A0A087XW68_POEFO Loading...

Class II major histocompatibility complex transactivator

AlphaFold DB , UniProt , Accession A0A087XW68, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 953 aa.

						>A0A087XW68_POEFO|A0A087XW68
MFPPQSANSIPIQFITIPDPSAYKVVQLSSSPPPLIRLPLPNTAATPTYIFVPNPSPTRKRQVPPLSPADGAVAPFLMSSIQPGSMSDTASKVTTPPAAPLSPTNEVSPCKESPKSPVVVEIPQAVKDYIQQLKIHMSQVCQDMEAGLRMNAHYVNVSVSQREIARAGKNTNRCLDKELIITGDIDRQKNSMGQSQIFDSLNGKRYNVLFGNAGMGKTTVIKKLCLDWSIDCIPQFDFVFLLDGKQLALTEPVHSLQTLLLSQSSFAPRCADPDGVYAQILAAPKRVLIVFDGFDELRHYEVLLQTQKKELVASLQKDSKAQAFTVKQLFSSILQRVLLPGCTLLLATRPRGTASQLLRRADSFLEVCGFTPANVETYVSQYFSDPGLRESALDFLKSSSYLNLLCWNPALCHLVCAALEQCKSEAALPRTLTALCHKVLCLKMEKDRGSTESLPELCSIAWEGVKSNSSVVPKGRTVSTQLRAFSLRTGLLLSQSLMRRTLSKDGILLWANPFLQSYMAAVHLSLSRTVTDHSFLQTLPFQMGAKGRRKPQREEMELTQRIAAGLLFHNRTELQSLHSYSETVFRDMVASKQALVMKHLEGLCFGDLSSAQILEACNYVYEASFTHQESGTDTSAKMLTHLASNLPELLTFRGVPLNPPDVFTVQNALRAGGAEGRSFCLDLEDSGIQICGLRTLVALSNINTYRACIADVVTLWEELEKRSDEGLLQEAVSKFKIHPLKATQVCHIEHLERLVSIHTSKRLSDSSDQSNSLLAEGVPAVKELYKLEFELDPENSPLALPKLWDLLPGLHNLQHLDVENSKIGDKGAEKLANALVSLHSLEVLNLSENCIGDQGVKKLALALKDLPKLHCLSLYSNVISDEGAESLAAVLPHMASLTDLDIKYNKMTDIGAQSLGASLRKCSKVKTLRMWNQCIPYGVFERLKQQDSRILWQ
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	33.4	Very low	246 Å²	246	148.4 Å²	148.4	100%	1.212	84%	0.843	S	S	*	*				0	129.8	0	-106.8	168.3	136.4	0	0	107.4
2	F	28.1	Very low	33.2	Very low	215 Å²	215	148.2 Å²	148.2	94%	0.943	84%	0.835	S	S	*	*			trans	-61.6	153.3	-153.1	-83.8	-95.7	0	0	0	116.9
3	P	36.7	Very low	32.8	Very low	108 Å²	108	150 Å²	150	70%	0.701	83%	0.832	S	S	*	*			trans	-97.7	-178.2	-173.6	44.5	-37	0	0	0	112.4
4	P	37.9	Very low	32.6	Very low	128 Å²	128	152.8 Å²	152.8	83%	0.831	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-86.4	145.8	-158.7	35	-31	0	0	0	113
5	Q	33.5	Very low	32.7	Very low	199 Å²	199	152.5 Å²	152.5	93%	0.93	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-92.3	126.6	-178	-77.4	-173.2	-12.7	0	0	113.3
6	S	31.3	Very low	32.9	Very low	105 Å²	105	151.2 Å²	151.2	73%	0.734	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-73.7	154.3	172.4	50.8	0	0	0	0	113.5
7	A	37.9	Very low	33.2	Very low	90 Å²	90	150.4 Å²	150.4	74%	0.744	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-51.9	143.3	162.5	0	0	0	0	0	112.7
8	N	28.7	Very low	33.5	Very low	153 Å²	153	148.2 Å²	148.2	82%	0.818	81%	0.813	S	S	*	*			trans	-156	128.1	149.6	-97.3	-23.4	0	0	0	111.4
9	S	36.4	Very low	33.9	Very low	116 Å²	116	147.3 Å²	147.3	81%	0.811	81%	0.808	S	S	*	*			trans	-67.1	141.3	172.3	46.1	0	0	0	0	112.8
