContact O-ND2 3.31Å; L182-N223 PolarHBondContact N-O 3.47Å; S205-N223 WeakPolarHBondContact O-CA 3.3Å; S205-N223 WeakPolarHBondContact O-CB 3.13Å; C207-N223 WeakPolarHBondContact O-CB 3.49Å; C207-N223 PolarHBondContact O-ND2 3.45Å; I209-N223 HydrophobicContact CD1-CB 4.4Å; I209-N223 WeakPolarHBondContact CD1-OD1 3.4Å; L221-N223 PolarHBondContact O-N 3.28Å
224	I	92.2	Very high	79.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	142.7	168.5	-54.3	-56.1	0	0	0	108.9	P30 A33 A34 L180 R181 K204 L221 F226 I241	P30-I224 HydrophobicContact CB-CG1 4.31Å; P30-I224 HydrophobicContact CB-CG2 4.24Å; A33-I224 HydrophobicContact CB-CD1 4.11Å; A34-I224 HydrophobicContact CB-CD1 4.26Å; A34-I224 HydrophobicContact CB-CG1 4.08Å; L180-I224 VanDerWaalsContact O-CA 3.31Å; L180-I224 WeakPolarHBondContact O-CA 3.2Å; R181-I224 HydrophobicContact CB-CD1 4.29Å; K204-I224 WeakPolarHBondContact CD-O 3.45Å; K204-I224 VanDerWaalsContact CE-O 3.26Å; K204-I224 WeakPolarHBondContact CE-O 3.1Å; K204-I224 PolarHBondContact NZ-O 3.46Å; L221-I224 HydrophobicContact CB-CB 4.25Å; L221-I224 HydrophobicContact CB-CG1 4.09Å; L221-I224 PolarHBondContact O-N 2.87Å; L221-I224 VanDerWaalsContact O-N 3.11Å; I224-F226 HydrophobicContact CB-CE1 4.19Å; I224-F226 HydrophobicContact CB-CZ 4.07Å; I224-F226 HydrophobicContact CG2-CD1 3.81Å; I224-F226 HydrophobicContact CG2-CE1 3.54Å; I224-F226 HydrophobicContact CG2-CE2 4.49Å; I224-F226 HydrophobicContact CG2-CG 4.4Å; I224-F226 HydrophobicContact CG2-CZ 3.91Å; I224-I241 HydrophobicContact CD1-CD1 3.95Å; I224-I241 HydrophobicContact CG2-CD1 4.44Å
225	A	91.6	Very high	80.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.4	162.1	0	0	0	0	0	108.4	L170 V176 L180 L182 I190	L170-A225 HydrophobicContact CD1-CB 4.25Å; V176-A225 HydrophobicContact CG1-CB 4.05Å; V176-A225 HydrophobicContact CG2-CB 4.27Å; L180-A225 HydrophobicContact CB-CB 4.43Å; L180-A225 PolarHBondContact N-O 3Å; L180-A225 PolarHBondContact O-N 2.97Å; L182-A225 HydrophobicContact CD2-CB 4.18Å; L182-A225 HydrophobicContact CG-CB 4.46Å; I190-A225 HydrophobicContact CD1-CB 3.5Å
226	F	89.1	Confident	82.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.			trans	-93.2	144.9	-173.6	-57.7	-75.6	0	0	0	112.7	P30 V176 D179 E192 L195 V218 L221 I224 T229 E248	P30-F226 HydrophobicContact CB-CE1 4.12Å; V176-F226 VanDerWaalsContact CB-O 3.31Å; V176-F226 WeakPolarHBondContact CB-O 3.36Å; V176-F226 WeakPolarHBondContact CG1-O 3.41Å; D179-F226 WeakPolarHBondContact OD1-CA 3.4Å; E192-F226 VanDerWaalsContact OE1-CD2 3.25Å; E192-F226 WeakPolarHBondContact OE1-CD2 3.31Å; L195-F226 HydrophobicContact CD2-CB 3.74Å; L195-F226 HydrophobicContact CD2-CD1 4.33Å; L195-F226 HydrophobicContact CD2-CD2 4.02Å; L195-F226 HydrophobicContact CD2-CG 3.77Å; V218-F226 HydrophobicContact CG1-CD2 3.93Å; V218-F226 HydrophobicContact CG1-CE1 4.03Å; V218-F226 HydrophobicContact CG1-CE2 3.39Å; V218-F226 HydrophobicContact CG1-CG 4.47Å; V218-F226 HydrophobicContact CG1-CZ 3.44Å; V218-F226 VanDerWaalsContact CG1-CZ 3.44Å; L221-F226 HydrophobicContact CB-CZ 3.93Å; L221-F226 HydrophobicContact CD1-CE1 4.37Å; L221-F226 HydrophobicContact CD1-CZ 3.97Å; L221-F226 HydrophobicContact CG-CZ 4.45Å; I224-F226 HydrophobicContact CB-CE1 4.19Å; I224-F226 HydrophobicContact CB-CZ 4.07Å; I224-F226 HydrophobicContact CG2-CD1 3.81Å; I224-F226 HydrophobicContact CG2-CE1 3.54Å; I224-F226 HydrophobicContact CG2-CE2 4.49Å; I224-F226 HydrophobicContact CG2-CG 4.4Å; I224-F226 HydrophobicContact CG2-CZ 3.91Å; F226-T229 HydrophobicContact CB-CG2 4.04Å; F226-T229 WeakPolarHBondContact O-CB 3.49Å; F226-T229 WeakPolarHBondContact O-CG2 3.43Å; F226-T229 PolarHBondContact O-N 3.37Å; F226-T229 PolarHBondContact O-OG1 3.37Å; F226-E248 HydrophobicContact CD1-CB 4.21Å; F226-E248 HydrophobicContact CD1-CG 4.01Å; F226-E248 HydrophobicContact CE1-CG 3.86Å
227	M	84.9	Confident	84.1	Confident	17 Å²	17	40.4 Å²	40.4	8%	0.084	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	138	176.8	-167.4	172.2	75.2	0	0	111.9	F70 V176 D179 T229 S247 F249	F70-M227 HydrophobicContact CE1-CE 3.92Å; F70-M227 HydrophobicContact CE2-CE 4.31Å; F70-M227 HydrophobicContact CZ-CE 3.37Å; V176-M227 CarbonylContact O-C 3.29Å; V176-M227 WeakPolarHBondContact O-CA 3.44Å; D179-M227 PolarHBondContact OD1-N 2.97Å; M227-T229 VanDerWaalsContact C-N 3.29Å; M227-T229 PolarHBondContact O-N 2.9Å; M227-S247 WeakPolarHBondContact CE-OG 3.47Å; M227-F249 HydrophobicContact CB-CB 4.34Å; M227-F249 HydrophobicContact CE-CB 4.16Å; M227-F249 HydrophobicContact CE-CD1 3.99Å; M227-F249 HydrophobicContact CE-CG 4.3Å; M227-F249 WeakPolarHBondContact O-CD2 3.34Å
228	G	79.8	Confident	85.4	Confident	26 Å²	26	36.9 Å²	36.9	27%	0.268	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-13.8	179.6	0	0	0	0	0	115.5	V176	V176-G228 PolarHBondContact O-N 2.98Å
229	T	84	Confident	86.3	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.006	17%	0.174	C	C	.	.			trans	-72.1	158.3	175	64.3	0	0	0	0	112	R175 V176 I190 D191 E192 F226 M227	R175-T229 CarbonylContact C-O 3.59Å; R175-T229 WeakPolarHBondContact CA-O 3.16Å; V176-T229 WeakPolarHBondContact CG2-OG1 3.35Å; V176-T229 PolarHBondContact N-O 3.44Å; I190-T229 HydrophobicContact CG2-CG2 4.45Å; I190-T229 WeakPolarHBondContact CG2-OG1 3.34Å; D191-T229 WeakPolarHBondContact O-CB 3.25Å; E192-T229 HydrophobicContact CB-CG2 4.36Å; E192-T229 HydrophobicContact CG-CG2 4.17Å; F226-T229 HydrophobicContact CB-CG2 4.04Å; F226-T229 WeakPolarHBondContact O-CB 3.49Å; F226-T229 WeakPolarHBondContact O-CG2 3.43Å; F226-T229 PolarHBondContact O-N 3.37Å; F226-T229 PolarHBondContact O-OG1 3.37Å; M227-T229 VanDerWaalsContact C-N 3.29Å; M227-T229 PolarHBondContact O-N 2.9Å
230	L	84.9	Confident	87.3	Confident	53 Å²	53	32.4 Å²	32.4	28%	0.277	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	128.6	-173	177	69.8	0	0	0	111.6	G173 R175 D191 R232	G173-L230 WeakPolarHBondContact O-CD1 3.23Å; R175-L230 HydrophobicContact CG-CD1 4.11Å; D191-L230 HydrophobicContact CB-CB 4.26Å; D191-L230 WeakPolarHBondContact CB-O 3.41Å; D191-L230 PolarHBondContact N-O 3.06Å; D191-L230 PolarHBondContact O-N 3.37Å; L230-R232 PolarHBondContact O-N 2.89Å
231	V	87.3	Confident	88	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.6	176.5	-177.1	0	0	0	0	110.1	L170 T171 G173 D174 V176 L188 I190	L170-V231 HydrophobicContact CB-CG2 4.17Å; L170-V231 HydrophobicContact CD1-CG2 4.25Å; L170-V231 HydrophobicContact CD2-CG2 4.39Å; T171-V231 WeakPolarHBondContact O-CB 3.39Å; T171-V231 WeakPolarHBondContact O-CG1 3.32Å; G173-V231 PolarHBondContact N-O 3.39Å; D174-V231 PolarHBondContact O-N 2.98Å; V176-V231 HydrophobicContact CG2-CG2 4.17Å; L188-V231 HydrophobicContact CD1-CG1 3.7Å; I190-V231 HydrophobicContact CG1-CG2 4.42Å
232	R	82.8	Confident	88.2	Confident	123 Å²	123	27.9 Å²	27.9	46%	0.464	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-43.2	-178.7	-69.3	-73.4	-168	165.2	1.7	112.9	Q189 D191 P201 L230	Q189-R232 PolarHBondContact O-N 2.65Å; D191-R232 HydrophobicContact CB-CG 3.68Å; D191-R232 IonicContact OD2-CZ 2.66Å; D191-R232 IonicContact OD2-NE 3.78Å; D191-R232 PolarHBondContact OD2-NE 3.49Å; D191-R232 IonicContact OD2-NH2 3.6Å; D191-R232 PolarHBondContact OD2-NH2 3.06Å; P201-R232 HydrophobicContact CG-CG 4.27Å; L230-R232 PolarHBondContact O-N 2.89Å
233	V	83.1	Confident	88.2	Confident	41 Å²	41	22.8 Å²	22.8	25%	0.248	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	150.8	-176.5	-171	0	0	0	0	110	M172 L188 Q189	M172-V233 HydrophobicContact SD-CG1 4.46Å; L188-V233 WeakPolarHBondContact CA-O 3.19Å; Q189-V233 HydrophobicContact CB-CB 4.1Å; Q189-V233 PolarHBondContact N-O 3.34Å; Q189-V233 PolarHBondContact O-N 3.12Å
234	G	82.9	Confident	87.5	Confident	13 Å²	13	22.9 Å²	22.9	13%	0.134	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.5	-165.4	171.7	0	0	0	0	0	114.4	M172 V186	M172-G234 VanDerWaalsContact CG-O 3.27Å; M172-G234 WeakPolarHBondContact CG-O 3.46Å; V186-G234 CarbonylContact O-C 3.55Å; V186-G234 WeakPolarHBondContact O-CA 3.25Å
235	K	88	Confident	86.6	Confident	139 Å²	139	26.3 Å²	26.3	60%	0.604	13%	0.133	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.1	175.6	-68.7	-174.3	178.6	-176	0	110.6	L170 V186	L170-K235 WeakPolarHBondContact O-CA 3.38Å; V186-K235 PolarHBondContact N-O 2.91Å; V186-K235 PolarHBondContact O-N 3.42Å
236	G	90.1	Very high	86.1	Confident	4 Å²	4	30.2 Å²	30.2	4%	0.041	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	156.3	178.1	0	0	0	0	0	112.2	L170 E184	L170-G236 PolarHBondContact N-O 3.34Å; L170-G236 PolarHBondContact O-N 2.58Å; E184-G236 WeakPolarHBondContact O-CA 3.3Å
237	K	92.5	Very high	85.7	Confident	40 Å²	40	30.2 Å²	30.2	17%	0.174	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	130.4	168.8	-174.4	-177.6	155.9	-159.3	0	107.2	V167 V168 L169 L183 E184	V167-K237 HydrophobicContact CG1-CD 4.35Å; V167-K237 HydrophobicContact CG1-CG 3.83Å; V168-K237 WeakPolarHBondContact O-CA 3.22Å; L169-K237 HydrophobicContact CD1-CB 4.14Å; L169-K237 HydrophobicContact CD1-CG 4.26Å; L183-K237 WeakPolarHBondContact CB-O 3.43Å; L183-K237 HydrophobicContact CD1-CG 4.37Å; L183-K237 PolarHBondContact N-O 3.21Å; E184-K237 HydrophobicContact CB-CB 4.13Å; E184-K237 PolarHBondContact N-O 2.93Å; E184-K237 PolarHBondContact O-N 3.37Å; E184-K237 WeakPolarHBondContact OE1-CD 3.28Å; E184-K237 IonicContact OE1-NZ 3.49Å; E184-K237 PolarHBondContact OE1-NZ 2.87Å
238	G	92.7	Very high	85.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	146.2	-170.7	0	0	0	0	0	112.8	V167 V168 R181	V167-G238 CarbonylContact C-O 3.22Å; V167-G238 WeakPolarHBondContact CA-O 3.29Å; V168-G238 PolarHBondContact N-O 2.95Å; V168-G238 PolarHBondContact O-N 3.23Å; R181-G238 CarbonylContact O-C 3.58Å; R181-G238 WeakPolarHBondContact O-CA 3.26Å
239	V	93.9	Very high	85.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	132.2	172.5	66	0	0	0	0	110	V41 L45 A47 L49 D166 V167 L180 R181 L183 I241	V41-V239 HydrophobicContact CG1-CG1 3.72Å; L45-V239 HydrophobicContact CD1-CG1 4.21Å; L45-V239 HydrophobicContact CD1-CG2 3.69Å; A47-V239 HydrophobicContact CB-CG2 4.38Å; L49-V239 HydrophobicContact CD2-CB 4.11Å; L49-V239 HydrophobicContact CD2-CG1 4.42Å; L49-V239 HydrophobicContact CD2-CG2 4.31Å; D166-V239 CarbonylContact O-C 3.53Å; D166-V239 WeakPolarHBondContact O-CA 3.11Å; V167-V239 HydrophobicContact CG2-CG2 4.48Å; L180-V239 CarbonylContact C-O 3.6Å; L180-V239 WeakPolarHBondContact CA-O 3.15Å; R181-V239 HydrophobicContact CB-CG1 4.06Å; R181-V239 PolarHBondContact N-O 3.17Å; R181-V239 PolarHBondContact O-N 2.81Å; L183-V239 HydrophobicContact CD1-CB 4.46Å; L183-V239 HydrophobicContact CD2-CB 4.29Å; L183-V239 HydrophobicContact CD2-CG1 3.95Å; V239-I241 PolarHBondContact O-N 2.93Å
240	V	93.4	Very high	84.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	119.4	179.3	-178.3	0	0	0	0	109.6	L45 P164 G165 D166 V168 A178 L180 T243	L45-V240 WeakPolarHBondContact CD1-O 3.36Å; P164-V240 WeakPolarHBondContact CA-O 3.45Å; G165-V240 PolarHBondContact N-O 3.06Å; D166-V240 HydrophobicContact CB-CG2 3.98Å; D166-V240 WeakPolarHBondContact O-CG2 3.42Å; D166-V240 PolarHBondContact O-N 3.14Å; V168-V240 HydrophobicContact CG2-CG2 3.73Å; A178-V240 HydrophobicContact CB-CG1 3.71Å; A178-V240 HydrophobicContact CB-CG2 4.31Å; L180-V240 HydrophobicContact CD2-CB 4.18Å; L180-V240 HydrophobicContact CD2-CG2 3.57Å; V240-T243 HydrophobicContact CG1-CG2 3.61Å
241	I	92.2	Very high	84.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-31.9	178.8	50.9	165	0	0	0	112.7	G27 L28 P30 A33 V41 L45 D179 R181 I224 V239	G27-I241 WeakPolarHBondContact CA-O 3.47Å; L28-I241 HydrophobicContact CB-CB 4.22Å; L28-I241 HydrophobicContact CB-CG2 4.41Å; L28-I241 PolarHBondContact N-O 3.22Å; P30-I241 HydrophobicContact CB-CD1 4.15Å; P30-I241 HydrophobicContact CG-CD1 3.89Å; A33-I241 HydrophobicContact CB-CB 4.46Å; A33-I241 HydrophobicContact CB-CD1 3.74Å; A33-I241 HydrophobicContact CB-CG2 3.9Å; V41-I241 HydrophobicContact CG1-CG2 3.93Å; L45-I241 HydrophobicContact CD1-CG2 4.33Å; D179-I241 HydrophobicContact CB-CD1 4.32Å; D179-I241 HydrophobicContact CB-CG1 3.98Å; D179-I241 WeakPolarHBondContact O-CG1 3.25Å; D179-I241 PolarHBondContact O-N 3.19Å; R181-I241 HydrophobicContact CB-CG2 3.75Å; I224-I241 HydrophobicContact CD1-CD1 3.95Å; I224-I241 HydrophobicContact CG2-CD1 4.44Å; V239-I241 PolarHBondContact O-N 2.93Å
242	S	88.2	Confident	83.5	Confident	3 Å²	3	33.2 Å²	33.2	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	152.6	174.1	63.3	0	0	0	0	112.3	D179 S246 S247	D179-S242 PolarHBondContact N-O 3.43Å; D179-S242 VanDerWaalsContact N-O 3.15Å; S242-S246 WeakPolarHBondContact CB-O 3.37Å; S242-S246 PolarHBondContact OG-O 3.38Å; S242-S247 WeakPolarHBondContact OG-CA 3.26Å
243	T	86.9	Confident	82.8	Confident	16 Å²	16	27.7 Å²	27.7	10%	0.098	15%	0.149	C	C	.	.			trans	-128.5	151.6	-172.1	47.9	0	0	0	0	111.1	N68 P164 A178 V240 H245 S246	N68-T243 HydrophobicContact CB-CG2 4.09Å; N68-T243 VanDerWaalsContact OD1-CA 3.31Å; N68-T243 WeakPolarHBondContact OD1-CA 3.16Å; N68-T243 VanDerWaalsContact OD1-CB 3.24Å; N68-T243 WeakPolarHBondContact OD1-CB 3.32Å; P164-T243 HydrophobicContact CG-CG2 4.18Å; A178-T243 HydrophobicContact CB-CG2 4.18Å; V240-T243 HydrophobicContact CG1-CG2 3.61Å; T243-H245 PolarHBondContact O-N 2.96Å; T243-S246 PolarHBondContact O-N 2.95Å
244	G	77.1	Confident	82.2	Confident	3 Å²	3	27.6 Å²	27.6	3%	0.031	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	48.9	-122.3	174.6	0	0	0	0	0	112.5	N68 S246 S247	N68-G244 PolarHBondContact OD1-N 2.82Å; G244-S246 PolarHBondContact O-N 2.85Å; G244-S246 VanDerWaalsContact O-N 3.1Å; G244-S247 PolarHBondContact O-N 2.81Å; G244-S247 PolarHBondContact O-OG 3.07Å
245	H	73.5	Confident	81.7	Confident	72 Å²	72	31.3 Å²	31.3	33%	0.333	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-59.7	-16.8	-178.9	-73.9	-83.8	0	0	0	115.8	L71 T243	L71-H245 PolarHBondContact N-NE2 3.42Å; T243-H245 PolarHBondContact O-N 2.96Å
246	S	80.5	Confident	81	Confident	83 Å²	83	24.9 Å²	24.9	58%	0.58	14%	0.137	S	C	*	.	G	3₁₀ helix	trans	-97.4	3.9	-178.9	-59.1	0	0	0	0	114.8	S242 T243 G244	S242-S246 WeakPolarHBondContact CB-O 3.37Å; S242-S246 PolarHBondContact OG-O 3.38Å; T243-S246 PolarHBondContact O-N 2.95Å; G244-S246 PolarHBondContact O-N 2.85Å; G244-S246 VanDerWaalsContact O-N 3.1Å
247	S	81.2	Confident	79.9	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-83.8	163.3	171.8	60.3	0	0	0	0	111.6	D179 M227 S242 G244 F249 G250 N251	D179-S247 VanDerWaalsContact CG-CB 3.46Å; D179-S247 WeakPolarHBondContact OD2-CA 3.19Å; D179-S247 WeakPolarHBondContact OD2-CB 3.4Å; M227-S247 WeakPolarHBondContact CE-OG 3.47Å; S242-S247 WeakPolarHBondContact OG-CA 3.26Å; G244-S247 PolarHBondContact O-N 2.81Å; G244-S247 PolarHBondContact O-OG 3.07Å; S247-F249 VanDerWaalsContact C-N 3.27Å; S247-F249 PolarHBondContact O-N 3.36Å; S247-G250 CarbonylContact O-C 3.5Å; S247-G250 WeakPolarHBondContact O-CA 3.29Å; S247-G250 PolarHBondContact O-N 2.95Å; S247-G250 PolarHBondContact OG-N 2.68Å; S247-N251 PolarHBondContact O-N 2.97Å; S247-N251 PolarHBondContact O-ND2 3.17Å
248	E	80.2	Confident	79	Confident	47 Å²	47	31.7 Å²	31.7	22%	0.22	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-36.4	173.9	-63.1	-52.4	163.3	0	0	112.3	P30 D179 F226 G250 N251 V252	P30-E248 HydrophobicContact CB-CG 4.45Å; P30-E248 HydrophobicContact CG-CG 4.03Å; D179-E248 PolarHBondContact OD2-N 3.25Å; F226-E248 HydrophobicContact CD1-CB 4.21Å; F226-E248 HydrophobicContact CD1-CG 4.01Å; F226-E248 HydrophobicContact CE1-CG 3.86Å; E248-G250 VanDerWaalsContact C-N 3.32Å; E248-G250 PolarHBondContact O-N 3.48Å; E248-N251 WeakPolarHBondContact O-CB 3.43Å; E248-N251 PolarHBondContact O-N 3.41Å; E248-N251 PolarHBondContact OE2-ND2 3.19Å; E248-V252 WeakPolarHBondContact O-CG2 3.14Å; E248-V252 PolarHBondContact O-N 2.76Å
249	F	76.2	Confident	78	Confident	25 Å²	25	33.2 Å²	33.2	11%	0.11	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-40.2	172.2	-171.4	-69.6	0	0	0	110.7	F70 M227 S247 V252 F253 V705 V727	F70-F249 HydrophobicContact CE2-CD1 4.26Å; F70-F249 AromaticContact CE2-CE1 3.83Å; F70-F249 HydrophobicContact CE2-CE1 3.83Å; F70-F249 AromaticContact CZ-CD1 3.61Å; F70-F249 HydrophobicContact CZ-CD1 3.61Å; F70-F249 AromaticContact CZ-CE1 3.67Å; F70-F249 HydrophobicContact CZ-CE1 3.67Å; M227-F249 HydrophobicContact CB-CB 4.34Å; M227-F249 HydrophobicContact CE-CB 4.16Å; M227-F249 HydrophobicContact CE-CD1 3.99Å; M227-F249 HydrophobicContact CE-CG 4.3Å; M227-F249 WeakPolarHBondContact O-CD2 3.34Å; S247-F249 VanDerWaalsContact C-N 3.27Å; S247-F249 PolarHBondContact O-N 3.36Å; F249-V252 PolarHBondContact O-N 3.26Å; F249-F253 WeakPolarHBondContact O-CB 3.27Å; F249-F253 PolarHBondContact O-N 3Å; F249-V705 HydrophobicContact CE2-CG2 4.24Å; F249-V727 HydrophobicContact CE1-CG2 3.8Å; F249-V727 HydrophobicContact CE2-CG2 3.76Å; F249-V727 HydrophobicContact CZ-CG2 3.16Å
250	G	72	Confident	76.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-33.1	173.5	0	0	0	0	0	114.1	S247 E248 S254	S247-G250 CarbonylContact O-C 3.5Å; S247-G250 WeakPolarHBondContact O-CA 3.29Å; S247-G250 PolarHBondContact O-N 2.95Å; S247-G250 PolarHBondContact OG-N 2.68Å; E248-G250 VanDerWaalsContact C-N 3.32Å; E248-G250 PolarHBondContact O-N 3.48Å; G250-S254 WeakPolarHBondContact O-CB 3.04Å; G250-S254 PolarHBondContact O-N 3.49Å; G250-S254 PolarHBondContact O-OG 2.88Å
251	N	76.6	Confident	75.8	Confident	56 Å²	56	43.3 Å²	43.3	30%	0.299	23%	0.234	S	C	.	.	H	α-helix	trans	-62.3	-49	170	-69	-30.8	0	0	0	110.1	S247 E248 S254 M255	S247-N251 PolarHBondContact O-N 2.97Å; S247-N251 PolarHBondContact O-ND2 3.17Å; E248-N251 WeakPolarHBondContact O-CB 3.43Å; E248-N251 PolarHBondContact O-N 3.41Å; E248-N251 PolarHBondContact OE2-ND2 3.19Å; N251-S254 PolarHBondContact O-N 3.41Å; N251-S254 PolarHBondContact O-OG 3.02Å; N251-M255 VanDerWaalsContact O-CG 3.32Å; N251-M255 WeakPolarHBondContact O-CG 3.3Å; N251-M255 PolarHBondContact O-N 2.89Å
252	V	69.5	Low	74.9	Confident	33 Å²	33	45.5 Å²	45.5	20%	0.2	25%	0.248	C	C	.	.	H	α-helix	trans	-65.2	-41.3	177.5	-178.9	0	0	0	0	111.6	L195 E248 F249 M255 M256 V705 V709	L195-V252 HydrophobicContact CD1-CG2 4.41Å; E248-V252 WeakPolarHBondContact O-CG2 3.14Å; E248-V252 PolarHBondContact O-N 2.76Å; F249-V252 PolarHBondContact O-N 3.26Å; V252-M255 PolarHBondContact O-N 2.93Å; V252-M256 WeakPolarHBondContact O-CB 3.29Å; V252-M256 PolarHBondContact O-N 3.27Å; V252-V705 HydrophobicContact CB-CG1 4.47Å; V252-V705 HydrophobicContact CG1-CG1 3.96Å; V252-V709 HydrophobicContact CG1-CG2 3.81Å
253	F	68.7	Low	74.3	Confident	7 Å²	7	50.8 Å²	50.8	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-39.4	177.1	-172.3	-93.6	0	0	0	112.6	F70 F249 M256 K257	F70-F253 HydrophobicContact CB-CD1 4.22Å; F70-F253 HydrophobicContact CB-CE1 3.63Å; F70-F253 HydrophobicContact CB-CZ 4.01Å; F70-F253 AromaticContact CD1-CD1 3.72Å; F70-F253 HydrophobicContact CD1-CD1 3.72Å; F70-F253 HydrophobicContact CD1-CE1 4.03Å; F70-F253 HydrophobicContact CD1-CG 4.2Å; F70-F253 HydrophobicContact CD2-CE1 4.39Å; F70-F253 HydrophobicContact CD2-CE2 4.45Å; F70-F253 HydrophobicContact CD2-CZ 4.34Å; F70-F253 HydrophobicContact CE1-CB 4.33Å; F70-F253 HydrophobicContact CE1-CD1 4.2Å; F70-F253 HydrophobicContact CE1-CG 4.27Å; F70-F253 AromaticContact CG-CD1 3.91Å; F70-F253 HydrophobicContact CG-CD1 3.91Å; F70-F253 AromaticContact CG-CE1 3.76Å; F70-F253 HydrophobicContact CG-CE1 3.76Å; F70-F253 HydrophobicContact CG-CG 4.4Å; F70-F253 HydrophobicContact CG-CZ 4.13Å; F249-F253 WeakPolarHBondContact O-CB 3.27Å; F249-F253 PolarHBondContact O-N 3Å; F253-M256 HydrophobicContact CD2-CE 3.73Å; F253-M256 HydrophobicContact CE2-CE 3.94Å; F253-M256 PolarHBondContact O-N 3.45Å; F253-K257 HydrophobicContact CD1-CG 4.43Å; F253-K257 HydrophobicContact CE1-CD 3.86Å; F253-K257 HydrophobicContact CE1-CG 4.03Å; F253-K257 HydrophobicContact CZ-CD 4.46Å; F253-K257 HydrophobicContact CZ-CG 4.47Å; F253-K257 PolarHBondContact O-N 2.88Å
254	S	69.2	Low	74.2	Confident	39 Å²	39	50.6 Å²	50.6	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-70.9	-35.9	175.6	59.5	0	0	0	0	112.7	G250 N251 M256 K257 T258	G250-S254 WeakPolarHBondContact O-CB 3.04Å; G250-S254 PolarHBondContact O-N 3.49Å; G250-S254 PolarHBondContact O-OG 2.88Å; N251-S254 PolarHBondContact O-N 3.41Å; N251-S254 PolarHBondContact O-OG 3.02Å; S254-M256 VanDerWaalsContact C-N 3.35Å; S254-K257 PolarHBondContact O-N 3.43Å; S254-T258 WeakPolarHBondContact O-CB 3.32Å; S254-T258 PolarHBondContact O-N 3.06Å; S254-T258 PolarHBondContact O-OG1 3.45Å
255	M	72.4	Confident	74.4	Confident	90 Å²	90	50.5 Å²	50.5	44%	0.443	27%	0.269	S	S	.	.	H	α-helix	trans	-60.6	-44.6	169.1	-68	176.3	-159.7	0	0	111.1	N251 V252 K257 T258 E259 V709	N251-M255 VanDerWaalsContact O-CG 3.32Å; N251-M255 WeakPolarHBondContact O-CG 3.3Å; N251-M255 PolarHBondContact O-N 2.89Å; V252-M255 PolarHBondContact O-N 2.93Å; M255-K257 PolarHBondContact O-N 2.9Å; M255-T258 PolarHBondContact O-N 3.03Å; M255-T258 VanDerWaalsContact O-N 3.14Å; M255-E259 PolarHBondContact O-N 3.34Å; M255-E259 VanDerWaalsContact O-N 3.14Å; M255-V709 HydrophobicContact CB-CG1 4.3Å; M255-V709 HydrophobicContact CB-CG2 4.16Å
256	M	72.9	Confident	74.9	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-65.8	-32.4	176.2	-172.5	-102.8	-70.8	0	0	113.1	V252 F253 S254 A708 V709 K712 V727 A731	V252-M256 WeakPolarHBondContact O-CB 3.29Å; V252-M256 PolarHBondContact O-N 3.27Å; F253-M256 HydrophobicContact CD2-CE 3.73Å; F253-M256 HydrophobicContact CE2-CE 3.94Å; F253-M256 PolarHBondContact O-N 3.45Å; S254-M256 VanDerWaalsContact C-N 3.35Å; M256-A708 HydrophobicContact CG-CB 4.42Å; M256-V709 HydrophobicContact CB-CG2 4.25Å; M256-K712 HydrophobicContact CG-CB 3.87Å; M256-K712 HydrophobicContact CG-CD 4.38Å; M256-K712 HydrophobicContact CG-CG 4.04Å; M256-K712 WeakPolarHBondContact O-CE 3.4Å; M256-K712 WeakPolarHBondContact O-CG 3.45Å; M256-K712 HydrophobicContact SD-CD 4.29Å; M256-V727 HydrophobicContact CE-CG1 3.64Å; M256-A731 HydrophobicContact CE-CB 4.08Å; M256-A731 HydrophobicContact CG-CB 4Å; M256-A731 HydrophobicContact SD-CB 3.87Å
257	K	68.5	Low	75	Confident	74 Å²	74	47.1 Å²	47.1	32%	0.322	24%	0.244	S	C	.	.	H	α-helix	trans	-72.9	-28.4	170.1	-85.1	-155.4	160.4	-152.8	0	113.7	L71 D73 F253 S254 M255	L71-K257 PolarHBondContact O-NZ 3.43Å; D73-K257 IonicContact OD1-NZ 3.64Å; D73-K257 IonicContact OD2-NZ 2.69Å; D73-K257 PolarHBondContact OD2-NZ 2.89Å; F253-K257 HydrophobicContact CD1-CG 4.43Å; F253-K257 HydrophobicContact CE1-CD 3.86Å; F253-K257 HydrophobicContact CE1-CG 4.03Å; F253-K257 HydrophobicContact CZ-CD 4.46Å; F253-K257 HydrophobicContact CZ-CG 4.47Å; F253-K257 PolarHBondContact O-N 2.88Å; S254-K257 PolarHBondContact O-N 3.43Å; M255-K257 PolarHBondContact O-N 2.9Å
258	T	72.8	Confident	75	Confident	112 Å²	112	50.9 Å²	50.9	69%	0.687	26%	0.26	S	S	*	.	H	α-helix	trans	-79.5	-27	-178.6	-53.6	0	0	0	0	112.6	S254 M255 E260	S254-T258 WeakPolarHBondContact O-CB 3.32Å; S254-T258 PolarHBondContact O-N 3.06Å; S254-T258 PolarHBondContact O-OG1 3.45Å; M255-T258 PolarHBondContact O-N 3.03Å; M255-T258 VanDerWaalsContact O-N 3.14Å; T258-E260 PolarHBondContact O-N 3.22Å
259	E	72.5	Confident	75	Confident	33 Å²	33	49.4 Å²	49.4	15%	0.154	26%	0.255	C	S	.	.	S	Bend	trans	-77.4	102.9	170.8	-67.2	-67.9	161.7	0	0	110.9	M255 S261 K656 V709 K712 K713	M255-E259 PolarHBondContact O-N 3.34Å; M255-E259 VanDerWaalsContact O-N 3.14Å; E259-S261 PolarHBondContact O-N 3.11Å; E259-K656 VanDerWaalsContact CD-NZ 3.32Å; E259-K656 VanDerWaalsContact OE1-CE 3.32Å; E259-K656 WeakPolarHBondContact OE1-CE 3.49Å; E259-K656 IonicContact OE1-NZ 2.68Å; E259-K656 PolarHBondContact OE1-NZ 2.88Å; E259-K656 WeakPolarHBondContact OE2-CE 3.42Å; E259-K656 IonicContact OE2-NZ 2.75Å; E259-K656 PolarHBondContact OE2-NZ 3.33Å; E259-V709 HydrophobicContact CG-CG1 4.14Å; E259-K712 HydrophobicContact CB-CG 4.31Å; E259-K712 WeakPolarHBondContact O-CE 3.28Å; E259-K712 WeakPolarHBondContact O-CG 3.48Å; E259-K713 VanDerWaalsContact OE2-CD 3.24Å; E259-K713 WeakPolarHBondContact OE2-CD 3.2Å; E259-K713 VanDerWaalsContact OE2-CE 3.27Å; E259-K713 WeakPolarHBondContact OE2-CE 3.37Å; E259-K713 IonicContact OE2-NZ 3.01Å; E259-K713 PolarHBondContact OE2-NZ 2.69Å
260	E	70.3	Confident	75.1	Confident	168 Å²	168	50 Å²	50	79%	0.785	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-62	129.6	166.3	-65.1	-173.7	174.4	0	0	110.5	T258	T258-E260 PolarHBondContact O-N 3.22Å
261	S	69.4	Low	75.3	Confident	43 Å²	43	53.3 Å²	53.3	30%	0.301	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-72.4	134.9	173.1	60.1	0	0	0	0	110.1	E259 K342	E259-S261 PolarHBondContact O-N 3.11Å; S261-K342 PolarHBondContact OG-NZ 3.08Å
262	P	74	Confident	75.4	Confident	46 Å²	46	55.7 Å²	55.7	30%	0.299	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-63.3	153.1	-172.3	26.3	-35.6	0	0	0	113.6	T264	P262-T264 PolarHBondContact O-N 3.31Å
263	K	76.7	Confident	75.9	Confident	114 Å²	114	54.6 Å²	54.6	50%	0.496	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-61.9	127.9	167.9	-82.8	-169.5	166.2	-169.8	0	110.1	K268 D271	K263-K268 HydrophobicContact CB-CG 4.29Å; K263-D271 IonicContact NZ-OD2 3.57Å; K263-D271 PolarHBondContact NZ-OD2 3.24Å
264	T	83.3	Confident	76.3	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.08	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-66.9	158.4	-175.6	69.6	0	0	0	0	112.8	P262 L266 Q267 K268 P344 T348	P262-T264 PolarHBondContact O-N 3.31Å; T264-L266 VanDerWaalsContact C-N 3.26Å; T264-L266 PolarHBondContact O-N 3.37Å; T264-Q267 VanDerWaalsContact N-OE1 3.12Å; T264-Q267 WeakPolarHBondContact O-CB 3.22Å; T264-Q267 PolarHBondContact O-N 3.46Å; T264-Q267 WeakPolarHBondContact OG1-CG 3.4Å; T264-Q267 PolarHBondContact OG1-N 3.11Å; T264-K268 PolarHBondContact O-N 3.38Å; T264-P344 HydrophobicContact CG2-CB 3.89Å; T264-P344 WeakPolarHBondContact OG1-CB 3.27Å; T264-T348 WeakPolarHBondContact CB-OG1 3.46Å
265	P	82.7	Confident	76.7	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	31%	0.314	C	S	.	.	H	α-helix	trans	-55.5	-39.1	176.6	-26.9	36.8	0	0	0	113.1	S269 E347 T348 I697 V825	P265-S269 VanDerWaalsContact O-CB 3.29Å; P265-S269 WeakPolarHBondContact O-CB 3.07Å; P265-S269 PolarHBondContact O-N 2.66Å; P265-S269 PolarHBondContact O-OG 3.24Å; P265-E347 WeakPolarHBondContact CB-OE2 3.28Å; P265-T348 WeakPolarHBondContact CD-OG1 3.48Å; P265-T348 HydrophobicContact CG-CG2 4.16Å; P265-I697 HydrophobicContact CG-CD1 3.78Å; P265-I697 HydrophobicContact CG-CG1 4.24Å; P265-V825 HydrophobicContact CB-CG1 3.87Å; P265-V825 HydrophobicContact CB-CG2 3.99Å; P265-V825 HydrophobicContact CG-CG1 4.28Å; P265-V825 HydrophobicContact CG-CG2 4Å
266	L	83.7	Confident	77.1	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-48.6	170.6	-174.1	58.3	0	0	0	112.4	T264 S269 M270 V322 L326 E347 I758	T264-L266 VanDerWaalsContact C-N 3.26Å; T264-L266 PolarHBondContact O-N 3.37Å; L266-S269 CarbonylContact O-C 3.54Å; L266-S269 WeakPolarHBondContact O-CB 3.45Å; L266-S269 PolarHBondContact O-N 3.26Å; L266-S269 VanDerWaalsContact O-N 3.14Å; L266-M270 HydrophobicContact CD1-CE 4.29Å; L266-M270 HydrophobicContact CD1-CG 4.22Å; L266-M270 HydrophobicContact CG-CG 4.4Å; L266-M270 VanDerWaalsContact O-CG 3.27Å; L266-M270 WeakPolarHBondContact O-CG 3.15Å; L266-M270 PolarHBondContact O-N 3.27Å; L266-V322 HydrophobicContact CD2-CG1 3.86Å; L266-L326 HydrophobicContact CD2-CD1 3.92Å; L266-L326 HydrophobicContact CD2-CD2 4.1Å; L266-L326 HydrophobicContact CD2-CG 4.47Å; L266-E347 HydrophobicContact CB-CB 4.05Å; L266-E347 HydrophobicContact CB-CG 3.91Å; L266-E347 WeakPolarHBondContact CB-OE2 3.5Å; L266-E347 HydrophobicContact CD2-CB 4.05Å; L266-E347 HydrophobicContact CD2-CG 4.42Å; L266-E347 PolarHBondContact N-OE1 3.4Å; L266-E347 PolarHBondContact N-OE2 3.31Å; L266-I758 HydrophobicContact CD1-CD1 4.38Å; L266-I758 HydrophobicContact CD1-CG2 4.3Å; L266-I758 HydrophobicContact CD2-CD1 4.06Å
267	Q	82.5	Confident	77.4	Confident	79 Å²	79	61 Å²	61	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-61.7	-45.9	178	-73.8	174.1	-26.1	0	0	112	T264 S269 M270 D271 P344	T264-Q267 VanDerWaalsContact N-OE1 3.12Å; T264-Q267 WeakPolarHBondContact O-CB 3.22Å; T264-Q267 PolarHBondContact O-N 3.46Å; T264-Q267 WeakPolarHBondContact OG1-CG 3.4Å; T264-Q267 PolarHBondContact OG1-N 3.11Å; Q267-S269 VanDerWaalsContact C-N 3.26Å; Q267-S269 PolarHBondContact O-N 3.04Å; Q267-M270 PolarHBondContact O-N 2.88Å; Q267-D271 WeakPolarHBondContact O-CB 3.18Å; Q267-D271 PolarHBondContact O-N 2.97Å; Q267-P344 HydrophobicContact CG-CB 4.47Å
268	K	80.9	Confident	77.7	Confident	79 Å²	79	59.5 Å²	59.5	34%	0.343	31%	0.31	S	S	.	.	H	α-helix	trans	-55.6	-42.2	172.5	-69.9	-179.9	178.2	177.8	0	111.2	K263 T264 H272 E661	K263-K268 HydrophobicContact CB-CG 4.29Å; T264-K268 PolarHBondContact O-N 3.38Å; K268-H272 WeakPolarHBondContact O-CB 3.42Å; K268-H272 PolarHBondContact O-N 3.33Å; K268-H272 VanDerWaalsContact O-N 3.14Å; K268-E661 IonicContact NZ-OE2 3.16Å; K268-E661 PolarHBondContact NZ-OE2 2.79Å
269	S	79.3	Confident	78.1	Confident	16 Å²	16	58.1 Å²	58.1	11%	0.112	30%	0.304	C	S	.	.	H	α-helix	trans	-68.7	-38.2	179.1	-57.5	0	0	0	0	112.7	P265 L266 Q267 L273 R823	P265-S269 VanDerWaalsContact O-CB 3.29Å; P265-S269 WeakPolarHBondContact O-CB 3.07Å; P265-S269 PolarHBondContact O-N 2.66Å; P265-S269 PolarHBondContact O-OG 3.24Å; L266-S269 CarbonylContact O-C 3.54Å; L266-S269 WeakPolarHBondContact O-CB 3.45Å; L266-S269 PolarHBondContact O-N 3.26Å; L266-S269 VanDerWaalsContact O-N 3.14Å; Q267-S269 VanDerWaalsContact C-N 3.26Å; Q267-S269 PolarHBondContact O-N 3.04Å; S269-L273 VanDerWaalsContact O-CB 3.31Å; S269-L273 WeakPolarHBondContact O-CB 3.23Å; S269-L273 PolarHBondContact O-N 2.99Å; S269-R823 PolarHBondContact OG-NH2 2.77Å
270	M	78.8	Confident	78.7	Confident	39 Å²	39	63.6 Å²	63.6	19%	0.192	32%	0.324	C	S	.	.	H	α-helix	trans	-71.7	-43.4	177.1	-67.7	-63.8	97.6	0	0	112.1	L266 Q267 H272 L273 G274 L318 V322 M829	L266-M270 HydrophobicContact CD1-CE 4.29Å; L266-M270 HydrophobicContact CD1-CG 4.22Å; L266-M270 HydrophobicContact CG-CG 4.4Å; L266-M270 VanDerWaalsContact O-CG 3.27Å; L266-M270 WeakPolarHBondContact O-CG 3.15Å; L266-M270 PolarHBondContact O-N 3.27Å; Q267-M270 PolarHBondContact O-N 2.88Å; M270-H272 PolarHBondContact O-N 3.48Å; M270-L273 HydrophobicContact CE-CD2 3.84Å; M270-L273 PolarHBondContact O-N 3.49Å; M270-G274 PolarHBondContact O-N 3.02Å; M270-L318 HydrophobicContact SD-CD2 3.42Å; M270-L318 WeakPolarHBondContact SD-CD2 3.39Å; M270-V322 HydrophobicContact SD-CG2 4.35Å; M270-M829 HydrophobicContact CE-CE 4.21Å; M270-M829 HydrophobicContact CE-SD 3.41Å; M270-M829 WeakPolarHBondContact CE-SD 3.45Å
271	D	76.4	Confident	79.1	Confident	68 Å²	68	55.9 Å²	55.9	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-56.3	-40.8	172.7	-81.3	-6.9	0	0	0	111.2	K263 Q267 K275	K263-D271 IonicContact NZ-OD2 3.57Å; K263-D271 PolarHBondContact NZ-OD2 3.24Å; Q267-D271 WeakPolarHBondContact O-CB 3.18Å; Q267-D271 PolarHBondContact O-N 2.97Å; D271-K275 WeakPolarHBondContact O-CB 3.44Å; D271-K275 WeakPolarHBondContact O-CD 3.33Å; D271-K275 WeakPolarHBondContact O-CG 3.47Å; D271-K275 PolarHBondContact O-N 2.7Å
272	H	78.8	Confident	79.7	Confident	106 Å²	106	59 Å²	59	49%	0.491	30%	0.298	S	S	.	.	H	α-helix	trans	-69.8	-47.6	177.3	-170.7	-79.4	0	0	0	111.9	K268 M270 K275 Q276	K268-H272 WeakPolarHBondContact O-CB 3.42Å; K268-H272 PolarHBondContact O-N 3.33Å; K268-H272 VanDerWaalsContact O-N 3.14Å; M270-H272 PolarHBondContact O-N 3.48Å; H272-K275 PolarHBondContact O-N 3.09Å; H272-Q276 PolarHBondContact CE1-OE1 3.48Å; H272-Q276 PolarHBondContact ND1-OE1 3.27Å; H272-Q276 WeakPolarHBondContact O-CG 3.47Å; H272-Q276 PolarHBondContact O-N 3.06Å
273	L	80.5	Confident	80.3	Confident	11 Å²	11	59.7 Å²	59.7	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-59.9	-47.2	178.8	176.2	55.6	0	0	0	111.8	S269 M270 K275 Q276 L277 L318 V762 L766 I830	S269-L273 VanDerWaalsContact O-CB 3.31Å; S269-L273 WeakPolarHBondContact O-CB 3.23Å; S269-L273 PolarHBondContact O-N 2.99Å; M270-L273 HydrophobicContact CE-CD2 3.84Å; M270-L273 PolarHBondContact O-N 3.49Å; L273-K275 VanDerWaalsContact C-N 3.34Å; L273-K275 PolarHBondContact O-N 3.29Å; L273-Q276 PolarHBondContact O-N 3.34Å; L273-L277 HydrophobicContact CD1-CD1 3.93Å; L273-L277 HydrophobicContact CD1-CG 4.2Å; L273-L277 HydrophobicContact CG-CD1 3.96Å; L273-L277 WeakPolarHBondContact O-CB 3.34Å; L273-L277 PolarHBondContact O-N 3.32Å; L273-L318 HydrophobicContact CD2-CD1 4.19Å; L273-V762 HydrophobicContact CD2-CG1 3.8Å; L273-L766 HydrophobicContact CD1-CD1 4.38Å; L273-I830 HydrophobicContact CD1-CD1 3.58Å
274	G	76.7	Confident	80.7	Confident	38 Å²	38	56.6 Å²	56.6	39%	0.392	30%	0.297	S	S	.	.	H	α-helix	trans	-61	-40.1	177.9	0	0	0	0	0	112.8	M270 S278	M270-G274 PolarHBondContact O-N 3.02Å; G274-S278 WeakPolarHBondContact O-CB 3.42Å; G274-S278 PolarHBondContact O-N 2.87Å
275	K	77.7	Confident	80.6	Confident	149 Å²	149	56.7 Å²	56.7	65%	0.648	30%	0.297	S	S	*	.	H	α-helix	trans	-65.3	-42.1	174.5	-74.1	169.1	-174.2	173.4	0	112.6	D271 H272 L273 C279	D271-K275 WeakPolarHBondContact O-CB 3.44Å; D271-K275 WeakPolarHBondContact O-CD 3.33Å; D271-K275 WeakPolarHBondContact O-CG 3.47Å; D271-K275 PolarHBondContact O-N 2.7Å; H272-K275 PolarHBondContact O-N 3.09Å; L273-K275 VanDerWaalsContact C-N 3.34Å; L273-K275 PolarHBondContact O-N 3.29Å; K275-C279 VanDerWaalsContact O-CB 3.3Å; K275-C279 WeakPolarHBondContact O-CB 3.35Å; K275-C279 PolarHBondContact O-N 3.16Å; K275-C279 VanDerWaalsContact O-N 3.08Å
276	Q	81	Confident	80.8	Confident	68 Å²	68	59.2 Å²	59.2	32%	0.318	32%	0.318	S	S	.	.	H	α-helix	trans	-64.9	-49.3	176.3	-72.1	-174.1	-72.2	0	0	111.6	H272 L273 C279 Y280	H272-Q276 PolarHBondContact CE1-OE1 3.48Å; H272-Q276 PolarHBondContact ND1-OE1 3.27Å; H272-Q276 WeakPolarHBondContact O-CG 3.47Å; H272-Q276 PolarHBondContact O-N 3.06Å; L273-Q276 PolarHBondContact O-N 3.34Å; Q276-C279 PolarHBondContact O-N 2.98Å; Q276-Y280 HydrophobicContact CB-CD2 4.45Å; Q276-Y280 HydrophobicContact CB-CE2 4.02Å; Q276-Y280 WeakPolarHBondContact O-CD2 3.45Å; Q276-Y280 PolarHBondContact O-N 3.3Å
277	L	78	Confident	80.9	Confident	21 Å²	21	64.1 Å²	64.1	11%	0.11	34%	0.344	C	S	.	.	H	α-helix	trans	-54.5	-55.2	175	-86.3	164.4	0	0	0	111.3	L273 C279 Y280 S281 P315 L766	L273-L277 HydrophobicContact CD1-CD1 3.93Å; L273-L277 HydrophobicContact CD1-CG 4.2Å; L273-L277 HydrophobicContact CG-CD1 3.96Å; L273-L277 WeakPolarHBondContact O-CB 3.34Å; L273-L277 PolarHBondContact O-N 3.32Å; L277-C279 VanDerWaalsContact C-N 3.29Å; L277-C279 PolarHBondContact O-N 3.34Å; L277-Y280 PolarHBondContact O-N 3.08Å; L277-Y280 VanDerWaalsContact O-N 3.16Å; L277-S281 WeakPolarHBondContact O-CB 3.25Å; L277-S281 PolarHBondContact O-N 3.49Å; L277-S281 PolarHBondContact O-OG 2.89Å; L277-P315 HydrophobicContact CD1-CG 4.1Å; L277-L766 HydrophobicContact CD1-CD2 4Å; L277-L766 HydrophobicContact CD2-CD2 3.7Å; L277-L766 HydrophobicContact CG-CD2 4.21Å
278	S	75.4	Confident	80.9	Confident	41 Å²	41	60.6 Å²	60.6	29%	0.287	33%	0.327	S	S	.	.	H	α-helix	trans	-54.6	-45.2	-179.8	-179.6	0	0	0	0	111.9	G274 S281 F282	G274-S278 WeakPolarHBondContact O-CB 3.42Å; G274-S278 PolarHBondContact O-N 2.87Å; S278-S281 PolarHBondContact O-N 2.82Å; S278-F282 WeakPolarHBondContact O-CB 3.42Å; S278-F282 WeakPolarHBondContact O-CD2 3.25Å; S278-F282 PolarHBondContact O-N 3.42Å; S278-F282 WeakPolarHBondContact OG-CD2 3.27Å; S278-F282 VanDerWaalsContact OG-CE2 3.3Å; S278-F282 WeakPolarHBondContact OG-CE2 3.44Å
279	C	82.6	Confident	81.1	Confident	83 Å²	83	60 Å²	60	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-61.2	-49.2	177.1	-173	0	0	0	0	112.7	K275 Q276 L277 A283	K275-C279 VanDerWaalsContact O-CB 3.3Å; K275-C279 WeakPolarHBondContact O-CB 3.35Å; K275-C279 PolarHBondContact O-N 3.16Å; K275-C279 VanDerWaalsContact O-N 3.08Å; Q276-C279 PolarHBondContact O-N 2.98Å; L277-C279 VanDerWaalsContact C-N 3.29Å; L277-C279 PolarHBondContact O-N 3.34Å; C279-A283 WeakPolarHBondContact O-CB 3.41Å; C279-A283 PolarHBondContact O-N 2.68Å
280	Y	83.3	Confident	81.4	Confident	148 Å²	148	63.6 Å²	63.6	58%	0.58	35%	0.346	S	S	*	.	H	α-helix	trans	-65.9	-41.4	178.6	-62	-42.5	0	0	0	112.3	Q276 L277 A283 V284	Q276-Y280 HydrophobicContact CB-CD2 4.45Å; Q276-Y280 HydrophobicContact CB-CE2 4.02Å; Q276-Y280 WeakPolarHBondContact O-CD2 3.45Å; Q276-Y280 PolarHBondContact O-N 3.3Å; L277-Y280 PolarHBondContact O-N 3.08Å; L277-Y280 VanDerWaalsContact O-N 3.16Å; Y280-A283 PolarHBondContact O-N 2.69Å; Y280-V284 WeakPolarHBondContact O-CG2 3.36Å; Y280-V284 PolarHBondContact O-N 2.86Å
281	S	79.8	Confident	81.8	Confident	6 Å²	6	63.2 Å²	63.2	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-62	-50	177.5	-57	0	0	0	0	111.1	L277 S278 A283 V284 I285 A313	L277-S281 WeakPolarHBondContact O-CB 3.25Å; L277-S281 PolarHBondContact O-N 3.49Å; L277-S281 PolarHBondContact O-OG 2.89Å; S278-S281 PolarHBondContact O-N 2.82Å; S281-A283 VanDerWaalsContact C-N 3.29Å; S281-A283 PolarHBondContact O-N 2.62Å; S281-V284 PolarHBondContact O-N 3.15Å; S281-I285 WeakPolarHBondContact O-CB 3.45Å; S281-I285 VanDerWaalsContact O-CD1 3.25Å; S281-I285 WeakPolarHBondContact O-CD1 3.41Å; S281-I285 WeakPolarHBondContact O-CG1 3.49Å; S281-I285 PolarHBondContact O-N 3.04Å; S281-A313 WeakPolarHBondContact OG-CB 3.47Å
282	F	82.3	Confident	82.2	Confident	110 Å²	110	60 Å²	60	48%	0.482	33%	0.329	S	S	.	.	H	α-helix	trans	-60.3	-37.3	175.8	-79.1	-55.8	0	0	0	112.5	S278 I285 A286	S278-F282 WeakPolarHBondContact O-CB 3.42Å; S278-F282 WeakPolarHBondContact O-CD2 3.25Å; S278-F282 PolarHBondContact O-N 3.42Å; S278-F282 WeakPolarHBondContact OG-CD2 3.27Å; S278-F282 VanDerWaalsContact OG-CE2 3.3Å; S278-F282 WeakPolarHBondContact OG-CE2 3.44Å; F282-I285 PolarHBondContact O-N 2.71Å; F282-A286 VanDerWaalsContact O-CB 3.23Å; F282-A286 WeakPolarHBondContact O-CB 3.44Å; F282-A286 PolarHBondContact O-N 3.19Å
283	A	86.6	Confident	82.5	Confident	60 Å²	60	58.8 Å²	58.8	50%	0.496	33%	0.325	S	S	.	.	H	α-helix	trans	-65.2	-44.3	175.6	0	0	0	0	0	112.6	C279 Y280 S281 L287	C279-A283 WeakPolarHBondContact O-CB 3.41Å; C279-A283 PolarHBondContact O-N 2.68Å; Y280-A283 PolarHBondContact O-N 2.69Å; S281-A283 VanDerWaalsContact C-N 3.29Å; S281-A283 PolarHBondContact O-N 2.62Å; A283-L287 WeakPolarHBondContact O-CB 3.34Å; A283-L287 PolarHBondContact O-N 3Å
284	V	83.9	Confident	82.9	Confident	48 Å²	48	62.5 Å²	62.5	29%	0.291	36%	0.357	S	S	.	.	H	α-helix	trans	-65.3	-41.4	176.2	170.7	0	0	0	0	111.2	Y280 S281 L287 I288 A777	Y280-V284 WeakPolarHBondContact O-CG2 3.36Å; Y280-V284 PolarHBondContact O-N 2.86Å; S281-V284 PolarHBondContact O-N 3.15Å; V284-L287 WeakPolarHBondContact O-CB 3.34Å; V284-L287 PolarHBondContact O-N 2.96Å; V284-I288 HydrophobicContact CG1-CD1 3.83Å; V284-I288 VanDerWaalsContact O-CG1 3.29Å; V284-I288 WeakPolarHBondContact O-CG1 3.32Å; V284-I288 PolarHBondContact O-N 3.19Å; V284-A777 HydrophobicContact CG1-CB 4.33Å
285	I	82.9	Confident	83.4	Confident	15 Å²	15	62.6 Å²	62.6	8%	0.077	35%	0.348	C	S	.	.	H	α-helix	trans	-69.9	-41.5	-178.9	-67.6	160	0	0	0	111.3	S281 F282 L287 I288 F289 A306 L309 A310	S281-I285 WeakPolarHBondContact O-CB 3.45Å; S281-I285 VanDerWaalsContact O-CD1 3.25Å; S281-I285 WeakPolarHBondContact O-CD1 3.41Å; S281-I285 WeakPolarHBondContact O-CG1 3.49Å; S281-I285 PolarHBondContact O-N 3.04Å; F282-I285 PolarHBondContact O-N 2.71Å; I285-L287 VanDerWaalsContact C-N 3.31Å; I285-L287 PolarHBondContact O-N 3.37Å; I285-I288 PolarHBondContact O-N 2.93Å; I285-F289 WeakPolarHBondContact O-CB 3.47Å; I285-F289 PolarHBondContact O-N 3.07Å; I285-A306 HydrophobicContact CG2-CB 3.59Å; I285-L309 HydrophobicContact CG1-CD2 4.2Å; I285-L309 HydrophobicContact CG1-CG 4.38Å; I285-A310 HydrophobicContact CD1-CB 3.74Å
286	A	84.9	Confident	83.6	Confident	54 Å²	54	58.7 Å²	58.7	45%	0.446	35%	0.35	S	S	.	.	H	α-helix	trans	-62.6	-38.3	173.3	0	0	0	0	0	111.9	F282 T290	F282-A286 VanDerWaalsContact O-CB 3.23Å; F282-A286 WeakPolarHBondContact O-CB 3.44Å; F282-A286 PolarHBondContact O-N 3.19Å; A286-T290 VanDerWaalsContact O-CB 3.31Å; A286-T290 WeakPolarHBondContact O-CB 3.41Å; A286-T290 PolarHBondContact O-N 2.97Å; A286-T290 PolarHBondContact O-OG1 3.22Å
287	L	86.7	Confident	83.5	Confident	108 Å²	108	57.8 Å²	57.8	57%	0.565	34%	0.344	S	S	*	.	H	α-helix	trans	-62.7	-49.1	173.1	178.4	64.5	0	0	0	111.4	A283 V284 I285 F289 T290 V291	A283-L287 WeakPolarHBondContact O-CB 3.34Å; A283-L287 PolarHBondContact O-N 3Å; V284-L287 WeakPolarHBondContact O-CB 3.34Å; V284-L287 PolarHBondContact O-N 2.96Å; I285-L287 VanDerWaalsContact C-N 3.31Å; I285-L287 PolarHBondContact O-N 3.37Å; L287-F289 PolarHBondContact O-N 2.95Å; L287-T290 PolarHBondContact O-N 3.31Å; L287-V291 HydrophobicContact CD1-CG2 4.05Å; L287-V291 HydrophobicContact CG-CG2 4.48Å; L287-V291 WeakPolarHBondContact O-CB 3.5Å; L287-V291 VanDerWaalsContact O-CG2 3.27Å; L287-V291 WeakPolarHBondContact O-CG2 3.49Å; L287-V291 PolarHBondContact O-N 2.74Å
288	I	83.5	Confident	83.6	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-57.7	-48.7	177.4	-73.2	167.3	0	0	0	111.2	V284 I285 V291 G292 M302 L309 A777 T780	V284-I288 HydrophobicContact CG1-CD1 3.83Å; V284-I288 VanDerWaalsContact O-CG1 3.29Å; V284-I288 WeakPolarHBondContact O-CG1 3.32Å; V284-I288 PolarHBondContact O-N 3.19Å; I285-I288 PolarHBondContact O-N 2.93Å; I288-V291 PolarHBondContact O-N 2.91Å; I288-G292 PolarHBondContact O-N 2.93Å; I288-M302 HydrophobicContact CG2-CE 3.74Å; I288-M302 VanDerWaalsContact O-CE 3.32Å; I288-M302 WeakPolarHBondContact O-CE 3.45Å; I288-L309 HydrophobicContact CD1-CD2 3.3Å; I288-A777 HydrophobicContact CD1-CB 3.84Å; I288-A777 HydrophobicContact CG1-CB 4.05Å; I288-T780 HydrophobicContact CG2-CG2 4.26Å
289	F	83.5	Confident	83.8	Confident	68 Å²	68	61.2 Å²	61.2	30%	0.298	37%	0.366	S	S	.	.	H	α-helix	trans	-61	-46.5	179.4	-174.3	-103.6	0	0	0	111.8	I285 L287 G292 I293 M302 F303 A306	I285-F289 WeakPolarHBondContact O-CB 3.47Å; I285-F289 PolarHBondContact O-N 3.07Å; L287-F289 PolarHBondContact O-N 2.95Å; F289-G292 PolarHBondContact O-N 3.24Å; F289-I293 HydrophobicContact CD1-CD1 3.88Å; F289-I293 HydrophobicContact CE1-CD1 3.43Å; F289-I293 VanDerWaalsContact CE1-CD1 3.43Å; F289-I293 HydrophobicContact CE2-CD1 4.19Å; F289-I293 HydrophobicContact CG-CD1 4.44Å; F289-I293 HydrophobicContact CZ-CD1 3.62Å; F289-I293 WeakPolarHBondContact O-CG1 3.21Å; F289-I293 PolarHBondContact O-N 3.02Å; F289-M302 HydrophobicContact CD2-CB 3.91Å; F289-M302 HydrophobicContact CE2-CB 4.18Å; F289-F303 HydrophobicContact CE2-CB 4.2Å; F289-A306 HydrophobicContact CD2-CB 4.46Å
290	T	87	Confident	83.3	Confident	90 Å²	90	60.7 Å²	60.7	55%	0.552	36%	0.357	S	S	*	.	H	α-helix	trans	-63.7	-44.3	178.2	-54.4	0	0	0	0	111.8	A286 L287 A294	A286-T290 VanDerWaalsContact O-CB 3.31Å; A286-T290 WeakPolarHBondContact O-CB 3.41Å; A286-T290 PolarHBondContact O-N 2.97Å; A286-T290 PolarHBondContact O-OG1 3.22Å; L287-T290 PolarHBondContact O-N 3.31Å; T290-A294 WeakPolarHBondContact O-CB 3.27Å; T290-A294 PolarHBondContact O-N 3.37Å
291	V	86.9	Confident	82.8	Confident	31 Å²	31	57.9 Å²	57.9	19%	0.188	35%	0.349	C	S	.	.	H	α-helix	trans	-65.4	-43.4	177.7	169.1	0	0	0	0	111	L287 I288 I293 A294 Q295 L781	L287-V291 HydrophobicContact CD1-CG2 4.05Å; L287-V291 HydrophobicContact CG-CG2 4.48Å; L287-V291 WeakPolarHBondContact O-CB 3.5Å; L287-V291 VanDerWaalsContact O-CG2 3.27Å; L287-V291 WeakPolarHBondContact O-CG2 3.49Å; L287-V291 PolarHBondContact O-N 2.74Å; I288-V291 PolarHBondContact O-N 2.91Å; V291-I293 PolarHBondContact O-N 3.21Å; V291-A294 CarbonylContact O-C 3.51Å; V291-A294 PolarHBondContact O-N 3.3Å; V291-Q295 HydrophobicContact CG1-CG 4.36Å; V291-Q295 VanDerWaalsContact O-CG 3.25Å; V291-Q295 WeakPolarHBondContact O-CG 3.45Å; V291-Q295 PolarHBondContact O-N 2.6Å; V291-L781 HydrophobicContact CG1-CD1 4.19Å
292	G	84	Confident	82.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-42	178.5	0	0	0	0	0	113.4	I288 F289 Q295 G296 R297	I288-G292 PolarHBondContact O-N 2.93Å; F289-G292 PolarHBondContact O-N 3.24Å; G292-Q295 PolarHBondContact O-N 3.17Å; G292-G296 PolarHBondContact O-N 3.2Å; G292-R297 WeakPolarHBondContact O-CB 3.23Å; G292-R297 PolarHBondContact O-N 3.14Å
293	I	85.8	Confident	82.4	Confident	81 Å²	81	55.8 Å²	55.8	42%	0.415	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-45.6	172.8	-70.4	173	0	0	0	110.6	F289 V291 Q295 G296	F289-I293 HydrophobicContact CD1-CD1 3.88Å; F289-I293 HydrophobicContact CE1-CD1 3.43Å; F289-I293 VanDerWaalsContact CE1-CD1 3.43Å; F289-I293 HydrophobicContact CE2-CD1 4.19Å; F289-I293 HydrophobicContact CG-CD1 4.44Å; F289-I293 HydrophobicContact CZ-CD1 3.62Å; F289-I293 WeakPolarHBondContact O-CG1 3.21Å; F289-I293 PolarHBondContact O-N 3.02Å; V291-I293 PolarHBondContact O-N 3.21Å; I293-Q295 PolarHBondContact O-N 3.38Å; I293-G296 PolarHBondContact O-N 2.92Å
294	A	88.3	Confident	81.7	Confident	89 Å²	89	54.1 Å²	54.1	74%	0.736	32%	0.323	S	S	*	.	H	α-helix	trans	-64.2	-21.3	176.8	0	0	0	0	0	113.7	T290 V291	T290-A294 WeakPolarHBondContact O-CB 3.27Å; T290-A294 PolarHBondContact O-N 3.37Å; V291-A294 CarbonylContact O-C 3.51Å; V291-A294 PolarHBondContact O-N 3.3Å
295	Q	87.6	Confident	81.1	Confident	40 Å²	40	52.8 Å²	52.8	19%	0.187	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-9.9	172.7	-71.3	177	3.3	0	0	114.1	V291 G292 I293 T780 L781 K783	V291-Q295 HydrophobicContact CG1-CG 4.36Å; V291-Q295 VanDerWaalsContact O-CG 3.25Å; V291-Q295 WeakPolarHBondContact O-CG 3.45Å; V291-Q295 PolarHBondContact O-N 2.6Å; G292-Q295 PolarHBondContact O-N 3.17Å; I293-Q295 PolarHBondContact O-N 3.38Å; Q295-T780 PolarHBondContact NE2-O 3.46Å; Q295-T780 PolarHBondContact OE1-O 2.92Å; Q295-L781 PolarHBondContact NE2-O 3Å; Q295-K783 HydrophobicContact CG-CG 4.08Å
296	G	81.5	Confident	80.8	Confident	68 Å²	68	52.5 Å²	52.5	70%	0.701	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	18.3	-176.6	0	0	0	0	0	115.2	G292 I293	G292-G296 PolarHBondContact O-N 3.2Å; I293-G296 PolarHBondContact O-N 2.92Å
297	R	78.6	Confident	80.1	Confident	48 Å²	48	50.2 Å²	50.2	18%	0.181	29%	0.294	C	S	.	.			trans	-70.7	154.9	171.3	-64.8	-175	177.5	-158	-5.6	110.5	G292 A299 M302 K783 L784	G292-R297 WeakPolarHBondContact O-CB 3.23Å; G292-R297 PolarHBondContact O-N 3.14Å; R297-A299 PolarHBondContact O-N 3.22Å; R297-M302 HydrophobicContact CB-CG 3.76Å; R297-M302 HydrophobicContact CB-SD 3.83Å; R297-M302 WeakPolarHBondContact CD-SD 3.37Å; R297-M302 HydrophobicContact CG-SD 4.28Å; R297-K783 PolarHBondContact NH2-O 3.3Å; R297-L784 PolarHBondContact NH2-O 3.1Å
298	N	81.1	Confident	79.3	Confident	86 Å²	86	46.8 Å²	46.8	46%	0.46	28%	0.279	S	S	.	.			trans	-63.5	127.3	178.9	-176.6	-10.7	0	0	0	109.7	L300 E301 M302	N298-L300 PolarHBondContact O-N 2.93Å; N298-L300 VanDerWaalsContact O-N 3.12Å; N298-L300 PolarHBondContact OD1-N 3.15Å; N298-L300 VanDerWaalsContact OD1-N 3.13Å; N298-E301 HydrophobicContact CB-CB 4.02Å; N298-E301 WeakPolarHBondContact O-CB 3.4Å; N298-E301 PolarHBondContact O-N 3.16Å; N298-E301 VanDerWaalsContact O-N 3.15Å; N298-M302 WeakPolarHBondContact O-CG 3.39Å; N298-M302 PolarHBondContact O-N 2.9Å
299	A	78.6	Confident	78.8	Confident	48 Å²	48	46.8 Å²	46.8	40%	0.397	28%	0.279	S	S	.	.	H	α-helix	trans	-58.6	-27.9	-178	0	0	0	0	0	112.9	R297 F303	R297-A299 PolarHBondContact O-N 3.22Å; A299-F303 VanDerWaalsContact O-CB 3.32Å; A299-F303 WeakPolarHBondContact O-CB 3.34Å; A299-F303 PolarHBondContact O-N 2.81Å
300	L	72.8	Confident	78.3	Confident	72 Å²	72	44 Å²	44	38%	0.377	27%	0.269	S	S	.	.	H	α-helix	trans	-79.3	-37.5	179.9	-67.4	150.5	0	0	0	111.8	I100 M104 N298 F303 T304	I100-L300 HydrophobicContact CG2-CD2 4.24Å; M104-L300 HydrophobicContact CE-CB 4.31Å; M104-L300 HydrophobicContact CE-CD1 3.67Å; M104-L300 HydrophobicContact CE-CG 4.46Å; M104-L300 HydrophobicContact SD-CB 3.74Å; M104-L300 HydrophobicContact SD-CD1 3.69Å; M104-L300 HydrophobicContact SD-CD2 3.87Å; M104-L300 HydrophobicContact SD-CG 3.94Å; N298-L300 PolarHBondContact O-N 2.93Å; N298-L300 VanDerWaalsContact O-N 3.12Å; N298-L300 PolarHBondContact OD1-N 3.15Å; N298-L300 VanDerWaalsContact OD1-N 3.13Å; L300-F303 WeakPolarHBondContact O-CB 3.21Å; L300-F303 PolarHBondContact O-N 2.96Å; L300-T304 PolarHBondContact O-N 3.05Å; L300-T304 PolarHBondContact O-OG1 3.24Å
301	E	72.4	Confident	77.3	Confident	90 Å²	90	40.4 Å²	40.4	42%	0.421	25%	0.247	S	C	.	.	H	α-helix	trans	-64.1	-44.5	168.9	-175.8	-165.1	169.9	0	0	110.8	N298 F303 T304 I305	N298-E301 HydrophobicContact CB-CB 4.02Å; N298-E301 WeakPolarHBondContact O-CB 3.4Å; N298-E301 PolarHBondContact O-N 3.16Å; N298-E301 VanDerWaalsContact O-N 3.15Å; E301-F303 PolarHBondContact O-N 3.42Å; E301-T304 PolarHBondContact O-N 2.91Å; E301-T304 PolarHBondContact O-OG1 3.5Å; E301-T304 VanDerWaalsContact O-OG1 3.1Å; E301-I305 HydrophobicContact CG-CD1 4.03Å; E301-I305 WeakPolarHBondContact O-CB 3.49Å; E301-I305 WeakPolarHBondContact O-CD1 3.11Å; E301-I305 WeakPolarHBondContact O-CG1 3.3Å; E301-I305 PolarHBondContact O-N 2.77Å
302	M	79.5	Confident	76.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-30.5	174.2	-69.1	-53.3	-48.5	0	0	112.5	I288 F289 R297 N298 I305 A306 T780	I288-M302 HydrophobicContact CG2-CE 3.74Å; I288-M302 VanDerWaalsContact O-CE 3.32Å; I288-M302 WeakPolarHBondContact O-CE 3.45Å; F289-M302 HydrophobicContact CD2-CB 3.91Å; F289-M302 HydrophobicContact CE2-CB 4.18Å; R297-M302 HydrophobicContact CB-CG 3.76Å; R297-M302 HydrophobicContact CB-SD 3.83Å; R297-M302 WeakPolarHBondContact CD-SD 3.37Å; R297-M302 HydrophobicContact CG-SD 4.28Å; N298-M302 WeakPolarHBondContact O-CG 3.39Å; N298-M302 PolarHBondContact O-N 2.9Å; M302-I305 HydrophobicContact SD-CD1 4.39Å; M302-A306 WeakPolarHBondContact O-CB 3.16Å; M302-A306 PolarHBondContact O-N 3.39Å; M302-T780 HydrophobicContact CE-CG2 4.24Å
303	F	75	Confident	75.7	Confident	72 Å²	72	39.3 Å²	39.3	32%	0.316	24%	0.241	S	C	.	.	H	α-helix	trans	-72.2	-46.9	174.7	-177.7	-96.2	0	0	0	112.1	I100 F289 A299 L300 E301 I305 A306 V307	I100-F303 HydrophobicContact CD1-CD1 4.44Å; I100-F303 HydrophobicContact CD1-CE1 3.68Å; I100-F303 HydrophobicContact CD1-CZ 4.13Å; F289-F303 HydrophobicContact CE2-CB 4.2Å; A299-F303 VanDerWaalsContact O-CB 3.32Å; A299-F303 WeakPolarHBondContact O-CB 3.34Å; A299-F303 PolarHBondContact O-N 2.81Å; L300-F303 WeakPolarHBondContact O-CB 3.21Å; L300-F303 PolarHBondContact O-N 2.96Å; E301-F303 PolarHBondContact O-N 3.42Å; F303-I305 VanDerWaalsContact C-N 3.33Å; F303-I305 PolarHBondContact O-N 3.37Å; F303-A306 PolarHBondContact O-N 3.28Å; F303-A306 VanDerWaalsContact O-N 3.17Å; F303-V307 HydrophobicContact CD1-CG2 4.11Å; F303-V307 HydrophobicContact CE1-CG2 3.69Å; F303-V307 HydrophobicContact CE2-CG2 4.19Å; F303-V307 HydrophobicContact CZ-CG2 3.74Å; F303-V307 WeakPolarHBondContact O-CG2 3.27Å; F303-V307 PolarHBondContact O-N 3.07Å
304	T	71	Confident	74.9	Confident	25 Å²	25	37.4 Å²	37.4	15%	0.153	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-36.3	177.7	55.9	0	0	0	0	112	L300 E301 S308	L300-T304 PolarHBondContact O-N 3.05Å; L300-T304 PolarHBondContact O-OG1 3.24Å; E301-T304 PolarHBondContact O-N 2.91Å; E301-T304 PolarHBondContact O-OG1 3.5Å; E301-T304 VanDerWaalsContact O-OG1 3.1Å; T304-S308 VanDerWaalsContact O-CB 3.29Å; T304-S308 WeakPolarHBondContact O-CB 3.47Å; T304-S308 PolarHBondContact O-N 3.41Å; T304-S308 PolarHBondContact O-OG 3.5Å
305	I	72.4	Confident	73.9	Confident	20 Å²	20	33.9 Å²	33.9	10%	0.103	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-49.4	169.4	-67.4	164.7	0	0	0	110.4	E301 M302 F303 V307 S308 L309 V776 N786	E301-I305 HydrophobicContact CG-CD1 4.03Å; E301-I305 WeakPolarHBondContact O-CB 3.49Å; E301-I305 WeakPolarHBondContact O-CD1 3.11Å; E301-I305 WeakPolarHBondContact O-CG1 3.3Å; E301-I305 PolarHBondContact O-N 2.77Å; M302-I305 HydrophobicContact SD-CD1 4.39Å; F303-I305 VanDerWaalsContact C-N 3.33Å; F303-I305 PolarHBondContact O-N 3.37Å; I305-V307 PolarHBondContact O-N 2.95Å; I305-S308 PolarHBondContact O-N 3.3Å; I305-L309 WeakPolarHBondContact O-CB 3.31Å; I305-L309 PolarHBondContact O-N 3.05Å; I305-V776 HydrophobicContact CG2-CG1 4.41Å; I305-N786 WeakPolarHBondContact CD1-ND2 3.42Å
306	A	75.8	Confident	72.9	Confident	9 Å²	9	34.9 Å²	34.9	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-42.2	179.8	0	0	0	0	0	113	I285 F289 M302 F303 A310	I285-A306 HydrophobicContact CG2-CB 3.59Å; F289-A306 HydrophobicContact CD2-CB 4.46Å; M302-A306 WeakPolarHBondContact O-CB 3.16Å; M302-A306 PolarHBondContact O-N 3.39Å; F303-A306 PolarHBondContact O-N 3.28Å; F303-A306 VanDerWaalsContact O-N 3.17Å; A306-A310 WeakPolarHBondContact O-CB 3.27Å; A306-A310 PolarHBondContact O-N 2.66Å
307	V	70.7	Confident	72.2	Confident	6 Å²	6	32.8 Å²	32.8	4%	0.036	18%	0.184	C	C	.	.	H	α-helix	trans	-66.5	-49.1	175.9	168.2	0	0	0	0	111.5	L93 L94 F303 I305 L309 A310 V311	L93-V307 HydrophobicContact CD2-CB 4.14Å; L93-V307 HydrophobicContact CD2-CG1 3.58Å; L93-V307 HydrophobicContact CD2-CG2 3.86Å; L94-V307 HydrophobicContact CD2-CG1 3.96Å; F303-V307 HydrophobicContact CD1-CG2 4.11Å; F303-V307 HydrophobicContact CE1-CG2 3.69Å; F303-V307 HydrophobicContact CE2-CG2 4.19Å; F303-V307 HydrophobicContact CZ-CG2 3.74Å; F303-V307 WeakPolarHBondContact O-CG2 3.27Å; F303-V307 PolarHBondContact O-N 3.07Å; I305-V307 PolarHBondContact O-N 2.95Å; V307-L309 PolarHBondContact O-N 3Å; V307-A310 WeakPolarHBondContact O-CB 3.41Å; V307-A310 PolarHBondContact O-N 3.42Å; V307-A310 VanDerWaalsContact O-N 3.1Å; V307-V311 PolarHBondContact O-N 3.25Å
308	S	69.3	Low	72.1	Confident	35 Å²	35	31 Å²	31	25%	0.245	18%	0.178	C	C	.	.	H	α-helix	trans	-58.8	-40	178.5	-58.4	0	0	0	0	111.1	T304 I305 A312	T304-S308 VanDerWaalsContact O-CB 3.29Å; T304-S308 WeakPolarHBondContact O-CB 3.47Å; T304-S308 PolarHBondContact O-N 3.41Å; T304-S308 PolarHBondContact O-OG 3.5Å; I305-S308 PolarHBondContact O-N 3.3Å; S308-A312 WeakPolarHBondContact O-CB 3.4Å; S308-A312 PolarHBondContact O-N 3.05Å; S308-A312 VanDerWaalsContact O-N 3.1Å
309	L	73.3	Confident	71.7	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-71.3	-33.5	177.2	-164.8	65.4	0	0	0	112.5	I285 I288 I305 V307 V311 A312 A313 L773 V776	I285-L309 HydrophobicContact CG1-CD2 4.2Å; I285-L309 HydrophobicContact CG1-CG 4.38Å; I288-L309 HydrophobicContact CD1-CD2 3.3Å; I305-L309 WeakPolarHBondContact O-CB 3.31Å; I305-L309 PolarHBondContact O-N 3.05Å; V307-L309 PolarHBondContact O-N 3Å; L309-V311 VanDerWaalsContact C-N 3.29Å; L309-V311 PolarHBondContact O-N 2.94Å; L309-A312 CarbonylContact O-C 3.59Å; L309-A312 PolarHBondContact O-N 3.38Å; L309-A313 WeakPolarHBondContact O-CB 3.1Å; L309-A313 PolarHBondContact O-N 2.81Å; L309-L773 HydrophobicContact CD1-CD2 3.73Å; L309-L773 HydrophobicContact CD2-CD2 4.1Å; L309-L773 HydrophobicContact CG-CD2 3.63Å; L309-V776 HydrophobicContact CD1-CB 4.11Å; L309-V776 HydrophobicContact CD1-CG1 4.29Å; L309-V776 HydrophobicContact CD1-CG2 4.12Å; L309-V776 HydrophobicContact CD2-CB 4.31Å; L309-V776 HydrophobicContact CD2-CG1 3.98Å
310	A	72	Confident	71.6	Confident	10 Å²	10	29.9 Å²	29.9	8%	0.083	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-39.5	175.5	0	0	0	0	0	113	I285 A306 V307	I285-A310 HydrophobicContact CD1-CB 3.74Å; A306-A310 WeakPolarHBondContact O-CB 3.27Å; A306-A310 PolarHBondContact O-N 2.66Å; V307-A310 WeakPolarHBondContact O-CB 3.41Å; V307-A310 PolarHBondContact O-N 3.42Å; V307-A310 VanDerWaalsContact O-N 3.1Å
311	V	66.1	Low	72	Confident	13 Å²	13	26.5 Å²	26.5	8%	0.079	15%	0.153	C	C	.	.	H	α-helix	trans	-74.9	-45.7	177.2	175.3	0	0	0	0	110.3	L94 V307 L309 A313 I314	L94-V311 HydrophobicContact CD1-CG1 4.26Å; L94-V311 HydrophobicContact CD1-CG2 3.72Å; L94-V311 HydrophobicContact CD2-CG2 3.8Å; L94-V311 HydrophobicContact CG-CG2 3.6Å; V307-V311 PolarHBondContact O-N 3.25Å; L309-V311 VanDerWaalsContact C-N 3.29Å; L309-V311 PolarHBondContact O-N 2.94Å; V311-A313 PolarHBondContact O-N 3.24Å; V311-I314 PolarHBondContact O-N 3.26Å; V311-I314 VanDerWaalsContact O-N 3.17Å
312	A	67.6	Low	72.6	Confident	9 Å²	9	22.8 Å²	22.8	7%	0.074	14%	0.136	C	C	.	.	H	α-helix	trans	-61.7	-23.3	174.2	0	0	0	0	0	114.3	S308 L309 I314 I793 N797	S308-A312 WeakPolarHBondContact O-CB 3.4Å; S308-A312 PolarHBondContact O-N 3.05Å; S308-A312 VanDerWaalsContact O-N 3.1Å; L309-A312 CarbonylContact O-C 3.59Å; L309-A312 PolarHBondContact O-N 3.38Å; A312-I314 VanDerWaalsContact C-N 3.32Å; A312-I793 HydrophobicContact CB-CG2 3.49Å; A312-I793 VanDerWaalsContact CB-CG2 3.49Å; A312-N797 WeakPolarHBondContact CA-ND2 3.47Å; A312-N797 PolarHBondContact O-ND2 3.28Å
313	A	70.2	Confident	72.7	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-19	178.9	0	0	0	0	0	113.9	S281 L309 V311 L773	S281-A313 WeakPolarHBondContact OG-CB 3.47Å; L309-A313 WeakPolarHBondContact O-CB 3.1Å; L309-A313 PolarHBondContact O-N 2.81Å; V311-A313 PolarHBondContact O-N 3.24Å; A313-L773 HydrophobicContact CB-CD1 3.86Å; A313-L773 HydrophobicContact CB-CD2 3.53Å; A313-L773 HydrophobicContact CB-CG 4.16Å
314	I	68.7	Low	73	Confident	41 Å²	41	24 Å²	24	21%	0.21	15%	0.149	C	C	.	.	S	Bend	trans	-107.4	119.4	-172.8	-66.2	174	0	0	0	107.5	L90 V311 A312 E316	L90-I314 HydrophobicContact CD1-CB 4.47Å; L90-I314 HydrophobicContact CD1-CD1 3.56Å; L90-I314 HydrophobicContact CD1-CG2 4.07Å; L90-I314 HydrophobicContact CD2-CD1 3.55Å; L90-I314 HydrophobicContact CG-CD1 4.21Å; V311-I314 PolarHBondContact O-N 3.26Å; V311-I314 VanDerWaalsContact O-N 3.17Å; A312-I314 VanDerWaalsContact C-N 3.32Å; I314-E316 VanDerWaalsContact C-N 3.28Å; I314-E316 PolarHBondContact O-N 3.39Å
315	P	68.6	Low	73.7	Confident	14 Å²	14	23 Å²	23	9%	0.091	14%	0.143	C	C	.	.			trans	-76.8	81.1	-176.4	31.7	-35.7	0	0	0	110	L277 G317 L318	L277-P315 HydrophobicContact CD1-CG 4.1Å; P315-G317 PolarHBondContact O-N 3.39Å; P315-G317 VanDerWaalsContact O-N 3.15Å; P315-L318 HydrophobicContact CB-CB 4.08Å; P315-L318 HydrophobicContact CB-CD1 4.39Å; P315-L318 HydrophobicContact CG-CB 4.09Å; P315-L318 HydrophobicContact CG-CD1 3.77Å; P315-L318 WeakPolarHBondContact O-CB 3.33Å; P315-L318 PolarHBondContact O-N 3.13Å
316	E	65.5	Low	74.5	Confident	61 Å²	61	22.2 Å²	22.2	29%	0.285	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-29.3	-178.9	-62.4	-171.4	149	0	0	112.9	V120 I314 L318 P319	V120-E316 WeakPolarHBondContact CG1-OE2 3.35Å; I314-E316 VanDerWaalsContact C-N 3.28Å; I314-E316 PolarHBondContact O-N 3.39Å; E316-L318 VanDerWaalsContact C-N 3.27Å; E316-L318 PolarHBondContact O-N 2.99Å; E316-P319 WeakPolarHBondContact O-CD 3.25Å
317	G	66.8	Low	74.9	Confident	24 Å²	24	23.3 Å²	23.3	25%	0.247	15%	0.148	C	C	.	.	H	α-helix	trans	-68.9	-18.3	173	0	0	0	0	0	114.6	P315 V320 I321	P315-G317 PolarHBondContact O-N 3.39Å; P315-G317 VanDerWaalsContact O-N 3.15Å; G317-V320 WeakPolarHBondContact O-CB 3.48Å; G317-V320 PolarHBondContact O-N 3.45Å; G317-I321 VanDerWaalsContact O-CG1 3.25Å; G317-I321 WeakPolarHBondContact O-CG1 3.32Å; G317-I321 PolarHBondContact O-N 3.39Å
318	L	76.6	Confident	75.5	Confident	12 Å²	12	26 Å²	26	6%	0.063	16%	0.162	C	C	.	.	H	α-helix	trans	-60.8	-50.4	-171.6	-166.3	164.8	0	0	0	112.8	M270 L273 P315 E316 V320 I321 V322 F761 V762	M270-L318 HydrophobicContact SD-CD2 3.42Å; M270-L318 WeakPolarHBondContact SD-CD2 3.39Å; L273-L318 HydrophobicContact CD2-CD1 4.19Å; P315-L318 HydrophobicContact CB-CB 4.08Å; P315-L318 HydrophobicContact CB-CD1 4.39Å; P315-L318 HydrophobicContact CG-CB 4.09Å; P315-L318 HydrophobicContact CG-CD1 3.77Å; P315-L318 WeakPolarHBondContact O-CB 3.33Å; P315-L318 PolarHBondContact O-N 3.13Å; E316-L318 VanDerWaalsContact C-N 3.27Å; E316-L318 PolarHBondContact O-N 2.99Å; L318-V320 VanDerWaalsContact C-N 3.27Å; L318-V320 PolarHBondContact O-N 3.44Å; L318-I321 PolarHBondContact O-N 3.45Å; L318-V322 HydrophobicContact CD2-CG2 3.83Å; L318-V322 WeakPolarHBondContact O-CG2 3.25Å; L318-V322 PolarHBondContact O-N 3.37Å; L318-F761 HydrophobicContact CG-CE2 4.32Å; L318-V762 HydrophobicContact CD1-CG1 4.39Å; L318-V762 HydrophobicContact CD1-CG2 3.83Å; L318-V762 HydrophobicContact CD2-CG2 4.26Å; L318-V762 HydrophobicContact CG-CG2 3.97Å
319	P	73.7	Confident	76.3	Confident	80 Å²	80	24.3 Å²	24.3	52%	0.519	15%	0.151	S	C	.	.	H	α-helix	trans	-61.5	-35	177.2	-22.3	35.5	0	0	0	112.9	E316 T323	E316-P319 WeakPolarHBondContact O-CD 3.25Å; P319-T323 WeakPolarHBondContact O-CB 3.41Å; P319-T323 PolarHBondContact O-N 3.12Å; P319-T323 PolarHBondContact O-OG1 2.67Å
320	V	74.5	Confident	76.9	Confident	29 Å²	29	25.2 Å²	25.2	18%	0.176	16%	0.156	C	C	.	.	H	α-helix	trans	-62.7	-48.1	177	-171.8	0	0	0	0	110.3	Q127 G317 L318 T323 V324	Q127-V320 HydrophobicContact CB-CG1 4.43Å; Q127-V320 VanDerWaalsContact CD-CG1 3.42Å; Q127-V320 HydrophobicContact CG-CG1 4.11Å; Q127-V320 VanDerWaalsContact OE1-CG1 3.31Å; G317-V320 WeakPolarHBondContact O-CB 3.48Å; G317-V320 PolarHBondContact O-N 3.45Å; L318-V320 VanDerWaalsContact C-N 3.27Å; L318-V320 PolarHBondContact O-N 3.44Å; V320-T323 WeakPolarHBondContact O-CB 3.35Å; V320-T323 PolarHBondContact O-N 3.45Å; V320-V324 WeakPolarHBondContact O-CG2 3.44Å; V320-V324 PolarHBondContact O-N 3.03Å
321	I	81.1	Confident	77.5	Confident	2 Å²	2	29 Å²	29	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-72.7	-36.5	-176.6	-61.5	-178.9	0	0	0	111.2	G317 L318 T323 T325 F761 A805 Q806	G317-I321 VanDerWaalsContact O-CG1 3.25Å; G317-I321 WeakPolarHBondContact O-CG1 3.32Å; G317-I321 PolarHBondContact O-N 3.39Å; L318-I321 PolarHBondContact O-N 3.45Å; I321-T323 VanDerWaalsContact C-N 3.32Å; I321-T323 PolarHBondContact O-N 3.08Å; I321-T325 VanDerWaalsContact O-CB 3.26Å; I321-T325 WeakPolarHBondContact O-CB 3.33Å; I321-T325 PolarHBondContact O-N 3.15Å; I321-T325 PolarHBondContact O-OG1 3.07Å; I321-F761 HydrophobicContact CB-CD2 4.45Å; I321-F761 HydrophobicContact CB-CE2 3.93Å; I321-F761 HydrophobicContact CB-CZ 3.97Å; I321-F761 HydrophobicContact CG2-CD1 3.85Å; I321-F761 HydrophobicContact CG2-CD2 3.85Å; I321-F761 HydrophobicContact CG2-CE1 3.61Å; I321-F761 HydrophobicContact CG2-CE2 3.65Å; I321-F761 HydrophobicContact CG2-CG 3.98Å; I321-F761 HydrophobicContact CG2-CZ 3.53Å; I321-A805 HydrophobicContact CD1-CB 3.45Å; I321-A805 VanDerWaalsContact CD1-CB 3.45Å; I321-Q806 HydrophobicContact CB-CG 4.47Å; I321-Q806 HydrophobicContact CD1-CG 3.99Å; I321-Q806 HydrophobicContact CG1-CG 3.67Å; I321-Q806 HydrophobicContact CG2-CG 4.26Å
322	V	85.2	Confident	78.4	Confident	12 Å²	12	31.6 Å²	31.6	7%	0.073	18%	0.183	C	C	.	.	H	α-helix	trans	-54.7	-50.5	166.7	168.7	0	0	0	0	110	L266 M270 L318 T325 L326 I758 F761	L266-V322 HydrophobicContact CD2-CG1 3.86Å; M270-V322 HydrophobicContact SD-CG2 4.35Å; L318-V322 HydrophobicContact CD2-CG2 3.83Å; L318-V322 WeakPolarHBondContact O-CG2 3.25Å; L318-V322 PolarHBondContact O-N 3.37Å; V322-T325 PolarHBondContact O-N 3.1Å; V322-L326 HydrophobicContact CG1-CD1 3.58Å; V322-L326 HydrophobicContact CG1-CG 4.27Å; V322-L326 VanDerWaalsContact O-CG 3.25Å; V322-L326 WeakPolarHBondContact O-CG 3.27Å; V322-L326 PolarHBondContact O-N 3.46Å; V322-I758 HydrophobicContact CG2-CG2 4.2Å; V322-F761 HydrophobicContact CB-CZ 4.49Å; V322-F761 HydrophobicContact CG2-CE2 4.4Å; V322-F761 HydrophobicContact CG2-CZ 3.72Å
323	T	81.9	Confident	79.3	Confident	43 Å²	43	31.3 Å²	31.3	26%	0.264	18%	0.18	S	C	.	.	H	α-helix	trans	-62.9	-46.1	-176.6	-60.1	0	0	0	0	112.3	P319 V320 I321 T325 L326 A327 L343	P319-T323 WeakPolarHBondContact O-CB 3.41Å; P319-T323 PolarHBondContact O-N 3.12Å; P319-T323 PolarHBondContact O-OG1 2.67Å; V320-T323 WeakPolarHBondContact O-CB 3.35Å; V320-T323 PolarHBondContact O-N 3.45Å; I321-T323 VanDerWaalsContact C-N 3.32Å; I321-T323 PolarHBondContact O-N 3.08Å; T323-T325 PolarHBondContact O-N 3.22Å; T323-L326 PolarHBondContact O-N 3.24Å; T323-A327 WeakPolarHBondContact O-CB 3.47Å; T323-A327 PolarHBondContact O-N 3.07Å; T323-L343 HydrophobicContact CG2-CD1 3.9Å
324	V	81.7	Confident	80.1	Confident	54 Å²	54	33.5 Å²	33.5	33%	0.327	20%	0.198	S	C	.	.	H	α-helix	trans	-62.6	-41.7	175.5	171.6	0	0	0	0	111.4	V320 A327 L328	V320-V324 WeakPolarHBondContact O-CG2 3.44Å; V320-V324 PolarHBondContact O-N 3.03Å; V324-A327 PolarHBondContact O-N 2.88Å; V324-L328 HydrophobicContact CG1-CD1 4.07Å; V324-L328 WeakPolarHBondContact O-CG 3.44Å; V324-L328 PolarHBondContact O-N 2.87Å
325	T	85.4	Confident	81	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-46.7	178.5	-58.5	0	0	0	0	111.4	I321 V322 T323 L328 G329 I754 I758 G809	I321-T325 VanDerWaalsContact O-CB 3.26Å; I321-T325 WeakPolarHBondContact O-CB 3.33Å; I321-T325 PolarHBondContact O-N 3.15Å; I321-T325 PolarHBondContact O-OG1 3.07Å; V322-T325 PolarHBondContact O-N 3.1Å; T323-T325 PolarHBondContact O-N 3.22Å; T325-L328 PolarHBondContact O-N 3.27Å; T325-G329 PolarHBondContact O-N 2.96Å; T325-I754 HydrophobicContact CG2-CG2 4.2Å; T325-I758 HydrophobicContact CG2-CG1 4.07Å; T325-G809 WeakPolarHBondContact CG2-O 3.33Å; T325-G809 WeakPolarHBondContact OG1-CA 3.35Å
326	L	88.6	Confident	81.6	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-64.1	-42.4	177	-65.1	165.1	0	0	0	111.6	L266 V322 T323 L328 G329 V330 L343 V346 I754 I758	L266-L326 HydrophobicContact CD2-CD1 3.92Å; L266-L326 HydrophobicContact CD2-CD2 4.1Å; L266-L326 HydrophobicContact CD2-CG 4.47Å; V322-L326 HydrophobicContact CG1-CD1 3.58Å; V322-L326 HydrophobicContact CG1-CG 4.27Å; V322-L326 VanDerWaalsContact O-CG 3.25Å; V322-L326 WeakPolarHBondContact O-CG 3.27Å; V322-L326 PolarHBondContact O-N 3.46Å; T323-L326 PolarHBondContact O-N 3.24Å; L326-L328 PolarHBondContact O-N 3.29Å; L326-G329 CarbonylContact O-C 3.52Å; L326-G329 VanDerWaalsContact O-CA 3.31Å; L326-G329 WeakPolarHBondContact O-CA 3.48Å; L326-G329 PolarHBondContact O-N 2.91Å; L326-V330 PolarHBondContact O-N 2.91Å; L326-L343 HydrophobicContact CB-CB 3.98Å; L326-L343 HydrophobicContact CD1-CB 4.3Å; L326-L343 WeakPolarHBondContact CD2-O 3.34Å; L326-V346 HydrophobicContact CD2-CB 3.99Å; L326-V346 HydrophobicContact CD2-CG1 4.32Å; L326-I754 HydrophobicContact CD2-CG2 3.9Å; L326-I758 HydrophobicContact CD2-CD1 4.34Å
327	A	85.6	Confident	82.6	Confident	32 Å²	32	48 Å²	48	26%	0.264	25%	0.252	S	S	.	.	H	α-helix	trans	-62.8	-41.8	177.9	0	0	0	0	0	112.6	T323 V324 G329 V330 I331 L343	T323-A327 WeakPolarHBondContact O-CB 3.47Å; T323-A327 PolarHBondContact O-N 3.07Å; V324-A327 PolarHBondContact O-N 2.88Å; A327-G329 VanDerWaalsContact C-N 3.25Å; A327-G329 PolarHBondContact O-N 3.46Å; A327-V330 PolarHBondContact O-N 3.33Å; A327-I331 WeakPolarHBondContact O-CG1 3.33Å; A327-I331 PolarHBondContact O-N 3.32Å; A327-L343 HydrophobicContact CB-CD1 4.39Å; A327-L343 HydrophobicContact CB-CD2 4.37Å
328	L	83.7	Confident	83.6	Confident	62 Å²	62	47 Å²	47	33%	0.325	24%	0.241	S	C	.	.	H	α-helix	trans	-63.4	-33.7	171.8	-70.4	171	0	0	0	111.9	V324 T325 L326 I331 R332 V810	V324-L328 HydrophobicContact CG1-CD1 4.07Å; V324-L328 WeakPolarHBondContact O-CG 3.44Å; V324-L328 PolarHBondContact O-N 2.87Å; T325-L328 PolarHBondContact O-N 3.27Å; L326-L328 PolarHBondContact O-N 3.29Å; L328-I331 PolarHBondContact O-N 2.84Å; L328-R332 WeakPolarHBondContact O-CG 3.26Å; L328-R332 PolarHBondContact O-N 3.28Å; L328-R332 VanDerWaalsContact O-N 3.09Å; L328-V810 HydrophobicContact CD1-CG1 4.29Å; L328-V810 HydrophobicContact CD1-CG2 3.7Å
329	G	84.4	Confident	84.1	Confident	1 Å²	1	49 Å²	49	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-50.8	168.9	0	0	0	0	0	113.8	T325 L326 A327 I331 R332 M333 I754	T325-G329 PolarHBondContact O-N 2.96Å; L326-G329 CarbonylContact O-C 3.52Å; L326-G329 VanDerWaalsContact O-CA 3.31Å; L326-G329 WeakPolarHBondContact O-CA 3.48Å; L326-G329 PolarHBondContact O-N 2.91Å; A327-G329 VanDerWaalsContact C-N 3.25Å; A327-G329 PolarHBondContact O-N 3.46Å; G329-I331 VanDerWaalsContact C-N 3.28Å; G329-I331 PolarHBondContact O-N 3.09Å; G329-R332 WeakPolarHBondContact O-CB 3.41Å; G329-R332 PolarHBondContact O-N 3.33Å; G329-M333 WeakPolarHBondContact O-CG 3.43Å; G329-M333 PolarHBondContact O-N 2.96Å; G329-I754 VanDerWaalsContact CA-CD1 3.45Å
330	V	86.6	Confident	84.7	Confident	23 Å²	23	45.4 Å²	45.4	14%	0.139	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-39.9	175.9	-179.9	0	0	0	0	111.1	L326 A327 R332 M333 A334 V340 L343 V346	L326-V330 PolarHBondContact O-N 2.91Å; A327-V330 PolarHBondContact O-N 3.33Å; V330-R332 VanDerWaalsContact C-N 3.3Å; V330-R332 PolarHBondContact O-N 3.43Å; V330-M333 PolarHBondContact O-N 3.12Å; V330-A334 WeakPolarHBondContact O-CB 3.48Å; V330-A334 PolarHBondContact O-N 3.47Å; V330-V340 HydrophobicContact CG1-CB 4.39Å; V330-V340 HydrophobicContact CG2-CB 4.14Å; V330-L343 HydrophobicContact CB-CD2 4.5Å; V330-L343 HydrophobicContact CG2-CD2 3.71Å; V330-V346 HydrophobicContact CG2-CG2 3.51Å
331	I	85	Confident	84.9	Confident	91 Å²	91	47 Å²	47	47%	0.467	23%	0.233	S	C	.	.	H	α-helix	trans	-64.3	-33.5	176.4	-67.8	164.7	0	0	0	111.9	A327 L328 G329 R335	A327-I331 WeakPolarHBondContact O-CG1 3.33Å; A327-I331 PolarHBondContact O-N 3.32Å; L328-I331 PolarHBondContact O-N 2.84Å; G329-I331 VanDerWaalsContact C-N 3.28Å; G329-I331 PolarHBondContact O-N 3.09Å; I331-R335 WeakPolarHBondContact O-CG 3.23Å
332	R	84.9	Confident	84.7	Confident	66 Å²	66	50.5 Å²	50.5	25%	0.249	25%	0.248	C	C	.	.	H	α-helix	trans	-70.5	-44.4	172.4	-69.2	169.6	-178.5	-178	1.4	111.4	L328 G329 V330 A334 R335 E750 V810	L328-R332 WeakPolarHBondContact O-CG 3.26Å; L328-R332 PolarHBondContact O-N 3.28Å; L328-R332 VanDerWaalsContact O-N 3.09Å; G329-R332 WeakPolarHBondContact O-CB 3.41Å; G329-R332 PolarHBondContact O-N 3.33Å; V330-R332 VanDerWaalsContact C-N 3.3Å; V330-R332 PolarHBondContact O-N 3.43Å; R332-A334 PolarHBondContact O-N 2.95Å; R332-R335 WeakPolarHBondContact O-CB 3.27Å; R332-R335 PolarHBondContact O-N 3.27Å; R332-E750 HydrophobicContact CB-CG 4.45Å; R332-E750 WeakPolarHBondContact CD-OE1 3.31Å; R332-E750 IonicContact CZ-OE1 3.88Å; R332-E750 IonicContact NE-OE1 3.54Å; R332-E750 IonicContact NH1-OE1 2.68Å; R332-E750 PolarHBondContact NH1-OE1 3.04Å; R332-V810 PolarHBondContact NH2-O 2.87Å
333	M	86.8	Confident	84.6	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-39.8	176	-69.9	-177.2	179.4	0	0	112.6	G329 V330 R335 N336 R337 V338 V340 V346 L349 A747 E750	G329-M333 WeakPolarHBondContact O-CG 3.43Å; G329-M333 PolarHBondContact O-N 2.96Å; V330-M333 PolarHBondContact O-N 3.12Å; M333-R335 VanDerWaalsContact C-N 3.29Å; M333-R335 PolarHBondContact O-N 3.24Å; M333-N336 CarbonylContact O-C 3.54Å; M333-N336 VanDerWaalsContact O-C 3.29Å; M333-N336 WeakPolarHBondContact O-CA 3.44Å; M333-N336 PolarHBondContact O-N 3.01Å; M333-R337 PolarHBondContact O-N 2.58Å; M333-V338 CarbonylContact C-O 3.53Å; M333-V338 HydrophobicContact CB-CB 4.13Å; M333-V338 HydrophobicContact CB-CG1 4.29Å; M333-V338 PolarHBondContact O-N 3.36Å; M333-V340 HydrophobicContact SD-CG2 3.72Å; M333-V346 HydrophobicContact CE-CG1 3.73Å; M333-V346 HydrophobicContact SD-CG1 4.37Å; M333-V346 HydrophobicContact SD-CG2 4.4Å; M333-L349 HydrophobicContact CE-CD1 3.97Å; M333-L349 HydrophobicContact SD-CD1 4.14Å; M333-A747 HydrophobicContact CE-CB 4.23Å; M333-A747 VanDerWaalsContact CE-O 3.25Å; M333-A747 WeakPolarHBondContact CE-O 3.36Å; M333-A747 HydrophobicContact SD-CB 4.36Å; M333-E750 HydrophobicContact CE-CB 3.84Å; M333-E750 HydrophobicContact CE-CG 4.18Å; M333-E750 HydrophobicContact CG-CG 4.5Å
334	A	87.3	Confident	84.7	Confident	47 Å²	47	50.8 Å²	50.8	39%	0.388	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-33.4	178.4	0	0	0	0	0	113.1	V330 R332 N336 R337 V338	V330-A334 WeakPolarHBondContact O-CB 3.48Å; V330-A334 PolarHBondContact O-N 3.47Å; R332-A334 PolarHBondContact O-N 2.95Å; A334-N336 VanDerWaalsContact C-N 3.25Å; A334-N336 PolarHBondContact O-N 2.86Å; A334-R337 WeakPolarHBondContact O-CA 3.45Å; A334-R337 PolarHBondContact O-N 2.88Å; A334-V338 WeakPolarHBondContact CA-O 3.5Å; A334-V338 PolarHBondContact N-O 3.14Å; A334-V338 VanDerWaalsContact N-O 3.17Å
335	R	85.9	Confident	84.9	Confident	194 Å²	194	48.3 Å²	48.3	73%	0.732	23%	0.234	S	C	*	.	H	α-helix	trans	-64.4	-32.3	172.3	-67.4	170.5	-177.7	-168.9	-1.4	112.1	I331 R332 M333 R337	I331-R335 WeakPolarHBondContact O-CG 3.23Å; R332-R335 WeakPolarHBondContact O-CB 3.27Å; R332-R335 PolarHBondContact O-N 3.27Å; M333-R335 VanDerWaalsContact C-N 3.29Å; M333-R335 PolarHBondContact O-N 3.24Å; R335-R337 PolarHBondContact O-N 3.41Å
336	N	82.8	Confident	85	Confident	86 Å²	86	48.1 Å²	48.1	46%	0.46	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	22.1	173.8	-62.2	-1.5	0	0	0	111.9	M333 A334 V338 S746	M333-N336 CarbonylContact O-C 3.54Å; M333-N336 VanDerWaalsContact O-C 3.29Å; M333-N336 WeakPolarHBondContact O-CA 3.44Å; M333-N336 PolarHBondContact O-N 3.01Å; A334-N336 VanDerWaalsContact C-N 3.25Å; A334-N336 PolarHBondContact O-N 2.86Å; N336-V338 VanDerWaalsContact C-N 3.26Å; N336-V338 PolarHBondContact O-N 3.35Å; N336-S746 PolarHBondContact ND2-OG 3.33Å
337	R	86.6	Confident	85	Confident	141 Å²	141	48 Å²	48	53%	0.532	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	24.8	175.5	-54	-171.1	-175.9	-162.1	1.4	115.3	M333 A334 R335 L737 N738	M333-R337 PolarHBondContact O-N 2.58Å; A334-R337 WeakPolarHBondContact O-CA 3.45Å; A334-R337 PolarHBondContact O-N 2.88Å; R335-R337 PolarHBondContact O-N 3.41Å; R337-L737 HydrophobicContact CB-CB 4.28Å; R337-L737 WeakPolarHBondContact O-CB 3.26Å; R337-L737 PolarHBondContact O-N 3.1Å; R337-L737 VanDerWaalsContact O-N 3.12Å; R337-N738 VanDerWaalsContact CD-CG 3.44Å; R337-N738 WeakPolarHBondContact CD-OD1 3.38Å; R337-N738 PolarHBondContact NH1-OD1 3.28Å
338	V	87.4	Confident	85.2	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.2	171.8	175.6	0	0	0	0	109.8	M333 A334 N336 V340 M734 L736 A743	M333-V338 CarbonylContact C-O 3.53Å; M333-V338 HydrophobicContact CB-CB 4.13Å; M333-V338 HydrophobicContact CB-CG1 4.29Å; M333-V338 PolarHBondContact O-N 3.36Å; A334-V338 WeakPolarHBondContact CA-O 3.5Å; A334-V338 PolarHBondContact N-O 3.14Å; A334-V338 VanDerWaalsContact N-O 3.17Å; N336-V338 VanDerWaalsContact C-N 3.26Å; N336-V338 PolarHBondContact O-N 3.35Å; V338-V340 HydrophobicContact CG1-CG2 4.04Å; V338-M734 HydrophobicContact CG1-CE 3.61Å; V338-M734 HydrophobicContact CG1-CG 3.68Å; V338-M734 HydrophobicContact CG1-SD 3.66Å; V338-M734 HydrophobicContact CG2-CE 4.28Å; V338-L736 HydrophobicContact CG2-CD2 4.12Å; V338-A743 HydrophobicContact CG2-CB 3.62Å
339	I	87.6	Confident	85.5	Confident	54 Å²	54	43.6 Å²	43.6	28%	0.277	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	133.6	168.9	-63.1	-177.3	0	0	0	108.5	M734 I735 L737	I339-M734 CarbonylContact O-C 3.54Å; I339-M734 VanDerWaalsContact O-CA 3.27Å; I339-M734 WeakPolarHBondContact O-CA 3.48Å; I339-I735 HydrophobicContact CB-CB 4.45Å; I339-I735 PolarHBondContact N-O 3Å; I339-I735 PolarHBondContact O-N 2.82Å; I339-L737 HydrophobicContact CD1-CD1 4.03Å; I339-L737 HydrophobicContact CD1-CD2 3.8Å; I339-L737 HydrophobicContact CD1-CG 4.12Å; I339-L737 HydrophobicContact CG1-CD1 4.03Å; I339-L737 HydrophobicContact CG1-CD2 4.36Å; I339-L737 HydrophobicContact CG1-CG 4.15Å
340	V	85.7	Confident	85.6	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.03	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127	170.2	-174.5	0	0	0	0	108.5	V330 M333 V338 K342 T345 V346 D733 M734	V330-V340 HydrophobicContact CG1-CB 4.39Å; V330-V340 HydrophobicContact CG2-CB 4.14Å; M333-V340 HydrophobicContact SD-CG2 3.72Å; V338-V340 HydrophobicContact CG1-CG2 4.04Å; V340-K342 WeakPolarHBondContact CG1-O 3.41Å; V340-T345 HydrophobicContact CG1-CG2 4.47Å; V340-V346 HydrophobicContact CB-CG2 4.37Å; V340-V346 HydrophobicContact CG1-CG2 4Å; V340-D733 CarbonylContact C-O 3.55Å; V340-M734 HydrophobicContact CG2-CB 4.48Å; V340-M734 HydrophobicContact CG2-CG 4.27Å; V340-M734 HydrophobicContact CG2-SD 4.41Å
341	K	78.5	Confident	85.7	Confident	62 Å²	62	42.7 Å²	42.7	27%	0.27	20%	0.2	S	C	.	.	S	Bend	trans	-83.3	-39.1	-176.3	-60.7	-172.9	-171.9	166	0	113.8	L135 R729 E730 A732 D733	L135-K341 WeakPolarHBondContact CD2-O 3.5Å; K341-R729 WeakPolarHBondContact CE-O 3.15Å; K341-R729 PolarHBondContact NZ-O 2.78Å; K341-E730 VanDerWaalsContact NZ-C 3.26Å; K341-E730 PolarHBondContact NZ-O 3.06Å; K341-A732 WeakPolarHBondContact CD-O 3.33Å; K341-A732 WeakPolarHBondContact CE-O 3.5Å; K341-A732 PolarHBondContact NZ-O 2.92Å; K341-D733 PolarHBondContact N-O 3.17Å
342	K	77.5	Confident	86	Confident	75 Å²	75	38.4 Å²	38.4	33%	0.326	18%	0.178	S	C	.	.	S	Bend	trans	-105.7	116	-178.1	-67.3	-177.3	-168.2	154.1	0	108.8	S261 V340 P344 T345 D733	S261-K342 PolarHBondContact OG-NZ 3.08Å; V340-K342 WeakPolarHBondContact CG1-O 3.41Å; K342-P344 VanDerWaalsContact C-CD 3.44Å; K342-P344 VanDerWaalsContact C-N 3.32Å; K342-T345 WeakPolarHBondContact CB-OG1 3.35Å; K342-T345 WeakPolarHBondContact O-CB 3.31Å; K342-T345 PolarHBondContact O-N 3.42Å; K342-T345 VanDerWaalsContact O-N 3.12Å; K342-D733 WeakPolarHBondContact CD-OD1 3.5Å; K342-D733 WeakPolarHBondContact CE-OD1 3.49Å; K342-D733 IonicContact NZ-OD1 2.64Å; K342-D733 PolarHBondContact NZ-OD1 3.09Å
343	L	82.8	Confident	86.2	Confident	28 Å²	28	36.8 Å²	36.8	15%	0.147	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-41.5	179.7	-58.3	-177.4	0	0	0	113.5	T323 L326 A327 V330 T345 V346	T323-L343 HydrophobicContact CG2-CD1 3.9Å; L326-L343 HydrophobicContact CB-CB 3.98Å; L326-L343 HydrophobicContact CD1-CB 4.3Å; L326-L343 WeakPolarHBondContact CD2-O 3.34Å; A327-L343 HydrophobicContact CB-CD1 4.39Å; A327-L343 HydrophobicContact CB-CD2 4.37Å; V330-L343 HydrophobicContact CB-CD2 4.5Å; V330-L343 HydrophobicContact CG2-CD2 3.71Å; L343-T345 VanDerWaalsContact C-N 3.31Å; L343-T345 PolarHBondContact O-N 3.49Å; L343-V346 WeakPolarHBondContact O-CB 3.41Å; L343-V346 VanDerWaalsContact O-CG2 3.27Å; L343-V346 WeakPolarHBondContact O-CG2 3.25Å; L343-V346 PolarHBondContact O-N 2.92Å
344	P	84.1	Confident	86.4	Confident	33 Å²	33	36.6 Å²	36.6	21%	0.214	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-23.9	-179.1	-23.1	36.2	0	0	0	115.4	T264 Q267 K342 V346 E347 T348	T264-P344 HydrophobicContact CG2-CB 3.89Å; T264-P344 WeakPolarHBondContact OG1-CB 3.27Å; Q267-P344 HydrophobicContact CG-CB 4.47Å; K342-P344 VanDerWaalsContact C-CD 3.44Å; K342-P344 VanDerWaalsContact C-N 3.32Å; P344-V346 PolarHBondContact O-N 3.41Å; P344-E347 PolarHBondContact O-N 3.5Å; P344-T348 PolarHBondContact O-OG1 2.98Å
345	T	85.4	Confident	86.7	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-62.7	-23.8	179.1	-58.5	0	0	0	0	112.2	V340 K342 L343 E347 T348 L349 I716 D733	V340-T345 HydrophobicContact CG1-CG2 4.47Å; K342-T345 WeakPolarHBondContact CB-OG1 3.35Å; K342-T345 WeakPolarHBondContact O-CB 3.31Å; K342-T345 PolarHBondContact O-N 3.42Å; K342-T345 VanDerWaalsContact O-N 3.12Å; L343-T345 VanDerWaalsContact C-N 3.31Å; L343-T345 PolarHBondContact O-N 3.49Å; T345-E347 VanDerWaalsContact C-N 3.26Å; T345-E347 PolarHBondContact O-N 3.01Å; T345-T348 WeakPolarHBondContact O-CB 3.41Å; T345-T348 PolarHBondContact O-N 3.47Å; T345-L349 PolarHBondContact O-N 3.24Å; T345-I716 HydrophobicContact CG2-CB 4.37Å; T345-I716 HydrophobicContact CG2-CG1 4.19Å; T345-I716 HydrophobicContact CG2-CG2 3.69Å; T345-D733 HydrophobicContact CG2-CB 3.84Å
346	V	88	Confident	87.1	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-56.7	-36.6	174.9	178.4	0	0	0	0	112.5	L326 V330 M333 V340 L343 P344 G751 I754	L326-V346 HydrophobicContact CD2-CB 3.99Å; L326-V346 HydrophobicContact CD2-CG1 4.32Å; V330-V346 HydrophobicContact CG2-CG2 3.51Å; M333-V346 HydrophobicContact CE-CG1 3.73Å; M333-V346 HydrophobicContact SD-CG1 4.37Å; M333-V346 HydrophobicContact SD-CG2 4.4Å; V340-V346 HydrophobicContact CB-CG2 4.37Å; V340-V346 HydrophobicContact CG1-CG2 4Å; L343-V346 WeakPolarHBondContact O-CB 3.41Å; L343-V346 VanDerWaalsContact O-CG2 3.27Å; L343-V346 WeakPolarHBondContact O-CG2 3.25Å; L343-V346 PolarHBondContact O-N 2.92Å; P344-V346 PolarHBondContact O-N 3.41Å; V346-G751 WeakPolarHBondContact O-CA 3.41Å; V346-I754 HydrophobicContact CG1-CD1 3.37Å
347	E	88.8	Confident	87.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-77.8	-35.3	174.3	179.3	-93.8	-174.2	0	0	112	P265 L266 P344 T345 L349 G350 Y755 R823	P265-E347 WeakPolarHBondContact CB-OE2 3.28Å; L266-E347 HydrophobicContact CB-CB 4.05Å; L266-E347 HydrophobicContact CB-CG 3.91Å; L266-E347 WeakPolarHBondContact CB-OE2 3.5Å; L266-E347 HydrophobicContact CD2-CB 4.05Å; L266-E347 HydrophobicContact CD2-CG 4.42Å; L266-E347 PolarHBondContact N-OE1 3.4Å; L266-E347 PolarHBondContact N-OE2 3.31Å; P344-E347 PolarHBondContact O-N 3.5Å; T345-E347 VanDerWaalsContact C-N 3.26Å; T345-E347 PolarHBondContact O-N 3.01Å; E347-L349 VanDerWaalsContact C-N 3.26Å; E347-L349 PolarHBondContact O-N 3.43Å; E347-G350 PolarHBondContact O-N 3.12Å; E347-Y755 HydrophobicContact CG-CD2 4.06Å; E347-R823 IonicContact OE1-NH1 2.75Å; E347-R823 PolarHBondContact OE1-NH1 3.34Å
348	T	89.7	Confident	87.8	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-61.8	-37.1	179.4	-42.8	0	0	0	0	111.1	T264 P265 P344 T345 G350 C351 V352 I697 D715 I716	T264-T348 WeakPolarHBondContact CB-OG1 3.46Å; P265-T348 WeakPolarHBondContact CD-OG1 3.48Å; P265-T348 HydrophobicContact CG-CG2 4.16Å; P344-T348 PolarHBondContact O-OG1 2.98Å; T345-T348 WeakPolarHBondContact O-CB 3.41Å; T345-T348 PolarHBondContact O-N 3.47Å; T348-G350 PolarHBondContact O-N 3.04Å; T348-C351 WeakPolarHBondContact O-CA 3.47Å; T348-C351 PolarHBondContact O-N 3.13Å; T348-V352 PolarHBondContact O-N 3.39Å; T348-I697 HydrophobicContact CG2-CG2 3.67Å; T348-D715 HydrophobicContact CG2-CB 4.09Å; T348-I716 HydrophobicContact CG2-CD1 3.89Å; T348-I716 HydrophobicContact CG2-CG1 3.62Å
349	L	89.6	Confident	87.8	Confident	1 Å²	1	15.1 Å²	15.1	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-54.7	-33.4	171.8	-76.3	163.7	0	0	0	113	M333 T345 E347 C351 I716 M734 A747 I748	M333-L349 HydrophobicContact CE-CD1 3.97Å; M333-L349 HydrophobicContact SD-CD1 4.14Å; T345-L349 PolarHBondContact O-N 3.24Å; E347-L349 VanDerWaalsContact C-N 3.26Å; E347-L349 PolarHBondContact O-N 3.43Å; L349-C351 VanDerWaalsContact C-N 3.28Å; L349-C351 PolarHBondContact O-N 3.33Å; L349-I716 HydrophobicContact CB-CD1 4.26Å; L349-I716 HydrophobicContact CD2-CD1 3.7Å; L349-I716 HydrophobicContact CD2-CG2 4.21Å; L349-I716 HydrophobicContact CG-CD1 3.8Å; L349-M734 HydrophobicContact CD1-SD 3.78Å; L349-M734 HydrophobicContact CD2-SD 3.77Å; L349-M734 HydrophobicContact CG-SD 4.4Å; L349-A747 HydrophobicContact CD1-CB 3.99Å; L349-A747 HydrophobicContact CD2-CB 4.36Å; L349-I748 WeakPolarHBondContact O-CG1 3.4Å
350	G	87.3	Confident	87.6	Confident	4 Å²	4	13.3 Å²	13.3	4%	0.041	7%	0.068	C	C	.	.	H	α-helix	trans	-74.8	-15.7	175.6	0	0	0	0	0	114.6	E347 T348 K752	E347-G350 PolarHBondContact O-N 3.12Å; T348-G350 PolarHBondContact O-N 3.04Å; G350-K752 WeakPolarHBondContact O-CE 3.44Å; G350-K752 WeakPolarHBondContact O-CG 3.45Å
351	C	88.2	Confident	87.3	Confident	1 Å²	1	13 Å²	13	1%	0.007	7%	0.066	C	C	.	.	H	α-helix	trans	-104.2	-8.7	-175.8	-59.8	0	0	0	0	114.2	T348 L349 N353 I697 V825	T348-C351 WeakPolarHBondContact O-CA 3.47Å; T348-C351 PolarHBondContact O-N 3.13Å; L349-C351 VanDerWaalsContact C-N 3.28Å; L349-C351 PolarHBondContact O-N 3.33Å; C351-N353 PolarHBondContact O-N 2.86Å; C351-N353 PolarHBondContact O-OD1 2.67Å; C351-I697 HydrophobicContact CB-CG1 4.09Å; C351-I697 HydrophobicContact CB-CG2 4.48Å; C351-V825 HydrophobicContact CB-CG2 4.02Å
352	V	90.5	Very high	87.7	Confident	2 Å²	2	10.1 Å²	10.1	1%	0.012	5%	0.054	C	C	.	.			trans	-50.9	123.8	-176.8	179.9	0	0	0	0	111.8	T348 V354 I355 V590 I697 A699 I716 P822	T348-V352 PolarHBondContact O-N 3.39Å; V352-V354 WeakPolarHBondContact CG1-O 3.43Å; V352-I355 HydrophobicContact CG1-CG1 3.89Å; V352-V590 HydrophobicContact CG1-CG1 4.15Å; V352-V590 WeakPolarHBondContact O-CG2 3.5Å; V352-I697 HydrophobicContact CG2-CG2 4.22Å; V352-A699 HydrophobicContact CG1-CB 3.87Å; V352-A699 HydrophobicContact CG2-CB 4.05Å; V352-I716 HydrophobicContact CG2-CD1 3.35Å; V352-I716 HydrophobicContact CG2-CG1 4.47Å; V352-P822 VanDerWaalsContact O-CB 3.27Å; V352-P822 WeakPolarHBondContact O-CB 3.44Å; V352-P822 WeakPolarHBondContact O-CG 3.38Å
353	N	89.4	Confident	88.2	Confident	31 Å²	31	6.6 Å²	6.6	17%	0.166	4%	0.038	C	C	.	.			trans	-100.3	-31.6	175.2	-50.6	112.3	0	0	0	111.9	C351 K591 F696 I697	C351-N353 PolarHBondContact O-N 2.86Å; C351-N353 PolarHBondContact O-OD1 2.67Å; N353-K591 PolarHBondContact O-N 3.19Å; N353-F696 HydrophobicContact CB-CB 4.05Å; N353-F696 HydrophobicContact CB-CD1 3.6Å; N353-F696 HydrophobicContact CB-CE1 4.48Å; N353-F696 HydrophobicContact CB-CG 4.19Å; N353-I697 PolarHBondContact N-O 3.36Å; N353-I697 PolarHBondContact OD1-N 3.49Å
354	V	91.6	Very high	88.4	Confident	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	132.6	-177	-171.4	0	0	0	0	110	V352 K591 K593 L658 F696 I697 V698 A699	V352-V354 WeakPolarHBondContact CG1-O 3.43Å; V354-K591 CarbonylContact C-O 3.51Å; V354-K591 WeakPolarHBondContact CA-O 3.43Å; V354-K591 HydrophobicContact CG1-CB 4.45Å; V354-K591 HydrophobicContact CG2-CB 4.33Å; V354-K593 HydrophobicContact CG1-CD 3.82Å; V354-K593 HydrophobicContact CG1-CG 4.23Å; V354-L658 HydrophobicContact CG1-CD1 4.19Å; V354-F696 HydrophobicContact CG2-CB 4.02Å; V354-F696 HydrophobicContact CG2-CD2 4.23Å; V354-F696 HydrophobicContact CG2-CG 4.03Å; V354-I697 PolarHBondContact N-O 2.9Å; V354-V698 WeakPolarHBondContact O-CA 3.19Å; V354-A699 PolarHBondContact O-N 3.47Å
355	I	93.5	Very high	88.3	Confident	1 Å²	1	6 Å²	6	1%	0.005	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	115.6	166.1	-55.8	-177.5	0	0	0	108.4	V352 V585 V590 K591 V592 K593 A699 F741 I744	V352-I355 HydrophobicContact CG1-CG1 3.89Å; I355-V585 HydrophobicContact CD1-CG1 3.88Å; I355-V590 HydrophobicContact CD1-CG1 4.21Å; I355-V590 HydrophobicContact CG1-CG1 3.85Å; I355-K591 PolarHBondContact N-O 3.41Å; I355-V592 WeakPolarHBondContact O-CA 3.47Å; I355-K593 PolarHBondContact O-N 2.93Å; I355-A699 WeakPolarHBondContact CA-O 3.33Å; I355-A699 HydrophobicContact CG1-CB 4.35Å; I355-F741 HydrophobicContact CG2-CZ 4.43Å; I355-I744 HydrophobicContact CD1-CG2 4.11Å
356	C	94.3	Very high	88	Confident	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.8	164.5	-72.3	0	0	0	0	108.8	K593 I595 L658 A699 M700 T701	C356-K593 WeakPolarHBondContact CA-O 3.2Å; C356-I595 HydrophobicContact CB-CD1 4.03Å; C356-L658 VanDerWaalsContact SG-CD1 3.57Å; C356-A699 PolarHBondContact N-O 3.19Å; C356-M700 CarbonylContact O-C 3.59Å; C356-M700 VanDerWaalsContact O-CA 3.29Å; C356-M700 WeakPolarHBondContact O-CA 3.09Å; C356-T701 PolarHBondContact O-N 3.22Å; C356-T701 PolarHBondContact O-OG1 3.07Å; C356-T701 VanDerWaalsContact O-OG1 3.13Å
357	S	93	Very high	87.8	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.4	-173.9	-157.5	0	0	0	0	110.9	L363 K593 M594 I595 T701	S357-L363 WeakPolarHBondContact OG-CG 3.27Å; S357-K593 PolarHBondContact N-O 3.43Å; S357-M594 CarbonylContact O-C 3.57Å; S357-M594 WeakPolarHBondContact O-CA 3.5Å; S357-I595 PolarHBondContact O-N 2.7Å; S357-T701 WeakPolarHBondContact CA-OG1 3.5Å; S357-T701 WeakPolarHBondContact CB-OG1 3.47Å; S357-T701 PolarHBondContact OG-OG1 3.26Å
358	D	91	Very high	87.8	Confident	7 Å²	7	11.2 Å²	11.2	4%	0.037	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	151.1	164.5	-161.2	85.7	0	0	0	110.4	T360 T362 L363 I595 K651 T701	D358-T360 PolarHBondContact OD2-N 3.05Å; D358-T362 VanDerWaalsContact O-CB 3.32Å; D358-T362 WeakPolarHBondContact O-CB 3.18Å; D358-T362 WeakPolarHBondContact O-CG2 3.48Å; D358-L363 WeakPolarHBondContact O-CG 3.49Å; D358-I595 CarbonylContact C-O 3.57Å; D358-I595 VanDerWaalsContact CA-O 3.3Å; D358-I595 WeakPolarHBondContact CA-O 3.02Å; D358-K651 WeakPolarHBondContact OD1-CE 3.41Å; D358-K651 IonicContact OD1-NZ 3.19Å; D358-K651 PolarHBondContact OD1-NZ 3.43Å; D358-T701 PolarHBondContact N-O 3.34Å
359	K	87.3	Confident	87.8	Confident	11 Å²	11	11.4 Å²	11.4	5%	0.048	6%	0.058	C	C	.	.	I	π-helix	trans	-78	-56.3	174.1	-175.1	-127.3	58.5	-164.6	0	112	L363 T364 M594 I595 D598 V606	K359-L363 PolarHBondContact O-N 3.05Å; K359-T364 HydrophobicContact CD-CG2 4.1Å; K359-T364 HydrophobicContact CG-CG2 3.99Å; K359-T364 PolarHBondContact O-N 3.35Å; K359-T364 PolarHBondContact O-OG1 2.77Å; K359-M594 HydrophobicContact CB-CG 4.1Å; K359-M594 HydrophobicContact CB-SD 3.95Å; K359-M594 HydrophobicContact CG-CE 4.27Å; K359-M594 HydrophobicContact CG-SD 4.07Å; K359-I595 PolarHBondContact N-O 3.09Å; K359-I595 VanDerWaalsContact N-O 3.11Å; K359-D598 WeakPolarHBondContact CD-OD2 3.06Å; K359-D598 VanDerWaalsContact CE-OD2 3.32Å; K359-D598 WeakPolarHBondContact CE-OD2 3.42Å; K359-D598 VanDerWaalsContact NZ-CG 3.28Å; K359-D598 IonicContact NZ-OD1 2.69Å; K359-D598 PolarHBondContact NZ-OD1 2.85Å; K359-D598 IonicContact NZ-OD2 3.56Å; K359-D598 PolarHBondContact NZ-OD2 3.39Å; K359-V606 HydrophobicContact CD-CG1 4.26Å; K359-V606 HydrophobicContact CD-CG2 4.32Å; K359-V606 HydrophobicContact CG-CG1 3.92Å
360	T	82.7	Confident	87.8	Confident	15 Å²	15	11.5 Å²	11.5	9%	0.092	6%	0.059	C	C	.	.	I	π-helix	trans	-69.5	130	-168.1	-60.7	0	0	0	0	109.8	T199 D358 T362 T364 N366	T199-T360 HydrophobicContact CG2-CG2 3.53Å; D358-T360 PolarHBondContact OD2-N 3.05Å; T360-T362 PolarHBondContact O-N 3.45Å; T360-T364 WeakPolarHBondContact CA-OG1 3.44Å; T360-N366 HydrophobicContact CG2-CB 4.46Å
361	G	79.5	Confident	88	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.067	C	C	.	.	I	π-helix	trans	65.3	-16.7	177.8	0	0	0	0	0	116.1	T364 R575 D703 T723	G361-T364 CarbonylContact C-O 3.51Å; G361-T364 VanDerWaalsContact CA-O 3.26Å; G361-T364 WeakPolarHBondContact CA-O 3.42Å; G361-T364 PolarHBondContact N-O 3.48Å; G361-T364 PolarHBondContact N-OG1 2.94Å; G361-R575 PolarHBondContact O-NE 2.99Å; G361-R575 VanDerWaalsContact O-NE 3.13Å; G361-R575 PolarHBondContact O-NH2 2.69Å; G361-D703 WeakPolarHBondContact CA-OD2 3.11Å; G361-T723 PolarHBondContact O-OG1 2.81Å
362	T	86.4	Confident	88.1	Confident	1 Å²	1	16 Å²	16	1%	0.006	8%	0.078	C	C	.	.	I	π-helix	trans	-98.4	-61.2	-179.3	-64.8	0	0	0	0	110.8	D358 T360 R575 G702 D703 M720	D358-T362 VanDerWaalsContact O-CB 3.32Å; D358-T362 WeakPolarHBondContact O-CB 3.18Å; D358-T362 WeakPolarHBondContact O-CG2 3.48Å; T360-T362 PolarHBondContact O-N 3.45Å; T362-R575 WeakPolarHBondContact O-CD 3.41Å; T362-G702 VanDerWaalsContact OG1-CA 3.29Å; T362-G702 WeakPolarHBondContact OG1-CA 3.22Å; T362-D703 PolarHBondContact OG1-N 3.36Å; T362-M720 HydrophobicContact CG2-SD 4.12Å; T362-M720 WeakPolarHBondContact O-CE 3.42Å
363	L	88.8	Confident	88.3	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.078	C	C	.	.	I	π-helix	trans	-87.7	-36.2	173.2	-67.3	171.8	0	0	0	112.3	S357 D358 K359 R575 T578 I582 M594 L610 M612 F741	S357-L363 WeakPolarHBondContact OG-CG 3.27Å; D358-L363 WeakPolarHBondContact O-CG 3.49Å; K359-L363 PolarHBondContact O-N 3.05Å; L363-R575 PolarHBondContact O-N 2.9Å; L363-T578 HydrophobicContact CD2-CG2 3.7Å; L363-I582 HydrophobicContact CD2-CD1 4.11Å; L363-M594 HydrophobicContact CD1-CE 4.14Å; L363-M594 HydrophobicContact CD1-CG 4.24Å; L363-L610 HydrophobicContact CB-CD1 4.06Å; L363-L610 HydrophobicContact CD1-CD1 3.93Å; L363-L610 HydrophobicContact CD2-CD1 4.49Å; L363-L610 HydrophobicContact CG-CD1 4.4Å; L363-M612 HydrophobicContact CD1-CE 4.42Å; L363-F741 HydrophobicContact CD2-CD2 4.13Å; L363-F741 HydrophobicContact CD2-CE2 3.83Å; L363-F741 HydrophobicContact CD2-CZ 4.48Å
364	T	87.8	Confident	88.5	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.072	C	C	.	.	B	Isolated β-bridge	trans	-95.8	165.9	172.8	60.4	0	0	0	0	111.5	K359 T360 G361 N366 D572 P573 R575 V606	K359-T364 HydrophobicContact CD-CG2 4.1Å; K359-T364 HydrophobicContact CG-CG2 3.99Å; K359-T364 PolarHBondContact O-N 3.35Å; K359-T364 PolarHBondContact O-OG1 2.77Å; T360-T364 WeakPolarHBondContact CA-OG1 3.44Å; G361-T364 CarbonylContact C-O 3.51Å; G361-T364 VanDerWaalsContact CA-O 3.26Å; G361-T364 WeakPolarHBondContact CA-O 3.42Å; G361-T364 PolarHBondContact N-O 3.48Å; G361-T364 PolarHBondContact N-OG1 2.94Å; T364-N366 VanDerWaalsContact C-N 3.33Å; T364-D572 VanDerWaalsContact CB-CG 3.48Å; T364-D572 WeakPolarHBondContact CB-OD2 3.49Å; T364-D572 WeakPolarHBondContact CG2-O 3.42Å; T364-D572 PolarHBondContact OG1-OD2 3.15Å; T364-P573 CarbonylContact C-O 3.59Å; T364-P573 WeakPolarHBondContact CA-O 3.29Å; T364-P573 VanDerWaalsContact CB-O 3.29Å; T364-P573 WeakPolarHBondContact CB-O 3.39Å; T364-R575 PolarHBondContact O-NE 3.2Å; T364-V606 HydrophobicContact CG2-CG1 4.01Å
365	K	82	Confident	88.6	Confident	48 Å²	48	15 Å²	15	21%	0.209	7%	0.074	C	C	.	.			trans	-78.2	-17	-175.9	-155.1	-178.2	179.5	-143.3	0	113.3	E367 V386 P573 R575	K365-E367 VanDerWaalsContact C-N 3.28Å; K365-E367 HydrophobicContact CB-CB 4.28Å; K365-E367 HydrophobicContact CD-CB 4.23Å; K365-E367 HydrophobicContact CD-CG 4.19Å; K365-E367 WeakPolarHBondContact CD-OE1 3.27Å; K365-E367 VanDerWaalsContact CE-CD 3.46Å; K365-E367 WeakPolarHBondContact CE-OE1 3.43Å; K365-E367 HydrophobicContact CG-CB 4.33Å; K365-E367 HydrophobicContact CG-CG 4.13Å; K365-E367 IonicContact NZ-OE1 2.77Å; K365-E367 PolarHBondContact NZ-OE1 3.4Å; K365-E367 IonicContact NZ-OE2 3.16Å; K365-E367 PolarHBondContact NZ-OE2 2.94Å; K365-V386 HydrophobicContact CD-CG1 3.93Å; K365-V386 PolarHBondContact NZ-O 3.42Å; K365-V386 VanDerWaalsContact NZ-O 3.15Å; K365-P573 PolarHBondContact N-O 3.02Å; K365-R575 HydrophobicContact CB-CG 4.29Å
366	N	79.1	Confident	88.5	Confident	49 Å²	49	15.3 Å²	15.3	26%	0.262	8%	0.077	S	C	.	.	S	Bend	trans	58.7	40	-165.3	-162.6	-0	0	0	0	111.9	T199 T360 T364 D572	T199-N366 WeakPolarHBondContact CB-OD1 3.33Å; T199-N366 WeakPolarHBondContact CG2-OD1 3.28Å; T360-N366 HydrophobicContact CG2-CB 4.46Å; T364-N366 VanDerWaalsContact C-N 3.33Å; N366-D572 VanDerWaalsContact CA-OD1 3.23Å; N366-D572 WeakPolarHBondContact CA-OD1 3.46Å; N366-D572 PolarHBondContact N-OD1 2.92Å
367	E	84.1	Confident	88.2	Confident	44 Å²	44	17.6 Å²	17.6	21%	0.206	9%	0.089	C	C	.	.			trans	-137.2	95.5	-179.1	-69.4	-177	-139.1	0	0	109.8	K365 T369 G387 Y388 D572 P573	K365-E367 VanDerWaalsContact C-N 3.28Å; K365-E367 HydrophobicContact CB-CB 4.28Å; K365-E367 HydrophobicContact CD-CB 4.23Å; K365-E367 HydrophobicContact CD-CG 4.19Å; K365-E367 WeakPolarHBondContact CD-OE1 3.27Å; K365-E367 VanDerWaalsContact CE-CD 3.46Å; K365-E367 WeakPolarHBondContact CE-OE1 3.43Å; K365-E367 HydrophobicContact CG-CB 4.33Å; K365-E367 HydrophobicContact CG-CG 4.13Å; K365-E367 IonicContact NZ-OE1 2.77Å; K365-E367 PolarHBondContact NZ-OE1 3.4Å; K365-E367 IonicContact NZ-OE2 3.16Å; K365-E367 PolarHBondContact NZ-OE2 2.94Å; E367-T369 PolarHBondContact O-N 3.21Å; E367-T369 VanDerWaalsContact O-N 3.13Å; E367-T369 PolarHBondContact O-OG1 2.87Å; E367-G387 WeakPolarHBondContact OE2-CA 3.48Å; E367-Y388 HydrophobicContact CB-CD2 3.95Å; E367-Y388 HydrophobicContact CB-CE2 3.74Å; E367-Y388 HydrophobicContact CG-CD2 3.71Å; E367-Y388 HydrophobicContact CG-CE2 3.72Å; E367-Y388 PolarHBondContact OE2-N 3.41Å; E367-D572 PolarHBondContact N-OD1 3.31Å; E367-D572 VanDerWaalsContact N-OD1 3.14Å; E367-P573 WeakPolarHBondContact O-CD 3.27Å
368	M	87.7	Confident	88	Confident	19 Å²	19	19.6 Å²	19.6	9%	0.094	11%	0.109	C	C	.	.			trans	-55.3	119.7	-178.3	-74.2	-68.2	-81.2	0	0	110.8	Y388 P434 A438 R549 I570 D572	M368-Y388 PolarHBondContact N-OH 3.16Å; M368-Y388 VanDerWaalsContact N-OH 3.15Å; M368-Y388 VanDerWaalsContact O-CE1 3.26Å; M368-Y388 WeakPolarHBondContact O-CE1 3.38Å; M368-Y388 PolarHBondContact O-OH 3.25Å; M368-P434 HydrophobicContact CB-CB 3.93Å; M368-P434 HydrophobicContact CG-CB 3.74Å; M368-A438 HydrophobicContact CB-CB 4.45Å; M368-A438 WeakPolarHBondContact O-CB 3.41Å; M368-R549 HydrophobicContact CE-CB 4.29Å; M368-I570 HydrophobicContact CB-CG2 4.09Å; M368-I570 HydrophobicContact CE-CB 4.31Å; M368-I570 HydrophobicContact CE-CG2 3.64Å; M368-I570 HydrophobicContact SD-CG2 4.41Å; M368-D572 HydrophobicContact SD-CB 4.16Å
369	T	89.1	Confident	87.9	Confident	5 Å²	5	21.1 Å²	21.1	3%	0.031	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.2	-171	-58.4	0	0	0	0	109.5	E367 V371 G387 I570 L571	E367-T369 PolarHBondContact O-N 3.21Å; E367-T369 VanDerWaalsContact O-N 3.13Å; E367-T369 PolarHBondContact O-OG1 2.87Å; T369-V371 HydrophobicContact CG2-CG2 4.04Å; T369-G387 WeakPolarHBondContact OG1-CA 3.44Å; T369-G387 PolarHBondContact OG1-N 3.43Å; T369-I570 WeakPolarHBondContact O-CA 3.24Å; T369-I570 WeakPolarHBondContact O-CG2 3.46Å; T369-L571 PolarHBondContact N-O 3.48Å; T369-L571 PolarHBondContact O-N 3.33Å
370	A	91.1	Very high	88.1	Confident	3 Å²	3	23.5 Å²	23.5	3%	0.025	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130.2	168.6	0	0	0	0	0	109.3	V383 L442 I568 I570	A370-V383 WeakPolarHBondContact O-CB 3.31Å; A370-V383 WeakPolarHBondContact O-CG1 3.34Å; A370-L442 HydrophobicContact CB-CB 4.12Å; A370-L442 HydrophobicContact CB-CD1 4.4Å; A370-L442 HydrophobicContact CB-CD2 3.99Å; A370-L442 HydrophobicContact CB-CG 4.41Å; A370-I568 HydrophobicContact CB-CG2 4.03Å; A370-I570 HydrophobicContact CB-CG1 4.35Å
371	V	89.9	Confident	88.5	Confident	34 Å²	34	22.8 Å²	22.8	21%	0.206	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	-29.1	-172.8	171.8	0	0	0	0	113.3	T369 V383 G569 L571	T369-V371 HydrophobicContact CG2-CG2 4.04Å; V371-V383 PolarHBondContact O-N 3.14Å; V371-G569 PolarHBondContact N-O 3.29Å; V371-L571 HydrophobicContact CB-CD2 3.72Å; V371-L571 HydrophobicContact CG1-CD2 4.17Å; V371-L571 HydrophobicContact CG2-CD2 3.5Å
372	R	92.2	Very high	89	Confident	66 Å²	66	26.6 Å²	26.6	25%	0.249	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.1	176	-165.9	75.1	176.3	-162.8	8.5	110.4	V374 A381 D382 L543 L548 G569	R372-V374 HydrophobicContact CG-CG2 4.47Å; R372-A381 CarbonylContact C-O 3.41Å; R372-A381 WeakPolarHBondContact CA-O 3.46Å; R372-D382 WeakPolarHBondContact CD-OD1 3.48Å; R372-D382 IonicContact CZ-OD1 2.79Å; R372-D382 IonicContact CZ-OD2 3.71Å; R372-D382 IonicContact NE-OD1 3.97Å; R372-D382 IonicContact NH1-OD1 2.72Å; R372-D382 PolarHBondContact NH1-OD1 3.41Å; R372-D382 IonicContact NH1-OD2 2.68Å; R372-D382 PolarHBondContact NH1-OD2 2.83Å; R372-L543 HydrophobicContact CG-CD2 4.04Å; R372-L548 HydrophobicContact CB-CD1 4.2Å; R372-G569 PolarHBondContact N-O 2.88Å; R372-G569 PolarHBondContact O-N 2.86Å
373	L	93.4	Very high	89.1	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.9	165.8	-74	79.3	0	0	0	109	Q380 A381 V383 I410 M413 I414 L442 I568	L373-Q380 WeakPolarHBondContact O-CA 3.38Å; L373-A381 HydrophobicContact CB-CB 4.26Å; L373-A381 PolarHBondContact N-O 3.29Å; L373-A381 PolarHBondContact O-N 3.38Å; L373-V383 HydrophobicContact CD1-CG2 3.62Å; L373-I410 HydrophobicContact CB-CD1 4.11Å; L373-I410 HydrophobicContact CD2-CG2 4.18Å; L373-M413 HydrophobicContact CB-CE 4.03Å; L373-M413 HydrophobicContact CD2-CB 4.31Å; L373-M413 HydrophobicContact CD2-CE 4.05Å; L373-M413 HydrophobicContact CD2-SD 4.49Å; L373-M413 HydrophobicContact CG-CE 4.23Å; L373-I414 HydrophobicContact CD2-CD1 4.44Å; L373-I414 HydrophobicContact CD2-CG1 3.98Å; L373-L442 HydrophobicContact CD1-CD1 3.91Å; L373-L442 HydrophobicContact CD1-CD2 3.96Å; L373-L442 HydrophobicContact CD2-CD2 4.17Å; L373-L442 HydrophobicContact CG-CD2 4.5Å; L373-I568 HydrophobicContact CD1-CG2 4.45Å; L373-I568 HydrophobicContact CD2-CG1 4.34Å; L373-I568 HydrophobicContact CG-CG1 4.19Å; L373-I568 HydrophobicContact CG-CG2 4.3Å
374	V	94.2	Very high	88.9	Confident	8 Å²	8	29.9 Å²	29.9	5%	0.048	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	114.9	167.9	-177.8	0	0	0	0	108.4	R372 T379 Q380 M413 E539 L543 G566 V567	R372-V374 HydrophobicContact CG-CG2 4.47Å; V374-T379 WeakPolarHBondContact CA-O 3.4Å; V374-Q380 HydrophobicContact CG1-CG 4.25Å; V374-Q380 HydrophobicContact CG2-CB 4.41Å; V374-Q380 HydrophobicContact CG2-CG 4.03Å; V374-M413 WeakPolarHBondContact O-CE 2.96Å; V374-E539 HydrophobicContact CG1-CG 4.14Å; V374-L543 HydrophobicContact CG2-CD1 4.02Å; V374-L543 HydrophobicContact CG2-CD2 4.4Å; V374-G566 WeakPolarHBondContact O-CA 3.39Å; V374-V567 HydrophobicContact CB-CG2 4.24Å; V374-V567 PolarHBondContact N-O 3.27Å; V374-V567 PolarHBondContact O-N 2.84Å
375	A	93.2	Very high	88.5	Confident	4 Å²	4	31 Å²	31	3%	0.033	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	163.3	175.8	0	0	0	0	0	111.5	D377 G378 T379 I410 M413	A375-D377 VanDerWaalsContact C-N 3.26Å; A375-D377 WeakPolarHBondContact CB-OD1 3.34Å; A375-D377 PolarHBondContact O-N 3.06Å; A375-G378 WeakPolarHBondContact O-CA 3.22Å; A375-G378 PolarHBondContact O-N 2.99Å; A375-T379 PolarHBondContact N-O 2.97Å; A375-I410 HydrophobicContact CB-CD1 4.16Å; A375-M413 VanDerWaalsContact CA-SD 3.51Å; A375-M413 HydrophobicContact CB-SD 3.72Å
376	A	91.3	Very high	88.4	Confident	8 Å²	8	31.3 Å²	31.3	7%	0.066	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.2	-179.1	0	0	0	0	0	114	G378 Y519 L520 F536 Y564 A565	A376-G378 PolarHBondContact O-N 3.23Å; A376-Y519 HydrophobicContact CB-CD2 4.03Å; A376-L520 WeakPolarHBondContact CB-O 3.49Å; A376-F536 HydrophobicContact CB-CE1 4.23Å; A376-F536 HydrophobicContact CB-CZ 3.95Å; A376-F536 WeakPolarHBondContact O-CE1 3.43Å; A376-Y564 HydrophobicContact CB-CD1 3.6Å; A376-Y564 HydrophobicContact CB-CE1 3.83Å; A376-Y564 WeakPolarHBondContact CB-O 3.46Å; A376-A565 PolarHBondContact N-O 2.61Å
377	D	89.2	Confident	88.3	Confident	47 Å²	47	29 Å²	29	25%	0.251	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-2.1	167.7	58.3	29.1	0	0	0	114.2	A375 T379 S409 L520 G522	A375-D377 VanDerWaalsContact C-N 3.26Å; A375-D377 WeakPolarHBondContact CB-OD1 3.34Å; A375-D377 PolarHBondContact O-N 3.06Å; D377-T379 WeakPolarHBondContact OD1-CB 2.96Å; D377-T379 PolarHBondContact OD1-N 3.29Å; D377-T379 PolarHBondContact OD1-OG1 3.47Å; D377-S409 WeakPolarHBondContact OD2-CB 3.46Å; D377-S409 PolarHBondContact OD2-OG 3.04Å; D377-L520 PolarHBondContact N-O 2.99Å; D377-G522 WeakPolarHBondContact OD2-CA 3.43Å; D377-G522 PolarHBondContact OD2-N 3.41Å
378	G	87.1	Confident	88	Confident	42 Å²	42	27.6 Å²	27.6	43%	0.433	17%	0.167	S	C	.	.			trans	87.4	-1.9	-177.8	0	0	0	0	0	115.1	A375 A376 Q380	A375-G378 WeakPolarHBondContact O-CA 3.22Å; A375-G378 PolarHBondContact O-N 2.99Å; A376-G378 PolarHBondContact O-N 3.23Å; G378-Q380 WeakPolarHBondContact O-CG 3.39Å; G378-Q380 PolarHBondContact O-N 3.38Å
379	T	89.9	Confident	87.4	Confident	40 Å²	40	29.1 Å²	29.1	25%	0.245	18%	0.18	C	C	.	.			trans	-59.1	127.7	173.8	-55.6	0	0	0	0	110	V374 A375 D377 V397 I410	V374-T379 WeakPolarHBondContact CA-O 3.4Å; A375-T379 PolarHBondContact N-O 2.97Å; D377-T379 WeakPolarHBondContact OD1-CB 2.96Å; D377-T379 PolarHBondContact OD1-N 3.29Å; D377-T379 PolarHBondContact OD1-OG1 3.47Å; T379-V397 HydrophobicContact CG2-CG1 3.77Å; T379-V397 HydrophobicContact CG2-CG2 4.13Å; T379-I410 HydrophobicContact CG2-CD1 4.23Å; T379-I410 HydrophobicContact CG2-CG1 3.92Å
380	Q	91.6	Very high	86.4	Confident	60 Å²	60	33.3 Å²	33.3	28%	0.28	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	131.7	-177.8	-45.7	-160.2	-0.2	0	0	111.1	L373 V374 G378	L373-Q380 WeakPolarHBondContact O-CA 3.38Å; V374-Q380 HydrophobicContact CG1-CG 4.25Å; V374-Q380 HydrophobicContact CG2-CB 4.41Å; V374-Q380 HydrophobicContact CG2-CG 4.03Å; G378-Q380 WeakPolarHBondContact O-CG 3.39Å; G378-Q380 PolarHBondContact O-N 3.38Å
381	A	90.3	Very high	85.3	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136	175.8	0	0	0	0	0	111.2	R372 L373 A396 V397 I410	R372-A381 CarbonylContact C-O 3.41Å; R372-A381 WeakPolarHBondContact CA-O 3.46Å; L373-A381 HydrophobicContact CB-CB 4.26Å; L373-A381 PolarHBondContact N-O 3.29Å; L373-A381 PolarHBondContact O-N 3.38Å; A381-A396 CarbonylContact C-O 3.52Å; A381-A396 VanDerWaalsContact CA-O 3.23Å; A381-A396 WeakPolarHBondContact CA-O 3.13Å; A381-V397 HydrophobicContact CB-CG2 3.63Å; A381-I410 HydrophobicContact CB-CD1 4.03Å; A381-I410 HydrophobicContact CB-CG1 4.39Å; A381-I410 HydrophobicContact CB-CG2 4.27Å
382	D	90.5	Very high	84.1	Confident	81 Å²	81	40.5 Å²	40.5	43%	0.433	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	150.8	167.6	-76.7	-56.4	0	0	0	110.4	R372 C395 A396	R372-D382 WeakPolarHBondContact CD-OD1 3.48Å; R372-D382 IonicContact CZ-OD1 2.79Å; R372-D382 IonicContact CZ-OD2 3.71Å; R372-D382 IonicContact NE-OD1 3.97Å; R372-D382 IonicContact NH1-OD1 2.72Å; R372-D382 PolarHBondContact NH1-OD1 3.41Å; R372-D382 IonicContact NH1-OD2 2.68Å; R372-D382 PolarHBondContact NH1-OD2 2.83Å; D382-C395 CarbonylContact O-C 3.16Å; D382-C395 WeakPolarHBondContact O-CA 3.26Å; D382-A396 PolarHBondContact N-O 2.93Å; D382-A396 PolarHBondContact O-N 2.8Å
383	V	87.8	Confident	83	Confident	10 Å²	10	37.8 Å²	37.8	6%	0.061	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	115.5	-179.3	-172.8	0	0	0	0	109.5	A370 V371 L373 L394 C395 L442 K445	A370-V383 WeakPolarHBondContact O-CB 3.31Å; A370-V383 WeakPolarHBondContact O-CG1 3.34Å; V371-V383 PolarHBondContact O-N 3.14Å; L373-V383 HydrophobicContact CD1-CG2 3.62Å; V383-L394 WeakPolarHBondContact CA-O 3.4Å; V383-C395 HydrophobicContact CG2-CB 4.36Å; V383-L442 HydrophobicContact CB-CD1 4.42Å; V383-L442 HydrophobicContact CG1-CD1 3.94Å; V383-L442 HydrophobicContact CG2-CD1 3.59Å; V383-K445 HydrophobicContact CG1-CD 3.77Å
384	S	85.4	Confident	82.4	Confident	60 Å²	60	41.4 Å²	41.4	42%	0.42	27%	0.267	S	S	.	.			trans	-90.2	174.2	178.1	70.3	0	0	0	0	112.5	G393 L394 K445	S384-G393 WeakPolarHBondContact O-CA 3.36Å; S384-L394 PolarHBondContact N-O 2.75Å; S384-L394 PolarHBondContact OG-N 2.82Å; S384-L394 PolarHBondContact OG-O 2.79Å; S384-K445 WeakPolarHBondContact O-CD 3.36Å; S384-K445 WeakPolarHBondContact O-CE 3.16Å; S384-K445 PolarHBondContact O-NZ 3.44Å
385	G	78.8	Confident	81.9	Confident	24 Å²	24	41 Å²	41	25%	0.247	26%	0.264	C	S	.	.	S	Bend	trans	79.4	141.7	-177.4	0	0	0	0	0	113.7	G392 K445	G385-G392 VanDerWaalsContact CA-O 3.24Å; G385-G392 WeakPolarHBondContact CA-O 3.41Å; G385-K445 PolarHBondContact O-NZ 2.83Å
386	V	79.4	Confident	81.5	Confident	54 Å²	54	42 Å²	42	33%	0.327	27%	0.272	S	S	.	.			trans	-111.9	118	-163.8	-171.7	0	0	0	0	112.3	K365 P573	K365-V386 HydrophobicContact CD-CG1 3.93Å; K365-V386 PolarHBondContact NZ-O 3.42Å; K365-V386 VanDerWaalsContact NZ-O 3.15Å; V386-P573 HydrophobicContact CG1-CB 3.94Å; V386-P573 HydrophobicContact CG1-CG 3.45Å; V386-P573 VanDerWaalsContact CG1-CG 3.45Å
387	G	78.5	Confident	81.2	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.01	28%	0.275	C	S	.	.	S	Bend	trans	78	-154.7	178.5	0	0	0	0	0	114.2	E367 T369 S389	E367-G387 WeakPolarHBondContact OE2-CA 3.48Å; T369-G387 WeakPolarHBondContact OG1-CA 3.44Å; T369-G387 PolarHBondContact OG1-N 3.43Å; G387-S389 VanDerWaalsContact C-N 3.27Å; G387-S389 PolarHBondContact O-N 3.31Å
388	Y	78.2	Confident	80.7	Confident	13 Å²	13	44.6 Å²	44.6	5%	0.051	31%	0.307	C	S	.	.	S	Bend	trans	-84.4	15.1	-169.8	-55.7	-50.9	0	0	0	115.3	E367 M368 V425 L430 P434 V441	E367-Y388 HydrophobicContact CB-CD2 3.95Å; E367-Y388 HydrophobicContact CB-CE2 3.74Å; E367-Y388 HydrophobicContact CG-CD2 3.71Å; E367-Y388 HydrophobicContact CG-CE2 3.72Å; E367-Y388 PolarHBondContact OE2-N 3.41Å; M368-Y388 PolarHBondContact N-OH 3.16Å; M368-Y388 VanDerWaalsContact N-OH 3.15Å; M368-Y388 VanDerWaalsContact O-CE1 3.26Å; M368-Y388 WeakPolarHBondContact O-CE1 3.38Å; M368-Y388 PolarHBondContact O-OH 3.25Å; Y388-V425 HydrophobicContact CD1-CG2 4.43Å; Y388-L430 HydrophobicContact CD2-CB 4.25Å; Y388-L430 HydrophobicContact CE2-CB 4.1Å; Y388-L430 HydrophobicContact CE2-CD2 4.1Å; Y388-P434 WeakPolarHBondContact OH-CA 3.48Å; Y388-P434 WeakPolarHBondContact OH-CB 3.32Å; Y388-P434 PolarHBondContact OH-O 2.57Å; Y388-V441 HydrophobicContact CD1-CG2 4.07Å
389	S	74.9	Confident	80.2	Confident	51 Å²	51	46 Å²	46	36%	0.357	32%	0.321	S	S	.	.			trans	-71.8	133.1	171.3	-179.8	0	0	0	0	111	G387 V391	G387-S389 VanDerWaalsContact C-N 3.27Å; G387-S389 PolarHBondContact O-N 3.31Å; S389-V391 PolarHBondContact OG-N 2.86Å; S389-V391 PolarHBondContact OG-O 2.95Å
390	E	68	Low	79.7	Confident	94 Å²	94	50.8 Å²	50.8	44%	0.439	34%	0.341	S	S	.	.	S	Bend	trans	-74.3	-31.3	169.3	-52.4	-170.3	170.4	0	0	111.5	K444	E390-K444 HydrophobicContact CG-CD 3.87Å; E390-K444 VanDerWaalsContact OE1-CD 3.31Å; E390-K444 WeakPolarHBondContact OE1-CD 3.43Å; E390-K444 WeakPolarHBondContact OE1-CE 3.44Å; E390-K444 IonicContact OE1-NZ 3.97Å; E390-K444 PolarHBondContact OE1-NZ 3.05Å
391	V	67.4	Low	79.1	Confident	123 Å²	123	49.4 Å²	49.4	75%	0.745	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	138.5	-176.9	-175.1	0	0	0	0	110.8	S389	S389-V391 PolarHBondContact OG-N 2.86Å; S389-V391 PolarHBondContact OG-O 2.95Å
392	G	64.3	Low	78.3	Confident	64 Å²	64	49.5 Å²	49.5	66%	0.66	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	23.8	168.9	0	0	0	0	0	115.6	G385	G385-G392 VanDerWaalsContact CA-O 3.24Å; G385-G392 WeakPolarHBondContact CA-O 3.41Å
393	G	70.1	Confident	77.4	Confident	9 Å²	9	49.6 Å²	49.6	9%	0.093	34%	0.34	C	S	.	.			trans	-136	137.4	173.8	0	0	0	0	0	112.4	S384	S384-G393 WeakPolarHBondContact O-CA 3.36Å
394	L	80.3	Confident	76.4	Confident	76 Å²	76	50.4 Å²	50.4	40%	0.398	35%	0.35	S	S	.	.			trans	-128.5	143	179.1	-70.5	165.9	0	0	0	109.1	V383 S384	V383-L394 WeakPolarHBondContact CA-O 3.4Å; S384-L394 PolarHBondContact N-O 2.75Å; S384-L394 PolarHBondContact OG-N 2.82Å; S384-L394 PolarHBondContact OG-O 2.79Å
395	C	83.4	Confident	75.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.2	162.5	-170.7	0	0	0	0	109.2	D382 V383 V402 K445 V446	D382-C395 CarbonylContact O-C 3.16Å; D382-C395 WeakPolarHBondContact O-CA 3.26Å; V383-C395 HydrophobicContact CG2-CB 4.36Å; C395-V402 HydrophobicContact CB-CB 4.41Å; C395-V402 HydrophobicContact CB-CG2 4.4Å; C395-V402 PolarHBondContact O-N 3.29Å; C395-K445 PolarHBondContact N-O 3.35Å; C395-V446 HydrophobicContact CB-CG2 3.53Å
396	A	85	Confident	75.5	Confident	24 Å²	24	54.4 Å²	54.4	20%	0.198	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	138.8	-177.8	0	0	0	0	0	112.8	A381 D382 E400	A381-A396 CarbonylContact C-O 3.52Å; A381-A396 VanDerWaalsContact CA-O 3.23Å; A381-A396 WeakPolarHBondContact CA-O 3.13Å; D382-A396 PolarHBondContact N-O 2.93Å; D382-A396 PolarHBondContact O-N 2.8Å; A396-E400 CarbonylContact C-O 3.59Å; A396-E400 WeakPolarHBondContact CA-O 3.46Å; A396-E400 WeakPolarHBondContact CB-O 3.44Å
397	V	84	Confident	75.7	Confident	21 Å²	21	53.7 Å²	53.7	13%	0.127	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.9	173.9	173.8	0	0	0	0	107.8	T379 A381 G399 E400 V402 I410	T379-V397 HydrophobicContact CG2-CG1 3.77Å; T379-V397 HydrophobicContact CG2-CG2 4.13Å; A381-V397 HydrophobicContact CB-CG2 3.63Å; V397-G399 PolarHBondContact O-N 2.78Å; V397-E400 PolarHBondContact N-O 2.83Å; V397-E400 PolarHBondContact O-N 2.91Å; V397-V402 HydrophobicContact CG2-CG2 3.82Å; V397-I410 HydrophobicContact CG2-CG1 4.12Å
398	G	80.1	Confident	75.9	Confident	89 Å²	89	56.4 Å²	56.4	92%	0.918	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	4	-178	0	0	0	0	0	116
399	G	75.9	Confident	76.4	Confident	71 Å²	71	56 Å²	56	73%	0.732	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.6	-15	-170.9	0	0	0	0	0	114.1	V397	V397-G399 PolarHBondContact O-N 2.78Å
400	E	80	Confident	77.1	Confident	142 Å²	142	53.6 Å²	53.6	66%	0.664	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	133.7	174.5	-62.5	-169.1	172.3	0	0	111.2	A396 V397	A396-E400 CarbonylContact C-O 3.59Å; A396-E400 WeakPolarHBondContact CA-O 3.46Å; A396-E400 WeakPolarHBondContact CB-O 3.44Å; V397-E400 PolarHBondContact N-O 2.83Å; V397-E400 PolarHBondContact O-N 2.91Å
401	A	77.7	Confident	77.9	Confident	30 Å²	30	49.2 Å²	49.2	25%	0.248	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	132.8	178.6	0	0	0	0	0	111.6	L403 M449	A401-L403 PolarHBondContact O-N 3.45Å; A401-M449 HydrophobicContact CB-CE 4.2Å
402	V	74.7	Confident	78.9	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.018	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-73.3	117.8	171.7	-173.8	0	0	0	0	108	C395 V397 H407 I410 V446	C395-V402 HydrophobicContact CB-CB 4.41Å; C395-V402 HydrophobicContact CB-CG2 4.4Å; C395-V402 PolarHBondContact O-N 3.29Å; V397-V402 HydrophobicContact CG2-CG2 3.82Å; V402-H407 HydrophobicContact CG1-CB 4.41Å; V402-I410 HydrophobicContact CG1-CG2 4.47Å; V402-I410 HydrophobicContact CG2-CG2 4.37Å; V402-V446 HydrophobicContact CB-CG1 4.18Å; V402-V446 HydrophobicContact CG1-CG1 3.81Å
403	L	71	Confident	80.2	Confident	82 Å²	82	42.5 Å²	42.5	43%	0.429	28%	0.277	S	S	.	.			trans	-121.3	107.5	-177.3	-68.7	175.9	0	0	0	109.1	A401 F405 S406 M449	A401-L403 PolarHBondContact O-N 3.45Å; L403-F405 PolarHBondContact O-N 3.1Å; L403-S406 PolarHBondContact N-OG 2.66Å; L403-S406 VanDerWaalsContact N-OG 3.14Å; L403-S406 PolarHBondContact O-N 2.98Å; L403-M449 HydrophobicContact CD1-CE 3.96Å; L403-M449 HydrophobicContact CD1-SD 4.4Å; L403-M449 HydrophobicContact CD2-CB 4.26Å; L403-M449 HydrophobicContact CD2-CE 4.25Å
404	G	66.7	Low	81.1	Confident	27 Å²	27	42.1 Å²	42.1	28%	0.278	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	-90	178.4	0	0	0	0	0	113.5	S411	G404-S411 PolarHBondContact O-OG 3.19Å
405	F	70.3	Confident	81.4	Confident	105 Å²	105	39.2 Å²	39.2	46%	0.461	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	20	-178.7	-67	-79	0	0	0	113.5	L403 H407 L466	L403-F405 PolarHBondContact O-N 3.1Å; F405-H407 PolarHBondContact O-N 3.13Å; F405-H407 VanDerWaalsContact O-N 3.16Å; F405-L466 HydrophobicContact CE2-CD1 3.9Å; F405-L466 HydrophobicContact CZ-CD1 3.78Å
406	S	76	Confident	81.8	Confident	64 Å²	64	39.2 Å²	39.2	45%	0.448	26%	0.257	S	S	.	.	S	Bend	trans	-57.4	-30	179.5	66.3	0	0	0	0	113.6	L403	L403-S406 PolarHBondContact N-OG 2.66Å; L403-S406 VanDerWaalsContact N-OG 3.14Å; L403-S406 PolarHBondContact O-N 2.98Å
407	H	83.2	Confident	82	Confident	39 Å²	39	38.1 Å²	38.1	18%	0.181	25%	0.248	C	C	.	.	S	Bend	trans	-122.9	98.2	174.6	-68.2	78	0	0	0	109	V402 F405 S409 I410 S411	V402-H407 HydrophobicContact CG1-CB 4.41Å; F405-H407 PolarHBondContact O-N 3.13Å; F405-H407 VanDerWaalsContact O-N 3.16Å; H407-S409 PolarHBondContact O-N 3.35Å; H407-I410 HydrophobicContact CB-CB 4.13Å; H407-I410 HydrophobicContact CB-CG1 4.27Å; H407-I410 PolarHBondContact O-N 2.94Å; H407-S411 WeakPolarHBondContact O-CB 3.49Å; H407-S411 PolarHBondContact O-N 3.37Å; H407-S411 PolarHBondContact O-OG 2.94Å
408	P	83.7	Confident	82.1	Confident	58 Å²	58	37.7 Å²	37.7	38%	0.377	25%	0.245	S	C	.	.	H	α-helix	trans	-62.3	-43.5	-167.1	22	-32.7	0	0	0	112.9	S411 K412 T523	P408-S411 PolarHBondContact O-N 2.77Å; P408-K412 WeakPolarHBondContact O-CB 3.48Å; P408-K412 PolarHBondContact O-N 2.91Å; P408-T523 HydrophobicContact CB-CG2 4.1Å; P408-T523 HydrophobicContact CG-CG2 3.99Å
409	S	88.3	Confident	82.4	Confident	5 Å²	5	33.6 Å²	33.6	4%	0.035	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-48.6	-178.9	-19.3	0	0	0	0	111.8	D377 H407 K412 M413	D377-S409 WeakPolarHBondContact OD2-CB 3.46Å; D377-S409 PolarHBondContact OD2-OG 3.04Å; H407-S409 PolarHBondContact O-N 3.35Å; S409-K412 PolarHBondContact O-N 2.88Å; S409-M413 WeakPolarHBondContact O-CG 3.36Å; S409-M413 PolarHBondContact O-N 2.77Å
410	I	88.7	Confident	83.1	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-44.3	175.5	-61.2	-63.6	0	0	0	110.8	L373 A375 T379 A381 V397 V402 H407 K412 M413 I414	L373-I410 HydrophobicContact CB-CD1 4.11Å; L373-I410 HydrophobicContact CD2-CG2 4.18Å; A375-I410 HydrophobicContact CB-CD1 4.16Å; T379-I410 HydrophobicContact CG2-CD1 4.23Å; T379-I410 HydrophobicContact CG2-CG1 3.92Å; A381-I410 HydrophobicContact CB-CD1 4.03Å; A381-I410 HydrophobicContact CB-CG1 4.39Å; A381-I410 HydrophobicContact CB-CG2 4.27Å; V397-I410 HydrophobicContact CG2-CG1 4.12Å; V402-I410 HydrophobicContact CG1-CG2 4.47Å; V402-I410 HydrophobicContact CG2-CG2 4.37Å; H407-I410 HydrophobicContact CB-CB 4.13Å; H407-I410 HydrophobicContact CB-CG1 4.27Å; H407-I410 PolarHBondContact O-N 2.94Å; I410-K412 VanDerWaalsContact C-N 3.27Å; I410-K412 PolarHBondContact O-N 2.69Å; I410-M413 HydrophobicContact CD1-SD 4.21Å; I410-M413 WeakPolarHBondContact O-CB 3.28Å; I410-M413 PolarHBondContact O-N 2.89Å; I410-I414 HydrophobicContact CG2-CD1 3.91Å; I410-I414 VanDerWaalsContact O-CG1 3.3Å; I410-I414 WeakPolarHBondContact O-CG1 3.43Å; I410-I414 PolarHBondContact O-N 3.23Å
411	S	85.9	Confident	83.4	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.007	14%	0.136	C	C	.	.	H	α-helix	trans	-62.9	-34.8	178.1	-51.1	0	0	0	0	111.9	G404 H407 P408 I414 E415	G404-S411 PolarHBondContact O-OG 3.19Å; H407-S411 WeakPolarHBondContact O-CB 3.49Å; H407-S411 PolarHBondContact O-N 3.37Å; H407-S411 PolarHBondContact O-OG 2.94Å; P408-S411 PolarHBondContact O-N 2.77Å; S411-I414 PolarHBondContact O-N 2.83Å; S411-E415 PolarHBondContact O-N 2.9Å
412	K	87.7	Confident	83.7	Confident	46 Å²	46	25.7 Å²	25.7	20%	0.2	14%	0.144	C	C	.	.	H	α-helix	trans	-70.7	-41	175.4	-170.2	66.6	-173.5	173.2	0	112.2	P408 S409 I410 I414 E415 I416 Y504 L520 Y555	P408-K412 WeakPolarHBondContact O-CB 3.48Å; P408-K412 PolarHBondContact O-N 2.91Å; S409-K412 PolarHBondContact O-N 2.88Å; I410-K412 VanDerWaalsContact C-N 3.27Å; I410-K412 PolarHBondContact O-N 2.69Å; K412-I414 VanDerWaalsContact C-N 3.3Å; K412-I414 PolarHBondContact O-N 2.89Å; K412-E415 WeakPolarHBondContact CD-OE2 3.45Å; K412-E415 IonicContact NZ-OE2 2.73Å; K412-E415 PolarHBondContact NZ-OE2 2.73Å; K412-E415 PolarHBondContact O-N 3.14Å; K412-I416 HydrophobicContact CG-CD1 4.4Å; K412-I416 WeakPolarHBondContact O-CD1 3.42Å; K412-I416 VanDerWaalsContact O-CG1 3.27Å; K412-I416 WeakPolarHBondContact O-CG1 3.46Å; K412-I416 PolarHBondContact O-N 3.14Å; K412-Y504 PolarHBondContact NZ-OH 3.44Å; K412-L520 HydrophobicContact CB-CD2 4.2Å; K412-L520 HydrophobicContact CG-CD2 4.17Å; K412-Y555 HydrophobicContact CG-CD1 4.4Å; K412-Y555 HydrophobicContact CG-CE1 4.12Å