10	I	30.2	Very low	34.2	Very low	162 Å²	162	145.5 Å²	145.5	83%	0.831	80%	0.803	S	S	*	*			trans	-122.8	136.3	167.1	-61.4	178.7	0	0	0	108.3
11	P	30.3	Very low	34.5	Very low	110 Å²	110	143.8 Å²	143.8	71%	0.714	80%	0.802	S	S	*	*			trans	-85	145.3	-161.9	33.6	-34.4	0	0	0	113.2	Q13	P11-Q13 PolarHBondContact O-N 2.85Å
12	I	31.1	Very low	34.8	Very low	146 Å²	146	136.1 Å²	136.1	75%	0.749	78%	0.777	S	S	*	*			trans	-78.3	111.2	163.3	-61.7	172.8	0	0	0	107
13	Q	28.5	Very low	35.3	Very low	172 Å²	172	132.3 Å²	132.3	80%	0.804	76%	0.758	S	S	*	*			trans	-78	120.3	166	-83.6	-178.2	-17.6	0	0	109.2	P11 I15	P11-Q13 PolarHBondContact O-N 2.85Å; Q13-I15 PolarHBondContact O-N 3.42Å
14	F	30.4	Very low	35.4	Very low	189 Å²	189	136.8 Å²	136.8	83%	0.829	77%	0.766	S	S	*	*			trans	-76.3	115.1	164.8	-72.8	-87.6	0	0	0	108.5
15	I	33.3	Very low	35.6	Very low	149 Å²	149	136.9 Å²	136.9	76%	0.764	76%	0.764	S	S	*	*			trans	-83.9	112	164.8	-60.9	174.9	0	0	0	106.9	Q13 I17	Q13-I15 PolarHBondContact O-N 3.42Å; I15-I17 PolarHBondContact O-N 2.93Å
16	T	35.7	Very low	35.8	Very low	131 Å²	131	133.1 Å²	133.1	80%	0.804	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-71.5	117.5	168.6	-6.5	0	0	0	0	108.5
17	I	39	Very low	36.1	Very low	138 Å²	138	136.9 Å²	136.9	71%	0.708	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-77.5	124.6	171	-58.4	174.3	0	0	0	107.5	I15	I15-I17 PolarHBondContact O-N 2.93Å
18	P	37.4	Very low	36	Very low	110 Å²	110	140.2 Å²	140.2	71%	0.714	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-80.5	156.6	173	20.4	-9.7	0	0	0	111.9
19	D	41.1	Very low	36.4	Very low	132 Å²	132	138.4 Å²	138.4	71%	0.706	76%	0.764	S	S	*	*			trans	-5	137.8	-178	-101.5	-31.2	0	0	0	120.6	S21	D19-S21 PolarHBondContact O-N 3.47Å
20	P	40.9	Very low	36.3	Very low	111 Å²	111	138.8 Å²	138.8	72%	0.721	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-75.9	11.7	-174.6	32.9	-35.4	0	0	0	115.3	A22	P20-A22 PolarHBondContact O-N 3.11Å
21	S	39.3	Very low	36.5	Very low	110 Å²	110	136.6 Å²	136.6	77%	0.769	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-84	-3.7	-171.5	56	0	0	0	0	115.5	D19	D19-S21 PolarHBondContact O-N 3.47Å
22	A	42.5	Very low	37.1	Very low	85 Å²	85	137 Å²	137	70%	0.702	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-105.4	6.1	-173.3	0	0	0	0	0	116.5	P20	P20-A22 PolarHBondContact O-N 3.11Å
23	Y	39.9	Very low	37.8	Very low	134 Å²	134	132.5 Å²	132.5	53%	0.525	75%	0.749	S	S	.	*			trans	-118.4	128.6	-175.3	-55.5	-80.5	0	0	0	112.9
24	K	38.6	Very low	38.5	Very low	202 Å²	202	129.3 Å²	129.3	88%	0.878	74%	0.743	S	S	*	*			trans	-92.9	111.5	170.2	-105.4	-177.7	177.2	177.8	0	110.2
25	V	41.6	Very low	39.1	Very low	130 Å²	130	124.9 Å²	124.9	79%	0.788	73%	0.728	S	S	*	*			trans	-81.2	117.9	167.5	179.9	0	0	0	0	108.1