413	M	91.8	Very high	84	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58	-43.4	172.4	-68.7	171	67.8	0	0	112	L373 V374 A375 S409 I410 I416 G417 V553 A565 V567 I568	L373-M413 HydrophobicContact CB-CE 4.03Å; L373-M413 HydrophobicContact CD2-CB 4.31Å; L373-M413 HydrophobicContact CD2-CE 4.05Å; L373-M413 HydrophobicContact CD2-SD 4.49Å; L373-M413 HydrophobicContact CG-CE 4.23Å; V374-M413 WeakPolarHBondContact O-CE 2.96Å; A375-M413 VanDerWaalsContact CA-SD 3.51Å; A375-M413 HydrophobicContact CB-SD 3.72Å; S409-M413 WeakPolarHBondContact O-CG 3.36Å; S409-M413 PolarHBondContact O-N 2.77Å; I410-M413 HydrophobicContact CD1-SD 4.21Å; I410-M413 WeakPolarHBondContact O-CB 3.28Å; I410-M413 PolarHBondContact O-N 2.89Å; M413-I416 PolarHBondContact O-N 2.87Å; M413-G417 PolarHBondContact O-N 2.94Å; M413-G417 VanDerWaalsContact O-N 3.09Å; M413-V553 HydrophobicContact CB-CG2 4.02Å; M413-V553 HydrophobicContact CE-CG2 4.3Å; M413-V553 HydrophobicContact CG-CG2 3.96Å; M413-A565 HydrophobicContact CG-CB 4.12Å; M413-V567 VanDerWaalsContact CE-O 3.25Å; M413-V567 WeakPolarHBondContact CE-O 3.04Å; M413-I568 HydrophobicContact CE-CG1 3.89Å
414	I	88.8	Confident	84.5	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-42	178.7	-64.7	167.7	0	0	0	110.8	L373 I410 S411 K412 I416 G417 V418 L442 A443 V446 L466	L373-I414 HydrophobicContact CD2-CD1 4.44Å; L373-I414 HydrophobicContact CD2-CG1 3.98Å; I410-I414 HydrophobicContact CG2-CD1 3.91Å; I410-I414 VanDerWaalsContact O-CG1 3.3Å; I410-I414 WeakPolarHBondContact O-CG1 3.43Å; I410-I414 PolarHBondContact O-N 3.23Å; S411-I414 PolarHBondContact O-N 2.83Å; K412-I414 VanDerWaalsContact C-N 3.3Å; K412-I414 PolarHBondContact O-N 2.89Å; I414-I416 PolarHBondContact O-N 3.35Å; I414-G417 PolarHBondContact O-N 2.92Å; I414-V418 WeakPolarHBondContact O-CG2 3.45Å; I414-V418 PolarHBondContact O-N 2.86Å; I414-V418 VanDerWaalsContact O-N 3.08Å; I414-L442 HydrophobicContact CG1-CD2 4.13Å; I414-L442 HydrophobicContact CG1-CG 4.2Å; I414-A443 HydrophobicContact CG2-CB 3.53Å; I414-V446 HydrophobicContact CD1-CG2 3.71Å; I414-L466 HydrophobicContact CB-CD2 4.39Å; I414-L466 HydrophobicContact CG2-CD2 3.82Å
415	E	87.4	Confident	85	Confident	14 Å²	14	24.1 Å²	24.1	7%	0.065	13%	0.13	C	C	.	.	H	α-helix	trans	-55.9	-48.7	173	175.1	171	-104.5	0	0	111.9	S411 K412 G417 V418 V419 R469 F473 Y504	S411-E415 PolarHBondContact O-N 2.9Å; K412-E415 WeakPolarHBondContact CD-OE2 3.45Å; K412-E415 IonicContact NZ-OE2 2.73Å; K412-E415 PolarHBondContact NZ-OE2 2.73Å; K412-E415 PolarHBondContact O-N 3.14Å; E415-G417 VanDerWaalsContact C-N 3.29Å; E415-G417 PolarHBondContact O-N 3.47Å; E415-V418 PolarHBondContact O-N 3.06Å; E415-V418 VanDerWaalsContact O-N 3.16Å; E415-V419 HydrophobicContact CG-CG2 4.11Å; E415-V419 WeakPolarHBondContact O-CB 3.44Å; E415-V419 WeakPolarHBondContact O-CG2 3.47Å; E415-V419 PolarHBondContact O-N 2.85Å; E415-R469 WeakPolarHBondContact OE1-CD 3.27Å; E415-R469 IonicContact OE1-CZ 3.23Å; E415-R469 IonicContact OE1-NE 4Å; E415-R469 IonicContact OE1-NH1 3.01Å; E415-R469 PolarHBondContact OE1-NH1 3.1Å; E415-F473 HydrophobicContact CG-CE2 4.3Å; E415-F473 WeakPolarHBondContact OE1-CE2 3.4Å; E415-F473 WeakPolarHBondContact OE1-CZ 3.38Å; E415-Y504 HydrophobicContact CG-CE1 4.3Å
416	I	90.6	Very high	85.2	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.4	-42.7	178.6	-58.3	154.9	0	0	0	110.8	K412 M413 I414 V418 C420 Y504 V553 Y555 A565	K412-I416 HydrophobicContact CG-CD1 4.4Å; K412-I416 WeakPolarHBondContact O-CD1 3.42Å; K412-I416 VanDerWaalsContact O-CG1 3.27Å; K412-I416 WeakPolarHBondContact O-CG1 3.46Å; K412-I416 PolarHBondContact O-N 3.14Å; M413-I416 PolarHBondContact O-N 2.87Å; I414-I416 PolarHBondContact O-N 3.35Å; I416-V418 VanDerWaalsContact C-N 3.29Å; I416-V418 PolarHBondContact O-N 3.37Å; I416-C420 WeakPolarHBondContact O-CB 3.24Å; I416-C420 PolarHBondContact O-N 3.48Å; I416-Y504 HydrophobicContact CB-CD1 4.15Å; I416-Y504 HydrophobicContact CG1-CD1 3.77Å; I416-Y504 HydrophobicContact CG1-CE1 4.15Å; I416-Y504 HydrophobicContact CG2-CD1 4.24Å; I416-V553 HydrophobicContact CB-CB 4.13Å; I416-V553 HydrophobicContact CB-CG1 4.39Å; I416-V553 HydrophobicContact CD1-CB 4.18Å; I416-V553 HydrophobicContact CD1-CG2 4.45Å; I416-V553 HydrophobicContact CG2-CB 3.8Å; I416-V553 HydrophobicContact CG2-CG1 3.99Å; I416-Y555 HydrophobicContact CD1-CD1 3.96Å; I416-A565 HydrophobicContact CD1-CB 3.52Å
417	G	89	Confident	84.9	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-68.1	-20.1	179	0	0	0	0	0	115.5	M413 I414 E415 N421 L439	M413-G417 PolarHBondContact O-N 2.94Å; M413-G417 VanDerWaalsContact O-N 3.09Å; I414-G417 PolarHBondContact O-N 2.92Å; E415-G417 VanDerWaalsContact C-N 3.29Å; E415-G417 PolarHBondContact O-N 3.47Å; G417-N421 PolarHBondContact O-ND2 3.11Å; G417-L439 WeakPolarHBondContact O-CB 3.36Å
418	V	86.6	Confident	84.2	Confident	12 Å²	12	25.4 Å²	25.4	7%	0.073	15%	0.148	C	C	.	.	H	α-helix	trans	-93.6	-38.5	175.4	172.4	0	0	0	0	112.2	I414 E415 I416 N421 A443 R470	I414-V418 WeakPolarHBondContact O-CG2 3.45Å; I414-V418 PolarHBondContact O-N 2.86Å; I414-V418 VanDerWaalsContact O-N 3.08Å; E415-V418 PolarHBondContact O-N 3.06Å; E415-V418 VanDerWaalsContact O-N 3.16Å; I416-V418 VanDerWaalsContact C-N 3.29Å; I416-V418 PolarHBondContact O-N 3.37Å; V418-N421 VanDerWaalsContact O-CB 3.29Å; V418-N421 WeakPolarHBondContact O-CB 3.27Å; V418-A443 HydrophobicContact CG2-CB 3.24Å; V418-R470 HydrophobicContact CG1-CB 4.27Å
419	V	87.1	Confident	83.6	Confident	4 Å²	4	27.9 Å²	27.9	2%	0.024	16%	0.159	C	C	.	.	H	α-helix	trans	-73.5	-45.7	-178.1	173.3	0	0	0	0	110.7	E415 N421 F473 V490 C492 Y504	E415-V419 HydrophobicContact CG-CG2 4.11Å; E415-V419 WeakPolarHBondContact O-CB 3.44Å; E415-V419 WeakPolarHBondContact O-CG2 3.47Å; E415-V419 PolarHBondContact O-N 2.85Å; V419-N421 PolarHBondContact O-N 3.29Å; V419-F473 HydrophobicContact CG1-CG 4.42Å; V419-F473 HydrophobicContact CG2-CD2 3.47Å; V419-F473 VanDerWaalsContact CG2-CD2 3.47Å; V419-F473 HydrophobicContact CG2-CE2 3.7Å; V419-F473 HydrophobicContact CG2-CG 4.09Å; V419-F473 HydrophobicContact CG2-CZ 4.49Å; V419-V490 HydrophobicContact CG1-CG2 4.06Å; V419-C492 HydrophobicContact CG1-CB 4.18Å; V419-C492 WeakPolarHBondContact CG1-SG 3.33Å; V419-Y504 HydrophobicContact CB-CD1 4.36Å; V419-Y504 HydrophobicContact CB-CG 4.31Å; V419-Y504 HydrophobicContact CG1-CD1 4.34Å; V419-Y504 HydrophobicContact CG1-CD2 3.8Å; V419-Y504 HydrophobicContact CG1-CE2 4.25Å; V419-Y504 HydrophobicContact CG1-CG 3.86Å
420	C	89.4	Confident	83.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	-87.1	73.5	173.9	-168.3	0	0	0	0	109.6	I416 V490 Y504 K506	I416-C420 WeakPolarHBondContact O-CB 3.24Å; I416-C420 PolarHBondContact O-N 3.48Å; C420-V490 HydrophobicContact CB-CG2 3.84Å; C420-Y504 PolarHBondContact SG-O 2.92Å; C420-K506 HydrophobicContact CB-CD 4.42Å; C420-K506 VanDerWaalsContact O-CD 3.28Å; C420-K506 WeakPolarHBondContact O-CD 3.31Å; C420-K506 VanDerWaalsContact O-CE 3.31Å; C420-K506 WeakPolarHBondContact O-CE 3.34Å; C420-K506 PolarHBondContact O-NZ 2.98Å
421	N	87.1	Confident	82.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.			trans	-156.2	133.2	-171.6	-157.7	-58.8	0	0	0	112	G417 V418 V419 S423 E436 R470	G417-N421 PolarHBondContact O-ND2 3.11Å; V418-N421 VanDerWaalsContact O-CB 3.29Å; V418-N421 WeakPolarHBondContact O-CB 3.27Å; V419-N421 PolarHBondContact O-N 3.29Å; N421-S423 WeakPolarHBondContact OD1-CB 3.49Å; N421-S423 PolarHBondContact OD1-N 3.44Å; N421-S423 PolarHBondContact OD1-O 3.24Å; N421-E436 PolarHBondContact ND2-O 2.88Å; N421-R470 PolarHBondContact O-NH1 3.1Å; N421-R470 PolarHBondContact O-NH2 3.3Å
422	N	83.3	Confident	82	Confident	76 Å²	76	39 Å²	39	41%	0.406	21%	0.213	S	C	.	.			trans	-108.3	-11.3	178	-70	0.6	0	0	0	113	E436 E478 M488	N422-E436 WeakPolarHBondContact CA-OE2 3.46Å; N422-E436 PolarHBondContact N-OE2 3.44Å; N422-E478 PolarHBondContact ND2-OE1 2.85Å; N422-M488 WeakPolarHBondContact OD1-CE 3.22Å
423	S	82.6	Confident	81.7	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.007	21%	0.213	C	C	.	.			trans	-74.4	162.3	170.6	-72.7	0	0	0	0	113.4	N421 R431 G432 Q433 E436 R470	N421-S423 WeakPolarHBondContact OD1-CB 3.49Å; N421-S423 PolarHBondContact OD1-N 3.44Å; N421-S423 PolarHBondContact OD1-O 3.24Å; S423-R431 CarbonylContact C-O 3.57Å; S423-R431 WeakPolarHBondContact CA-O 3.34Å; S423-R431 VanDerWaalsContact CB-O 3.23Å; S423-R431 WeakPolarHBondContact CB-O 3.4Å; S423-R431 PolarHBondContact OG-O 2.94Å; S423-G432 VanDerWaalsContact OG-C 3.3Å; S423-G432 WeakPolarHBondContact OG-CA 3.4Å; S423-Q433 PolarHBondContact OG-N 3.31Å; S423-Q433 PolarHBondContact OG-O 3.35Å; S423-E436 PolarHBondContact N-OE2 3.02Å; S423-E436 WeakPolarHBondContact OG-CB 3.4Å; S423-R470 PolarHBondContact O-NH1 2.96Å
424	D	79.7	Confident	81.4	Confident	76 Å²	76	39.6 Å²	39.6	41%	0.406	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	159.3	162.3	-167.7	12.8	0	0	0	109.2	R431	D424-R431 PolarHBondContact N-O 3.47Å; D424-R431 PolarHBondContact O-N 3.32Å; D424-R431 VanDerWaalsContact O-O 3.11Å
425	V	77	Confident	81.3	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	109.8	177.4	177.2	0	0	0	0	108.5	Y388 N429 L430 V441 K444	Y388-V425 HydrophobicContact CD1-CG2 4.43Å; V425-N429 WeakPolarHBondContact CA-O 3.28Å; V425-L430 HydrophobicContact CG2-CD1 4.05Å; V425-V441 HydrophobicContact CB-CG2 4.05Å; V425-V441 HydrophobicContact CG1-CG2 4Å; V425-V441 HydrophobicContact CG2-CG2 3.82Å; V425-K444 PolarHBondContact O-NZ 2.9Å
426	V	75.1	Confident	81.3	Confident	47 Å²	47	39.8 Å²	39.8	29%	0.285	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.8	-175	-175.7	0	0	0	0	108.1	G428 N429	V426-G428 PolarHBondContact O-N 2.79Å; V426-N429 PolarHBondContact N-O 3.21Å; V426-N429 WeakPolarHBondContact O-CA 3.31Å; V426-N429 WeakPolarHBondContact O-CB 3.4Å; V426-N429 PolarHBondContact O-N 2.79Å
427	D	69.2	Low	81.1	Confident	149 Å²	149	39.8 Å²	39.8	80%	0.797	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	40.9	-178	-50.4	-39.5	0	0	0	113	N429	D427-N429 PolarHBondContact O-N 3.12Å; D427-N429 VanDerWaalsContact O-N 3.11Å; D427-N429 PolarHBondContact O-ND2 3.35Å; D427-N429 VanDerWaalsContact O-ND2 3.07Å
428	G	69.6	Low	81.1	Confident	39 Å²	39	39.8 Å²	39.8	40%	0.402	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	-8.7	-175	0	0	0	0	0	115.4	V426	V426-G428 PolarHBondContact O-N 2.79Å
429	N	71.9	Confident	81.3	Confident	111 Å²	111	39.4 Å²	39.4	59%	0.594	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	123.3	179	-69.1	-87.3	0	0	0	110.8	V425 V426 D427	V425-N429 WeakPolarHBondContact CA-O 3.28Å; V426-N429 PolarHBondContact N-O 3.21Å; V426-N429 WeakPolarHBondContact O-CA 3.31Å; V426-N429 WeakPolarHBondContact O-CB 3.4Å; V426-N429 PolarHBondContact O-N 2.79Å; D427-N429 PolarHBondContact O-N 3.12Å; D427-N429 VanDerWaalsContact O-N 3.11Å; D427-N429 PolarHBondContact O-ND2 3.35Å; D427-N429 VanDerWaalsContact O-ND2 3.07Å
430	L	78.5	Confident	81.3	Confident	38 Å²	38	39.8 Å²	39.8	20%	0.199	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	132.5	172.4	176.5	66.5	0	0	0	111.6	Y388 V425 P434	Y388-L430 HydrophobicContact CD2-CB 4.25Å; Y388-L430 HydrophobicContact CE2-CB 4.1Å; Y388-L430 HydrophobicContact CE2-CD2 4.1Å; V425-L430 HydrophobicContact CG2-CD1 4.05Å; L430-P434 HydrophobicContact CD2-CB 4.19Å; L430-P434 HydrophobicContact CD2-CG 4.02Å
431	R	75.9	Confident	81.2	Confident	168 Å²	168	40 Å²	40	63%	0.634	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.4	160.7	-60.7	-179.2	-178.8	-173.7	0.8	107.9	S423 D424	S423-R431 CarbonylContact C-O 3.57Å; S423-R431 WeakPolarHBondContact CA-O 3.34Å; S423-R431 VanDerWaalsContact CB-O 3.23Å; S423-R431 WeakPolarHBondContact CB-O 3.4Å; S423-R431 PolarHBondContact OG-O 2.94Å; D424-R431 PolarHBondContact N-O 3.47Å; D424-R431 PolarHBondContact O-N 3.32Å; D424-R431 VanDerWaalsContact O-O 3.11Å
432	G	74.6	Confident	81.2	Confident	34 Å²	34	40.1 Å²	40.1	35%	0.351	22%	0.221	S	C	.	.	S	Bend	trans	97.8	-154.3	-174.9	0	0	0	0	0	113.6	S423	S423-G432 VanDerWaalsContact OG-C 3.3Å; S423-G432 WeakPolarHBondContact OG-CA 3.4Å
433	Q	80.7	Confident	81.3	Confident	43 Å²	43	36.6 Å²	36.6	20%	0.201	20%	0.202	C	C	.	.			trans	-83.8	140.9	-174.9	-63.1	-167.9	-16.9	0	0	113.1	S423 T435 E436 G437	S423-Q433 PolarHBondContact OG-N 3.31Å; S423-Q433 PolarHBondContact OG-O 3.35Å; Q433-T435 PolarHBondContact O-N 3.38Å; Q433-E436 HydrophobicContact CB-CB 4.37Å; Q433-E436 HydrophobicContact CB-CG 4.14Å; Q433-E436 PolarHBondContact O-N 3.37Å; Q433-E436 VanDerWaalsContact O-N 3.1Å; Q433-G437 PolarHBondContact O-N 2.72Å
434	P	84.4	Confident	81.2	Confident	14 Å²	14	38.1 Å²	38.1	9%	0.091	21%	0.209	C	C	.	.	H	α-helix	trans	-57.2	-42.7	179.7	-28.5	35.9	0	0	0	114.5	M368 Y388 L430 E436 G437 A438	M368-P434 HydrophobicContact CB-CB 3.93Å; M368-P434 HydrophobicContact CG-CB 3.74Å; Y388-P434 WeakPolarHBondContact OH-CA 3.48Å; Y388-P434 WeakPolarHBondContact OH-CB 3.32Å; Y388-P434 PolarHBondContact OH-O 2.57Å; L430-P434 HydrophobicContact CD2-CB 4.19Å; L430-P434 HydrophobicContact CD2-CG 4.02Å; P434-E436 PolarHBondContact O-N 3.3Å; P434-G437 PolarHBondContact O-N 3.06Å; P434-A438 PolarHBondContact O-N 3.15Å; P434-A438 VanDerWaalsContact O-N 3.11Å
435	T	87.3	Confident	81.2	Confident	7 Å²	7	34.9 Å²	34.9	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-30.7	178.2	-55.9	0	0	0	0	112.6	Q433 A438 R549 L551 I570	Q433-T435 PolarHBondContact O-N 3.38Å; T435-A438 WeakPolarHBondContact O-CB 3.48Å; T435-R549 VanDerWaalsContact OG1-CZ 3.23Å; T435-R549 PolarHBondContact OG1-NH1 3.37Å; T435-R549 PolarHBondContact OG1-NH2 3.4Å; T435-L551 HydrophobicContact CG2-CD1 3.5Å; T435-I570 HydrophobicContact CG2-CD1 3.81Å
436	E	87.4	Confident	81.1	Confident	13 Å²	13	35 Å²	35	6%	0.061	19%	0.192	C	C	.	.	H	α-helix	trans	-83.8	-37.2	178.2	-64	-165	163.3	0	0	112.3	N421 N422 S423 Q433 P434 A438 L439 V440 K506	N421-E436 PolarHBondContact ND2-O 2.88Å; N422-E436 WeakPolarHBondContact CA-OE2 3.46Å; N422-E436 PolarHBondContact N-OE2 3.44Å; S423-E436 PolarHBondContact N-OE2 3.02Å; S423-E436 WeakPolarHBondContact OG-CB 3.4Å; Q433-E436 HydrophobicContact CB-CB 4.37Å; Q433-E436 HydrophobicContact CB-CG 4.14Å; Q433-E436 PolarHBondContact O-N 3.37Å; Q433-E436 VanDerWaalsContact O-N 3.1Å; P434-E436 PolarHBondContact O-N 3.3Å; E436-A438 PolarHBondContact O-N 3.06Å; E436-L439 WeakPolarHBondContact O-CB 3.46Å; E436-L439 PolarHBondContact O-N 3.19Å; E436-V440 PolarHBondContact O-N 3.26Å; E436-K506 WeakPolarHBondContact OE1-CE 3.38Å; E436-K506 IonicContact OE1-NZ 3.53Å; E436-K506 PolarHBondContact OE1-NZ 2.89Å; E436-K506 IonicContact OE2-NZ 2.66Å
437	G	86.8	Confident	80.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-34.2	172.6	0	0	0	0	0	112.9	Q433 P434 L439 V440 V441	Q433-G437 PolarHBondContact O-N 2.72Å; P434-G437 PolarHBondContact O-N 3.06Å; G437-L439 PolarHBondContact O-N 2.89Å; G437-V440 PolarHBondContact O-N 3.17Å; G437-V441 PolarHBondContact O-N 3.5Å
438	A	89.8	Confident	79.3	Confident	2 Å²	2	31.1 Å²	31.1	2%	0.017	18%	0.177	C	C	.	.	H	α-helix	trans	-55.2	-38.2	172.3	0	0	0	0	0	112.8	M368 P434 T435 E436 L442 I570	M368-A438 HydrophobicContact CB-CB 4.45Å; M368-A438 WeakPolarHBondContact O-CB 3.41Å; P434-A438 PolarHBondContact O-N 3.15Å; P434-A438 VanDerWaalsContact O-N 3.11Å; T435-A438 WeakPolarHBondContact O-CB 3.48Å; E436-A438 PolarHBondContact O-N 3.06Å; A438-L442 VanDerWaalsContact O-CB 3.29Å; A438-L442 WeakPolarHBondContact O-CB 3.28Å; A438-L442 PolarHBondContact O-N 3.35Å; A438-I570 HydrophobicContact CB-CD1 4.28Å; A438-I570 HydrophobicContact CB-CG2 3.78Å
439	L	90	Very high	77.7	Confident	4 Å²	4	35 Å²	35	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-78.8	-34.9	-179.6	-56.8	176.2	0	0	0	112.1	G417 E436 G437 L442 A443 I568 I570	G417-L439 WeakPolarHBondContact O-CB 3.36Å; E436-L439 WeakPolarHBondContact O-CB 3.46Å; E436-L439 PolarHBondContact O-N 3.19Å; G437-L439 PolarHBondContact O-N 2.89Å; L439-L442 HydrophobicContact CD2-CD2 4.46Å; L439-L442 WeakPolarHBondContact O-CB 3.42Å; L439-A443 PolarHBondContact O-N 2.96Å; L439-I568 HydrophobicContact CD2-CB 4.43Å; L439-I568 HydrophobicContact CD2-CD1 3.65Å; L439-I568 HydrophobicContact CD2-CG2 3.93Å; L439-I570 HydrophobicContact CD2-CD1 4.17Å
440	V	87.3	Confident	76.1	Confident	11 Å²	11	36.8 Å²	36.8	7%	0.067	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-46.7	172.9	177.3	0	0	0	0	110.5	E436 G437 A443 K444	E436-V440 PolarHBondContact O-N 3.26Å; G437-V440 PolarHBondContact O-N 3.17Å; V440-A443 PolarHBondContact O-N 2.67Å; V440-K444 PolarHBondContact O-N 2.8Å
441	V	87.3	Confident	73.9	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.024	23%	0.226	C	C	.	.	H	α-helix	trans	-72.9	-33.5	-179	171.5	0	0	0	0	112.1	Y388 V425 G437 A443 K444 K445	Y388-V441 HydrophobicContact CD1-CG2 4.07Å; V425-V441 HydrophobicContact CB-CG2 4.05Å; V425-V441 HydrophobicContact CG1-CG2 4Å; V425-V441 HydrophobicContact CG2-CG2 3.82Å; G437-V441 PolarHBondContact O-N 3.5Å; V441-A443 VanDerWaalsContact C-N 3.28Å; V441-A443 PolarHBondContact O-N 2.98Å; V441-K444 PolarHBondContact O-N 3.39Å; V441-K444 VanDerWaalsContact O-N 3.15Å; V441-K445 HydrophobicContact CG1-CD 4.5Å; V441-K445 WeakPolarHBondContact O-CG 3.33Å; V441-K445 PolarHBondContact O-N 3.14Å; V441-K445 VanDerWaalsContact O-N 3.1Å
442	L	87.9	Confident	71.9	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-51.8	-47.5	167.9	171.6	61.8	0	0	0	111.7	A370 L373 V383 I414 A438 L439 K444 K445 I568	A370-L442 HydrophobicContact CB-CB 4.12Å; A370-L442 HydrophobicContact CB-CD1 4.4Å; A370-L442 HydrophobicContact CB-CD2 3.99Å; A370-L442 HydrophobicContact CB-CG 4.41Å; L373-L442 HydrophobicContact CD1-CD1 3.91Å; L373-L442 HydrophobicContact CD1-CD2 3.96Å; L373-L442 HydrophobicContact CD2-CD2 4.17Å; L373-L442 HydrophobicContact CG-CD2 4.5Å; V383-L442 HydrophobicContact CB-CD1 4.42Å; V383-L442 HydrophobicContact CG1-CD1 3.94Å; V383-L442 HydrophobicContact CG2-CD1 3.59Å; I414-L442 HydrophobicContact CG1-CD2 4.13Å; I414-L442 HydrophobicContact CG1-CG 4.2Å; A438-L442 VanDerWaalsContact O-CB 3.29Å; A438-L442 WeakPolarHBondContact O-CB 3.28Å; A438-L442 PolarHBondContact O-N 3.35Å; L439-L442 HydrophobicContact CD2-CD2 4.46Å; L439-L442 WeakPolarHBondContact O-CB 3.42Å; L442-K444 VanDerWaalsContact C-N 3.31Å; L442-K444 PolarHBondContact O-N 3.05Å; L442-K445 PolarHBondContact O-N 2.99Å; L442-I568 HydrophobicContact CD2-CD1 4.39Å; L442-I568 HydrophobicContact CD2-CG2 4.31Å
443	A	84.8	Confident	70	Confident	2 Å²	2	47.7 Å²	47.7	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-69	-26.6	-179.8	0	0	0	0	0	114.2	I414 V418 L439 V440 V441	I414-A443 HydrophobicContact CG2-CB 3.53Å; V418-A443 HydrophobicContact CG2-CB 3.24Å; L439-A443 PolarHBondContact O-N 2.96Å; V440-A443 PolarHBondContact O-N 2.67Å; V441-A443 VanDerWaalsContact C-N 3.28Å; V441-A443 PolarHBondContact O-N 2.98Å
444	K	80.4	Confident	67.7	Low	34 Å²	34	49 Å²	49	15%	0.148	27%	0.269	C	S	.	.	H	α-helix	trans	-69	-42	172.2	-65.3	-177.6	178.9	-175	0	111.1	E390 V425 V440 V441 L442 V446 G447 A467	E390-K444 HydrophobicContact CG-CD 3.87Å; E390-K444 VanDerWaalsContact OE1-CD 3.31Å; E390-K444 WeakPolarHBondContact OE1-CD 3.43Å; E390-K444 WeakPolarHBondContact OE1-CE 3.44Å; E390-K444 IonicContact OE1-NZ 3.97Å; E390-K444 PolarHBondContact OE1-NZ 3.05Å; V425-K444 PolarHBondContact O-NZ 2.9Å; V440-K444 PolarHBondContact O-N 2.8Å; V441-K444 PolarHBondContact O-N 3.39Å; V441-K444 VanDerWaalsContact O-N 3.15Å; L442-K444 VanDerWaalsContact C-N 3.31Å; L442-K444 PolarHBondContact O-N 3.05Å; K444-V446 PolarHBondContact O-N 3.09Å; K444-G447 PolarHBondContact O-N 3.24Å; K444-A467 HydrophobicContact CG-CB 4.24Å
445	K	79.6	Confident	65.5	Low	8 Å²	8	53.3 Å²	53.3	4%	0.035	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	0.3	177.3	-67	176.6	178.1	-178.2	0	116.1	V383 S384 G385 C395 V441 L442	V383-K445 HydrophobicContact CG1-CD 3.77Å; S384-K445 WeakPolarHBondContact O-CD 3.36Å; S384-K445 WeakPolarHBondContact O-CE 3.16Å; S384-K445 PolarHBondContact O-NZ 3.44Å; G385-K445 PolarHBondContact O-NZ 2.83Å; C395-K445 PolarHBondContact N-O 3.35Å; V441-K445 HydrophobicContact CG1-CD 4.5Å; V441-K445 WeakPolarHBondContact O-CG 3.33Å; V441-K445 PolarHBondContact O-N 3.14Å; V441-K445 VanDerWaalsContact O-N 3.1Å; L442-K445 PolarHBondContact O-N 2.99Å
446	V	73.7	Confident	62.8	Low	5 Å²	5	62 Å²	62	3%	0.03	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	1	175.8	-178.5	0	0	0	0	111.7	C395 V402 I414 K444	C395-V446 HydrophobicContact CB-CG2 3.53Å; V402-V446 HydrophobicContact CB-CG1 4.18Å; V402-V446 HydrophobicContact CG1-CG1 3.81Å; I414-V446 HydrophobicContact CD1-CG2 3.71Å; K444-V446 PolarHBondContact O-N 3.09Å
447	G	56.3	Low	60.5	Low	31 Å²	31	66.8 Å²	66.8	32%	0.32	36%	0.357	S	S	.	.	S	Bend	trans	-116.6	-3.8	-170.9	0	0	0	0	0	117	K444	K444-G447 PolarHBondContact O-N 3.24Å
448	D	50.4	Low	58.2	Low	83 Å²	83	72.3 Å²	72.3	44%	0.444	39%	0.386	S	S	.	.			trans	-130.5	121.8	180	-73.4	-68.5	0	0	0	111.5	K465	D448-K465 IonicContact OD1-NZ 2.68Å; D448-K465 PolarHBondContact OD1-NZ 3.33Å; D448-K465 IonicContact OD2-NZ 2.74Å; D448-K465 PolarHBondContact OD2-NZ 3.05Å
449	M	37.1	Very low	55.6	Low	121 Å²	121	79 Å²	79	60%	0.596	42%	0.421	S	S	*	.			trans	-117.8	148.6	162.4	178.8	177.5	-86.9	0	0	107.6	A401 L403	A401-M449 HydrophobicContact CB-CE 4.2Å; L403-M449 HydrophobicContact CD1-CE 3.96Å; L403-M449 HydrophobicContact CD1-SD 4.4Å; L403-M449 HydrophobicContact CD2-CB 4.26Å; L403-M449 HydrophobicContact CD2-CE 4.25Å
450	D	38.7	Very low	52.9	Low	147 Å²	147	88 Å²	88	79%	0.786	46%	0.46	S	S	*	.			trans	-46.3	129.1	-150.1	-70.8	-79.3	0	0	0	119	N452	D450-N452 VanDerWaalsContact C-N 3.32Å; D450-N452 PolarHBondContact O-N 2.91Å
451	L	31.8	Very low	50.3	Low	162 Å²	162	90.7 Å²	90.7	85%	0.848	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	78.9	169.9	-177	79.2	0	0	0	111.3
452	N	32.8	Very low	47.7	Very low	150 Å²	150	102.5 Å²	102.5	80%	0.802	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.7	-18.5	163.2	-100.7	-44.9	0	0	0	117.2	D450	D450-N452 VanDerWaalsContact C-N 3.32Å; D450-N452 PolarHBondContact O-N 2.91Å
453	I	34.7	Very low	45.1	Very low	158 Å²	158	110.4 Å²	110.4	81%	0.81	56%	0.558	S	S	*	*	S	Bend	trans	-114.8	-28	-168.2	-67.2	178.2	0	0	0	115.3
454	C	33.5	Very low	43	Very low	71 Å²	71	113.8 Å²	113.8	48%	0.48	59%	0.586	S	S	.	*			trans	-112.1	26	-167.4	-73.7	0	0	0	0	116.7	F456 I457 L458	C454-F456 VanDerWaalsContact C-N 3.25Å; C454-F456 PolarHBondContact O-N 2.74Å; C454-F456 VanDerWaalsContact O-N 3.15Å; C454-I457 PolarHBondContact O-N 2.76Å; C454-L458 HydrophobicContact CB-CD1 4.28Å; C454-L458 PolarHBondContact O-N 3.1Å
455	V	37.1	Very low	41.5	Very low	103 Å²	103	116.7 Å²	116.7	62%	0.624	60%	0.598	S	S	*	*	H	α-helix	trans	-54.7	-35.8	-175.4	179.7	0	0	0	0	113.6
456	F	31.9	Very low	40.2	Very low	191 Å²	191	117 Å²	117	84%	0.838	60%	0.6	S	S	*	*	H	α-helix	trans	-79.5	-18	-174	-149.5	-94.8	0	0	0	114.6	C454	C454-F456 VanDerWaalsContact C-N 3.25Å; C454-F456 PolarHBondContact O-N 2.74Å; C454-F456 VanDerWaalsContact O-N 3.15Å
457	I	38.6	Very low	39.3	Very low	112 Å²	112	118.6 Å²	118.6	57%	0.574	61%	0.613	S	S	*	*	H	α-helix	trans	-99	-41.2	-175.6	-62.6	177	0	0	0	111.1	C454 L459 F460 T461	C454-I457 PolarHBondContact O-N 2.76Å; I457-L459 PolarHBondContact O-N 2.89Å; I457-L459 VanDerWaalsContact O-N 3.14Å; I457-F460 PolarHBondContact O-N 2.68Å; I457-T461 PolarHBondContact O-N 3.22Å; I457-T461 PolarHBondContact O-OG1 3.47Å
458	L	38.8	Very low	39.2	Very low	117 Å²	117	120 Å²	120	61%	0.613	61%	0.614	S	S	*	*	H	α-helix	trans	-63.8	-18.8	-179.2	-73.6	165.9	0	0	0	114	C454 F460	C454-L458 HydrophobicContact CB-CD1 4.28Å; C454-L458 PolarHBondContact O-N 3.1Å; L458-F460 VanDerWaalsContact C-N 3.28Å; L458-F460 PolarHBondContact O-N 3.02Å
459	L	35.2	Very low	39.5	Very low	143 Å²	143	120.1 Å²	120.1	75%	0.749	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-18.3	172.5	-78.4	168	0	0	0	113.8	I457	I457-L459 PolarHBondContact O-N 2.89Å; I457-L459 VanDerWaalsContact O-N 3.14Å
460	F	33.8	Very low	40.6	Very low	192 Å²	192	118.7 Å²	118.7	84%	0.842	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-21.5	179.5	-96.8	-91.8	0	0	0	114.2	I457 L458	I457-F460 PolarHBondContact O-N 2.68Å; L458-F460 VanDerWaalsContact C-N 3.28Å; L458-F460 PolarHBondContact O-N 3.02Å
461	T	32.2	Very low	41.6	Very low	67 Å²	67	120.1 Å²	120.1	41%	0.411	59%	0.59	S	S	.	*			trans	-101.6	98.6	179.6	46.7	0	0	0	0	112.2	I457 Q463	I457-T461 PolarHBondContact O-N 3.22Å; I457-T461 PolarHBondContact O-OG1 3.47Å; T461-Q463 PolarHBondContact O-N 3.44Å
462	R	31.6	Very low	43.3	Very low	252 Å²	252	115.8 Å²	115.8	95%	0.951	57%	0.568	S	S	*	*			trans	-71.5	57	177	-65.4	179.2	69.9	172.3	2.4	113.4	A464	R462-A464 PolarHBondContact O-N 3.07Å
463	Q	34.1	Very low	45.3	Very low	170 Å²	170	109.5 Å²	109.5	79%	0.794	53%	0.534	S	S	*	.			trans	-75.6	111.3	168.5	-70.6	-173	-15.3	0	0	109.2	T461	T461-Q463 PolarHBondContact O-N 3.44Å
464	A	40.3	Very low	47.4	Very low	73 Å²	73	106.1 Å²	106.1	60%	0.603	52%	0.515	S	S	*	.			trans	-72	133.4	-175.9	0	0	0	0	0	111.8	R462	R462-A464 PolarHBondContact O-N 3.07Å
465	K	50.1	Low	49.8	Very low	95 Å²	95	106 Å²	106	41%	0.413	51%	0.509	S	S	.	.			trans	-58.9	144.9	173.2	-72.3	-163.5	168.9	-166	0	110.4	D448 A467 D468	D448-K465 IonicContact OD1-NZ 2.68Å; D448-K465 PolarHBondContact OD1-NZ 3.33Å; D448-K465 IonicContact OD2-NZ 2.74Å; D448-K465 PolarHBondContact OD2-NZ 3.05Å; K465-A467 PolarHBondContact O-N 3.18Å; K465-D468 WeakPolarHBondContact O-CB 3.2Å; K465-D468 PolarHBondContact O-N 3.38Å
466	L	51.9	Low	52.1	Low	15 Å²	15	105.7 Å²	105.7	8%	0.079	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-58.4	-36.1	-177.3	-123.3	78.5	0	0	0	112.6	F405 I414 D468 R469	F405-L466 HydrophobicContact CE2-CD1 3.9Å; F405-L466 HydrophobicContact CZ-CD1 3.78Å; I414-L466 HydrophobicContact CB-CD2 4.39Å; I414-L466 HydrophobicContact CG2-CD2 3.82Å; L466-D468 PolarHBondContact O-N 2.98Å; L466-R469 WeakPolarHBondContact O-CB 3.36Å; L466-R469 PolarHBondContact O-N 3.5Å; L466-R469 VanDerWaalsContact O-N 3.09Å
467	A	53.5	Low	54.8	Low	37 Å²	37	101.2 Å²	101.2	31%	0.306	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-59.7	-30.6	175.2	0	0	0	0	0	113.6	K444 K465 R469	K444-A467 HydrophobicContact CG-CB 4.24Å; K465-A467 PolarHBondContact O-N 3.18Å; A467-R469 VanDerWaalsContact C-N 3.27Å; A467-R469 PolarHBondContact O-N 2.89Å
468	D	55.5	Low	57	Low	62 Å²	62	99.5 Å²	99.5	33%	0.332	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-72.4	-15.5	177.2	-99.9	-50.7	0	0	0	113.2	K465 L466 R470 R471	K465-D468 WeakPolarHBondContact O-CB 3.2Å; K465-D468 PolarHBondContact O-N 3.38Å; L466-D468 PolarHBondContact O-N 2.98Å; D468-R470 PolarHBondContact O-N 3.28Å; D468-R470 VanDerWaalsContact O-N 3.07Å; D468-R471 WeakPolarHBondContact O-CB 3.09Å; D468-R471 PolarHBondContact O-N 3.45Å; D468-R471 WeakPolarHBondContact OD1-CD 3.25Å; D468-R471 IonicContact OD1-CZ 3.71Å; D468-R471 IonicContact OD1-NE 2.8Å; D468-R471 IonicContact OD1-NH1 3.61Å; D468-R471 PolarHBondContact OD1-NH1 2.9Å
469	R	56.9	Low	59.4	Low	85 Å²	85	96.1 Å²	96.1	32%	0.321	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-57.5	-26	177.2	-82.9	-160.5	169	-163.4	-0.8	113	E415 L466 A467 R471 N472 F473	E415-R469 WeakPolarHBondContact OE1-CD 3.27Å; E415-R469 IonicContact OE1-CZ 3.23Å; E415-R469 IonicContact OE1-NE 4Å; E415-R469 IonicContact OE1-NH1 3.01Å; E415-R469 PolarHBondContact OE1-NH1 3.1Å; L466-R469 WeakPolarHBondContact O-CB 3.36Å; L466-R469 PolarHBondContact O-N 3.5Å; L466-R469 VanDerWaalsContact O-N 3.09Å; A467-R469 VanDerWaalsContact C-N 3.27Å; A467-R469 PolarHBondContact O-N 2.89Å; R469-R471 PolarHBondContact O-N 3.08Å; R469-R471 VanDerWaalsContact O-N 3.12Å; R469-N472 WeakPolarHBondContact O-CA 3.47Å; R469-N472 WeakPolarHBondContact O-CB 3.38Å; R469-N472 PolarHBondContact O-N 2.89Å; R469-F473 HydrophobicContact CB-CE2 4.36Å; R469-F473 WeakPolarHBondContact O-CD2 3.36Å; R469-F473 PolarHBondContact O-N 3.35Å
470	R	58.7	Low	61.8	Low	90 Å²	90	93.2 Å²	93.2	34%	0.34	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-60.2	-19.9	174.8	-167.6	171.8	175.2	178.7	2.2	113.3	V418 N421 S423 D468	V418-R470 HydrophobicContact CG1-CB 4.27Å; N421-R470 PolarHBondContact O-NH1 3.1Å; N421-R470 PolarHBondContact O-NH2 3.3Å; S423-R470 PolarHBondContact O-NH1 2.96Å; D468-R470 PolarHBondContact O-N 3.28Å; D468-R470 VanDerWaalsContact O-N 3.07Å
471	R	59.9	Low	64.3	Low	177 Å²	177	87.7 Å²	87.7	67%	0.668	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-80.7	-22.8	172	-63	179.6	170.4	153.8	-8.7	113.5	D468 R469 R495	D468-R471 WeakPolarHBondContact O-CB 3.09Å; D468-R471 PolarHBondContact O-N 3.45Å; D468-R471 WeakPolarHBondContact OD1-CD 3.25Å; D468-R471 IonicContact OD1-CZ 3.71Å; D468-R471 IonicContact OD1-NE 2.8Å; D468-R471 IonicContact OD1-NH1 3.61Å; D468-R471 PolarHBondContact OD1-NH1 2.9Å; R469-R471 PolarHBondContact O-N 3.08Å; R469-R471 VanDerWaalsContact O-N 3.12Å; R471-R495 PolarHBondContact O-NH1 3.3Å
472	N	68.7	Low	66.5	Low	72 Å²	72	86.5 Å²	86.5	39%	0.385	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-20.9	178.8	-64.3	-6	0	0	0	112.6	R469 R495	R469-N472 WeakPolarHBondContact O-CA 3.47Å; R469-N472 WeakPolarHBondContact O-CB 3.38Å; R469-N472 PolarHBondContact O-N 2.89Å; N472-R495 VanDerWaalsContact O-CB 3.27Å; N472-R495 WeakPolarHBondContact O-CB 3.39Å; N472-R495 WeakPolarHBondContact O-CG 3.39Å; N472-R495 PolarHBondContact O-N 2.94Å
473	F	73.5	Confident	68.5	Low	18 Å²	18	78.5 Å²	78.5	8%	0.079	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	140.6	171.7	-70.5	-75.1	0	0	0	111.3	E415 V419 R469 C492 N493 N494 Y504	E415-F473 HydrophobicContact CG-CE2 4.3Å; E415-F473 WeakPolarHBondContact OE1-CE2 3.4Å; E415-F473 WeakPolarHBondContact OE1-CZ 3.38Å; V419-F473 HydrophobicContact CG1-CG 4.42Å; V419-F473 HydrophobicContact CG2-CD2 3.47Å; V419-F473 VanDerWaalsContact CG2-CD2 3.47Å; V419-F473 HydrophobicContact CG2-CE2 3.7Å; V419-F473 HydrophobicContact CG2-CG 4.09Å; V419-F473 HydrophobicContact CG2-CZ 4.49Å; R469-F473 HydrophobicContact CB-CE2 4.36Å; R469-F473 WeakPolarHBondContact O-CD2 3.36Å; R469-F473 PolarHBondContact O-N 3.35Å; F473-C492 HydrophobicContact CB-CB 4.41Å; F473-C492 HydrophobicContact CD1-CB 4.12Å; F473-N493 CarbonylContact C-O 3.53Å; F473-N493 WeakPolarHBondContact CA-O 3.42Å; F473-N494 HydrophobicContact CD1-CB 4.17Å; F473-N494 HydrophobicContact CE1-CB 3.91Å; F473-Y504 HydrophobicContact CE1-CE2 4.3Å
474	E	80.3	Confident	70.4	Confident	87 Å²	87	77.1 Å²	77.1	41%	0.407	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	114.3	173.1	-169.1	157.4	140.6	0	0	108.8	L476 C492 N493 R495	E474-L476 PolarHBondContact O-N 2.86Å; E474-C492 VanDerWaalsContact O-CA 3.31Å; E474-C492 WeakPolarHBondContact O-CA 3.5Å; E474-N493 PolarHBondContact N-O 3.23Å; E474-N493 PolarHBondContact O-N 3.38Å; E474-R495 HydrophobicContact CB-CG 4.36Å; E474-R495 IonicContact OE2-CZ 3.46Å; E474-R495 IonicContact OE2-NE 2.73Å; E474-R495 PolarHBondContact OE2-NE 3.33Å; E474-R495 IonicContact OE2-NH2 2.76Å; E474-R495 PolarHBondContact OE2-NH2 3.34Å
475	I	82.4	Confident	72.5	Confident	69 Å²	69	76.4 Å²	76.4	35%	0.354	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	109.8	178.5	-60	169	0	0	0	107.6	V490	I475-V490 HydrophobicContact CG2-CB 4.21Å; I475-V490 HydrophobicContact CG2-CG1 4.3Å
476	L	85.8	Confident	74.3	Confident	95 Å²	95	77 Å²	77	50%	0.497	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-32.9	178	-58.7	-179.3	0	0	0	111.8	E474 L491 N493 P501	E474-L476 PolarHBondContact O-N 2.86Å; L476-L491 HydrophobicContact CB-CG 4.44Å; L476-L491 PolarHBondContact N-O 3.1Å; L476-N493 HydrophobicContact CD1-CB 4.19Å; L476-N493 HydrophobicContact CG-CB 4.44Å; L476-P501 HydrophobicContact CD1-CB 3.84Å
477	Q	88.2	Confident	76.2	Confident	98 Å²	98	78.3 Å²	78.3	46%	0.458	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	142.3	179.7	-176	-179.1	-5.5	0	0	110	V490 L491	Q477-V490 CarbonylContact O-C 3.59Å; Q477-V490 WeakPolarHBondContact O-CA 3.49Å; Q477-L491 HydrophobicContact CB-CB 4.05Å; Q477-L491 PolarHBondContact N-O 2.98Å; Q477-L491 PolarHBondContact O-N 3.36Å
478	E	86.3	Confident	78.1	Confident	75 Å²	75	76.6 Å²	76.6	35%	0.35	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	141.3	168.9	-177.1	-178.9	152.9	0	0	110.1	N422 M488 V490	N422-E478 PolarHBondContact ND2-OE1 2.85Å; E478-M488 HydrophobicContact CG-CE 4.23Å; E478-V490 HydrophobicContact CB-CG1 4.37Å; E478-V490 HydrophobicContact CG-CG1 4.1Å
479	I	89.4	Confident	79.9	Confident	47 Å²	47	73.7 Å²	73.7	24%	0.241	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	100.2	165	-55.4	177.5	0	0	0	106.5	W487 M488 A489 L559	I479-W487 HydrophobicContact CB-CZ3 4.02Å; I479-W487 HydrophobicContact CD1-CH2 4.11Å; I479-W487 HydrophobicContact CD1-CZ3 4.12Å; I479-W487 HydrophobicContact CG2-CH2 3.91Å; I479-W487 HydrophobicContact CG2-CZ3 3.63Å; I479-M488 WeakPolarHBondContact O-CA 3.31Å; I479-M488 WeakPolarHBondContact O-CG 3.36Å; I479-A489 HydrophobicContact CB-CB 4.33Å; I479-A489 HydrophobicContact CD1-CB 4.5Å; I479-A489 PolarHBondContact N-O 2.96Å; I479-A489 PolarHBondContact O-N 2.77Å; I479-L559 HydrophobicContact CD1-CD1 3.83Å
480	P	85.3	Confident	81.5	Confident	81 Å²	81	69.7 Å²	69.7	53%	0.526	35%	0.347	S	S	.	.			trans	-71.2	156.3	-171.5	28.8	-36	0	0	0	112.1	S482	P480-S482 PolarHBondContact O-N 2.77Å; P480-S482 VanDerWaalsContact O-N 3.14Å
481	F	85.3	Confident	83.1	Confident	76 Å²	76	66.4 Å²	66.4	33%	0.333	34%	0.336	S	S	.	.			trans	-60.8	115.4	-179.4	-176.6	-92.4	0	0	0	113	K203 K486 M488	K203-F481 PolarHBondContact NZ-O 3.03Å; F481-K486 VanDerWaalsContact CE2-C 3.47Å; F481-M488 HydrophobicContact CB-CB 4.16Å
482	S	79.4	Confident	84.5	Confident	42 Å²	42	58.1 Å²	58.1	29%	0.294	31%	0.305	S	S	.	.			trans	-99.5	143.2	164.8	178.1	0	0	0	0	111.3	P480 D484 T485 K486	P480-S482 PolarHBondContact O-N 2.77Å; P480-S482 VanDerWaalsContact O-N 3.14Å; S482-D484 PolarHBondContact O-N 2.74Å; S482-D484 PolarHBondContact OG-N 3.2Å; S482-D484 PolarHBondContact OG-OD2 2.72Å; S482-T485 PolarHBondContact O-OG1 2.71Å; S482-K486 WeakPolarHBondContact O-CA 3.41Å; S482-K486 PolarHBondContact O-N 3.4Å
483	S	73.9	Confident	85.3	Confident	84 Å²	84	57.3 Å²	57.3	59%	0.587	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-22.8	172.5	-58.5	0	0	0	0	113.2	K486	S483-K486 VanDerWaalsContact O-CG 3.27Å; S483-K486 WeakPolarHBondContact O-CG 3.39Å
484	D	73.2	Confident	85.5	Confident	142 Å²	142	59 Å²	59	76%	0.759	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-44.4	-178.2	-49.8	-50.8	0	0	0	111.2	S482	S482-D484 PolarHBondContact O-N 2.74Å; S482-D484 PolarHBondContact OG-N 3.2Å; S482-D484 PolarHBondContact OG-OD2 2.72Å
485	T	85.1	Confident	85	Confident	57 Å²	57	62.3 Å²	62.3	35%	0.35	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-30.2	178.5	61.8	0	0	0	0	113	S482 W487	S482-T485 PolarHBondContact O-OG1 2.71Å; T485-W487 PolarHBondContact O-N 2.94Å
486	K	87.9	Confident	84.1	Confident	109 Å²	109	64 Å²	64	47%	0.474	34%	0.337	S	S	.	.			trans	62.4	23	179.7	-52.3	173.8	-172.4	170.6	0	114.7	F481 S482 S483 G507 A508	F481-K486 VanDerWaalsContact CE2-C 3.47Å; S482-K486 WeakPolarHBondContact O-CA 3.41Å; S482-K486 PolarHBondContact O-N 3.4Å; S483-K486 VanDerWaalsContact O-CG 3.27Å; S483-K486 WeakPolarHBondContact O-CG 3.39Å; K486-G507 CarbonylContact O-C 3.46Å; K486-G507 VanDerWaalsContact O-CA 3.3Å; K486-G507 WeakPolarHBondContact O-CA 3.16Å; K486-A508 HydrophobicContact CB-CB 3.83Å; K486-A508 PolarHBondContact O-N 3.41Å
487	W	92.1	Very high	83.2	Confident	41 Å²	41	62.7 Å²	62.7	16%	0.155	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	163.4	172.5	58.8	-101.4	0	0	0	112	I479 T485 A489 K506 M515 L559	I479-W487 HydrophobicContact CB-CZ3 4.02Å; I479-W487 HydrophobicContact CD1-CH2 4.11Å; I479-W487 HydrophobicContact CD1-CZ3 4.12Å; I479-W487 HydrophobicContact CG2-CH2 3.91Å; I479-W487 HydrophobicContact CG2-CZ3 3.63Å; T485-W487 PolarHBondContact O-N 2.94Å; W487-A489 HydrophobicContact CE3-CB 4.04Å; W487-A489 HydrophobicContact CZ3-CB 3.69Å; W487-K506 CarbonylContact C-O 3.45Å; W487-K506 VanDerWaalsContact CA-O 3.29Å; W487-K506 WeakPolarHBondContact CA-O 3.38Å; W487-K506 WeakPolarHBondContact CB-O 3.31Å; W487-M515 HydrophobicContact CB-CE 4.18Å; W487-M515 HydrophobicContact CD2-CE 3.83Å; W487-M515 HydrophobicContact CD2-SD 4.27Å; W487-M515 HydrophobicContact CG-CE 3.62Å; W487-M515 HydrophobicContact CZ2-SD 4.12Å; W487-L559 HydrophobicContact CH2-CD1 4.37Å
488	M	92.1	Very high	82	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.8	172.8	177.5	-174.5	171.9	0	0	108.3	N422 E478 I479 F481 V490 V505 K506	N422-M488 WeakPolarHBondContact OD1-CE 3.22Å; E478-M488 HydrophobicContact CG-CE 4.23Å; I479-M488 WeakPolarHBondContact O-CA 3.31Å; I479-M488 WeakPolarHBondContact O-CG 3.36Å; F481-M488 HydrophobicContact CB-CB 4.16Å; M488-V490 HydrophobicContact CE-CG1 4.25Å; M488-V505 WeakPolarHBondContact O-CA 3.47Å; M488-K506 HydrophobicContact CB-CG 4.26Å; M488-K506 PolarHBondContact N-O 2.92Å; M488-K506 PolarHBondContact O-N 3.08Å; M488-K506 WeakPolarHBondContact SD-CE 3.34Å; M488-K506 PolarHBondContact SD-NZ 3.34Å; M488-K506 VanDerWaalsContact SD-NZ 3.4Å
489	A	93.1	Very high	81.2	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.008	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148	176	0	0	0	0	0	111.5	I479 W487 Y504 V505 L559	I479-A489 HydrophobicContact CB-CB 4.33Å; I479-A489 HydrophobicContact CD1-CB 4.5Å; I479-A489 PolarHBondContact N-O 2.96Å; I479-A489 PolarHBondContact O-N 2.77Å; W487-A489 HydrophobicContact CE3-CB 4.04Å; W487-A489 HydrophobicContact CZ3-CB 3.69Å; A489-Y504 WeakPolarHBondContact CA-O 3.49Å; A489-V505 HydrophobicContact CB-CG2 3.87Å; A489-L559 HydrophobicContact CB-CD2 4.02Å
490	V	91.8	Very high	80.8	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.006	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.4	165.5	-65.1	0	0	0	0	109.4	V419 C420 I475 Q477 E478 M488 C492 Y503 Y504	V419-V490 HydrophobicContact CG1-CG2 4.06Å; C420-V490 HydrophobicContact CB-CG2 3.84Å; I475-V490 HydrophobicContact CG2-CB 4.21Å; I475-V490 HydrophobicContact CG2-CG1 4.3Å; Q477-V490 CarbonylContact O-C 3.59Å; Q477-V490 WeakPolarHBondContact O-CA 3.49Å; E478-V490 HydrophobicContact CB-CG1 4.37Å; E478-V490 HydrophobicContact CG-CG1 4.1Å; M488-V490 HydrophobicContact CE-CG1 4.25Å; V490-C492 VanDerWaalsContact CG2-SG 3.56Å; V490-Y503 CarbonylContact O-C 3.59Å; V490-Y503 WeakPolarHBondContact O-CA 3.48Å; V490-Y504 PolarHBondContact N-O 2.87Å; V490-Y504 PolarHBondContact O-N 3.47Å
491	L	92.6	Very high	80.8	Confident	22 Å²	22	66.7 Å²	66.7	12%	0.115	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	117.7	170.7	-178.8	60.4	0	0	0	108.2	L476 Q477 P501 Y503	L476-L491 HydrophobicContact CB-CG 4.44Å; L476-L491 PolarHBondContact N-O 3.1Å; Q477-L491 HydrophobicContact CB-CB 4.05Å; Q477-L491 PolarHBondContact N-O 2.98Å; Q477-L491 PolarHBondContact O-N 3.36Å; L491-P501 HydrophobicContact CD1-CB 3.79Å; L491-P501 HydrophobicContact CD1-CG 4.33Å; L491-P501 HydrophobicContact CG-CB 4.12Å; L491-Y503 HydrophobicContact CB-CD1 4.08Å; L491-Y503 HydrophobicContact CB-CE1 3.91Å; L491-Y503 HydrophobicContact CD1-CD1 4.05Å; L491-Y503 HydrophobicContact CD1-CD2 3.83Å; L491-Y503 HydrophobicContact CD1-CE1 4Å; L491-Y503 HydrophobicContact CD1-CE2 3.76Å; L491-Y503 HydrophobicContact CD1-CG 3.98Å; L491-Y503 HydrophobicContact CD2-CE1 4.36Å; L491-Y503 HydrophobicContact CG-CE1 4.31Å
492	C	87.3	Confident	81.1	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.014	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	134.7	-172.1	-67	0	0	0	0	112.4	V419 F473 E474 V490 P501 V502 Y504	V419-C492 HydrophobicContact CG1-CB 4.18Å; V419-C492 WeakPolarHBondContact CG1-SG 3.33Å; F473-C492 HydrophobicContact CB-CB 4.41Å; F473-C492 HydrophobicContact CD1-CB 4.12Å; E474-C492 VanDerWaalsContact O-CA 3.31Å; E474-C492 WeakPolarHBondContact O-CA 3.5Å; V490-C492 VanDerWaalsContact CG2-SG 3.56Å; C492-P501 WeakPolarHBondContact O-CA 3.35Å; C492-V502 PolarHBondContact N-O 3.23Å; C492-V502 PolarHBondContact O-N 3.04Å; C492-Y504 HydrophobicContact CB-CD2 3.97Å; C492-Y504 HydrophobicContact CB-CE2 4.04Å
493	N	85.7	Confident	81.8	Confident	56 Å²	56	64.9 Å²	64.9	30%	0.299	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	149.9	163.1	-165.7	-0.3	0	0	0	110.2	F473 E474 L476	F473-N493 CarbonylContact C-O 3.53Å; F473-N493 WeakPolarHBondContact CA-O 3.42Å; E474-N493 PolarHBondContact N-O 3.23Å; E474-N493 PolarHBondContact O-N 3.38Å; L476-N493 HydrophobicContact CD1-CB 4.19Å; L476-N493 HydrophobicContact CG-CB 4.44Å
494	N	78.8	Confident	82.7	Confident	53 Å²	53	61.4 Å²	61.4	28%	0.283	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	110.9	176.6	-179.9	-8.6	0	0	0	109.8	F473 S496 S497	F473-N494 HydrophobicContact CD1-CB 4.17Å; F473-N494 HydrophobicContact CE1-CB 3.91Å; N494-S496 PolarHBondContact O-N 2.72Å; N494-S496 WeakPolarHBondContact OD1-CB 3.48Å; N494-S496 PolarHBondContact OD1-N 2.79Å; N494-S497 CarbonylContact O-C 3.59Å; N494-S497 PolarHBondContact O-N 3.28Å
495	R	69.3	Low	83.7	Confident	157 Å²	157	54.6 Å²	54.6	59%	0.592	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-16.2	-179.3	-66	171.5	165.1	167.4	-7.4	114.4	R471 N472 E474	R471-R495 PolarHBondContact O-NH1 3.3Å; N472-R495 VanDerWaalsContact O-CB 3.27Å; N472-R495 WeakPolarHBondContact O-CB 3.39Å; N472-R495 WeakPolarHBondContact O-CG 3.39Å; N472-R495 PolarHBondContact O-N 2.94Å; E474-R495 HydrophobicContact CB-CG 4.36Å; E474-R495 IonicContact OE2-CZ 3.46Å; E474-R495 IonicContact OE2-NE 2.73Å; E474-R495 PolarHBondContact OE2-NE 3.33Å; E474-R495 IonicContact OE2-NH2 2.76Å; E474-R495 PolarHBondContact OE2-NH2 3.34Å
496	S	64.7	Low	84.2	Confident	103 Å²	103	52.4 Å²	52.4	72%	0.72	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-1.6	177.3	-170.2	0	0	0	0	114.2	N494	N494-S496 PolarHBondContact O-N 2.72Å; N494-S496 WeakPolarHBondContact OD1-CB 3.48Å; N494-S496 PolarHBondContact OD1-N 2.79Å
497	S	65.2	Low	84.4	Confident	68 Å²	68	47.5 Å²	47.5	48%	0.476	26%	0.264	S	S	.	.			trans	-146.3	119.2	-178.7	-172	0	0	0	0	110.9	N494 G499	N494-S497 CarbonylContact O-C 3.59Å; N494-S497 PolarHBondContact O-N 3.28Å; S497-G499 PolarHBondContact O-N 2.86Å
498	N	64.2	Low	84.4	Confident	173 Å²	173	47.1 Å²	47.1	93%	0.925	27%	0.269	S	S	*	.			trans	-79.5	47.9	-174.6	-161.7	77	0	0	0	112.7
499	G	68	Low	84.4	Confident	40 Å²	40	47.9 Å²	47.9	41%	0.412	27%	0.274	S	S	.	.			trans	-104	179.1	-179.6	0	0	0	0	0	113.2	S497	S497-G499 PolarHBondContact O-N 2.86Å
500	D	81	Confident	84.2	Confident	123 Å²	123	50.4 Å²	50.4	66%	0.658	29%	0.291	S	S	*	.			trans	-64.4	147.4	-178.2	-63.7	-56.6	0	0	0	112.8	L557	D500-L557 HydrophobicContact CB-CD2 3.93Å
501	P	86.7	Confident	84.2	Confident	50 Å²	50	51.3 Å²	51.3	33%	0.325	30%	0.298	S	S	.	.			trans	-70.1	134.4	179	31.2	-36.1	0	0	0	110.9	L476 L491 C492	L476-P501 HydrophobicContact CD1-CB 3.84Å; L491-P501 HydrophobicContact CD1-CB 3.79Å; L491-P501 HydrophobicContact CD1-CG 4.33Å; L491-P501 HydrophobicContact CG-CB 4.12Å; C492-P501 WeakPolarHBondContact O-CA 3.35Å
502	V	90.7	Very high	84.2	Confident	33 Å²	33	50.3 Å²	50.3	20%	0.2	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.3	-172.9	178.2	0	0	0	0	110.2	C492 Y504 Y555 L557	C492-V502 PolarHBondContact N-O 3.23Å; C492-V502 PolarHBondContact O-N 3.04Å; V502-Y504 HydrophobicContact CB-CD2 4.43Å; V502-Y504 HydrophobicContact CB-CE2 3.84Å; V502-Y504 HydrophobicContact CG1-CD2 4.21Å; V502-Y504 HydrophobicContact CG1-CE2 3.79Å; V502-Y504 WeakPolarHBondContact O-CD2 3.33Å; V502-Y555 HydrophobicContact CG1-CD2 4.28Å; V502-L557 HydrophobicContact CG2-CD2 4.34Å
503	Y	93.7	Very high	84.4	Confident	47 Å²	47	50.3 Å²	50.3	18%	0.184	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.9	167	-70.1	-84.4	0	0	0	110	V490 L491 Y555 G556 L559	V490-Y503 CarbonylContact O-C 3.59Å; V490-Y503 WeakPolarHBondContact O-CA 3.48Å; L491-Y503 HydrophobicContact CB-CD1 4.08Å; L491-Y503 HydrophobicContact CB-CE1 3.91Å; L491-Y503 HydrophobicContact CD1-CD1 4.05Å; L491-Y503 HydrophobicContact CD1-CD2 3.83Å; L491-Y503 HydrophobicContact CD1-CE1 4Å; L491-Y503 HydrophobicContact CD1-CE2 3.76Å; L491-Y503 HydrophobicContact CD1-CG 3.98Å; L491-Y503 HydrophobicContact CD2-CE1 4.36Å; L491-Y503 HydrophobicContact CG-CE1 4.31Å; Y503-Y555 CarbonylContact O-C 3.6Å; Y503-Y555 WeakPolarHBondContact O-CA 3.38Å; Y503-G556 WeakPolarHBondContact CB-O 3.34Å; Y503-G556 PolarHBondContact N-O 3.03Å; Y503-G556 PolarHBondContact O-N 3.14Å; Y503-L559 HydrophobicContact CD1-CD1 4.44Å; Y503-L559 HydrophobicContact CD1-CD2 3.63Å; Y503-L559 HydrophobicContact CD1-CG 3.89Å; Y503-L559 HydrophobicContact CD2-CG 4.48Å; Y503-L559 HydrophobicContact CE1-CD1 4.13Å; Y503-L559 HydrophobicContact CE1-CD2 4.16Å; Y503-L559 HydrophobicContact CE1-CG 3.95Å; Y503-L559 HydrophobicContact CG-CD2 3.91Å; Y503-L559 HydrophobicContact CG-CG 4.17Å
504	Y	93.7	Very high	84.7	Confident	10 Å²	10	54.3 Å²	54.3	4%	0.039	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.6	170.2	-71.2	-94.6	0	0	0	108.5	K412 E415 I416 V419 C420 F473 A489 V490 C492 V502	K412-Y504 PolarHBondContact NZ-OH 3.44Å; E415-Y504 HydrophobicContact CG-CE1 4.3Å; I416-Y504 HydrophobicContact CB-CD1 4.15Å; I416-Y504 HydrophobicContact CG1-CD1 3.77Å; I416-Y504 HydrophobicContact CG1-CE1 4.15Å; I416-Y504 HydrophobicContact CG2-CD1 4.24Å; V419-Y504 HydrophobicContact CB-CD1 4.36Å; V419-Y504 HydrophobicContact CB-CG 4.31Å; V419-Y504 HydrophobicContact CG1-CD1 4.34Å; V419-Y504 HydrophobicContact CG1-CD2 3.8Å; V419-Y504 HydrophobicContact CG1-CE2 4.25Å; V419-Y504 HydrophobicContact CG1-CG 3.86Å; C420-Y504 PolarHBondContact SG-O 2.92Å; F473-Y504 HydrophobicContact CE1-CE2 4.3Å; A489-Y504 WeakPolarHBondContact CA-O 3.49Å; V490-Y504 PolarHBondContact N-O 2.87Å; V490-Y504 PolarHBondContact O-N 3.47Å; C492-Y504 HydrophobicContact CB-CD2 3.97Å; C492-Y504 HydrophobicContact CB-CE2 4.04Å; V502-Y504 HydrophobicContact CB-CD2 4.43Å; V502-Y504 HydrophobicContact CB-CE2 3.84Å; V502-Y504 HydrophobicContact CG1-CD2 4.21Å; V502-Y504 HydrophobicContact CG1-CE2 3.79Å; V502-Y504 WeakPolarHBondContact O-CD2 3.33Å
505	V	94.8	Very high	85.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.8	-167.1	-173.8	0	0	0	0	110.6	M488 A489 M515 A554 L559 L562	M488-V505 WeakPolarHBondContact O-CA 3.47Å; A489-V505 HydrophobicContact CB-CG2 3.87Å; V505-M515 HydrophobicContact CG1-CE 3.83Å; V505-A554 PolarHBondContact N-O 2.81Å; V505-A554 PolarHBondContact O-N 2.84Å; V505-L559 HydrophobicContact CG2-CD2 3.94Å; V505-L562 HydrophobicContact CB-CD1 4Å; V505-L562 HydrophobicContact CG1-CD1 4.16Å; V505-L562 HydrophobicContact CG2-CD1 3.7Å; V505-L562 HydrophobicContact CG2-CD2 3.98Å
506	K	94.6	Very high	86.4	Confident	10 Å²	10	46.3 Å²	46.3	4%	0.043	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	149.2	173	76.6	-174.4	175.9	-169.1	0	110.8	C420 E436 W487 M488 L551 A552 V553	C420-K506 HydrophobicContact CB-CD 4.42Å; C420-K506 VanDerWaalsContact O-CD 3.28Å; C420-K506 WeakPolarHBondContact O-CD 3.31Å; C420-K506 VanDerWaalsContact O-CE 3.31Å; C420-K506 WeakPolarHBondContact O-CE 3.34Å; C420-K506 PolarHBondContact O-NZ 2.98Å; E436-K506 WeakPolarHBondContact OE1-CE 3.38Å; E436-K506 IonicContact OE1-NZ 3.53Å; E436-K506 PolarHBondContact OE1-NZ 2.89Å; E436-K506 IonicContact OE2-NZ 2.66Å; W487-K506 CarbonylContact C-O 3.45Å; W487-K506 VanDerWaalsContact CA-O 3.29Å; W487-K506 WeakPolarHBondContact CA-O 3.38Å; W487-K506 WeakPolarHBondContact CB-O 3.31Å; M488-K506 HydrophobicContact CB-CG 4.26Å; M488-K506 PolarHBondContact N-O 2.92Å; M488-K506 PolarHBondContact O-N 3.08Å; M488-K506 WeakPolarHBondContact SD-CE 3.34Å; M488-K506 PolarHBondContact SD-NZ 3.34Å; M488-K506 VanDerWaalsContact SD-NZ 3.4Å; K506-L551 HydrophobicContact CB-CD2 3.68Å; K506-L551 HydrophobicContact CG-CD2 4.15Å; K506-A552 VanDerWaalsContact CA-O 3.27Å; K506-A552 WeakPolarHBondContact CA-O 3.39Å; K506-V553 HydrophobicContact CB-CG1 4.26Å
507	G	93.2	Very high	87.7	Confident	7 Å²	7	42.4 Å²	42.4	7%	0.072	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.9	-163	177	0	0	0	0	0	115.8	K486 A552	K486-G507 CarbonylContact O-C 3.46Å; K486-G507 VanDerWaalsContact O-CA 3.3Å; K486-G507 WeakPolarHBondContact O-CA 3.16Å; G507-A552 PolarHBondContact N-O 2.86Å; G507-A552 PolarHBondContact O-N 2.97Å
508	A	91.6	Very high	89.1	Confident	33 Å²	33	43.1 Å²	43.1	27%	0.273	25%	0.245	S	C	.	.			trans	-63.5	136.4	171.7	0	0	0	0	0	110.8	K486 S510 S511 V512	K486-A508 HydrophobicContact CB-CB 3.83Å; K486-A508 PolarHBondContact O-N 3.41Å; A508-S510 PolarHBondContact O-N 3.28Å; A508-S511 PolarHBondContact O-N 3.12Å; A508-S511 VanDerWaalsContact O-N 3.12Å; A508-V512 PolarHBondContact O-N 3.35Å
509	V	91.7	Very high	90.5	Very high	17 Å²	17	36.2 Å²	36.2	10%	0.103	21%	0.206	C	C	.	.	H	α-helix	trans	-58.3	-41.9	-167.7	-174.2	0	0	0	0	113.3	L513 A540 V550 A552 V567	V509-L513 HydrophobicContact CG1-CD1 3.75Å; V509-L513 HydrophobicContact CG1-CG 4.3Å; V509-L513 WeakPolarHBondContact O-CB 3.17Å; V509-L513 VanDerWaalsContact O-CG 3.28Å; V509-L513 WeakPolarHBondContact O-CG 3.21Å; V509-L513 PolarHBondContact O-N 3Å; V509-A540 HydrophobicContact CB-CB 4.24Å; V509-A540 HydrophobicContact CG1-CB 3.82Å; V509-A540 HydrophobicContact CG2-CB 3.95Å; V509-V550 HydrophobicContact CG2-CB 4.43Å; V509-V550 HydrophobicContact CG2-CG1 3.89Å; V509-A552 HydrophobicContact CB-CB 4.29Å; V509-A552 HydrophobicContact CG1-CB 4.36Å; V509-A552 HydrophobicContact CG2-CB 4.07Å; V509-V567 HydrophobicContact CG1-CG1 4.22Å; V509-V567 HydrophobicContact CG2-CG1 3.79Å
510	S	89	Confident	91.6	Very high	53 Å²	53	34.8 Å²	34.8	37%	0.371	19%	0.189	S	C	.	.	H	α-helix	trans	-60.9	-51.3	176	54.8	0	0	0	0	111.9	A508 V512 L513 E514	A508-S510 PolarHBondContact O-N 3.28Å; S510-V512 VanDerWaalsContact C-N 3.33Å; S510-V512 PolarHBondContact O-N 2.82Å; S510-L513 PolarHBondContact O-N 2.65Å; S510-E514 WeakPolarHBondContact O-CB 3.41Å; S510-E514 VanDerWaalsContact O-CG 3.29Å; S510-E514 WeakPolarHBondContact O-CG 3.34Å; S510-E514 PolarHBondContact O-N 2.92Å
511	S	91	Very high	92	Very high	21 Å²	21	31.7 Å²	31.7	15%	0.147	17%	0.173	C	C	.	.	H	α-helix	trans	-67.5	-31	-175.8	-54.6	0	0	0	0	112.9	A508 M515	A508-S511 PolarHBondContact O-N 3.12Å; A508-S511 VanDerWaalsContact O-N 3.12Å; S511-M515 WeakPolarHBondContact O-CE 3.18Å
512	V	93.2	Very high	91.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-74.8	-45.3	172.7	177.2	0	0	0	0	111	A508 S510 E514 M515 C516 A552 A554	A508-V512 PolarHBondContact O-N 3.35Å; S510-V512 VanDerWaalsContact C-N 3.33Å; S510-V512 PolarHBondContact O-N 2.82Å; V512-E514 VanDerWaalsContact C-N 3.26Å; V512-E514 PolarHBondContact O-N 3.47Å; V512-M515 PolarHBondContact O-N 2.69Å; V512-C516 PolarHBondContact O-N 2.69Å; V512-C516 PolarHBondContact O-SG 2.99Å; V512-C516 VanDerWaalsContact O-SG 3.33Å; V512-A552 HydrophobicContact CB-CB 3.84Å; V512-A552 HydrophobicContact CG1-CB 3.99Å; V512-A552 HydrophobicContact CG2-CB 4.09Å; V512-A554 HydrophobicContact CG1-CB 3.72Å
513	L	92.2	Very high	91	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-31.5	178.4	-73.9	172.1	0	0	0	112.6	V509 S510 M515 C516 L528 M533 F536 N537 Y564	V509-L513 HydrophobicContact CG1-CD1 3.75Å; V509-L513 HydrophobicContact CG1-CG 4.3Å; V509-L513 WeakPolarHBondContact O-CB 3.17Å; V509-L513 VanDerWaalsContact O-CG 3.28Å; V509-L513 WeakPolarHBondContact O-CG 3.21Å; V509-L513 PolarHBondContact O-N 3Å; S510-L513 PolarHBondContact O-N 2.65Å; L513-M515 PolarHBondContact O-N 2.94Å; L513-C516 PolarHBondContact O-N 3.44Å; L513-L528 HydrophobicContact CD2-CD2 4.42Å; L513-M533 HydrophobicContact CB-CE 3.81Å; L513-M533 HydrophobicContact CB-CG 4.24Å; L513-M533 HydrophobicContact CD1-CG 4.34Å; L513-F536 HydrophobicContact CD1-CB 4.08Å; L513-F536 HydrophobicContact CD2-CB 4.42Å; L513-F536 HydrophobicContact CD2-CD2 4.15Å; L513-N537 VanDerWaalsContact CD1-ND2 3.31Å; L513-N537 WeakPolarHBondContact CD1-ND2 3.35Å; L513-Y564 HydrophobicContact CD2-CD1 4.18Å; L513-Y564 HydrophobicContact CD2-CD2 3.55Å; L513-Y564 HydrophobicContact CD2-CE1 4.41Å; L513-Y564 HydrophobicContact CD2-CE2 3.81Å; L513-Y564 HydrophobicContact CD2-CG 3.74Å; L513-Y564 HydrophobicContact CG-CD2 4.37Å; L513-Y564 HydrophobicContact CG-CE2 4.36Å
514	E	90.7	Very high	90.7	Very high	140 Å²	140	35 Å²	35	65%	0.654	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.9	173.4	-76.1	162.5	-158.2	0	0	113.7	S510 V512 M533	S510-E514 WeakPolarHBondContact O-CB 3.41Å; S510-E514 VanDerWaalsContact O-CG 3.29Å; S510-E514 WeakPolarHBondContact O-CG 3.34Å; S510-E514 PolarHBondContact O-N 2.92Å; V512-E514 VanDerWaalsContact C-N 3.26Å; V512-E514 PolarHBondContact O-N 3.47Å; E514-M533 HydrophobicContact CG-CE 4.09Å
515	M	91.7	Very high	90.5	Very high	28 Å²	28	39.6 Å²	39.6	14%	0.138	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-7.5	174.9	-65.6	-172.8	-67.6	0	0	113.4	W487 V505 S511 V512 L513 L559 L562	W487-M515 HydrophobicContact CB-CE 4.18Å; W487-M515 HydrophobicContact CD2-CE 3.83Å; W487-M515 HydrophobicContact CD2-SD 4.27Å; W487-M515 HydrophobicContact CG-CE 3.62Å; W487-M515 HydrophobicContact CZ2-SD 4.12Å; V505-M515 HydrophobicContact CG1-CE 3.83Å; S511-M515 WeakPolarHBondContact O-CE 3.18Å; V512-M515 PolarHBondContact O-N 2.69Å; L513-M515 PolarHBondContact O-N 2.94Å; M515-L559 WeakPolarHBondContact CB-O 3.35Å; M515-L562 HydrophobicContact CB-CD1 3.69Å; M515-L562 HydrophobicContact CB-CG 4.39Å; M515-L562 HydrophobicContact CE-CD1 4.38Å; M515-L562 WeakPolarHBondContact O-CB 3.36Å; M515-L562 PolarHBondContact O-N 3.17Å; M515-L562 VanDerWaalsContact O-N 3.12Å
516	C	93	Very high	90.3	Very high	15 Å²	15	43.7 Å²	43.7	10%	0.101	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.2	-177.8	-70.9	0	0	0	0	112.2	V512 L513 L528 L562	V512-C516 PolarHBondContact O-N 2.69Å; V512-C516 PolarHBondContact O-SG 2.99Å; V512-C516 VanDerWaalsContact O-SG 3.33Å; L513-C516 PolarHBondContact O-N 3.44Å; C516-L528 HydrophobicContact CB-CD2 3.9Å; C516-L562 CarbonylContact C-O 3.56Å; C516-L562 VanDerWaalsContact CA-O 3.25Å; C516-L562 WeakPolarHBondContact CA-O 3.27Å
517	A	92.5	Very high	90.2	Very high	20 Å²	20	50.8 Å²	50.8	17%	0.165	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-15.6	170	0	0	0	0	0	112.5	L528 L562	A517-L528 PolarHBondContact O-N 3.35Å; A517-L562 PolarHBondContact N-O 2.89Å
518	Y	94.4	Very high	90.1	Very high	84 Å²	84	51.7 Å²	51.7	33%	0.329	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	166.7	-177	-60.8	-91.3	0	0	0	110.8	Q526 K527 L562 V563 Y564	Y518-Q526 CarbonylContact C-O 3.56Å; Y518-Q526 WeakPolarHBondContact CA-O 3.24Å; Y518-Q526 WeakPolarHBondContact CB-O 3.39Å; Y518-K527 HydrophobicContact CD1-CB 4.41Å; Y518-K527 HydrophobicContact CE1-CB 4.43Å; Y518-L562 PolarHBondContact N-O 3.4Å; Y518-L562 VanDerWaalsContact N-O 3.11Å; Y518-V563 WeakPolarHBondContact O-CA 3.48Å; Y518-Y564 PolarHBondContact O-N 3.25Å
519	Y	93.6	Very high	90.1	Very high	28 Å²	28	53.3 Å²	53.3	11%	0.11	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	155.6	167.7	74.5	-89.7	0	0	0	111	A376 D521 Q526 L528 E532 F536 Y564	A376-Y519 HydrophobicContact CB-CD2 4.03Å; Y519-D521 HydrophobicContact CD2-CB 4.44Å; Y519-D521 HydrophobicContact CE2-CB 3.88Å; Y519-Q526 HydrophobicContact CD1-CB 4.04Å; Y519-Q526 HydrophobicContact CE1-CB 3.48Å; Y519-Q526 VanDerWaalsContact CE1-CB 3.48Å; Y519-Q526 HydrophobicContact CE2-CB 4.07Å; Y519-Q526 VanDerWaalsContact CZ-CB 3.48Å; Y519-Q526 PolarHBondContact N-O 2.69Å; Y519-Q526 PolarHBondContact O-N 3.49Å; Y519-L528 HydrophobicContact CD1-CD1 4.16Å; Y519-E532 HydrophobicContact CD1-CG 4.5Å; Y519-E532 HydrophobicContact CE1-CG 3.93Å; Y519-E532 WeakPolarHBondContact CE1-OE2 3.32Å; Y519-F536 HydrophobicContact CD2-CZ 4.08Å; Y519-F536 HydrophobicContact CG-CE2 4.16Å; Y519-F536 HydrophobicContact CG-CZ 4.13Å; Y519-Y564 CarbonylContact C-O 3.56Å; Y519-Y564 WeakPolarHBondContact CA-O 3.45Å
520	L	91.5	Very high	90	Very high	9 Å²	9	61.7 Å²	61.7	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	112.3	-179.1	-178.7	64	0	0	0	110.9	A376 D377 K412 V563 Y564	A376-L520 WeakPolarHBondContact CB-O 3.49Å; D377-L520 PolarHBondContact N-O 2.99Å; K412-L520 HydrophobicContact CB-CD2 4.2Å; K412-L520 HydrophobicContact CG-CD2 4.17Å; L520-V563 HydrophobicContact CB-CG1 4.21Å; L520-Y564 PolarHBondContact N-O 2.97Å
521	D	87.9	Confident	90.1	Very high	58 Å²	58	62.6 Å²	62.6	31%	0.31	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	92.1	173.4	-169.9	11.5	0	0	0	109.4	Y519 T523 S524 Q526	Y519-D521 HydrophobicContact CD2-CB 4.44Å; Y519-D521 HydrophobicContact CE2-CB 3.88Å; D521-T523 PolarHBondContact O-N 3.36Å; D521-S524 PolarHBondContact N-O 3.13Å; D521-S524 PolarHBondContact O-N 2.82Å; D521-S524 PolarHBondContact O-OG 3.35Å; D521-Q526 HydrophobicContact CB-CG 3.91Å; D521-Q526 PolarHBondContact OD2-NE2 3.38Å
522	G	79.5	Confident	90	Very high	21 Å²	21	63.7 Å²	63.7	22%	0.216	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	-86.3	-172.7	0	0	0	0	0	113.4	D377	D377-G522 WeakPolarHBondContact OD2-CA 3.43Å; D377-G522 PolarHBondContact OD2-N 3.41Å
523	T	78.1	Confident	89.9	Confident	124 Å²	124	66.3 Å²	66.3	76%	0.761	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.3	5	176.4	55.9	0	0	0	0	113.2	P408 D521	P408-T523 HydrophobicContact CB-CG2 4.1Å; P408-T523 HydrophobicContact CG-CG2 3.99Å; D521-T523 PolarHBondContact O-N 3.36Å
524	S	86.1	Confident	89.8	Confident	55 Å²	55	68.1 Å²	68.1	39%	0.385	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	147.9	-178.6	69.1	0	0	0	0	111.6	D521	D521-S524 PolarHBondContact N-O 3.13Å; D521-S524 PolarHBondContact O-N 2.82Å; D521-S524 PolarHBondContact O-OG 3.35Å
525	E	90.5	Very high	89.9	Confident	106 Å²	106	64.8 Å²	64.8	50%	0.495	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	103.4	-179.7	-62.2	-175.7	172.7	0	0	109.4	Y555 V563	E525-Y555 WeakPolarHBondContact OE1-CE2 3.43Å; E525-Y555 PolarHBondContact OE1-OH 2.7Å; E525-V563 HydrophobicContact CG-CG1 4.1Å; E525-V563 HydrophobicContact CG-CG2 4.32Å
526	Q	91	Very high	90	Very high	87 Å²	87	64.7 Å²	64.7	41%	0.407	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	150.7	179.4	-69.6	-134.3	52.1	0	0	111	Y518 Y519 D521	Y518-Q526 CarbonylContact C-O 3.56Å; Y518-Q526 WeakPolarHBondContact CA-O 3.24Å; Y518-Q526 WeakPolarHBondContact CB-O 3.39Å; Y519-Q526 HydrophobicContact CD1-CB 4.04Å; Y519-Q526 HydrophobicContact CE1-CB 3.48Å; Y519-Q526 VanDerWaalsContact CE1-CB 3.48Å; Y519-Q526 HydrophobicContact CE2-CB 4.07Å; Y519-Q526 VanDerWaalsContact CZ-CB 3.48Å; Y519-Q526 PolarHBondContact N-O 2.69Å; Y519-Q526 PolarHBondContact O-N 3.49Å; D521-Q526 HydrophobicContact CB-CG 3.91Å; D521-Q526 PolarHBondContact OD2-NE2 3.38Å
527	K	92.1	Very high	89.9	Confident	158 Å²	158	66 Å²	66	69%	0.687	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.7	-175.9	-178.4	178.3	179.9	175.4	0	111.1	Y518 T529	Y518-K527 HydrophobicContact CD1-CB 4.41Å; Y518-K527 HydrophobicContact CE1-CB 4.43Å; K527-T529 PolarHBondContact O-N 2.76Å
528	L	90.4	Very high	89.9	Confident	26 Å²	26	70.8 Å²	70.8	14%	0.136	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-67.6	118.1	-176	-172.5	70.6	0	0	0	111.9	L513 C516 A517 Y519 E532 F536	L513-L528 HydrophobicContact CD2-CD2 4.42Å; C516-L528 HydrophobicContact CB-CD2 3.9Å; A517-L528 PolarHBondContact O-N 3.35Å; Y519-L528 HydrophobicContact CD1-CD1 4.16Å; L528-E532 HydrophobicContact CD1-CB 3.87Å; L528-F536 HydrophobicContact CD1-CD2 4.03Å; L528-F536 HydrophobicContact CD1-CE2 3.72Å