26	V	37.5	Very low	39.7	Very low	120 Å²	120	122.4 Å²	122.4	73%	0.727	72%	0.715	S	S	*	*			trans	-100.9	115.8	173.5	179.9	0	0	0	0	108.1
27	Q	38.4	Very low	40	Very low	185 Å²	185	124.7 Å²	124.7	86%	0.864	71%	0.709	S	S	*	*			trans	-90.3	114.3	171.6	-82.6	-174.6	-23	0	0	109.7
28	L	35.8	Very low	40	Very low	160 Å²	160	123.2 Å²	123.2	84%	0.838	70%	0.702	S	S	*	*			trans	-95	137	159.3	-78	158.6	0	0	0	108
29	S	36.4	Very low	40.1	Very low	114 Å²	114	123.5 Å²	123.5	80%	0.797	70%	0.704	S	S	*	*	S	Bend	trans	-65.9	131.3	-175.3	47.5	0	0	0	0	112.6
30	S	34.2	Very low	40.1	Very low	124 Å²	124	124 Å²	124	87%	0.867	71%	0.706	S	S	*	*	S	Bend	trans	83.9	130.9	175.8	75.2	0	0	0	0	117.5
31	S	34.5	Very low	39.9	Very low	116 Å²	116	124 Å²	124	81%	0.811	71%	0.706	S	S	*	*			trans	-68.3	159.5	-163.8	53.7	0	0	0	0	116.8
32	P	43.9	Very low	40.3	Very low	119 Å²	119	126.2 Å²	126.2	77%	0.773	71%	0.709	S	S	*	*	S	Bend	cis	-130.4	-161.6	18.2	40	-20.8	0	0	0	115.4
33	P	44.1	Very low	40.1	Very low	52 Å²	52	128.3 Å²	128.3	34%	0.338	71%	0.713	S	S	.	*	P	Polyproline II helix		-67.8	173.3	-95.8	40.2	-30.1	0	0	0	115.2	L35 F51	P33-L35 PolarHBondContact O-N 3.42Å; P33-F51 HydrophobicContact CG-CD1 3.68Å; P33-F51 HydrophobicContact CG-CE1 3.4Å; P33-F51 VanDerWaalsContact CG-CE1 3.4Å; P33-F51 HydrophobicContact CG-CZ 4.39Å
34	P	43.9	Very low	40.3	Very low	105 Å²	105	127.3 Å²	127.3	68%	0.682	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-69.9	129.3	-174.4	28.2	-33.6	0	0	0	112.4
35	L	42.1	Very low	40.5	Very low	96 Å²	96	121.9 Å²	121.9	50%	0.503	73%	0.725	S	S	.	*	P	Polyproline II helix	trans	-92.6	127.5	175.2	-70.3	159.4	0	0	0	109.8	P33 Y49 F51	P33-L35 PolarHBondContact O-N 3.42Å; L35-Y49 HydrophobicContact CB-CD1 4.18Å; L35-Y49 HydrophobicContact CD1-CD1 4.41Å; L35-Y49 HydrophobicContact CD2-CD1 4.26Å; L35-Y49 HydrophobicContact CD2-CG 4.39Å; L35-F51 HydrophobicContact CD2-CD2 4.48Å; L35-F51 HydrophobicContact CD2-CE2 4.4Å
36	I	46.3	Very low	40.4	Very low	97 Å²	97	121.8 Å²	121.8	50%	0.497	73%	0.725	S	S	.	*	B	Isolated β-bridge	trans	-91.6	124.4	172.1	-60.1	175.2	0	0	0	108.3	V52	I36-V52 HydrophobicContact CD1-CG2 4.26Å
37	R	41.7	Very low	40.6	Very low	178 Å²	178	119.2 Å²	119.2	67%	0.672	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-100.8	117.2	174.3	-170.4	-179.4	-177.2	-177.9	1	109.3
38	L	40.6	Very low	40.7	Very low	108 Å²	108	116 Å²	116	57%	0.565	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-95.5	133.5	173.6	-68.9	167	0	0	0	109.8
39	P	38.3	Very low	41	Very low	116 Å²	116	114.2 Å²	114.2	75%	0.753	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-82.5	121	166.5	30.5	-25.9	0	0	0	109