529	T	91.9	Very high	89.7	Confident	68 Å²	68	68.6 Å²	68.6	42%	0.417	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-95.8	166.1	170.6	91.3	0	0	0	0	111.9	K527 A531 E532 M533	K527-T529 PolarHBondContact O-N 2.76Å; T529-A531 PolarHBondContact O-N 2.83Å; T529-A531 WeakPolarHBondContact OG1-CB 3.37Å; T529-A531 PolarHBondContact OG1-N 3.39Å; T529-E532 WeakPolarHBondContact CB-OE1 3.27Å; T529-E532 VanDerWaalsContact CG2-OE1 3.27Å; T529-E532 WeakPolarHBondContact CG2-OE1 3.32Å; T529-E532 PolarHBondContact N-OE2 2.68Å; T529-E532 PolarHBondContact O-N 2.85Å; T529-E532 VanDerWaalsContact OG1-CD 3.3Å; T529-E532 PolarHBondContact OG1-OE1 2.64Å; T529-M533 WeakPolarHBondContact O-CB 3.44Å; T529-M533 PolarHBondContact O-N 2.95Å
530	K	89.6	Confident	89.6	Confident	193 Å²	193	67.8 Å²	67.8	84%	0.839	38%	0.377	S	S	*	.	H	α-helix	trans	-62.8	-21.2	173.5	-67.1	-172.3	177.1	-175.7	0	113.1	G534	K530-G534 PolarHBondContact O-N 3.07Å; K530-G534 VanDerWaalsContact O-N 3.14Å
531	A	90.4	Very high	89.5	Confident	72 Å²	72	75.8 Å²	75.8	60%	0.595	41%	0.406	S	S	*	.	H	α-helix	trans	-75.9	-50.2	177	0	0	0	0	0	111.1	T529 M533 G534 S535	T529-A531 PolarHBondContact O-N 2.83Å; T529-A531 WeakPolarHBondContact OG1-CB 3.37Å; T529-A531 PolarHBondContact OG1-N 3.39Å; A531-M533 VanDerWaalsContact C-N 3.35Å; A531-M533 PolarHBondContact O-N 2.88Å; A531-G534 PolarHBondContact O-N 3.31Å; A531-G534 VanDerWaalsContact O-N 3.17Å; A531-S535 PolarHBondContact O-N 3.2Å
532	E	89.7	Confident	89.6	Confident	44 Å²	44	79 Å²	79	21%	0.206	41%	0.414	C	S	.	.	H	α-helix	trans	-61.5	-42.5	173.2	-60.4	101.8	-108.7	0	0	111.5	Y519 L528 T529 G534 S535 F536	Y519-E532 HydrophobicContact CD1-CG 4.5Å; Y519-E532 HydrophobicContact CE1-CG 3.93Å; Y519-E532 WeakPolarHBondContact CE1-OE2 3.32Å; L528-E532 HydrophobicContact CD1-CB 3.87Å; T529-E532 WeakPolarHBondContact CB-OE1 3.27Å; T529-E532 VanDerWaalsContact CG2-OE1 3.27Å; T529-E532 WeakPolarHBondContact CG2-OE1 3.32Å; T529-E532 PolarHBondContact N-OE2 2.68Å; T529-E532 PolarHBondContact O-N 2.85Å; T529-E532 VanDerWaalsContact OG1-CD 3.3Å; T529-E532 PolarHBondContact OG1-OE1 2.64Å; E532-G534 PolarHBondContact O-N 3.18Å; E532-S535 CarbonylContact O-C 3.4Å; E532-S535 WeakPolarHBondContact O-CA 3.46Å; E532-S535 WeakPolarHBondContact O-CB 3.28Å; E532-S535 PolarHBondContact O-N 3Å; E532-F536 HydrophobicContact CB-CD2 4.29Å; E532-F536 HydrophobicContact CB-CE2 3.8Å; E532-F536 HydrophobicContact CB-CZ 4.25Å; E532-F536 VanDerWaalsContact O-CD2 3.28Å; E532-F536 WeakPolarHBondContact O-CD2 3.35Å; E532-F536 WeakPolarHBondContact O-CG 3.41Å; E532-F536 PolarHBondContact O-N 3.34Å
533	M	90.6	Very high	90	Very high	54 Å²	54	78.3 Å²	78.3	27%	0.266	41%	0.405	S	S	.	.	H	α-helix	trans	-58	-36.4	175.9	-164.4	-163.8	-165	0	0	111.9	L513 E514 T529 A531 N537	L513-M533 HydrophobicContact CB-CE 3.81Å; L513-M533 HydrophobicContact CB-CG 4.24Å; L513-M533 HydrophobicContact CD1-CG 4.34Å; E514-M533 HydrophobicContact CG-CE 4.09Å; T529-M533 WeakPolarHBondContact O-CB 3.44Å; T529-M533 PolarHBondContact O-N 2.95Å; A531-M533 VanDerWaalsContact C-N 3.35Å; A531-M533 PolarHBondContact O-N 2.88Å; M533-N537 WeakPolarHBondContact O-CB 3.22Å; M533-N537 PolarHBondContact O-N 3.06Å; M533-N537 PolarHBondContact O-ND2 2.82Å
534	G	91.2	Very high	90.2	Very high	40 Å²	40	73.7 Å²	73.7	41%	0.412	38%	0.383	S	S	.	.	H	α-helix	trans	-67.2	-43.6	171.6	0	0	0	0	0	112.8	K530 A531 E532 N537 L538	K530-G534 PolarHBondContact O-N 3.07Å; K530-G534 VanDerWaalsContact O-N 3.14Å; A531-G534 PolarHBondContact O-N 3.31Å; A531-G534 VanDerWaalsContact O-N 3.17Å; E532-G534 PolarHBondContact O-N 3.18Å; G534-N537 PolarHBondContact O-N 2.66Å; G534-L538 PolarHBondContact O-N 2.99Å
535	S	92.3	Very high	89.9	Confident	71 Å²	71	75.8 Å²	75.8	50%	0.497	40%	0.396	S	S	.	.	H	α-helix	trans	-61	-49.6	177.2	-167.7	0	0	0	0	112.3	A531 E532 N537 L538 E539	A531-S535 PolarHBondContact O-N 3.2Å; E532-S535 CarbonylContact O-C 3.4Å; E532-S535 WeakPolarHBondContact O-CA 3.46Å; E532-S535 WeakPolarHBondContact O-CB 3.28Å; E532-S535 PolarHBondContact O-N 3Å; S535-N537 VanDerWaalsContact C-N 3.33Å; S535-N537 PolarHBondContact O-N 3.39Å; S535-L538 WeakPolarHBondContact O-CB 3.45Å; S535-L538 PolarHBondContact O-N 3.44Å; S535-E539 PolarHBondContact O-N 2.97Å
536	F	93.6	Very high	89.5	Confident	25 Å²	25	73.5 Å²	73.5	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-63.7	-36.1	178.3	-60.2	-39.5	0	0	0	112.5	A376 L513 Y519 L528 E532 A540 Y564	A376-F536 HydrophobicContact CB-CE1 4.23Å; A376-F536 HydrophobicContact CB-CZ 3.95Å; A376-F536 WeakPolarHBondContact O-CE1 3.43Å; L513-F536 HydrophobicContact CD1-CB 4.08Å; L513-F536 HydrophobicContact CD2-CB 4.42Å; L513-F536 HydrophobicContact CD2-CD2 4.15Å; Y519-F536 HydrophobicContact CD2-CZ 4.08Å; Y519-F536 HydrophobicContact CG-CE2 4.16Å; Y519-F536 HydrophobicContact CG-CZ 4.13Å; L528-F536 HydrophobicContact CD1-CD2 4.03Å; L528-F536 HydrophobicContact CD1-CE2 3.72Å; E532-F536 HydrophobicContact CB-CD2 4.29Å; E532-F536 HydrophobicContact CB-CE2 3.8Å; E532-F536 HydrophobicContact CB-CZ 4.25Å; E532-F536 VanDerWaalsContact O-CD2 3.28Å; E532-F536 WeakPolarHBondContact O-CD2 3.35Å; E532-F536 WeakPolarHBondContact O-CG 3.41Å; E532-F536 PolarHBondContact O-N 3.34Å; F536-A540 VanDerWaalsContact O-CB 3.26Å; F536-A540 WeakPolarHBondContact O-CB 3.49Å; F536-A540 PolarHBondContact O-N 3.07Å; F536-Y564 HydrophobicContact CB-CE1 4.04Å; F536-Y564 AromaticContact CD1-CE1 3.71Å; F536-Y564 HydrophobicContact CD1-CE1 3.71Å; F536-Y564 AromaticContact CD2-CD1 3.66Å; F536-Y564 HydrophobicContact CD2-CD1 3.66Å; F536-Y564 AromaticContact CD2-CE1 3.52Å; F536-Y564 HydrophobicContact CD2-CE1 3.52Å; F536-Y564 HydrophobicContact CE1-CD1 4.48Å; F536-Y564 AromaticContact CE1-CE1 3.98Å; F536-Y564 HydrophobicContact CE1-CE1 3.98Å; F536-Y564 AromaticContact CE2-CD1 3.63Å; F536-Y564 HydrophobicContact CE2-CD1 3.63Å; F536-Y564 AromaticContact CE2-CE1 3.8Å; F536-Y564 HydrophobicContact CE2-CE1 3.8Å; F536-Y564 HydrophobicContact CG-CD1 4.13Å; F536-Y564 AromaticContact CG-CE1 3.48Å; F536-Y564 HydrophobicContact CG-CE1 3.48Å; F536-Y564 VanDerWaalsContact CG-CE1 3.48Å; F536-Y564 HydrophobicContact CZ-CD1 4.07Å; F536-Y564 HydrophobicContact CZ-CE1 4.03Å
537	N	91.6	Very high	88.8	Confident	42 Å²	42	70 Å²	70	23%	0.225	38%	0.376	C	S	.	.	H	α-helix	trans	-66.9	-36.3	171.6	-87.2	-74.5	0	0	0	112.7	L513 M533 G534 S535 R541	L513-N537 VanDerWaalsContact CD1-ND2 3.31Å; L513-N537 WeakPolarHBondContact CD1-ND2 3.35Å; M533-N537 WeakPolarHBondContact O-CB 3.22Å; M533-N537 PolarHBondContact O-N 3.06Å; M533-N537 PolarHBondContact O-ND2 2.82Å; G534-N537 PolarHBondContact O-N 2.66Å; S535-N537 VanDerWaalsContact C-N 3.33Å; S535-N537 PolarHBondContact O-N 3.39Å; N537-R541 WeakPolarHBondContact O-CB 3.42Å; N537-R541 VanDerWaalsContact O-CG 3.23Å; N537-R541 WeakPolarHBondContact O-CG 3.31Å; N537-R541 PolarHBondContact O-N 3.5Å
538	L	92	Very high	88.6	Confident	121 Å²	121	63.1 Å²	63.1	63%	0.634	35%	0.347	S	S	*	.	H	α-helix	trans	-68.6	-43.4	176.2	-177.9	61.8	0	0	0	111.5	G534 S535 R541 R542	G534-L538 PolarHBondContact O-N 2.99Å; S535-L538 WeakPolarHBondContact O-CB 3.45Å; S535-L538 PolarHBondContact O-N 3.44Å; L538-R541 WeakPolarHBondContact O-CB 3.32Å; L538-R541 PolarHBondContact O-N 3.36Å; L538-R542 PolarHBondContact O-N 3.23Å
539	E	91.2	Very high	88.4	Confident	39 Å²	39	67.1 Å²	67.1	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-66.8	-41.4	177.4	-179.3	58.8	-169.3	0	0	111.8	V374 S535 R541 R542 L543	V374-E539 HydrophobicContact CG1-CG 4.14Å; S535-E539 PolarHBondContact O-N 2.97Å; E539-R541 VanDerWaalsContact C-N 3.3Å; E539-R541 PolarHBondContact O-N 2.87Å; E539-R542 WeakPolarHBondContact O-CB 3.15Å; E539-R542 PolarHBondContact O-N 3.08Å; E539-R542 VanDerWaalsContact O-N 3.12Å; E539-R542 IonicContact OE1-CZ 2.72Å; E539-R542 IonicContact OE1-NE 3.7Å; E539-R542 PolarHBondContact OE1-NE 3.01Å; E539-R542 IonicContact OE1-NH2 2.79Å; E539-R542 PolarHBondContact OE1-NH2 3.18Å; E539-R542 IonicContact OE2-CZ 2.65Å; E539-R542 IonicContact OE2-NE 3.9Å; E539-R542 PolarHBondContact OE2-NE 3.41Å; E539-R542 IonicContact OE2-NH2 3.48Å; E539-R542 PolarHBondContact OE2-NH2 3.48Å; E539-L543 WeakPolarHBondContact O-CG 3.16Å; E539-L543 PolarHBondContact O-N 3.28Å
540	A	90.4	Very high	88.4	Confident	10 Å²	10	65.2 Å²	65.2	8%	0.083	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-38	171.7	0	0	0	0	0	112.6	V509 F536 G544 V550	V509-A540 HydrophobicContact CB-CB 4.24Å; V509-A540 HydrophobicContact CG1-CB 3.82Å; V509-A540 HydrophobicContact CG2-CB 3.95Å; F536-A540 VanDerWaalsContact O-CB 3.26Å; F536-A540 WeakPolarHBondContact O-CB 3.49Å; F536-A540 PolarHBondContact O-N 3.07Å; A540-G544 PolarHBondContact O-N 3.17Å; A540-V550 HydrophobicContact CB-CG1 4.12Å
541	R	88.8	Confident	88.6	Confident	178 Å²	178	57 Å²	57	67%	0.672	31%	0.314	S	S	*	.	H	α-helix	trans	-66.4	-40.7	171.7	-74.4	170.2	-176.7	-162.5	1.5	111.8	N537 L538 E539 L543 G544 C545	N537-R541 WeakPolarHBondContact O-CB 3.42Å; N537-R541 VanDerWaalsContact O-CG 3.23Å; N537-R541 WeakPolarHBondContact O-CG 3.31Å; N537-R541 PolarHBondContact O-N 3.5Å; L538-R541 WeakPolarHBondContact O-CB 3.32Å; L538-R541 PolarHBondContact O-N 3.36Å; E539-R541 VanDerWaalsContact C-N 3.3Å; E539-R541 PolarHBondContact O-N 2.87Å; R541-L543 PolarHBondContact O-N 3.46Å; R541-G544 PolarHBondContact O-N 3.5Å; R541-C545 PolarHBondContact O-N 3.06Å; R541-C545 PolarHBondContact O-SG 3.31Å
542	R	89.6	Confident	88.9	Confident	125 Å²	125	53.6 Å²	53.6	47%	0.472	29%	0.285	S	S	.	.	H	α-helix	trans	-58.6	-47.3	176.3	-167.7	-177.1	72.9	94	0.1	111.3	L538 E539 C545 T546	L538-R542 PolarHBondContact O-N 3.23Å; E539-R542 WeakPolarHBondContact O-CB 3.15Å; E539-R542 PolarHBondContact O-N 3.08Å; E539-R542 VanDerWaalsContact O-N 3.12Å; E539-R542 IonicContact OE1-CZ 2.72Å; E539-R542 IonicContact OE1-NE 3.7Å; E539-R542 PolarHBondContact OE1-NE 3.01Å; E539-R542 IonicContact OE1-NH2 2.79Å; E539-R542 PolarHBondContact OE1-NH2 3.18Å; E539-R542 IonicContact OE2-CZ 2.65Å; E539-R542 IonicContact OE2-NE 3.9Å; E539-R542 PolarHBondContact OE2-NE 3.41Å; E539-R542 IonicContact OE2-NH2 3.48Å; E539-R542 PolarHBondContact OE2-NH2 3.48Å; R542-C545 PolarHBondContact O-N 3.46Å; R542-T546 PolarHBondContact O-N 3.33Å
543	L	88.5	Confident	89.1	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-45.1	173.3	-67.8	173.6	0	0	0	111.5	R372 V374 E539 R541 C545 T546 L548 V550 V567	R372-L543 HydrophobicContact CG-CD2 4.04Å; V374-L543 HydrophobicContact CG2-CD1 4.02Å; V374-L543 HydrophobicContact CG2-CD2 4.4Å; E539-L543 WeakPolarHBondContact O-CG 3.16Å; E539-L543 PolarHBondContact O-N 3.28Å; R541-L543 PolarHBondContact O-N 3.46Å; L543-C545 PolarHBondContact O-N 2.96Å; L543-T546 WeakPolarHBondContact O-CA 3.3Å; L543-T546 PolarHBondContact O-N 3.33Å; L543-T546 PolarHBondContact O-OG1 3.15Å; L543-L548 HydrophobicContact CB-CD1 4.18Å; L543-L548 HydrophobicContact CD2-CD1 3.94Å; L543-L548 WeakPolarHBondContact O-CB 3.38Å; L543-V550 HydrophobicContact CB-CG2 3.64Å; L543-V550 HydrophobicContact CD1-CG1 4.48Å; L543-V567 HydrophobicContact CD1-CG2 3.86Å
544	G	83.1	Confident	89.4	Confident	28 Å²	28	48.9 Å²	48.9	29%	0.289	26%	0.263	S	S	.	.	H	α-helix	trans	-56	-45.5	175.6	0	0	0	0	0	113.9	A540 R541 T546 G547	A540-G544 PolarHBondContact O-N 3.17Å; R541-G544 PolarHBondContact O-N 3.5Å; G544-T546 PolarHBondContact O-N 3.17Å; G544-T546 VanDerWaalsContact O-N 3.13Å; G544-G547 PolarHBondContact O-N 3.27Å
545	C	79.4	Confident	89.5	Confident	98 Å²	98	48.4 Å²	48.4	66%	0.662	25%	0.249	S	C	*	.	H	α-helix	trans	-62.1	-18.7	175.6	-67.7	0	0	0	0	113.5	R541 R542 L543 G547	R541-C545 PolarHBondContact O-N 3.06Å; R541-C545 PolarHBondContact O-SG 3.31Å; R542-C545 PolarHBondContact O-N 3.46Å; L543-C545 PolarHBondContact O-N 2.96Å; C545-G547 PolarHBondContact O-N 2.92Å
546	T	81.5	Confident	89.5	Confident	59 Å²	59	45.3 Å²	45.3	36%	0.362	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	23.2	170.9	67.1	0	0	0	0	113.7	R542 L543 G544 L548 C605 R609	R542-T546 PolarHBondContact O-N 3.33Å; L543-T546 WeakPolarHBondContact O-CA 3.3Å; L543-T546 PolarHBondContact O-N 3.33Å; L543-T546 PolarHBondContact O-OG1 3.15Å; G544-T546 PolarHBondContact O-N 3.17Å; G544-T546 VanDerWaalsContact O-N 3.13Å; T546-L548 PolarHBondContact O-N 3.34Å; T546-L548 WeakPolarHBondContact OG1-CD1 3.39Å; T546-L548 WeakPolarHBondContact OG1-CG 3.48Å; T546-C605 PolarHBondContact O-SG 2.65Å; T546-R609 PolarHBondContact O-NH2 3.2Å
547	G	77.5	Confident	89.2	Confident	12 Å²	12	49.8 Å²	49.8	12%	0.124	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	18.4	177.3	0	0	0	0	0	114.1	G544 C545	G544-G547 PolarHBondContact O-N 3.27Å; C545-G547 PolarHBondContact O-N 2.92Å
548	L	87.2	Confident	89.1	Confident	15 Å²	15	49.9 Å²	49.9	8%	0.079	26%	0.256	C	S	.	.			trans	-92.6	131.5	179.2	-56	177.8	0	0	0	110.4	R372 L543 T546 V550 L571	R372-L548 HydrophobicContact CB-CD1 4.2Å; L543-L548 HydrophobicContact CB-CD1 4.18Å; L543-L548 HydrophobicContact CD2-CD1 3.94Å; L543-L548 WeakPolarHBondContact O-CB 3.38Å; T546-L548 PolarHBondContact O-N 3.34Å; T546-L548 WeakPolarHBondContact OG1-CD1 3.39Å; T546-L548 WeakPolarHBondContact OG1-CG 3.48Å; L548-V550 HydrophobicContact CB-CG2 4.34Å; L548-V550 PolarHBondContact O-N 3.04Å; L548-L571 HydrophobicContact CD2-CB 4.14Å; L548-L571 HydrophobicContact CD2-CD2 3.55Å; L548-L571 HydrophobicContact CD2-CG 4.4Å
549	R	86.7	Confident	88.9	Confident	109 Å²	109	46 Å²	46	41%	0.411	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	110.5	160.5	-176.2	176.3	-178.2	167.9	-8.8	107.8	E200 M368 T435 I570	E200-R549 IonicContact OE1-CZ 2.68Å; E200-R549 IonicContact OE1-NH1 2.65Å; E200-R549 PolarHBondContact OE1-NH1 3.49Å; E200-R549 IonicContact OE1-NH2 3.68Å; E200-R549 PolarHBondContact OE1-NH2 3.2Å; E200-R549 IonicContact OE2-NH2 3.64Å; M368-R549 HydrophobicContact CE-CB 4.29Å; T435-R549 VanDerWaalsContact OG1-CZ 3.23Å; T435-R549 PolarHBondContact OG1-NH1 3.37Å; T435-R549 PolarHBondContact OG1-NH2 3.4Å; R549-I570 WeakPolarHBondContact CB-O 3.5Å; R549-I570 PolarHBondContact N-O 2.96Å; R549-I570 PolarHBondContact O-N 2.91Å
550	V	91.5	Very high	88.7	Confident	28 Å²	28	49 Å²	49	17%	0.17	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	131.2	-175.7	-171.1	0	0	0	0	110.4	V509 A540 L543 L548 V567	V509-V550 HydrophobicContact CG2-CB 4.43Å; V509-V550 HydrophobicContact CG2-CG1 3.89Å; A540-V550 HydrophobicContact CB-CG1 4.12Å; L543-V550 HydrophobicContact CB-CG2 3.64Å; L543-V550 HydrophobicContact CD1-CG1 4.48Å; L548-V550 HydrophobicContact CB-CG2 4.34Å; L548-V550 PolarHBondContact O-N 3.04Å; V550-V567 HydrophobicContact CG1-CB 3.67Å; V550-V567 HydrophobicContact CG1-CG1 3.68Å; V550-V567 HydrophobicContact CG1-CG2 4.33Å
551	L	93.7	Very high	88.7	Confident	21 Å²	21	53.2 Å²	53.2	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	120.8	-176.1	-147.6	164.2	0	0	0	108.9	T435 K506 V567 I568 I570	T435-L551 HydrophobicContact CG2-CD1 3.5Å; K506-L551 HydrophobicContact CB-CD2 3.68Å; K506-L551 HydrophobicContact CG-CD2 4.15Å; L551-V567 WeakPolarHBondContact O-CA 3.38Å; L551-I568 PolarHBondContact N-O 3.31Å; L551-I568 PolarHBondContact O-N 3.42Å; L551-I570 HydrophobicContact CD1-CD1 4.3Å
552	A	95.5	Very high	88.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	145.5	179.1	0	0	0	0	0	111.3	K506 G507 V509 V512 Y564 V567	K506-A552 VanDerWaalsContact CA-O 3.27Å; K506-A552 WeakPolarHBondContact CA-O 3.39Å; G507-A552 PolarHBondContact N-O 2.86Å; G507-A552 PolarHBondContact O-N 2.97Å; V509-A552 HydrophobicContact CB-CB 4.29Å; V509-A552 HydrophobicContact CG1-CB 4.36Å; V509-A552 HydrophobicContact CG2-CB 4.07Å; V512-A552 HydrophobicContact CB-CB 3.84Å; V512-A552 HydrophobicContact CG1-CB 3.99Å; V512-A552 HydrophobicContact CG2-CB 4.09Å; A552-Y564 HydrophobicContact CB-CE2 4.13Å; A552-V567 HydrophobicContact CB-CG1 3.98Å
553	V	95.3	Very high	89.1	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.9	176.8	-74.1	0	0	0	0	111.2	M413 I416 K506 A565 G566 I568	M413-V553 HydrophobicContact CB-CG2 4.02Å; M413-V553 HydrophobicContact CE-CG2 4.3Å; M413-V553 HydrophobicContact CG-CG2 3.96Å; I416-V553 HydrophobicContact CB-CB 4.13Å; I416-V553 HydrophobicContact CB-CG1 4.39Å; I416-V553 HydrophobicContact CD1-CB 4.18Å; I416-V553 HydrophobicContact CD1-CG2 4.45Å; I416-V553 HydrophobicContact CG2-CB 3.8Å; I416-V553 HydrophobicContact CG2-CG1 3.99Å; K506-V553 HydrophobicContact CB-CG1 4.26Å; V553-A565 HydrophobicContact CG2-CB 4.41Å; V553-A565 PolarHBondContact O-N 2.92Å; V553-G566 WeakPolarHBondContact CG2-O 3.35Å; V553-G566 PolarHBondContact N-O 3.24Å; V553-G566 PolarHBondContact O-N 2.79Å; V553-I568 HydrophobicContact CG1-CD1 4.15Å; V553-I568 HydrophobicContact CG2-CD1 4.44Å; V553-I568 HydrophobicContact CG2-CG1 4.48Å
554	A	95.7	Very high	89.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	161	-178.1	0	0	0	0	0	111.4	V505 V512 L562 V563	V505-A554 PolarHBondContact N-O 2.81Å; V505-A554 PolarHBondContact O-N 2.84Å; V512-A554 HydrophobicContact CG1-CB 3.72Å; A554-L562 HydrophobicContact CB-CB 4.23Å; A554-L562 HydrophobicContact CB-CD1 4.32Å; A554-V563 WeakPolarHBondContact CA-O 3.38Å; A554-V563 VanDerWaalsContact CB-O 3.27Å; A554-V563 WeakPolarHBondContact CB-O 3.36Å
555	Y	94.5	Very high	90	Very high	29 Å²	29	37.6 Å²	37.6	11%	0.114	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	163.3	173.1	69.7	-87	0	0	0	111.3	K412 I416 V502 Y503 E525 L562 V563	K412-Y555 HydrophobicContact CG-CD1 4.4Å; K412-Y555 HydrophobicContact CG-CE1 4.12Å; I416-Y555 HydrophobicContact CD1-CD1 3.96Å; V502-Y555 HydrophobicContact CG1-CD2 4.28Å; Y503-Y555 CarbonylContact O-C 3.6Å; Y503-Y555 WeakPolarHBondContact O-CA 3.38Å; E525-Y555 WeakPolarHBondContact OE1-CE2 3.43Å; E525-Y555 PolarHBondContact OE1-OH 2.7Å; Y555-L562 CarbonylContact O-C 3.55Å; Y555-L562 WeakPolarHBondContact O-CA 3.18Å; Y555-V563 HydrophobicContact CD1-CB 4.35Å; Y555-V563 HydrophobicContact CD2-CG2 4.5Å; Y555-V563 HydrophobicContact CE1-CB 3.97Å; Y555-V563 HydrophobicContact CE1-CG1 4.04Å; Y555-V563 HydrophobicContact CE2-CB 4.12Å; Y555-V563 HydrophobicContact CE2-CG2 3.96Å; Y555-V563 PolarHBondContact N-O 2.92Å; Y555-V563 PolarHBondContact O-N 3.35Å
556	G	92	Very high	90.7	Very high	6 Å²	6	32.9 Å²	32.9	6%	0.062	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.3	173.7	172	0	0	0	0	0	114.7	Y503 S558	Y503-G556 WeakPolarHBondContact CB-O 3.34Å; Y503-G556 PolarHBondContact N-O 3.03Å; Y503-G556 PolarHBondContact O-N 3.14Å; G556-S558 VanDerWaalsContact C-N 3.33Å
557	L	88.3	Confident	91.3	Very high	120 Å²	120	30.2 Å²	30.2	63%	0.628	16%	0.159	S	C	*	.	S	Bend	trans	-78	-17.6	178.3	-61.3	175	0	0	0	113.1	D500 V502	D500-L557 HydrophobicContact CB-CD2 3.93Å; V502-L557 HydrophobicContact CG2-CD2 4.34Å
558	S	89.2	Confident	92.2	Very high	43 Å²	43	29.7 Å²	29.7	30%	0.301	15%	0.154	S	C	.	.	S	Bend	trans	-144.8	144.2	175.8	175.6	0	0	0	0	110.7	G556 T560 Q561 L562	G556-S558 VanDerWaalsContact C-N 3.33Å; S558-T560 PolarHBondContact O-N 3.38Å; S558-T560 PolarHBondContact OG-N 3.37Å; S558-T560 VanDerWaalsContact OG-N 3.16Å; S558-T560 PolarHBondContact OG-OG1 2.97Å; S558-Q561 CarbonylContact O-C 3.53Å; S558-Q561 PolarHBondContact O-N 3.48Å; S558-L562 WeakPolarHBondContact O-CD2 3.22Å
559	L	88.1	Confident	92.4	Very high	39 Å²	39	29 Å²	29	20%	0.204	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-14.5	170.7	-63.3	174	0	0	0	113.7	I479 W487 A489 Y503 V505 M515	I479-L559 HydrophobicContact CD1-CD1 3.83Å; W487-L559 HydrophobicContact CH2-CD1 4.37Å; A489-L559 HydrophobicContact CB-CD2 4.02Å; Y503-L559 HydrophobicContact CD1-CD1 4.44Å; Y503-L559 HydrophobicContact CD1-CD2 3.63Å; Y503-L559 HydrophobicContact CD1-CG 3.89Å; Y503-L559 HydrophobicContact CD2-CG 4.48Å; Y503-L559 HydrophobicContact CE1-CD1 4.13Å; Y503-L559 HydrophobicContact CE1-CD2 4.16Å; Y503-L559 HydrophobicContact CE1-CG 3.95Å; Y503-L559 HydrophobicContact CG-CD2 3.91Å; Y503-L559 HydrophobicContact CG-CG 4.17Å; V505-L559 HydrophobicContact CG2-CD2 3.94Å; M515-L559 WeakPolarHBondContact CB-O 3.35Å
560	T	86.3	Confident	92.6	Very high	102 Å²	102	23.8 Å²	23.8	63%	0.626	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-4.6	176.3	59	0	0	0	0	114.2	S558	S558-T560 PolarHBondContact O-N 3.38Å; S558-T560 PolarHBondContact OG-N 3.37Å; S558-T560 VanDerWaalsContact OG-N 3.16Å; S558-T560 PolarHBondContact OG-OG1 2.97Å
561	Q	89.3	Confident	92.5	Very high	100 Å²	100	22.9 Å²	22.9	47%	0.467	13%	0.125	S	C	.	.	S	Bend	trans	-141.9	55.1	-176.4	-66.3	-69.2	-83.6	0	0	109.7	S558	S558-Q561 CarbonylContact O-C 3.53Å; S558-Q561 PolarHBondContact O-N 3.48Å
562	L	93.7	Very high	92.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	154.9	178.6	-59.6	175.9	0	0	0	112.2	V505 M515 C516 A517 Y518 A554 Y555 S558	V505-L562 HydrophobicContact CB-CD1 4Å; V505-L562 HydrophobicContact CG1-CD1 4.16Å; V505-L562 HydrophobicContact CG2-CD1 3.7Å; V505-L562 HydrophobicContact CG2-CD2 3.98Å; M515-L562 HydrophobicContact CB-CD1 3.69Å; M515-L562 HydrophobicContact CB-CG 4.39Å; M515-L562 HydrophobicContact CE-CD1 4.38Å; M515-L562 WeakPolarHBondContact O-CB 3.36Å; M515-L562 PolarHBondContact O-N 3.17Å; M515-L562 VanDerWaalsContact O-N 3.12Å; C516-L562 CarbonylContact C-O 3.56Å; C516-L562 VanDerWaalsContact CA-O 3.25Å; C516-L562 WeakPolarHBondContact CA-O 3.27Å; A517-L562 PolarHBondContact N-O 2.89Å; Y518-L562 PolarHBondContact N-O 3.4Å; Y518-L562 VanDerWaalsContact N-O 3.11Å; A554-L562 HydrophobicContact CB-CB 4.23Å; A554-L562 HydrophobicContact CB-CD1 4.32Å; Y555-L562 CarbonylContact O-C 3.55Å; Y555-L562 WeakPolarHBondContact O-CA 3.18Å; S558-L562 WeakPolarHBondContact O-CD2 3.22Å
563	V	94.7	Very high	91.6	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.024	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115.9	169.6	-170.1	0	0	0	0	108.1	Y518 L520 E525 A554 Y555 A565	Y518-V563 WeakPolarHBondContact O-CA 3.48Å; L520-V563 HydrophobicContact CB-CG1 4.21Å; E525-V563 HydrophobicContact CG-CG1 4.1Å; E525-V563 HydrophobicContact CG-CG2 4.32Å; A554-V563 WeakPolarHBondContact CA-O 3.38Å; A554-V563 VanDerWaalsContact CB-O 3.27Å; A554-V563 WeakPolarHBondContact CB-O 3.36Å; Y555-V563 HydrophobicContact CD1-CB 4.35Å; Y555-V563 HydrophobicContact CD2-CG2 4.5Å; Y555-V563 HydrophobicContact CE1-CB 3.97Å; Y555-V563 HydrophobicContact CE1-CG1 4.04Å; Y555-V563 HydrophobicContact CE2-CB 4.12Å; Y555-V563 HydrophobicContact CE2-CG2 3.96Å; Y555-V563 PolarHBondContact N-O 2.92Å; Y555-V563 PolarHBondContact O-N 3.35Å; V563-A565 PolarHBondContact O-N 2.85Å
564	Y	95.4	Very high	91.3	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.016	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	119.5	174	175.9	-107.7	0	0	0	110.4	A376 L513 Y518 Y519 L520 F536 A552 V567	A376-Y564 HydrophobicContact CB-CD1 3.6Å; A376-Y564 HydrophobicContact CB-CE1 3.83Å; A376-Y564 WeakPolarHBondContact CB-O 3.46Å; L513-Y564 HydrophobicContact CD2-CD1 4.18Å; L513-Y564 HydrophobicContact CD2-CD2 3.55Å; L513-Y564 HydrophobicContact CD2-CE1 4.41Å; L513-Y564 HydrophobicContact CD2-CE2 3.81Å; L513-Y564 HydrophobicContact CD2-CG 3.74Å; L513-Y564 HydrophobicContact CG-CD2 4.37Å; L513-Y564 HydrophobicContact CG-CE2 4.36Å; Y518-Y564 PolarHBondContact O-N 3.25Å; Y519-Y564 CarbonylContact C-O 3.56Å; Y519-Y564 WeakPolarHBondContact CA-O 3.45Å; L520-Y564 PolarHBondContact N-O 2.97Å; F536-Y564 HydrophobicContact CB-CE1 4.04Å; F536-Y564 AromaticContact CD1-CE1 3.71Å; F536-Y564 HydrophobicContact CD1-CE1 3.71Å; F536-Y564 AromaticContact CD2-CD1 3.66Å; F536-Y564 HydrophobicContact CD2-CD1 3.66Å; F536-Y564 AromaticContact CD2-CE1 3.52Å; F536-Y564 HydrophobicContact CD2-CE1 3.52Å; F536-Y564 HydrophobicContact CE1-CD1 4.48Å; F536-Y564 AromaticContact CE1-CE1 3.98Å; F536-Y564 HydrophobicContact CE1-CE1 3.98Å; F536-Y564 AromaticContact CE2-CD1 3.63Å; F536-Y564 HydrophobicContact CE2-CD1 3.63Å; F536-Y564 AromaticContact CE2-CE1 3.8Å; F536-Y564 HydrophobicContact CE2-CE1 3.8Å; F536-Y564 HydrophobicContact CG-CD1 4.13Å; F536-Y564 AromaticContact CG-CE1 3.48Å; F536-Y564 HydrophobicContact CG-CE1 3.48Å; F536-Y564 VanDerWaalsContact CG-CE1 3.48Å; F536-Y564 HydrophobicContact CZ-CD1 4.07Å; F536-Y564 HydrophobicContact CZ-CE1 4.03Å; A552-Y564 HydrophobicContact CB-CE2 4.13Å; Y564-V567 HydrophobicContact CE2-CG1 4.5Å; Y564-V567 WeakPolarHBondContact OH-CG1 3.42Å
565	A	93.8	Very high	90.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-31.4	-178.7	0	0	0	0	0	112.9	A376 M413 I416 V553 V563	A376-A565 PolarHBondContact N-O 2.61Å; M413-A565 HydrophobicContact CG-CB 4.12Å; I416-A565 HydrophobicContact CD1-CB 3.52Å; V553-A565 HydrophobicContact CG2-CB 4.41Å; V553-A565 PolarHBondContact O-N 2.92Å; V563-A565 PolarHBondContact O-N 2.85Å
566	G	94.5	Very high	90.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.5	-164.6	177.5	0	0	0	0	0	114.1	V374 V553	V374-G566 WeakPolarHBondContact O-CA 3.39Å; V553-G566 WeakPolarHBondContact CG2-O 3.35Å; V553-G566 PolarHBondContact N-O 3.24Å; V553-G566 PolarHBondContact O-N 2.79Å
567	V	95	Very high	89.9	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.012	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	141.3	178.2	-84.2	0	0	0	0	112.9	V374 M413 V509 L543 V550 L551 A552 Y564	V374-V567 HydrophobicContact CB-CG2 4.24Å; V374-V567 PolarHBondContact N-O 3.27Å; V374-V567 PolarHBondContact O-N 2.84Å; M413-V567 VanDerWaalsContact CE-O 3.25Å; M413-V567 WeakPolarHBondContact CE-O 3.04Å; V509-V567 HydrophobicContact CG1-CG1 4.22Å; V509-V567 HydrophobicContact CG2-CG1 3.79Å; L543-V567 HydrophobicContact CD1-CG2 3.86Å; V550-V567 HydrophobicContact CG1-CB 3.67Å; V550-V567 HydrophobicContact CG1-CG1 3.68Å; V550-V567 HydrophobicContact CG1-CG2 4.33Å; L551-V567 WeakPolarHBondContact O-CA 3.38Å; A552-V567 HydrophobicContact CB-CG1 3.98Å; Y564-V567 HydrophobicContact CE2-CG1 4.5Å; Y564-V567 WeakPolarHBondContact OH-CG1 3.42Å
568	I	94.8	Very high	89.8	Confident	1 Å²	1	25 Å²	25	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.1	177.2	-52.5	179.3	0	0	0	108.3	A370 L373 M413 L439 L442 L551 V553 I570	A370-I568 HydrophobicContact CB-CG2 4.03Å; L373-I568 HydrophobicContact CD1-CG2 4.45Å; L373-I568 HydrophobicContact CD2-CG1 4.34Å; L373-I568 HydrophobicContact CG-CG1 4.19Å; L373-I568 HydrophobicContact CG-CG2 4.3Å; M413-I568 HydrophobicContact CE-CG1 3.89Å; L439-I568 HydrophobicContact CD2-CB 4.43Å; L439-I568 HydrophobicContact CD2-CD1 3.65Å; L439-I568 HydrophobicContact CD2-CG2 3.93Å; L442-I568 HydrophobicContact CD2-CD1 4.39Å; L442-I568 HydrophobicContact CD2-CG2 4.31Å; L551-I568 PolarHBondContact N-O 3.31Å; L551-I568 PolarHBondContact O-N 3.42Å; V553-I568 HydrophobicContact CG1-CD1 4.15Å; V553-I568 HydrophobicContact CG2-CD1 4.44Å; V553-I568 HydrophobicContact CG2-CG1 4.48Å; I568-I570 HydrophobicContact CG2-CG1 4.13Å
569	G	92.5	Very high	89.8	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	116.9	176	0	0	0	0	0	111.6	V371 R372	V371-G569 PolarHBondContact N-O 3.29Å; R372-G569 PolarHBondContact N-O 2.88Å; R372-G569 PolarHBondContact O-N 2.86Å
570	I	91.1	Very high	89.9	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	139	-176.3	-51.1	171.5	0	0	0	108.6	M368 T369 A370 T435 A438 L439 R549 L551 I568	M368-I570 HydrophobicContact CB-CG2 4.09Å; M368-I570 HydrophobicContact CE-CB 4.31Å; M368-I570 HydrophobicContact CE-CG2 3.64Å; M368-I570 HydrophobicContact SD-CG2 4.41Å; T369-I570 WeakPolarHBondContact O-CA 3.24Å; T369-I570 WeakPolarHBondContact O-CG2 3.46Å; A370-I570 HydrophobicContact CB-CG1 4.35Å; T435-I570 HydrophobicContact CG2-CD1 3.81Å; A438-I570 HydrophobicContact CB-CD1 4.28Å; A438-I570 HydrophobicContact CB-CG2 3.78Å; L439-I570 HydrophobicContact CD2-CD1 4.17Å; R549-I570 WeakPolarHBondContact CB-O 3.5Å; R549-I570 PolarHBondContact N-O 2.96Å; R549-I570 PolarHBondContact O-N 2.91Å; L551-I570 HydrophobicContact CD1-CD1 4.3Å; I568-I570 HydrophobicContact CG2-CG1 4.13Å
571	L	88.4	Confident	89.9	Confident	9 Å²	9	26.1 Å²	26.1	5%	0.047	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	169.2	167.1	76.9	147	0	0	0	112	T369 V371 L548 P573	T369-L571 PolarHBondContact N-O 3.48Å; T369-L571 PolarHBondContact O-N 3.33Å; V371-L571 HydrophobicContact CB-CD2 3.72Å; V371-L571 HydrophobicContact CG1-CD2 4.17Å; V371-L571 HydrophobicContact CG2-CD2 3.5Å; L548-L571 HydrophobicContact CD2-CB 4.14Å; L548-L571 HydrophobicContact CD2-CD2 3.55Å; L548-L571 HydrophobicContact CD2-CG 4.4Å; L571-P573 WeakPolarHBondContact O-CD 3.49Å
572	D	85.7	Confident	89.9	Confident	21 Å²	21	21.3 Å²	21.3	11%	0.112	12%	0.116	C	C	.	.			trans	-86.4	106.5	161	179	23.4	0	0	0	108.7	T364 N366 E367 M368	T364-D572 VanDerWaalsContact CB-CG 3.48Å; T364-D572 WeakPolarHBondContact CB-OD2 3.49Å; T364-D572 WeakPolarHBondContact CG2-O 3.42Å; T364-D572 PolarHBondContact OG1-OD2 3.15Å; N366-D572 VanDerWaalsContact CA-OD1 3.23Å; N366-D572 WeakPolarHBondContact CA-OD1 3.46Å; N366-D572 PolarHBondContact N-OD1 2.92Å; E367-D572 PolarHBondContact N-OD1 3.31Å; E367-D572 VanDerWaalsContact N-OD1 3.14Å; M368-D572 HydrophobicContact SD-CB 4.16Å
573	P	86	Confident	89.6	Confident	12 Å²	12	25.4 Å²	25.4	8%	0.078	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-78.7	150	-168.9	32.6	-36.4	0	0	0	112.5	T364 K365 E367 V386 L571	T364-P573 CarbonylContact C-O 3.59Å; T364-P573 WeakPolarHBondContact CA-O 3.29Å; T364-P573 VanDerWaalsContact CB-O 3.29Å; T364-P573 WeakPolarHBondContact CB-O 3.39Å; K365-P573 PolarHBondContact N-O 3.02Å; E367-P573 WeakPolarHBondContact O-CD 3.27Å; V386-P573 HydrophobicContact CG1-CB 3.94Å; V386-P573 HydrophobicContact CG1-CG 3.45Å; V386-P573 VanDerWaalsContact CG1-CG 3.45Å; L571-P573 WeakPolarHBondContact O-CD 3.49Å
574	P	87.7	Confident	89.1	Confident	29 Å²	29	27.4 Å²	27.4	19%	0.188	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-49.9	143.3	163.7	-28.7	37.1	0	0	0	112.6	R609 L610	P574-R609 HydrophobicContact CG-CB 4.35Å; P574-L610 HydrophobicContact CB-CD2 3.84Å; P574-L610 HydrophobicContact CB-CG 4.5Å; P574-L610 HydrophobicContact CG-CD2 4.24Å; P574-L610 HydrophobicContact CG-CG 4.38Å
575	R	86.1	Confident	88.6	Confident	29 Å²	29	27.2 Å²	27.2	11%	0.109	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-64.3	143.6	170.5	-69.1	170.7	175.3	-91.3	11.8	110.1	G361 T362 L363 T364 K365 T578 T723 D739	G361-R575 PolarHBondContact O-NE 2.99Å; G361-R575 VanDerWaalsContact O-NE 3.13Å; G361-R575 PolarHBondContact O-NH2 2.69Å; T362-R575 WeakPolarHBondContact O-CD 3.41Å; L363-R575 PolarHBondContact O-N 2.9Å; T364-R575 PolarHBondContact O-NE 3.2Å; K365-R575 HydrophobicContact CB-CG 4.29Å; R575-T578 WeakPolarHBondContact CB-OG1 3.35Å; R575-T578 WeakPolarHBondContact O-CB 3.37Å; R575-T578 PolarHBondContact O-N 3.38Å; R575-T578 PolarHBondContact O-OG1 2.8Å; R575-T723 VanDerWaalsContact NH2-CG2 3.26Å; R575-T723 PolarHBondContact NH2-OG1 3.34Å; R575-D739 IonicContact CZ-OD2 3.36Å; R575-D739 IonicContact NH1-OD2 3.09Å; R575-D739 PolarHBondContact NH1-OD2 2.67Å; R575-D739 IonicContact NH2-OD2 2.63Å; R575-D739 PolarHBondContact NH2-OD2 2.63Å
576	P	82.4	Confident	88.2	Confident	99 Å²	99	32.4 Å²	32.4	64%	0.643	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	140	177.6	27.6	-34.9	0	0	0	110.6	T578	P576-T578 VanDerWaalsContact C-N 3.26Å; P576-T578 PolarHBondContact O-N 3.49Å
577	G	84.6	Confident	87.6	Confident	31 Å²	31	37.1 Å²	37.1	32%	0.32	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-10.6	-177.9	0	0	0	0	0	115.4	E580 S581	G577-E580 WeakPolarHBondContact CA-OE2 3.39Å; G577-S581 VanDerWaalsContact O-CB 3.26Å; G577-S581 WeakPolarHBondContact O-CB 3.38Å; G577-S581 PolarHBondContact O-N 2.94Å; G577-S581 PolarHBondContact O-OG 3.35Å
578	T	87.3	Confident	86.8	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-67.9	-37	-177.6	-59.8	0	0	0	0	112.5	L363 R575 P576 S581 I582 L610 F741	L363-T578 HydrophobicContact CD2-CG2 3.7Å; R575-T578 WeakPolarHBondContact CB-OG1 3.35Å; R575-T578 WeakPolarHBondContact O-CB 3.37Å; R575-T578 PolarHBondContact O-N 3.38Å; R575-T578 PolarHBondContact O-OG1 2.8Å; P576-T578 VanDerWaalsContact C-N 3.26Å; P576-T578 PolarHBondContact O-N 3.49Å; T578-S581 PolarHBondContact O-N 2.86Å; T578-I582 HydrophobicContact CG2-CD1 3.98Å; T578-I582 HydrophobicContact CG2-CG1 4.46Å; T578-I582 VanDerWaalsContact O-CG1 3.31Å; T578-I582 WeakPolarHBondContact O-CG1 3.38Å; T578-I582 PolarHBondContact O-N 2.95Å; T578-L610 HydrophobicContact CG2-CD2 3.75Å; T578-F741 HydrophobicContact CG2-CB 4.28Å; T578-F741 HydrophobicContact CG2-CD2 4.47Å; T578-F741 HydrophobicContact CG2-CG 4.28Å
579	R	89	Confident	86.2	Confident	95 Å²	95	40.3 Å²	40.3	36%	0.358	23%	0.229	S	C	.	.	H	α-helix	trans	-63.8	-52.4	178.8	176.9	-178	178.2	117.9	5.6	110.7	S581 I582 E583 R609	R579-S581 PolarHBondContact O-N 3.5Å; R579-I582 PolarHBondContact O-N 3.4Å; R579-I582 VanDerWaalsContact O-N 3.11Å; R579-E583 IonicContact CZ-OE1 2.99Å; R579-E583 IonicContact NE-OE1 3.18Å; R579-E583 PolarHBondContact NE-OE1 3.05Å; R579-E583 IonicContact NH2-OE1 2.69Å; R579-E583 PolarHBondContact NH2-OE1 3.3Å; R579-E583 VanDerWaalsContact NH2-OE1 3.09Å; R579-E583 WeakPolarHBondContact O-CG 3.37Å; R579-E583 PolarHBondContact O-N 3.06Å; R579-R609 PolarHBondContact NH1-O 3.35Å
580	E	88.6	Confident	85.9	Confident	109 Å²	109	40.4 Å²	40.4	51%	0.509	23%	0.23	S	C	.	.	H	α-helix	trans	-59.2	-38.6	178.4	-59.4	80	178.3	0	0	110.3	G577 E583 V584	G577-E580 WeakPolarHBondContact CA-OE2 3.39Å; E580-E583 PolarHBondContact O-N 3.27Å; E580-V584 WeakPolarHBondContact O-CB 3.44Å; E580-V584 VanDerWaalsContact O-CG2 3.24Å; E580-V584 WeakPolarHBondContact O-CG2 3.24Å; E580-V584 PolarHBondContact O-N 3.01Å
581	S	86.3	Confident	85.8	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-39.3	175.6	-58.5	0	0	0	0	112.7	G577 T578 R579 V584 V585 Y742	G577-S581 VanDerWaalsContact O-CB 3.26Å; G577-S581 WeakPolarHBondContact O-CB 3.38Å; G577-S581 PolarHBondContact O-N 2.94Å; G577-S581 PolarHBondContact O-OG 3.35Å; T578-S581 PolarHBondContact O-N 2.86Å; R579-S581 PolarHBondContact O-N 3.5Å; S581-V584 PolarHBondContact O-N 2.93Å; S581-V585 WeakPolarHBondContact O-CB 3.4Å; S581-V585 VanDerWaalsContact O-CG2 3.22Å; S581-V585 WeakPolarHBondContact O-CG2 3.46Å; S581-V585 PolarHBondContact O-N 3.02Å; S581-Y742 WeakPolarHBondContact OG-CA 3.48Å; S581-Y742 WeakPolarHBondContact OG-CB 3.45Å; S581-Y742 PolarHBondContact OG-N 3.14Å
582	I	89.5	Confident	86	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-46	172.7	-72.8	169.4	0	0	0	110.7	L363 T578 R579 V584 V585 R586 V592 L610 M612 F741	L363-I582 HydrophobicContact CD2-CD1 4.11Å; T578-I582 HydrophobicContact CG2-CD1 3.98Å; T578-I582 HydrophobicContact CG2-CG1 4.46Å; T578-I582 VanDerWaalsContact O-CG1 3.31Å; T578-I582 WeakPolarHBondContact O-CG1 3.38Å; T578-I582 PolarHBondContact O-N 2.95Å; R579-I582 PolarHBondContact O-N 3.4Å; R579-I582 VanDerWaalsContact O-N 3.11Å; I582-V584 VanDerWaalsContact C-N 3.31Å; I582-V584 PolarHBondContact O-N 3.14Å; I582-V585 PolarHBondContact O-N 3.23Å; I582-R586 HydrophobicContact CG2-CG 4.32Å; I582-R586 WeakPolarHBondContact O-CB 3.3Å; I582-R586 VanDerWaalsContact O-CG 3.3Å; I582-R586 WeakPolarHBondContact O-CG 3.48Å; I582-R586 PolarHBondContact O-N 3.37Å; I582-V592 HydrophobicContact CG1-CG1 4.44Å; I582-V592 HydrophobicContact CG2-CB 4.49Å; I582-V592 HydrophobicContact CG2-CG2 4.36Å; I582-L610 HydrophobicContact CD1-CB 4.15Å; I582-L610 HydrophobicContact CD1-CD1 4.42Å; I582-L610 HydrophobicContact CD1-CD2 4.16Å; I582-L610 HydrophobicContact CD1-CG 4.5Å; I582-M612 HydrophobicContact CD1-CE 4.38Å; I582-M612 HydrophobicContact CG2-CG 4.15Å; I582-F741 HydrophobicContact CG1-CD1 4.5Å; I582-F741 HydrophobicContact CG1-CE1 4.03Å; I582-F741 HydrophobicContact CG1-CZ 4.42Å
583	E	87.4	Confident	86.4	Confident	86 Å²	86	43.5 Å²	43.5	40%	0.402	24%	0.243	S	C	.	.	H	α-helix	trans	-59.5	-42.1	177.3	-71.1	175.2	-174.4	0	0	111	R579 E580 S587	R579-E583 IonicContact CZ-OE1 2.99Å; R579-E583 IonicContact NE-OE1 3.18Å; R579-E583 PolarHBondContact NE-OE1 3.05Å; R579-E583 IonicContact NH2-OE1 2.69Å; R579-E583 PolarHBondContact NH2-OE1 3.3Å; R579-E583 VanDerWaalsContact NH2-OE1 3.09Å; R579-E583 WeakPolarHBondContact O-CG 3.37Å; R579-E583 PolarHBondContact O-N 3.06Å; E580-E583 PolarHBondContact O-N 3.27Å; E583-S587 PolarHBondContact O-N 2.78Å
584	V	84	Confident	86.8	Confident	45 Å²	45	43 Å²	43	27%	0.273	24%	0.239	S	C	.	.	H	α-helix	trans	-69.9	-40.8	175.6	172	0	0	0	0	112.5	E580 S581 I582 S587 S588 R745	E580-V584 WeakPolarHBondContact O-CB 3.44Å; E580-V584 VanDerWaalsContact O-CG2 3.24Å; E580-V584 WeakPolarHBondContact O-CG2 3.24Å; E580-V584 PolarHBondContact O-N 3.01Å; S581-V584 PolarHBondContact O-N 2.93Å; I582-V584 VanDerWaalsContact C-N 3.31Å; I582-V584 PolarHBondContact O-N 3.14Å; V584-S587 PolarHBondContact O-N 2.85Å; V584-S587 PolarHBondContact O-OG 2.65Å; V584-S588 PolarHBondContact O-N 3.34Å; V584-R745 HydrophobicContact CG1-CG 3.88Å
585	V	85.6	Confident	87	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-61.9	-45.1	174.7	163.9	0	0	0	0	110.7	I355 S581 I582 S587 S588 V590 V592	I355-V585 HydrophobicContact CD1-CG1 3.88Å; S581-V585 WeakPolarHBondContact O-CB 3.4Å; S581-V585 VanDerWaalsContact O-CG2 3.22Å; S581-V585 WeakPolarHBondContact O-CG2 3.46Å; S581-V585 PolarHBondContact O-N 3.02Å; I582-V585 PolarHBondContact O-N 3.23Å; V585-S587 PolarHBondContact O-N 2.72Å; V585-S588 PolarHBondContact O-N 2.79Å; V585-S588 VanDerWaalsContact O-N 3.1Å; V585-S588 PolarHBondContact O-OG 2.91Å; V585-V590 HydrophobicContact CG1-CB 3.71Å; V585-V590 HydrophobicContact CG1-CG1 3.83Å; V585-V590 HydrophobicContact CG1-CG2 4.48Å; V585-V590 PolarHBondContact O-N 2.8Å; V585-V592 HydrophobicContact CG1-CG2 3.82Å
586	R	86.2	Confident	87.1	Confident	108 Å²	108	40.2 Å²	40.2	41%	0.408	23%	0.225	S	C	.	.	H	α-helix	trans	-61.1	-41.5	175.4	-70.9	179.4	79.2	169.6	11	112.3	I582 S588 G589 V590 V592 G611	I582-R586 HydrophobicContact CG2-CG 4.32Å; I582-R586 WeakPolarHBondContact O-CB 3.3Å; I582-R586 VanDerWaalsContact O-CG 3.3Å; I582-R586 WeakPolarHBondContact O-CG 3.48Å; I582-R586 PolarHBondContact O-N 3.37Å; R586-S588 PolarHBondContact O-N 3.49Å; R586-G589 PolarHBondContact O-N 3.03Å; R586-V590 WeakPolarHBondContact CA-O 3.32Å; R586-V592 HydrophobicContact CG-CG2 4.24Å; R586-G611 PolarHBondContact NH1-O 3.46Å; R586-G611 VanDerWaalsContact NH1-O 3.15Å
587	S	82	Confident	87	Confident	99 Å²	99	38 Å²	38	69%	0.692	22%	0.22	S	C	*	.	H	α-helix	trans	-65.5	-19.1	176	69.5	0	0	0	0	114.1	E583 V584 V585 G589	E583-S587 PolarHBondContact O-N 2.78Å; V584-S587 PolarHBondContact O-N 2.85Å; V584-S587 PolarHBondContact O-OG 2.65Å; V585-S587 PolarHBondContact O-N 2.72Å; S587-G589 VanDerWaalsContact C-N 3.28Å; S587-G589 PolarHBondContact O-N 2.97Å
588	S	77.3	Confident	86.8	Confident	23 Å²	23	38.5 Å²	38.5	16%	0.161	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	4.8	171.8	79.5	0	0	0	0	114.7	V584 V585 R586 P822	V584-S588 PolarHBondContact O-N 3.34Å; V585-S588 PolarHBondContact O-N 2.79Å; V585-S588 VanDerWaalsContact O-N 3.1Å; V585-S588 PolarHBondContact O-OG 2.91Å; R586-S588 PolarHBondContact O-N 3.49Å; S588-P822 WeakPolarHBondContact O-CD 3.26Å
589	G	81.9	Confident	86.5	Confident	47 Å²	47	40.4 Å²	40.4	49%	0.485	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	12.1	178.1	0	0	0	0	0	115.3	R586 S587	R586-G589 PolarHBondContact O-N 3.03Å; S587-G589 VanDerWaalsContact C-N 3.28Å; S587-G589 PolarHBondContact O-N 2.97Å
590	V	87.1	Confident	86.4	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.018	22%	0.222	C	C	.	.			trans	-98.2	128.6	-177.8	-177.1	0	0	0	0	110.4	V352 I355 V585 R586 P822	V352-V590 HydrophobicContact CG1-CG1 4.15Å; V352-V590 WeakPolarHBondContact O-CG2 3.5Å; I355-V590 HydrophobicContact CD1-CG1 4.21Å; I355-V590 HydrophobicContact CG1-CG1 3.85Å; V585-V590 HydrophobicContact CG1-CB 3.71Å; V585-V590 HydrophobicContact CG1-CG1 3.83Å; V585-V590 HydrophobicContact CG1-CG2 4.48Å; V585-V590 PolarHBondContact O-N 2.8Å; R586-V590 WeakPolarHBondContact CA-O 3.32Å; V590-P822 HydrophobicContact CG2-CG 3.78Å
591	K	89.4	Confident	86.1	Confident	84 Å²	84	38 Å²	38	37%	0.365	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	138.4	174.6	-65	177.8	-176.2	175.4	0	109.6	N353 V354 I355 D638	N353-K591 PolarHBondContact O-N 3.19Å; V354-K591 CarbonylContact C-O 3.51Å; V354-K591 WeakPolarHBondContact CA-O 3.43Å; V354-K591 HydrophobicContact CG1-CB 4.45Å; V354-K591 HydrophobicContact CG2-CB 4.33Å; I355-K591 PolarHBondContact N-O 3.41Å; K591-D638 IonicContact NZ-OD1 3.97Å; K591-D638 PolarHBondContact NZ-OD1 2.79Å; K591-D638 IonicContact NZ-OD2 3.49Å; K591-D638 PolarHBondContact NZ-OD2 3.18Å
592	V	92.1	Very high	85.8	Confident	8 Å²	8	40 Å²	40	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.8	173.6	-176.3	0	0	0	0	108.4	I355 I582 V585 R586 M612	I355-V592 WeakPolarHBondContact O-CA 3.47Å; I582-V592 HydrophobicContact CG1-CG1 4.44Å; I582-V592 HydrophobicContact CG2-CB 4.49Å; I582-V592 HydrophobicContact CG2-CG2 4.36Å; V585-V592 HydrophobicContact CG1-CG2 3.82Å; R586-V592 HydrophobicContact CG-CG2 4.24Å; V592-M612 HydrophobicContact CB-SD 4.38Å; V592-M612 HydrophobicContact CG1-SD 3.91Å
593	K	93.5	Very high	85.6	Confident	3 Å²	3	40 Å²	40	1%	0.013	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.7	-179.8	-62.5	175.8	-175.6	-83	0	109.5	V354 I355 C356 S357 I637 D638 V640 I641 F643 L658	V354-K593 HydrophobicContact CG1-CD 3.82Å; V354-K593 HydrophobicContact CG1-CG 4.23Å; I355-K593 PolarHBondContact O-N 2.93Å; C356-K593 WeakPolarHBondContact CA-O 3.2Å; S357-K593 PolarHBondContact N-O 3.43Å; K593-I637 PolarHBondContact NZ-O 2.99Å; K593-D638 PolarHBondContact NZ-O 2.95Å; K593-V640 PolarHBondContact NZ-O 3.5Å; K593-I641 CarbonylContact C-O 3.54Å; K593-I641 VanDerWaalsContact CA-O 3.29Å; K593-I641 WeakPolarHBondContact CA-O 3.38Å; K593-F643 HydrophobicContact CD-CE2 4.43Å; K593-L658 HydrophobicContact CD-CD1 4.29Å
594	M	93.7	Very high	85.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	139.8	174.6	-176	-169.8	-68.9	0	0	110.3	S357 K359 L363 T596 V606 A607 L610 M612 I641 V642 F643	S357-M594 CarbonylContact O-C 3.57Å; S357-M594 WeakPolarHBondContact O-CA 3.5Å; K359-M594 HydrophobicContact CB-CG 4.1Å; K359-M594 HydrophobicContact CB-SD 3.95Å; K359-M594 HydrophobicContact CG-CE 4.27Å; K359-M594 HydrophobicContact CG-SD 4.07Å; L363-M594 HydrophobicContact CD1-CE 4.14Å; L363-M594 HydrophobicContact CD1-CG 4.24Å; M594-T596 HydrophobicContact SD-CG2 4.45Å; M594-V606 HydrophobicContact CE-CB 4.17Å; M594-V606 HydrophobicContact CE-CG1 3.87Å; M594-A607 HydrophobicContact CE-CB 3.97Å; M594-L610 HydrophobicContact CE-CD1 3.86Å; M594-M612 HydrophobicContact CB-CE 4.16Å; M594-M612 HydrophobicContact CE-CE 3.67Å; M594-I641 PolarHBondContact N-O 2.88Å; M594-V642 WeakPolarHBondContact O-CA 3.42Å; M594-F643 PolarHBondContact O-N 2.93Å
595	I	92.5	Very high	85.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137	166.6	-51.7	173.7	0	0	0	107.6	C356 S357 D358 K359 F643 A646 K651 I654	C356-I595 HydrophobicContact CB-CD1 4.03Å; S357-I595 PolarHBondContact O-N 2.7Å; D358-I595 CarbonylContact C-O 3.57Å; D358-I595 VanDerWaalsContact CA-O 3.3Å; D358-I595 WeakPolarHBondContact CA-O 3.02Å; K359-I595 PolarHBondContact N-O 3.09Å; K359-I595 VanDerWaalsContact N-O 3.11Å; I595-F643 CarbonylContact C-O 3.55Å; I595-F643 WeakPolarHBondContact CA-O 3.36Å; I595-F643 HydrophobicContact CB-CB 4.43Å; I595-F643 HydrophobicContact CG1-CB 4.26Å; I595-F643 HydrophobicContact CG1-CD2 3.98Å; I595-F643 HydrophobicContact CG1-CG 4.45Å; I595-F643 HydrophobicContact CG2-CB 4.13Å; I595-A646 HydrophobicContact CG2-CB 3.43Å; I595-A646 VanDerWaalsContact CG2-CB 3.43Å; I595-K651 HydrophobicContact CG2-CG 3.82Å; I595-I654 HydrophobicContact CD1-CB 4.42Å; I595-I654 HydrophobicContact CD1-CD1 3.98Å; I595-I654 HydrophobicContact CD1-CG2 4.03Å; I595-I654 HydrophobicContact CG1-CD1 4.3Å; I595-I654 HydrophobicContact CG2-CD1 4.4Å
596	T	88.2	Confident	85.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	22%	0.218	C	C	.	.			trans	-153.2	157.9	177.2	-175	0	0	0	0	112.8	M594 D598 A603 F643 Y644 R645 A646	M594-T596 HydrophobicContact SD-CG2 4.45Å; T596-D598 HydrophobicContact CG2-CB 3.94Å; T596-D598 PolarHBondContact OG1-N 2.84Å; T596-D598 VanDerWaalsContact OG1-N 3.15Å; T596-D598 PolarHBondContact OG1-OD2 2.81Å; T596-A603 HydrophobicContact CG2-CB 3.68Å; T596-F643 PolarHBondContact N-O 3.17Å; T596-Y644 CarbonylContact O-C 3.52Å; T596-Y644 WeakPolarHBondContact O-CA 3.32Å; T596-R645 PolarHBondContact O-N 3.34Å; T596-A646 WeakPolarHBondContact O-CB 3.44Å; T596-A646 PolarHBondContact O-N 3.44Å
597	G	80.7	Confident	85.9	Confident	52 Å²	52	31.3 Å²	31.3	54%	0.536	20%	0.199	S	C	.	.	S	Bend	trans	-78.1	-12.7	166.9	0	0	0	0	0	114.8	R645	G597-R645 WeakPolarHBondContact O-CA 3.29Å
598	D	80.3	Confident	86.2	Confident	41 Å²	41	29.7 Å²	29.7	22%	0.219	18%	0.183	C	C	.	.	S	Bend	trans	-63.5	172.7	-174.1	-54.8	-66.2	0	0	0	114.3	K359 T596 T602 R645	K359-D598 WeakPolarHBondContact CD-OD2 3.06Å; K359-D598 VanDerWaalsContact CE-OD2 3.32Å; K359-D598 WeakPolarHBondContact CE-OD2 3.42Å; K359-D598 VanDerWaalsContact NZ-CG 3.28Å; K359-D598 IonicContact NZ-OD1 2.69Å; K359-D598 PolarHBondContact NZ-OD1 2.85Å; K359-D598 IonicContact NZ-OD2 3.56Å; K359-D598 PolarHBondContact NZ-OD2 3.39Å; T596-D598 HydrophobicContact CG2-CB 3.94Å; T596-D598 PolarHBondContact OG1-N 2.84Å; T596-D598 VanDerWaalsContact OG1-N 3.15Å; T596-D598 PolarHBondContact OG1-OD2 2.81Å; D598-T602 HydrophobicContact CB-CG2 4.04Å; D598-R645 WeakPolarHBondContact O-CG 3.37Å; D598-R645 PolarHBondContact O-N 3.21Å
599	S	82	Confident	86.6	Confident	41 Å²	41	32.6 Å²	32.6	29%	0.287	19%	0.19	S	C	.	.			trans	-70.5	163	164.1	79.1	0	0	0	0	112.7	E601 T602 A603	S599-E601 VanDerWaalsContact C-N 3.32Å; S599-E601 WeakPolarHBondContact CB-OE2 3.42Å; S599-E601 PolarHBondContact O-N 3.22Å; S599-E601 PolarHBondContact OG-OE2 3.15Å; S599-T602 PolarHBondContact O-N 3.28Å; S599-A603 WeakPolarHBondContact O-CB 3.22Å; S599-A603 PolarHBondContact O-N 3.23Å
600	L	85.5	Confident	86.9	Confident	42 Å²	42	30.4 Å²	30.4	22%	0.22	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-42.2	-176.5	177.2	61.2	0	0	0	112.5	A603 L604 A619 Y644	L600-A603 PolarHBondContact O-N 3.24Å; L600-L604 HydrophobicContact CD1-CD1 3.7Å; L600-L604 HydrophobicContact CD1-CD2 4.44Å; L600-L604 HydrophobicContact CD1-CG 3.8Å; L600-L604 HydrophobicContact CG-CD1 3.89Å; L600-L604 HydrophobicContact CG-CG 4.33Å; L600-L604 WeakPolarHBondContact O-CB 3.49Å; L600-L604 VanDerWaalsContact O-CG 3.31Å; L600-L604 WeakPolarHBondContact O-CG 3.23Å; L600-L604 PolarHBondContact O-N 2.95Å; L600-A619 HydrophobicContact CD1-CB 3.64Å; L600-Y644 HydrophobicContact CB-CD2 3.96Å; L600-Y644 HydrophobicContact CB-CE1 4.38Å; L600-Y644 HydrophobicContact CB-CE2 3.76Å; L600-Y644 HydrophobicContact CB-CG 4.35Å; L600-Y644 HydrophobicContact CD1-CD1 3.84Å; L600-Y644 HydrophobicContact CD1-CE1 3.64Å; L600-Y644 HydrophobicContact CD1-CG 4.38Å; L600-Y644 HydrophobicContact CG-CE1 4.45Å
601	E	82.8	Confident	86.8	Confident	113 Å²	113	30.6 Å²	30.6	53%	0.528	17%	0.17	S	C	.	.	H	α-helix	trans	-66.4	-44.5	-174.8	-48.9	77.4	-171.1	0	0	110.9	S599 C605	S599-E601 VanDerWaalsContact C-N 3.32Å; S599-E601 WeakPolarHBondContact CB-OE2 3.42Å; S599-E601 PolarHBondContact O-N 3.22Å; S599-E601 PolarHBondContact OG-OE2 3.15Å; E601-C605 VanDerWaalsContact O-CB 3.31Å; E601-C605 WeakPolarHBondContact O-CB 3.28Å; E601-C605 PolarHBondContact O-N 3.4Å
602	T	81	Confident	86.6	Confident	43 Å²	43	26.7 Å²	26.7	26%	0.264	15%	0.153	S	C	.	.	H	α-helix	trans	-64.8	-47.3	174.8	-59	0	0	0	0	110.9	D598 S599 C605 V606	D598-T602 HydrophobicContact CB-CG2 4.04Å; S599-T602 PolarHBondContact O-N 3.28Å; T602-C605 PolarHBondContact O-N 2.9Å; T602-V606 WeakPolarHBondContact O-CG2 3.35Å; T602-V606 PolarHBondContact O-N 3.19Å
603	A	85.4	Confident	85.6	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.7	-48.4	-179.1	0	0	0	0	0	112.2	T596 S599 L600 C605 V606 A607 V642	T596-A603 HydrophobicContact CG2-CB 3.68Å; S599-A603 WeakPolarHBondContact O-CB 3.22Å; S599-A603 PolarHBondContact O-N 3.23Å; L600-A603 PolarHBondContact O-N 3.24Å; A603-C605 PolarHBondContact O-N 3.02Å; A603-V606 PolarHBondContact O-N 2.97Å; A603-A607 VanDerWaalsContact O-CB 3.31Å; A603-A607 WeakPolarHBondContact O-CB 3.29Å; A603-A607 PolarHBondContact O-N 3.21Å; A603-V642 HydrophobicContact CB-CG1 3.7Å
604	L	87.8	Confident	84.4	Confident	28 Å²	28	32.2 Å²	32.2	15%	0.147	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-40.6	175.8	-71.7	178.6	0	0	0	112.1	L600 A607 N608 T614 A619	L600-L604 HydrophobicContact CD1-CD1 3.7Å; L600-L604 HydrophobicContact CD1-CD2 4.44Å; L600-L604 HydrophobicContact CD1-CG 3.8Å; L600-L604 HydrophobicContact CG-CD1 3.89Å; L600-L604 HydrophobicContact CG-CG 4.33Å; L600-L604 WeakPolarHBondContact O-CB 3.49Å; L600-L604 VanDerWaalsContact O-CG 3.31Å; L600-L604 WeakPolarHBondContact O-CG 3.23Å; L600-L604 PolarHBondContact O-N 2.95Å; L604-A607 PolarHBondContact O-N 3.1Å; L604-N608 WeakPolarHBondContact O-CB 3.25Å; L604-N608 VanDerWaalsContact O-CG 3.28Å; L604-N608 PolarHBondContact O-N 3.13Å; L604-N608 PolarHBondContact O-ND2 2.85Å; L604-T614 HydrophobicContact CD2-CG2 4.03Å; L604-A619 HydrophobicContact CD2-CB 4.18Å
605	C	84.5	Confident	83.3	Confident	22 Å²	22	38.3 Å²	38.3	15%	0.149	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-45.7	178.8	-171.3	0	0	0	0	112.1	T546 E601 T602 A603 A607 N608 R609	T546-C605 PolarHBondContact O-SG 2.65Å; E601-C605 VanDerWaalsContact O-CB 3.31Å; E601-C605 WeakPolarHBondContact O-CB 3.28Å; E601-C605 PolarHBondContact O-N 3.4Å; T602-C605 PolarHBondContact O-N 2.9Å; A603-C605 PolarHBondContact O-N 3.02Å; C605-A607 VanDerWaalsContact C-N 3.34Å; C605-A607 PolarHBondContact O-N 2.99Å; C605-N608 PolarHBondContact O-N 2.83Å; C605-R609 WeakPolarHBondContact O-CG 3.24Å; C605-R609 PolarHBondContact O-N 2.75Å; C605-R609 PolarHBondContact SG-NE 3.08Å; C605-R609 VanDerWaalsContact SG-NE 3.36Å
606	V	86.9	Confident	82.1	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-65.1	-39.6	177.4	179.6	0	0	0	0	110.6	K359 T364 M594 T602 A603 N608 R609 L610	K359-V606 HydrophobicContact CD-CG1 4.26Å; K359-V606 HydrophobicContact CD-CG2 4.32Å; K359-V606 HydrophobicContact CG-CG1 3.92Å; T364-V606 HydrophobicContact CG2-CG1 4.01Å; M594-V606 HydrophobicContact CE-CB 4.17Å; M594-V606 HydrophobicContact CE-CG1 3.87Å; T602-V606 WeakPolarHBondContact O-CG2 3.35Å; T602-V606 PolarHBondContact O-N 3.19Å; A603-V606 PolarHBondContact O-N 2.97Å; V606-N608 PolarHBondContact O-N 2.93Å; V606-R609 PolarHBondContact O-N 2.95Å; V606-L610 HydrophobicContact CG1-CD1 3.94Å; V606-L610 HydrophobicContact CG1-CG 4.48Å; V606-L610 WeakPolarHBondContact O-CB 3.47Å; V606-L610 VanDerWaalsContact O-CG 3.31Å; V606-L610 WeakPolarHBondContact O-CG 3.41Å; V606-L610 PolarHBondContact O-N 3.28Å
607	A	89	Confident	81.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.7	-42.5	174.9	0	0	0	0	0	112.7	M594 A603 L604 C605 L610 G611 M612 V642	M594-A607 HydrophobicContact CE-CB 3.97Å; A603-A607 VanDerWaalsContact O-CB 3.31Å; A603-A607 WeakPolarHBondContact O-CB 3.29Å; A603-A607 PolarHBondContact O-N 3.21Å; L604-A607 PolarHBondContact O-N 3.1Å; C605-A607 VanDerWaalsContact C-N 3.34Å; C605-A607 PolarHBondContact O-N 2.99Å; A607-L610 CarbonylContact O-C 3.51Å; A607-L610 PolarHBondContact O-N 3.24Å; A607-G611 PolarHBondContact O-N 2.65Å; A607-M612 HydrophobicContact CB-CB 4.25Å; A607-M612 HydrophobicContact CB-CE 4.29Å; A607-M612 WeakPolarHBondContact O-CB 3.04Å; A607-M612 PolarHBondContact O-N 3.26Å; A607-V642 HydrophobicContact CB-CG2 3.74Å
608	N	87.7	Confident	81.6	Confident	66 Å²	66	45.5 Å²	45.5	35%	0.353	26%	0.259	S	S	.	.	H	α-helix	trans	-71.7	-35.2	178.5	-70.1	-20.5	0	0	0	112.4	L604 C605 V606 L610 G611 N613 T614	L604-N608 WeakPolarHBondContact O-CB 3.25Å; L604-N608 VanDerWaalsContact O-CG 3.28Å; L604-N608 PolarHBondContact O-N 3.13Å; L604-N608 PolarHBondContact O-ND2 2.85Å; C605-N608 PolarHBondContact O-N 2.83Å; V606-N608 PolarHBondContact O-N 2.93Å; N608-L610 VanDerWaalsContact C-N 3.29Å; N608-L610 PolarHBondContact O-N 2.81Å; N608-G611 PolarHBondContact O-N 3.22Å; N608-N613 VanDerWaalsContact OD1-CA 3.25Å; N608-N613 WeakPolarHBondContact OD1-CA 3.49Å; N608-N613 PolarHBondContact OD1-N 3.03Å; N608-T614 PolarHBondContact OD1-N 2.92Å
609	R	86.4	Confident	82	Confident	83 Å²	83	44.3 Å²	44.3	31%	0.313	26%	0.255	S	S	.	.	H	α-helix	trans	-60.5	-39.3	169.8	-70.1	172.6	-170.7	-122	8	111.7	T546 P574 R579 C605 V606 G611	T546-R609 PolarHBondContact O-NH2 3.2Å; P574-R609 HydrophobicContact CG-CB 4.35Å; R579-R609 PolarHBondContact NH1-O 3.35Å; C605-R609 WeakPolarHBondContact O-CG 3.24Å; C605-R609 PolarHBondContact O-N 2.75Å; C605-R609 PolarHBondContact SG-NE 3.08Å; C605-R609 VanDerWaalsContact SG-NE 3.36Å; V606-R609 PolarHBondContact O-N 2.95Å; R609-G611 VanDerWaalsContact C-N 3.26Å; R609-G611 PolarHBondContact O-N 2.86Å
610	L	88.5	Confident	82.5	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	3.3	176.7	-71.8	171.5	0	0	0	115	L363 P574 T578 I582 M594 V606 A607 N608 M612	L363-L610 HydrophobicContact CB-CD1 4.06Å; L363-L610 HydrophobicContact CD1-CD1 3.93Å; L363-L610 HydrophobicContact CD2-CD1 4.49Å; L363-L610 HydrophobicContact CG-CD1 4.4Å; P574-L610 HydrophobicContact CB-CD2 3.84Å; P574-L610 HydrophobicContact CB-CG 4.5Å; P574-L610 HydrophobicContact CG-CD2 4.24Å; P574-L610 HydrophobicContact CG-CG 4.38Å; T578-L610 HydrophobicContact CG2-CD2 3.75Å; I582-L610 HydrophobicContact CD1-CB 4.15Å; I582-L610 HydrophobicContact CD1-CD1 4.42Å; I582-L610 HydrophobicContact CD1-CD2 4.16Å; I582-L610 HydrophobicContact CD1-CG 4.5Å; M594-L610 HydrophobicContact CE-CD1 3.86Å; V606-L610 HydrophobicContact CG1-CD1 3.94Å; V606-L610 HydrophobicContact CG1-CG 4.48Å; V606-L610 WeakPolarHBondContact O-CB 3.47Å; V606-L610 VanDerWaalsContact O-CG 3.31Å; V606-L610 WeakPolarHBondContact O-CG 3.41Å; V606-L610 PolarHBondContact O-N 3.28Å; A607-L610 CarbonylContact O-C 3.51Å; A607-L610 PolarHBondContact O-N 3.24Å; N608-L610 VanDerWaalsContact C-N 3.29Å; N608-L610 PolarHBondContact O-N 2.81Å; L610-M612 VanDerWaalsContact C-N 3.28Å; L610-M612 HydrophobicContact CB-CE 3.96Å; L610-M612 HydrophobicContact CD1-CE 3.74Å; L610-M612 PolarHBondContact O-N 2.9Å
611	G	85.7	Confident	82.7	Confident	8 Å²	8	41.3 Å²	41.3	8%	0.082	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	18.7	-179.7	0	0	0	0	0	114.3	R586 A607 N608 R609 N613	R586-G611 PolarHBondContact NH1-O 3.46Å; R586-G611 VanDerWaalsContact NH1-O 3.15Å; A607-G611 PolarHBondContact O-N 2.65Å; N608-G611 PolarHBondContact O-N 3.22Å; R609-G611 VanDerWaalsContact C-N 3.26Å; R609-G611 PolarHBondContact O-N 2.86Å; G611-N613 VanDerWaalsContact C-N 3.33Å
612	M	84.4	Confident	82.8	Confident	1 Å²	1	36 Å²	36	1%	0.005	21%	0.213	C	C	.	.			trans	-80.7	-13.9	174.7	-71.6	-171.9	-77.6	0	0	113.4	L363 I582 V592 M594 A607 L610 T614 I641	L363-M612 HydrophobicContact CD1-CE 4.42Å; I582-M612 HydrophobicContact CD1-CE 4.38Å; I582-M612 HydrophobicContact CG2-CG 4.15Å; V592-M612 HydrophobicContact CB-SD 4.38Å; V592-M612 HydrophobicContact CG1-SD 3.91Å; M594-M612 HydrophobicContact CB-CE 4.16Å; M594-M612 HydrophobicContact CE-CE 3.67Å; A607-M612 HydrophobicContact CB-CB 4.25Å; A607-M612 HydrophobicContact CB-CE 4.29Å; A607-M612 WeakPolarHBondContact O-CB 3.04Å; A607-M612 PolarHBondContact O-N 3.26Å; L610-M612 VanDerWaalsContact C-N 3.28Å; L610-M612 HydrophobicContact CB-CE 3.96Å; L610-M612 HydrophobicContact CD1-CE 3.74Å; L610-M612 PolarHBondContact O-N 2.9Å; M612-T614 PolarHBondContact O-OG1 2.8Å; M612-T614 VanDerWaalsContact O-OG1 3.14Å; M612-I641 HydrophobicContact CB-CG2 4.14Å; M612-I641 HydrophobicContact SD-CG2 4.38Å
613	N	71	Confident	83.1	Confident	119 Å²	119	38.4 Å²	38.4	64%	0.636	22%	0.221	S	C	*	.			trans	40.4	74.9	167.1	-68	12.9	0	0	0	113.1	N608 G611	N608-N613 VanDerWaalsContact OD1-CA 3.25Å; N608-N613 WeakPolarHBondContact OD1-CA 3.49Å; N608-N613 PolarHBondContact OD1-N 3.03Å; G611-N613 VanDerWaalsContact C-N 3.33Å
614	T	68.9	Low	83.2	Confident	8 Å²	8	42.3 Å²	42.3	5%	0.049	24%	0.239	C	C	.	.			trans	-127	124.1	-170.8	-67.1	0	0	0	0	110.3	L604 N608 M612 I641 V642	L604-T614 HydrophobicContact CD2-CG2 4.03Å; N608-T614 PolarHBondContact OD1-N 2.92Å; M612-T614 PolarHBondContact O-OG1 2.8Å; M612-T614 VanDerWaalsContact O-OG1 3.14Å; T614-I641 HydrophobicContact CG2-CB 4.27Å; T614-I641 WeakPolarHBondContact OG1-CB 3.1Å; T614-I641 WeakPolarHBondContact OG1-CD1 3.49Å; T614-I641 WeakPolarHBondContact OG1-CG2 3.5Å; T614-V642 HydrophobicContact CG2-CG2 4.14Å
615	D	70.4	Confident	83.2	Confident	129 Å²	129	41 Å²	41	69%	0.69	23%	0.233	S	C	*	.			trans	-76.6	167.7	167	-64.2	-41.8	0	0	0	110.6	S617 G618	D615-S617 PolarHBondContact O-N 2.95Å; D615-G618 PolarHBondContact O-N 2.99Å
616	S	67.7	Low	83.2	Confident	87 Å²	87	46 Å²	46	61%	0.608	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-57.5	-22.5	179	52	0	0	0	0	114.4	G618 A619	S616-G618 VanDerWaalsContact C-N 3.28Å; S616-G618 PolarHBondContact O-N 3.08Å; S616-A619 PolarHBondContact O-N 3.4Å
617	S	74	Confident	83.2	Confident	106 Å²	106	52.8 Å²	52.8	74%	0.741	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-68.4	-20.6	173.6	53.9	0	0	0	0	114.4	D615	D615-S617 PolarHBondContact O-N 2.95Å
618	G	83.5	Confident	83	Confident	10 Å²	10	55 Å²	55	10%	0.103	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-95.4	12.6	175.3	0	0	0	0	0	113.9	D615 S616 I641 V642	D615-G618 PolarHBondContact O-N 2.99Å; S616-G618 VanDerWaalsContact C-N 3.28Å; S616-G618 PolarHBondContact O-N 3.08Å; G618-I641 PolarHBondContact O-N 2.89Å; G618-V642 PolarHBondContact O-N 3.4Å; G618-V642 VanDerWaalsContact O-N 3.16Å
619	A	89.6	Confident	82.8	Confident	17 Å²	17	56.6 Å²	56.6	14%	0.14	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	147.2	179.4	0	0	0	0	0	112.4	L600 L604 S616 V642 Y644	L600-A619 HydrophobicContact CD1-CB 3.64Å; L604-A619 HydrophobicContact CD2-CB 4.18Å; S616-A619 PolarHBondContact O-N 3.4Å; A619-V642 CarbonylContact C-O 3.51Å; A619-V642 WeakPolarHBondContact CA-O 3.46Å; A619-V642 HydrophobicContact CB-CB 4.26Å; A619-Y644 HydrophobicContact CB-CD1 4.33Å; A619-Y644 HydrophobicContact CB-CE1 4.31Å
620	L	91.6	Very high	82.4	Confident	9 Å²	9	56 Å²	56	5%	0.047	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	135.6	178.7	-172.3	69.7	0	0	0	111.4	E624 L625 M628 L633 V640 V642 F643 Y644	L620-E624 HydrophobicContact CD1-CB 3.68Å; L620-E624 HydrophobicContact CG-CB 4.37Å; L620-L625 HydrophobicContact CD2-CB 4.43Å; L620-L625 HydrophobicContact CD2-CD1 3.99Å; L620-M628 HydrophobicContact CD1-CE 3.69Å; L620-M628 HydrophobicContact CD1-SD 4.3Å; L620-M628 HydrophobicContact CD2-SD 4.13Å; L620-L633 HydrophobicContact CD2-CD1 4.32Å; L620-V640 HydrophobicContact CB-CG1 3.93Å; L620-V640 HydrophobicContact CB-CG2 4.15Å; L620-V642 PolarHBondContact N-O 2.94Å; L620-F643 HydrophobicContact CB-CD1 4.13Å; L620-F643 HydrophobicContact CB-CE1 4.35Å; L620-F643 HydrophobicContact CD2-CD1 4.27Å; L620-F643 HydrophobicContact CD2-CE1 4.01Å; L620-F643 WeakPolarHBondContact O-CA 3.5Å; L620-Y644 VanDerWaalsContact C-CD1 3.48Å; L620-Y644 VanDerWaalsContact O-CD1 3.25Å; L620-Y644 WeakPolarHBondContact O-CD1 3.37Å; L620-Y644 PolarHBondContact O-N 3.44Å
621	S	90.3	Very high	82	Confident	10 Å²	10	59.3 Å²	59.3	7%	0.07	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	156	176.7	70.3	0	0	0	0	113.3	E623 E624 L625 Y644	S621-E623 PolarHBondContact O-N 2.98Å; S621-E623 PolarHBondContact OG-N 3.33Å; S621-E624 WeakPolarHBondContact CB-OE2 3.35Å; S621-E624 PolarHBondContact N-OE2 3.49Å; S621-E624 PolarHBondContact O-N 2.82Å; S621-E624 WeakPolarHBondContact OG-CB 3.46Å; S621-E624 VanDerWaalsContact OG-CG 3.27Å; S621-E624 WeakPolarHBondContact OG-CG 3.33Å; S621-E624 PolarHBondContact OG-N 3.06Å; S621-E624 PolarHBondContact OG-OE2 3.45Å; S621-L625 WeakPolarHBondContact O-CB 3.2Å; S621-L625 PolarHBondContact O-N 3.12Å; S621-Y644 CarbonylContact C-O 3.5Å; S621-Y644 WeakPolarHBondContact CA-O 3.3Å; S621-Y644 VanDerWaalsContact CB-CZ 3.5Å; S621-Y644 VanDerWaalsContact N-CE1 3.33Å
622	G	85.5	Confident	81.9	Confident	2 Å²	2	63.9 Å²	63.9	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-56.4	-33.8	166.8	0	0	0	0	0	113.7	L625 E626 Y644 H650	G622-L625 PolarHBondContact O-N 2.75Å; G622-E626 WeakPolarHBondContact O-CG 3.47Å; G622-E626 PolarHBondContact O-N 3.04Å; G622-Y644 PolarHBondContact N-O 3.44Å; G622-H650 VanDerWaalsContact C-CE1 3.44Å; G622-H650 VanDerWaalsContact CA-ND1 3.34Å; G622-H650 WeakPolarHBondContact CA-ND1 3.43Å; G622-H650 PolarHBondContact O-CE1 3.4Å
623	E	86.5	Confident	81.9	Confident	94 Å²	94	63.9 Å²	63.9	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-72.4	-32.3	178.9	-66.7	-179.3	-134.4	0	0	113.3	S621 K627 R645	S621-E623 PolarHBondContact O-N 2.98Å; S621-E623 PolarHBondContact OG-N 3.33Å; E623-K627 WeakPolarHBondContact O-CD 3.45Å; E623-K627 WeakPolarHBondContact O-CE 3.41Å; E623-K627 VanDerWaalsContact O-CG 3.28Å; E623-K627 WeakPolarHBondContact O-CG 3.34Å; E623-K627 PolarHBondContact O-NZ 3.25Å; E623-K627 IonicContact OE2-NZ 2.68Å; E623-R645 IonicContact OE1-NH1 3.41Å; E623-R645 PolarHBondContact OE1-NH1 3.2Å
624	E	88.3	Confident	82.3	Confident	81 Å²	81	60.2 Å²	60.2	38%	0.379	32%	0.321	S	S	.	.	H	α-helix	trans	-75.2	-40.1	172	-69.6	154.6	141.1	0	0	110.4	L620 S621 E626 K627 M628	L620-E624 HydrophobicContact CD1-CB 3.68Å; L620-E624 HydrophobicContact CG-CB 4.37Å; S621-E624 WeakPolarHBondContact CB-OE2 3.35Å; S621-E624 PolarHBondContact N-OE2 3.49Å; S621-E624 PolarHBondContact O-N 2.82Å; S621-E624 WeakPolarHBondContact OG-CB 3.46Å; S621-E624 VanDerWaalsContact OG-CG 3.27Å; S621-E624 WeakPolarHBondContact OG-CG 3.33Å; S621-E624 PolarHBondContact OG-N 3.06Å; S621-E624 PolarHBondContact OG-OE2 3.45Å; E624-E626 VanDerWaalsContact C-N 3.26Å; E624-E626 PolarHBondContact O-N 2.99Å; E624-K627 PolarHBondContact O-N 3.01Å; E624-M628 WeakPolarHBondContact O-CG 3.2Å; E624-M628 PolarHBondContact O-N 3.14Å
625	L	87.4	Confident	83	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-60.3	-32.7	175.4	-171.4	76.5	0	0	0	112.8	L620 S621 G622 L633 H650 K653 I654	L620-L625 HydrophobicContact CD2-CB 4.43Å; L620-L625 HydrophobicContact CD2-CD1 3.99Å; S621-L625 WeakPolarHBondContact O-CB 3.2Å; S621-L625 PolarHBondContact O-N 3.12Å; G622-L625 PolarHBondContact O-N 2.75Å; L625-L633 HydrophobicContact CD1-CD1 3.44Å; L625-L633 VanDerWaalsContact CD1-CD1 3.44Å; L625-L633 HydrophobicContact CD1-CD2 3.57Å; L625-L633 HydrophobicContact CD1-CG 4.13Å; L625-H650 HydrophobicContact CD2-CB 3.48Å; L625-H650 VanDerWaalsContact CD2-CB 3.48Å; L625-K653 HydrophobicContact CG-CD 4.29Å; L625-K653 PolarHBondContact O-NZ 3.29Å; L625-I654 HydrophobicContact CD1-CG1 4.34Å; L625-I654 HydrophobicContact CD2-CD1 4.04Å; L625-I654 HydrophobicContact CD2-CG1 3.95Å
626	E	84.9	Confident	83.7	Confident	126 Å²	126	64.8 Å²	64.8	59%	0.589	33%	0.334	S	S	*	.	H	α-helix	trans	-69.7	-36.3	171.8	-76.9	-172.8	172.7	0	0	113	G622 E624 H650	G622-E626 WeakPolarHBondContact O-CG 3.47Å; G622-E626 PolarHBondContact O-N 3.04Å; E624-E626 VanDerWaalsContact C-N 3.26Å; E624-E626 PolarHBondContact O-N 2.99Å; E626-H650 WeakPolarHBondContact CG-NE2 3.31Å; E626-H650 IonicContact OE1-CD2 2.98Å; E626-H650 IonicContact OE1-CE1 3.94Å; E626-H650 CovalentContact OE1-NE2 1.78Å; E626-H650 IonicContact OE1-NE2 2.67Å; E626-H650 PolarHBondContact OE1-NE2 2.81Å; E626-H650 IonicContact OE2-NE2 3.78Å
627	K	86.9	Confident	84.6	Confident	150 Å²	150	60.6 Å²	60.6	65%	0.652	31%	0.305	S	S	*	.	H	α-helix	trans	-76.8	-25.8	-179.4	-65	159.5	-164.2	152.7	0	112.7	E623 E624	E623-K627 WeakPolarHBondContact O-CD 3.45Å; E623-K627 WeakPolarHBondContact O-CE 3.41Å; E623-K627 VanDerWaalsContact O-CG 3.28Å; E623-K627 WeakPolarHBondContact O-CG 3.34Å; E623-K627 PolarHBondContact O-NZ 3.25Å; E623-K627 IonicContact OE2-NZ 2.68Å; E624-K627 PolarHBondContact O-N 3.01Å
628	M	84.2	Confident	85	Confident	45 Å²	45	57.7 Å²	57.7	22%	0.222	28%	0.281	C	S	.	.	S	Bend	trans	-76.4	128.7	178.4	-72.9	179.3	-177.8	0	0	112.7	L620 E624 Q632 K653	L620-M628 HydrophobicContact CD1-CE 3.69Å; L620-M628 HydrophobicContact CD1-SD 4.3Å; L620-M628 HydrophobicContact CD2-SD 4.13Å; E624-M628 WeakPolarHBondContact O-CG 3.2Å; E624-M628 PolarHBondContact O-N 3.14Å; M628-Q632 HydrophobicContact CB-CB 4.37Å; M628-K653 PolarHBondContact O-NZ 3.42Å
629	D	83.1	Confident	85.1	Confident	101 Å²	101	64 Å²	64	54%	0.54	31%	0.307	S	S	.	.			trans	-69.2	160.3	165.5	-178.2	38.5	0	0	0	111.4	V631 Q632 L633	D629-V631 VanDerWaalsContact C-N 3.34Å; D629-V631 PolarHBondContact O-N 3.12Å; D629-Q632 HydrophobicContact CB-CG 4.41Å; D629-Q632 WeakPolarHBondContact O-CB 3.37Å; D629-Q632 PolarHBondContact O-N 3.39Å; D629-L633 PolarHBondContact O-N 3.4Å
630	Q	78.8	Confident	85.1	Confident	69 Å²	69	63.5 Å²	63.5	32%	0.322	30%	0.302	S	S	.	.	H	α-helix	trans	-55.3	-45.8	-176.2	176.6	171.8	-21.3	0	0	112.3	Q632 L633 E634	Q630-Q632 PolarHBondContact O-N 3.33Å; Q630-L633 PolarHBondContact O-N 3.28Å; Q630-E634 HydrophobicContact CG-CG 4.38Å; Q630-E634 VanDerWaalsContact CG-OE1 3.26Å; Q630-E634 WeakPolarHBondContact CG-OE1 3.39Å; Q630-E634 PolarHBondContact NE2-OE1 3.16Å; Q630-E634 WeakPolarHBondContact O-CG 3.21Å; Q630-E634 PolarHBondContact O-N 3.34Å
631	V	78.9	Confident	85.1	Confident	71 Å²	71	64.8 Å²	64.8	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-68	-25.5	-179	-177.5	0	0	0	0	112.3	D629 R635	D629-V631 VanDerWaalsContact C-N 3.34Å; D629-V631 PolarHBondContact O-N 3.12Å; V631-R635 WeakPolarHBondContact O-CG 3.44Å
632	Q	83.7	Confident	85.2	Confident	105 Å²	105	64.3 Å²	64.3	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-75.5	-44.3	173.1	-63.8	175.7	-28.7	0	0	110.6	M628 D629 Q630 R635	M628-Q632 HydrophobicContact CB-CB 4.37Å; D629-Q632 HydrophobicContact CB-CG 4.41Å; D629-Q632 WeakPolarHBondContact O-CB 3.37Å; D629-Q632 PolarHBondContact O-N 3.39Å; Q630-Q632 PolarHBondContact O-N 3.33Å; Q632-R635 PolarHBondContact O-N 2.71Å
633	L	84.1	Confident	85.6	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-47.3	177	179	56.4	0	0	0	111.3	L620 L625 D629 Q630 R635 V636 I637 K653 T657	L620-L633 HydrophobicContact CD2-CD1 4.32Å; L625-L633 HydrophobicContact CD1-CD1 3.44Å; L625-L633 VanDerWaalsContact CD1-CD1 3.44Å; L625-L633 HydrophobicContact CD1-CD2 3.57Å; L625-L633 HydrophobicContact CD1-CG 4.13Å; D629-L633 PolarHBondContact O-N 3.4Å; Q630-L633 PolarHBondContact O-N 3.28Å; L633-R635 VanDerWaalsContact C-N 3.25Å; L633-R635 PolarHBondContact O-N 3.03Å; L633-V636 PolarHBondContact O-N 3.31Å; L633-I637 HydrophobicContact CD1-CB 4.08Å; L633-I637 HydrophobicContact CD1-CD1 4.12Å; L633-I637 HydrophobicContact CD1-CG1 4.2Å; L633-I637 HydrophobicContact CD2-CD1 4.36Å; L633-I637 HydrophobicContact CG-CB 4.38Å; L633-I637 HydrophobicContact CG-CD1 4.07Å; L633-I637 VanDerWaalsContact O-CB 3.27Å; L633-I637 WeakPolarHBondContact O-CB 3.44Å; L633-I637 PolarHBondContact O-N 2.99Å; L633-K653 HydrophobicContact CD2-CD 4.26Å; L633-K653 HydrophobicContact CD2-CG 4Å; L633-T657 HydrophobicContact CD2-CG2 4.21Å; L633-T657 HydrophobicContact CG-CG2 4.06Å
634	E	80.8	Confident	85.7	Confident	43 Å²	43	61.7 Å²	61.7	20%	0.201	29%	0.292	C	S	.	.	H	α-helix	trans	-50.1	-44.1	176.8	-75.2	168.4	-174.5	0	0	112.2	Q630 V636 T657 F693	Q630-E634 HydrophobicContact CG-CG 4.38Å; Q630-E634 VanDerWaalsContact CG-OE1 3.26Å; Q630-E634 WeakPolarHBondContact CG-OE1 3.39Å; Q630-E634 PolarHBondContact NE2-OE1 3.16Å; Q630-E634 WeakPolarHBondContact O-CG 3.21Å; Q630-E634 PolarHBondContact O-N 3.34Å; E634-V636 VanDerWaalsContact C-N 3.26Å; E634-V636 PolarHBondContact O-N 3.06Å; E634-T657 HydrophobicContact CB-CG2 4.38Å; E634-T657 HydrophobicContact CG-CG2 3.45Å; E634-T657 VanDerWaalsContact CG-CG2 3.45Å; E634-F693 HydrophobicContact CB-CD2 4.46Å; E634-F693 HydrophobicContact CB-CE2 4.45Å; E634-F693 WeakPolarHBondContact O-CE2 3.43Å; E634-F693 WeakPolarHBondContact O-CZ 3.24Å
635	R	81.9	Confident	85.6	Confident	177 Å²	177	64.2 Å²	64.2	67%	0.668	30%	0.297	S	S	*	.	H	α-helix	trans	-66.7	-23.9	179.7	-66.5	171.1	-173	-169.3	1.1	114.4	V631 Q632 L633	V631-R635 WeakPolarHBondContact O-CG 3.44Å; Q632-R635 PolarHBondContact O-N 2.71Å; L633-R635 VanDerWaalsContact C-N 3.25Å; L633-R635 PolarHBondContact O-N 3.03Å
636	V	85.4	Confident	85.5	Confident	55 Å²	55	64.7 Å²	64.7	33%	0.333	30%	0.302	S	S	.	.	H	α-helix	trans	-106.2	-30	-172.5	177	0	0	0	0	111.9	L633 E634 D638 H639 V640	L633-V636 PolarHBondContact O-N 3.31Å; E634-V636 VanDerWaalsContact C-N 3.26Å; E634-V636 PolarHBondContact O-N 3.06Å; V636-D638 VanDerWaalsContact C-N 3.25Å; V636-D638 PolarHBondContact O-N 2.73Å; V636-D638 VanDerWaalsContact O-N 3.13Å; V636-H639 PolarHBondContact O-N 2.96Å; V636-H639 VanDerWaalsContact O-N 3.12Å; V636-V640 HydrophobicContact CG1-CG2 3.72Å; V636-V640 PolarHBondContact O-N 2.75Å
637	I	87.1	Confident	85.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-26.5	-168.2	-157.6	168.3	0	0	0	113.9	K593 L633 F643 I654 T657 L658 F693	K593-I637 PolarHBondContact NZ-O 2.99Å; L633-I637 HydrophobicContact CD1-CB 4.08Å; L633-I637 HydrophobicContact CD1-CD1 4.12Å; L633-I637 HydrophobicContact CD1-CG1 4.2Å; L633-I637 HydrophobicContact CD2-CD1 4.36Å; L633-I637 HydrophobicContact CG-CB 4.38Å; L633-I637 HydrophobicContact CG-CD1 4.07Å; L633-I637 VanDerWaalsContact O-CB 3.27Å; L633-I637 WeakPolarHBondContact O-CB 3.44Å; L633-I637 PolarHBondContact O-N 2.99Å; I637-F643 HydrophobicContact CG1-CZ 4.04Å; I637-I654 HydrophobicContact CD1-CG2 4.3Å; I637-T657 HydrophobicContact CD1-CG2 3.84Å; I637-T657 HydrophobicContact CG2-CG2 4.33Å; I637-L658 HydrophobicContact CD1-CD1 4.42Å; I637-L658 HydrophobicContact CD1-CD2 4.09Å; I637-L658 HydrophobicContact CD1-CG 3.75Å; I637-L658 HydrophobicContact CG1-CD2 4.01Å; I637-L658 HydrophobicContact CG1-CG 4.16Å; I637-L658 HydrophobicContact CG2-CD2 4.02Å; I637-F693 HydrophobicContact CG2-CE1 3.98Å; I637-F693 HydrophobicContact CG2-CZ 3.85Å
638	D	82.9	Confident	85	Confident	45 Å²	45	56.3 Å²	56.3	24%	0.241	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-37.8	178.6	-164.5	55.4	0	0	0	112.3	K591 K593 V636 F693	K591-D638 IonicContact NZ-OD1 3.97Å; K591-D638 PolarHBondContact NZ-OD1 2.79Å; K591-D638 IonicContact NZ-OD2 3.49Å; K591-D638 PolarHBondContact NZ-OD2 3.18Å; K593-D638 PolarHBondContact NZ-O 2.95Å; V636-D638 VanDerWaalsContact C-N 3.25Å; V636-D638 PolarHBondContact O-N 2.73Å; V636-D638 VanDerWaalsContact O-N 3.13Å; D638-F693 HydrophobicContact CB-CZ 4.35Å
639	H	85	Confident	84.9	Confident	143 Å²	143	63.1 Å²	63.1	66%	0.662	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-30	-179.6	-62.1	-64.5	0	0	0	113.5	V636 I641	V636-H639 PolarHBondContact O-N 2.96Å; V636-H639 VanDerWaalsContact O-N 3.12Å; H639-I641 PolarHBondContact O-N 3.43Å
640	V	89.6	Confident	85.2	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.03	28%	0.277	C	S	.	.			trans	-69.7	128.5	179.2	176.7	0	0	0	0	111	K593 L620 V636 V642 F643	K593-V640 PolarHBondContact NZ-O 3.5Å; L620-V640 HydrophobicContact CB-CG1 3.93Å; L620-V640 HydrophobicContact CB-CG2 4.15Å; V636-V640 HydrophobicContact CG1-CG2 3.72Å; V636-V640 PolarHBondContact O-N 2.75Å; V640-V642 WeakPolarHBondContact CG1-O 3.32Å; V640-F643 HydrophobicContact CB-CE1 4.24Å; V640-F643 HydrophobicContact CB-CE2 4.38Å; V640-F643 HydrophobicContact CB-CZ 3.87Å; V640-F643 HydrophobicContact CG1-CD1 4.01Å; V640-F643 HydrophobicContact CG1-CD2 4.11Å; V640-F643 HydrophobicContact CG1-CE1 3.64Å; V640-F643 HydrophobicContact CG1-CE2 3.74Å; V640-F643 HydrophobicContact CG1-CG 4.24Å; V640-F643 HydrophobicContact CG1-CZ 3.48Å; V640-F643 VanDerWaalsContact CG1-CZ 3.48Å
641	I	92	Very high	85.6	Confident	37 Å²	37	56.3 Å²	56.3	19%	0.19	26%	0.262	C	S	.	.			trans	-106.1	-28.7	177.9	-64	170.5	0	0	0	111	K593 M594 M612 T614 G618 H639	K593-I641 CarbonylContact C-O 3.54Å; K593-I641 VanDerWaalsContact CA-O 3.29Å; K593-I641 WeakPolarHBondContact CA-O 3.38Å; M594-I641 PolarHBondContact N-O 2.88Å; M612-I641 HydrophobicContact CB-CG2 4.14Å; M612-I641 HydrophobicContact SD-CG2 4.38Å; T614-I641 HydrophobicContact CG2-CB 4.27Å; T614-I641 WeakPolarHBondContact OG1-CB 3.1Å; T614-I641 WeakPolarHBondContact OG1-CD1 3.49Å; T614-I641 WeakPolarHBondContact OG1-CG2 3.5Å; G618-I641 PolarHBondContact O-N 2.89Å; H639-I641 PolarHBondContact O-N 3.43Å
642	V	93.1	Very high	86	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123.4	-176.1	-178.7	0	0	0	0	111.2	M594 A603 A607 T614 G618 A619 L620 V640	M594-V642 WeakPolarHBondContact O-CA 3.42Å; A603-V642 HydrophobicContact CB-CG1 3.7Å; A607-V642 HydrophobicContact CB-CG2 3.74Å; T614-V642 HydrophobicContact CG2-CG2 4.14Å; G618-V642 PolarHBondContact O-N 3.4Å; G618-V642 VanDerWaalsContact O-N 3.16Å; A619-V642 CarbonylContact C-O 3.51Å; A619-V642 WeakPolarHBondContact CA-O 3.46Å; A619-V642 HydrophobicContact CB-CB 4.26Å; L620-V642 PolarHBondContact N-O 2.94Å; V640-V642 WeakPolarHBondContact CG1-O 3.32Å
643	F	92.9	Very high	86.2	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	126.6	169.5	-59.2	-93.8	0	0	0	109.4	K593 M594 I595 T596 L620 I637 V640 I654	K593-F643 HydrophobicContact CD-CE2 4.43Å; M594-F643 PolarHBondContact O-N 2.93Å; I595-F643 CarbonylContact C-O 3.55Å; I595-F643 WeakPolarHBondContact CA-O 3.36Å; I595-F643 HydrophobicContact CB-CB 4.43Å; I595-F643 HydrophobicContact CG1-CB 4.26Å; I595-F643 HydrophobicContact CG1-CD2 3.98Å; I595-F643 HydrophobicContact CG1-CG 4.45Å; I595-F643 HydrophobicContact CG2-CB 4.13Å; T596-F643 PolarHBondContact N-O 3.17Å; L620-F643 HydrophobicContact CB-CD1 4.13Å; L620-F643 HydrophobicContact CB-CE1 4.35Å; L620-F643 HydrophobicContact CD2-CD1 4.27Å; L620-F643 HydrophobicContact CD2-CE1 4.01Å; L620-F643 WeakPolarHBondContact O-CA 3.5Å; I637-F643 HydrophobicContact CG1-CZ 4.04Å; V640-F643 HydrophobicContact CB-CE1 4.24Å; V640-F643 HydrophobicContact CB-CE2 4.38Å; V640-F643 HydrophobicContact CB-CZ 3.87Å; V640-F643 HydrophobicContact CG1-CD1 4.01Å; V640-F643 HydrophobicContact CG1-CD2 4.11Å; V640-F643 HydrophobicContact CG1-CE1 3.64Å; V640-F643 HydrophobicContact CG1-CE2 3.74Å; V640-F643 HydrophobicContact CG1-CG 4.24Å; V640-F643 HydrophobicContact CG1-CZ 3.48Å; V640-F643 VanDerWaalsContact CG1-CZ 3.48Å; F643-I654 HydrophobicContact CB-CD1 3.95Å; F643-I654 HydrophobicContact CD1-CD1 3.51Å; F643-I654 HydrophobicContact CD1-CG1 4.03Å; F643-I654 HydrophobicContact CD2-CD1 4Å; F643-I654 HydrophobicContact CE1-CD1 3.93Å; F643-I654 HydrophobicContact CE1-CG1 3.94Å; F643-I654 HydrophobicContact CE2-CD1 4.39Å; F643-I654 HydrophobicContact CE2-CG2 4.12Å; F643-I654 HydrophobicContact CG-CD1 3.54Å; F643-I654 HydrophobicContact CG-CG1 4.42Å; F643-I654 HydrophobicContact CZ-CD1 4.36Å; F643-I654 HydrophobicContact CZ-CG1 4.27Å; F643-I654 HydrophobicContact CZ-CG2 4.17Å
644	Y	89.5	Confident	86.5	Confident	37 Å²	37	52.1 Å²	52.1	15%	0.145	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	156.9	-174.8	71.6	-82.7	0	0	0	112	T596 L600 A619 L620 S621 G622 A646	T596-Y644 CarbonylContact O-C 3.52Å; T596-Y644 WeakPolarHBondContact O-CA 3.32Å; L600-Y644 HydrophobicContact CB-CD2 3.96Å; L600-Y644 HydrophobicContact CB-CE1 4.38Å; L600-Y644 HydrophobicContact CB-CE2 3.76Å; L600-Y644 HydrophobicContact CB-CG 4.35Å; L600-Y644 HydrophobicContact CD1-CD1 3.84Å; L600-Y644 HydrophobicContact CD1-CE1 3.64Å; L600-Y644 HydrophobicContact CD1-CG 4.38Å; L600-Y644 HydrophobicContact CG-CE1 4.45Å; A619-Y644 HydrophobicContact CB-CD1 4.33Å; A619-Y644 HydrophobicContact CB-CE1 4.31Å; L620-Y644 VanDerWaalsContact C-CD1 3.48Å; L620-Y644 VanDerWaalsContact O-CD1 3.25Å; L620-Y644 WeakPolarHBondContact O-CD1 3.37Å; L620-Y644 PolarHBondContact O-N 3.44Å; S621-Y644 CarbonylContact C-O 3.5Å; S621-Y644 WeakPolarHBondContact CA-O 3.3Å; S621-Y644 VanDerWaalsContact CB-CZ 3.5Å; S621-Y644 VanDerWaalsContact N-CE1 3.33Å; G622-Y644 PolarHBondContact N-O 3.44Å; Y644-A646 PolarHBondContact O-N 3.22Å
645	R	85.7	Confident	86.9	Confident	133 Å²	133	50 Å²	50	50%	0.502	23%	0.228	S	C	.	.	S	Bend	trans	48.5	35.9	-166.3	-63.3	-177.2	178.9	177.5	2.3	114	T596 G597 D598 E623	T596-R645 PolarHBondContact O-N 3.34Å; G597-R645 WeakPolarHBondContact O-CA 3.29Å; D598-R645 WeakPolarHBondContact O-CG 3.37Å; D598-R645 PolarHBondContact O-N 3.21Å; E623-R645 IonicContact OE1-NH1 3.41Å; E623-R645 PolarHBondContact OE1-NH1 3.2Å
646	A	85.2	Confident	87.1	Confident	13 Å²	13	45.1 Å²	45.1	11%	0.107	21%	0.212	C	C	.	.			trans	-82.2	123.5	-175.6	0	0	0	0	0	112.6	I595 T596 Y644 H650	I595-A646 HydrophobicContact CG2-CB 3.43Å; I595-A646 VanDerWaalsContact CG2-CB 3.43Å; T596-A646 WeakPolarHBondContact O-CB 3.44Å; T596-A646 PolarHBondContact O-N 3.44Å; Y644-A646 PolarHBondContact O-N 3.22Å; A646-H650 HydrophobicContact CB-CB 4.12Å
647	S	81.9	Confident	87.2	Confident	35 Å²	35	42.8 Å²	42.8	25%	0.245	20%	0.198	C	C	.	.			trans	-79.2	168.2	172.7	79.2	0	0	0	0	112.7	R649 H650 K651	S647-R649 PolarHBondContact O-N 3.49Å; S647-R649 PolarHBondContact OG-N 2.81Å; S647-H650 PolarHBondContact N-ND1 2.94Å; S647-H650 WeakPolarHBondContact O-CA 3.27Å; S647-H650 VanDerWaalsContact O-CB 3.32Å; S647-H650 WeakPolarHBondContact O-CB 3.39Å; S647-H650 PolarHBondContact O-N 3.13Å; S647-H650 PolarHBondContact OG-CD2 2.74Å; S647-H650 PolarHBondContact OG-N 3.16Å; S647-H650 PolarHBondContact OG-ND1 3.14Å; S647-K651 PolarHBondContact O-N 3.4Å
648	P	78.7	Confident	87.2	Confident	64 Å²	64	42.8 Å²	42.8	42%	0.416	20%	0.198	S	C	.	.	H	α-helix	trans	-54.5	-35	172.2	-25.2	33.7	0	0	0	113.5	H650 L652 N706	P648-H650 VanDerWaalsContact C-N 3.34Å; P648-L652 PolarHBondContact O-N 2.97Å; P648-L652 VanDerWaalsContact O-N 3.15Å; P648-N706 HydrophobicContact CG-CB 4.01Å
649	R	82.9	Confident	86.9	Confident	189 Å²	189	42 Å²	42	71%	0.713	20%	0.195	S	C	*	.	H	α-helix	trans	-71.3	-31.1	176.7	-64.6	-179.7	178.7	172.2	0	112	S647 K653	S647-R649 PolarHBondContact O-N 3.49Å; S647-R649 PolarHBondContact OG-N 2.81Å; R649-K653 WeakPolarHBondContact O-CB 3.45Å; R649-K653 PolarHBondContact O-N 3.13Å
650	H	88.2	Confident	85.8	Confident	22 Å²	22	36.2 Å²	36.2	10%	0.102	17%	0.171	C	C	.	.	H	α-helix	trans	-71.2	-45.4	176.3	-58.6	162.7	0	0	0	110.7	G622 L625 E626 A646 S647 P648 L652 K653 I654	G622-H650 VanDerWaalsContact C-CE1 3.44Å; G622-H650 VanDerWaalsContact CA-ND1 3.34Å; G622-H650 WeakPolarHBondContact CA-ND1 3.43Å; G622-H650 PolarHBondContact O-CE1 3.4Å; L625-H650 HydrophobicContact CD2-CB 3.48Å; L625-H650 VanDerWaalsContact CD2-CB 3.48Å; E626-H650 WeakPolarHBondContact CG-NE2 3.31Å; E626-H650 IonicContact OE1-CD2 2.98Å; E626-H650 IonicContact OE1-CE1 3.94Å; E626-H650 CovalentContact OE1-NE2 1.78Å; E626-H650 IonicContact OE1-NE2 2.67Å; E626-H650 PolarHBondContact OE1-NE2 2.81Å; E626-H650 IonicContact OE2-NE2 3.78Å; A646-H650 HydrophobicContact CB-CB 4.12Å; S647-H650 PolarHBondContact N-ND1 2.94Å; S647-H650 WeakPolarHBondContact O-CA 3.27Å; S647-H650 VanDerWaalsContact O-CB 3.32Å; S647-H650 WeakPolarHBondContact O-CB 3.39Å; S647-H650 PolarHBondContact O-N 3.13Å; S647-H650 PolarHBondContact OG-CD2 2.74Å; S647-H650 PolarHBondContact OG-N 3.16Å; S647-H650 PolarHBondContact OG-ND1 3.14Å; P648-H650 VanDerWaalsContact C-N 3.34Å; H650-L652 VanDerWaalsContact C-N 3.31Å; H650-L652 PolarHBondContact O-N 2.91Å; H650-K653 PolarHBondContact O-N 3.45Å; H650-K653 VanDerWaalsContact O-N 3.14Å; H650-I654 WeakPolarHBondContact O-CD1 3.34Å; H650-I654 VanDerWaalsContact O-CG1 3.28Å; H650-I654 WeakPolarHBondContact O-CG1 3.45Å; H650-I654 PolarHBondContact O-N 2.89Å
651	K	89.1	Confident	84.1	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.017	19%	0.19	C	C	.	.	H	α-helix	trans	-51.1	-49.9	170.5	-68.8	174.9	172.4	-167.5	0	111.1	D358 I595 S647 I654 V655 M700 N706 D707 A710	D358-K651 WeakPolarHBondContact OD1-CE 3.41Å; D358-K651 IonicContact OD1-NZ 3.19Å; D358-K651 PolarHBondContact OD1-NZ 3.43Å; I595-K651 HydrophobicContact CG2-CG 3.82Å; S647-K651 PolarHBondContact O-N 3.4Å; K651-I654 PolarHBondContact O-N 3.26Å; K651-V655 WeakPolarHBondContact O-CG2 3.29Å; K651-V655 PolarHBondContact O-N 2.86Å; K651-V655 VanDerWaalsContact O-N 3.09Å; K651-M700 HydrophobicContact CB-CE 4.35Å; K651-M700 HydrophobicContact CD-CE 4.17Å; K651-M700 HydrophobicContact CG-CE 4.47Å; K651-N706 PolarHBondContact NZ-ND2 3.18Å; K651-D707 VanDerWaalsContact CD-OD1 3.3Å; K651-D707 WeakPolarHBondContact CD-OD1 3.28Å; K651-D707 WeakPolarHBondContact CE-OD1 3.44Å; K651-D707 IonicContact NZ-OD1 2.7Å; K651-D707 PolarHBondContact NZ-OD1 3.14Å; K651-D707 IonicContact NZ-OD2 2.81Å; K651-A710 HydrophobicContact CB-CB 3.91Å
652	L	87.2	Confident	81.8	Confident	29 Å²	29	43.3 Å²	43.3	15%	0.152	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-42.1	177.1	-173.6	64	0	0	0	113.3	P648 H650 V655 K656 V709 A710 K713	P648-L652 PolarHBondContact O-N 2.97Å; P648-L652 VanDerWaalsContact O-N 3.15Å; H650-L652 VanDerWaalsContact C-N 3.31Å; H650-L652 PolarHBondContact O-N 2.91Å; L652-V655 PolarHBondContact O-N 3.18Å; L652-K656 HydrophobicContact CD1-CD 4.5Å; L652-K656 HydrophobicContact CD1-CG 4.34Å; L652-K656 HydrophobicContact CG-CD 4.35Å; L652-K656 HydrophobicContact CG-CG 4.49Å; L652-K656 WeakPolarHBondContact O-CB 3.32Å; L652-K656 WeakPolarHBondContact O-CG 3.15Å; L652-K656 PolarHBondContact O-N 3.24Å; L652-V709 HydrophobicContact CD1-CG1 4.23Å; L652-V709 HydrophobicContact CD2-CG1 3.92Å; L652-A710 HydrophobicContact CB-CB 4.49Å; L652-K713 HydrophobicContact CD1-CB 3.61Å; L652-K713 HydrophobicContact CD1-CG 3.83Å
653	K	87.2	Confident	79.3	Confident	59 Å²	59	51.8 Å²	51.8	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-62.1	-44.8	177.4	-172	175.8	178.1	-177	0	111.3	L625 M628 L633 R649 H650 K656 T657	L625-K653 HydrophobicContact CG-CD 4.29Å; L625-K653 PolarHBondContact O-NZ 3.29Å; M628-K653 PolarHBondContact O-NZ 3.42Å; L633-K653 HydrophobicContact CD2-CD 4.26Å; L633-K653 HydrophobicContact CD2-CG 4Å; R649-K653 WeakPolarHBondContact O-CB 3.45Å; R649-K653 PolarHBondContact O-N 3.13Å; H650-K653 PolarHBondContact O-N 3.45Å; H650-K653 VanDerWaalsContact O-N 3.14Å; K653-K656 PolarHBondContact O-N 2.94Å; K653-T657 PolarHBondContact O-N 3.21Å; K653-T657 PolarHBondContact O-OG1 2.95Å
654	I	90	Very high	76.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-50.3	177.4	-67.5	159.1	0	0	0	110.9	I595 L625 I637 F643 H650 K651 T657 L658	I595-I654 HydrophobicContact CD1-CB 4.42Å; I595-I654 HydrophobicContact CD1-CD1 3.98Å; I595-I654 HydrophobicContact CD1-CG2 4.03Å; I595-I654 HydrophobicContact CG1-CD1 4.3Å; I595-I654 HydrophobicContact CG2-CD1 4.4Å; L625-I654 HydrophobicContact CD1-CG1 4.34Å; L625-I654 HydrophobicContact CD2-CD1 4.04Å; L625-I654 HydrophobicContact CD2-CG1 3.95Å; I637-I654 HydrophobicContact CD1-CG2 4.3Å; F643-I654 HydrophobicContact CB-CD1 3.95Å; F643-I654 HydrophobicContact CD1-CD1 3.51Å; F643-I654 HydrophobicContact CD1-CG1 4.03Å; F643-I654 HydrophobicContact CD2-CD1 4Å; F643-I654 HydrophobicContact CE1-CD1 3.93Å; F643-I654 HydrophobicContact CE1-CG1 3.94Å; F643-I654 HydrophobicContact CE2-CD1 4.39Å; F643-I654 HydrophobicContact CE2-CG2 4.12Å; F643-I654 HydrophobicContact CG-CD1 3.54Å; F643-I654 HydrophobicContact CG-CG1 4.42Å; F643-I654 HydrophobicContact CZ-CD1 4.36Å; F643-I654 HydrophobicContact CZ-CG1 4.27Å; F643-I654 HydrophobicContact CZ-CG2 4.17Å; H650-I654 WeakPolarHBondContact O-CD1 3.34Å; H650-I654 VanDerWaalsContact O-CG1 3.28Å; H650-I654 WeakPolarHBondContact O-CG1 3.45Å; H650-I654 PolarHBondContact O-N 2.89Å; K651-I654 PolarHBondContact O-N 3.26Å; I654-T657 PolarHBondContact O-N 3.1Å; I654-L658 HydrophobicContact CG2-CD1 3.99Å; I654-L658 WeakPolarHBondContact O-CG 3.27Å; I654-L658 PolarHBondContact O-N 2.93Å; I654-L658 VanDerWaalsContact O-N 3.08Å
655	V	89.5	Confident	74.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-47.8	179.2	171.6	0	0	0	0	111.3	K651 L652 T657 L658 S659 V698 M700 A710 A714	K651-V655 WeakPolarHBondContact O-CG2 3.29Å; K651-V655 PolarHBondContact O-N 2.86Å; K651-V655 VanDerWaalsContact O-N 3.09Å; L652-V655 PolarHBondContact O-N 3.18Å; V655-T657 PolarHBondContact O-N 3.45Å; V655-L658 PolarHBondContact O-N 2.95Å; V655-S659 PolarHBondContact O-N 2.93Å; V655-V698 HydrophobicContact CG1-CG1 4.45Å; V655-V698 HydrophobicContact CG2-CG1 4.49Å; V655-M700 HydrophobicContact CG2-SD 3.84Å; V655-A710 HydrophobicContact CG2-CB 4.37Å; V655-A714 HydrophobicContact CG1-CB 3.97Å
656	K	86.4	Confident	72.1	Confident	73 Å²	73	55.5 Å²	55.5	32%	0.317	29%	0.285	S	S	.	.	H	α-helix	trans	-58.5	-45.2	178.1	-73.4	-170	-176.2	-167	0	111.9	E259 L652 K653 L658 C660 K713	E259-K656 VanDerWaalsContact CD-NZ 3.32Å; E259-K656 VanDerWaalsContact OE1-CE 3.32Å; E259-K656 WeakPolarHBondContact OE1-CE 3.49Å; E259-K656 IonicContact OE1-NZ 2.68Å; E259-K656 PolarHBondContact OE1-NZ 2.88Å; E259-K656 WeakPolarHBondContact OE2-CE 3.42Å; E259-K656 IonicContact OE2-NZ 2.75Å; E259-K656 PolarHBondContact OE2-NZ 3.33Å; L652-K656 HydrophobicContact CD1-CD 4.5Å; L652-K656 HydrophobicContact CD1-CG 4.34Å; L652-K656 HydrophobicContact CG-CD 4.35Å; L652-K656 HydrophobicContact CG-CG 4.49Å; L652-K656 WeakPolarHBondContact O-CB 3.32Å; L652-K656 WeakPolarHBondContact O-CG 3.15Å; L652-K656 PolarHBondContact O-N 3.24Å; K653-K656 PolarHBondContact O-N 2.94Å; K656-L658 VanDerWaalsContact C-N 3.33Å; K656-L658 PolarHBondContact O-N 2.88Å; K656-C660 WeakPolarHBondContact O-CB 3.49Å; K656-C660 PolarHBondContact O-N 2.87Å; K656-C660 VanDerWaalsContact O-N 3.1Å; K656-C660 PolarHBondContact O-SG 3.42Å; K656-K713 HydrophobicContact CG-CG 3.9Å
657	T	86.6	Confident	70	Confident	6 Å²	6	62.6 Å²	62.6	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-67.3	-30.1	179.5	-60.2	0	0	0	0	113.4	L633 E634 I637 K653 I654 V655	L633-T657 HydrophobicContact CD2-CG2 4.21Å; L633-T657 HydrophobicContact CG-CG2 4.06Å; E634-T657 HydrophobicContact CB-CG2 4.38Å; E634-T657 HydrophobicContact CG-CG2 3.45Å; E634-T657 VanDerWaalsContact CG-CG2 3.45Å; I637-T657 HydrophobicContact CD1-CG2 3.84Å; I637-T657 HydrophobicContact CG2-CG2 4.33Å; K653-T657 PolarHBondContact O-N 3.21Å; K653-T657 PolarHBondContact O-OG1 2.95Å; I654-T657 PolarHBondContact O-N 3.1Å; V655-T657 PolarHBondContact O-N 3.45Å
658	L	87	Confident	68.3	Low	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-77.5	-41	175.8	-72.5	169.2	0	0	0	113.3	V354 C356 K593 I637 I654 V655 K656 C660 F696 V698	V354-L658 HydrophobicContact CG1-CD1 4.19Å; C356-L658 VanDerWaalsContact SG-CD1 3.57Å; K593-L658 HydrophobicContact CD-CD1 4.29Å; I637-L658 HydrophobicContact CD1-CD1 4.42Å; I637-L658 HydrophobicContact CD1-CD2 4.09Å; I637-L658 HydrophobicContact CD1-CG 3.75Å; I637-L658 HydrophobicContact CG1-CD2 4.01Å; I637-L658 HydrophobicContact CG1-CG 4.16Å; I637-L658 HydrophobicContact CG2-CD2 4.02Å; I654-L658 HydrophobicContact CG2-CD1 3.99Å; I654-L658 WeakPolarHBondContact O-CG 3.27Å; I654-L658 PolarHBondContact O-N 2.93Å; I654-L658 VanDerWaalsContact O-N 3.08Å; V655-L658 PolarHBondContact O-N 2.95Å; K656-L658 VanDerWaalsContact C-N 3.33Å; K656-L658 PolarHBondContact O-N 2.88Å; L658-C660 VanDerWaalsContact C-N 3.27Å; L658-C660 PolarHBondContact O-N 3.44Å; L658-F696 HydrophobicContact CD2-CD2 4.41Å; L658-F696 PolarHBondContact O-N 3.27Å; L658-F696 VanDerWaalsContact O-N 3.11Å; L658-V698 HydrophobicContact CB-CG2 3.42Å; L658-V698 VanDerWaalsContact CB-CG2 3.42Å
659	S	77	Confident	66.8	Low	28 Å²	28	64.7 Å²	64.7	20%	0.196	32%	0.317	C	S	.	.	H	α-helix	trans	-80.4	-0.8	177.5	-63.5	0	0	0	0	114	V655 E661 V698 D715	V655-S659 PolarHBondContact O-N 2.93Å; S659-E661 PolarHBondContact O-N 3.26Å; S659-V698 WeakPolarHBondContact OG-CB 3.49Å; S659-V698 WeakPolarHBondContact OG-CG2 3.34Å; S659-D715 PolarHBondContact OG-OD2 3.35Å
660	C	62.8	Low	65.2	Low	22 Å²	22	62.1 Å²	62.1	15%	0.149	31%	0.312	C	S	.	.			trans	-63.2	99	-170.9	-111.4	0	0	0	0	113.6	K656 L658 D662	K656-C660 WeakPolarHBondContact O-CB 3.49Å; K656-C660 PolarHBondContact O-N 2.87Å; K656-C660 VanDerWaalsContact O-N 3.1Å; K656-C660 PolarHBondContact O-SG 3.42Å; L658-C660 VanDerWaalsContact C-N 3.27Å; L658-C660 PolarHBondContact O-N 3.44Å; C660-D662 VanDerWaalsContact C-N 3.29Å
661	E	52.7	Low	63.5	Low	90 Å²	90	63.2 Å²	63.2	42%	0.421	32%	0.322	S	S	.	.			trans	-91.2	9.1	151.2	-62.5	-160.4	111.6	0	0	111.6	K268 S659 Y663 R826	K268-E661 IonicContact NZ-OE2 3.16Å; K268-E661 PolarHBondContact NZ-OE2 2.79Å; S659-E661 PolarHBondContact O-N 3.26Å; E661-Y663 PolarHBondContact O-N 2.94Å; E661-R826 IonicContact OE1-NE 3.91Å; E661-R826 IonicContact OE1-NH2 2.72Å
662	D	43.7	Very low	61.7	Low	101 Å²	101	66 Å²	66	54%	0.54	34%	0.336	S	S	.	.			trans	-74.9	81.4	-164.5	-81.2	-33.6	0	0	0	115	C660 I664	C660-D662 VanDerWaalsContact C-N 3.29Å; D662-I664 VanDerWaalsContact C-N 3.3Å; D662-I664 PolarHBondContact O-N 3.18Å
663	Y	41.4	Very low	60.2	Low	179 Å²	179	66.5 Å²	66.5	70%	0.702	34%	0.341	S	S	*	.	S	Bend	trans	60.3	-31.9	139.1	-73.2	-81.3	0	0	0	122	E661 A665 S666 F667	E661-Y663 PolarHBondContact O-N 2.94Å; Y663-A665 PolarHBondContact O-N 2.97Å; Y663-S666 PolarHBondContact O-N 2.95Å; Y663-S666 VanDerWaalsContact O-N 3.14Å; Y663-F667 PolarHBondContact O-N 2.89Å
664	I	38	Very low	58.7	Low	121 Å²	121	72 Å²	72	62%	0.621	36%	0.364	S	S	*	.	H	α-helix	trans	-63.9	-42.6	-170.1	-61.9	176.5	0	0	0	111.7	D662 T668	D662-I664 VanDerWaalsContact C-N 3.3Å; D662-I664 PolarHBondContact O-N 3.18Å; I664-T668 PolarHBondContact O-OG1 3.11Å
665	A	38.7	Very low	57.3	Low	65 Å²	65	77.8 Å²	77.8	54%	0.537	39%	0.394	S	S	.	.	H	α-helix	trans	-60.3	-49.9	173.3	0	0	0	0	0	111.1	Y663 Y669	Y663-A665 PolarHBondContact O-N 2.97Å; A665-Y669 WeakPolarHBondContact O-CB 3.38Å; A665-Y669 PolarHBondContact O-N 3.42Å
666	S	40.9	Very low	55.9	Low	66 Å²	66	83.2 Å²	83.2	46%	0.462	42%	0.418	S	S	.	.	H	α-helix	trans	-65.8	-42.6	-175.8	-79.2	0	0	0	0	113.9	Y663 T668 Y669 F670	Y663-S666 PolarHBondContact O-N 2.95Å; Y663-S666 VanDerWaalsContact O-N 3.14Å; S666-T668 VanDerWaalsContact C-N 3.33Å; S666-T668 PolarHBondContact O-N 2.91Å; S666-Y669 PolarHBondContact O-N 3.21Å; S666-F670 WeakPolarHBondContact O-CB 3.32Å; S666-F670 PolarHBondContact O-N 2.91Å
667	F	40.4	Very low	54.8	Low	162 Å²	162	81.1 Å²	81.1	71%	0.711	42%	0.417	S	S	*	.	H	α-helix	trans	-66	-39.8	-177	-157.9	-92.7	0	0	0	111.7	Y663 S671	Y663-F667 PolarHBondContact O-N 2.89Å; F667-S671 VanDerWaalsContact O-CB 3.23Å; F667-S671 WeakPolarHBondContact O-CB 3.36Å; F667-S671 PolarHBondContact O-N 2.96Å; F667-S671 PolarHBondContact O-OG 3.27Å
668	T	45	Very low	53.4	Low	79 Å²	79	88.3 Å²	88.3	49%	0.485	45%	0.45	S	S	.	.	H	α-helix	trans	-70.7	-45.5	175.5	-33.9	0	0	0	0	111.2	I664 S666 S671 L672	I664-T668 PolarHBondContact O-OG1 3.11Å; S666-T668 VanDerWaalsContact C-N 3.33Å; S666-T668 PolarHBondContact O-N 2.91Å; T668-S671 PolarHBondContact O-N 2.91Å; T668-L672 HydrophobicContact CG2-CD1 3.99Å; T668-L672 WeakPolarHBondContact O-CB 3.49Å; T668-L672 VanDerWaalsContact O-CG 3.28Å; T668-L672 WeakPolarHBondContact O-CG 3.5Å; T668-L672 PolarHBondContact O-N 3.38Å
669	Y	47.7	Very low	51.9	Low	63 Å²	63	96.2 Å²	96.2	25%	0.247	49%	0.487	C	S	.	.	H	α-helix	trans	-64.2	-48.3	179.8	179.6	-96.2	0	0	0	112.7	A665 S666 S671 L672 V673 H681 I684 F692	A665-Y669 WeakPolarHBondContact O-CB 3.38Å; A665-Y669 PolarHBondContact O-N 3.42Å; S666-Y669 PolarHBondContact O-N 3.21Å; Y669-S671 VanDerWaalsContact C-N 3.32Å; Y669-S671 PolarHBondContact O-N 2.65Å; Y669-L672 PolarHBondContact O-N 2.84Å; Y669-V673 HydrophobicContact CD1-CG2 4.34Å; Y669-V673 HydrophobicContact CD2-CG2 4.29Å; Y669-V673 HydrophobicContact CE1-CG2 4.15Å; Y669-V673 HydrophobicContact CE2-CG2 4.1Å; Y669-V673 HydrophobicContact CG-CG2 4.41Å; Y669-V673 VanDerWaalsContact O-CB 3.29Å; Y669-V673 WeakPolarHBondContact O-CB 3.38Å; Y669-V673 VanDerWaalsContact O-CG2 3.25Å; Y669-V673 WeakPolarHBondContact O-CG2 3.3Å; Y669-V673 PolarHBondContact O-N 2.76Å; Y669-H681 PolarHBondContact OH-CE1 3.23Å; Y669-H681 PolarHBondContact OH-ND1 2.98Å; Y669-I684 HydrophobicContact CD2-CD1 4.34Å; Y669-I684 HydrophobicContact CE2-CD1 4.23Å; Y669-F692 HydrophobicContact CD2-CZ 4.46Å; Y669-F692 HydrophobicContact CE2-CZ 4.37Å
670	F	48.9	Very low	50.8	Low	136 Å²	136	97.8 Å²	97.8	60%	0.596	49%	0.491	S	S	*	.	H	α-helix	trans	-68.4	-31.5	178.9	-121.3	-81.8	0	0	0	112.4	S666 K674	S666-F670 WeakPolarHBondContact O-CB 3.32Å; S666-F670 PolarHBondContact O-N 2.91Å; F670-K674 VanDerWaalsContact O-CB 3.31Å; F670-K674 WeakPolarHBondContact O-CB 3.47Å; F670-K674 WeakPolarHBondContact O-CG 3.44Å; F670-K674 PolarHBondContact O-N 3.11Å
671	S	53.2	Low	50.5	Low	45 Å²	45	100.1 Å²	100.1	32%	0.315	50%	0.499	S	S	.	.	H	α-helix	trans	-68.8	-49.9	172.8	-60.4	0	0	0	0	111.1	F667 T668 Y669 V673 K674 I675	F667-S671 VanDerWaalsContact O-CB 3.23Å; F667-S671 WeakPolarHBondContact O-CB 3.36Å; F667-S671 PolarHBondContact O-N 2.96Å; F667-S671 PolarHBondContact O-OG 3.27Å; T668-S671 PolarHBondContact O-N 2.91Å; Y669-S671 VanDerWaalsContact C-N 3.32Å; Y669-S671 PolarHBondContact O-N 2.65Å; S671-V673 PolarHBondContact O-N 3.29Å; S671-K674 PolarHBondContact O-N 3.43Å; S671-I675 WeakPolarHBondContact O-CB 3.48Å; S671-I675 WeakPolarHBondContact O-CD1 3.45Å; S671-I675 VanDerWaalsContact O-CG1 3.22Å; S671-I675 WeakPolarHBondContact O-CG1 3.37Å; S671-I675 PolarHBondContact O-N 3.17Å
672	L	50.3	Low	50.5	Low	61 Å²	61	100.5 Å²	100.5	32%	0.319	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-39.7	178.1	-71	171.4	0	0	0	112.4	T668 Y669 K674 I675 F676 F680	T668-L672 HydrophobicContact CG2-CD1 3.99Å; T668-L672 WeakPolarHBondContact O-CB 3.49Å; T668-L672 VanDerWaalsContact O-CG 3.28Å; T668-L672 WeakPolarHBondContact O-CG 3.5Å; T668-L672 PolarHBondContact O-N 3.38Å; Y669-L672 PolarHBondContact O-N 2.84Å; L672-K674 VanDerWaalsContact C-N 3.35Å; L672-I675 PolarHBondContact O-N 2.83Å; L672-F676 HydrophobicContact CB-CD2 4.49Å; L672-F676 HydrophobicContact CD2-CD2 3.95Å; L672-F676 HydrophobicContact CD2-CE2 3.7Å; L672-F676 WeakPolarHBondContact O-CB 3.46Å; L672-F676 WeakPolarHBondContact O-CD2 3.37Å; L672-F676 PolarHBondContact O-N 2.88Å; L672-F680 HydrophobicContact CB-CD1 4.39Å; L672-F680 HydrophobicContact CB-CE1 4.12Å; L672-F680 HydrophobicContact CD1-CE1 4.29Å
673	V	57.3	Low	50.8	Low	40 Å²	40	101.2 Å²	101.2	24%	0.242	51%	0.508	C	S	.	.	H	α-helix	trans	-69.4	-31	175.4	172.6	0	0	0	0	111.8	Y669 S671 G677	Y669-V673 HydrophobicContact CD1-CG2 4.34Å; Y669-V673 HydrophobicContact CD2-CG2 4.29Å; Y669-V673 HydrophobicContact CE1-CG2 4.15Å; Y669-V673 HydrophobicContact CE2-CG2 4.1Å; Y669-V673 HydrophobicContact CG-CG2 4.41Å; Y669-V673 VanDerWaalsContact O-CB 3.29Å; Y669-V673 WeakPolarHBondContact O-CB 3.38Å; Y669-V673 VanDerWaalsContact O-CG2 3.25Å; Y669-V673 WeakPolarHBondContact O-CG2 3.3Å; Y669-V673 PolarHBondContact O-N 2.76Å; S671-V673 PolarHBondContact O-N 3.29Å; V673-G677 VanDerWaalsContact O-CA 3.24Å; V673-G677 WeakPolarHBondContact O-CA 3.19Å; V673-G677 PolarHBondContact O-N 3.14Å
674	K	54.3	Low	51.3	Low	174 Å²	174	95.5 Å²	95.5	76%	0.757	49%	0.488	S	S	*	.	H	α-helix	trans	-68.6	-32.9	168.5	-86.4	-173.3	176.3	-174	0	113.4	F670 S671 L672	F670-K674 VanDerWaalsContact O-CB 3.31Å; F670-K674 WeakPolarHBondContact O-CB 3.47Å; F670-K674 WeakPolarHBondContact O-CG 3.44Å; F670-K674 PolarHBondContact O-N 3.11Å; S671-K674 PolarHBondContact O-N 3.43Å; L672-K674 VanDerWaalsContact C-N 3.35Å
675	I	60.7	Low	51.9	Low	122 Å²	122	94 Å²	94	63%	0.626	49%	0.485	S	S	*	.	H	α-helix	trans	-84.4	-41.2	-176.6	-68.2	163.5	0	0	0	111.9	S671 L672	S671-I675 WeakPolarHBondContact O-CB 3.48Å; S671-I675 WeakPolarHBondContact O-CD1 3.45Å; S671-I675 VanDerWaalsContact O-CG1 3.22Å; S671-I675 WeakPolarHBondContact O-CG1 3.37Å; S671-I675 PolarHBondContact O-N 3.17Å; L672-I675 PolarHBondContact O-N 2.83Å
676	F	61.5	Low	52.2	Low	115 Å²	115	97.6 Å²	97.6	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-107.7	-4.7	-173.9	-66.3	-81.5	0	0	0	114.4	L672 F680	L672-F676 HydrophobicContact CB-CD2 4.49Å; L672-F676 HydrophobicContact CD2-CD2 3.95Å; L672-F676 HydrophobicContact CD2-CE2 3.7Å; L672-F676 WeakPolarHBondContact O-CB 3.46Å; L672-F676 WeakPolarHBondContact O-CD2 3.37Å; L672-F676 PolarHBondContact O-N 2.88Å; F676-F680 HydrophobicContact CB-CB 3.72Å; F676-F680 HydrophobicContact CB-CD2 3.48Å; F676-F680 VanDerWaalsContact CB-CD2 3.48Å; F676-F680 HydrophobicContact CB-CE2 4.22Å; F676-F680 HydrophobicContact CB-CG 3.7Å; F676-F680 HydrophobicContact CD1-CD2 4.31Å; F676-F680 HydrophobicContact CD1-CE2 4.41Å; F676-F680 HydrophobicContact CD2-CD2 4.23Å; F676-F680 HydrophobicContact CD2-CE2 4.13Å; F676-F680 HydrophobicContact CD2-CZ 4.49Å; F676-F680 AromaticContact CG-CD2 3.77Å; F676-F680 HydrophobicContact CG-CD2 3.77Å; F676-F680 HydrophobicContact CG-CE2 4.01Å; F676-F680 HydrophobicContact CG-CG 4.34Å
677	G	62.6	Low	52	Low	29 Å²	29	100.2 Å²	100.2	30%	0.299	50%	0.503	S	S	.	.	H	α-helix	trans	66	-162.7	170.3	0	0	0	0	0	115.9	V673 Q679 F680	V673-G677 VanDerWaalsContact O-CA 3.24Å; V673-G677 WeakPolarHBondContact O-CA 3.19Å; V673-G677 PolarHBondContact O-N 3.14Å; G677-Q679 PolarHBondContact O-N 2.96Å; G677-Q679 VanDerWaalsContact O-N 3.13Å; G677-F680 PolarHBondContact O-N 3.28Å; G677-F680 VanDerWaalsContact O-N 3.13Å
678	Q	57.2	Low	51.9	Low	156 Å²	156	97.5 Å²	97.5	73%	0.729	51%	0.505	S	S	*	.	H	α-helix	trans	-57.5	-30.2	-170.9	-150.1	82.8	11.6	0	0	114	F680 H681 N682	Q678-F680 VanDerWaalsContact C-N 3.34Å; Q678-F680 PolarHBondContact O-N 3.42Å; Q678-H681 PolarHBondContact O-N 2.9Å; Q678-N682 PolarHBondContact O-N 3.45Å
679	Q	54.9	Low	51.3	Low	166 Å²	166	100.9 Å²	100.9	78%	0.776	52%	0.52	S	S	*	.	H	α-helix	trans	-67.3	-34.6	-179.1	-69.3	-178.3	-13	0	0	112.3	G677 H681 N682 L683	G677-Q679 PolarHBondContact O-N 2.96Å; G677-Q679 VanDerWaalsContact O-N 3.13Å; Q679-H681 VanDerWaalsContact C-N 3.33Å; Q679-H681 PolarHBondContact O-N 2.9Å; Q679-N682 PolarHBondContact O-N 2.88Å; Q679-L683 PolarHBondContact O-N 3.49Å; Q679-L683 VanDerWaalsContact O-N 3.12Å
680	F	55.6	Low	50.5	Low	62 Å²	62	105.7 Å²	105.7	27%	0.272	54%	0.542	S	S	.	.	H	α-helix	trans	-67.1	-35.2	178.8	-144.9	-101.6	0	0	0	112	L672 F676 G677 Q678 L683 I684	L672-F680 HydrophobicContact CB-CD1 4.39Å; L672-F680 HydrophobicContact CB-CE1 4.12Å; L672-F680 HydrophobicContact CD1-CE1 4.29Å; F676-F680 HydrophobicContact CB-CB 3.72Å; F676-F680 HydrophobicContact CB-CD2 3.48Å; F676-F680 VanDerWaalsContact CB-CD2 3.48Å; F676-F680 HydrophobicContact CB-CE2 4.22Å; F676-F680 HydrophobicContact CB-CG 3.7Å; F676-F680 HydrophobicContact CD1-CD2 4.31Å; F676-F680 HydrophobicContact CD1-CE2 4.41Å; F676-F680 HydrophobicContact CD2-CD2 4.23Å; F676-F680 HydrophobicContact CD2-CE2 4.13Å; F676-F680 HydrophobicContact CD2-CZ 4.49Å; F676-F680 AromaticContact CG-CD2 3.77Å; F676-F680 HydrophobicContact CG-CD2 3.77Å; F676-F680 HydrophobicContact CG-CE2 4.01Å; F676-F680 HydrophobicContact CG-CG 4.34Å; G677-F680 PolarHBondContact O-N 3.28Å; G677-F680 VanDerWaalsContact O-N 3.13Å; Q678-F680 VanDerWaalsContact C-N 3.34Å; Q678-F680 PolarHBondContact O-N 3.42Å; F680-L683 PolarHBondContact O-N 3.28Å; F680-I684 HydrophobicContact CD1-CD1 3.72Å; F680-I684 HydrophobicContact CD1-CG1 4.43Å; F680-I684 HydrophobicContact CE1-CD1 3.86Å; F680-I684 WeakPolarHBondContact O-CG1 3.43Å; F680-I684 PolarHBondContact O-N 3.33Å; F680-I684 VanDerWaalsContact O-N 3.12Å
681	H	54.6	Low	49.8	Very low	71 Å²	71	105.7 Å²	105.7	33%	0.329	55%	0.547	S	S	.	.	H	α-helix	trans	-63	-44.4	175.3	-178	59.1	0	0	0	112.1	Y669 Q678 Q679 T685	Y669-H681 PolarHBondContact OH-CE1 3.23Å; Y669-H681 PolarHBondContact OH-ND1 2.98Å; Q678-H681 PolarHBondContact O-N 2.9Å; Q679-H681 VanDerWaalsContact C-N 3.33Å; Q679-H681 PolarHBondContact O-N 2.9Å; H681-T685 WeakPolarHBondContact O-CB 3.43Å; H681-T685 PolarHBondContact O-N 2.78Å; H681-T685 PolarHBondContact O-OG1 3.37Å
682	N	52.8	Low	49.1	Very low	97 Å²	97	109.2 Å²	109.2	52%	0.519	56%	0.557	S	S	.	*	H	α-helix	trans	-65.2	-38.4	175.9	-69.8	1.8	0	0	0	112.1	Q678 Q679 T685 L686	Q678-N682 PolarHBondContact O-N 3.45Å; Q679-N682 PolarHBondContact O-N 2.88Å; N682-T685 PolarHBondContact O-N 3.28Å; N682-L686 PolarHBondContact O-N 3.25Å; N682-L686 VanDerWaalsContact O-N 3.14Å
683	L	50.7	Low	48.8	Very low	117 Å²	117	108.4 Å²	108.4	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-66.2	-37.6	-179.6	-147.6	85.9	0	0	0	112.8	Q679 F680	Q679-L683 PolarHBondContact O-N 3.49Å; Q679-L683 VanDerWaalsContact O-N 3.12Å; F680-L683 PolarHBondContact O-N 3.28Å
684	I	51.6	Low	48.5	Very low	58 Å²	58	109.8 Å²	109.8	30%	0.297	56%	0.56	S	S	.	*	H	α-helix	trans	-72.3	-40.9	174.2	-67.1	171.6	0	0	0	110.6	Y669 F680 L686 N687	Y669-I684 HydrophobicContact CD2-CD1 4.34Å; Y669-I684 HydrophobicContact CE2-CD1 4.23Å; F680-I684 HydrophobicContact CD1-CD1 3.72Å; F680-I684 HydrophobicContact CD1-CG1 4.43Å; F680-I684 HydrophobicContact CE1-CD1 3.86Å; F680-I684 WeakPolarHBondContact O-CG1 3.43Å; F680-I684 PolarHBondContact O-N 3.33Å; F680-I684 VanDerWaalsContact O-N 3.12Å; I684-L686 PolarHBondContact O-N 2.84Å; I684-N687 CarbonylContact O-C 3.59Å; I684-N687 PolarHBondContact O-N 3.26Å
685	T	50.9	Low	49	Very low	89 Å²	89	102.4 Å²	102.4	55%	0.546	53%	0.533	S	S	.	.	H	α-helix	trans	-62.5	-26.3	179.5	-55.6	0	0	0	0	112.8	H681 N682	H681-T685 WeakPolarHBondContact O-CB 3.43Å; H681-T685 PolarHBondContact O-N 2.78Å; H681-T685 PolarHBondContact O-OG1 3.37Å; N682-T685 PolarHBondContact O-N 3.28Å
686	L	45.2	Very low	50.1	Low	142 Å²	142	98.1 Å²	98.1	74%	0.743	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-13.1	173.1	-84.8	161.3	0	0	0	114.7	N682 I684	N682-L686 PolarHBondContact O-N 3.25Å; N682-L686 VanDerWaalsContact O-N 3.14Å; I684-L686 PolarHBondContact O-N 2.84Å
687	N	37.2	Very low	51.4	Low	121 Å²	121	93 Å²	93	65%	0.647	49%	0.488	S	S	*	.			trans	-107.4	66.4	174.2	-87.4	-71	0	0	0	110.6	I684 N689 F690	I684-N687 CarbonylContact O-C 3.59Å; I684-N687 PolarHBondContact O-N 3.26Å; N687-N689 PolarHBondContact O-N 2.89Å; N687-F690 PolarHBondContact O-N 3.05Å
688	S	36.9	Very low	52.8	Low	105 Å²	105	91.7 Å²	91.7	73%	0.734	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	8.2	-171.9	47.8	0	0	0	0	116.8
689	N	32.9	Very low	54.6	Low	150 Å²	150	84.3 Å²	84.3	80%	0.802	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-2.5	173.5	-75	-25.4	0	0	0	114	N687 L691	N687-N689 PolarHBondContact O-N 2.89Å; N689-L691 VanDerWaalsContact C-N 3.34Å; N689-L691 PolarHBondContact O-N 2.68Å
690	F	32	Very low	56.5	Low	164 Å²	164	76.4 Å²	76.4	72%	0.719	40%	0.403	S	S	*	.	S	Bend	trans	-77.4	85.9	169.3	-134.1	-84	0	0	0	109.5	N687 F692	N687-F690 PolarHBondContact O-N 3.05Å; F690-F692 PolarHBondContact O-N 3.11Å
691	L	33.8	Very low	58.3	Low	135 Å²	135	73.5 Å²	73.5	71%	0.707	39%	0.39	S	S	*	.			trans	-57.4	103.3	175.4	-97.9	77.9	0	0	0	110	N689 F693	N689-L691 VanDerWaalsContact C-N 3.34Å; N689-L691 PolarHBondContact O-N 2.68Å; L691-F693 PolarHBondContact O-N 3.05Å
692	F	37.9	Very low	60	Low	120 Å²	120	70.1 Å²	70.1	53%	0.526	37%	0.374	S	S	.	.			trans	-64.6	100.1	160.6	-91.1	-89.4	0	0	0	107.7	Y669 F690 T694	Y669-F692 HydrophobicContact CD2-CZ 4.46Å; Y669-F692 HydrophobicContact CE2-CZ 4.37Å; F690-F692 PolarHBondContact O-N 3.11Å; F692-T694 PolarHBondContact O-N 3.24Å; F692-T694 VanDerWaalsContact O-N 3.11Å
693	F	43.4	Very low	61.5	Low	44 Å²	44	66.3 Å²	66.3	19%	0.193	35%	0.354	C	S	.	.			trans	-55.3	123.2	-180	-123.8	-105.6	0	0	0	109.8	E634 I637 D638 L691 G695 F696 R826	E634-F693 HydrophobicContact CB-CD2 4.46Å; E634-F693 HydrophobicContact CB-CE2 4.45Å; E634-F693 WeakPolarHBondContact O-CE2 3.43Å; E634-F693 WeakPolarHBondContact O-CZ 3.24Å; I637-F693 HydrophobicContact CG2-CE1 3.98Å; I637-F693 HydrophobicContact CG2-CZ 3.85Å; D638-F693 HydrophobicContact CB-CZ 4.35Å; L691-F693 PolarHBondContact O-N 3.05Å; F693-G695 PolarHBondContact O-N 2.73Å; F693-F696 HydrophobicContact CE1-CE2 4.11Å; F693-R826 PolarHBondContact O-NH2 3.01Å
694	T	51.6	Low	62.7	Low	69 Å²	69	60.9 Å²	60.9	42%	0.423	33%	0.326	S	S	.	.			trans	-78.2	103	174.3	47.3	0	0	0	0	106.4	F692 F696	F692-T694 PolarHBondContact O-N 3.24Å; F692-T694 VanDerWaalsContact O-N 3.11Å; T694-F696 WeakPolarHBondContact O-CD2 3.29Å; T694-F696 VanDerWaalsContact O-CG 3.32Å; T694-F696 WeakPolarHBondContact O-CG 3.26Å; T694-F696 PolarHBondContact O-N 3.4Å; T694-F696 VanDerWaalsContact OG1-CE1 3.27Å; T694-F696 WeakPolarHBondContact OG1-CE1 3.26Å; T694-F696 VanDerWaalsContact OG1-CZ 3.27Å; T694-F696 WeakPolarHBondContact OG1-CZ 3.4Å
695	G	65.4	Low	63.8	Low	18 Å²	18	58.2 Å²	58.2	19%	0.186	31%	0.312	C	S	.	.			trans	-50.5	109.8	174.8	0	0	0	0	0	108.9	F693	F693-G695 PolarHBondContact O-N 2.73Å
696	F	83.8	Confident	65.2	Low	32 Å²	32	54.9 Å²	54.9	14%	0.14	29%	0.291	C	S	.	.			trans	-86.3	143.1	-173.5	-70.4	-59.8	0	0	0	108.7	N353 V354 L658 F693 T694 V698	N353-F696 HydrophobicContact CB-CB 4.05Å; N353-F696 HydrophobicContact CB-CD1 3.6Å; N353-F696 HydrophobicContact CB-CE1 4.48Å; N353-F696 HydrophobicContact CB-CG 4.19Å; V354-F696 HydrophobicContact CG2-CB 4.02Å; V354-F696 HydrophobicContact CG2-CD2 4.23Å; V354-F696 HydrophobicContact CG2-CG 4.03Å; L658-F696 HydrophobicContact CD2-CD2 4.41Å; L658-F696 PolarHBondContact O-N 3.27Å; L658-F696 VanDerWaalsContact O-N 3.11Å; F693-F696 HydrophobicContact CE1-CE2 4.11Å; T694-F696 WeakPolarHBondContact O-CD2 3.29Å; T694-F696 VanDerWaalsContact O-CG 3.32Å; T694-F696 WeakPolarHBondContact O-CG 3.26Å; T694-F696 PolarHBondContact O-N 3.4Å; T694-F696 VanDerWaalsContact OG1-CE1 3.27Å; T694-F696 WeakPolarHBondContact OG1-CE1 3.26Å; T694-F696 VanDerWaalsContact OG1-CZ 3.27Å; T694-F696 WeakPolarHBondContact OG1-CZ 3.4Å; F696-V698 PolarHBondContact O-N 3.05Å
697	I	88.9	Confident	67.1	Low	9 Å²	9	48.1 Å²	48.1	5%	0.046	26%	0.256	C	S	.	.			trans	-74.5	112.2	166.4	-59.8	-53.8	0	0	0	107.6	P265 T348 C351 V352 N353 V354 D715 V825	P265-I697 HydrophobicContact CG-CD1 3.78Å; P265-I697 HydrophobicContact CG-CG1 4.24Å; T348-I697 HydrophobicContact CG2-CG2 3.67Å; C351-I697 HydrophobicContact CB-CG1 4.09Å; C351-I697 HydrophobicContact CB-CG2 4.48Å; V352-I697 HydrophobicContact CG2-CG2 4.22Å; N353-I697 PolarHBondContact N-O 3.36Å; N353-I697 PolarHBondContact OD1-N 3.49Å; V354-I697 PolarHBondContact N-O 2.9Å; I697-D715 HydrophobicContact CD1-CB 4.5Å; I697-D715 HydrophobicContact CG2-CB 3.82Å; I697-V825 HydrophobicContact CD1-CG2 4Å; I697-V825 HydrophobicContact CG1-CG2 3.63Å
698	V	91.8	Very high	69.2	Low	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	120.5	-177.5	-176.2	0	0	0	0	109.3	V354 V655 L658 S659 F696 D715 I716	V354-V698 WeakPolarHBondContact O-CA 3.19Å; V655-V698 HydrophobicContact CG1-CG1 4.45Å; V655-V698 HydrophobicContact CG2-CG1 4.49Å; L658-V698 HydrophobicContact CB-CG2 3.42Å; L658-V698 VanDerWaalsContact CB-CG2 3.42Å; S659-V698 WeakPolarHBondContact OG-CB 3.49Å; S659-V698 WeakPolarHBondContact OG-CG2 3.34Å; F696-V698 PolarHBondContact O-N 3.05Å; V698-D715 PolarHBondContact N-OD2 2.78Å; V698-D715 WeakPolarHBondContact O-CB 3.33Å; V698-D715 PolarHBondContact O-N 3.12Å; V698-I716 PolarHBondContact O-N 3.34Å
699	A	94	Very high	71.5	Confident	1 Å²	1	38 Å²	38	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	138.4	159.6	0	0	0	0	0	109	V352 V354 I355 C356 I716 I718	V352-A699 HydrophobicContact CG1-CB 3.87Å; V352-A699 HydrophobicContact CG2-CB 4.05Å; V354-A699 PolarHBondContact O-N 3.47Å; I355-A699 WeakPolarHBondContact CA-O 3.33Å; I355-A699 HydrophobicContact CG1-CB 4.35Å; C356-A699 PolarHBondContact N-O 3.19Å; A699-I716 WeakPolarHBondContact CA-O 3.03Å; A699-I716 HydrophobicContact CB-CB 4.09Å; A699-I716 HydrophobicContact CB-CD1 4.41Å; A699-I718 HydrophobicContact CB-CD1 4.18Å
700	M	94.6	Very high	74.2	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139.2	169.1	-176.9	165.7	170.2	0	0	110.6	C356 K651 V655 D707 A710 L711 A714 I716 I718	C356-M700 CarbonylContact O-C 3.59Å; C356-M700 VanDerWaalsContact O-CA 3.29Å; C356-M700 WeakPolarHBondContact O-CA 3.09Å; K651-M700 HydrophobicContact CB-CE 4.35Å; K651-M700 HydrophobicContact CD-CE 4.17Å; K651-M700 HydrophobicContact CG-CE 4.47Å; V655-M700 HydrophobicContact CG2-SD 3.84Å; M700-D707 HydrophobicContact CE-CB 3.99Å; M700-D707 WeakPolarHBondContact CE-OD1 3.27Å; M700-A710 HydrophobicContact CE-CB 3.87Å; M700-A710 VanDerWaalsContact SD-C 3.57Å; M700-A710 HydrophobicContact SD-CB 3.34Å; M700-A710 WeakPolarHBondContact SD-CB 3.05Å; M700-L711 HydrophobicContact CB-CD2 4.18Å; M700-L711 HydrophobicContact CG-CD2 4.02Å; M700-L711 HydrophobicContact CG-CG 4.46Å; M700-L711 VanDerWaalsContact O-CD2 3.3Å; M700-L711 WeakPolarHBondContact O-CD2 3.42Å; M700-A714 HydrophobicContact CB-CB 3.8Å; M700-I716 PolarHBondContact N-O 3.46Å; M700-I718 WeakPolarHBondContact O-CB 3.16Å; M700-I718 PolarHBondContact O-N 3.15Å
701	T	94.1	Very high	77	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	136.6	172.3	38	0	0	0	0	110.3	C356 S357 D358 I718 I744	C356-T701 PolarHBondContact O-N 3.22Å; C356-T701 PolarHBondContact O-OG1 3.07Å; C356-T701 VanDerWaalsContact O-OG1 3.13Å; S357-T701 WeakPolarHBondContact CA-OG1 3.5Å; S357-T701 WeakPolarHBondContact CB-OG1 3.47Å; S357-T701 PolarHBondContact OG-OG1 3.26Å; D358-T701 PolarHBondContact N-O 3.34Å; T701-I718 WeakPolarHBondContact CA-O 3.45Å; T701-I718 HydrophobicContact CG2-CB 3.66Å; T701-I718 HydrophobicContact CG2-CD1 4.11Å; T701-I718 HydrophobicContact CG2-CG1 4.39Å; T701-I718 HydrophobicContact CG2-CG2 3.8Å; T701-I744 HydrophobicContact CG2-CD1 3.81Å
702	G	90.1	Very high	79.4	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	170.1	-178.7	0	0	0	0	0	112.7	T362 D707 I718 S719 M720	T362-G702 VanDerWaalsContact OG1-CA 3.29Å; T362-G702 WeakPolarHBondContact OG1-CA 3.22Å; G702-D707 WeakPolarHBondContact CA-OD2 3.37Å; G702-I718 PolarHBondContact N-O 3.16Å; G702-S719 WeakPolarHBondContact O-CA 3.32Å; G702-M720 PolarHBondContact O-N 3.29Å
703	D	85.3	Confident	81.8	Confident	17 Å²	17	15.7 Å²	15.7	9%	0.091	8%	0.084	C	C	.	.			trans	-130.2	-28.1	-178.2	72.7	-27.3	0	0	0	113.7	G361 T362 D707 M720 T725 S728	G361-D703 WeakPolarHBondContact CA-OD2 3.11Å; T362-D703 PolarHBondContact OG1-N 3.36Å; D703-D707 PolarHBondContact N-OD2 3.07Å; D703-M720 HydrophobicContact CB-CB 4.09Å; D703-M720 HydrophobicContact CB-CG 3.86Å; D703-T725 WeakPolarHBondContact O-CB 3.16Å; D703-T725 WeakPolarHBondContact O-CG2 3.5Å; D703-T725 PolarHBondContact O-N 3.25Å; D703-T725 PolarHBondContact O-OG1 2.96Å; D703-S728 VanDerWaalsContact O-CB 3.27Å; D703-S728 WeakPolarHBondContact O-CB 3.39Å; D703-S728 PolarHBondContact O-OG 3.4Å
704	G	75.9	Confident	84	Confident	3 Å²	3	13.7 Å²	13.7	3%	0.031	8%	0.075	C	C	.	.	S	Bend	trans	-87.8	168	-177.7	0	0	0	0	0	115.8	N706 D707 S728	G704-N706 VanDerWaalsContact C-OD1 3.29Å; G704-N706 WeakPolarHBondContact CA-OD1 3.43Å; G704-N706 PolarHBondContact O-N 3.49Å; G704-D707 WeakPolarHBondContact O-CB 3.26Å; G704-D707 PolarHBondContact O-N 3.48Å; G704-D707 VanDerWaalsContact O-N 3.14Å; G704-S728 WeakPolarHBondContact O-CB 3.47Å
705	V	74.8	Confident	85.9	Confident	2 Å²	2	11.3 Å²	11.3	1%	0.012	6%	0.06	C	C	.	.	H	α-helix	trans	-67.3	-27.2	171.3	-170.5	0	0	0	0	110.4	S194 F249 V252 D707 A708 T725 V727	S194-V705 WeakPolarHBondContact O-CA 3.47Å; S194-V705 WeakPolarHBondContact O-CB 3.25Å; S194-V705 VanDerWaalsContact O-CG2 3.24Å; S194-V705 WeakPolarHBondContact O-CG2 3.32Å; S194-V705 PolarHBondContact O-N 3.47Å; F249-V705 HydrophobicContact CE2-CG2 4.24Å; V252-V705 HydrophobicContact CB-CG1 4.47Å; V252-V705 HydrophobicContact CG1-CG1 3.96Å; V705-D707 PolarHBondContact O-N 3.04Å; V705-A708 WeakPolarHBondContact O-CB 3.32Å; V705-A708 PolarHBondContact O-N 2.86Å; V705-T725 HydrophobicContact CG2-CG2 4.32Å; V705-V727 HydrophobicContact CB-CB 4.43Å; V705-V727 HydrophobicContact CG1-CB 4.07Å; V705-V727 HydrophobicContact CG1-CG1 4.07Å; V705-V727 HydrophobicContact CG1-CG2 4.11Å; V705-V727 HydrophobicContact CG2-CB 3.98Å; V705-V727 HydrophobicContact CG2-CG2 3.78Å
706	N	79.1	Confident	87.1	Confident	19 Å²	19	10.4 Å²	10.4	10%	0.102	5%	0.051	C	C	.	.	H	α-helix	trans	-58.3	-25.5	169.4	64.6	-13.6	0	0	0	113.8	P648 K651 G704	P648-N706 HydrophobicContact CG-CB 4.01Å; K651-N706 PolarHBondContact NZ-ND2 3.18Å; G704-N706 VanDerWaalsContact C-OD1 3.29Å; G704-N706 WeakPolarHBondContact CA-OD1 3.43Å; G704-N706 PolarHBondContact O-N 3.49Å
707	D	86.6	Confident	87.5	Confident	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-87.5	-25.3	175.4	-71.6	-50.2	0	0	0	113.3	K651 M700 G702 D703 G704 V705 V709 A710 L711	K651-D707 VanDerWaalsContact CD-OD1 3.3Å; K651-D707 WeakPolarHBondContact CD-OD1 3.28Å; K651-D707 WeakPolarHBondContact CE-OD1 3.44Å; K651-D707 IonicContact NZ-OD1 2.7Å; K651-D707 PolarHBondContact NZ-OD1 3.14Å; K651-D707 IonicContact NZ-OD2 2.81Å; M700-D707 HydrophobicContact CE-CB 3.99Å; M700-D707 WeakPolarHBondContact CE-OD1 3.27Å; G702-D707 WeakPolarHBondContact CA-OD2 3.37Å; D703-D707 PolarHBondContact N-OD2 3.07Å; G704-D707 WeakPolarHBondContact O-CB 3.26Å; G704-D707 PolarHBondContact O-N 3.48Å; G704-D707 VanDerWaalsContact O-N 3.14Å; V705-D707 PolarHBondContact O-N 3.04Å; D707-V709 VanDerWaalsContact C-N 3.31Å; D707-V709 PolarHBondContact O-N 3.12Å; D707-V709 VanDerWaalsContact O-N 3.11Å; D707-A710 PolarHBondContact O-N 3.46Å; D707-L711 HydrophobicContact CB-CD1 3.67Å; D707-L711 HydrophobicContact CB-CG 3.99Å; D707-L711 PolarHBondContact O-N 2.9Å
708	A	81.1	Confident	87.8	Confident	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-53.4	-40.9	-165.7	0	0	0	0	0	114.3	M256 V705 A710 K712 V727 A731	M256-A708 HydrophobicContact CG-CB 4.42Å; V705-A708 WeakPolarHBondContact O-CB 3.32Å; V705-A708 PolarHBondContact O-N 2.86Å; A708-A710 VanDerWaalsContact C-N 3.35Å; A708-A710 PolarHBondContact O-N 2.9Å; A708-K712 WeakPolarHBondContact O-CB 3.26Å; A708-K712 PolarHBondContact O-N 3.48Å; A708-V727 HydrophobicContact CB-CG1 3.87Å; A708-A731 HydrophobicContact CB-CB 3.85Å; A708-A731 WeakPolarHBondContact O-CB 3.27Å
709	V	85.2	Confident	87.7	Confident	13 Å²	13	8.5 Å²	8.5	8%	0.079	4%	0.042	C	C	.	.	H	α-helix	trans	-68	-34.6	179.2	-168	0	0	0	0	111.9	V252 M255 M256 E259 L652 D707 K713	V252-V709 HydrophobicContact CG1-CG2 3.81Å; M255-V709 HydrophobicContact CB-CG1 4.3Å; M255-V709 HydrophobicContact CB-CG2 4.16Å; M256-V709 HydrophobicContact CB-CG2 4.25Å; E259-V709 HydrophobicContact CG-CG1 4.14Å; L652-V709 HydrophobicContact CD1-CG1 4.23Å; L652-V709 HydrophobicContact CD2-CG1 3.92Å; D707-V709 VanDerWaalsContact C-N 3.31Å; D707-V709 PolarHBondContact O-N 3.12Å; D707-V709 VanDerWaalsContact O-N 3.11Å; V709-K713 PolarHBondContact O-N 3.36Å
710	A	89.1	Confident	87.6	Confident	1 Å²	1	8.5 Å²	8.5	1%	0.008	4%	0.042	C	C	.	.	H	α-helix	trans	-85.9	-35.5	-178.9	0	0	0	0	0	112	K651 L652 V655 M700 D707 A708 K712 K713 A714	K651-A710 HydrophobicContact CB-CB 3.91Å; L652-A710 HydrophobicContact CB-CB 4.49Å; V655-A710 HydrophobicContact CG2-CB 4.37Å; M700-A710 HydrophobicContact CE-CB 3.87Å; M700-A710 VanDerWaalsContact SD-C 3.57Å; M700-A710 HydrophobicContact SD-CB 3.34Å; M700-A710 WeakPolarHBondContact SD-CB 3.05Å; D707-A710 PolarHBondContact O-N 3.46Å; A708-A710 VanDerWaalsContact C-N 3.35Å; A708-A710 PolarHBondContact O-N 2.9Å; A710-K712 VanDerWaalsContact C-N 3.28Å; A710-K712 PolarHBondContact O-N 3.44Å; A710-K713 PolarHBondContact O-N 3Å; A710-A714 PolarHBondContact O-N 3.4Å
711	L	90.1	Very high	87	Confident	0 Å²	0	9 Å²	9	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-54.5	-44.2	166.1	-76.5	168.9	0	0	0	111.6	M700 D707 K713 G717 I718 A731	M700-L711 HydrophobicContact CB-CD2 4.18Å; M700-L711 HydrophobicContact CG-CD2 4.02Å; M700-L711 HydrophobicContact CG-CG 4.46Å; M700-L711 VanDerWaalsContact O-CD2 3.3Å; M700-L711 WeakPolarHBondContact O-CD2 3.42Å; D707-L711 HydrophobicContact CB-CD1 3.67Å; D707-L711 HydrophobicContact CB-CG 3.99Å; D707-L711 PolarHBondContact O-N 2.9Å; L711-K713 VanDerWaalsContact C-N 3.34Å; L711-K713 PolarHBondContact O-N 2.7Å; L711-G717 WeakPolarHBondContact O-CA 3.3Å; L711-G717 PolarHBondContact O-N 3.34Å; L711-I718 VanDerWaalsContact CD2-O 3.32Å; L711-I718 WeakPolarHBondContact CD2-O 3.37Å; L711-A731 HydrophobicContact CB-CB 4.45Å
712	K	85.3	Confident	86.3	Confident	50 Å²	50	13.4 Å²	13.4	22%	0.217	8%	0.078	C	C	.	.	H	α-helix	trans	-65.6	-33.7	177.9	179.6	72.8	171.9	-152.4	0	113.6	M256 E259 A708 A710 A731	M256-K712 HydrophobicContact CG-CB 3.87Å; M256-K712 HydrophobicContact CG-CD 4.38Å; M256-K712 HydrophobicContact CG-CG 4.04Å; M256-K712 WeakPolarHBondContact O-CE 3.4Å; M256-K712 WeakPolarHBondContact O-CG 3.45Å; M256-K712 HydrophobicContact SD-CD 4.29Å; E259-K712 HydrophobicContact CB-CG 4.31Å; E259-K712 WeakPolarHBondContact O-CE 3.28Å; E259-K712 WeakPolarHBondContact O-CG 3.48Å; A708-K712 WeakPolarHBondContact O-CB 3.26Å; A708-K712 PolarHBondContact O-N 3.48Å; A710-K712 VanDerWaalsContact C-N 3.28Å; A710-K712 PolarHBondContact O-N 3.44Å; K712-A731 HydrophobicContact CB-CB 4.48Å
713	K	88.2	Confident	85.7	Confident	51 Å²	51	15.8 Å²	15.8	22%	0.222	9%	0.093	C	C	.	.	H	α-helix	trans	-88.8	-25	-174.8	-173.1	52.2	171.6	-155.6	0	113.9	E259 L652 K656 V709 A710 L711	E259-K713 VanDerWaalsContact OE2-CD 3.24Å; E259-K713 WeakPolarHBondContact OE2-CD 3.2Å; E259-K713 VanDerWaalsContact OE2-CE 3.27Å; E259-K713 WeakPolarHBondContact OE2-CE 3.37Å; E259-K713 IonicContact OE2-NZ 3.01Å; E259-K713 PolarHBondContact OE2-NZ 2.69Å; L652-K713 HydrophobicContact CD1-CB 3.61Å; L652-K713 HydrophobicContact CD1-CG 3.83Å; K656-K713 HydrophobicContact CG-CG 3.9Å; V709-K713 PolarHBondContact O-N 3.36Å; A710-K713 PolarHBondContact O-N 3Å; L711-K713 VanDerWaalsContact C-N 3.34Å; L711-K713 PolarHBondContact O-N 2.7Å
714	A	89.9	Confident	85.3	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.008	9%	0.092	C	C	.	.	S	Bend	trans	-56.2	155.7	171.6	0	0	0	0	0	110.8	V655 M700 A710 I716	V655-A714 HydrophobicContact CG1-CB 3.97Å; M700-A714 HydrophobicContact CB-CB 3.8Å; A710-A714 PolarHBondContact O-N 3.4Å; A714-I716 WeakPolarHBondContact CB-O 3.36Å; A714-I716 PolarHBondContact O-N 3.26Å