40	L	40.8	Very low	41.1	Very low	143 Å²	143	113.9 Å²	113.9	75%	0.749	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-93.1	135.9	164	-81	161.6	0	0	0	108.8	N42	L40-N42 PolarHBondContact O-N 3.5Å
41	P	38.2	Very low	41.1	Very low	111 Å²	111	114.8 Å²	114.8	72%	0.721	66%	0.664	S	S	*	*	S	Bend	trans	-74.1	127.7	174.3	27.7	-26	0	0	0	109.5
42	N	46	Very low	41.3	Very low	156 Å²	156	113 Å²	113	83%	0.834	65%	0.647	S	S	*	*	S	Bend	trans	59.3	84.3	169.3	-64.3	-13.5	0	0	0	117.1	L40	L40-N42 PolarHBondContact O-N 3.5Å
43	T	39.4	Very low	40.8	Very low	128 Å²	128	112.8 Å²	112.8	79%	0.785	65%	0.646	S	S	*	*			trans	-166.2	141.7	145.4	16.8	0	0	0	0	110	A45	T43-A45 PolarHBondContact O-N 3.05Å
44	A	43.8	Very low	40.2	Very low	114 Å²	114	118 Å²	118	94%	0.942	67%	0.671	S	S	*	*			trans	-88.6	81	175.6	0	0	0	0	0	110.3
45	A	42	Very low	39.6	Very low	87 Å²	87	118.6 Å²	118.6	72%	0.719	68%	0.675	S	S	*	*	S	Bend	trans	-155.2	153.2	166.1	0	0	0	0	0	110.9	T43	T43-A45 PolarHBondContact O-N 3.05Å
46	T	41.1	Very low	39.1	Very low	128 Å²	128	119.1 Å²	119.1	79%	0.785	69%	0.687	S	S	*	*			trans	-44.2	141.7	-172.2	41	0	0	0	0	115.8
47	P	41.5	Very low	38.3	Very low	66 Å²	66	120.7 Å²	120.7	43%	0.429	70%	0.703	S	S	.	*			trans	-69	133	-175.4	27.6	-33.2	0	0	0	113	Y49	P47-Y49 HydrophobicContact CB-CE2 4.25Å; P47-Y49 HydrophobicContact CG-CE2 3.95Å; P47-Y49 WeakPolarHBondContact O-CD2 3.39Å; P47-Y49 WeakPolarHBondContact O-CE2 3.3Å
48	T	39.6	Very low	37.6	Very low	118 Å²	118	118.9 Å²	118.9	72%	0.724	71%	0.712	S	S	*	*			trans	-85.4	133.1	173.6	-39.2	0	0	0	0	110.5
49	Y	43.3	Very low	36.9	Very low	123 Å²	123	125.5 Å²	125.5	48%	0.482	73%	0.73	S	S	.	*			trans	-114.1	138.9	177.2	-61.7	-89.9	0	0	0	110.8	L35 P47	L35-Y49 HydrophobicContact CB-CD1 4.18Å; L35-Y49 HydrophobicContact CD1-CD1 4.41Å; L35-Y49 HydrophobicContact CD2-CD1 4.26Å; L35-Y49 HydrophobicContact CD2-CG 4.39Å; P47-Y49 HydrophobicContact CB-CE2 4.25Å; P47-Y49 HydrophobicContact CG-CE2 3.95Å; P47-Y49 WeakPolarHBondContact O-CD2 3.39Å; P47-Y49 WeakPolarHBondContact O-CE2 3.3Å
50	I	37.5	Very low	36.3	Very low	106 Å²	106	129.9 Å²	129.9	54%	0.544	74%	0.737	S	S	.	*	B	Isolated β-bridge	trans	-110.5	130.3	176.5	-58.2	179.4	0	0	0	109.7
51	F	34.7	Very low	35.5	Very low	144 Å²	144	134.6 Å²	134.6	63%	0.632	75%	0.745	S	S	*	*			trans	-80.9	128.5	170.7	-101	-97.5	0	0	0	110.8	P33 L35 P53	P33-F51 HydrophobicContact CG-CD1 3.68Å; P33-F51 HydrophobicContact CG-CE1 3.4Å; P33-F51 VanDerWaalsContact CG-CE1 3.4Å; P33-F51 HydrophobicContact CG-CZ 4.39Å; L35-F51 HydrophobicContact CD2-CD2 4.48Å; L35-F51 HydrophobicContact CD2-CE2 4.4Å; F51-P53 WeakPolarHBondContact O-CD 3.16Å