715	D	90.2	Very high	85.1	Confident	19 Å²	19	16.5 Å²	16.5	10%	0.102	10%	0.098	C	C	.	.	S	Bend	trans	-61.8	-22.4	170.6	-58.1	-87.5	0	0	0	111.5	T348 S659 I697 V698	T348-D715 HydrophobicContact CG2-CB 4.09Å; S659-D715 PolarHBondContact OG-OD2 3.35Å; I697-D715 HydrophobicContact CD1-CB 4.5Å; I697-D715 HydrophobicContact CG2-CB 3.82Å; V698-D715 PolarHBondContact N-OD2 2.78Å; V698-D715 WeakPolarHBondContact O-CB 3.33Å; V698-D715 PolarHBondContact O-N 3.12Å
716	I	91.9	Very high	84.9	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	116	172.1	-45	178.5	0	0	0	110.1	T345 T348 L349 V352 V698 A699 M700 A714 I718	T345-I716 HydrophobicContact CG2-CB 4.37Å; T345-I716 HydrophobicContact CG2-CG1 4.19Å; T345-I716 HydrophobicContact CG2-CG2 3.69Å; T348-I716 HydrophobicContact CG2-CD1 3.89Å; T348-I716 HydrophobicContact CG2-CG1 3.62Å; L349-I716 HydrophobicContact CB-CD1 4.26Å; L349-I716 HydrophobicContact CD2-CD1 3.7Å; L349-I716 HydrophobicContact CD2-CG2 4.21Å; L349-I716 HydrophobicContact CG-CD1 3.8Å; V352-I716 HydrophobicContact CG2-CD1 3.35Å; V352-I716 HydrophobicContact CG2-CG1 4.47Å; V698-I716 PolarHBondContact O-N 3.34Å; A699-I716 WeakPolarHBondContact CA-O 3.03Å; A699-I716 HydrophobicContact CB-CB 4.09Å; A699-I716 HydrophobicContact CB-CD1 4.41Å; M700-I716 PolarHBondContact N-O 3.46Å; A714-I716 WeakPolarHBondContact CB-O 3.36Å; A714-I716 PolarHBondContact O-N 3.26Å; I716-I718 HydrophobicContact CG2-CD1 4.41Å; I716-I718 HydrophobicContact CG2-CG1 3.86Å
717	G	92.3	Very high	84.4	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	127.6	163	0	0	0	0	0	111.5	L711 A732 D733 M734	L711-G717 WeakPolarHBondContact O-CA 3.3Å; L711-G717 PolarHBondContact O-N 3.34Å; G717-A732 WeakPolarHBondContact O-CB 3.26Å; G717-D733 PolarHBondContact N-OD2 3.08Å; G717-D733 PolarHBondContact O-N 3.37Å; G717-M734 PolarHBondContact O-N 2.88Å
718	I	94	Very high	84.1	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.3	174.7	-53.2	177.7	0	0	0	109.2	A699 M700 T701 G702 L711 I716 M734 L736 I744	A699-I718 HydrophobicContact CB-CD1 4.18Å; M700-I718 WeakPolarHBondContact O-CB 3.16Å; M700-I718 PolarHBondContact O-N 3.15Å; T701-I718 WeakPolarHBondContact CA-O 3.45Å; T701-I718 HydrophobicContact CG2-CB 3.66Å; T701-I718 HydrophobicContact CG2-CD1 4.11Å; T701-I718 HydrophobicContact CG2-CG1 4.39Å; T701-I718 HydrophobicContact CG2-CG2 3.8Å; G702-I718 PolarHBondContact N-O 3.16Å; L711-I718 VanDerWaalsContact CD2-O 3.32Å; L711-I718 WeakPolarHBondContact CD2-O 3.37Å; I716-I718 HydrophobicContact CG2-CD1 4.41Å; I716-I718 HydrophobicContact CG2-CG1 3.86Å; I718-M734 CarbonylContact C-O 3.59Å; I718-M734 WeakPolarHBondContact CA-O 3.39Å; I718-M734 HydrophobicContact CD1-CE 4.18Å; I718-M734 HydrophobicContact CD1-SD 4.36Å; I718-M734 HydrophobicContact CG1-CB 4.24Å; I718-M734 HydrophobicContact CG1-CG 4.46Å; I718-M734 HydrophobicContact CG1-SD 4.33Å; I718-M734 HydrophobicContact CG2-CE 4.13Å; I718-M734 HydrophobicContact CG2-CG 4.29Å; I718-L736 HydrophobicContact CG2-CD1 3.96Å; I718-L736 HydrophobicContact CG2-CD2 4.25Å; I718-L736 HydrophobicContact CG2-CG 3.8Å; I718-I744 HydrophobicContact CD1-CD1 4.46Å; I718-I744 HydrophobicContact CD1-CG2 4.31Å
719	S	90.7	Very high	84.1	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	147.3	175.5	-178.3	0	0	0	0	111.9	G702 S728 R729 M734 I735 L736	G702-S719 WeakPolarHBondContact O-CA 3.32Å; S719-S728 PolarHBondContact OG-OG 3.4Å; S719-S728 VanDerWaalsContact OG-OG 3.13Å; S719-R729 WeakPolarHBondContact OG-CG 3.19Å; S719-R729 PolarHBondContact OG-N 3.11Å; S719-M734 PolarHBondContact N-O 3.34Å; S719-I735 WeakPolarHBondContact O-CA 3.43Å; S719-L736 PolarHBondContact O-N 3.06Å
720	M	90.3	Very high	83.6	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	150.9	161.7	-51.5	-52.2	-81.7	0	0	109.8	T362 G702 D703 T723 G724 R729 L736 D739	T362-M720 HydrophobicContact CG2-SD 4.12Å; T362-M720 WeakPolarHBondContact O-CE 3.42Å; G702-M720 PolarHBondContact O-N 3.29Å; D703-M720 HydrophobicContact CB-CB 4.09Å; D703-M720 HydrophobicContact CB-CG 3.86Å; M720-T723 WeakPolarHBondContact CB-OG1 3.14Å; M720-G724 WeakPolarHBondContact O-CA 3.16Å; M720-R729 WeakPolarHBondContact O-CG 3.43Å; M720-L736 HydrophobicContact SD-CD1 4.13Å; M720-D739 HydrophobicContact CE-CB 3.57Å
721	G	82.6	Confident	83.1	Confident	10 Å²	10	27.7 Å²	27.7	10%	0.103	15%	0.149	C	C	.	.	S	Bend	trans	-100.7	-34.6	-171.8	0	0	0	0	0	114.1	R729 L736 D739	G721-R729 PolarHBondContact O-NH1 2.67Å; G721-L736 VanDerWaalsContact CA-O 3.24Å; G721-L736 WeakPolarHBondContact CA-O 3.46Å; G721-L736 PolarHBondContact N-O 2.92Å; G721-D739 PolarHBondContact N-OD1 3.07Å
722	S	78.9	Confident	82.9	Confident	94 Å²	94	27.8 Å²	27.8	66%	0.657	15%	0.149	S	C	*	.	S	Bend	trans	-102.3	-43.8	-179.8	-62.2	0	0	0	0	112.2	L737 D739	S722-L737 PolarHBondContact OG-O 3.25Å; S722-D739 PolarHBondContact N-OD1 3.35Å
723	T	79.2	Confident	83	Confident	49 Å²	49	25.8 Å²	25.8	30%	0.301	14%	0.141	S	C	.	.	S	Bend	trans	-83.1	-19.8	170.1	53.9	0	0	0	0	114	G361 R575 M720 T725 D739	G361-T723 PolarHBondContact O-OG1 2.81Å; R575-T723 VanDerWaalsContact NH2-CG2 3.26Å; R575-T723 PolarHBondContact NH2-OG1 3.34Å; M720-T723 WeakPolarHBondContact CB-OG1 3.14Å; T723-T725 PolarHBondContact O-N 2.94Å; T723-D739 WeakPolarHBondContact CG2-OD2 3.19Å; T723-D739 PolarHBondContact N-OD2 3.21Å; T723-D739 PolarHBondContact OG1-OD2 2.77Å; T723-D739 VanDerWaalsContact OG1-OD2 3.11Å
724	G	75.6	Confident	83.1	Confident	7 Å²	7	23.4 Å²	23.4	7%	0.072	13%	0.131	C	C	.	.			trans	-66	123.4	-175.6	0	0	0	0	0	113.7	M720 R729	M720-G724 WeakPolarHBondContact O-CA 3.16Å; G724-R729 WeakPolarHBondContact O-CD 3.43Å; G724-R729 PolarHBondContact O-NE 3.34Å
725	T	72.9	Confident	83.1	Confident	28 Å²	28	24.4 Å²	24.4	17%	0.172	14%	0.136	C	C	.	.			trans	-54.5	155.4	170.6	60.3	0	0	0	0	112.1	D703 V705 T723 V727 S728 R729	D703-T725 WeakPolarHBondContact O-CB 3.16Å; D703-T725 WeakPolarHBondContact O-CG2 3.5Å; D703-T725 PolarHBondContact O-N 3.25Å; D703-T725 PolarHBondContact O-OG1 2.96Å; V705-T725 HydrophobicContact CG2-CG2 4.32Å; T723-T725 PolarHBondContact O-N 2.94Å; T725-V727 PolarHBondContact O-N 3.14Å; T725-V727 VanDerWaalsContact O-N 3.15Å; T725-S728 PolarHBondContact N-OG 3.22Å; T725-S728 PolarHBondContact O-N 3.14Å; T725-S728 PolarHBondContact O-OG 2.99Å; T725-S728 PolarHBondContact OG1-N 2.99Å; T725-S728 PolarHBondContact OG1-OG 3.11Å; T725-S728 VanDerWaalsContact OG1-OG 3.1Å; T725-R729 WeakPolarHBondContact O-CB 3.3Å; T725-R729 WeakPolarHBondContact O-CG 3.45Å; T725-R729 PolarHBondContact O-N 3.05Å
726	D	69.6	Low	83.2	Confident	65 Å²	65	23.6 Å²	23.6	35%	0.348	13%	0.131	S	C	.	.	H	α-helix	trans	-59.1	-30.4	179.2	-57.3	-29.1	0	0	0	112.2	R175 R729 E730	R175-D726 IonicContact CZ-OD2 3.57Å; R175-D726 IonicContact NH1-OD2 3.58Å; R175-D726 PolarHBondContact NH1-OD2 3.43Å; R175-D726 IonicContact NH2-OD1 2.64Å; R175-D726 IonicContact NH2-OD2 3.37Å; R175-D726 PolarHBondContact NH2-OD2 3.18Å; D726-R729 IonicContact OD1-CZ 3.59Å; D726-R729 IonicContact OD1-NE 2.7Å; D726-R729 IonicContact OD1-NH2 2.65Å; D726-R729 PolarHBondContact OD1-NH2 3.35Å; D726-E730 VanDerWaalsContact O-CB 3.32Å; D726-E730 WeakPolarHBondContact O-CB 3.44Å; D726-E730 PolarHBondContact O-N 2.86Å
727	V	69.8	Low	82.9	Confident	7 Å²	7	27.2 Å²	27.2	4%	0.042	15%	0.15	C	C	.	.	H	α-helix	trans	-79.6	-39.3	179.2	-162	0	0	0	0	113	F249 M256 V705 A708 T725 R729 E730 A731	F249-V727 HydrophobicContact CE1-CG2 3.8Å; F249-V727 HydrophobicContact CE2-CG2 3.76Å; F249-V727 HydrophobicContact CZ-CG2 3.16Å; M256-V727 HydrophobicContact CE-CG1 3.64Å; V705-V727 HydrophobicContact CB-CB 4.43Å; V705-V727 HydrophobicContact CG1-CB 4.07Å; V705-V727 HydrophobicContact CG1-CG1 4.07Å; V705-V727 HydrophobicContact CG1-CG2 4.11Å; V705-V727 HydrophobicContact CG2-CB 3.98Å; V705-V727 HydrophobicContact CG2-CG2 3.78Å; A708-V727 HydrophobicContact CB-CG1 3.87Å; T725-V727 PolarHBondContact O-N 3.14Å; T725-V727 VanDerWaalsContact O-N 3.15Å; V727-R729 VanDerWaalsContact C-N 3.3Å; V727-E730 PolarHBondContact O-N 3.47Å; V727-A731 VanDerWaalsContact O-CB 3.3Å; V727-A731 WeakPolarHBondContact O-CB 3.32Å; V727-A731 PolarHBondContact O-N 3.01Å
728	S	78.3	Confident	82.5	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-42.5	172.1	62.9	0	0	0	0	109.9	D703 G704 S719 T725 E730 A731 A732	D703-S728 VanDerWaalsContact O-CB 3.27Å; D703-S728 WeakPolarHBondContact O-CB 3.39Å; D703-S728 PolarHBondContact O-OG 3.4Å; G704-S728 WeakPolarHBondContact O-CB 3.47Å; S719-S728 PolarHBondContact OG-OG 3.4Å; S719-S728 VanDerWaalsContact OG-OG 3.13Å; T725-S728 PolarHBondContact N-OG 3.22Å; T725-S728 PolarHBondContact O-N 3.14Å; T725-S728 PolarHBondContact O-OG 2.99Å; T725-S728 PolarHBondContact OG1-N 2.99Å; T725-S728 PolarHBondContact OG1-OG 3.11Å; T725-S728 VanDerWaalsContact OG1-OG 3.1Å; S728-E730 VanDerWaalsContact C-N 3.3Å; S728-E730 PolarHBondContact O-N 3.07Å; S728-A731 PolarHBondContact O-N 3.15Å; S728-A732 VanDerWaalsContact O-CB 3.22Å; S728-A732 WeakPolarHBondContact O-CB 3.45Å; S728-A732 PolarHBondContact O-N 3.43Å
729	R	81.2	Confident	82.1	Confident	88 Å²	88	31.6 Å²	31.6	33%	0.332	17%	0.174	S	C	.	.	H	α-helix	trans	-63.8	-30.2	172.9	-67.9	-170.4	-55	155.8	6.3	112.7	K341 S719 M720 G721 G724 T725 D726 V727 I735	K341-R729 WeakPolarHBondContact CE-O 3.15Å; K341-R729 PolarHBondContact NZ-O 2.78Å; S719-R729 WeakPolarHBondContact OG-CG 3.19Å; S719-R729 PolarHBondContact OG-N 3.11Å; M720-R729 WeakPolarHBondContact O-CG 3.43Å; G721-R729 PolarHBondContact O-NH1 2.67Å; G724-R729 WeakPolarHBondContact O-CD 3.43Å; G724-R729 PolarHBondContact O-NE 3.34Å; T725-R729 WeakPolarHBondContact O-CB 3.3Å; T725-R729 WeakPolarHBondContact O-CG 3.45Å; T725-R729 PolarHBondContact O-N 3.05Å; D726-R729 IonicContact OD1-CZ 3.59Å; D726-R729 IonicContact OD1-NE 2.7Å; D726-R729 IonicContact OD1-NH2 2.65Å; D726-R729 PolarHBondContact OD1-NH2 3.35Å; V727-R729 VanDerWaalsContact C-N 3.3Å; R729-I735 HydrophobicContact CB-CD1 4.14Å; R729-I735 HydrophobicContact CG-CD1 4.47Å; R729-I735 HydrophobicContact CG-CG2 4.49Å
730	E	75.7	Confident	81.7	Confident	106 Å²	106	34.1 Å²	34.1	50%	0.495	19%	0.187	S	C	.	.	H	α-helix	trans	-75.9	-44.9	172.5	-170.2	-178.4	170.1	0	0	112.5	K341 D726 V727 S728	K341-E730 VanDerWaalsContact NZ-C 3.26Å; K341-E730 PolarHBondContact NZ-O 3.06Å; D726-E730 VanDerWaalsContact O-CB 3.32Å; D726-E730 WeakPolarHBondContact O-CB 3.44Å; D726-E730 PolarHBondContact O-N 2.86Å; V727-E730 PolarHBondContact O-N 3.47Å; S728-E730 VanDerWaalsContact C-N 3.3Å; S728-E730 PolarHBondContact O-N 3.07Å
731	A	78.4	Confident	81.3	Confident	5 Å²	5	34.2 Å²	34.2	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-68.6	-35.1	-177.4	0	0	0	0	0	113.4	M256 A708 L711 K712 V727 S728	M256-A731 HydrophobicContact CE-CB 4.08Å; M256-A731 HydrophobicContact CG-CB 4Å; M256-A731 HydrophobicContact SD-CB 3.87Å; A708-A731 HydrophobicContact CB-CB 3.85Å; A708-A731 WeakPolarHBondContact O-CB 3.27Å; L711-A731 HydrophobicContact CB-CB 4.45Å; K712-A731 HydrophobicContact CB-CB 4.48Å; V727-A731 VanDerWaalsContact O-CB 3.3Å; V727-A731 WeakPolarHBondContact O-CB 3.32Å; V727-A731 PolarHBondContact O-N 3.01Å; S728-A731 PolarHBondContact O-N 3.15Å
732	A	86	Confident	81.4	Confident	2 Å²	2	38.9 Å²	38.9	2%	0.017	20%	0.203	C	C	.	.			trans	-71.6	148.1	-178.3	0	0	0	0	0	113.7	K341 G717 S728 M734	K341-A732 WeakPolarHBondContact CD-O 3.33Å; K341-A732 WeakPolarHBondContact CE-O 3.5Å; K341-A732 PolarHBondContact NZ-O 2.92Å; G717-A732 WeakPolarHBondContact O-CB 3.26Å; S728-A732 VanDerWaalsContact O-CB 3.22Å; S728-A732 WeakPolarHBondContact O-CB 3.45Å; S728-A732 PolarHBondContact O-N 3.43Å; A732-M734 WeakPolarHBondContact CB-O 3.22Å
733	D	87.5	Confident	81.8	Confident	8 Å²	8	34.9 Å²	34.9	4%	0.043	18%	0.175	C	C	.	.	S	Bend	trans	-83.9	-22.1	173.2	-54.9	-69.9	0	0	0	112.7	V340 K341 K342 T345 G717	V340-D733 CarbonylContact C-O 3.55Å; K341-D733 PolarHBondContact N-O 3.17Å; K342-D733 WeakPolarHBondContact CD-OD1 3.5Å; K342-D733 WeakPolarHBondContact CE-OD1 3.49Å; K342-D733 IonicContact NZ-OD1 2.64Å; K342-D733 PolarHBondContact NZ-OD1 3.09Å; T345-D733 HydrophobicContact CG2-CB 3.84Å; G717-D733 PolarHBondContact N-OD2 3.08Å; G717-D733 PolarHBondContact O-N 3.37Å
734	M	90.1	Very high	82.2	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	145.3	-177.5	174.1	170	144.2	0	0	110.8	V338 I339 V340 L349 G717 I718 S719 A732 L736 I744 A747	V338-M734 HydrophobicContact CG1-CE 3.61Å; V338-M734 HydrophobicContact CG1-CG 3.68Å; V338-M734 HydrophobicContact CG1-SD 3.66Å; V338-M734 HydrophobicContact CG2-CE 4.28Å; I339-M734 CarbonylContact O-C 3.54Å; I339-M734 VanDerWaalsContact O-CA 3.27Å; I339-M734 WeakPolarHBondContact O-CA 3.48Å; V340-M734 HydrophobicContact CG2-CB 4.48Å; V340-M734 HydrophobicContact CG2-CG 4.27Å; V340-M734 HydrophobicContact CG2-SD 4.41Å; L349-M734 HydrophobicContact CD1-SD 3.78Å; L349-M734 HydrophobicContact CD2-SD 3.77Å; L349-M734 HydrophobicContact CG-SD 4.4Å; G717-M734 PolarHBondContact O-N 2.88Å; I718-M734 CarbonylContact C-O 3.59Å; I718-M734 WeakPolarHBondContact CA-O 3.39Å; I718-M734 HydrophobicContact CD1-CE 4.18Å; I718-M734 HydrophobicContact CD1-SD 4.36Å; I718-M734 HydrophobicContact CG1-CB 4.24Å; I718-M734 HydrophobicContact CG1-CG 4.46Å; I718-M734 HydrophobicContact CG1-SD 4.33Å; I718-M734 HydrophobicContact CG2-CE 4.13Å; I718-M734 HydrophobicContact CG2-CG 4.29Å; S719-M734 PolarHBondContact N-O 3.34Å; A732-M734 WeakPolarHBondContact CB-O 3.22Å; M734-L736 HydrophobicContact CE-CD2 3.49Å; M734-L736 VanDerWaalsContact CE-CD2 3.49Å; M734-I744 HydrophobicContact CE-CG1 4.32Å; M734-A747 HydrophobicContact CE-CB 3.89Å; M734-A747 HydrophobicContact SD-CB 4.21Å
735	I	90	Very high	82.7	Confident	22 Å²	22	36.1 Å²	36.1	11%	0.113	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.8	-179.6	-54.3	176.1	0	0	0	110	I339 S719 R729	I339-I735 HydrophobicContact CB-CB 4.45Å; I339-I735 PolarHBondContact N-O 3Å; I339-I735 PolarHBondContact O-N 2.82Å; S719-I735 WeakPolarHBondContact O-CA 3.43Å; R729-I735 HydrophobicContact CB-CD1 4.14Å; R729-I735 HydrophobicContact CG-CD1 4.47Å; R729-I735 HydrophobicContact CG-CG2 4.49Å
736	L	91.3	Very high	83.2	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	90.8	177	-58.7	-178.7	0	0	0	110.4	V338 I718 S719 M720 G721 M734 N738 D739 A743 I744	V338-L736 HydrophobicContact CG2-CD2 4.12Å; I718-L736 HydrophobicContact CG2-CD1 3.96Å; I718-L736 HydrophobicContact CG2-CD2 4.25Å; I718-L736 HydrophobicContact CG2-CG 3.8Å; S719-L736 PolarHBondContact O-N 3.06Å; M720-L736 HydrophobicContact SD-CD1 4.13Å; G721-L736 VanDerWaalsContact CA-O 3.24Å; G721-L736 WeakPolarHBondContact CA-O 3.46Å; G721-L736 PolarHBondContact N-O 2.92Å; M734-L736 HydrophobicContact CE-CD2 3.49Å; M734-L736 VanDerWaalsContact CE-CD2 3.49Å; L736-N738 PolarHBondContact O-N 3.48Å; L736-D739 PolarHBondContact O-N 2.9Å; L736-A743 HydrophobicContact CD2-CB 4.17Å; L736-I744 HydrophobicContact CD1-CD1 4.07Å; L736-I744 HydrophobicContact CD1-CG1 3.94Å; L736-I744 HydrophobicContact CD2-CG1 4.12Å
737	L	86.6	Confident	84.2	Confident	76 Å²	76	33.1 Å²	33.1	40%	0.398	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-34.3	-174	-68.5	173.9	0	0	0	113.9	R337 I339 S722	R337-L737 HydrophobicContact CB-CB 4.28Å; R337-L737 WeakPolarHBondContact O-CB 3.26Å; R337-L737 PolarHBondContact O-N 3.1Å; R337-L737 VanDerWaalsContact O-N 3.12Å; I339-L737 HydrophobicContact CD1-CD1 4.03Å; I339-L737 HydrophobicContact CD1-CD2 3.8Å; I339-L737 HydrophobicContact CD1-CG 4.12Å; I339-L737 HydrophobicContact CG1-CD1 4.03Å; I339-L737 HydrophobicContact CG1-CD2 4.36Å; I339-L737 HydrophobicContact CG1-CG 4.15Å; S722-L737 PolarHBondContact OG-O 3.25Å
738	N	84	Confident	85.1	Confident	82 Å²	82	33 Å²	33	44%	0.439	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-1.4	-177.4	-107.8	41	0	0	0	114.4	R337 L736 D740	R337-N738 VanDerWaalsContact CD-CG 3.44Å; R337-N738 WeakPolarHBondContact CD-OD1 3.38Å; R337-N738 PolarHBondContact NH1-OD1 3.28Å; L736-N738 PolarHBondContact O-N 3.48Å; N738-D740 HydrophobicContact CB-CB 4.06Å; N738-D740 PolarHBondContact O-N 2.93Å
739	D	84.8	Confident	85.5	Confident	10 Å²	10	34.5 Å²	34.5	5%	0.053	17%	0.166	C	C	.	.			trans	53.1	29.7	-168.7	-65.2	2	0	0	0	114.1	R575 M720 G721 S722 T723 L736	R575-D739 IonicContact CZ-OD2 3.36Å; R575-D739 IonicContact NH1-OD2 3.09Å; R575-D739 PolarHBondContact NH1-OD2 2.67Å; R575-D739 IonicContact NH2-OD2 2.63Å; R575-D739 PolarHBondContact NH2-OD2 2.63Å; M720-D739 HydrophobicContact CE-CB 3.57Å; G721-D739 PolarHBondContact N-OD1 3.07Å; S722-D739 PolarHBondContact N-OD1 3.35Å; T723-D739 WeakPolarHBondContact CG2-OD2 3.19Å; T723-D739 PolarHBondContact N-OD2 3.21Å; T723-D739 PolarHBondContact OG1-OD2 2.77Å; T723-D739 VanDerWaalsContact OG1-OD2 3.11Å; L736-D739 PolarHBondContact O-N 2.9Å
740	D	82.8	Confident	85.8	Confident	53 Å²	53	31.7 Å²	31.7	28%	0.283	16%	0.156	S	C	.	.			trans	-100.5	116.9	-175	175.2	13.7	0	0	0	111.4	N738 Y742 A743	N738-D740 HydrophobicContact CB-CB 4.06Å; N738-D740 PolarHBondContact O-N 2.93Å; D740-Y742 PolarHBondContact O-N 2.99Å; D740-Y742 WeakPolarHBondContact OD1-CB 3.24Å; D740-Y742 PolarHBondContact OD1-N 2.79Å; D740-A743 WeakPolarHBondContact O-CB 3.5Å; D740-A743 PolarHBondContact O-N 2.9Å
741	F	82.1	Confident	86.5	Confident	5 Å²	5	26.7 Å²	26.7	2%	0.022	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-24	179.4	-154.7	-86.2	0	0	0	112.6	I355 L363 T578 I582 A743 I744	I355-F741 HydrophobicContact CG2-CZ 4.43Å; L363-F741 HydrophobicContact CD2-CD2 4.13Å; L363-F741 HydrophobicContact CD2-CE2 3.83Å; L363-F741 HydrophobicContact CD2-CZ 4.48Å; T578-F741 HydrophobicContact CG2-CB 4.28Å; T578-F741 HydrophobicContact CG2-CD2 4.47Å; T578-F741 HydrophobicContact CG2-CG 4.28Å; I582-F741 HydrophobicContact CG1-CD1 4.5Å; I582-F741 HydrophobicContact CG1-CE1 4.03Å; I582-F741 HydrophobicContact CG1-CZ 4.42Å; F741-A743 PolarHBondContact O-N 3.24Å; F741-I744 HydrophobicContact CD1-CD1 4.18Å; F741-I744 HydrophobicContact CD2-CD1 3.73Å; F741-I744 HydrophobicContact CE1-CD1 4.17Å; F741-I744 HydrophobicContact CE2-CD1 3.72Å; F741-I744 HydrophobicContact CG-CD1 3.97Å; F741-I744 HydrophobicContact CZ-CD1 3.95Å; F741-I744 WeakPolarHBondContact O-CB 3.48Å; F741-I744 PolarHBondContact O-N 2.55Å; F741-I744 VanDerWaalsContact O-N 3.16Å
742	Y	83.8	Confident	87	Confident	108 Å²	108	27.3 Å²	27.3	42%	0.424	14%	0.135	S	C	.	.	H	α-helix	trans	-62.6	-30	175.3	-175	-96.5	0	0	0	112	S581 D740 I744 R745 S746	S581-Y742 WeakPolarHBondContact OG-CA 3.48Å; S581-Y742 WeakPolarHBondContact OG-CB 3.45Å; S581-Y742 PolarHBondContact OG-N 3.14Å; D740-Y742 PolarHBondContact O-N 2.99Å; D740-Y742 WeakPolarHBondContact OD1-CB 3.24Å; D740-Y742 PolarHBondContact OD1-N 2.79Å; Y742-I744 PolarHBondContact O-N 2.74Å; Y742-R745 VanDerWaalsContact O-CB 3.3Å; Y742-R745 WeakPolarHBondContact O-CB 3.33Å; Y742-R745 PolarHBondContact O-N 3.01Å; Y742-R745 VanDerWaalsContact O-N 3.07Å; Y742-R745 PolarHBondContact OH-NH1 2.92Å; Y742-S746 PolarHBondContact O-N 2.87Å
743	A	87.8	Confident	87.1	Confident	9 Å²	9	27.2 Å²	27.2	7%	0.074	13%	0.134	C	C	.	.	H	α-helix	trans	-63.7	-27.8	178.4	0	0	0	0	0	112.4	V338 L736 D740 F741 S746 A747	V338-A743 HydrophobicContact CG2-CB 3.62Å; L736-A743 HydrophobicContact CD2-CB 4.17Å; D740-A743 WeakPolarHBondContact O-CB 3.5Å; D740-A743 PolarHBondContact O-N 2.9Å; F741-A743 PolarHBondContact O-N 3.24Å; A743-S746 WeakPolarHBondContact O-CB 3.4Å; A743-S746 PolarHBondContact O-N 3.28Å; A743-A747 PolarHBondContact O-N 3.18Å
744	I	87.9	Confident	87.2	Confident	2 Å²	2	27 Å²	27	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-62.5	-42.7	172.6	-53.7	176.9	0	0	0	110.7	I355 T701 I718 M734 L736 F741 Y742 S746 A747 I748	I355-I744 HydrophobicContact CD1-CG2 4.11Å; T701-I744 HydrophobicContact CG2-CD1 3.81Å; I718-I744 HydrophobicContact CD1-CD1 4.46Å; I718-I744 HydrophobicContact CD1-CG2 4.31Å; M734-I744 HydrophobicContact CE-CG1 4.32Å; L736-I744 HydrophobicContact CD1-CD1 4.07Å; L736-I744 HydrophobicContact CD1-CG1 3.94Å; L736-I744 HydrophobicContact CD2-CG1 4.12Å; F741-I744 HydrophobicContact CD1-CD1 4.18Å; F741-I744 HydrophobicContact CD2-CD1 3.73Å; F741-I744 HydrophobicContact CE1-CD1 4.17Å; F741-I744 HydrophobicContact CE2-CD1 3.72Å; F741-I744 HydrophobicContact CG-CD1 3.97Å; F741-I744 HydrophobicContact CZ-CD1 3.95Å; F741-I744 WeakPolarHBondContact O-CB 3.48Å; F741-I744 PolarHBondContact O-N 2.55Å; F741-I744 VanDerWaalsContact O-N 3.16Å; Y742-I744 PolarHBondContact O-N 2.74Å; I744-S746 VanDerWaalsContact C-N 3.32Å; I744-S746 PolarHBondContact O-N 2.8Å; I744-A747 WeakPolarHBondContact O-CB 3.12Å; I744-A747 PolarHBondContact O-N 2.71Å; I744-A747 VanDerWaalsContact O-N 3.08Å; I744-I748 HydrophobicContact CG2-CD1 4.02Å; I744-I748 HydrophobicContact CG2-CG1 4.43Å; I744-I748 WeakPolarHBondContact O-CG1 3.14Å; I744-I748 PolarHBondContact O-N 3.13Å
745	R	85.2	Confident	87.1	Confident	81 Å²	81	28.4 Å²	28.4	31%	0.306	14%	0.138	S	C	.	.	H	α-helix	trans	-57.7	-45.6	174.7	-178.3	-141.6	177.9	165.7	10.4	111	V584 Y742 A747 I748 V749	V584-R745 HydrophobicContact CG1-CG 3.88Å; Y742-R745 VanDerWaalsContact O-CB 3.3Å; Y742-R745 WeakPolarHBondContact O-CB 3.33Å; Y742-R745 PolarHBondContact O-N 3.01Å; Y742-R745 VanDerWaalsContact O-N 3.07Å; Y742-R745 PolarHBondContact OH-NH1 2.92Å; R745-A747 VanDerWaalsContact C-N 3.25Å; R745-A747 PolarHBondContact O-N 2.82Å; R745-I748 PolarHBondContact O-N 3.41Å; R745-V749 WeakPolarHBondContact O-CG2 2.91Å; R745-V749 PolarHBondContact O-N 3.48Å; R745-V749 VanDerWaalsContact O-N 3.12Å
746	S	85	Confident	87	Confident	28 Å²	28	28.8 Å²	28.8	20%	0.196	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-36.3	176.8	-173.9	0	0	0	0	112.1	N336 Y742 A743 I744 E750	N336-S746 PolarHBondContact ND2-OG 3.33Å; Y742-S746 PolarHBondContact O-N 2.87Å; A743-S746 WeakPolarHBondContact O-CB 3.4Å; A743-S746 PolarHBondContact O-N 3.28Å; I744-S746 VanDerWaalsContact C-N 3.32Å; I744-S746 PolarHBondContact O-N 2.8Å; S746-E750 PolarHBondContact O-N 3.05Å; S746-E750 VanDerWaalsContact O-N 3.14Å
747	A	89.5	Confident	86.8	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-70.6	-42.3	-179.6	0	0	0	0	0	112	M333 L349 M734 A743 I744 R745 V749 E750 G751	M333-A747 HydrophobicContact CE-CB 4.23Å; M333-A747 VanDerWaalsContact CE-O 3.25Å; M333-A747 WeakPolarHBondContact CE-O 3.36Å; M333-A747 HydrophobicContact SD-CB 4.36Å; L349-A747 HydrophobicContact CD1-CB 3.99Å; L349-A747 HydrophobicContact CD2-CB 4.36Å; M734-A747 HydrophobicContact CE-CB 3.89Å; M734-A747 HydrophobicContact SD-CB 4.21Å; A743-A747 PolarHBondContact O-N 3.18Å; I744-A747 WeakPolarHBondContact O-CB 3.12Å; I744-A747 PolarHBondContact O-N 2.71Å; I744-A747 VanDerWaalsContact O-N 3.08Å; R745-A747 VanDerWaalsContact C-N 3.25Å; R745-A747 PolarHBondContact O-N 2.82Å; A747-V749 VanDerWaalsContact C-N 3.34Å; A747-V749 PolarHBondContact O-N 2.91Å; A747-E750 PolarHBondContact O-N 2.87Å; A747-G751 PolarHBondContact O-N 3.13Å
748	I	89	Confident	86.9	Confident	6 Å²	6	25.3 Å²	25.3	3%	0.031	12%	0.122	C	C	.	.	H	α-helix	trans	-58.9	-44.1	173.1	-65.4	164.5	0	0	0	111	L349 I744 R745 G751 K752	L349-I748 WeakPolarHBondContact O-CG1 3.4Å; I744-I748 HydrophobicContact CG2-CD1 4.02Å; I744-I748 HydrophobicContact CG2-CG1 4.43Å; I744-I748 WeakPolarHBondContact O-CG1 3.14Å; I744-I748 PolarHBondContact O-N 3.13Å; R745-I748 PolarHBondContact O-N 3.41Å; I748-G751 PolarHBondContact O-N 2.74Å; I748-K752 HydrophobicContact CG2-CD 4.46Å; I748-K752 WeakPolarHBondContact O-CG 3.48Å; I748-K752 PolarHBondContact O-N 3.46Å
749	V	86.5	Confident	87.1	Confident	30 Å²	30	23.5 Å²	23.5	18%	0.182	11%	0.109	C	C	.	.	H	α-helix	trans	-64.1	-48.3	-179.4	166	0	0	0	0	112.3	R745 A747 G751 K752 G753 I818	R745-V749 WeakPolarHBondContact O-CG2 2.91Å; R745-V749 PolarHBondContact O-N 3.48Å; R745-V749 VanDerWaalsContact O-N 3.12Å; A747-V749 VanDerWaalsContact C-N 3.34Å; A747-V749 PolarHBondContact O-N 2.91Å; V749-G751 VanDerWaalsContact C-N 3.32Å; V749-G751 PolarHBondContact O-N 2.84Å; V749-K752 PolarHBondContact O-N 3.47Å; V749-G753 PolarHBondContact O-N 3.1Å; V749-G753 VanDerWaalsContact O-N 3.08Å; V749-I818 HydrophobicContact CG1-CD1 4.26Å; V749-I818 HydrophobicContact CG1-CG1 3.92Å; V749-I818 HydrophobicContact CG2-CG1 4.36Å; V749-I818 HydrophobicContact CG2-CG2 4Å
750	E	88.4	Confident	87.2	Confident	30 Å²	30	23.2 Å²	23.2	14%	0.14	11%	0.108	C	C	.	.	H	α-helix	trans	-65.8	-37.6	178.8	-169.9	67	-149.4	0	0	110.8	R332 M333 S746 A747 G753 I754	R332-E750 HydrophobicContact CB-CG 4.45Å; R332-E750 WeakPolarHBondContact CD-OE1 3.31Å; R332-E750 IonicContact CZ-OE1 3.88Å; R332-E750 IonicContact NE-OE1 3.54Å; R332-E750 IonicContact NH1-OE1 2.68Å; R332-E750 PolarHBondContact NH1-OE1 3.04Å; M333-E750 HydrophobicContact CE-CB 3.84Å; M333-E750 HydrophobicContact CE-CG 4.18Å; M333-E750 HydrophobicContact CG-CG 4.5Å; S746-E750 PolarHBondContact O-N 3.05Å; S746-E750 VanDerWaalsContact O-N 3.14Å; A747-E750 PolarHBondContact O-N 2.87Å; E750-G753 PolarHBondContact O-N 3.02Å; E750-I754 HydrophobicContact CG-CD1 3.89Å; E750-I754 WeakPolarHBondContact O-CB 3.44Å; E750-I754 WeakPolarHBondContact O-CG1 3.21Å; E750-I754 PolarHBondContact O-N 3.25Å
751	G	90.3	Very high	87.5	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61	-45.1	174.6	0	0	0	0	0	114	V346 A747 I748 V749 G753 I754 Y755	V346-G751 WeakPolarHBondContact O-CA 3.41Å; A747-G751 PolarHBondContact O-N 3.13Å; I748-G751 PolarHBondContact O-N 2.74Å; V749-G751 VanDerWaalsContact C-N 3.32Å; V749-G751 PolarHBondContact O-N 2.84Å; G751-G753 VanDerWaalsContact C-N 3.32Å; G751-G753 PolarHBondContact O-N 3.49Å; G751-I754 PolarHBondContact O-N 3.4Å; G751-Y755 PolarHBondContact O-N 3.09Å
752	K	88.4	Confident	87.7	Confident	18 Å²	18	20.6 Å²	20.6	8%	0.078	9%	0.094	C	C	.	.	H	α-helix	trans	-61.1	-40.9	173	-70.7	-178.8	-179.4	178.2	0	111.8	G350 I748 V749 N756 I817 Q820	G350-K752 WeakPolarHBondContact O-CE 3.44Å; G350-K752 WeakPolarHBondContact O-CG 3.45Å; I748-K752 HydrophobicContact CG2-CD 4.46Å; I748-K752 WeakPolarHBondContact O-CG 3.48Å; I748-K752 PolarHBondContact O-N 3.46Å; V749-K752 PolarHBondContact O-N 3.47Å; K752-N756 PolarHBondContact O-N 2.88Å; K752-I817 HydrophobicContact CB-CG2 3.52Å; K752-I817 HydrophobicContact CD-CG2 4.49Å; K752-Q820 PolarHBondContact NZ-O 2.7Å
753	G	88.1	Confident	88	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.1	-46.3	176	0	0	0	0	0	112.9	V749 E750 G751 Y755 N756 N757	V749-G753 PolarHBondContact O-N 3.1Å; V749-G753 VanDerWaalsContact O-N 3.08Å; E750-G753 PolarHBondContact O-N 3.02Å; G751-G753 VanDerWaalsContact C-N 3.32Å; G751-G753 PolarHBondContact O-N 3.49Å; G753-Y755 PolarHBondContact O-N 3.23Å; G753-N756 WeakPolarHBondContact O-CB 2.59Å; G753-N756 PolarHBondContact O-N 3.15Å; G753-N757 PolarHBondContact O-N 3.37Å; G753-N757 PolarHBondContact O-OD1 3.23Å
754	I	89.1	Confident	88.1	Confident	3 Å²	3	15.6 Å²	15.6	2%	0.015	7%	0.073	C	C	.	.	H	α-helix	trans	-62.3	-43.8	179	-76.5	164.5	0	0	0	111.9	T325 L326 G329 V346 E750 G751 N756 N757 I758	T325-I754 HydrophobicContact CG2-CG2 4.2Å; L326-I754 HydrophobicContact CD2-CG2 3.9Å; G329-I754 VanDerWaalsContact CA-CD1 3.45Å; V346-I754 HydrophobicContact CG1-CD1 3.37Å; E750-I754 HydrophobicContact CG-CD1 3.89Å; E750-I754 WeakPolarHBondContact O-CB 3.44Å; E750-I754 WeakPolarHBondContact O-CG1 3.21Å; E750-I754 PolarHBondContact O-N 3.25Å; G751-I754 PolarHBondContact O-N 3.4Å; I754-N756 VanDerWaalsContact C-N 3.28Å; I754-N756 PolarHBondContact O-N 3.44Å; I754-N757 PolarHBondContact O-N 3.02Å; I754-I758 HydrophobicContact CG2-CD1 3.63Å; I754-I758 HydrophobicContact CG2-CG1 4.33Å; I754-I758 VanDerWaalsContact O-CG1 3.27Å; I754-I758 WeakPolarHBondContact O-CG1 3.39Å; I754-I758 PolarHBondContact O-N 3.19Å
755	Y	88.5	Confident	88.1	Confident	30 Å²	30	15.9 Å²	15.9	12%	0.118	7%	0.074	C	C	.	.	H	α-helix	trans	-58.3	-41.2	174.6	175.7	-104.4	0	0	0	112.2	E347 G751 G753 I758 R759 R823 M829	E347-Y755 HydrophobicContact CG-CD2 4.06Å; G751-Y755 PolarHBondContact O-N 3.09Å; G753-Y755 PolarHBondContact O-N 3.23Å; Y755-I758 PolarHBondContact O-N 3.09Å; Y755-R759 WeakPolarHBondContact O-CB 3.5Å; Y755-R759 PolarHBondContact O-N 3.33Å; Y755-R823 VanDerWaalsContact CE2-NH1 3.26Å; Y755-R823 PolarHBondContact OH-NE 3.47Å; Y755-M829 HydrophobicContact CE2-CG 4.18Å; Y755-M829 WeakPolarHBondContact OH-CA 3.29Å
756	N	87	Confident	88.3	Confident	31 Å²	31	12.2 Å²	12.2	17%	0.166	6%	0.06	C	C	.	.	H	α-helix	trans	-65.5	-39.8	176.5	-175.2	74.9	0	0	0	112.4	K752 G753 I754 R759 N760 I817	K752-N756 PolarHBondContact O-N 2.88Å; G753-N756 WeakPolarHBondContact O-CB 2.59Å; G753-N756 PolarHBondContact O-N 3.15Å; I754-N756 VanDerWaalsContact C-N 3.28Å; I754-N756 PolarHBondContact O-N 3.44Å; N756-R759 WeakPolarHBondContact O-CB 3.35Å; N756-R759 PolarHBondContact O-N 3.39Å; N756-N760 PolarHBondContact O-N 3.33Å; N756-I817 HydrophobicContact CB-CD1 3.79Å
757	N	88.7	Confident	88.5	Confident	4 Å²	4	11 Å²	11	2%	0.021	5%	0.051	C	C	.	.	H	α-helix	trans	-65.1	-41.2	175	-68.2	4	0	0	0	112	G753 I754 R759 N760 F761 G809 E811	G753-N757 PolarHBondContact O-N 3.37Å; G753-N757 PolarHBondContact O-OD1 3.23Å; I754-N757 PolarHBondContact O-N 3.02Å; N757-R759 VanDerWaalsContact C-N 3.32Å; N757-R759 PolarHBondContact O-N 2.98Å; N757-N760 WeakPolarHBondContact O-CB 3.42Å; N757-N760 PolarHBondContact O-N 3.11Å; N757-N760 VanDerWaalsContact O-N 3.14Å; N757-F761 WeakPolarHBondContact O-CD1 3.46Å; N757-F761 PolarHBondContact O-N 2.94Å; N757-G809 PolarHBondContact ND2-O 2.82Å; N757-E811 PolarHBondContact ND2-O 2.88Å
758	I	88.7	Confident	88.5	Confident	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-61.5	-42.4	174.8	-65	164.5	0	0	0	110.3	L266 V322 T325 L326 I754 Y755 N760 F761 V762 M829	L266-I758 HydrophobicContact CD1-CD1 4.38Å; L266-I758 HydrophobicContact CD1-CG2 4.3Å; L266-I758 HydrophobicContact CD2-CD1 4.06Å; V322-I758 HydrophobicContact CG2-CG2 4.2Å; T325-I758 HydrophobicContact CG2-CG1 4.07Å; L326-I758 HydrophobicContact CD2-CD1 4.34Å; I754-I758 HydrophobicContact CG2-CD1 3.63Å; I754-I758 HydrophobicContact CG2-CG1 4.33Å; I754-I758 VanDerWaalsContact O-CG1 3.27Å; I754-I758 WeakPolarHBondContact O-CG1 3.39Å; I754-I758 PolarHBondContact O-N 3.19Å; Y755-I758 PolarHBondContact O-N 3.09Å; I758-N760 VanDerWaalsContact C-N 3.32Å; I758-N760 PolarHBondContact O-N 2.7Å; I758-F761 HydrophobicContact CB-CE1 4.02Å; I758-F761 HydrophobicContact CB-CZ 4.44Å; I758-F761 HydrophobicContact CG1-CE1 3.82Å; I758-F761 HydrophobicContact CG1-CZ 4.36Å; I758-F761 HydrophobicContact CG2-CE1 4.15Å; I758-F761 HydrophobicContact CG2-CZ 4.06Å; I758-F761 PolarHBondContact O-N 2.85Å; I758-V762 HydrophobicContact CG2-CG2 4.35Å; I758-V762 WeakPolarHBondContact O-CB 3.01Å; I758-V762 VanDerWaalsContact O-CG2 3.32Å; I758-V762 WeakPolarHBondContact O-CG2 3Å; I758-V762 PolarHBondContact O-N 3.48Å; I758-M829 HydrophobicContact CG2-CE 3.64Å
759	R	87.9	Confident	88.3	Confident	45 Å²	45	10.8 Å²	10.8	17%	0.17	5%	0.05	C	C	.	.	H	α-helix	trans	-62.3	-34.8	173.5	-169.5	177.5	178.3	-144.5	-5.4	113.1	Y755 N756 N757 R763 M829 T831 Q888	Y755-R759 WeakPolarHBondContact O-CB 3.5Å; Y755-R759 PolarHBondContact O-N 3.33Å; N756-R759 WeakPolarHBondContact O-CB 3.35Å; N756-R759 PolarHBondContact O-N 3.39Å; N757-R759 VanDerWaalsContact C-N 3.32Å; N757-R759 PolarHBondContact O-N 2.98Å; R759-R763 VanDerWaalsContact O-CB 3.25Å; R759-R763 WeakPolarHBondContact O-CB 3.27Å; R759-R763 PolarHBondContact O-N 3.5Å; R759-R763 VanDerWaalsContact O-N 3.13Å; R759-M829 HydrophobicContact CB-CE 4.34Å; R759-M829 PolarHBondContact NE-O 3.28Å; R759-T831 PolarHBondContact NH2-OG1 2.83Å; R759-Q888 VanDerWaalsContact NH1-NE2 3.19Å
760	N	86.5	Confident	88.4	Confident	4 Å²	4	12.4 Å²	12.4	2%	0.021	6%	0.058	C	C	.	.	H	α-helix	trans	-71.3	-44	177.9	-75.3	-9.6	0	0	0	113.1	N756 N757 I758 R763 F764 C885 R886	N756-N760 PolarHBondContact O-N 3.33Å; N757-N760 WeakPolarHBondContact O-CB 3.42Å; N757-N760 PolarHBondContact O-N 3.11Å; N757-N760 VanDerWaalsContact O-N 3.14Å; I758-N760 VanDerWaalsContact C-N 3.32Å; I758-N760 PolarHBondContact O-N 2.7Å; N760-R763 WeakPolarHBondContact O-CB 3.23Å; N760-F764 PolarHBondContact O-N 3.06Å; N760-C885 WeakPolarHBondContact CB-O 3.37Å; N760-R886 PolarHBondContact ND2-O 2.93Å; N760-R886 VanDerWaalsContact ND2-O 3.1Å
761	F	88.3	Confident	88.5	Confident	0 Å²	0	11 Å²	11	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-77	-34	178.4	80.4	-113	0	0	0	113.1	L318 I321 V322 N757 I758 R763 F764 Q765 A805 L808	L318-F761 HydrophobicContact CG-CE2 4.32Å; I321-F761 HydrophobicContact CB-CD2 4.45Å; I321-F761 HydrophobicContact CB-CE2 3.93Å; I321-F761 HydrophobicContact CB-CZ 3.97Å; I321-F761 HydrophobicContact CG2-CD1 3.85Å; I321-F761 HydrophobicContact CG2-CD2 3.85Å; I321-F761 HydrophobicContact CG2-CE1 3.61Å; I321-F761 HydrophobicContact CG2-CE2 3.65Å; I321-F761 HydrophobicContact CG2-CG 3.98Å; I321-F761 HydrophobicContact CG2-CZ 3.53Å; V322-F761 HydrophobicContact CB-CZ 4.49Å; V322-F761 HydrophobicContact CG2-CE2 4.4Å; V322-F761 HydrophobicContact CG2-CZ 3.72Å; N757-F761 WeakPolarHBondContact O-CD1 3.46Å; N757-F761 PolarHBondContact O-N 2.94Å; I758-F761 HydrophobicContact CB-CE1 4.02Å; I758-F761 HydrophobicContact CB-CZ 4.44Å; I758-F761 HydrophobicContact CG1-CE1 3.82Å; I758-F761 HydrophobicContact CG1-CZ 4.36Å; I758-F761 HydrophobicContact CG2-CE1 4.15Å; I758-F761 HydrophobicContact CG2-CZ 4.06Å; I758-F761 PolarHBondContact O-N 2.85Å; F761-R763 VanDerWaalsContact C-N 3.31Å; F761-R763 PolarHBondContact O-N 3.19Å; F761-F764 WeakPolarHBondContact O-CB 3.34Å; F761-F764 PolarHBondContact O-N 2.87Å; F761-F764 VanDerWaalsContact O-N 3.12Å; F761-Q765 PolarHBondContact O-N 3.22Å; F761-A805 HydrophobicContact CB-CB 4.22Å; F761-A805 WeakPolarHBondContact CB-O 3.21Å; F761-L808 HydrophobicContact CB-CB 3.75Å; F761-L808 HydrophobicContact CB-CD1 4.06Å
762	V	88.2	Confident	88.3	Confident	2 Å²	2	11.2 Å²	11.2	1%	0.012	5%	0.053	C	C	.	.	H	α-helix	trans	-65.4	-36.7	174.1	168.2	0	0	0	0	110.8	L273 L318 I758 F764 L766 M829	L273-V762 HydrophobicContact CD2-CG1 3.8Å; L318-V762 HydrophobicContact CD1-CG1 4.39Å; L318-V762 HydrophobicContact CD1-CG2 3.83Å; L318-V762 HydrophobicContact CD2-CG2 4.26Å; L318-V762 HydrophobicContact CG-CG2 3.97Å; I758-V762 HydrophobicContact CG2-CG2 4.35Å; I758-V762 WeakPolarHBondContact O-CB 3.01Å; I758-V762 VanDerWaalsContact O-CG2 3.32Å; I758-V762 WeakPolarHBondContact O-CG2 3Å; I758-V762 PolarHBondContact O-N 3.48Å; V762-F764 VanDerWaalsContact C-N 3.32Å; V762-F764 PolarHBondContact O-N 3.11Å; V762-L766 HydrophobicContact CG1-CD1 3.55Å; V762-L766 HydrophobicContact CG1-CG 4.12Å; V762-L766 VanDerWaalsContact O-CB 3.27Å; V762-L766 WeakPolarHBondContact O-CB 3.43Å; V762-L766 WeakPolarHBondContact O-CD1 3.45Å; V762-L766 WeakPolarHBondContact O-CG 3.49Å; V762-L766 PolarHBondContact O-N 2.73Å; V762-M829 HydrophobicContact CB-CE 3.61Å; V762-M829 HydrophobicContact CG1-CE 3.86Å; V762-M829 HydrophobicContact CG2-CE 3.66Å
763	R	88.8	Confident	88.2	Confident	13 Å²	13	11 Å²	11	5%	0.049	5%	0.053	C	C	.	.	H	α-helix	trans	-55.6	-45.2	169.1	169.9	-160.8	173.4	102.5	2.5	112.1	R759 N760 F761 S767 V834 S837 I838 C885	R759-R763 VanDerWaalsContact O-CB 3.25Å; R759-R763 WeakPolarHBondContact O-CB 3.27Å; R759-R763 PolarHBondContact O-N 3.5Å; R759-R763 VanDerWaalsContact O-N 3.13Å; N760-R763 WeakPolarHBondContact O-CB 3.23Å; F761-R763 VanDerWaalsContact C-N 3.31Å; F761-R763 PolarHBondContact O-N 3.19Å; R763-S767 PolarHBondContact O-N 3.15Å; R763-S767 PolarHBondContact O-OG 2.64Å; R763-V834 HydrophobicContact CB-CG1 4.24Å; R763-V834 HydrophobicContact CG-CG1 4.34Å; R763-S837 PolarHBondContact NH1-OG 3.48Å; R763-S837 VanDerWaalsContact NH2-CB 3.32Å; R763-S837 PolarHBondContact NH2-OG 2.95Å; R763-I838 HydrophobicContact CG-CG1 4.27Å; R763-C885 PolarHBondContact NE-SG 3.05Å
764	F	89.8	Confident	88.2	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.1	-56	178.7	163.2	-113	0	0	0	111.9	N760 F761 V762 L766 S767 T768 D801 P804 A805 L808 D878 N881 A882 C885	N760-F764 PolarHBondContact O-N 3.06Å; F761-F764 WeakPolarHBondContact O-CB 3.34Å; F761-F764 PolarHBondContact O-N 2.87Å; F761-F764 VanDerWaalsContact O-N 3.12Å; V762-F764 VanDerWaalsContact C-N 3.32Å; V762-F764 PolarHBondContact O-N 3.11Å; F764-L766 PolarHBondContact O-N 2.86Å; F764-S767 PolarHBondContact O-N 2.8Å; F764-S767 VanDerWaalsContact O-N 3.15Å; F764-S767 PolarHBondContact O-OG 3.17Å; F764-T768 PolarHBondContact O-N 3.33Å; F764-T768 VanDerWaalsContact O-N 3.17Å; F764-T768 PolarHBondContact O-OG1 2.87Å; F764-D801 HydrophobicContact CE1-CB 4.08Å; F764-D801 HydrophobicContact CZ-CB 4.29Å; F764-P804 HydrophobicContact CE1-CB 4.34Å; F764-A805 HydrophobicContact CD1-CB 3.94Å; F764-A805 HydrophobicContact CE1-CB 4.05Å; F764-L808 HydrophobicContact CB-CD1 3.88Å; F764-L808 HydrophobicContact CD1-CD1 4.08Å; F764-L808 HydrophobicContact CG-CD1 4.11Å; F764-D878 HydrophobicContact CE2-CB 4.19Å; F764-D878 WeakPolarHBondContact CE2-O 3.23Å; F764-D878 HydrophobicContact CZ-CB 4.44Å; F764-N881 HydrophobicContact CD2-CB 4.37Å; F764-N881 WeakPolarHBondContact CD2-ND2 3.49Å; F764-N881 HydrophobicContact CE2-CB 4.45Å; F764-A882 HydrophobicContact CD2-CB 3.85Å; F764-A882 HydrophobicContact CE2-CB 3.7Å; F764-A882 HydrophobicContact CG-CB 4.36Å; F764-A882 HydrophobicContact CZ-CB 4.05Å; F764-C885 HydrophobicContact CB-CB 3.9Å
765	Q	88.8	Confident	88.2	Confident	7 Å²	7	13.2 Å²	13.2	3%	0.033	7%	0.066	C	C	.	.	H	α-helix	trans	-55.9	-40.2	179.9	-69.6	-175	-56.5	0	0	111.9	F761 T768 S769 A805	F761-Q765 PolarHBondContact O-N 3.22Å; Q765-T768 PolarHBondContact O-N 2.75Å; Q765-S769 PolarHBondContact O-N 2.74Å; Q765-S769 PolarHBondContact O-OG 2.75Å; Q765-S769 VanDerWaalsContact O-OG 3.07Å; Q765-A805 HydrophobicContact CG-CB 4.12Å
766	L	88.3	Confident	88	Confident	5 Å²	5	12.1 Å²	12.1	3%	0.026	6%	0.063	C	C	.	.	H	α-helix	trans	-69.8	-36.1	-180	-69.3	172.9	0	0	0	113.7	L273 L277 V762 F764 T768 I770 I830 I838	L273-L766 HydrophobicContact CD1-CD1 4.38Å; L277-L766 HydrophobicContact CD1-CD2 4Å; L277-L766 HydrophobicContact CD2-CD2 3.7Å; L277-L766 HydrophobicContact CG-CD2 4.21Å; V762-L766 HydrophobicContact CG1-CD1 3.55Å; V762-L766 HydrophobicContact CG1-CG 4.12Å; V762-L766 VanDerWaalsContact O-CB 3.27Å; V762-L766 WeakPolarHBondContact O-CB 3.43Å; V762-L766 WeakPolarHBondContact O-CD1 3.45Å; V762-L766 WeakPolarHBondContact O-CG 3.49Å; V762-L766 PolarHBondContact O-N 2.73Å; F764-L766 PolarHBondContact O-N 2.86Å; L766-T768 VanDerWaalsContact C-N 3.32Å; L766-I770 VanDerWaalsContact O-CB 3.23Å; L766-I770 WeakPolarHBondContact O-CB 3.47Å; L766-I770 WeakPolarHBondContact O-CD1 3.44Å; L766-I770 WeakPolarHBondContact O-CG1 3.32Å; L766-I770 PolarHBondContact O-N 2.96Å; L766-I830 HydrophobicContact CD1-CD1 3.41Å; L766-I830 VanDerWaalsContact CD1-CD1 3.41Å; L766-I830 HydrophobicContact CD1-CG1 4.22Å; L766-I838 HydrophobicContact CB-CD1 3.88Å; L766-I838 HydrophobicContact CB-CG1 4.5Å; L766-I838 HydrophobicContact CB-CG2 4.45Å; L766-I838 HydrophobicContact CD1-CD1 4.01Å
767	S	89.7	Confident	87.9	Confident	1 Å²	1	11.8 Å²	11.8	1%	0.007	6%	0.064	C	C	.	.	H	α-helix	trans	-67.5	-36.2	174.2	45.6	0	0	0	0	111.6	R763 F764 A771 A842 N881	R763-S767 PolarHBondContact O-N 3.15Å; R763-S767 PolarHBondContact O-OG 2.64Å; F764-S767 PolarHBondContact O-N 2.8Å; F764-S767 VanDerWaalsContact O-N 3.15Å; F764-S767 PolarHBondContact O-OG 3.17Å; S767-A771 VanDerWaalsContact O-CB 3.26Å; S767-A771 WeakPolarHBondContact O-CB 3.49Å; S767-A771 PolarHBondContact O-N 3.31Å; S767-A842 WeakPolarHBondContact O-CB 3.37Å; S767-N881 PolarHBondContact OG-ND2 2.86Å; S767-N881 PolarHBondContact OG-OD1 3.14Å
768	T	88.5	Confident	87.9	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-69.3	-51.1	176.2	-58.7	0	0	0	0	112.5	F764 Q765 L766 I770 A771 A772 I796 D801 F874 D878 N881	F764-T768 PolarHBondContact O-N 3.33Å; F764-T768 VanDerWaalsContact O-N 3.17Å; F764-T768 PolarHBondContact O-OG1 2.87Å; Q765-T768 PolarHBondContact O-N 2.75Å; L766-T768 VanDerWaalsContact C-N 3.32Å; T768-I770 VanDerWaalsContact C-N 3.34Å; T768-I770 PolarHBondContact O-N 3.18Å; T768-A771 WeakPolarHBondContact O-CB 3.49Å; T768-A771 PolarHBondContact O-N 3.31Å; T768-A771 VanDerWaalsContact O-N 3.17Å; T768-A772 PolarHBondContact O-N 2.89Å; T768-I796 HydrophobicContact CG2-CG2 4.16Å; T768-D801 VanDerWaalsContact CG2-OD2 3.29Å; T768-D801 WeakPolarHBondContact CG2-OD2 3.33Å; T768-F874 HydrophobicContact CG2-CE1 3.83Å; T768-F874 HydrophobicContact CG2-CZ 4.34Å; T768-D878 WeakPolarHBondContact CB-OD1 3.45Å; T768-D878 WeakPolarHBondContact CG2-OD1 3.03Å; T768-D878 PolarHBondContact OG1-OD1 3.15Å; T768-N881 PolarHBondContact OG1-ND2 2.78Å
769	S	85.9	Confident	87.9	Confident	3 Å²	3	13 Å²	13	2%	0.021	7%	0.072	C	C	.	.	H	α-helix	trans	-61.2	-40.1	177	-54.6	0	0	0	0	112.4	Q765 A772 L773	Q765-S769 PolarHBondContact O-N 2.74Å; Q765-S769 PolarHBondContact O-OG 2.75Å; Q765-S769 VanDerWaalsContact O-OG 3.07Å; S769-A772 PolarHBondContact O-N 2.9Å; S769-L773 WeakPolarHBondContact O-CB 3.34Å; S769-L773 WeakPolarHBondContact O-CD1 3.23Å; S769-L773 VanDerWaalsContact O-CG 3.23Å; S769-L773 WeakPolarHBondContact O-CG 3.16Å; S769-L773 PolarHBondContact O-N 2.96Å
770	I	88.4	Confident	87.7	Confident	65 Å²	65	10.9 Å²	10.9	33%	0.333	6%	0.064	S	C	.	.	H	α-helix	trans	-68.9	-36.1	176.8	-68	168.7	0	0	0	111.2	L766 T768 T774 I838 A842	L766-I770 VanDerWaalsContact O-CB 3.23Å; L766-I770 WeakPolarHBondContact O-CB 3.47Å; L766-I770 WeakPolarHBondContact O-CD1 3.44Å; L766-I770 WeakPolarHBondContact O-CG1 3.32Å; L766-I770 PolarHBondContact O-N 2.96Å; T768-I770 VanDerWaalsContact C-N 3.34Å; T768-I770 PolarHBondContact O-N 3.18Å; I770-T774 VanDerWaalsContact O-CB 3.3Å; I770-T774 WeakPolarHBondContact O-CB 3.47Å; I770-T774 PolarHBondContact O-N 3.22Å; I770-T774 PolarHBondContact O-OG1 3.06Å; I770-I838 HydrophobicContact CD1-CG2 3.75Å; I770-A842 HydrophobicContact CB-CB 4.17Å; I770-A842 HydrophobicContact CG2-CB 3.87Å
771	A	90.2	Very high	87.7	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62	-48.1	172.9	0	0	0	0	0	111.4	S767 T768 T774 L775 A842 I845 F874	S767-A771 VanDerWaalsContact O-CB 3.26Å; S767-A771 WeakPolarHBondContact O-CB 3.49Å; S767-A771 PolarHBondContact O-N 3.31Å; T768-A771 WeakPolarHBondContact O-CB 3.49Å; T768-A771 PolarHBondContact O-N 3.31Å; T768-A771 VanDerWaalsContact O-N 3.17Å; A771-T774 PolarHBondContact O-N 2.82Å; A771-L775 WeakPolarHBondContact O-CB 3.29Å; A771-L775 PolarHBondContact O-N 3Å; A771-A842 HydrophobicContact CB-CB 4.3Å; A771-I845 HydrophobicContact CB-CB 3.92Å; A771-I845 HydrophobicContact CB-CD1 4.37Å; A771-I845 HydrophobicContact CB-CG2 3.73Å; A771-F874 HydrophobicContact CB-CE2 4.14Å; A771-F874 HydrophobicContact CB-CZ 4.04Å
772	A	86.9	Confident	87.6	Confident	5 Å²	5	22 Å²	22	4%	0.041	12%	0.116	C	C	.	.	H	α-helix	trans	-60.8	-48.1	178.6	0	0	0	0	0	112.1	T768 S769 T774 L775 V776 I793 F874	T768-A772 PolarHBondContact O-N 2.89Å; S769-A772 PolarHBondContact O-N 2.9Å; A772-T774 PolarHBondContact O-N 3.33Å; A772-L775 PolarHBondContact O-N 2.86Å; A772-V776 PolarHBondContact O-N 3.17Å; A772-V776 VanDerWaalsContact O-N 3.12Å; A772-I793 HydrophobicContact CB-CG2 4.47Å; A772-F874 HydrophobicContact CB-CE2 4.26Å; A772-F874 HydrophobicContact CB-CZ 3.78Å
773	L	85.8	Confident	87.4	Confident	14 Å²	14	28.5 Å²	28.5	7%	0.073	15%	0.145	C	C	.	.	H	α-helix	trans	-58.7	-46.5	176.9	-74.5	164.7	0	0	0	112.2	L309 A313 S769 A777	L309-L773 HydrophobicContact CD1-CD2 3.73Å; L309-L773 HydrophobicContact CD2-CD2 4.1Å; L309-L773 HydrophobicContact CG-CD2 3.63Å; A313-L773 HydrophobicContact CB-CD1 3.86Å; A313-L773 HydrophobicContact CB-CD2 3.53Å; A313-L773 HydrophobicContact CB-CG 4.16Å; S769-L773 WeakPolarHBondContact O-CB 3.34Å; S769-L773 WeakPolarHBondContact O-CD1 3.23Å; S769-L773 VanDerWaalsContact O-CG 3.23Å; S769-L773 WeakPolarHBondContact O-CG 3.16Å; S769-L773 PolarHBondContact O-N 2.96Å; L773-A777 WeakPolarHBondContact O-CB 3.22Å; L773-A777 PolarHBondContact O-N 3.42Å
774	T	87.7	Confident	87.1	Confident	49 Å²	49	29.2 Å²	29.2	30%	0.301	15%	0.149	S	C	.	.	H	α-helix	trans	-72	-34	-177.9	-46.9	0	0	0	0	111.3	I770 A771 A772 A777 V778 L846	I770-T774 VanDerWaalsContact O-CB 3.3Å; I770-T774 WeakPolarHBondContact O-CB 3.47Å; I770-T774 PolarHBondContact O-N 3.22Å; I770-T774 PolarHBondContact O-OG1 3.06Å; A771-T774 PolarHBondContact O-N 2.82Å; A772-T774 PolarHBondContact O-N 3.33Å; T774-A777 PolarHBondContact O-N 3.25Å; T774-V778 HydrophobicContact CG2-CG2 3.99Å; T774-V778 VanDerWaalsContact O-CB 3.25Å; T774-V778 WeakPolarHBondContact O-CB 3.31Å; T774-V778 WeakPolarHBondContact O-CG2 3.3Å; T774-V778 PolarHBondContact O-N 2.94Å; T774-L846 HydrophobicContact CG2-CD1 4.32Å; T774-L846 HydrophobicContact CG2-CD2 3.51Å
775	L	89.6	Confident	86.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-47	175.6	178.7	62.2	0	0	0	111.3	A771 A772 S779 P787 L788 L846 L850 F874	A771-L775 WeakPolarHBondContact O-CB 3.29Å; A771-L775 PolarHBondContact O-N 3Å; A772-L775 PolarHBondContact O-N 2.86Å; L775-S779 WeakPolarHBondContact O-CB 3.4Å; L775-S779 PolarHBondContact O-N 3.2Å; L775-S779 PolarHBondContact O-OG 2.8Å; L775-P787 HydrophobicContact CD1-CG 4.04Å; L775-P787 HydrophobicContact CD2-CG 4.07Å; L775-P787 HydrophobicContact CG-CG 3.7Å; L775-L788 HydrophobicContact CD2-CD1 4.03Å; L775-L788 HydrophobicContact CD2-CG 4.46Å; L775-L846 HydrophobicContact CB-CD1 3.92Å; L775-L846 HydrophobicContact CD1-CD1 4.17Å; L775-L850 HydrophobicContact CD1-CB 4.2Å; L775-L850 HydrophobicContact CD1-CD1 4.33Å; L775-F874 HydrophobicContact CD2-CD2 3.92Å; L775-F874 HydrophobicContact CD2-CE2 4.11Å
776	V	84.9	Confident	86.2	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.042	17%	0.173	C	C	.	.	H	α-helix	trans	-67	-39.7	175.7	177.9	0	0	0	0	111.6	I305 L309 A772 T780 I793	I305-V776 HydrophobicContact CG2-CG1 4.41Å; L309-V776 HydrophobicContact CD1-CB 4.11Å; L309-V776 HydrophobicContact CD1-CG1 4.29Å; L309-V776 HydrophobicContact CD1-CG2 4.12Å; L309-V776 HydrophobicContact CD2-CB 4.31Å; L309-V776 HydrophobicContact CD2-CG1 3.98Å; A772-V776 PolarHBondContact O-N 3.17Å; A772-V776 VanDerWaalsContact O-N 3.12Å; V776-T780 WeakPolarHBondContact O-CB 3.38Å; V776-T780 PolarHBondContact O-N 1.78Å; V776-T780 PolarHBondContact O-OG1 2.87Å; V776-I793 HydrophobicContact CG2-CD1 4.09Å
777	A	85.3	Confident	86	Confident	23 Å²	23	33 Å²	33	19%	0.19	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-47.4	176.5	0	0	0	0	0	112.6	V284 I288 L773 T774 T780 L781	V284-A777 HydrophobicContact CG1-CB 4.33Å; I288-A777 HydrophobicContact CD1-CB 3.84Å; I288-A777 HydrophobicContact CG1-CB 4.05Å; L773-A777 WeakPolarHBondContact O-CB 3.22Å; L773-A777 PolarHBondContact O-N 3.42Å; T774-A777 PolarHBondContact O-N 3.25Å; A777-T780 PolarHBondContact O-N 3.39Å; A777-L781 WeakPolarHBondContact O-CB 3.23Å; A777-L781 PolarHBondContact O-N 3.13Å
778	V	88.7	Confident	85.7	Confident	30 Å²	30	33.2 Å²	33.2	18%	0.182	17%	0.173	C	C	.	.	H	α-helix	trans	-68	-44.6	-179.1	169	0	0	0	0	111	T774 T780 L781 F782 L850	T774-V778 HydrophobicContact CG2-CG2 3.99Å; T774-V778 VanDerWaalsContact O-CB 3.25Å; T774-V778 WeakPolarHBondContact O-CB 3.31Å; T774-V778 WeakPolarHBondContact O-CG2 3.3Å; T774-V778 PolarHBondContact O-N 2.94Å; V778-T780 VanDerWaalsContact C-N 3.33Å; V778-T780 PolarHBondContact O-N 3.33Å; V778-L781 PolarHBondContact O-N 2.74Å; V778-F782 HydrophobicContact CG1-CD2 3.7Å; V778-F782 HydrophobicContact CG1-CE2 3.83Å; V778-F782 WeakPolarHBondContact O-CD2 3.31Å; V778-F782 PolarHBondContact O-N 3.11Å; V778-L850 HydrophobicContact CG1-CD2 3.69Å
779	S	86.9	Confident	85.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-41.2	175.4	-70.8	0	0	0	0	112.3	L775 F782 K783 L784	L775-S779 WeakPolarHBondContact O-CB 3.4Å; L775-S779 PolarHBondContact O-N 3.2Å; L775-S779 PolarHBondContact O-OG 2.8Å; S779-F782 PolarHBondContact O-N 3.34Å; S779-K783 PolarHBondContact O-N 3.27Å; S779-L784 WeakPolarHBondContact O-CB 3.13Å; S779-L784 PolarHBondContact O-N 2.96Å
780	T	83.8	Confident	84.4	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-48.7	172.8	-54.3	0	0	0	0	110.9	I288 Q295 M302 V776 A777 V778 F782 K783	I288-T780 HydrophobicContact CG2-CG2 4.26Å; Q295-T780 PolarHBondContact NE2-O 3.46Å; Q295-T780 PolarHBondContact OE1-O 2.92Å; M302-T780 HydrophobicContact CE-CG2 4.24Å; V776-T780 WeakPolarHBondContact O-CB 3.38Å; V776-T780 PolarHBondContact O-N 1.78Å; V776-T780 PolarHBondContact O-OG1 2.87Å; A777-T780 PolarHBondContact O-N 3.39Å; V778-T780 VanDerWaalsContact C-N 3.33Å; V778-T780 PolarHBondContact O-N 3.33Å; T780-F782 VanDerWaalsContact C-N 3.31Å; T780-F782 PolarHBondContact O-N 2.91Å; T780-K783 PolarHBondContact O-N 3.23Å
781	L	86.6	Confident	83.6	Confident	103 Å²	103	37 Å²	37	54%	0.539	20%	0.2	S	C	.	.	H	α-helix	trans	-58.2	-40.2	-178.4	-175.3	63.7	0	0	0	112.8	V291 Q295 A777 V778 K783	V291-L781 HydrophobicContact CG1-CD1 4.19Å; Q295-L781 PolarHBondContact NE2-O 3Å; A777-L781 WeakPolarHBondContact O-CB 3.23Å; A777-L781 PolarHBondContact O-N 3.13Å; V778-L781 PolarHBondContact O-N 2.74Å; L781-K783 VanDerWaalsContact C-N 3.27Å; L781-K783 PolarHBondContact O-N 2.87Å
782	F	87.1	Confident	83.2	Confident	133 Å²	133	37 Å²	37	58%	0.583	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	12.8	177	-73.2	-66.9	0	0	0	114.7	V778 S779 T780 L784	V778-F782 HydrophobicContact CG1-CD2 3.7Å; V778-F782 HydrophobicContact CG1-CE2 3.83Å; V778-F782 WeakPolarHBondContact O-CD2 3.31Å; V778-F782 PolarHBondContact O-N 3.11Å; S779-F782 PolarHBondContact O-N 3.34Å; T780-F782 VanDerWaalsContact C-N 3.31Å; T780-F782 PolarHBondContact O-N 2.91Å; F782-L784 HydrophobicContact CB-CD1 4.24Å; F782-L784 HydrophobicContact CB-CG 3.95Å; F782-L784 PolarHBondContact O-N 3.24Å; F782-L784 VanDerWaalsContact O-N 3.14Å
783	K	83.5	Confident	82.9	Confident	140 Å²	140	37.3 Å²	37.3	61%	0.609	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	13.1	-176.6	-68.2	-174	170.9	-168.4	0	115	Q295 R297 S779 T780 L781	Q295-K783 HydrophobicContact CG-CG 4.08Å; R297-K783 PolarHBondContact NH2-O 3.3Å; S779-K783 PolarHBondContact O-N 3.27Å; T780-K783 PolarHBondContact O-N 3.23Å; L781-K783 VanDerWaalsContact C-N 3.27Å; L781-K783 PolarHBondContact O-N 2.87Å
784	L	83.3	Confident	82.3	Confident	27 Å²	27	38.5 Å²	38.5	14%	0.141	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-67.7	152.2	179.6	-54.7	176.9	0	0	0	111.2	R297 S779 F782 L850 F853 M854	R297-L784 PolarHBondContact NH2-O 3.1Å; S779-L784 WeakPolarHBondContact O-CB 3.13Å; S779-L784 PolarHBondContact O-N 2.96Å; F782-L784 HydrophobicContact CB-CD1 4.24Å; F782-L784 HydrophobicContact CB-CG 3.95Å; F782-L784 PolarHBondContact O-N 3.24Å; F782-L784 VanDerWaalsContact O-N 3.14Å; L784-L850 HydrophobicContact CD1-CD1 4.1Å; L784-F853 HydrophobicContact CB-CE1 4.14Å; L784-F853 HydrophobicContact CD1-CD1 4.42Å; L784-F853 HydrophobicContact CD1-CE1 4.04Å; L784-M854 HydrophobicContact CD1-CE 3.53Å; L784-M854 HydrophobicContact CD1-SD 3.88Å; L784-M854 HydrophobicContact CD2-CE 4.12Å; L784-M854 HydrophobicContact CD2-SD 4.11Å; L784-M854 HydrophobicContact CG-CE 4.41Å
785	P	82.2	Confident	82	Confident	50 Å²	50	36.7 Å²	36.7	33%	0.325	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-60.1	158.8	163.6	25.4	-30.4	0	0	0	110.6	F853 I857 M862	P785-F853 HydrophobicContact CG-CZ 4.17Å; P785-F853 WeakPolarHBondContact O-CZ 3.45Å; P785-I857 HydrophobicContact CG-CD1 3.63Å; P785-M862 HydrophobicContact CB-CE 4.11Å; P785-M862 HydrophobicContact CB-CG 4.02Å; P785-M862 HydrophobicContact CB-SD 4.05Å; P785-M862 HydrophobicContact CG-CE 4.24Å; P785-M862 HydrophobicContact CG-CG 3.53Å; P785-M862 HydrophobicContact CG-SD 3.52Å; P785-M862 VanDerWaalsContact CG-SD 3.52Å
786	N	77.8	Confident	81.8	Confident	41 Å²	41	36.8 Å²	36.8	22%	0.219	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-67.8	128.8	-176.7	-63.6	-20.2	0	0	0	110	I305 L788	I305-N786 WeakPolarHBondContact CD1-ND2 3.42Å; N786-L788 VanDerWaalsContact C-N 3.34Å; N786-L788 PolarHBondContact O-N 3.06Å
787	P	83.9	Confident	81.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-77.4	-19.8	-173.8	28.7	-34.1	0	0	0	113.9	L775 F853 T870	L775-P787 HydrophobicContact CD1-CG 4.04Å; L775-P787 HydrophobicContact CD2-CG 4.07Å; L775-P787 HydrophobicContact CG-CG 3.7Å; P787-F853 HydrophobicContact CB-CD1 4.06Å; P787-F853 HydrophobicContact CB-CD2 3.77Å; P787-F853 HydrophobicContact CB-CE1 4.09Å; P787-F853 HydrophobicContact CB-CE2 3.83Å; P787-F853 HydrophobicContact CB-CG 3.88Å; P787-F853 HydrophobicContact CB-CZ 3.97Å; P787-T870 HydrophobicContact CB-CG2 4.06Å
788	L	83.3	Confident	81	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.031	21%	0.206	C	C	.	.	S	Bend	trans	-138.3	141.2	179.3	-61.6	174.7	0	0	0	108.9	L775 N786 I793 I796 T870 F871 F874	L775-L788 HydrophobicContact CD2-CD1 4.03Å; L775-L788 HydrophobicContact CD2-CG 4.46Å; N786-L788 VanDerWaalsContact C-N 3.34Å; N786-L788 PolarHBondContact O-N 3.06Å; L788-I793 HydrophobicContact CB-CD1 4.12Å; L788-I793 HydrophobicContact CB-CG1 3.76Å; L788-I793 HydrophobicContact CD1-CG1 4.2Å; L788-I796 HydrophobicContact CD1-CD1 4.33Å; L788-T870 HydrophobicContact CD2-CG2 4.23Å; L788-F871 HydrophobicContact CD2-CB 3.8Å; L788-F874 HydrophobicContact CD1-CD2 4.08Å; L788-F874 HydrophobicContact CD1-CG 4.33Å
789	N	75.2	Confident	80.6	Confident	49 Å²	49	40.9 Å²	40.9	26%	0.262	21%	0.211	S	C	.	.			trans	-82.7	154.5	175.8	-69.4	-9.4	0	0	0	111.1	M791 Q792 I793 Q927	N789-M791 VanDerWaalsContact C-N 3.26Å; N789-M791 PolarHBondContact O-N 2.68Å; N789-Q792 HydrophobicContact CB-CG 4.29Å; N789-Q792 WeakPolarHBondContact O-CA 3.38Å; N789-Q792 WeakPolarHBondContact O-CB 3.46Å; N789-Q792 PolarHBondContact O-N 2.84Å; N789-I793 PolarHBondContact O-N 2.82Å; N789-I793 VanDerWaalsContact O-N 3.1Å; N789-Q927 PolarHBondContact ND2-OE1 2.69Å
790	A	70.5	Confident	80.6	Confident	50 Å²	50	40.9 Å²	40.9	41%	0.413	21%	0.211	S	C	.	.	H	α-helix	trans	-53.1	-41.8	-178.2	0	0	0	0	0	113.2	Q792 I793 L794	A790-Q792 VanDerWaalsContact C-N 3.32Å; A790-Q792 PolarHBondContact O-N 2.85Å; A790-I793 PolarHBondContact O-N 2.81Å; A790-L794 WeakPolarHBondContact O-CB 3.36Å; A790-L794 PolarHBondContact O-N 2.64Å
791	M	72.7	Confident	80.8	Confident	48 Å²	48	41 Å²	41	24%	0.236	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-34.1	175.2	-67.6	-62.9	-70.4	0	0	113.4	N789 F795 L925 F926	N789-M791 VanDerWaalsContact C-N 3.26Å; N789-M791 PolarHBondContact O-N 2.68Å; M791-F795 VanDerWaalsContact O-CB 3.25Å; M791-F795 WeakPolarHBondContact O-CB 3.39Å; M791-F795 PolarHBondContact O-N 3.27Å; M791-L925 HydrophobicContact CE-CD1 4.44Å; M791-F926 HydrophobicContact CB-CD1 4.29Å
792	Q	82.3	Confident	80.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-72.9	-39.8	178.4	-66.5	169.2	-11.2	0	0	110.9	N789 A790 F795 I796 F871 F926	N789-Q792 HydrophobicContact CB-CG 4.29Å; N789-Q792 WeakPolarHBondContact O-CA 3.38Å; N789-Q792 WeakPolarHBondContact O-CB 3.46Å; N789-Q792 PolarHBondContact O-N 2.84Å; A790-Q792 VanDerWaalsContact C-N 3.32Å; A790-Q792 PolarHBondContact O-N 2.85Å; Q792-F795 PolarHBondContact O-N 2.56Å; Q792-I796 WeakPolarHBondContact O-CD1 3.17Å; Q792-I796 WeakPolarHBondContact O-CG1 3.39Å; Q792-I796 PolarHBondContact O-N 2.68Å; Q792-F871 HydrophobicContact CB-CD2 3.78Å; Q792-F871 HydrophobicContact CB-CE2 4.06Å; Q792-F871 HydrophobicContact CG-CD2 4.18Å; Q792-F871 HydrophobicContact CG-CE2 4.45Å; Q792-F926 PolarHBondContact NE2-O 3.5Å
793	I	79.2	Confident	80.7	Confident	13 Å²	13	31.9 Å²	31.9	7%	0.067	17%	0.174	C	C	.	.	H	α-helix	trans	-68.3	-43.5	176.8	-54.1	172.5	0	0	0	110.8	A312 A772 V776 L788 N789 A790 F795 I796 N797	A312-I793 HydrophobicContact CB-CG2 3.49Å; A312-I793 VanDerWaalsContact CB-CG2 3.49Å; A772-I793 HydrophobicContact CB-CG2 4.47Å; V776-I793 HydrophobicContact CG2-CD1 4.09Å; L788-I793 HydrophobicContact CB-CD1 4.12Å; L788-I793 HydrophobicContact CB-CG1 3.76Å; L788-I793 HydrophobicContact CD1-CG1 4.2Å; N789-I793 PolarHBondContact O-N 2.82Å; N789-I793 VanDerWaalsContact O-N 3.1Å; A790-I793 PolarHBondContact O-N 2.81Å; I793-F795 VanDerWaalsContact C-N 3.29Å; I793-F795 PolarHBondContact O-N 3.11Å; I793-I796 PolarHBondContact O-N 2.54Å; I793-N797 PolarHBondContact O-N 2.94Å; I793-N797 VanDerWaalsContact O-N 3.14Å
794	L	74.2	Confident	80.9	Confident	38 Å²	38	25.2 Å²	25.2	20%	0.199	15%	0.145	C	C	.	.	H	α-helix	trans	-58.8	-41.5	173.4	-179.6	66.8	0	0	0	111.7	A116 A790 M798	A116-L794 HydrophobicContact CB-CD2 3.56Å; A790-L794 WeakPolarHBondContact O-CB 3.36Å; A790-L794 PolarHBondContact O-N 2.64Å; L794-M798 WeakPolarHBondContact O-CB 3.21Å; L794-M798 PolarHBondContact O-N 3.41Å
795	F	81.8	Confident	81.1	Confident	12 Å²	12	23.9 Å²	23.9	5%	0.053	14%	0.138	C	C	.	.	H	α-helix	trans	-64.3	-40.9	178.2	-173.6	-95.9	0	0	0	112.9	M791 Q792 I793 I799 M800 F871 I912 V916 F926	M791-F795 VanDerWaalsContact O-CB 3.25Å; M791-F795 WeakPolarHBondContact O-CB 3.39Å; M791-F795 PolarHBondContact O-N 3.27Å; Q792-F795 PolarHBondContact O-N 2.56Å; I793-F795 VanDerWaalsContact C-N 3.29Å; I793-F795 PolarHBondContact O-N 3.11Å; F795-I799 HydrophobicContact CD2-CB 4.25Å; F795-I799 HydrophobicContact CD2-CD1 3.74Å; F795-I799 HydrophobicContact CD2-CG1 4.49Å; F795-I799 HydrophobicContact CE1-CG2 4.44Å; F795-I799 HydrophobicContact CE2-CB 4.1Å; F795-I799 HydrophobicContact CE2-CD1 3.62Å; F795-I799 HydrophobicContact CE2-CG1 4.44Å; F795-I799 HydrophobicContact CE2-CG2 3.93Å; F795-I799 HydrophobicContact CZ-CB 4.35Å; F795-I799 HydrophobicContact CZ-CG2 3.86Å; F795-I799 WeakPolarHBondContact O-CB 3.24Å; F795-I799 PolarHBondContact O-N 3.34Å; F795-M800 HydrophobicContact CD1-CG 3.76Å; F795-M800 HydrophobicContact CD1-SD 4.12Å; F795-M800 HydrophobicContact CE1-CG 3.69Å; F795-M800 HydrophobicContact CE1-SD 3.4Å; F795-M800 WeakPolarHBondContact CE1-SD 3.42Å; F795-M800 HydrophobicContact CZ-SD 4.05Å; F795-M800 PolarHBondContact O-N 3.2Å; F795-F871 HydrophobicContact CD1-CE2 4.02Å; F795-F871 AromaticContact CD1-CZ 3.69Å; F795-F871 HydrophobicContact CD1-CZ 3.69Å; F795-F871 HydrophobicContact CE1-CZ 4.03Å; F795-I912 HydrophobicContact CE1-CG2 4.17Å; F795-I912 HydrophobicContact CE2-CG2 4.5Å; F795-I912 HydrophobicContact CZ-CG2 3.51Å; F795-V916 HydrophobicContact CE1-CG2 4.16Å; F795-V916 HydrophobicContact CE2-CG2 4.07Å; F795-V916 HydrophobicContact CZ-CG2 3.55Å; F795-F926 HydrophobicContact CB-CD1 4.42Å; F795-F926 HydrophobicContact CB-CE1 3.85Å; F795-F926 HydrophobicContact CB-CZ 4.48Å; F795-F926 HydrophobicContact CD2-CD1 4.5Å; F795-F926 AromaticContact CD2-CE1 3.6Å; F795-F926 HydrophobicContact CD2-CE1 3.6Å; F795-F926 HydrophobicContact CD2-CE2 4.09Å; F795-F926 AromaticContact CD2-CZ 3.36Å; F795-F926 HydrophobicContact CD2-CZ 3.36Å; F795-F926 HydrophobicContact CE2-CE1 4.41Å; F795-F926 HydrophobicContact CE2-CE2 4.1Å; F795-F926 AromaticContact CE2-CZ 3.79Å; F795-F926 HydrophobicContact CE2-CZ 3.79Å; F795-F926 AromaticContact CG-CE1 3.94Å; F795-F926 HydrophobicContact CG-CE1 3.94Å; F795-F926 HydrophobicContact CG-CZ 4.14Å