52	V	38	Very low	35	Very low	77 Å²	77	138.4 Å²	138.4	47%	0.467	75%	0.753	S	S	.	*			trans	-104.8	110.9	173.3	-174.8	0	0	0	0	109.3	I36	I36-V52 HydrophobicContact CD1-CG2 4.26Å
53	P	33.6	Very low	34	Very low	115 Å²	115	137.1 Å²	137.1	75%	0.747	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-76.2	136.1	172.2	26.2	-26.7	0	0	0	111.2	F51	F51-P53 WeakPolarHBondContact O-CD 3.16Å
54	N	31.8	Very low	33.4	Very low	162 Å²	162	136.2 Å²	136.2	87%	0.866	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-73.8	135	173.6	-115.9	-4.5	0	0	0	110.3
55	P	31.6	Very low	32.7	Very low	118 Å²	118	136.8 Å²	136.8	77%	0.766	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-80	132.2	-175	29.9	-32.3	0	0	0	112.8
56	S	30.6	Very low	32	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-81.8	146.5	165	49.5	0	0	0	0	111.6
57	P	30.6	Very low	31.4	Very low	129 Å²	129	140.5 Å²	140.5	84%	0.838	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-72.1	146.3	-179.5	27.8	-32	0	0	0	113.4
58	T	27.2	Very low	31	Very low	141 Å²	141	143.5 Å²	143.5	87%	0.865	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67	130.3	-171.3	38.9	0	0	0	0	114.4
59	R	25.3	Very low	30.4	Very low	247 Å²	247	142.1 Å²	142.1	93%	0.932	77%	0.772	S	S	*	*			trans	-91.6	109.8	171.7	-149.7	178.8	-166.5	-175.3	3.9	108.7	R61	R59-R61 PolarHBondContact O-N 3.38Å
60	K	25.1	Very low	29.7	Very low	207 Å²	207	144.4 Å²	144.4	90%	0.9	79%	0.792	S	S	*	*			trans	-65.9	112.4	168.4	-75.6	-176.8	177.6	-179.2	0	108.8
61	R	25.5	Very low	29.1	Very low	243 Å²	243	143 Å²	143	92%	0.917	80%	0.804	S	S	*	*			trans	-86.8	107.5	171.5	-136.5	176.2	-176.5	-178.3	0.1	107.2	R59	R59-R61 PolarHBondContact O-N 3.38Å
62	Q	25.9	Very low	28.6	Very low	191 Å²	191	140.8 Å²	140.8	89%	0.893	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72.5	129	165.8	-87.6	177	-22.6	0	0	108.5
63	V	26.2	Very low	28	Very low	129 Å²	129	144.2 Å²	144.2	78%	0.782	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-85.5	131.3	178	177.7	0	0	0	0	108.1
64	P	26.8	Very low	27.5	Very low	109 Å²	109	142.9 Å²	142.9	71%	0.708	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-77.3	148.1	168.5	31	-30.1	0	0	0	110.3
65	P	29.4	Very low	27.5	Very low	126 Å²	126	141.1 Å²	141.1	82%	0.818	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-75.6	144.3	-173.9	30.6	-32.1	0	0	0	112.2
66	L	26.4	Very low	27.2	Very low	178 Å²	178	145.7 Å²	145.7	93%	0.932	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-66.1	135.6	172.3	-72.1	145.2	0	0	0	111
67	S	28.7	Very low	26.9	Very low	115 Å²	115	148.6 Å²	148.6	80%	0.804	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-79.2	150.2	165.3	-51.9	0	0	0	0	110.8
68	P	32.2	Very low	26.5	Very low	129 Å²	129	151.3 Å²	151.3	84%	0.838	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-88.9	146.6	166.7	19.9	-4.3	0	0	0	111.6
69	A	28.3	Very low	26.4	Very low	89 Å²	89	150.3 Å²	150.3	74%	0.736	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-92.6	133.3	170	0	0	0	0	0	110.1
70	D	28	Very low	26.3	Very low	170 Å²	170	143.9 Å²	143.9	91%	0.909	84%	0.839	S	S	*	*				-175.4	140.2	122.6	-93.8	-23.5	0	0	0	109.7
71	G	26.1	Very low	26.3	Very low	77 Å²	77	142.1 Å²	142.1	79%	0.794	84%	0.838	S	S	*	*			trans	-94	178.1	-155.4	0	0	0	0	0	117.7
72	A	23	Very low	26.2	Very low	98 Å²	98	139.3 Å²	139.3	81%	0.81	84%	0.835	S	S	*	*				177.4	132.5	124.8	0	0	0	0	0	112.6
73	V	25.7	Very low	26.8	Very low	149 Å²	149	136.1 Å²	136.1	90%	0.903	83%	0.831	S	S	*	*			trans	72.5	128.8	153.2	-155.8	0	0	0	0	121.8
74	A	23.1	Very low	26.7	Very low	86 Å²	86	133.7 Å²	133.7	71%	0.711	83%	0.832	S	S	*	*			trans	-81.8	-170.7	-177.3	0	0	0	0	0	114.5
75	P	32.5	Very low	26.5	Very low	126 Å²	126	133.7 Å²	133.7	82%	0.818	83%	0.834	S	S	*	*			cis	-130.4	165.4	-5.7	37.4	-18.7	0	0	0	115.8
76	F	24.2	Very low	26.4	Very low	213 Å²	213	135.5 Å²	135.5	93%	0.934	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-100.5	133.5	177.7	-121.5	-92.9	0	0	0	111.6
77	L	25.2	Very low	26.4	Very low	169 Å²	169	132.6 Å²	132.6	89%	0.885	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.6	135.8	174.6	-102	153.6	0	0	0	111.2
78	M	21.9	Very low	26.3	Very low	185 Å²	185	133.8 Å²	133.8	91%	0.911	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-74.2	145.1	167.9	-75.2	-152.5	153.3	0	0	111.7
79	S	24.6	Very low	26	Very low	121 Å²	121	134.8 Å²	134.8	85%	0.846	83%	0.83	S	S	*	*			trans	-147.3	123	140.8	60.7	0	0	0	0	111.4
80	S	23.8	Very low	25.9	Very low	111 Å²	111	134.9 Å²	134.9	78%	0.776	83%	0.831	S	S	*	*			trans	-74.3	145.9	169.1	48.2	0	0	0	0	111.4
81	I	24.4	Very low	25.9	Very low	170 Å²	170	132.3 Å²	132.3	87%	0.872	83%	0.826	S	S	*	*			trans	-133.1	120	153.3	-60.2	179.4	0	0	0	108.6
82	Q	24.4	Very low	26	Very low	185 Å²	185	138 Å²	138	86%	0.864	83%	0.829	S	S	*	*			trans	-105.7	168.9	163.5	-103.3	-156.2	-14	0	0	110.2
83	P	38.4	Very low	26.1	Very low	124 Å²	124	139 Å²	139	81%	0.805	83%	0.825	S	S	*	*			trans	-110.9	173.6	-157	41.3	-32.9	0	0	0	116
84	G	23.1	Very low	26	Very low	77 Å²	77	138.1 Å²	138.1	79%	0.794	82%	0.82	S	S	*	*			trans	147.8	152.2	167.2	0	0	0	0	0	110.6
85	S	23.6	Very low	26	Very low	109 Å²	109	140 Å²	140	76%	0.762	82%	0.822	S	S	*	*			cis	-174.2	148.9	4.1	175.1	0	0	0	0	108.1