796	I	85.4	Confident	81.3	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.01	14%	0.139	C	C	.	.	I	π-helix	trans	-57.2	-61	173.6	-70.3	158.2	0	0	0	109.7	T768 L788 Q792 I793 M798 M800 D801 F871 F874 V875	T768-I796 HydrophobicContact CG2-CG2 4.16Å; L788-I796 HydrophobicContact CD1-CD1 4.33Å; Q792-I796 WeakPolarHBondContact O-CD1 3.17Å; Q792-I796 WeakPolarHBondContact O-CG1 3.39Å; Q792-I796 PolarHBondContact O-N 2.68Å; I793-I796 PolarHBondContact O-N 2.54Å; I796-M798 VanDerWaalsContact C-N 3.32Å; I796-M798 PolarHBondContact O-N 2.98Å; I796-M800 WeakPolarHBondContact O-CB 3.36Å; I796-M800 PolarHBondContact O-N 3.31Å; I796-D801 PolarHBondContact O-N 2.99Å; I796-F871 HydrophobicContact CD1-CD2 4.02Å; I796-F871 HydrophobicContact CD1-CE2 4.21Å; I796-F871 HydrophobicContact CG1-CD2 4.29Å; I796-F871 HydrophobicContact CG1-CE2 3.98Å; I796-F874 HydrophobicContact CD1-CD1 3.7Å; I796-F874 HydrophobicContact CD1-CE1 4.17Å; I796-F874 HydrophobicContact CD1-CG 4.29Å; I796-F874 HydrophobicContact CG1-CD1 4.48Å; I796-F874 HydrophobicContact CG2-CD1 4.26Å; I796-F874 HydrophobicContact CG2-CE1 4Å; I796-V875 HydrophobicContact CG1-CG2 3.96Å
797	N	78	Confident	81.9	Confident	24 Å²	24	23.4 Å²	23.4	13%	0.128	13%	0.13	C	C	.	.	I	π-helix	trans	-59.1	-38	-174.8	-73.3	7.4	0	0	0	113.7	A312 I793	A312-N797 WeakPolarHBondContact CA-ND2 3.47Å; A312-N797 PolarHBondContact O-ND2 3.28Å; I793-N797 PolarHBondContact O-N 2.94Å; I793-N797 VanDerWaalsContact O-N 3.14Å
798	M	74.1	Confident	82.1	Confident	67 Å²	67	23.4 Å²	23.4	33%	0.33	13%	0.131	S	C	.	.	I	π-helix	trans	-90.6	-41.5	-173.7	-167.2	-177.3	73.1	0	0	113.5	I119 V120 L794 I796	I119-M798 HydrophobicContact CG2-CE 4.03Å; I119-M798 HydrophobicContact CG2-SD 4.34Å; V120-M798 HydrophobicContact CG2-SD 4.33Å; L794-M798 WeakPolarHBondContact O-CB 3.21Å; L794-M798 PolarHBondContact O-N 3.41Å; I796-M798 VanDerWaalsContact C-N 3.32Å; I796-M798 PolarHBondContact O-N 2.98Å
799	I	81.1	Confident	82.2	Confident	54 Å²	54	23.3 Å²	23.3	28%	0.277	13%	0.131	S	C	.	.	I	π-helix	trans	-110.5	-33.9	-168.4	-69	172.8	0	0	0	112.4	F795 P803 I912	F795-I799 HydrophobicContact CD2-CB 4.25Å; F795-I799 HydrophobicContact CD2-CD1 3.74Å; F795-I799 HydrophobicContact CD2-CG1 4.49Å; F795-I799 HydrophobicContact CE1-CG2 4.44Å; F795-I799 HydrophobicContact CE2-CB 4.1Å; F795-I799 HydrophobicContact CE2-CD1 3.62Å; F795-I799 HydrophobicContact CE2-CG1 4.44Å; F795-I799 HydrophobicContact CE2-CG2 3.93Å; F795-I799 HydrophobicContact CZ-CB 4.35Å; F795-I799 HydrophobicContact CZ-CG2 3.86Å; F795-I799 WeakPolarHBondContact O-CB 3.24Å; F795-I799 PolarHBondContact O-N 3.34Å; I799-P803 WeakPolarHBondContact O-CD 3.4Å; I799-P803 WeakPolarHBondContact O-CG 3.33Å; I799-I912 HydrophobicContact CG2-CD1 4.22Å; I799-I912 HydrophobicContact CG2-CG2 3.95Å
800	M	87.6	Confident	82.6	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.005	13%	0.129	C	C	.	.	I	π-helix	trans	-89.6	-40.1	-176.5	-53.1	-54.1	-73.1	0	0	112.4	F795 I796 P804 V875 S909 I912 L913	F795-M800 HydrophobicContact CD1-CG 3.76Å; F795-M800 HydrophobicContact CD1-SD 4.12Å; F795-M800 HydrophobicContact CE1-CG 3.69Å; F795-M800 HydrophobicContact CE1-SD 3.4Å; F795-M800 WeakPolarHBondContact CE1-SD 3.42Å; F795-M800 HydrophobicContact CZ-SD 4.05Å; F795-M800 PolarHBondContact O-N 3.2Å; I796-M800 WeakPolarHBondContact O-CB 3.36Å; I796-M800 PolarHBondContact O-N 3.31Å; M800-P804 WeakPolarHBondContact O-CD 3.44Å; M800-P804 VanDerWaalsContact O-CG 3.27Å; M800-P804 WeakPolarHBondContact O-CG 3.47Å; M800-V875 HydrophobicContact CE-CG1 3.45Å; M800-V875 VanDerWaalsContact CE-CG1 3.45Å; M800-V875 HydrophobicContact CE-CG2 4.39Å; M800-V875 HydrophobicContact CG-CG2 4.29Å; M800-S909 WeakPolarHBondContact CE-O 3.18Å; M800-I912 HydrophobicContact SD-CG2 3.9Å; M800-L913 HydrophobicContact CE-CB 3.92Å
801	D	87.3	Confident	83.3	Confident	4 Å²	4	20.8 Å²	20.8	2%	0.021	11%	0.111	C	C	.	.	S	Bend	trans	-79.4	-32.9	177	-68.5	-15.7	0	0	0	112.4	F764 T768 I796 P804 A805	F764-D801 HydrophobicContact CE1-CB 4.08Å; F764-D801 HydrophobicContact CZ-CB 4.29Å; T768-D801 VanDerWaalsContact CG2-OD2 3.29Å; T768-D801 WeakPolarHBondContact CG2-OD2 3.33Å; I796-D801 PolarHBondContact O-N 2.99Å; D801-P804 WeakPolarHBondContact O-CD 3.35Å; D801-A805 WeakPolarHBondContact O-CB 3.25Å; D801-A805 PolarHBondContact O-N 3.38Å
802	G	83.7	Confident	83.7	Confident	10 Å²	10	20.6 Å²	20.6	10%	0.103	11%	0.114	C	C	.	.	H	α-helix	trans	-54.4	-60.2	-172.9	0	0	0	0	0	113.7	A805 Q806	G802-A805 PolarHBondContact O-N 3.19Å; G802-Q806 WeakPolarHBondContact O-CB 3.2Å; G802-Q806 VanDerWaalsContact O-CG 3.29Å; G802-Q806 WeakPolarHBondContact O-CG 3.47Å; G802-Q806 PolarHBondContact O-N 2.99Å
803	P	86.7	Confident	83.5	Confident	33 Å²	33	22 Å²	22	21%	0.214	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-44.5	-178.4	-17.4	29.4	0	0	0	114	I799 Q806 S807 A905	I799-P803 WeakPolarHBondContact O-CD 3.4Å; I799-P803 WeakPolarHBondContact O-CG 3.33Å; P803-Q806 PolarHBondContact O-N 3Å; P803-S807 WeakPolarHBondContact O-CB 3.49Å; P803-S807 PolarHBondContact O-N 3.15Å; P803-A905 HydrophobicContact CB-CB 4.1Å
804	P	88.6	Confident	83.3	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.8	-47	172.1	-27.2	37.3	0	0	0	112.8	F764 M800 D801 Q806 S807 L808 M879 A882	F764-P804 HydrophobicContact CE1-CB 4.34Å; M800-P804 WeakPolarHBondContact O-CD 3.44Å; M800-P804 VanDerWaalsContact O-CG 3.27Å; M800-P804 WeakPolarHBondContact O-CG 3.47Å; D801-P804 WeakPolarHBondContact O-CD 3.35Å; P804-Q806 PolarHBondContact O-N 3.1Å; P804-S807 WeakPolarHBondContact O-CB 3.47Å; P804-S807 PolarHBondContact O-N 3.13Å; P804-S807 VanDerWaalsContact O-N 3.07Å; P804-S807 PolarHBondContact O-OG 3.14Å; P804-L808 WeakPolarHBondContact O-CG 3.29Å; P804-L808 PolarHBondContact O-N 2.84Å; P804-M879 HydrophobicContact CG-CE 4.05Å; P804-M879 HydrophobicContact CG-SD 4.21Å; P804-A882 HydrophobicContact CB-CB 4.17Å
805	A	88	Confident	83.4	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-37.7	177.8	0	0	0	0	0	112.5	I321 F761 F764 Q765 D801 G802 S807 L808 G809	I321-A805 HydrophobicContact CD1-CB 3.45Å; I321-A805 VanDerWaalsContact CD1-CB 3.45Å; F761-A805 HydrophobicContact CB-CB 4.22Å; F761-A805 WeakPolarHBondContact CB-O 3.21Å; F764-A805 HydrophobicContact CD1-CB 3.94Å; F764-A805 HydrophobicContact CE1-CB 4.05Å; Q765-A805 HydrophobicContact CG-CB 4.12Å; D801-A805 WeakPolarHBondContact O-CB 3.25Å; D801-A805 PolarHBondContact O-N 3.38Å; G802-A805 PolarHBondContact O-N 3.19Å; A805-S807 PolarHBondContact O-N 3.29Å; A805-L808 PolarHBondContact O-N 2.96Å; A805-G809 PolarHBondContact O-N 2.96Å
806	Q	86.9	Confident	83.1	Confident	75 Å²	75	27.3 Å²	27.3	35%	0.35	16%	0.156	S	C	.	.	H	α-helix	trans	-59.7	-44.9	169.6	-74.6	177	17.4	0	0	111.8	I321 G802 P803 P804 L808 G809 V810	I321-Q806 HydrophobicContact CB-CG 4.47Å; I321-Q806 HydrophobicContact CD1-CG 3.99Å; I321-Q806 HydrophobicContact CG1-CG 3.67Å; I321-Q806 HydrophobicContact CG2-CG 4.26Å; G802-Q806 WeakPolarHBondContact O-CB 3.2Å; G802-Q806 VanDerWaalsContact O-CG 3.29Å; G802-Q806 WeakPolarHBondContact O-CG 3.47Å; G802-Q806 PolarHBondContact O-N 2.99Å; P803-Q806 PolarHBondContact O-N 3Å; P804-Q806 PolarHBondContact O-N 3.1Å; Q806-L808 VanDerWaalsContact C-N 3.31Å; Q806-L808 PolarHBondContact O-N 3.35Å; Q806-G809 WeakPolarHBondContact O-CA 3.31Å; Q806-G809 PolarHBondContact O-N 3.24Å; Q806-V810 WeakPolarHBondContact O-CG2 3.41Å; Q806-V810 PolarHBondContact O-N 3.5Å
807	S	89.1	Confident	82.5	Confident	5 Å²	5	27.9 Å²	27.9	4%	0.035	16%	0.159	C	C	.	.	H	α-helix	trans	-66.4	-31	-178.6	79.9	0	0	0	0	113.8	P803 P804 A805 G809 V810 N899 F902	P803-S807 WeakPolarHBondContact O-CB 3.49Å; P803-S807 PolarHBondContact O-N 3.15Å; P804-S807 WeakPolarHBondContact O-CB 3.47Å; P804-S807 PolarHBondContact O-N 3.13Å; P804-S807 VanDerWaalsContact O-N 3.07Å; P804-S807 PolarHBondContact O-OG 3.14Å; A805-S807 PolarHBondContact O-N 3.29Å; S807-G809 VanDerWaalsContact C-N 3.31Å; S807-V810 PolarHBondContact O-N 2.95Å; S807-N899 PolarHBondContact O-ND2 2.8Å; S807-F902 WeakPolarHBondContact OG-CA 3.42Å; S807-F902 WeakPolarHBondContact OG-CD2 3.43Å
808	L	87.8	Confident	82.3	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-34.6	170.5	-70.4	175.4	0	0	0	111.8	F761 F764 P804 A805 Q806 V810 E811 C885 R886 F902	F761-L808 HydrophobicContact CB-CB 3.75Å; F761-L808 HydrophobicContact CB-CD1 4.06Å; F764-L808 HydrophobicContact CB-CD1 3.88Å; F764-L808 HydrophobicContact CD1-CD1 4.08Å; F764-L808 HydrophobicContact CG-CD1 4.11Å; P804-L808 WeakPolarHBondContact O-CG 3.29Å; P804-L808 PolarHBondContact O-N 2.84Å; A805-L808 PolarHBondContact O-N 2.96Å; Q806-L808 VanDerWaalsContact C-N 3.31Å; Q806-L808 PolarHBondContact O-N 3.35Å; L808-V810 PolarHBondContact O-N 2.95Å; L808-E811 WeakPolarHBondContact O-CB 3.33Å; L808-E811 PolarHBondContact O-N 3.37Å; L808-C885 HydrophobicContact CD1-CB 4.47Å; L808-R886 HydrophobicContact CD2-CB 4.18Å; L808-R886 HydrophobicContact CD2-CG 3.45Å; L808-R886 VanDerWaalsContact CD2-CG 3.45Å; L808-F902 HydrophobicContact CD2-CD2 4.1Å; L808-F902 HydrophobicContact CD2-CE2 4.11Å; L808-F902 HydrophobicContact CG-CD2 4.48Å
809	G	85.4	Confident	82.2	Confident	4 Å²	4	34.5 Å²	34.5	4%	0.041	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-31.3	171.2	0	0	0	0	0	113.9	T325 N757 A805 Q806 S807	T325-G809 WeakPolarHBondContact CG2-O 3.33Å; T325-G809 WeakPolarHBondContact OG1-CA 3.35Å; N757-G809 PolarHBondContact ND2-O 2.82Å; A805-G809 PolarHBondContact O-N 2.96Å; Q806-G809 WeakPolarHBondContact O-CA 3.31Å; Q806-G809 PolarHBondContact O-N 3.24Å; S807-G809 VanDerWaalsContact C-N 3.31Å
810	V	84.5	Confident	82	Confident	37 Å²	37	36.9 Å²	36.9	22%	0.224	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.9	-174.7	-156.5	0	0	0	0	113.7	L328 R332 Q806 S807 L808	L328-V810 HydrophobicContact CD1-CG1 4.29Å; L328-V810 HydrophobicContact CD1-CG2 3.7Å; R332-V810 PolarHBondContact NH2-O 2.87Å; Q806-V810 WeakPolarHBondContact O-CG2 3.41Å; Q806-V810 PolarHBondContact O-N 3.5Å; S807-V810 PolarHBondContact O-N 2.95Å; L808-V810 PolarHBondContact O-N 2.95Å
811	E	85.6	Confident	81.6	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.037	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-51.8	136.8	-177	-164.3	73.3	-137	0	0	111.4	N757 L808 R886 N899	N757-E811 PolarHBondContact ND2-O 2.88Å; L808-E811 WeakPolarHBondContact O-CB 3.33Å; L808-E811 PolarHBondContact O-N 3.37Å; E811-R886 IonicContact OE1-CZ 2.65Å; E811-R886 IonicContact OE1-NE 2.58Å; E811-R886 IonicContact OE1-NH2 3.42Å; E811-R886 PolarHBondContact OE1-NH2 2.92Å; E811-R886 IonicContact OE2-CZ 2.67Å; E811-R886 IonicContact OE2-NE 2.87Å; E811-R886 PolarHBondContact OE2-NE 3.01Å; E811-R886 IonicContact OE2-NH2 2.63Å; E811-R886 PolarHBondContact OE2-NH2 3.26Å; E811-N899 VanDerWaalsContact OE2-CB 3.31Å; E811-N899 WeakPolarHBondContact OE2-CB 3.48Å; E811-N899 PolarHBondContact OE2-ND2 3.16Å
812	P	81.2	Confident	81.4	Confident	45 Å²	45	41.9 Å²	41.9	29%	0.292	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-71.5	143.7	-176.8	27.6	-35.7	0	0	0	112.5	D814 R898	P812-D814 PolarHBondContact O-N 2.97Å; P812-R898 HydrophobicContact CG-CG 3.95Å
813	V	76.5	Confident	81.3	Confident	29 Å²	29	43 Å²	43	18%	0.176	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-53	137.5	-178.7	-168.6	0	0	0	0	111.7	R898	V813-R898 PolarHBondContact O-NH2 3.03Å
814	D	76.6	Confident	80.8	Confident	27 Å²	27	45.3 Å²	45.3	14%	0.144	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-80.7	126.2	173.2	-172	-39	0	0	0	109.7	P812 D816 I817 K889	P812-D814 PolarHBondContact O-N 2.97Å; D814-D816 PolarHBondContact O-N 2.65Å; D814-D816 PolarHBondContact OD1-N 2.7Å; D814-I817 HydrophobicContact CB-CD1 3.79Å; D814-I817 HydrophobicContact CB-CG1 4.04Å; D814-I817 WeakPolarHBondContact O-CB 3.49Å; D814-I817 PolarHBondContact O-N 2.89Å; D814-K889 VanDerWaalsContact CG-NZ 3.26Å; D814-K889 IonicContact OD1-NZ 3.29Å; D814-K889 PolarHBondContact OD1-NZ 2.84Å; D814-K889 WeakPolarHBondContact OD2-CD 3.43Å; D814-K889 VanDerWaalsContact OD2-CE 3.31Å; D814-K889 WeakPolarHBondContact OD2-CE 3.5Å; D814-K889 IonicContact OD2-NZ 3.96Å; D814-K889 PolarHBondContact OD2-NZ 2.64Å
815	P	76	Confident	80.2	Confident	78 Å²	78	46.6 Å²	46.6	51%	0.506	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-25.6	179.3	-28.4	36.3	0	0	0	115.3	I817 I818	P815-I817 VanDerWaalsContact C-N 3.33Å; P815-I818 WeakPolarHBondContact O-CB 3.17Å; P815-I818 PolarHBondContact O-N 3.4Å
816	D	74.3	Confident	79.4	Confident	70 Å²	70	52.6 Å²	52.6	37%	0.374	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-23.6	178	-69.7	-37.8	0	0	0	113.1	D814 I818 K819 Q820 K889	D814-D816 PolarHBondContact O-N 2.65Å; D814-D816 PolarHBondContact OD1-N 2.7Å; D816-I818 PolarHBondContact O-N 3.23Å; D816-K819 PolarHBondContact O-N 3.15Å; D816-K819 IonicContact OD1-NZ 3.71Å; D816-Q820 PolarHBondContact O-N 2.99Å; D816-K889 IonicContact OD2-NZ 2.82Å; D816-K889 PolarHBondContact OD2-NZ 3.49Å
817	I	73.5	Confident	78.7	Confident	13 Å²	13	53.9 Å²	53.9	7%	0.067	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-64.2	-29.6	174.9	-65.3	170.5	0	0	0	110.7	K752 N756 D814 P815 K819 Q820	K752-I817 HydrophobicContact CB-CG2 3.52Å; K752-I817 HydrophobicContact CD-CG2 4.49Å; N756-I817 HydrophobicContact CB-CD1 3.79Å; D814-I817 HydrophobicContact CB-CD1 3.79Å; D814-I817 HydrophobicContact CB-CG1 4.04Å; D814-I817 WeakPolarHBondContact O-CB 3.49Å; D814-I817 PolarHBondContact O-N 2.89Å; P815-I817 VanDerWaalsContact C-N 3.33Å; I817-K819 PolarHBondContact O-N 3.14Å; I817-Q820 PolarHBondContact O-N 3.46Å
818	I	73.4	Confident	77.9	Confident	65 Å²	65	57.2 Å²	57.2	33%	0.333	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-60.5	-35.2	177	-54.5	178.6	0	0	0	111.2	V749 P815 D816	V749-I818 HydrophobicContact CG1-CD1 4.26Å; V749-I818 HydrophobicContact CG1-CG1 3.92Å; V749-I818 HydrophobicContact CG2-CG1 4.36Å; V749-I818 HydrophobicContact CG2-CG2 4Å; P815-I818 WeakPolarHBondContact O-CB 3.17Å; P815-I818 PolarHBondContact O-N 3.4Å; D816-I818 PolarHBondContact O-N 3.23Å
819	K	73.2	Confident	77.4	Confident	165 Å²	165	57.7 Å²	57.7	72%	0.717	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-88.1	-10.7	-176.5	-60.4	173.8	-174.2	161.7	0	113.8	D816 I817	D816-K819 PolarHBondContact O-N 3.15Å; D816-K819 IonicContact OD1-NZ 3.71Å; I817-K819 PolarHBondContact O-N 3.14Å
820	Q	76.1	Confident	77.1	Confident	105 Å²	105	59.3 Å²	59.3	49%	0.491	31%	0.309	S	S	.	.	S	Bend	trans	-74.4	144.5	179	-69.5	173.2	22.7	0	0	110.1	K752 D816 I817	K752-Q820 PolarHBondContact NZ-O 2.7Å; D816-Q820 PolarHBondContact O-N 2.99Å; I817-Q820 PolarHBondContact O-N 3.46Å
821	P	79.9	Confident	77	Confident	93 Å²	93	59.2 Å²	59.2	60%	0.604	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-61.4	169.7	172.5	28.6	-35.8	0	0	0	111.2
822	P	82.4	Confident	76.8	Confident	17 Å²	17	69.3 Å²	69.3	11%	0.11	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-59.3	142.4	173.1	-20.1	33.8	0	0	0	110.9	V352 S588 V590 N824	V352-P822 VanDerWaalsContact O-CB 3.27Å; V352-P822 WeakPolarHBondContact O-CB 3.44Å; V352-P822 WeakPolarHBondContact O-CG 3.38Å; S588-P822 WeakPolarHBondContact O-CD 3.26Å; V590-P822 HydrophobicContact CG2-CG 3.78Å; P822-N824 PolarHBondContact O-N 2.96Å
823	R	80.6	Confident	76.8	Confident	32 Å²	32	69.1 Å²	69.1	12%	0.121	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-58.6	133.8	177.9	168.3	-177.2	169.3	-143.2	-2.6	110.3	S269 E347 Y755 V825 E827	S269-R823 PolarHBondContact OG-NH2 2.77Å; E347-R823 IonicContact OE1-NH1 2.75Å; E347-R823 PolarHBondContact OE1-NH1 3.34Å; Y755-R823 VanDerWaalsContact CE2-NH1 3.26Å; Y755-R823 PolarHBondContact OH-NE 3.47Å; R823-V825 PolarHBondContact O-N 3.03Å; R823-E827 PolarHBondContact NH2-O 3.32Å
824	N	76.5	Confident	77.2	Confident	83 Å²	83	68 Å²	68	44%	0.444	34%	0.34	S	S	.	.			trans	-69.1	111.5	162.4	-179	-5	0	0	0	109.1	P822 R826 E827	P822-N824 PolarHBondContact O-N 2.96Å; N824-R826 PolarHBondContact O-N 3.47Å; N824-R826 VanDerWaalsContact O-N 3.17Å; N824-R826 WeakPolarHBondContact OD1-CB 3.45Å; N824-R826 PolarHBondContact OD1-N 3.32Å; N824-R826 VanDerWaalsContact OD1-N 3.09Å; N824-E827 HydrophobicContact CB-CG 4.16Å; N824-E827 WeakPolarHBondContact O-CB 3.29Å; N824-E827 PolarHBondContact O-N 3.44Å
825	V	76.7	Confident	77.7	Confident	27 Å²	27	71.3 Å²	71.3	16%	0.164	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-23.9	-176.2	171.6	0	0	0	0	112.7	P265 C351 I697 R823 E827	P265-V825 HydrophobicContact CB-CG1 3.87Å; P265-V825 HydrophobicContact CB-CG2 3.99Å; P265-V825 HydrophobicContact CG-CG1 4.28Å; P265-V825 HydrophobicContact CG-CG2 4Å; C351-V825 HydrophobicContact CB-CG2 4.02Å; I697-V825 HydrophobicContact CD1-CG2 4Å; I697-V825 HydrophobicContact CG1-CG2 3.63Å; R823-V825 PolarHBondContact O-N 3.03Å; V825-E827 PolarHBondContact O-N 3.02Å
826	R	70.4	Confident	78.2	Confident	126 Å²	126	71.4 Å²	71.4	48%	0.475	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-10	175.3	-60.1	-179.9	178.4	162.7	2	113.1	E661 F693 N824	E661-R826 IonicContact OE1-NE 3.91Å; E661-R826 IonicContact OE1-NH2 2.72Å; F693-R826 PolarHBondContact O-NH2 3.01Å; N824-R826 PolarHBondContact O-N 3.47Å; N824-R826 VanDerWaalsContact O-N 3.17Å; N824-R826 WeakPolarHBondContact OD1-CB 3.45Å; N824-R826 PolarHBondContact OD1-N 3.32Å; N824-R826 VanDerWaalsContact OD1-N 3.09Å
827	E	72.4	Confident	78.8	Confident	102 Å²	102	68.2 Å²	68.2	48%	0.477	34%	0.338	S	S	.	.	S	Bend	trans	-75.1	124.9	171	-72.9	-178	-151.4	0	0	111.3	R823 N824 V825	R823-E827 PolarHBondContact NH2-O 3.32Å; N824-E827 HydrophobicContact CB-CG 4.16Å; N824-E827 WeakPolarHBondContact O-CB 3.29Å; N824-E827 PolarHBondContact O-N 3.44Å; V825-E827 PolarHBondContact O-N 3.02Å
828	P	72.8	Confident	79.6	Confident	74 Å²	74	68.1 Å²	68.1	48%	0.481	34%	0.338	S	S	.	.			trans	-67.3	138.4	177.4	29.2	-34.7	0	0	0	110	I830 T831	P828-I830 CarbonylContact O-C 3.59Å; P828-I830 PolarHBondContact O-N 2.9Å; P828-I830 VanDerWaalsContact O-N 3.11Å; P828-T831 VanDerWaalsContact O-CG2 3.28Å; P828-T831 WeakPolarHBondContact O-CG2 3.47Å; P828-T831 PolarHBondContact O-N 2.96Å
829	M	77.1	Confident	80.4	Confident	11 Å²	11	67.9 Å²	67.9	5%	0.054	35%	0.346	C	S	.	.	S	Bend	trans	-54.4	-35.1	-178.5	-176.6	-179	165.4	0	0	113.1	M270 Y755 I758 R759 V762 T831	M270-M829 HydrophobicContact CE-CE 4.21Å; M270-M829 HydrophobicContact CE-SD 3.41Å; M270-M829 WeakPolarHBondContact CE-SD 3.45Å; Y755-M829 HydrophobicContact CE2-CG 4.18Å; Y755-M829 WeakPolarHBondContact OH-CA 3.29Å; I758-M829 HydrophobicContact CG2-CE 3.64Å; R759-M829 HydrophobicContact CB-CE 4.34Å; R759-M829 PolarHBondContact NE-O 3.28Å; V762-M829 HydrophobicContact CB-CE 3.61Å; V762-M829 HydrophobicContact CG1-CE 3.86Å; V762-M829 HydrophobicContact CG2-CE 3.66Å; M829-T831 PolarHBondContact O-N 3.04Å
830	I	78.9	Confident	81.4	Confident	38 Å²	38	62.7 Å²	62.7	20%	0.195	33%	0.326	C	S	.	.	S	Bend	trans	-93.9	82.9	170.4	-44.1	176.3	0	0	0	109.2	L273 L766 P828 V834 I835 I838	L273-I830 HydrophobicContact CD1-CD1 3.58Å; L766-I830 HydrophobicContact CD1-CD1 3.41Å; L766-I830 VanDerWaalsContact CD1-CD1 3.41Å; L766-I830 HydrophobicContact CD1-CG1 4.22Å; P828-I830 CarbonylContact O-C 3.59Å; P828-I830 PolarHBondContact O-N 2.9Å; P828-I830 VanDerWaalsContact O-N 3.11Å; I830-V834 HydrophobicContact CG2-CB 3.86Å; I830-V834 HydrophobicContact CG2-CG1 3.85Å; I830-I835 HydrophobicContact CG2-CG1 3.55Å; I830-I838 HydrophobicContact CG2-CD1 4.12Å
831	T	82	Confident	82.1	Confident	35 Å²	35	57.9 Å²	57.9	22%	0.215	30%	0.303	C	S	.	.			trans	-70.2	164.9	172.6	70.8	0	0	0	0	111.3	R759 P828 M829 S833 V834 I835	R759-T831 PolarHBondContact NH2-OG1 2.83Å; P828-T831 VanDerWaalsContact O-CG2 3.28Å; P828-T831 WeakPolarHBondContact O-CG2 3.47Å; P828-T831 PolarHBondContact O-N 2.96Å; M829-T831 PolarHBondContact O-N 3.04Å; T831-S833 VanDerWaalsContact C-N 3.28Å; T831-S833 PolarHBondContact O-N 2.86Å; T831-S833 VanDerWaalsContact O-N 3.13Å; T831-V834 WeakPolarHBondContact O-CA 3.49Å; T831-V834 WeakPolarHBondContact O-CB 3.35Å; T831-V834 PolarHBondContact O-N 3.02Å; T831-I835 PolarHBondContact O-N 3.03Å
832	R	83.1	Confident	82.7	Confident	220 Å²	220	53.7 Å²	53.7	83%	0.83	28%	0.277	S	S	*	.	H	α-helix	trans	-53.8	-37	-175.1	-68.5	-176	179.7	178.9	0.1	114.5	V834 I835 T836	R832-V834 VanDerWaalsContact C-N 3.32Å; R832-V834 PolarHBondContact O-N 2.95Å; R832-I835 PolarHBondContact O-N 3.16Å; R832-T836 PolarHBondContact O-N 3.31Å; R832-T836 PolarHBondContact O-OG1 3.12Å
833	S	81.3	Confident	83.2	Confident	41 Å²	41	54.2 Å²	54.2	29%	0.287	29%	0.285	S	S	.	.	H	α-helix	trans	-68	-28.8	174.6	168.3	0	0	0	0	112.9	T831 T836 S837 E957	T831-S833 VanDerWaalsContact C-N 3.28Å; T831-S833 PolarHBondContact O-N 2.86Å; T831-S833 VanDerWaalsContact O-N 3.13Å; S833-T836 PolarHBondContact O-OG1 2.75Å; S833-S837 VanDerWaalsContact O-CB 3.24Å; S833-S837 WeakPolarHBondContact O-CB 3.42Å; S833-S837 PolarHBondContact O-N 3.01Å; S833-S837 PolarHBondContact O-OG 3.44Å; S833-E957 PolarHBondContact OG-OE1 3.3Å
834	V	83.9	Confident	83.8	Confident	7 Å²	7	54.1 Å²	54.1	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-72.9	-39.2	170.8	-168.2	0	0	0	0	110.4	R763 I830 T831 R832 S837 I838	R763-V834 HydrophobicContact CB-CG1 4.24Å; R763-V834 HydrophobicContact CG-CG1 4.34Å; I830-V834 HydrophobicContact CG2-CB 3.86Å; I830-V834 HydrophobicContact CG2-CG1 3.85Å; T831-V834 WeakPolarHBondContact O-CA 3.49Å; T831-V834 WeakPolarHBondContact O-CB 3.35Å; T831-V834 PolarHBondContact O-N 3.02Å; R832-V834 VanDerWaalsContact C-N 3.32Å; R832-V834 PolarHBondContact O-N 2.95Å; V834-S837 WeakPolarHBondContact O-CB 3.21Å; V834-S837 PolarHBondContact O-N 3.15Å; V834-I838 HydrophobicContact CG1-CD1 3.82Å; V834-I838 HydrophobicContact CG1-CG1 4.34Å; V834-I838 WeakPolarHBondContact O-CB 3.38Å; V834-I838 VanDerWaalsContact O-CG1 3.27Å; V834-I838 WeakPolarHBondContact O-CG1 3.39Å; V834-I838 PolarHBondContact O-N 2.68Å
835	I	87.4	Confident	84.7	Confident	96 Å²	96	50.2 Å²	50.2	49%	0.492	27%	0.267	S	S	.	.	H	α-helix	trans	-62.3	-50.4	175	-56.5	179	0	0	0	110.9	I830 T831 R832 S837 I838 A839	I830-I835 HydrophobicContact CG2-CG1 3.55Å; T831-I835 PolarHBondContact O-N 3.03Å; R832-I835 PolarHBondContact O-N 3.16Å; I835-S837 VanDerWaalsContact C-N 3.26Å; I835-S837 PolarHBondContact O-N 2.83Å; I835-I838 PolarHBondContact O-N 2.84Å; I835-A839 WeakPolarHBondContact O-CB 3.16Å; I835-A839 PolarHBondContact O-N 3.47Å
836	T	87.1	Confident	85.5	Confident	80 Å²	80	50.1 Å²	50.1	49%	0.491	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-33.4	178.7	56.5	0	0	0	0	112.2	R832 S833 L840	R832-T836 PolarHBondContact O-N 3.31Å; R832-T836 PolarHBondContact O-OG1 3.12Å; S833-T836 PolarHBondContact O-OG1 2.75Å; T836-L840 WeakPolarHBondContact O-CB 3.16Å; T836-L840 PolarHBondContact O-N 3.47Å
837	S	86.1	Confident	86.6	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.014	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-49.9	170.7	-69.4	0	0	0	0	113.2	R763 S833 V834 I835 A839 L840 A841 R953	R763-S837 PolarHBondContact NH1-OG 3.48Å; R763-S837 VanDerWaalsContact NH2-CB 3.32Å; R763-S837 PolarHBondContact NH2-OG 2.95Å; S833-S837 VanDerWaalsContact O-CB 3.24Å; S833-S837 WeakPolarHBondContact O-CB 3.42Å; S833-S837 PolarHBondContact O-N 3.01Å; S833-S837 PolarHBondContact O-OG 3.44Å; V834-S837 WeakPolarHBondContact O-CB 3.21Å; V834-S837 PolarHBondContact O-N 3.15Å; I835-S837 VanDerWaalsContact C-N 3.26Å; I835-S837 PolarHBondContact O-N 2.83Å; S837-A839 VanDerWaalsContact C-N 3.34Å; S837-L840 PolarHBondContact O-N 2.72Å; S837-A841 PolarHBondContact O-N 3.41Å; S837-R953 PolarHBondContact OG-NE 3.14Å; S837-R953 PolarHBondContact OG-NH1 3.19Å; S837-R953 VanDerWaalsContact OG-NH1 3.15Å
838	I	89.7	Confident	87.6	Confident	11 Å²	11	43.9 Å²	43.9	6%	0.056	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-43.6	-179.4	-74.7	167.7	0	0	0	109.8	R763 L766 I770 I830 V834 I835 A841 A842	R763-I838 HydrophobicContact CG-CG1 4.27Å; L766-I838 HydrophobicContact CB-CD1 3.88Å; L766-I838 HydrophobicContact CB-CG1 4.5Å; L766-I838 HydrophobicContact CB-CG2 4.45Å; L766-I838 HydrophobicContact CD1-CD1 4.01Å; I770-I838 HydrophobicContact CD1-CG2 3.75Å; I830-I838 HydrophobicContact CG2-CD1 4.12Å; V834-I838 HydrophobicContact CG1-CD1 3.82Å; V834-I838 HydrophobicContact CG1-CG1 4.34Å; V834-I838 WeakPolarHBondContact O-CB 3.38Å; V834-I838 VanDerWaalsContact O-CG1 3.27Å; V834-I838 WeakPolarHBondContact O-CG1 3.39Å; V834-I838 PolarHBondContact O-N 2.68Å; I835-I838 PolarHBondContact O-N 2.84Å; I838-A841 PolarHBondContact O-N 3.46Å; I838-A842 VanDerWaalsContact O-CB 3.25Å; I838-A842 WeakPolarHBondContact O-CB 3.2Å; I838-A842 PolarHBondContact O-N 3.41Å
839	A	91.6	Very high	88.6	Confident	60 Å²	60	40.3 Å²	40.3	50%	0.496	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-40.3	177.1	0	0	0	0	0	112.7	I835 S837 G843	I835-A839 WeakPolarHBondContact O-CB 3.16Å; I835-A839 PolarHBondContact O-N 3.47Å; S837-A839 VanDerWaalsContact C-N 3.34Å; A839-G843 PolarHBondContact O-N 3.15Å
840	L	92.7	Very high	89.3	Confident	57 Å²	57	41.2 Å²	41.2	30%	0.298	24%	0.235	S	C	.	.	H	α-helix	trans	-66	-43.3	176.2	-179.5	145.2	0	0	0	111.7	T836 S837 T844 L949 R953	T836-L840 WeakPolarHBondContact O-CB 3.16Å; T836-L840 PolarHBondContact O-N 3.47Å; S837-L840 PolarHBondContact O-N 2.72Å; L840-T844 WeakPolarHBondContact O-CB 3.28Å; L840-T844 WeakPolarHBondContact O-CG2 3.27Å; L840-T844 PolarHBondContact O-N 3.29Å; L840-T844 VanDerWaalsContact O-N 3.16Å; L840-T844 PolarHBondContact O-OG1 3.49Å; L840-L949 HydrophobicContact CD2-CB 4.25Å; L840-R953 HydrophobicContact CD1-CB 4.49Å; L840-R953 HydrophobicContact CD1-CG 4.3Å
841	A	92.3	Very high	90	Very high	3 Å²	3	45.7 Å²	45.7	3%	0.025	25%	0.25	C	C	.	.	H	α-helix	trans	-65.1	-57.3	175	0	0	0	0	0	111.1	S837 I838 G843 T844 I845	S837-A841 PolarHBondContact O-N 3.41Å; I838-A841 PolarHBondContact O-N 3.46Å; A841-G843 VanDerWaalsContact C-N 3.3Å; A841-G843 PolarHBondContact O-N 3.35Å; A841-T844 PolarHBondContact O-N 3.01Å; A841-T844 PolarHBondContact O-OG1 3.48Å; A841-I845 VanDerWaalsContact O-CG1 3.27Å; A841-I845 WeakPolarHBondContact O-CG1 3.48Å; A841-I845 PolarHBondContact O-N 2.89Å
842	A	92.1	Very high	90.5	Very high	5 Å²	5	44.1 Å²	44.1	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-58	-40	-178.4	0	0	0	0	0	112.8	S767 I770 A771 I838 L846	S767-A842 WeakPolarHBondContact O-CB 3.37Å; I770-A842 HydrophobicContact CB-CB 4.17Å; I770-A842 HydrophobicContact CG2-CB 3.87Å; A771-A842 HydrophobicContact CB-CB 4.3Å; I838-A842 VanDerWaalsContact O-CB 3.25Å; I838-A842 WeakPolarHBondContact O-CB 3.2Å; I838-A842 PolarHBondContact O-N 3.41Å; A842-L846 WeakPolarHBondContact O-CB 3.4Å; A842-L846 PolarHBondContact O-N 3.24Å
843	G	93.6	Very high	90.8	Very high	28 Å²	28	33.6 Å²	33.6	29%	0.289	20%	0.2	S	C	.	.	H	α-helix	trans	-67.7	-33.1	176.6	0	0	0	0	0	113.9	A839 A841 C847	A839-G843 PolarHBondContact O-N 3.15Å; A841-G843 VanDerWaalsContact C-N 3.3Å; A841-G843 PolarHBondContact O-N 3.35Å; G843-C847 WeakPolarHBondContact O-CB 3.43Å; G843-C847 PolarHBondContact O-N 2.75Å; G843-C847 PolarHBondContact O-SG 2.8Å
844	T	93.3	Very high	91.2	Very high	31 Å²	31	35.4 Å²	35.4	19%	0.19	21%	0.205	C	C	.	.	H	α-helix	trans	-78	-37.7	177.3	44.5	0	0	0	0	112.1	L840 A841 G848 V946 L949	L840-T844 WeakPolarHBondContact O-CB 3.28Å; L840-T844 WeakPolarHBondContact O-CG2 3.27Å; L840-T844 PolarHBondContact O-N 3.29Å; L840-T844 VanDerWaalsContact O-N 3.16Å; L840-T844 PolarHBondContact O-OG1 3.49Å; A841-T844 PolarHBondContact O-N 3.01Å; A841-T844 PolarHBondContact O-OG1 3.48Å; T844-G848 PolarHBondContact O-N 2.63Å; T844-V946 WeakPolarHBondContact OG1-CG2 3.36Å; T844-L949 HydrophobicContact CG2-CD1 3.54Å
845	I	93.9	Very high	91.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-48.4	169.4	-58.2	171.7	0	0	0	110.2	A771 A841 G848 T849 F874 F877 N881 V946	A771-I845 HydrophobicContact CB-CB 3.92Å; A771-I845 HydrophobicContact CB-CD1 4.37Å; A771-I845 HydrophobicContact CB-CG2 3.73Å; A841-I845 VanDerWaalsContact O-CG1 3.27Å; A841-I845 WeakPolarHBondContact O-CG1 3.48Å; A841-I845 PolarHBondContact O-N 2.89Å; I845-G848 PolarHBondContact O-N 3.37Å; I845-T849 HydrophobicContact CG2-CG2 4.25Å; I845-T849 WeakPolarHBondContact O-CB 3.31Å; I845-T849 WeakPolarHBondContact O-CG2 3.1Å; I845-T849 PolarHBondContact O-N 3.29Å; I845-T849 PolarHBondContact O-OG1 3.43Å; I845-F874 HydrophobicContact CG2-CD2 4.32Å; I845-F874 HydrophobicContact CG2-CE2 4.15Å; I845-F874 HydrophobicContact CG2-CZ 4.47Å; I845-F877 HydrophobicContact CB-CB 4.44Å; I845-F877 HydrophobicContact CG1-CB 4.04Å; I845-F877 HydrophobicContact CG1-CD1 4.47Å; I845-F877 HydrophobicContact CG1-CG 4.34Å; I845-F877 HydrophobicContact CG2-CB 3.96Å; I845-F877 HydrophobicContact CG2-CD2 4.37Å; I845-F877 HydrophobicContact CG2-CG 4.27Å; I845-N881 HydrophobicContact CD1-CB 4.27Å; I845-V946 HydrophobicContact CG1-CG2 3.91Å
846	L	93.5	Very high	91.6	Very high	25 Å²	25	35.5 Å²	35.5	13%	0.131	20%	0.199	C	C	.	.	H	α-helix	trans	-56.7	-54.4	177.3	173.6	66.9	0	0	0	112.2	T774 L775 A842 G848 T849 L850	T774-L846 HydrophobicContact CG2-CD1 4.32Å; T774-L846 HydrophobicContact CG2-CD2 3.51Å; L775-L846 HydrophobicContact CB-CD1 3.92Å; L775-L846 HydrophobicContact CD1-CD1 4.17Å; A842-L846 WeakPolarHBondContact O-CB 3.4Å; A842-L846 PolarHBondContact O-N 3.24Å; L846-G848 VanDerWaalsContact C-N 3.33Å; L846-G848 PolarHBondContact O-N 3.34Å; L846-T849 PolarHBondContact O-OG1 3.34Å; L846-L850 WeakPolarHBondContact O-CB 3.31Å; L846-L850 PolarHBondContact O-N 2.94Å
847	C	94	Very high	91.6	Very high	88 Å²	88	33.5 Å²	33.5	60%	0.595	19%	0.185	S	C	*	.	H	α-helix	trans	-62.8	-39.6	-178	-73.2	0	0	0	0	112.2	G843 W851	G843-C847 WeakPolarHBondContact O-CB 3.43Å; G843-C847 PolarHBondContact O-N 2.75Å; G843-C847 PolarHBondContact O-SG 2.8Å; C847-W851 WeakPolarHBondContact O-CB 3.4Å; C847-W851 PolarHBondContact O-N 3.18Å
848	G	93.7	Very high	91.5	Very high	9 Å²	9	37.7 Å²	37.7	9%	0.093	21%	0.214	C	C	.	.	H	α-helix	trans	-69.7	-45.7	178.8	0	0	0	0	0	113.7	T844 I845 L846 W851 V852	T844-G848 PolarHBondContact O-N 2.63Å; I845-G848 PolarHBondContact O-N 3.37Å; L846-G848 VanDerWaalsContact C-N 3.33Å; L846-G848 PolarHBondContact O-N 3.34Å; G848-W851 PolarHBondContact O-N 3.09Å; G848-V852 PolarHBondContact O-N 3.11Å
849	T	93	Very high	91.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68	-42.2	179.1	51.6	0	0	0	0	112	I845 L846 W851 V852 F853 C873 F874 F877	I845-T849 HydrophobicContact CG2-CG2 4.25Å; I845-T849 WeakPolarHBondContact O-CB 3.31Å; I845-T849 WeakPolarHBondContact O-CG2 3.1Å; I845-T849 PolarHBondContact O-N 3.29Å; I845-T849 PolarHBondContact O-OG1 3.43Å; L846-T849 PolarHBondContact O-OG1 3.34Å; T849-W851 VanDerWaalsContact C-N 3.34Å; T849-W851 PolarHBondContact O-N 2.98Å; T849-V852 PolarHBondContact O-N 2.82Å; T849-F853 WeakPolarHBondContact O-CB 3.36Å; T849-F853 PolarHBondContact O-N 2.81Å; T849-C873 HydrophobicContact CG2-CB 4.46Å; T849-F874 HydrophobicContact CG2-CB 3.93Å; T849-F874 HydrophobicContact CG2-CD2 3.85Å; T849-F874 HydrophobicContact CG2-CG 4.26Å; T849-F877 HydrophobicContact CG2-CD2 3.65Å; T849-F877 HydrophobicContact CG2-CE2 4Å
850	L	91.8	Very high	90.2	Very high	30 Å²	30	42.4 Å²	42.4	16%	0.157	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-37.3	174.5	-174	65.3	0	0	0	111.8	L775 V778 L784 L846 F853 M854	L775-L850 HydrophobicContact CD1-CB 4.2Å; L775-L850 HydrophobicContact CD1-CD1 4.33Å; V778-L850 HydrophobicContact CG1-CD2 3.69Å; L784-L850 HydrophobicContact CD1-CD1 4.1Å; L846-L850 WeakPolarHBondContact O-CB 3.31Å; L846-L850 PolarHBondContact O-N 2.94Å; L850-F853 HydrophobicContact CD1-CD1 4.33Å; L850-F853 PolarHBondContact O-N 2.71Å; L850-M854 HydrophobicContact CD1-CG 4.34Å; L850-M854 HydrophobicContact CG-CG 4.34Å; L850-M854 VanDerWaalsContact O-CB 3.3Å; L850-M854 WeakPolarHBondContact O-CB 3.38Å; L850-M854 WeakPolarHBondContact O-CG 3.44Å; L850-M854 PolarHBondContact O-N 2.94Å
851	W	93.4	Very high	89.6	Confident	132 Å²	132	41.3 Å²	41.3	50%	0.5	24%	0.238	S	C	.	.	H	α-helix	trans	-65.6	-42.6	175.8	177.8	66.7	0	0	0	112.8	C847 G848 T849 R855 F938 L942	C847-W851 WeakPolarHBondContact O-CB 3.4Å; C847-W851 PolarHBondContact O-N 3.18Å; G848-W851 PolarHBondContact O-N 3.09Å; T849-W851 VanDerWaalsContact C-N 3.34Å; T849-W851 PolarHBondContact O-N 2.98Å; W851-R855 WeakPolarHBondContact O-CB 3.41Å; W851-R855 PolarHBondContact O-N 3.21Å; W851-R855 VanDerWaalsContact O-N 3.1Å; W851-F938 HydrophobicContact CH2-CE2 4.1Å; W851-F938 AromaticContact CH2-CZ 3.84Å; W851-F938 HydrophobicContact CH2-CZ 3.84Å; W851-F938 HydrophobicContact CZ3-CE2 4.13Å; W851-F938 AromaticContact CZ3-CZ 3.6Å; W851-F938 HydrophobicContact CZ3-CZ 3.6Å; W851-L942 HydrophobicContact CE3-CD1 4.04Å; W851-L942 HydrophobicContact CE3-CD2 3.92Å; W851-L942 HydrophobicContact CZ3-CD1 3.79Å; W851-L942 HydrophobicContact CZ3-CD2 3.89Å; W851-L942 HydrophobicContact CZ3-CG 4.44Å
852	V	92.1	Very high	89	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-63.1	-45.9	174.1	168.8	0	0	0	0	111	G848 T849 R855 E856 M869 C873 F938 L939 L942	G848-V852 PolarHBondContact O-N 3.11Å; T849-V852 PolarHBondContact O-N 2.82Å; V852-R855 PolarHBondContact O-N 3.03Å; V852-E856 HydrophobicContact CG1-CG 4.48Å; V852-E856 PolarHBondContact O-N 3.25Å; V852-M869 HydrophobicContact CG1-CE 4.19Å; V852-M869 HydrophobicContact CG1-CG 3.9Å; V852-C873 HydrophobicContact CG1-CB 4.32Å; V852-F938 HydrophobicContact CG2-CE1 4.18Å; V852-L939 HydrophobicContact CG1-CD2 4.33Å; V852-L939 HydrophobicContact CG2-CD2 4.18Å; V852-L942 HydrophobicContact CG2-CD2 3.39Å
853	F	91.1	Very high	88.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-48.6	177.3	177.6	-113.1	0	0	0	112.3	L784 P785 P787 T849 L850 R855 E856 I857 M862 V866 T870	L784-F853 HydrophobicContact CB-CE1 4.14Å; L784-F853 HydrophobicContact CD1-CD1 4.42Å; L784-F853 HydrophobicContact CD1-CE1 4.04Å; P785-F853 HydrophobicContact CG-CZ 4.17Å; P785-F853 WeakPolarHBondContact O-CZ 3.45Å; P787-F853 HydrophobicContact CB-CD1 4.06Å; P787-F853 HydrophobicContact CB-CD2 3.77Å; P787-F853 HydrophobicContact CB-CE1 4.09Å; P787-F853 HydrophobicContact CB-CE2 3.83Å; P787-F853 HydrophobicContact CB-CG 3.88Å; P787-F853 HydrophobicContact CB-CZ 3.97Å; T849-F853 WeakPolarHBondContact O-CB 3.36Å; T849-F853 PolarHBondContact O-N 2.81Å; L850-F853 HydrophobicContact CD1-CD1 4.33Å; L850-F853 PolarHBondContact O-N 2.71Å; F853-R855 PolarHBondContact O-N 3.33Å; F853-E856 PolarHBondContact O-N 3.24Å; F853-I857 HydrophobicContact CZ-CD1 4.23Å; F853-I857 WeakPolarHBondContact O-CB 3.25Å; F853-I857 VanDerWaalsContact O-CG2 3.22Å; F853-I857 WeakPolarHBondContact O-CG2 3.39Å; F853-I857 PolarHBondContact O-N 3Å; F853-M862 HydrophobicContact CE2-CE 4.4Å; F853-M862 HydrophobicContact CE2-SD 3.92Å; F853-M862 HydrophobicContact CZ-SD 4.17Å; F853-V866 HydrophobicContact CD2-CG1 3.79Å; F853-V866 HydrophobicContact CE2-CG1 3.96Å; F853-T870 HydrophobicContact CB-CG2 4.03Å; F853-T870 HydrophobicContact CD2-CG2 4.39Å
854	M	89.8	Confident	88	Confident	79 Å²	79	49.2 Å²	49.2	39%	0.389	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-28	177.8	-74.3	-70.5	-146.7	0	0	113.5	L784 L850 I857 S858	L784-M854 HydrophobicContact CD1-CE 3.53Å; L784-M854 HydrophobicContact CD1-SD 3.88Å; L784-M854 HydrophobicContact CD2-CE 4.12Å; L784-M854 HydrophobicContact CD2-SD 4.11Å; L784-M854 HydrophobicContact CG-CE 4.41Å; L850-M854 HydrophobicContact CD1-CG 4.34Å; L850-M854 HydrophobicContact CG-CG 4.34Å; L850-M854 VanDerWaalsContact O-CB 3.3Å; L850-M854 WeakPolarHBondContact O-CB 3.38Å; L850-M854 WeakPolarHBondContact O-CG 3.44Å; L850-M854 PolarHBondContact O-N 2.94Å; M854-I857 WeakPolarHBondContact O-CG2 3.34Å; M854-S858 PolarHBondContact O-N 2.77Å; M854-S858 PolarHBondContact O-OG 3.15Å
855	R	90.2	Very high	87.7	Confident	96 Å²	96	50.2 Å²	50.2	36%	0.362	28%	0.276	S	S	.	.	H	α-helix	trans	-79.9	-50.2	176.6	176.3	-179.8	164.2	-161.4	-11.8	112.3	W851 V852 F853 I857 S858 D859	W851-R855 WeakPolarHBondContact O-CB 3.41Å; W851-R855 PolarHBondContact O-N 3.21Å; W851-R855 VanDerWaalsContact O-N 3.1Å; V852-R855 PolarHBondContact O-N 3.03Å; F853-R855 PolarHBondContact O-N 3.33Å; R855-I857 VanDerWaalsContact C-N 3.29Å; R855-I857 PolarHBondContact O-N 2.7Å; R855-S858 PolarHBondContact O-N 3.41Å; R855-S858 PolarHBondContact O-OG 3.29Å; R855-D859 PolarHBondContact O-N 2.87Å
856	E	88.3	Confident	87.5	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.037	28%	0.276	C	S	.	.	H	α-helix	trans	-69.9	-29.8	-177.3	-60.9	-67.4	132.8	0	0	111.5	V852 F853 D859 S860 R865 V866 M869	V852-E856 HydrophobicContact CG1-CG 4.48Å; V852-E856 PolarHBondContact O-N 3.25Å; F853-E856 PolarHBondContact O-N 3.24Å; E856-D859 PolarHBondContact O-N 3.3Å; E856-S860 PolarHBondContact O-N 3.37Å; E856-R865 IonicContact OE2-CZ 2.95Å; E856-R865 IonicContact OE2-NH1 2.68Å; E856-R865 PolarHBondContact OE2-NH1 3.03Å; E856-R865 IonicContact OE2-NH2 3.19Å; E856-V866 HydrophobicContact CB-CB 4.46Å; E856-V866 HydrophobicContact CB-CG1 4.22Å; E856-V866 HydrophobicContact CB-CG2 3.95Å; E856-M869 VanDerWaalsContact CD-SD 3.5Å; E856-M869 HydrophobicContact CG-CE 3.86Å; E856-M869 HydrophobicContact CG-CG 4.13Å; E856-M869 HydrophobicContact CG-SD 3.76Å; E856-M869 WeakPolarHBondContact OE1-CE 3.33Å
857	I	87.4	Confident	87.2	Confident	39 Å²	39	49.4 Å²	49.4	20%	0.2	27%	0.273	C	S	.	.	H	α-helix	trans	-70.4	-30.2	172.8	-157.4	177.9	0	0	0	112.9	P785 F853 M854 R855 G861 M862 V866	P785-I857 HydrophobicContact CG-CD1 3.63Å; F853-I857 HydrophobicContact CZ-CD1 4.23Å; F853-I857 WeakPolarHBondContact O-CB 3.25Å; F853-I857 VanDerWaalsContact O-CG2 3.22Å; F853-I857 WeakPolarHBondContact O-CG2 3.39Å; F853-I857 PolarHBondContact O-N 3Å; M854-I857 WeakPolarHBondContact O-CG2 3.34Å; R855-I857 VanDerWaalsContact C-N 3.29Å; R855-I857 PolarHBondContact O-N 2.7Å; I857-G861 WeakPolarHBondContact O-CA 3.31Å; I857-G861 PolarHBondContact O-N 3.29Å; I857-M862 HydrophobicContact CD1-CG 3.92Å; I857-M862 HydrophobicContact CD1-SD 3.64Å; I857-M862 HydrophobicContact CG1-CG 4.28Å; I857-M862 HydrophobicContact CG1-SD 4.07Å; I857-V866 HydrophobicContact CB-CG1 4.5Å
858	S	84.9	Confident	87.1	Confident	90 Å²	90	45.2 Å²	45.2	63%	0.629	24%	0.244	S	C	*	.	H	α-helix	trans	-72	-31.5	173.7	61.9	0	0	0	0	112.6	M854 R855	M854-S858 PolarHBondContact O-N 2.77Å; M854-S858 PolarHBondContact O-OG 3.15Å; R855-S858 PolarHBondContact O-N 3.41Å; R855-S858 PolarHBondContact O-OG 3.29Å
859	D	80.6	Confident	87	Confident	108 Å²	108	45 Å²	45	58%	0.578	24%	0.241	S	C	*	.	H	α-helix	trans	-84	-32	-176.1	-67.4	6.4	0	0	0	112.4	R855 E856	R855-D859 PolarHBondContact O-N 2.87Å; E856-D859 PolarHBondContact O-N 3.3Å
860	S	73.6	Confident	87	Confident	62 Å²	62	45 Å²	45	43%	0.434	24%	0.241	S	C	.	.	H	α-helix	trans	-130.5	-10.4	-170.4	-58.7	0	0	0	0	116.2	E856	E856-S860 PolarHBondContact O-N 3.37Å
861	G	79.9	Confident	86.9	Confident	33 Å²	33	43.5 Å²	43.5	34%	0.34	23%	0.233	S	C	.	.	S	Bend	trans	65.4	-170.8	-161.1	0	0	0	0	0	112.2	I857 T863 V866	I857-G861 WeakPolarHBondContact O-CA 3.31Å; I857-G861 PolarHBondContact O-N 3.29Å; G861-T863 PolarHBondContact O-N 3.23Å; G861-T863 VanDerWaalsContact O-N 3.16Å; G861-V866 VanDerWaalsContact O-CG2 3.25Å; G861-V866 WeakPolarHBondContact O-CG2 3.28Å
862	M	79.4	Confident	86.9	Confident	88 Å²	88	37.2 Å²	37.2	43%	0.433	21%	0.209	S	C	.	.	S	Bend	trans	-74.5	106.9	179.3	-75.3	-61.2	-68.2	0	0	111.7	P785 F853 I857 V866 T867	P785-M862 HydrophobicContact CB-CE 4.11Å; P785-M862 HydrophobicContact CB-CG 4.02Å; P785-M862 HydrophobicContact CB-SD 4.05Å; P785-M862 HydrophobicContact CG-CE 4.24Å; P785-M862 HydrophobicContact CG-CG 3.53Å; P785-M862 HydrophobicContact CG-SD 3.52Å; P785-M862 VanDerWaalsContact CG-SD 3.52Å; F853-M862 HydrophobicContact CE2-CE 4.4Å; F853-M862 HydrophobicContact CE2-SD 3.92Å; F853-M862 HydrophobicContact CZ-SD 4.17Å; I857-M862 HydrophobicContact CD1-CG 3.92Å; I857-M862 HydrophobicContact CD1-SD 3.64Å; I857-M862 HydrophobicContact CG1-CG 4.28Å; I857-M862 HydrophobicContact CG1-SD 4.07Å; M862-V866 HydrophobicContact SD-CG1 4.4Å; M862-T867 HydrophobicContact CE-CG2 3.96Å
863	T	83.4	Confident	87	Confident	47 Å²	47	37.2 Å²	37.2	29%	0.288	21%	0.209	S	C	.	.			trans	-126.3	161.4	172.4	63	0	0	0	0	110.7	G861 R865 V866 T867	G861-T863 PolarHBondContact O-N 3.23Å; G861-T863 VanDerWaalsContact O-N 3.16Å; T863-R865 PolarHBondContact O-N 3.27Å; T863-V866 WeakPolarHBondContact O-CB 3.44Å; T863-V866 PolarHBondContact O-N 3.1Å; T863-T867 PolarHBondContact O-N 2.79Å
864	P	81.5	Confident	87.1	Confident	67 Å²	67	37.2 Å²	37.2	44%	0.435	21%	0.209	S	C	.	.	H	α-helix	trans	-56.5	-31.8	174	-25.9	36.7	0	0	0	113.1	V866 T867 T868 E929	P864-V866 VanDerWaalsContact C-N 3.34Å; P864-V866 PolarHBondContact O-N 2.79Å; P864-T867 PolarHBondContact O-N 2.91Å; P864-T867 PolarHBondContact O-OG1 2.9Å; P864-T868 WeakPolarHBondContact O-CB 3.41Å; P864-T868 PolarHBondContact O-N 3.12Å; P864-T868 PolarHBondContact O-OG1 3.38Å; P864-E929 HydrophobicContact CB-CB 4.17Å
865	R	87	Confident	87.3	Confident	52 Å²	52	33.5 Å²	33.5	20%	0.196	19%	0.191	C	C	.	.	H	α-helix	trans	-56.3	-40.8	169	-171.4	168.1	175.6	-80.1	-15.4	113.6	E856 T863 T868 M869 E929 L931 D935	E856-R865 IonicContact OE2-CZ 2.95Å; E856-R865 IonicContact OE2-NH1 2.68Å; E856-R865 PolarHBondContact OE2-NH1 3.03Å; E856-R865 IonicContact OE2-NH2 3.19Å; T863-R865 PolarHBondContact O-N 3.27Å; R865-T868 PolarHBondContact O-N 2.94Å; R865-M869 VanDerWaalsContact O-CB 3.25Å; R865-M869 WeakPolarHBondContact O-CB 3.41Å; R865-M869 PolarHBondContact O-N 3.09Å; R865-E929 HydrophobicContact CB-CB 4.4Å; R865-E929 WeakPolarHBondContact CB-OE2 3.44Å; R865-E929 PolarHBondContact N-OE2 2.95Å; R865-L931 HydrophobicContact CG-CD2 4.06Å; R865-D935 IonicContact CZ-OD2 2.9Å; R865-D935 IonicContact NE-OD2 3.47Å; R865-D935 IonicContact NH2-OD1 3.47Å; R865-D935 IonicContact NH2-OD2 3.58Å; R865-D935 PolarHBondContact NH2-OD2 2.93Å
866	V	89.3	Confident	87.5	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-47.3	179.1	179	0	0	0	0	111.5	F853 E856 I857 G861 M862 T863 P864 T868 M869 T870	F853-V866 HydrophobicContact CD2-CG1 3.79Å; F853-V866 HydrophobicContact CE2-CG1 3.96Å; E856-V866 HydrophobicContact CB-CB 4.46Å; E856-V866 HydrophobicContact CB-CG1 4.22Å; E856-V866 HydrophobicContact CB-CG2 3.95Å; I857-V866 HydrophobicContact CB-CG1 4.5Å; G861-V866 VanDerWaalsContact O-CG2 3.25Å; G861-V866 WeakPolarHBondContact O-CG2 3.28Å; M862-V866 HydrophobicContact SD-CG1 4.4Å; T863-V866 WeakPolarHBondContact O-CB 3.44Å; T863-V866 PolarHBondContact O-N 3.1Å; P864-V866 VanDerWaalsContact C-N 3.34Å; P864-V866 PolarHBondContact O-N 2.79Å; V866-T868 VanDerWaalsContact C-N 3.34Å; V866-M869 PolarHBondContact O-N 2.95Å; V866-T870 WeakPolarHBondContact O-CB 3.35Å; V866-T870 PolarHBondContact O-N 2.9Å; V866-T870 PolarHBondContact O-OG1 3.38Å
867	T	87.4	Confident	87.7	Confident	9 Å²	9	29.7 Å²	29.7	6%	0.055	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-40.7	178.2	62.4	0	0	0	0	110.5	M862 T863 P864 T870 F871	M862-T867 HydrophobicContact CE-CG2 3.96Å; T863-T867 PolarHBondContact O-N 2.79Å; P864-T867 PolarHBondContact O-N 2.91Å; P864-T867 PolarHBondContact O-OG1 2.9Å; T867-T870 PolarHBondContact O-N 3.2Å; T867-F871 WeakPolarHBondContact O-CB 3.4Å; T867-F871 PolarHBondContact O-N 2.92Å
868	T	91.3	Very high	88	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.9	-42.6	177.4	-48.6	0	0	0	0	112.7	P864 R865 V866 T870 F871 T872 I917 T928 E929 L931	P864-T868 WeakPolarHBondContact O-CB 3.41Å; P864-T868 PolarHBondContact O-N 3.12Å; P864-T868 PolarHBondContact O-OG1 3.38Å; R865-T868 PolarHBondContact O-N 2.94Å; V866-T868 VanDerWaalsContact C-N 3.34Å; T868-T870 VanDerWaalsContact C-N 3.34Å; T868-F871 PolarHBondContact O-N 3.34Å; T868-T872 VanDerWaalsContact O-CB 3.25Å; T868-T872 WeakPolarHBondContact O-CB 3.43Å; T868-T872 PolarHBondContact O-N 3.28Å; T868-T872 PolarHBondContact O-OG1 3.07Å; T868-I917 HydrophobicContact CG2-CG1 4.04Å; T868-T928 HydrophobicContact CG2-CG2 3.92Å; T868-T928 WeakPolarHBondContact OG1-CA 3.33Å; T868-E929 WeakPolarHBondContact CG2-O 3.39Å; T868-E929 PolarHBondContact OG1-N 2.93Å; T868-L931 HydrophobicContact CG2-CD1 4.16Å; T868-L931 HydrophobicContact CG2-CD2 4.41Å; T868-L931 HydrophobicContact CG2-CG 4.06Å
869	M	91.7	Very high	88.3	Confident	3 Å²	3	24.1 Å²	24.1	2%	0.015	14%	0.14	C	C	.	.	H	α-helix	trans	-67.7	-36.2	178.1	-174.7	146.6	163	0	0	111.5	V852 E856 R865 V866 C873 L931 D935 F938 L939	V852-M869 HydrophobicContact CG1-CE 4.19Å; V852-M869 HydrophobicContact CG1-CG 3.9Å; E856-M869 VanDerWaalsContact CD-SD 3.5Å; E856-M869 HydrophobicContact CG-CE 3.86Å; E856-M869 HydrophobicContact CG-CG 4.13Å; E856-M869 HydrophobicContact CG-SD 3.76Å; E856-M869 WeakPolarHBondContact OE1-CE 3.33Å; R865-M869 VanDerWaalsContact O-CB 3.25Å; R865-M869 WeakPolarHBondContact O-CB 3.41Å; R865-M869 PolarHBondContact O-N 3.09Å; V866-M869 PolarHBondContact O-N 2.95Å; M869-C873 WeakPolarHBondContact O-CB 3.36Å; M869-C873 PolarHBondContact O-N 3.3Å; M869-L931 HydrophobicContact CB-CD2 4.13Å; M869-D935 HydrophobicContact SD-CB 4.31Å; M869-F938 HydrophobicContact CE-CD1 3.87Å; M869-F938 HydrophobicContact CE-CE1 3.9Å; M869-L939 HydrophobicContact CG-CD1 4.4Å
870	T	92.1	Very high	88.9	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-69.6	-43.8	175.1	-52.1	0	0	0	0	111.8	P787 L788 F853 V866 T867 T868 C873 F874	P787-T870 HydrophobicContact CB-CG2 4.06Å; L788-T870 HydrophobicContact CD2-CG2 4.23Å; F853-T870 HydrophobicContact CB-CG2 4.03Å; F853-T870 HydrophobicContact CD2-CG2 4.39Å; V866-T870 WeakPolarHBondContact O-CB 3.35Å; V866-T870 PolarHBondContact O-N 2.9Å; V866-T870 PolarHBondContact O-OG1 3.38Å; T867-T870 PolarHBondContact O-N 3.2Å; T868-T870 VanDerWaalsContact C-N 3.34Å; T870-C873 WeakPolarHBondContact O-CB 3.33Å; T870-C873 PolarHBondContact O-N 3.03Å; T870-F874 WeakPolarHBondContact O-CB 3.46Å; T870-F874 PolarHBondContact O-N 3.01Å
871	F	91.6	Very high	89.7	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59	-48.2	172.6	168.4	-109.3	0	0	0	112.3	L788 Q792 F795 I796 T867 T868 C873 F874 V875 L913 V916	L788-F871 HydrophobicContact CD2-CB 3.8Å; Q792-F871 HydrophobicContact CB-CD2 3.78Å; Q792-F871 HydrophobicContact CB-CE2 4.06Å; Q792-F871 HydrophobicContact CG-CD2 4.18Å; Q792-F871 HydrophobicContact CG-CE2 4.45Å; F795-F871 HydrophobicContact CD1-CE2 4.02Å; F795-F871 AromaticContact CD1-CZ 3.69Å; F795-F871 HydrophobicContact CD1-CZ 3.69Å; F795-F871 HydrophobicContact CE1-CZ 4.03Å; I796-F871 HydrophobicContact CD1-CD2 4.02Å; I796-F871 HydrophobicContact CD1-CE2 4.21Å; I796-F871 HydrophobicContact CG1-CD2 4.29Å; I796-F871 HydrophobicContact CG1-CE2 3.98Å; T867-F871 WeakPolarHBondContact O-CB 3.4Å; T867-F871 PolarHBondContact O-N 2.92Å; T868-F871 PolarHBondContact O-N 3.34Å; F871-C873 VanDerWaalsContact C-N 3.31Å; F871-C873 PolarHBondContact O-N 3.35Å; F871-F874 PolarHBondContact O-N 2.79Å; F871-V875 HydrophobicContact CD2-CG2 4.46Å; F871-V875 HydrophobicContact CE2-CG2 4.24Å; F871-V875 HydrophobicContact CZ-CG2 4.47Å; F871-V875 WeakPolarHBondContact O-CG2 3.44Å; F871-V875 PolarHBondContact O-N 3.24Å; F871-L913 HydrophobicContact CD1-CD1 4.22Å; F871-L913 HydrophobicContact CE1-CD1 3.64Å; F871-L913 HydrophobicContact CZ-CD1 4.22Å; F871-V916 HydrophobicContact CE1-CG1 4.21Å; F871-V916 HydrophobicContact CZ-CG1 4.5Å
872	T	92.9	Very high	90.2	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64	-37.6	177.6	-54.5	0	0	0	0	111.3	T868 F876 L913 I917 L931 F936 L939	T868-T872 VanDerWaalsContact O-CB 3.25Å; T868-T872 WeakPolarHBondContact O-CB 3.43Å; T868-T872 PolarHBondContact O-N 3.28Å; T868-T872 PolarHBondContact O-OG1 3.07Å; T872-F876 HydrophobicContact CG2-CD2 3.84Å; T872-F876 HydrophobicContact CG2-CE2 3.66Å; T872-F876 VanDerWaalsContact O-CD2 3.25Å; T872-F876 WeakPolarHBondContact O-CD2 3.49Å; T872-F876 PolarHBondContact O-N 3.17Å; T872-F876 VanDerWaalsContact O-N 3.1Å; T872-L913 HydrophobicContact CG2-CD2 4.18Å; T872-I917 HydrophobicContact CG2-CD1 4.18Å; T872-I917 WeakPolarHBondContact OG1-CD1 3.12Å; T872-L931 HydrophobicContact CG2-CD1 3.97Å; T872-L931 WeakPolarHBondContact OG1-CD1 3.46Å; T872-F936 HydrophobicContact CG2-CE1 4.11Å; T872-L939 HydrophobicContact CG2-CD1 3.63Å
873	C	94	Very high	90.7	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-62.2	-48.5	174.2	-174.9	0	0	0	0	111.8	T849 V852 M869 T870 F871 F876 F877 L939	T849-C873 HydrophobicContact CG2-CB 4.46Å; V852-C873 HydrophobicContact CG1-CB 4.32Å; M869-C873 WeakPolarHBondContact O-CB 3.36Å; M869-C873 PolarHBondContact O-N 3.3Å; T870-C873 WeakPolarHBondContact O-CB 3.33Å; T870-C873 PolarHBondContact O-N 3.03Å; F871-C873 VanDerWaalsContact C-N 3.31Å; F871-C873 PolarHBondContact O-N 3.35Å; C873-F876 PolarHBondContact O-N 3.35Å; C873-F877 VanDerWaalsContact O-CD2 3.28Å; C873-F877 WeakPolarHBondContact O-CD2 3.3Å; C873-F877 PolarHBondContact O-N 3.37Å; C873-F877 WeakPolarHBondContact SG-CE2 3.42Å; C873-L939 HydrophobicContact CB-CD1 4.39Å; C873-L939 HydrophobicContact CB-CD2 3.58Å
874	F	93.6	Very high	90.9	Very high	1 Å²	1	12.6 Å²	12.6	0%	0.004	6%	0.06	C	C	.	.	H	α-helix	trans	-59.1	-51.7	179	-163.6	-75.7	0	0	0	111	T768 A771 A772 L775 L788 I796 I845 T849 T870 F871 F876 F877 D878	T768-F874 HydrophobicContact CG2-CE1 3.83Å; T768-F874 HydrophobicContact CG2-CZ 4.34Å; A771-F874 HydrophobicContact CB-CE2 4.14Å; A771-F874 HydrophobicContact CB-CZ 4.04Å; A772-F874 HydrophobicContact CB-CE2 4.26Å; A772-F874 HydrophobicContact CB-CZ 3.78Å; L775-F874 HydrophobicContact CD2-CD2 3.92Å; L775-F874 HydrophobicContact CD2-CE2 4.11Å; L788-F874 HydrophobicContact CD1-CD2 4.08Å; L788-F874 HydrophobicContact CD1-CG 4.33Å; I796-F874 HydrophobicContact CD1-CD1 3.7Å; I796-F874 HydrophobicContact CD1-CE1 4.17Å; I796-F874 HydrophobicContact CD1-CG 4.29Å; I796-F874 HydrophobicContact CG1-CD1 4.48Å; I796-F874 HydrophobicContact CG2-CD1 4.26Å; I796-F874 HydrophobicContact CG2-CE1 4Å; I845-F874 HydrophobicContact CG2-CD2 4.32Å; I845-F874 HydrophobicContact CG2-CE2 4.15Å; I845-F874 HydrophobicContact CG2-CZ 4.47Å; T849-F874 HydrophobicContact CG2-CB 3.93Å; T849-F874 HydrophobicContact CG2-CD2 3.85Å; T849-F874 HydrophobicContact CG2-CG 4.26Å; T870-F874 WeakPolarHBondContact O-CB 3.46Å; T870-F874 PolarHBondContact O-N 3.01Å; F871-F874 PolarHBondContact O-N 2.79Å; F874-F876 PolarHBondContact O-N 3.49Å; F874-F877 VanDerWaalsContact O-CB 3.3Å; F874-F877 WeakPolarHBondContact O-CB 3.35Å; F874-F877 PolarHBondContact O-N 2.58Å; F874-F877 VanDerWaalsContact O-N 3.11Å; F874-D878 WeakPolarHBondContact CD1-OD2 3.37Å; F874-D878 WeakPolarHBondContact CE1-OD2 3.27Å; F874-D878 PolarHBondContact O-N 3.37Å
875	V	93	Very high	91.1	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.006	4%	0.04	C	C	.	.	H	α-helix	trans	-58.8	-42.3	178.3	169.6	0	0	0	0	112.9	I796 M800 F871 F877 D878 M879 L913	I796-V875 HydrophobicContact CG1-CG2 3.96Å; M800-V875 HydrophobicContact CE-CG1 3.45Å; M800-V875 VanDerWaalsContact CE-CG1 3.45Å; M800-V875 HydrophobicContact CE-CG2 4.39Å; M800-V875 HydrophobicContact CG-CG2 4.29Å; F871-V875 HydrophobicContact CD2-CG2 4.46Å; F871-V875 HydrophobicContact CE2-CG2 4.24Å; F871-V875 HydrophobicContact CZ-CG2 4.47Å; F871-V875 WeakPolarHBondContact O-CG2 3.44Å; F871-V875 PolarHBondContact O-N 3.24Å; V875-F877 VanDerWaalsContact C-N 3.34Å; V875-D878 PolarHBondContact O-N 3.33Å; V875-M879 WeakPolarHBondContact O-CG 3.45Å; V875-M879 PolarHBondContact O-N 2.92Å; V875-M879 VanDerWaalsContact O-N 3.08Å; V875-L913 HydrophobicContact CB-CD1 4.3Å; V875-L913 HydrophobicContact CB-CD2 4.32Å; V875-L913 HydrophobicContact CG1-CD1 4.15Å; V875-L913 HydrophobicContact CG1-CD2 3.75Å; V875-L913 HydrophobicContact CG1-CG 4.4Å; V875-L913 HydrophobicContact CG2-CD1 4.27Å
876	F	93.6	Very high	91.1	Very high	22 Å²	22	7.4 Å²	7.4	10%	0.096	3%	0.032	C	C	.	.	H	α-helix	trans	-66.4	-37.3	177.4	-86	-55	0	0	0	112.2	T872 C873 F874 D878 M879 W880 L913 F936 L939 T943	T872-F876 HydrophobicContact CG2-CD2 3.84Å; T872-F876 HydrophobicContact CG2-CE2 3.66Å; T872-F876 VanDerWaalsContact O-CD2 3.25Å; T872-F876 WeakPolarHBondContact O-CD2 3.49Å; T872-F876 PolarHBondContact O-N 3.17Å; T872-F876 VanDerWaalsContact O-N 3.1Å; C873-F876 PolarHBondContact O-N 3.35Å; F874-F876 PolarHBondContact O-N 3.49Å; F876-D878 VanDerWaalsContact C-N 3.29Å; F876-D878 PolarHBondContact O-N 3.43Å; F876-M879 PolarHBondContact O-N 3.04Å; F876-W880 PolarHBondContact O-N 2.59Å; F876-L913 HydrophobicContact CE2-CD2 4.3Å; F876-L913 HydrophobicContact CZ-CD2 4.3Å; F876-F936 AromaticContact CE2-CD1 3.71Å; F876-F936 HydrophobicContact CE2-CD1 3.71Å; F876-F936 HydrophobicContact CE2-CE1 4.16Å; F876-F936 AromaticContact CZ-CD1 3.86Å; F876-F936 HydrophobicContact CZ-CD1 3.86Å; F876-F936 HydrophobicContact CZ-CE1 4.32Å; F876-L939 HydrophobicContact CD2-CB 4.09Å; F876-T943 HydrophobicContact CB-CG2 3.66Å
877	F	94.5	Very high	90.6	Very high	1 Å²	1	8 Å²	8	0%	0.004	4%	0.037	C	C	.	.	H	α-helix	trans	-58.5	-41.3	171.6	-90.3	-55	0	0	0	111.8	I845 T849 C873 F874 V875 W880 N881 L942 T943 V946	I845-F877 HydrophobicContact CB-CB 4.44Å; I845-F877 HydrophobicContact CG1-CB 4.04Å; I845-F877 HydrophobicContact CG1-CD1 4.47Å; I845-F877 HydrophobicContact CG1-CG 4.34Å; I845-F877 HydrophobicContact CG2-CB 3.96Å; I845-F877 HydrophobicContact CG2-CD2 4.37Å; I845-F877 HydrophobicContact CG2-CG 4.27Å; T849-F877 HydrophobicContact CG2-CD2 3.65Å; T849-F877 HydrophobicContact CG2-CE2 4Å; C873-F877 VanDerWaalsContact O-CD2 3.28Å; C873-F877 WeakPolarHBondContact O-CD2 3.3Å; C873-F877 PolarHBondContact O-N 3.37Å; C873-F877 WeakPolarHBondContact SG-CE2 3.42Å; F874-F877 VanDerWaalsContact O-CB 3.3Å; F874-F877 WeakPolarHBondContact O-CB 3.35Å; F874-F877 PolarHBondContact O-N 2.58Å; F874-F877 VanDerWaalsContact O-N 3.11Å; V875-F877 VanDerWaalsContact C-N 3.34Å; F877-W880 PolarHBondContact O-N 3.03Å; F877-N881 VanDerWaalsContact O-CB 3.29Å; F877-N881 WeakPolarHBondContact O-CB 3.48Å; F877-N881 PolarHBondContact O-N 3.44Å; F877-L942 HydrophobicContact CZ-CG 4.13Å; F877-T943 HydrophobicContact CB-CG2 4.33Å; F877-T943 HydrophobicContact CD1-CG2 3.87Å; F877-T943 HydrophobicContact CD2-CG2 3.7Å; F877-T943 VanDerWaalsContact CE1-CA 3.46Å; F877-T943 HydrophobicContact CE1-CG2 4.1Å; F877-T943 HydrophobicContact CE2-CG2 3.89Å; F877-T943 HydrophobicContact CG-CG2 3.69Å; F877-T943 HydrophobicContact CZ-CG2 4.08Å; F877-V946 HydrophobicContact CD1-CB 4.25Å; F877-V946 HydrophobicContact CD1-CG2 3.3Å; F877-V946 HydrophobicContact CE1-CG2 3.58Å; F877-V946 HydrophobicContact CG-CG2 4.38Å
878	D	92.2	Very high	89.8	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-65.3	-39.2	176.8	-67.9	-45.9	0	0	0	113	F764 T768 F874 V875 F876 W880 N881 A882	F764-D878 HydrophobicContact CE2-CB 4.19Å; F764-D878 WeakPolarHBondContact CE2-O 3.23Å; F764-D878 HydrophobicContact CZ-CB 4.44Å; T768-D878 WeakPolarHBondContact CB-OD1 3.45Å; T768-D878 WeakPolarHBondContact CG2-OD1 3.03Å; T768-D878 PolarHBondContact OG1-OD1 3.15Å; F874-D878 WeakPolarHBondContact CD1-OD2 3.37Å; F874-D878 WeakPolarHBondContact CE1-OD2 3.27Å; F874-D878 PolarHBondContact O-N 3.37Å; V875-D878 PolarHBondContact O-N 3.33Å; F876-D878 VanDerWaalsContact C-N 3.29Å; F876-D878 PolarHBondContact O-N 3.43Å; D878-W880 VanDerWaalsContact C-N 3.31Å; D878-W880 PolarHBondContact O-N 3.47Å; D878-N881 PolarHBondContact O-N 3.14Å; D878-A882 WeakPolarHBondContact O-CB 3.27Å; D878-A882 PolarHBondContact O-N 3.31Å
879	M	92	Very high	89.1	Confident	12 Å²	12	13.8 Å²	13.8	6%	0.059	6%	0.062	C	C	.	.	H	α-helix	trans	-62.2	-37.6	175.9	-62.1	-55.1	102.8	0	0	112.3	P804 V875 F876 L883 V906	P804-M879 HydrophobicContact CG-CE 4.05Å; P804-M879 HydrophobicContact CG-SD 4.21Å; V875-M879 WeakPolarHBondContact O-CG 3.45Å; V875-M879 PolarHBondContact O-N 2.92Å; V875-M879 VanDerWaalsContact O-N 3.08Å; F876-M879 PolarHBondContact O-N 3.04Å; M879-L883 PolarHBondContact O-N 2.89Å; M879-V906 HydrophobicContact CB-CG1 4.31Å; M879-V906 HydrophobicContact CG-CG1 4.37Å; M879-V906 HydrophobicContact SD-CB 4.5Å; M879-V906 HydrophobicContact SD-CG1 4.09Å; M879-V906 HydrophobicContact SD-CG2 4.32Å
880	W	92.7	Very high	88.4	Confident	73 Å²	73	14.8 Å²	14.8	28%	0.277	7%	0.068	S	C	.	.	H	α-helix	trans	-73.5	-39	173.9	-72.2	112.2	0	0	0	112.7	F876 F877 D878 L883 S884 T943 F947	F876-W880 PolarHBondContact O-N 2.59Å; F877-W880 PolarHBondContact O-N 3.03Å; D878-W880 VanDerWaalsContact C-N 3.31Å; D878-W880 PolarHBondContact O-N 3.47Å; W880-L883 HydrophobicContact CE3-CD2 3.99Å; W880-L883 HydrophobicContact CZ3-CD2 3.97Å; W880-L883 WeakPolarHBondContact O-CB 3.4Å; W880-L883 PolarHBondContact O-N 2.96Å; W880-S884 PolarHBondContact O-N 2.9Å; W880-T943 VanDerWaalsContact CD1-C 3.41Å; W880-T943 VanDerWaalsContact CD1-OG1 3.28Å; W880-T943 PolarHBondContact NE1-OG1 2.82Å; W880-F947 HydrophobicContact CB-CB 4.26Å; W880-F947 HydrophobicContact CD2-CB 4.45Å; W880-F947 HydrophobicContact CE3-CB 3.89Å; W880-F947 HydrophobicContact CE3-CD2 4.19Å; W880-F947 HydrophobicContact CE3-CG 4.03Å; W880-F947 HydrophobicContact CZ3-CG 4.45Å
881	N	91.5	Very high	87.7	Confident	1 Å²	1	15.2 Å²	15.2	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-60	-44.6	173.9	177.4	30.6	0	0	0	111.6	F764 S767 T768 I845 F877 D878 L883 S884 C885 V946	F764-N881 HydrophobicContact CD2-CB 4.37Å; F764-N881 WeakPolarHBondContact CD2-ND2 3.49Å; F764-N881 HydrophobicContact CE2-CB 4.45Å; S767-N881 PolarHBondContact OG-ND2 2.86Å; S767-N881 PolarHBondContact OG-OD1 3.14Å; T768-N881 PolarHBondContact OG1-ND2 2.78Å; I845-N881 HydrophobicContact CD1-CB 4.27Å; F877-N881 VanDerWaalsContact O-CB 3.29Å; F877-N881 WeakPolarHBondContact O-CB 3.48Å; F877-N881 PolarHBondContact O-N 3.44Å; D878-N881 PolarHBondContact O-N 3.14Å; N881-L883 VanDerWaalsContact C-N 3.32Å; N881-L883 PolarHBondContact O-N 3.04Å; N881-S884 PolarHBondContact O-N 3.39Å; N881-C885 WeakPolarHBondContact O-CB 3.29Å; N881-C885 PolarHBondContact O-N 2.99Å; N881-C885 PolarHBondContact O-SG 3.36Å; N881-V946 HydrophobicContact CB-CG1 4.15Å
882	A	90.3	Very high	86.7	Confident	0 Å²	0	24 Å²	24	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-59.1	-41.8	174.9	0	0	0	0	0	111.8	F764 P804 D878 C885 R886 F902	F764-A882 HydrophobicContact CD2-CB 3.85Å; F764-A882 HydrophobicContact CE2-CB 3.7Å; F764-A882 HydrophobicContact CG-CB 4.36Å; F764-A882 HydrophobicContact CZ-CB 4.05Å; P804-A882 HydrophobicContact CB-CB 4.17Å; D878-A882 WeakPolarHBondContact O-CB 3.27Å; D878-A882 PolarHBondContact O-N 3.31Å; A882-C885 PolarHBondContact O-N 3.03Å; A882-R886 PolarHBondContact O-N 2.78Å; A882-F902 HydrophobicContact CB-CE2 4.04Å; A882-F902 HydrophobicContact CB-CZ 4.22Å
883	L	90	Very high	85.7	Confident	22 Å²	22	29 Å²	29	12%	0.115	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-46.3	176.1	-178.5	61.8	0	0	0	111.3	M879 W880 N881 C885 R886 I891 L896 F902 F947	M879-L883 PolarHBondContact O-N 2.89Å; W880-L883 HydrophobicContact CE3-CD2 3.99Å; W880-L883 HydrophobicContact CZ3-CD2 3.97Å; W880-L883 WeakPolarHBondContact O-CB 3.4Å; W880-L883 PolarHBondContact O-N 2.96Å; N881-L883 VanDerWaalsContact C-N 3.32Å; N881-L883 PolarHBondContact O-N 3.04Å; L883-C885 VanDerWaalsContact C-N 3.29Å; L883-C885 PolarHBondContact O-N 2.76Å; L883-R886 WeakPolarHBondContact O-CB 3.3Å; L883-R886 PolarHBondContact O-N 3.36Å; L883-I891 HydrophobicContact CG-CD1 4.25Å; L883-I891 VanDerWaalsContact O-CD1 3.27Å; L883-I891 WeakPolarHBondContact O-CD1 3.42Å; L883-L896 HydrophobicContact CD1-CD2 3.87Å; L883-L896 HydrophobicContact CD2-CD2 4.39Å; L883-F902 HydrophobicContact CB-CE1 4.33Å; L883-F902 HydrophobicContact CB-CZ 3.95Å; L883-F902 HydrophobicContact CD1-CE1 3.78Å; L883-F902 HydrophobicContact CD1-CZ 4.13Å; L883-F947 HydrophobicContact CB-CD2 4.47Å; L883-F947 HydrophobicContact CD2-CD2 3.78Å; L883-F947 HydrophobicContact CD2-CE2 3.6Å; L883-F947 HydrophobicContact CG-CD2 4.03Å; L883-F947 HydrophobicContact CG-CE2 3.86Å
884	S	87.4	Confident	84.7	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.4	-31.9	175.2	-70.8	0	0	0	0	114.1	W880 N881 R886 F947 S950 K954	W880-S884 PolarHBondContact O-N 2.9Å; N881-S884 PolarHBondContact O-N 3.39Å; S884-R886 VanDerWaalsContact C-N 3.33Å; S884-R886 PolarHBondContact O-N 3.32Å; S884-F947 WeakPolarHBondContact OG-CA 3.17Å; S884-S950 WeakPolarHBondContact OG-CB 3.46Å; S884-K954 PolarHBondContact O-NZ 2.79Å
885	C	85.9	Confident	83.9	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.014	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.9	-179.4	-68.7	0	0	0	0	114.8	N760 R763 F764 L808 N881 A882 L883 S887	N760-C885 WeakPolarHBondContact CB-O 3.37Å; R763-C885 PolarHBondContact NE-SG 3.05Å; F764-C885 HydrophobicContact CB-CB 3.9Å; L808-C885 HydrophobicContact CD1-CB 4.47Å; N881-C885 WeakPolarHBondContact O-CB 3.29Å; N881-C885 PolarHBondContact O-N 2.99Å; N881-C885 PolarHBondContact O-SG 3.36Å; A882-C885 PolarHBondContact O-N 3.03Å; L883-C885 VanDerWaalsContact C-N 3.29Å; L883-C885 PolarHBondContact O-N 2.76Å; C885-S887 PolarHBondContact O-N 3.33Å; C885-S887 VanDerWaalsContact O-N 3.14Å
886	R	86.7	Confident	83	Confident	8 Å²	8	36 Å²	36	3%	0.03	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27	175.9	-76.6	-175.9	66.6	-158.4	-12.8	114.6	N760 L808 E811 A882 L883 S884 L896 F902	N760-R886 PolarHBondContact ND2-O 2.93Å; N760-R886 VanDerWaalsContact ND2-O 3.1Å; L808-R886 HydrophobicContact CD2-CB 4.18Å; L808-R886 HydrophobicContact CD2-CG 3.45Å; L808-R886 VanDerWaalsContact CD2-CG 3.45Å; E811-R886 IonicContact OE1-CZ 2.65Å; E811-R886 IonicContact OE1-NE 2.58Å; E811-R886 IonicContact OE1-NH2 3.42Å; E811-R886 PolarHBondContact OE1-NH2 2.92Å; E811-R886 IonicContact OE2-CZ 2.67Å; E811-R886 IonicContact OE2-NE 2.87Å; E811-R886 PolarHBondContact OE2-NE 3.01Å; E811-R886 IonicContact OE2-NH2 2.63Å; E811-R886 PolarHBondContact OE2-NH2 3.26Å; A882-R886 PolarHBondContact O-N 2.78Å; L883-R886 WeakPolarHBondContact O-CB 3.3Å; L883-R886 PolarHBondContact O-N 3.36Å; S884-R886 VanDerWaalsContact C-N 3.33Å; S884-R886 PolarHBondContact O-N 3.32Å; R886-L896 PolarHBondContact NH1-O 2.96Å; R886-F902 HydrophobicContact CG-CD2 3.99Å; R886-F902 HydrophobicContact CG-CE2 3.93Å; R886-F902 HydrophobicContact CG-CZ 4.41Å
887	S	78.3	Confident	82.2	Confident	14 Å²	14	42.7 Å²	42.7	10%	0.098	21%	0.205	C	C	.	.			trans	-163.6	168.8	174.3	-170.9	0	0	0	0	112.8	C885 K889 K954	C885-S887 PolarHBondContact O-N 3.33Å; C885-S887 VanDerWaalsContact O-N 3.14Å; S887-K889 PolarHBondContact OG-N 3.34Å; S887-K954 WeakPolarHBondContact O-CE 3.36Å; S887-K954 PolarHBondContact O-NZ 3.06Å
888	Q	71.3	Confident	81.5	Confident	74 Å²	74	48 Å²	48	35%	0.346	23%	0.225	S	C	.	.	S	Bend	trans	-81.2	-24.2	168.1	-66.2	166	43.8	0	0	112.1	R759 K954	R759-Q888 VanDerWaalsContact NH1-NE2 3.19Å; Q888-K954 WeakPolarHBondContact O-CD 3.5Å; Q888-K954 WeakPolarHBondContact O-CG 3.43Å
889	K	75.1	Confident	81	Confident	55 Å²	55	48.4 Å²	48.4	24%	0.239	23%	0.227	C	C	.	.	S	Bend	trans	-74.5	164.9	171.1	-77	176.3	179.4	171	0	112.2	D814 D816 S887 E893 I894 K954	D814-K889 VanDerWaalsContact CG-NZ 3.26Å; D814-K889 IonicContact OD1-NZ 3.29Å; D814-K889 PolarHBondContact OD1-NZ 2.84Å; D814-K889 WeakPolarHBondContact OD2-CD 3.43Å; D814-K889 VanDerWaalsContact OD2-CE 3.31Å; D814-K889 WeakPolarHBondContact OD2-CE 3.5Å; D814-K889 IonicContact OD2-NZ 3.96Å; D814-K889 PolarHBondContact OD2-NZ 2.64Å; D816-K889 IonicContact OD2-NZ 2.82Å; D816-K889 PolarHBondContact OD2-NZ 3.49Å; S887-K889 PolarHBondContact OG-N 3.34Å; K889-E893 WeakPolarHBondContact CB-OE2 3.35Å; K889-E893 WeakPolarHBondContact CD-OE2 3.27Å; K889-E893 WeakPolarHBondContact CG-OE2 3.48Å; K889-I894 HydrophobicContact CB-CD1 4.1Å; K889-I894 HydrophobicContact CB-CG1 4.49Å; K889-K954 WeakPolarHBondContact O-CD 3.4Å; K889-K954 PolarHBondContact O-NZ 2.87Å
890	L	77.1	Confident	80.7	Confident	25 Å²	25	57.6 Å²	57.6	13%	0.131	26%	0.262	C	S	.	.			trans	-63.4	141.7	173.3	-54.7	176.9	0	0	0	110.6	F892 E893 E951 K954 L955 Q958	L890-F892 PolarHBondContact O-N 3.4Å; L890-E893 HydrophobicContact CB-CG 4.18Å; L890-E893 WeakPolarHBondContact O-CB 3.46Å; L890-E893 PolarHBondContact O-N 3.32Å; L890-E893 VanDerWaalsContact O-N 3.1Å; L890-E951 WeakPolarHBondContact CA-OE2 3.5Å; L890-K954 HydrophobicContact CD2-CB 3.9Å; L890-L955 HydrophobicContact CD1-CD2 3.61Å; L890-L955 HydrophobicContact CD2-CD2 3.72Å; L890-L955 HydrophobicContact CD2-CG 3.73Å; L890-L955 HydrophobicContact CG-CD2 4.3Å; L890-Q958 VanDerWaalsContact CD1-OE1 3.31Å; L890-Q958 VanDerWaalsContact CG-OE1 3.25Å
891	I	77.3	Confident	80.4	Confident	9 Å²	9	59.3 Å²	59.3	5%	0.046	27%	0.274	C	S	.	.	H	α-helix	trans	-69.3	-25.1	-176.3	-70.9	168.9	0	0	0	112.1	L883 E893 I894 G895 L896 F947 E951	L883-I891 HydrophobicContact CG-CD1 4.25Å; L883-I891 VanDerWaalsContact O-CD1 3.27Å; L883-I891 WeakPolarHBondContact O-CD1 3.42Å; I891-E893 VanDerWaalsContact C-N 3.32Å; I891-E893 PolarHBondContact O-N 2.92Å; I891-I894 PolarHBondContact O-N 3.35Å; I891-G895 PolarHBondContact O-N 2.95Å; I891-G895 VanDerWaalsContact O-N 3.1Å; I891-L896 HydrophobicContact CG2-CD2 3.46Å; I891-L896 VanDerWaalsContact CG2-CD2 3.46Å; I891-L896 HydrophobicContact CG2-CG 4.11Å; I891-F947 HydrophobicContact CD1-CD2 4.29Å; I891-F947 HydrophobicContact CD1-CE2 3.55Å; I891-F947 HydrophobicContact CD1-CZ 4.34Å; I891-E951 WeakPolarHBondContact CD1-OE1 3.46Å; I891-E951 PolarHBondContact N-OE2 2.72Å
892	F	71.7	Confident	80.3	Confident	184 Å²	184	59.9 Å²	59.9	81%	0.807	28%	0.276	S	S	*	.	H	α-helix	trans	-64.1	-30.1	171.9	-63.3	-77.4	0	0	0	113.7	L890 I894	L890-F892 PolarHBondContact O-N 3.4Å; F892-I894 VanDerWaalsContact C-N 3.32Å
893	E	72.6	Confident	80.2	Confident	106 Å²	106	64 Å²	64	50%	0.495	30%	0.298	S	S	.	.	H	α-helix	trans	-74.6	-23	177.6	-65.8	171.4	-169.1	0	0	112.7	K889 L890 I891 Q958	K889-E893 WeakPolarHBondContact CB-OE2 3.35Å; K889-E893 WeakPolarHBondContact CD-OE2 3.27Å; K889-E893 WeakPolarHBondContact CG-OE2 3.48Å; L890-E893 HydrophobicContact CB-CG 4.18Å; L890-E893 WeakPolarHBondContact O-CB 3.46Å; L890-E893 PolarHBondContact O-N 3.32Å; L890-E893 VanDerWaalsContact O-N 3.1Å; I891-E893 VanDerWaalsContact C-N 3.32Å; I891-E893 PolarHBondContact O-N 2.92Å; E893-Q958 PolarHBondContact OE1-NE2 3.42Å
894	I	72.1	Confident	80.3	Confident	26 Å²	26	68.3 Å²	68.3	13%	0.133	32%	0.32	C	S	.	.	H	α-helix	trans	-102.2	-32	-169.3	-58.5	164.5	0	0	0	111.8	K889 I891 F892 R898	K889-I894 HydrophobicContact CB-CD1 4.1Å; K889-I894 HydrophobicContact CB-CG1 4.49Å; I891-I894 PolarHBondContact O-N 3.35Å; F892-I894 VanDerWaalsContact C-N 3.32Å; I894-R898 VanDerWaalsContact O-CD 3.28Å; I894-R898 WeakPolarHBondContact O-CD 3.43Å
895	G	76.7	Confident	80.4	Confident	32 Å²	32	68.9 Å²	68.9	33%	0.33	33%	0.325	S	S	.	.			trans	84.3	121.3	-175	0	0	0	0	0	112.8	I891 F897 R898	I891-G895 PolarHBondContact O-N 2.95Å; I891-G895 VanDerWaalsContact O-N 3.1Å; G895-F897 VanDerWaalsContact C-N 3.28Å; G895-F897 PolarHBondContact O-N 2.8Å; G895-R898 WeakPolarHBondContact O-CB 3.45Å; G895-R898 PolarHBondContact O-N 3.28Å; G895-R898 VanDerWaalsContact O-N 3.16Å
896	L	73.6	Confident	80.6	Confident	89 Å²	89	69.8 Å²	69.8	47%	0.466	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-51.8	-45.8	178.1	-71.1	168.7	0	0	0	112	L883 R886 I891 R898	L883-L896 HydrophobicContact CD1-CD2 3.87Å; L883-L896 HydrophobicContact CD2-CD2 4.39Å; R886-L896 PolarHBondContact NH1-O 2.96Å; I891-L896 HydrophobicContact CG2-CD2 3.46Å; I891-L896 VanDerWaalsContact CG2-CD2 3.46Å; I891-L896 HydrophobicContact CG2-CG 4.11Å; L896-R898 VanDerWaalsContact C-N 3.3Å; L896-R898 PolarHBondContact O-N 3.17Å
897	F	77.9	Confident	80.8	Confident	163 Å²	163	72.6 Å²	72.6	72%	0.715	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-80.1	0.9	-174.9	-58.3	-73.7	0	0	0	115.4	G895 N899 L903	G895-F897 VanDerWaalsContact C-N 3.28Å; G895-F897 PolarHBondContact O-N 2.8Å; F897-N899 VanDerWaalsContact C-N 3.35Å; F897-N899 PolarHBondContact O-N 3.37Å; F897-L903 HydrophobicContact CD1-CD2 4.18Å; F897-L903 HydrophobicContact CE1-CD2 4.28Å
898	R	78.4	Confident	81.4	Confident	113 Å²	113	77.5 Å²	77.5	43%	0.426	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-64.9	-35.2	-177.6	-171.9	174.3	174.6	-155.8	-10.5	112.9	P812 V813 I894 G895 L896	P812-R898 HydrophobicContact CG-CG 3.95Å; V813-R898 PolarHBondContact O-NH2 3.03Å; I894-R898 VanDerWaalsContact O-CD 3.28Å; I894-R898 WeakPolarHBondContact O-CD 3.43Å; G895-R898 WeakPolarHBondContact O-CB 3.45Å; G895-R898 PolarHBondContact O-N 3.28Å; G895-R898 VanDerWaalsContact O-N 3.16Å; L896-R898 VanDerWaalsContact C-N 3.3Å; L896-R898 PolarHBondContact O-N 3.17Å
899	N	82.1	Confident	82.4	Confident	8 Å²	8	74 Å²	74	4%	0.043	35%	0.352	C	S	.	.			trans	-105.5	95.9	174.7	-173.3	-11.9	0	0	0	110.6	S807 E811 F897 M901 F902 L903	S807-N899 PolarHBondContact O-ND2 2.8Å; E811-N899 VanDerWaalsContact OE2-CB 3.31Å; E811-N899 WeakPolarHBondContact OE2-CB 3.48Å; E811-N899 PolarHBondContact OE2-ND2 3.16Å; F897-N899 VanDerWaalsContact C-N 3.35Å; F897-N899 PolarHBondContact O-N 3.37Å; N899-M901 VanDerWaalsContact C-N 3.3Å; N899-M901 PolarHBondContact O-N 3.08Å; N899-M901 WeakPolarHBondContact OD1-CB 3.38Å; N899-M901 PolarHBondContact OD1-N 3.09Å; N899-M901 VanDerWaalsContact OD1-N 3.1Å; N899-F902 HydrophobicContact CB-CB 4Å; N899-F902 PolarHBondContact O-N 3.23Å; N899-F902 PolarHBondContact OD1-N 2.92Å; N899-L903 PolarHBondContact O-N 2.96Å
900	R	86.4	Confident	83.1	Confident	206 Å²	206	74.3 Å²	74.3	78%	0.777	36%	0.356	S	S	*	.	H	α-helix	trans	-66.5	-30.3	177.1	-65.4	-175.6	-178.9	-177.5	-0.1	112.9	F902 L903 L904	R900-F902 VanDerWaalsContact C-N 3.34Å; R900-L903 PolarHBondContact O-N 2.92Å; R900-L904 WeakPolarHBondContact O-CG 3.36Å; R900-L904 PolarHBondContact O-N 2.85Å; R900-L904 VanDerWaalsContact O-N 3.09Å
901	M	86.2	Confident	83.8	Confident	108 Å²	108	78 Å²	78	53%	0.532	38%	0.375	S	S	.	.	H	α-helix	trans	-67.8	-36.8	177.9	-63.1	-57.1	-62.8	0	0	111.2	N899 L904 A905	N899-M901 VanDerWaalsContact C-N 3.3Å; N899-M901 PolarHBondContact O-N 3.08Å; N899-M901 WeakPolarHBondContact OD1-CB 3.38Å; N899-M901 PolarHBondContact OD1-N 3.09Å; N899-M901 VanDerWaalsContact OD1-N 3.1Å; M901-L904 PolarHBondContact O-N 3.36Å; M901-A905 VanDerWaalsContact O-CB 3.28Å; M901-A905 WeakPolarHBondContact O-CB 3.27Å; M901-A905 PolarHBondContact O-N 3.24Å
902	F	88.8	Confident	84.4	Confident	13 Å²	13	79.1 Å²	79.1	6%	0.057	38%	0.38	C	S	.	.	H	α-helix	trans	-62	-47.5	174.6	-180	-83.5	0	0	0	112	S807 L808 A882 L883 R886 N899 R900 L904 A905 V906	S807-F902 WeakPolarHBondContact OG-CA 3.42Å; S807-F902 WeakPolarHBondContact OG-CD2 3.43Å; L808-F902 HydrophobicContact CD2-CD2 4.1Å; L808-F902 HydrophobicContact CD2-CE2 4.11Å; L808-F902 HydrophobicContact CG-CD2 4.48Å; A882-F902 HydrophobicContact CB-CE2 4.04Å; A882-F902 HydrophobicContact CB-CZ 4.22Å; L883-F902 HydrophobicContact CB-CE1 4.33Å; L883-F902 HydrophobicContact CB-CZ 3.95Å; L883-F902 HydrophobicContact CD1-CE1 3.78Å; L883-F902 HydrophobicContact CD1-CZ 4.13Å; R886-F902 HydrophobicContact CG-CD2 3.99Å; R886-F902 HydrophobicContact CG-CE2 3.93Å; R886-F902 HydrophobicContact CG-CZ 4.41Å; N899-F902 HydrophobicContact CB-CB 4Å; N899-F902 PolarHBondContact O-N 3.23Å; N899-F902 PolarHBondContact OD1-N 2.92Å; R900-F902 VanDerWaalsContact C-N 3.34Å; F902-L904 PolarHBondContact O-N 2.86Å; F902-A905 PolarHBondContact O-N 2.86Å; F902-V906 HydrophobicContact CD1-CG2 4.21Å; F902-V906 HydrophobicContact CE1-CG2 3.68Å; F902-V906 HydrophobicContact CE2-CG2 4.25Å; F902-V906 HydrophobicContact CZ-CG2 3.69Å; F902-V906 WeakPolarHBondContact O-CG2 3.44Å; F902-V906 PolarHBondContact O-N 3.31Å
903	L	89	Confident	85.3	Confident	87 Å²	87	70.3 Å²	70.3	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-46.4	177.9	-176.8	59.9	0	0	0	111.3	F897 N899 R900 A905 V906 T907	F897-L903 HydrophobicContact CD1-CD2 4.18Å; F897-L903 HydrophobicContact CE1-CD2 4.28Å; N899-L903 PolarHBondContact O-N 2.96Å; R900-L903 PolarHBondContact O-N 2.92Å; L903-A905 PolarHBondContact O-N 3.14Å; L903-V906 PolarHBondContact O-N 3.34Å; L903-T907 WeakPolarHBondContact O-CB 3.31Å; L903-T907 PolarHBondContact O-N 3.31Å; L903-T907 PolarHBondContact O-OG1 3.46Å
904	L	91	Very high	86.2	Confident	112 Å²	112	68.1 Å²	68.1	59%	0.586	34%	0.335	S	S	*	.	H	α-helix	trans	-61.8	-41.9	176.4	-70.3	170.8	0	0	0	112.6	R900 M901 F902 T907 F908	R900-L904 WeakPolarHBondContact O-CG 3.36Å; R900-L904 PolarHBondContact O-N 2.85Å; R900-L904 VanDerWaalsContact O-N 3.09Å; M901-L904 PolarHBondContact O-N 3.36Å; F902-L904 PolarHBondContact O-N 2.86Å; L904-T907 PolarHBondContact O-N 2.82Å; L904-F908 VanDerWaalsContact O-CB 3.23Å; L904-F908 WeakPolarHBondContact O-CB 3.25Å; L904-F908 PolarHBondContact O-N 2.87Å
905	A	90.7	Very high	87	Confident	12 Å²	12	71.1 Å²	71.1	10%	0.099	35%	0.351	C	S	.	.	H	α-helix	trans	-64.8	-44.6	179.4	0	0	0	0	0	112.4	P803 M901 F902 L903 F908 S909	P803-A905 HydrophobicContact CB-CB 4.1Å; M901-A905 VanDerWaalsContact O-CB 3.28Å; M901-A905 WeakPolarHBondContact O-CB 3.27Å; M901-A905 PolarHBondContact O-N 3.24Å; F902-A905 PolarHBondContact O-N 2.86Å; L903-A905 PolarHBondContact O-N 3.14Å; A905-F908 PolarHBondContact O-N 2.9Å; A905-S909 WeakPolarHBondContact O-CB 3.32Å; A905-S909 PolarHBondContact O-N 3.43Å; A905-S909 PolarHBondContact O-OG 3.13Å
906	V	90.1	Very high	87.5	Confident	21 Å²	21	69.7 Å²	69.7	13%	0.127	34%	0.336	C	S	.	.	H	α-helix	trans	-66.7	-43.7	176.5	173.1	0	0	0	0	110.9	M879 F902 L903 F908 S909 I910	M879-V906 HydrophobicContact CB-CG1 4.31Å; M879-V906 HydrophobicContact CG-CG1 4.37Å; M879-V906 HydrophobicContact SD-CB 4.5Å; M879-V906 HydrophobicContact SD-CG1 4.09Å; M879-V906 HydrophobicContact SD-CG2 4.32Å; F902-V906 HydrophobicContact CD1-CG2 4.21Å; F902-V906 HydrophobicContact CE1-CG2 3.68Å; F902-V906 HydrophobicContact CE2-CG2 4.25Å; F902-V906 HydrophobicContact CZ-CG2 3.69Å; F902-V906 WeakPolarHBondContact O-CG2 3.44Å; F902-V906 PolarHBondContact O-N 3.31Å; L903-V906 PolarHBondContact O-N 3.34Å; V906-F908 PolarHBondContact O-N 2.94Å; V906-S909 PolarHBondContact O-N 2.88Å; V906-I910 HydrophobicContact CG1-CD1 3.89Å; V906-I910 WeakPolarHBondContact O-CG1 3.5Å; V906-I910 PolarHBondContact O-N 3.17Å
907	T	90.9	Very high	88.2	Confident	67 Å²	67	65.5 Å²	65.5	41%	0.411	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-44.2	175.1	-61.4	0	0	0	0	111.9	L903 L904 I910 I911	L903-T907 WeakPolarHBondContact O-CB 3.31Å; L903-T907 PolarHBondContact O-N 3.31Å; L903-T907 PolarHBondContact O-OG1 3.46Å; L904-T907 PolarHBondContact O-N 2.82Å; T907-I910 PolarHBondContact O-N 2.94Å; T907-I911 HydrophobicContact CG2-CD1 3.96Å; T907-I911 VanDerWaalsContact O-CG1 3.29Å; T907-I911 WeakPolarHBondContact O-CG1 3.45Å; T907-I911 PolarHBondContact O-N 2.67Å
908	F	90.9	Very high	88.8	Confident	117 Å²	117	62.5 Å²	62.5	51%	0.513	30%	0.301	S	S	.	.	H	α-helix	trans	-64.1	-40.1	177.2	-177	-112.4	0	0	0	112.3	L904 A905 V906 I911 I912	L904-F908 VanDerWaalsContact O-CB 3.23Å; L904-F908 WeakPolarHBondContact O-CB 3.25Å; L904-F908 PolarHBondContact O-N 2.87Å; A905-F908 PolarHBondContact O-N 2.9Å; V906-F908 PolarHBondContact O-N 2.94Å; F908-I911 PolarHBondContact O-N 3.29Å; F908-I912 HydrophobicContact CD1-CD1 3.88Å; F908-I912 HydrophobicContact CE1-CD1 3.39Å; F908-I912 HydrophobicContact CE1-CG1 4.43Å; F908-I912 HydrophobicContact CE2-CD1 4.3Å; F908-I912 HydrophobicContact CZ-CD1 3.64Å; F908-I912 HydrophobicContact CZ-CG1 4.39Å; F908-I912 PolarHBondContact O-N 3Å
909	S	91	Very high	89.3	Confident	1 Å²	1	62 Å²	62	1%	0.007	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-46	175.3	-53.3	0	0	0	0	111	M800 A905 V906 I911 I912 L913	M800-S909 WeakPolarHBondContact CE-O 3.18Å; A905-S909 WeakPolarHBondContact O-CB 3.32Å; A905-S909 PolarHBondContact O-N 3.43Å; A905-S909 PolarHBondContact O-OG 3.13Å; V906-S909 PolarHBondContact O-N 2.88Å; S909-I911 VanDerWaalsContact C-N 3.32Å; S909-I911 PolarHBondContact O-N 3.44Å; S909-I912 WeakPolarHBondContact O-CB 3.49Å; S909-I912 PolarHBondContact O-N 2.96Å; S909-I912 VanDerWaalsContact O-N 3.15Å; S909-L913 PolarHBondContact O-N 2.97Å
910	I	90.4	Very high	89.3	Confident	61 Å²	61	65.7 Å²	65.7	31%	0.313	33%	0.327	S	S	.	.	H	α-helix	trans	-62.5	-38.2	176.3	-66.8	166.7	0	0	0	111.5	V906 T907 L913 V914	V906-I910 HydrophobicContact CG1-CD1 3.89Å; V906-I910 WeakPolarHBondContact O-CG1 3.5Å; V906-I910 PolarHBondContact O-N 3.17Å; T907-I910 PolarHBondContact O-N 2.94Å; I910-L913 PolarHBondContact O-N 2.97Å; I910-V914 WeakPolarHBondContact O-CG2 3.41Å; I910-V914 PolarHBondContact O-N 2.98Å
911	I	91.9	Very high	89.3	Confident	103 Å²	103	59.6 Å²	59.6	53%	0.528	31%	0.314	S	S	.	.	H	α-helix	trans	-63.1	-42.1	174.2	-70.1	164.9	0	0	0	111.2	T907 F908 S909 V914 L915	T907-I911 HydrophobicContact CG2-CD1 3.96Å; T907-I911 VanDerWaalsContact O-CG1 3.29Å; T907-I911 WeakPolarHBondContact O-CG1 3.45Å; T907-I911 PolarHBondContact O-N 2.67Å; F908-I911 PolarHBondContact O-N 3.29Å; S909-I911 VanDerWaalsContact C-N 3.32Å; S909-I911 PolarHBondContact O-N 3.44Å; I911-V914 PolarHBondContact O-N 3.07Å; I911-L915 WeakPolarHBondContact O-CB 3.49Å; I911-L915 PolarHBondContact O-N 2.94Å
912	I	90.2	Very high	89	Confident	32 Å²	32	56.6 Å²	56.6	16%	0.164	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-42	175.6	-78.1	177.5	0	0	0	111.8	F795 I799 M800 F908 S909 V914 L915 V916	F795-I912 HydrophobicContact CE1-CG2 4.17Å; F795-I912 HydrophobicContact CE2-CG2 4.5Å; F795-I912 HydrophobicContact CZ-CG2 3.51Å; I799-I912 HydrophobicContact CG2-CD1 4.22Å; I799-I912 HydrophobicContact CG2-CG2 3.95Å; M800-I912 HydrophobicContact SD-CG2 3.9Å; F908-I912 HydrophobicContact CD1-CD1 3.88Å; F908-I912 HydrophobicContact CE1-CD1 3.39Å; F908-I912 HydrophobicContact CE1-CG1 4.43Å; F908-I912 HydrophobicContact CE2-CD1 4.3Å; F908-I912 HydrophobicContact CZ-CD1 3.64Å; F908-I912 HydrophobicContact CZ-CG1 4.39Å; F908-I912 PolarHBondContact O-N 3Å; S909-I912 WeakPolarHBondContact O-CB 3.49Å; S909-I912 PolarHBondContact O-N 2.96Å; S909-I912 VanDerWaalsContact O-N 3.15Å; I912-V914 PolarHBondContact O-N 3.43Å; I912-L915 WeakPolarHBondContact O-CB 3.23Å; I912-L915 PolarHBondContact O-N 3.44Å; I912-V916 PolarHBondContact O-N 2.87Å
913	L	91	Very high	88.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-47.5	175.4	-179.6	65.5	0	0	0	111.3	M800 F871 T872 V875 F876 S909 I910 L915 V916 I917	M800-L913 HydrophobicContact CE-CB 3.92Å; F871-L913 HydrophobicContact CD1-CD1 4.22Å; F871-L913 HydrophobicContact CE1-CD1 3.64Å; F871-L913 HydrophobicContact CZ-CD1 4.22Å; T872-L913 HydrophobicContact CG2-CD2 4.18Å; V875-L913 HydrophobicContact CB-CD1 4.3Å; V875-L913 HydrophobicContact CB-CD2 4.32Å; V875-L913 HydrophobicContact CG1-CD1 4.15Å; V875-L913 HydrophobicContact CG1-CD2 3.75Å; V875-L913 HydrophobicContact CG1-CG 4.4Å; V875-L913 HydrophobicContact CG2-CD1 4.27Å; F876-L913 HydrophobicContact CE2-CD2 4.3Å; F876-L913 HydrophobicContact CZ-CD2 4.3Å; S909-L913 PolarHBondContact O-N 2.97Å; I910-L913 PolarHBondContact O-N 2.97Å; L913-L915 VanDerWaalsContact C-N 3.32Å; L913-L915 PolarHBondContact O-N 2.87Å; L913-V916 PolarHBondContact O-N 2.93Å; L913-I917 HydrophobicContact CD1-CD1 3.96Å; L913-I917 HydrophobicContact CG-CD1 3.91Å; L913-I917 VanDerWaalsContact O-CG1 3.32Å; L913-I917 WeakPolarHBondContact O-CG1 3.37Å; L913-I917 PolarHBondContact O-N 2.82Å; L913-I917 VanDerWaalsContact O-N 3.09Å
914	V	90.4	Very high	88.2	Confident	59 Å²	59	59.3 Å²	59.3	36%	0.358	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-41.6	175.3	170.7	0	0	0	0	110.7	I910 I911 I912 V916 I917 F918	I910-V914 WeakPolarHBondContact O-CG2 3.41Å; I910-V914 PolarHBondContact O-N 2.98Å; I911-V914 PolarHBondContact O-N 3.07Å; I912-V914 PolarHBondContact O-N 3.43Å; V914-V916 PolarHBondContact O-N 2.78Å; V914-I917 PolarHBondContact O-N 2.9Å; V914-F918 HydrophobicContact CG1-CD2 3.85Å; V914-F918 HydrophobicContact CG1-CE2 4.34Å; V914-F918 WeakPolarHBondContact O-CD2 3.46Å; V914-F918 PolarHBondContact O-N 2.96Å
915	L	89.5	Confident	87.5	Confident	89 Å²	89	58.5 Å²	58.5	47%	0.466	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-42.8	176.3	-164.3	75.8	0	0	0	112	I911 I912 L913 I917 F919 L922	I911-L915 WeakPolarHBondContact O-CB 3.49Å; I911-L915 PolarHBondContact O-N 2.94Å; I912-L915 WeakPolarHBondContact O-CB 3.23Å; I912-L915 PolarHBondContact O-N 3.44Å; L913-L915 VanDerWaalsContact C-N 3.32Å; L913-L915 PolarHBondContact O-N 2.87Å; L915-I917 VanDerWaalsContact C-N 3.33Å; L915-I917 PolarHBondContact O-N 2.99Å; L915-F919 HydrophobicContact CD1-CB 4.1Å; L915-F919 HydrophobicContact CD1-CG 4.35Å; L915-F919 HydrophobicContact CG-CB 4.16Å; L915-F919 WeakPolarHBondContact O-CB 3.28Å; L915-F919 PolarHBondContact O-N 2.86Å; L915-L922 HydrophobicContact CB-CD1 4.49Å; L915-L922 HydrophobicContact CD2-CD1 3.75Å; L915-L922 HydrophobicContact CG-CD1 3.81Å
916	V	87.4	Confident	86.8	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-68.5	-28.3	178.3	167.5	0	0	0	0	113.2	F795 F871 I912 L913 V914 L922 F926 T928	F795-V916 HydrophobicContact CE1-CG2 4.16Å; F795-V916 HydrophobicContact CE2-CG2 4.07Å; F795-V916 HydrophobicContact CZ-CG2 3.55Å; F871-V916 HydrophobicContact CE1-CG1 4.21Å; F871-V916 HydrophobicContact CZ-CG1 4.5Å; I912-V916 PolarHBondContact O-N 2.87Å; L913-V916 PolarHBondContact O-N 2.93Å; V914-V916 PolarHBondContact O-N 2.78Å; V916-L922 HydrophobicContact CG2-CB 4.43Å; V916-L922 HydrophobicContact CG2-CD1 4.1Å; V916-F926 HydrophobicContact CG1-CB 3.97Å; V916-F926 HydrophobicContact CG1-CD2 3.71Å; V916-F926 HydrophobicContact CG1-CG 3.98Å; V916-F926 HydrophobicContact CG2-CD2 4.1Å; V916-F926 HydrophobicContact CG2-CE2 4.16Å; V916-T928 HydrophobicContact CG1-CG2 4.28Å; V916-T928 PolarHBondContact O-OG1 2.85Å
917	I	88.9	Confident	86.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-82.9	-32	179.1	-66.7	166.6	0	0	0	112.1	T868 T872 L913 V914 L915 L931 F936	T868-I917 HydrophobicContact CG2-CG1 4.04Å; T872-I917 HydrophobicContact CG2-CD1 4.18Å; T872-I917 WeakPolarHBondContact OG1-CD1 3.12Å; L913-I917 HydrophobicContact CD1-CD1 3.96Å; L913-I917 HydrophobicContact CG-CD1 3.91Å; L913-I917 VanDerWaalsContact O-CG1 3.32Å; L913-I917 WeakPolarHBondContact O-CG1 3.37Å; L913-I917 PolarHBondContact O-N 2.82Å; L913-I917 VanDerWaalsContact O-N 3.09Å; V914-I917 PolarHBondContact O-N 2.9Å; L915-I917 VanDerWaalsContact C-N 3.33Å; L915-I917 PolarHBondContact O-N 2.99Å; I917-L931 HydrophobicContact CG2-CG 4.47Å; I917-F936 HydrophobicContact CD1-CE1 4.33Å; I917-F936 HydrophobicContact CD1-CZ 3.94Å
918	F	89.2	Confident	85.8	Confident	100 Å²	100	60.8 Å²	60.8	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-115.5	-9.5	-171	-67.3	-77.1	0	0	0	116	V914 A930 L931 F936	V914-F918 HydrophobicContact CG1-CD2 3.85Å; V914-F918 HydrophobicContact CG1-CE2 4.34Å; V914-F918 WeakPolarHBondContact O-CD2 3.46Å; V914-F918 PolarHBondContact O-N 2.96Å; F918-A930 HydrophobicContact CD1-CB 3.92Å; F918-A930 HydrophobicContact CE1-CB 3.83Å; F918-L931 WeakPolarHBondContact CZ-O 3.42Å; F918-F936 AromaticContact CE2-CE2 3.96Å; F918-F936 HydrophobicContact CE2-CE2 3.96Å; F918-F936 AromaticContact CE2-CZ 3.98Å; F918-F936 HydrophobicContact CE2-CZ 3.98Å; F918-F936 HydrophobicContact CZ-CE2 4.02Å; F918-F936 HydrophobicContact CZ-CZ 4.48Å
919	F	89	Confident	85.6	Confident	104 Å²	104	58.7 Å²	58.7	46%	0.456	31%	0.312	S	S	.	.			trans	-98.4	112.4	-179.7	-170.1	-133.6	0	0	0	111.7	L915 P921 L922 Q923	L915-F919 HydrophobicContact CD1-CB 4.1Å; L915-F919 HydrophobicContact CD1-CG 4.35Å; L915-F919 HydrophobicContact CG-CB 4.16Å; L915-F919 WeakPolarHBondContact O-CB 3.28Å; L915-F919 PolarHBondContact O-N 2.86Å; F919-P921 VanDerWaalsContact C-CD 3.47Å; F919-P921 HydrophobicContact CD1-CG 3.68Å; F919-P921 HydrophobicContact CE1-CG 3.38Å; F919-P921 HydrophobicContact CE2-CG 4.27Å; F919-P921 HydrophobicContact CG-CG 4.25Å; F919-P921 HydrophobicContact CZ-CG 3.7Å; F919-P921 VanDerWaalsContact O-N 3.16Å; F919-L922 HydrophobicContact CB-CD1 4.49Å; F919-L922 HydrophobicContact CD1-CD1 3.97Å; F919-L922 HydrophobicContact CD1-CG 3.97Å; F919-L922 PolarHBondContact O-N 3.47Å; F919-Q923 PolarHBondContact O-N 3.4Å
920	P	83.5	Confident	85.5	Confident	85 Å²	85	61.1 Å²	61.1	55%	0.552	33%	0.332	S	S	*	.	H	α-helix	trans	-50.5	-41.1	-168.1	-31.4	36.6	0	0	0	118.3	Q923 S924	P920-Q923 WeakPolarHBondContact O-CB 3.35Å; P920-Q923 PolarHBondContact O-N 3.05Å; P920-S924 PolarHBondContact O-N 3Å
921	P	84.5	Confident	85.4	Confident	78 Å²	78	58.5 Å²	58.5	51%	0.506	32%	0.318	S	S	.	.	H	α-helix	trans	-72.2	-30.3	-179.9	28.7	-35.2	0	0	0	112.9	F919 L925	F919-P921 VanDerWaalsContact C-CD 3.47Å; F919-P921 HydrophobicContact CD1-CG 3.68Å; F919-P921 HydrophobicContact CE1-CG 3.38Å; F919-P921 HydrophobicContact CE2-CG 4.27Å; F919-P921 HydrophobicContact CG-CG 4.25Å; F919-P921 HydrophobicContact CZ-CG 3.7Å; F919-P921 VanDerWaalsContact O-N 3.16Å; P921-L925 PolarHBondContact O-N 2.92Å
922	L	81.7	Confident	85.1	Confident	45 Å²	45	62.1 Å²	62.1	24%	0.236	33%	0.325	C	S	.	.	H	α-helix	trans	-74.9	-37.2	170.6	-63.9	177.1	0	0	0	110.5	L915 V916 F919 S924 L925 F926	L915-L922 HydrophobicContact CB-CD1 4.49Å; L915-L922 HydrophobicContact CD2-CD1 3.75Å; L915-L922 HydrophobicContact CG-CD1 3.81Å; V916-L922 HydrophobicContact CG2-CB 4.43Å; V916-L922 HydrophobicContact CG2-CD1 4.1Å; F919-L922 HydrophobicContact CB-CD1 4.49Å; F919-L922 HydrophobicContact CD1-CD1 3.97Å; F919-L922 HydrophobicContact CD1-CG 3.97Å; F919-L922 PolarHBondContact O-N 3.47Å; L922-S924 VanDerWaalsContact C-N 3.29Å; L922-S924 PolarHBondContact O-N 3Å; L922-L925 PolarHBondContact O-N 3.25Å; L922-F926 HydrophobicContact CB-CD2 4.38Å; L922-F926 HydrophobicContact CD2-CE2 4.25Å; L922-F926 WeakPolarHBondContact O-CD2 3.26Å; L922-F926 PolarHBondContact O-N 3.05Å
923	Q	83.5	Confident	85	Confident	56 Å²	56	67.1 Å²	67.1	26%	0.262	35%	0.351	S	S	.	.	H	α-helix	trans	-58.3	-42.5	176.6	-167	-170.6	-13.2	0	0	111.7	F919 P920 L925 Q927 T928	F919-Q923 PolarHBondContact O-N 3.4Å; P920-Q923 WeakPolarHBondContact O-CB 3.35Å; P920-Q923 PolarHBondContact O-N 3.05Å; Q923-L925 VanDerWaalsContact C-N 3.34Å; Q923-L925 PolarHBondContact O-N 3.43Å; Q923-Q927 WeakPolarHBondContact O-CA 3.47Å; Q923-Q927 PolarHBondContact O-N 2.88Å; Q923-T928 WeakPolarHBondContact CA-OG1 3.23Å; Q923-T928 WeakPolarHBondContact CG-O 3.27Å; Q923-T928 WeakPolarHBondContact CG-OG1 3.46Å; Q923-T928 PolarHBondContact NE2-O 2.68Å; Q923-T928 PolarHBondContact O-N 3.31Å; Q923-T928 VanDerWaalsContact O-N 3.09Å
924	S	77.6	Confident	85	Confident	101 Å²	101	70.3 Å²	70.3	71%	0.706	37%	0.373	S	S	*	.	H	α-helix	trans	-67.7	-29.5	173.7	-169.3	0	0	0	0	113.8	P920 L922	P920-S924 PolarHBondContact O-N 3Å; L922-S924 VanDerWaalsContact C-N 3.29Å; L922-S924 PolarHBondContact O-N 3Å
925	L	75.8	Confident	85	Confident	94 Å²	94	68.1 Å²	68.1	49%	0.492	36%	0.359	S	S	.	.	H	α-helix	trans	-80.3	-37.8	-178.7	-178	64.4	0	0	0	112.6	M791 P921 L922 Q923	M791-L925 HydrophobicContact CE-CD1 4.44Å; P921-L925 PolarHBondContact O-N 2.92Å; L922-L925 PolarHBondContact O-N 3.25Å; Q923-L925 VanDerWaalsContact C-N 3.34Å; Q923-L925 PolarHBondContact O-N 3.43Å
926	F	75	Confident	85	Confident	20 Å²	20	65.5 Å²	65.5	9%	0.088	34%	0.344	C	S	.	.	H	α-helix	trans	-99.1	1.5	-179.6	-65.4	-70.4	0	0	0	114	M791 Q792 F795 V916 L922 T928	M791-F926 HydrophobicContact CB-CD1 4.29Å; Q792-F926 PolarHBondContact NE2-O 3.5Å; F795-F926 HydrophobicContact CB-CD1 4.42Å; F795-F926 HydrophobicContact CB-CE1 3.85Å; F795-F926 HydrophobicContact CB-CZ 4.48Å; F795-F926 HydrophobicContact CD2-CD1 4.5Å; F795-F926 AromaticContact CD2-CE1 3.6Å; F795-F926 HydrophobicContact CD2-CE1 3.6Å; F795-F926 HydrophobicContact CD2-CE2 4.09Å; F795-F926 AromaticContact CD2-CZ 3.36Å; F795-F926 HydrophobicContact CD2-CZ 3.36Å; F795-F926 HydrophobicContact CE2-CE1 4.41Å; F795-F926 HydrophobicContact CE2-CE2 4.1Å; F795-F926 AromaticContact CE2-CZ 3.79Å; F795-F926 HydrophobicContact CE2-CZ 3.79Å; F795-F926 AromaticContact CG-CE1 3.94Å; F795-F926 HydrophobicContact CG-CE1 3.94Å; F795-F926 HydrophobicContact CG-CZ 4.14Å; V916-F926 HydrophobicContact CG1-CB 3.97Å; V916-F926 HydrophobicContact CG1-CD2 3.71Å; V916-F926 HydrophobicContact CG1-CG 3.98Å; V916-F926 HydrophobicContact CG2-CD2 4.1Å; V916-F926 HydrophobicContact CG2-CE2 4.16Å; L922-F926 HydrophobicContact CB-CD2 4.38Å; L922-F926 HydrophobicContact CD2-CE2 4.25Å; L922-F926 WeakPolarHBondContact O-CD2 3.26Å; L922-F926 PolarHBondContact O-N 3.05Å; F926-T928 VanDerWaalsContact C-N 3.33Å; F926-T928 HydrophobicContact CB-CG2 4.08Å; F926-T928 PolarHBondContact O-N 3.35Å
927	Q	77.1	Confident	85.2	Confident	122 Å²	122	70.9 Å²	70.9	57%	0.57	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	44.2	179.9	-59.4	177.6	-9.5	0	0	112.7	N789 Q923	N789-Q927 PolarHBondContact ND2-OE1 2.69Å; Q923-Q927 WeakPolarHBondContact O-CA 3.47Å; Q923-Q927 PolarHBondContact O-N 2.88Å
928	T	83.9	Confident	85.3	Confident	6 Å²	6	73.5 Å²	73.5	4%	0.037	38%	0.383	C	S	.	.			trans	-97.3	168.5	-175.2	48.2	0	0	0	0	113.7	T868 V916 Q923 F926	T868-T928 HydrophobicContact CG2-CG2 3.92Å; T868-T928 WeakPolarHBondContact OG1-CA 3.33Å; V916-T928 HydrophobicContact CG1-CG2 4.28Å; V916-T928 PolarHBondContact O-OG1 2.85Å; Q923-T928 WeakPolarHBondContact CA-OG1 3.23Å; Q923-T928 WeakPolarHBondContact CG-O 3.27Å; Q923-T928 WeakPolarHBondContact CG-OG1 3.46Å; Q923-T928 PolarHBondContact NE2-O 2.68Å; Q923-T928 PolarHBondContact O-N 3.31Å; Q923-T928 VanDerWaalsContact O-N 3.09Å; F926-T928 VanDerWaalsContact C-N 3.33Å; F926-T928 HydrophobicContact CB-CG2 4.08Å; F926-T928 PolarHBondContact O-N 3.35Å
929	E	86.5	Confident	85.5	Confident	74 Å²	74	68.7 Å²	68.7	35%	0.346	36%	0.362	S	S	.	.			trans	-137.1	141.7	177.7	-157.3	-178.8	142.1	0	0	111.5	P864 R865 T868 L931	P864-E929 HydrophobicContact CB-CB 4.17Å; R865-E929 HydrophobicContact CB-CB 4.4Å; R865-E929 WeakPolarHBondContact CB-OE2 3.44Å; R865-E929 PolarHBondContact N-OE2 2.95Å; T868-E929 WeakPolarHBondContact CG2-O 3.39Å; T868-E929 PolarHBondContact OG1-N 2.93Å; E929-L931 PolarHBondContact O-N 2.98Å; E929-L931 VanDerWaalsContact O-N 3.09Å
930	A	88.2	Confident	85.6	Confident	52 Å²	52	66.2 Å²	66.2	43%	0.43	36%	0.358	S	S	.	.			trans	-64.4	109.4	-174.6	0	0	0	0	0	112.5	F918	F918-A930 HydrophobicContact CD1-CB 3.92Å; F918-A930 HydrophobicContact CE1-CB 3.83Å
931	L	87.7	Confident	86	Confident	6 Å²	6	70.2 Å²	70.2	3%	0.031	37%	0.367	C	S	.	.			trans	-76.9	152	179.9	-63.2	-178.6	0	0	0	112.7	R865 T868 M869 T872 I917 F918 E929 D935 F936	R865-L931 HydrophobicContact CG-CD2 4.06Å; T868-L931 HydrophobicContact CG2-CD1 4.16Å; T868-L931 HydrophobicContact CG2-CD2 4.41Å; T868-L931 HydrophobicContact CG2-CG 4.06Å; M869-L931 HydrophobicContact CB-CD2 4.13Å; T872-L931 HydrophobicContact CG2-CD1 3.97Å; T872-L931 WeakPolarHBondContact OG1-CD1 3.46Å; I917-L931 HydrophobicContact CG2-CG 4.47Å; F918-L931 WeakPolarHBondContact CZ-O 3.42Å; E929-L931 PolarHBondContact O-N 2.98Å; E929-L931 VanDerWaalsContact O-N 3.09Å; L931-D935 HydrophobicContact CB-CB 4.44Å; L931-F936 HydrophobicContact CB-CD2 4.39Å; L931-F936 HydrophobicContact CB-CE2 3.81Å; L931-F936 HydrophobicContact CB-CZ 4.4Å
932	R	87.6	Confident	86.5	Confident	179 Å²	179	68 Å²	68	68%	0.675	35%	0.35	S	S	*	.			trans	-81.6	155	177.8	-62.7	177	178.7	175.2	1.1	111.1	S934 D935 F936	R932-S934 VanDerWaalsContact CB-OG 3.26Å; R932-S934 WeakPolarHBondContact CB-OG 3.19Å; R932-S934 PolarHBondContact O-N 2.66Å; R932-D935 PolarHBondContact N-OD2 2.86Å; R932-D935 WeakPolarHBondContact O-CA 3.39Å; R932-D935 VanDerWaalsContact O-CB 3.28Å; R932-D935 WeakPolarHBondContact O-CB 3.46Å; R932-D935 PolarHBondContact O-N 2.84Å; R932-F936 WeakPolarHBondContact O-CD2 3.14Å; R932-F936 PolarHBondContact O-N 2.7Å
933	I	87.8	Confident	87	Confident	137 Å²	137	65.9 Å²	65.9	70%	0.703	34%	0.339	S	S	*	.	H	α-helix	trans	-59.3	-31.7	177.6	-60.7	172.5	0	0	0	111.8	D935 F936 I937	I933-D935 PolarHBondContact O-N 3.29Å; I933-F936 PolarHBondContact O-N 3.07Å; I933-I937 HydrophobicContact CG2-CD1 4.12Å; I933-I937 WeakPolarHBondContact O-CG1 3.42Å; I933-I937 PolarHBondContact O-N 3.12Å; I933-I937 VanDerWaalsContact O-N 3.13Å
934	S	89.5	Confident	87.5	Confident	66 Å²	66	64.4 Å²	64.4	46%	0.462	34%	0.335	S	S	.	.	H	α-helix	trans	-53.3	-41.1	169.6	44.1	0	0	0	0	112.9	R932 I937 F938	R932-S934 VanDerWaalsContact CB-OG 3.26Å; R932-S934 WeakPolarHBondContact CB-OG 3.19Å; R932-S934 PolarHBondContact O-N 2.66Å; S934-I937 PolarHBondContact O-N 3.3Å; S934-F938 WeakPolarHBondContact O-CB 3.33Å; S934-F938 PolarHBondContact O-N 3.15Å
935	D	90.2	Very high	88.2	Confident	14 Å²	14	61.4 Å²	61.4	8%	0.075	31%	0.314	C	S	.	.	H	α-helix	trans	-75.8	-41.1	-170.3	-47.2	-3.9	0	0	0	108.1	R865 M869 L931 R932 I933 I937 F938 L939	R865-D935 IonicContact CZ-OD2 2.9Å; R865-D935 IonicContact NE-OD2 3.47Å; R865-D935 IonicContact NH2-OD1 3.47Å; R865-D935 IonicContact NH2-OD2 3.58Å; R865-D935 PolarHBondContact NH2-OD2 2.93Å; M869-D935 HydrophobicContact SD-CB 4.31Å; L931-D935 HydrophobicContact CB-CB 4.44Å; R932-D935 PolarHBondContact N-OD2 2.86Å; R932-D935 WeakPolarHBondContact O-CA 3.39Å; R932-D935 VanDerWaalsContact O-CB 3.28Å; R932-D935 WeakPolarHBondContact O-CB 3.46Å; R932-D935 PolarHBondContact O-N 2.84Å; I933-D935 PolarHBondContact O-N 3.29Å; D935-I937 PolarHBondContact O-N 2.97Å; D935-F938 PolarHBondContact O-N 2.95Å; D935-L939 WeakPolarHBondContact O-CB 3.46Å; D935-L939 VanDerWaalsContact O-CG 3.24Å; D935-L939 WeakPolarHBondContact O-CG 3.39Å; D935-L939 PolarHBondContact O-N 2.91Å
936	F	89.6	Confident	89	Confident	34 Å²	34	57 Å²	57	15%	0.149	29%	0.291	C	S	.	.	H	α-helix	trans	-58.4	-43.6	169.7	-76.2	-82.1	0	0	0	113.3	T872 F876 I917 F918 L931 R932 I933 S940	T872-F936 HydrophobicContact CG2-CE1 4.11Å; F876-F936 AromaticContact CE2-CD1 3.71Å; F876-F936 HydrophobicContact CE2-CD1 3.71Å; F876-F936 HydrophobicContact CE2-CE1 4.16Å; F876-F936 AromaticContact CZ-CD1 3.86Å; F876-F936 HydrophobicContact CZ-CD1 3.86Å; F876-F936 HydrophobicContact CZ-CE1 4.32Å; I917-F936 HydrophobicContact CD1-CE1 4.33Å; I917-F936 HydrophobicContact CD1-CZ 3.94Å; F918-F936 AromaticContact CE2-CE2 3.96Å; F918-F936 HydrophobicContact CE2-CE2 3.96Å; F918-F936 AromaticContact CE2-CZ 3.98Å; F918-F936 HydrophobicContact CE2-CZ 3.98Å; F918-F936 HydrophobicContact CZ-CE2 4.02Å; F918-F936 HydrophobicContact CZ-CZ 4.48Å; L931-F936 HydrophobicContact CB-CD2 4.39Å; L931-F936 HydrophobicContact CB-CE2 3.81Å; L931-F936 HydrophobicContact CB-CZ 4.4Å; R932-F936 WeakPolarHBondContact O-CD2 3.14Å; R932-F936 PolarHBondContact O-N 2.7Å; I933-F936 PolarHBondContact O-N 3.07Å; F936-S940 VanDerWaalsContact O-CB 3.28Å; F936-S940 WeakPolarHBondContact O-CB 3.39Å; F936-S940 PolarHBondContact O-N 2.83Å
937	I	91.9	Very high	89.7	Confident	115 Å²	115	57.5 Å²	57.5	59%	0.59	29%	0.294	S	S	*	.	H	α-helix	trans	-65.7	-46	178.5	-67.2	166.8	0	0	0	110.7	I933 S934 D935 S940 F941	I933-I937 HydrophobicContact CG2-CD1 4.12Å; I933-I937 WeakPolarHBondContact O-CG1 3.42Å; I933-I937 PolarHBondContact O-N 3.12Å; I933-I937 VanDerWaalsContact O-N 3.13Å; S934-I937 PolarHBondContact O-N 3.3Å; D935-I937 PolarHBondContact O-N 2.97Å; I937-S940 PolarHBondContact O-N 3.24Å; I937-F941 PolarHBondContact O-N 3.38Å
938	F	92.6	Very high	90.4	Very high	55 Å²	55	56.5 Å²	56.5	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-47.9	177.2	168.1	-107.3	0	0	0	112	W851 V852 M869 S934 D935 F941 L942	W851-F938 HydrophobicContact CH2-CE2 4.1Å; W851-F938 AromaticContact CH2-CZ 3.84Å; W851-F938 HydrophobicContact CH2-CZ 3.84Å; W851-F938 HydrophobicContact CZ3-CE2 4.13Å; W851-F938 AromaticContact CZ3-CZ 3.6Å; W851-F938 HydrophobicContact CZ3-CZ 3.6Å; V852-F938 HydrophobicContact CG2-CE1 4.18Å; M869-F938 HydrophobicContact CE-CD1 3.87Å; M869-F938 HydrophobicContact CE-CE1 3.9Å; S934-F938 WeakPolarHBondContact O-CB 3.33Å; S934-F938 PolarHBondContact O-N 3.15Å; D935-F938 PolarHBondContact O-N 2.95Å; F938-F941 PolarHBondContact O-N 3.26Å; F938-L942 WeakPolarHBondContact O-CB 3.18Å; F938-L942 PolarHBondContact O-N 3.04Å
939	L	92.7	Very high	90.7	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.6	-42.8	176.8	-69.1	-179.6	0	0	0	111.9	V852 M869 T872 C873 F876 D935 F941 L942 T943	V852-L939 HydrophobicContact CG1-CD2 4.33Å; V852-L939 HydrophobicContact CG2-CD2 4.18Å; M869-L939 HydrophobicContact CG-CD1 4.4Å; T872-L939 HydrophobicContact CG2-CD1 3.63Å; C873-L939 HydrophobicContact CB-CD1 4.39Å; C873-L939 HydrophobicContact CB-CD2 3.58Å; F876-L939 HydrophobicContact CD2-CB 4.09Å; D935-L939 WeakPolarHBondContact O-CB 3.46Å; D935-L939 VanDerWaalsContact O-CG 3.24Å; D935-L939 WeakPolarHBondContact O-CG 3.39Å; D935-L939 PolarHBondContact O-N 2.91Å; L939-F941 VanDerWaalsContact C-N 3.31Å; L939-F941 PolarHBondContact O-N 2.98Å; L939-L942 PolarHBondContact O-N 2.86Å; L939-T943 VanDerWaalsContact O-CB 3.28Å; L939-T943 WeakPolarHBondContact O-CB 3.37Å; L939-T943 WeakPolarHBondContact O-CG2 3.48Å; L939-T943 PolarHBondContact O-N 3.12Å; L939-T943 PolarHBondContact O-OG1 3.48Å
940	S	90.5	Very high	90.8	Very high	52 Å²	52	56.8 Å²	56.8	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-38.4	177.8	-175.9	0	0	0	0	112.5	F936 I937 T943	F936-S940 VanDerWaalsContact O-CB 3.28Å; F936-S940 WeakPolarHBondContact O-CB 3.39Å; F936-S940 PolarHBondContact O-N 2.83Å; I937-S940 PolarHBondContact O-N 3.24Å; S940-T943 PolarHBondContact O-OG1 2.95Å
941	F	93	Very high	90.8	Very high	168 Å²	168	55 Å²	55	74%	0.737	28%	0.278	S	S	*	.	H	α-helix	trans	-68.9	-51.5	176	-178.3	-99.2	0	0	0	111.3	I937 F938 L939 T943 S944	I937-F941 PolarHBondContact O-N 3.38Å; F938-F941 PolarHBondContact O-N 3.26Å; L939-F941 VanDerWaalsContact C-N 3.31Å; L939-F941 PolarHBondContact O-N 2.98Å; F941-T943 VanDerWaalsContact C-N 3.3Å; F941-T943 PolarHBondContact O-N 2.93Å; F941-S944 PolarHBondContact O-N 2.74Å; F941-S944 PolarHBondContact O-OG 3.4Å
942	L	93.3	Very high	90.9	Very high	32 Å²	32	58.1 Å²	58.1	17%	0.168	30%	0.299	C	S	.	.	H	α-helix	trans	-56.1	-44.4	179.6	177.6	65.3	0	0	0	112.3	W851 V852 F877 F938 L939 S944 S945	W851-L942 HydrophobicContact CE3-CD1 4.04Å; W851-L942 HydrophobicContact CE3-CD2 3.92Å; W851-L942 HydrophobicContact CZ3-CD1 3.79Å; W851-L942 HydrophobicContact CZ3-CD2 3.89Å; W851-L942 HydrophobicContact CZ3-CG 4.44Å; V852-L942 HydrophobicContact CG2-CD2 3.39Å; F877-L942 HydrophobicContact CZ-CG 4.13Å; F938-L942 WeakPolarHBondContact O-CB 3.18Å; F938-L942 PolarHBondContact O-N 3.04Å; L939-L942 PolarHBondContact O-N 2.86Å; L942-S944 VanDerWaalsContact C-N 3.32Å; L942-S944 PolarHBondContact O-N 3.07Å; L942-S945 VanDerWaalsContact O-CB 3.32Å; L942-S945 WeakPolarHBondContact O-CB 3.1Å; L942-S945 PolarHBondContact O-N 2.98Å; L942-S945 PolarHBondContact O-OG 2.95Å
943	T	93.4	Very high	90.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-73.6	-22.2	-171.3	55.1	0	0	0	0	113.8	F876 F877 W880 L939 S940 F941 S945 V946	F876-T943 HydrophobicContact CB-CG2 3.66Å; F877-T943 HydrophobicContact CB-CG2 4.33Å; F877-T943 HydrophobicContact CD1-CG2 3.87Å; F877-T943 HydrophobicContact CD2-CG2 3.7Å; F877-T943 VanDerWaalsContact CE1-CA 3.46Å; F877-T943 HydrophobicContact CE1-CG2 4.1Å; F877-T943 HydrophobicContact CE2-CG2 3.89Å; F877-T943 HydrophobicContact CG-CG2 3.69Å; F877-T943 HydrophobicContact CZ-CG2 4.08Å; W880-T943 VanDerWaalsContact CD1-C 3.41Å; W880-T943 VanDerWaalsContact CD1-OG1 3.28Å; W880-T943 PolarHBondContact NE1-OG1 2.82Å; L939-T943 VanDerWaalsContact O-CB 3.28Å; L939-T943 WeakPolarHBondContact O-CB 3.37Å; L939-T943 WeakPolarHBondContact O-CG2 3.48Å; L939-T943 PolarHBondContact O-N 3.12Å; L939-T943 PolarHBondContact O-OG1 3.48Å; S940-T943 PolarHBondContact O-OG1 2.95Å; F941-T943 VanDerWaalsContact C-N 3.3Å; F941-T943 PolarHBondContact O-N 2.93Å; T943-S945 PolarHBondContact O-N 2.73Å; T943-S945 VanDerWaalsContact O-N 3.11Å; T943-V946 PolarHBondContact O-N 3.41Å
944	S	93.1	Very high	90.9	Very high	25 Å²	25	44.7 Å²	44.7	18%	0.175	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-16.1	172.3	75.5	0	0	0	0	114	F941 L942 V946 F947 L948	F941-S944 PolarHBondContact O-N 2.74Å; F941-S944 PolarHBondContact O-OG 3.4Å; L942-S944 VanDerWaalsContact C-N 3.32Å; L942-S944 PolarHBondContact O-N 3.07Å; S944-V946 PolarHBondContact O-N 2.89Å; S944-F947 WeakPolarHBondContact O-CB 3.29Å; S944-F947 PolarHBondContact O-N 2.68Å; S944-F947 VanDerWaalsContact O-N 3.13Å; S944-L948 PolarHBondContact O-N 2.99Å; S944-L948 VanDerWaalsContact O-N 3.12Å
945	S	93.3	Very high	90.7	Very high	39 Å²	39	45.9 Å²	45.9	27%	0.273	24%	0.24	S	C	.	.	H	α-helix	trans	-60.5	-37.3	178.5	58.1	0	0	0	0	113.8	L942 T943 F947 L948 L949	L942-S945 VanDerWaalsContact O-CB 3.32Å; L942-S945 WeakPolarHBondContact O-CB 3.1Å; L942-S945 PolarHBondContact O-N 2.98Å; L942-S945 PolarHBondContact O-OG 2.95Å; T943-S945 PolarHBondContact O-N 2.73Å; T943-S945 VanDerWaalsContact O-N 3.11Å; S945-F947 VanDerWaalsContact C-N 3.26Å; S945-F947 PolarHBondContact O-N 2.72Å; S945-L948 PolarHBondContact O-N 3.44Å; S945-L949 WeakPolarHBondContact O-CB 3.48Å; S945-L949 WeakPolarHBondContact O-CG 3.31Å; S945-L949 PolarHBondContact O-N 3.45Å
946	V	91.7	Very high	90.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.3	-39.9	175.1	172.6	0	0	0	0	110.8	T844 I845 F877 N881 T943 S944 S950	T844-V946 WeakPolarHBondContact OG1-CG2 3.36Å; I845-V946 HydrophobicContact CG1-CG2 3.91Å; F877-V946 HydrophobicContact CD1-CB 4.25Å; F877-V946 HydrophobicContact CD1-CG2 3.3Å; F877-V946 HydrophobicContact CE1-CG2 3.58Å; F877-V946 HydrophobicContact CG-CG2 4.38Å; N881-V946 HydrophobicContact CB-CG1 4.15Å; T943-V946 PolarHBondContact O-N 3.41Å; S944-V946 PolarHBondContact O-N 2.89Å; V946-S950 VanDerWaalsContact O-CB 3.23Å; V946-S950 WeakPolarHBondContact O-CB 3.45Å; V946-S950 PolarHBondContact O-N 2.98Å; V946-S950 PolarHBondContact O-OG 3.33Å
947	F	90.8	Very high	90.2	Very high	32 Å²	32	50.5 Å²	50.5	14%	0.14	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-49.7	178.9	169.9	-86	0	0	0	111.5	W880 L883 S884 I891 S944 S945 L949 S950 E951	W880-F947 HydrophobicContact CB-CB 4.26Å; W880-F947 HydrophobicContact CD2-CB 4.45Å; W880-F947 HydrophobicContact CE3-CB 3.89Å; W880-F947 HydrophobicContact CE3-CD2 4.19Å; W880-F947 HydrophobicContact CE3-CG 4.03Å; W880-F947 HydrophobicContact CZ3-CG 4.45Å; L883-F947 HydrophobicContact CB-CD2 4.47Å; L883-F947 HydrophobicContact CD2-CD2 3.78Å; L883-F947 HydrophobicContact CD2-CE2 3.6Å; L883-F947 HydrophobicContact CG-CD2 4.03Å; L883-F947 HydrophobicContact CG-CE2 3.86Å; S884-F947 WeakPolarHBondContact OG-CA 3.17Å; I891-F947 HydrophobicContact CD1-CD2 4.29Å; I891-F947 HydrophobicContact CD1-CE2 3.55Å; I891-F947 HydrophobicContact CD1-CZ 4.34Å; S944-F947 WeakPolarHBondContact O-CB 3.29Å; S944-F947 PolarHBondContact O-N 2.68Å; S944-F947 VanDerWaalsContact O-N 3.13Å; S945-F947 VanDerWaalsContact C-N 3.26Å; S945-F947 PolarHBondContact O-N 2.72Å; F947-L949 PolarHBondContact O-N 3.28Å; F947-S950 PolarHBondContact O-N 2.89Å; F947-E951 HydrophobicContact CE1-CG 4.21Å; F947-E951 HydrophobicContact CE2-CG 4.32Å; F947-E951 HydrophobicContact CZ-CG 4.06Å; F947-E951 PolarHBondContact O-N 3.35Å
948	L	90.9	Very high	89.7	Confident	101 Å²	101	47.8 Å²	47.8	53%	0.529	25%	0.252	S	S	.	.	H	α-helix	trans	-60.1	-47.5	179.7	-67.2	173.9	0	0	0	111.8	S944 S945 S950 E951 C952	S944-L948 PolarHBondContact O-N 2.99Å; S944-L948 VanDerWaalsContact O-N 3.12Å; S945-L948 PolarHBondContact O-N 3.44Å; L948-S950 VanDerWaalsContact C-N 3.3Å; L948-S950 PolarHBondContact O-N 3.33Å; L948-E951 PolarHBondContact O-N 3.44Å; L948-C952 WeakPolarHBondContact O-CB 3.49Å; L948-C952 PolarHBondContact O-N 3.39Å; L948-C952 PolarHBondContact O-SG 3.16Å
949	L	91.3	Very high	89.2	Confident	84 Å²	84	51.6 Å²	51.6	44%	0.44	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-35	178.7	-68.2	169.3	0	0	0	112	L840 T844 S945 F947 R953	L840-L949 HydrophobicContact CD2-CB 4.25Å; T844-L949 HydrophobicContact CG2-CD1 3.54Å; S945-L949 WeakPolarHBondContact O-CB 3.48Å; S945-L949 WeakPolarHBondContact O-CG 3.31Å; S945-L949 PolarHBondContact O-N 3.45Å; F947-L949 PolarHBondContact O-N 3.28Å; L949-R953 WeakPolarHBondContact O-CB 3.38Å; L949-R953 PolarHBondContact O-N 3.33Å
950	S	88	Confident	88.7	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.014	29%	0.289	C	S	.	.	H	α-helix	trans	-67.6	-43	175.9	-67	0	0	0	0	113.2	S884 V946 F947 L948 R953 K954	S884-S950 WeakPolarHBondContact OG-CB 3.46Å; V946-S950 VanDerWaalsContact O-CB 3.23Å; V946-S950 WeakPolarHBondContact O-CB 3.45Å; V946-S950 PolarHBondContact O-N 2.98Å; V946-S950 PolarHBondContact O-OG 3.33Å; F947-S950 PolarHBondContact O-N 2.89Å; L948-S950 VanDerWaalsContact C-N 3.3Å; L948-S950 PolarHBondContact O-N 3.33Å; S950-R953 PolarHBondContact O-N 3.03Å; S950-K954 WeakPolarHBondContact O-CG 3.33Å; S950-K954 PolarHBondContact O-N 3.38Å
951	E	88.8	Confident	87.9	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.065	30%	0.296	C	S	.	.	H	α-helix	trans	-70	-40.3	176.3	-64.9	-58.7	101.9	0	0	111.5	L890 I891 F947 L948 R953 K954 L955	L890-E951 WeakPolarHBondContact CA-OE2 3.5Å; I891-E951 WeakPolarHBondContact CD1-OE1 3.46Å; I891-E951 PolarHBondContact N-OE2 2.72Å; F947-E951 HydrophobicContact CE1-CG 4.21Å; F947-E951 HydrophobicContact CE2-CG 4.32Å; F947-E951 HydrophobicContact CZ-CG 4.06Å; F947-E951 PolarHBondContact O-N 3.35Å; L948-E951 PolarHBondContact O-N 3.44Å; E951-R953 VanDerWaalsContact C-N 3.28Å; E951-R953 PolarHBondContact O-N 3.34Å; E951-K954 WeakPolarHBondContact O-CB 3.25Å; E951-K954 PolarHBondContact O-N 3.23Å; E951-K954 VanDerWaalsContact O-N 3.07Å; E951-K954 WeakPolarHBondContact OE1-CD 3.42Å; E951-K954 VanDerWaalsContact OE1-CE 3.26Å; E951-K954 WeakPolarHBondContact OE1-CE 3.49Å; E951-K954 IonicContact OE1-NZ 3.58Å; E951-K954 PolarHBondContact OE1-NZ 3.11Å; E951-L955 PolarHBondContact O-N 2.94Å
952	C	89	Confident	87	Confident	72 Å²	72	53.2 Å²	53.2	49%	0.486	28%	0.284	S	S	.	.	H	α-helix	trans	-56.3	-41.7	172.4	-74.3	0	0	0	0	112.2	L948 K954 L955 V956	L948-C952 WeakPolarHBondContact O-CB 3.49Å; L948-C952 PolarHBondContact O-N 3.39Å; L948-C952 PolarHBondContact O-SG 3.16Å; C952-K954 VanDerWaalsContact C-N 3.34Å; C952-K954 PolarHBondContact O-N 2.84Å; C952-L955 PolarHBondContact O-N 3.19Å; C952-V956 WeakPolarHBondContact O-CG2 3.28Å; C952-V956 PolarHBondContact O-N 3.26Å
953	R	88.5	Confident	85.9	Confident	33 Å²	33	57.7 Å²	57.7	13%	0.125	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-37.9	175.8	-167.2	-154.2	69.7	78.3	23.3	112.2	S837 L840 L949 S950 E951 V956 E957	S837-R953 PolarHBondContact OG-NE 3.14Å; S837-R953 PolarHBondContact OG-NH1 3.19Å; S837-R953 VanDerWaalsContact OG-NH1 3.15Å; L840-R953 HydrophobicContact CD1-CB 4.49Å; L840-R953 HydrophobicContact CD1-CG 4.3Å; L949-R953 WeakPolarHBondContact O-CB 3.38Å; L949-R953 PolarHBondContact O-N 3.33Å; S950-R953 PolarHBondContact O-N 3.03Å; E951-R953 VanDerWaalsContact C-N 3.28Å; E951-R953 PolarHBondContact O-N 3.34Å; R953-V956 PolarHBondContact O-N 2.81Å; R953-E957 IonicContact CZ-OE1 2.67Å; R953-E957 IonicContact CZ-OE2 2.62Å; R953-E957 IonicContact NH1-OE1 2.83Å; R953-E957 PolarHBondContact NH1-OE1 2.96Å; R953-E957 IonicContact NH1-OE2 3.41Å; R953-E957 PolarHBondContact NH1-OE2 3.06Å; R953-E957 IonicContact NH2-OE1 3.51Å; R953-E957 IonicContact NH2-OE2 3.78Å; R953-E957 PolarHBondContact NH2-OE2 3.4Å; R953-E957 PolarHBondContact O-N 2.9Å; R953-E957 VanDerWaalsContact O-N 3.15Å
954	K	86.1	Confident	84.3	Confident	1 Å²	1	63.7 Å²	63.7	0%	0.004	33%	0.326	C	S	.	.	H	α-helix	trans	-67.7	-43.2	175.7	-67	172.6	-177.9	178.4	0	112.2	S884 S887 Q888 K889 L890 S950 E951 C952 V956 E957 Q958	S884-K954 PolarHBondContact O-NZ 2.79Å; S887-K954 WeakPolarHBondContact O-CE 3.36Å; S887-K954 PolarHBondContact O-NZ 3.06Å; Q888-K954 WeakPolarHBondContact O-CD 3.5Å; Q888-K954 WeakPolarHBondContact O-CG 3.43Å; K889-K954 WeakPolarHBondContact O-CD 3.4Å; K889-K954 PolarHBondContact O-NZ 2.87Å; L890-K954 HydrophobicContact CD2-CB 3.9Å; S950-K954 WeakPolarHBondContact O-CG 3.33Å; S950-K954 PolarHBondContact O-N 3.38Å; E951-K954 WeakPolarHBondContact O-CB 3.25Å; E951-K954 PolarHBondContact O-N 3.23Å; E951-K954 VanDerWaalsContact O-N 3.07Å; E951-K954 WeakPolarHBondContact OE1-CD 3.42Å; E951-K954 VanDerWaalsContact OE1-CE 3.26Å; E951-K954 WeakPolarHBondContact OE1-CE 3.49Å; E951-K954 IonicContact OE1-NZ 3.58Å; E951-K954 PolarHBondContact OE1-NZ 3.11Å; C952-K954 VanDerWaalsContact C-N 3.34Å; C952-K954 PolarHBondContact O-N 2.84Å; K954-V956 VanDerWaalsContact C-N 3.26Å; K954-V956 PolarHBondContact O-N 3.16Å; K954-E957 PolarHBondContact O-N 2.85Å; K954-Q958 PolarHBondContact O-N 3.01Å
955	L	86.4	Confident	82.5	Confident	90 Å²	90	71.3 Å²	71.3	47%	0.471	35%	0.351	S	S	.	.	H	α-helix	trans	-55.5	-42.8	175	-74.5	168.4	0	0	0	111.4	L890 E951 C952 Q958 Y959	L890-L955 HydrophobicContact CD1-CD2 3.61Å; L890-L955 HydrophobicContact CD2-CD2 3.72Å; L890-L955 HydrophobicContact CD2-CG 3.73Å; L890-L955 HydrophobicContact CG-CD2 4.3Å; E951-L955 PolarHBondContact O-N 2.94Å; C952-L955 PolarHBondContact O-N 3.19Å; L955-Q958 PolarHBondContact O-N 3.12Å; L955-Y959 WeakPolarHBondContact O-CB 3.45Å; L955-Y959 PolarHBondContact O-N 2.83Å
956	V	86.6	Confident	80.5	Confident	84 Å²	84	76 Å²	76	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-66.5	-43.2	176.8	174.4	0	0	0	0	112	C952 R953 K954 Y959 L960	C952-V956 WeakPolarHBondContact O-CG2 3.28Å; C952-V956 PolarHBondContact O-N 3.26Å; R953-V956 PolarHBondContact O-N 2.81Å; K954-V956 VanDerWaalsContact C-N 3.26Å; K954-V956 PolarHBondContact O-N 3.16Å; V956-Y959 PolarHBondContact O-N 2.89Å; V956-L960 HydrophobicContact CG1-CD1 3.82Å; V956-L960 HydrophobicContact CG1-CG 4.33Å; V956-L960 WeakPolarHBondContact O-CB 3.45Å; V956-L960 VanDerWaalsContact O-CG 3.3Å; V956-L960 WeakPolarHBondContact O-CG 3.37Å; V956-L960 PolarHBondContact O-N 3.48Å
957	E	82.8	Confident	78.5	Confident	62 Å²	62	83.8 Å²	83.8	29%	0.29	40%	0.403	S	S	.	.	H	α-helix	trans	-62.5	-41.8	175.2	-78.7	-177.2	151.8	0	0	112.5	S833 R953 K954 T961	S833-E957 PolarHBondContact OG-OE1 3.3Å; R953-E957 IonicContact CZ-OE1 2.67Å; R953-E957 IonicContact CZ-OE2 2.62Å; R953-E957 IonicContact NH1-OE1 2.83Å; R953-E957 PolarHBondContact NH1-OE1 2.96Å; R953-E957 IonicContact NH1-OE2 3.41Å; R953-E957 PolarHBondContact NH1-OE2 3.06Å; R953-E957 IonicContact NH2-OE1 3.51Å; R953-E957 IonicContact NH2-OE2 3.78Å; R953-E957 PolarHBondContact NH2-OE2 3.4Å; R953-E957 PolarHBondContact O-N 2.9Å; R953-E957 VanDerWaalsContact O-N 3.15Å; K954-E957 PolarHBondContact O-N 2.85Å; E957-T961 WeakPolarHBondContact O-CB 3.41Å; E957-T961 WeakPolarHBondContact O-CG2 3.1Å; E957-T961 PolarHBondContact O-N 3.46Å; E957-T961 PolarHBondContact O-OG1 2.95Å
958	Q	80.3	Confident	76.4	Confident	57 Å²	57	88.7 Å²	88.7	27%	0.266	43%	0.431	S	S	.	.	H	α-helix	trans	-63.5	-41.7	174.7	-76.3	179.9	-40	0	0	112	L890 E893 K954 L955 T961 T962	L890-Q958 VanDerWaalsContact CD1-OE1 3.31Å; L890-Q958 VanDerWaalsContact CG-OE1 3.25Å; E893-Q958 PolarHBondContact OE1-NE2 3.42Å; K954-Q958 PolarHBondContact O-N 3.01Å; L955-Q958 PolarHBondContact O-N 3.12Å; Q958-T961 PolarHBondContact O-OG1 2.82Å; Q958-T962 WeakPolarHBondContact O-CB 3.36Å; Q958-T962 PolarHBondContact O-N 3.36Å; Q958-T962 PolarHBondContact O-OG1 2.59Å
959	Y	82.6	Confident	74.1	Confident	135 Å²	135	90.6 Å²	90.6	53%	0.529	44%	0.441	S	S	.	.	H	α-helix	trans	-65.2	-45.2	178.8	-171.4	-100.6	0	0	0	112.3	L955 V956 T962 R963	L955-Y959 WeakPolarHBondContact O-CB 3.45Å; L955-Y959 PolarHBondContact O-N 2.83Å; V956-Y959 PolarHBondContact O-N 2.89Å; Y959-T962 PolarHBondContact O-N 2.65Å; Y959-R963 HydrophobicContact CE1-CG 4.31Å; Y959-R963 PolarHBondContact O-N 2.86Å; Y959-R963 PolarHBondContact OH-NE 3.17Å; Y959-R963 VanDerWaalsContact OH-NE 3.14Å; Y959-R963 PolarHBondContact OH-NH2 3.14Å
960	L	81.7	Confident	71.5	Confident	91 Å²	91	89.6 Å²	89.6	48%	0.476	45%	0.445	S	S	.	.	H	α-helix	trans	-65.9	-43.9	179.2	-70.1	171.4	0	0	0	112.2	V956 R963 H964	V956-L960 HydrophobicContact CG1-CD1 3.82Å; V956-L960 HydrophobicContact CG1-CG 4.33Å; V956-L960 WeakPolarHBondContact O-CB 3.45Å; V956-L960 VanDerWaalsContact O-CG 3.3Å; V956-L960 WeakPolarHBondContact O-CG 3.37Å; V956-L960 PolarHBondContact O-N 3.48Å; L960-R963 PolarHBondContact O-N 3.25Å; L960-H964 PolarHBondContact O-CD2 2.95Å; L960-H964 PolarHBondContact O-N 2.94Å
961	T	74.1	Confident	68.9	Low	85 Å²	85	94.7 Å²	94.7	52%	0.521	48%	0.478	S	S	.	.	H	α-helix	trans	-67.9	-34.6	178.4	49.1	0	0	0	0	112.6	E957 Q958 R965	E957-T961 WeakPolarHBondContact O-CB 3.41Å; E957-T961 WeakPolarHBondContact O-CG2 3.1Å; E957-T961 PolarHBondContact O-N 3.46Å; E957-T961 PolarHBondContact O-OG1 2.95Å; Q958-T961 PolarHBondContact O-OG1 2.82Å; T961-R965 PolarHBondContact O-N 2.53Å
962	T	75	Confident	66.4	Low	79 Å²	79	102.9 Å²	102.9	49%	0.485	52%	0.518	S	S	.	.	H	α-helix	trans	-65.4	-45.1	173.2	-56.3	0	0	0	0	111.3	Q958 Y959 H964 R965 Q966	Q958-T962 WeakPolarHBondContact O-CB 3.36Å; Q958-T962 PolarHBondContact O-N 3.36Å; Q958-T962 PolarHBondContact O-OG1 2.59Å; Y959-T962 PolarHBondContact O-N 2.65Å; T962-H964 PolarHBondContact O-N 3Å; T962-R965 PolarHBondContact O-N 2.81Å; T962-Q966 PolarHBondContact O-N 2.81Å
963	R	68.8	Low	63.9	Low	126 Å²	126	107.3 Å²	107.3	48%	0.475	53%	0.531	S	S	.	.	H	α-helix	trans	-59.7	-45	175.2	-84.9	-167.5	174.3	-145.7	4.2	112.7	Y959 L960 R965 Q966 F967	Y959-R963 HydrophobicContact CE1-CG 4.31Å; Y959-R963 PolarHBondContact O-N 2.86Å; Y959-R963 PolarHBondContact OH-NE 3.17Å; Y959-R963 VanDerWaalsContact OH-NE 3.14Å; Y959-R963 PolarHBondContact OH-NH2 3.14Å; L960-R963 PolarHBondContact O-N 3.25Å; R963-R965 PolarHBondContact O-N 2.93Å; R963-Q966 WeakPolarHBondContact O-CB 3.38Å; R963-Q966 PolarHBondContact O-N 3.25Å; R963-Q966 VanDerWaalsContact O-N 3.09Å; R963-F967 WeakPolarHBondContact O-CD2 3.27Å; R963-F967 PolarHBondContact O-N 2.74Å
964	H	60.8	Low	61.1	Low	125 Å²	125	112 Å²	112	58%	0.579	57%	0.568	S	S	*	*	H	α-helix	trans	-58.7	-46.5	178.9	-90	-73.7	0	0	0	112.1	L960 T962 Q966 F967 D968	L960-H964 PolarHBondContact O-CD2 2.95Å; L960-H964 PolarHBondContact O-N 2.94Å; T962-H964 PolarHBondContact O-N 3Å; H964-Q966 PolarHBondContact O-N 3.47Å; H964-F967 PolarHBondContact O-N 2.9Å; H964-D968 PolarHBondContact O-N 3Å; H964-D968 VanDerWaalsContact O-N 3.09Å
965	R	54.7	Low	58.9	Low	186 Å²	186	119.3 Å²	119.3	70%	0.702	61%	0.606	S	S	*	*	H	α-helix	trans	-60	-30.9	175.2	-72.6	-176.4	176.3	179.7	0.1	113.7	T961 T962 R963 L969	T961-R965 PolarHBondContact O-N 2.53Å; T962-R965 PolarHBondContact O-N 2.81Å; R963-R965 PolarHBondContact O-N 2.93Å; R965-L969 WeakPolarHBondContact O-CB 3.32Å; R965-L969 WeakPolarHBondContact O-CG 3.49Å; R965-L969 PolarHBondContact O-N 3.29Å
966	Q	51.7	Low	56.4	Low	137 Å²	137	124 Å²	124	64%	0.64	62%	0.622	S	S	*	*	H	α-helix	trans	-73	-26.3	175.6	-73	-178.2	-41.8	0	0	113.3	T962 R963 H964	T962-Q966 PolarHBondContact O-N 2.81Å; R963-Q966 WeakPolarHBondContact O-CB 3.38Å; R963-Q966 PolarHBondContact O-N 3.25Å; R963-Q966 VanDerWaalsContact O-N 3.09Å; H964-Q966 PolarHBondContact O-N 3.47Å
967	F	50.8	Low	54.2	Low	163 Å²	163	126.5 Å²	126.5	72%	0.715	64%	0.642	S	S	*	*	H	α-helix	trans	-77	-41.2	171.9	-86.7	-84.4	0	0	0	112	R963 H964 L969 A970	R963-F967 WeakPolarHBondContact O-CD2 3.27Å; R963-F967 PolarHBondContact O-N 2.74Å; H964-F967 PolarHBondContact O-N 2.9Å; F967-L969 PolarHBondContact O-N 2.74Å; F967-A970 PolarHBondContact O-N 2.9Å
968	D	46.3	Very low	52.1	Low	135 Å²	135	132.2 Å²	132.2	72%	0.722	67%	0.669	S	S	*	*	H	α-helix	trans	-70.3	-17.5	178.6	-60.7	-33.8	0	0	0	113.5	H964	H964-D968 PolarHBondContact O-N 3Å; H964-D968 VanDerWaalsContact O-N 3.09Å
969	L	43.1	Very low	50.2	Low	141 Å²	141	135.6 Å²	135.6	74%	0.738	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	10.7	178.7	-75	165.8	0	0	0	114.1	R965 F967	R965-L969 WeakPolarHBondContact O-CB 3.32Å; R965-L969 WeakPolarHBondContact O-CG 3.49Å; R965-L969 PolarHBondContact O-N 3.29Å; F967-L969 PolarHBondContact O-N 2.74Å
970	A	34.8	Very low	48.4	Very low	64 Å²	64	141.9 Å²	141.9	53%	0.529	73%	0.729	S	S	.	*	S	Bend	trans	-66.1	123.8	167.4	0	0	0	0	0	109.2	F967 M972	F967-A970 PolarHBondContact O-N 2.9Å; A970-M972 PolarHBondContact O-N 2.53Å
971	P	34.4	Very low	46.8	Very low	108 Å²	108	144.4 Å²	144.4	70%	0.701	74%	0.741	S	S	*	*			trans	-66.6	124	-178.3	26.7	-33.5	0	0	0	110	H973	P971-H973 PolarHBondContact O-N 3.06Å
972	M	35.8	Very low	45.3	Very low	187 Å²	187	147.5 Å²	147.5	92%	0.921	75%	0.753	S	S	*	*			trans	-62	103.1	162.5	-73.4	-162.8	-167.8	0	0	107.9	A970 C974	A970-M972 PolarHBondContact O-N 2.53Å; M972-C974 PolarHBondContact O-N 3.42Å
973	H	36.2	Very low	43.7	Very low	164 Å²	164	151.3 Å²	151.3	76%	0.759	77%	0.768	S	S	*	*			trans	-55.8	130.7	173.8	-101.1	-88.3	0	0	0	109.8	P971 I975	P971-H973 PolarHBondContact O-N 3.06Å; H973-I975 PolarHBondContact O-N 3.22Å
974	C	30.7	Very low	42.2	Very low	132 Å²	132	152.8 Å²	152.8	89%	0.892	79%	0.785	S	S	*	*			trans	-59.9	105.7	-179.1	-58.6	0	0	0	0	111.3	M972	M972-C974 PolarHBondContact O-N 3.42Å
975	I	39.4	Very low	41	Very low	155 Å²	155	154.6 Å²	154.6	80%	0.795	80%	0.798	S	S	*	*			trans	-100.1	96.6	170	-61.6	178.5	0	0	0	108.6	H973	H973-I975 PolarHBondContact O-N 3.22Å
976	K	34.3	Very low	40.1	Very low	188 Å²	188	152.5 Å²	152.5	82%	0.817	80%	0.804	S	S	*	*			trans	34.7	110.4	151.3	-58.7	-176.6	177.6	-172	0	118.6
977	C	40.2	Very low	39.3	Very low	137 Å²	137	153.6 Å²	153.6	93%	0.926	82%	0.816	S	S	*	*				-145.9	128.3	127.2	-93.2	0	0	0	0	108.5
978	E	38.6	Very low	38.4	Very low	182 Å²	182	152.8 Å²	152.8	85%	0.85	82%	0.824	S	S	*	*			trans	-85.9	154.8	173.3	-73.5	166.3	112.4	0	0	110
979	P	41	Very low	37.7	Very low	127 Å²	127	154.3 Å²	154.3	83%	0.825	83%	0.832	S	S	*	*			trans	-76.8	138.3	178.3	31.6	-34.1	0	0	0	111.8
980	H	44.7	Very low	37.3	Very low	267 Å²	267	155.5 Å²	155.5	100%	1.236	84%	0.841	S	S	*	*			trans	-139.5	0	165.6	-108.3	-48.4	0	0	0	109.6

Retrieved 980 of 980 residues in 904.4 ms (Link to these results)

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