86	M	26.3	Very low	26.4	Very low	164 Å²	164	139.3 Å²	139.3	81%	0.808	82%	0.818	S	S	*	*			trans	26.4	131.1	148.3	-56.3	-76.6	-80.8	0	0	122.4
87	S	26.7	Very low	27.3	Very low	118 Å²	118	134.7 Å²	134.7	83%	0.825	81%	0.809	S	S	*	*				169.5	155.3	114.2	47.7	0	0	0	0	114.7
88	D	26.3	Very low	27.2	Very low	140 Å²	140	131.4 Å²	131.4	75%	0.749	81%	0.807	S	S	*	*			trans	-69.8	158	-166.1	-53.4	-70.9	0	0	0	117.2
89	T	26.8	Very low	27.3	Very low	150 Å²	150	127 Å²	127	92%	0.92	80%	0.799	S	S	*	*				175.4	149.8	104.8	17.9	0	0	0	0	113.4
90	A	25.1	Very low	28	Very low	90 Å²	90	126.4 Å²	126.4	74%	0.744	79%	0.793	S	S	*	*			trans	-96.7	154.9	-175.4	0	0	0	0	0	114
91	S	28.5	Very low	28	Very low	117 Å²	117	129 Å²	129	82%	0.818	80%	0.798	S	S	*	*			trans	170.6	111.5	139.5	32.3	0	0	0	0	110
92	K	27.4	Very low	27.9	Very low	196 Å²	196	126 Å²	126	85%	0.852	79%	0.792	S	S	*	*				82.7	114.6	88.2	-87.7	-167.2	175.4	178	0	115.8
93	V	25.7	Very low	28.7	Very low	120 Å²	120	122.4 Å²	122.4	73%	0.727	78%	0.784	S	S	*	*			trans	69.5	126.5	131.3	-167.7	0	0	0	0	115.2
94	T	24.1	Very low	28	Very low	129 Å²	129	122.7 Å²	122.7	79%	0.791	78%	0.784	S	S	*	*				-178.5	152.9	53.7	-15.6	0	0	0	0	108.8
95	T	22.5	Very low	28.1	Very low	125 Å²	125	125.7 Å²	125.7	77%	0.767	78%	0.781	S	S	*	*			trans	-89.9	-172.2	164.3	45.2	0	0	0	0	110.8
96	P	40.9	Very low	28.1	Very low	112 Å²	112	128.5 Å²	128.5	73%	0.727	78%	0.782	S	S	*	*				-124.1	-140.4	-61.5	39.9	-20.6	0	0	0	108.8
97	P	44.2	Very low	28.1	Very low	116 Å²	116	126.9 Å²	126.9	75%	0.753	78%	0.782	S	S	*	*			cis	-136.3	-174.7	-21.9	36.4	-15.1	0	0	0	115.9
98	A	23.3	Very low	27.9	Very low	100 Å²	100	126.2 Å²	126.2	83%	0.826	78%	0.777	S	S	*	*			trans	103.7	132.3	145.3	0	0	0	0	0	121
99	A	23.9	Very low	28.3	Very low	92 Å²	92	124.7 Å²	124.7	76%	0.76	78%	0.775	S	S	*	*			trans	-82.5	-162.4	-179.8	0	0	0	0	0	112.3
100	P	38.6	Very low	28.1	Very low	109 Å²	109	123 Å²	123	71%	0.708	77%	0.768	S	S	*	*			cis	-135.6	-174.9	-13.5	30.9	-7.5	0	0	0	114.1
101	L	23	Very low	28.2	Very low	167 Å²	167	128.8 Å²	128.8	87%	0.874	78%	0.776	S	S	*	*			trans	128.3	130.5	147.6	-65.7	162.2	0	0	0	115.9
102	S	22.2	Very low	28.1	Very low	107 Å²	107	132.4 Å²	132.4	75%	0.748	78%	0.78	S	S	*	*			trans	-100.5	-169.3	171.1	55.5	0	0	0	0	109.8
103	P	43.1	Very low	28	Very low	108 Å²	108	128.1 Å²	128.1	70%	0.701	78%	0.775	S	S	*	*			cis	-130.9	175.1	-25.1	27.3	-6.1	0	0	0	112.6
104	T	23.4	Very low	28.2	Very low	130 Å²	130	128.4 Å²	128.4	80%	0.798	78%	0.78	S	S	*	*			trans	175.9	121.4	130.7	35.5	0	0	0	0	113
105	N	24.9	Very low	28.4	Very low	140 Å²	140	131.7 Å²	131.7	75%	0.749	78%	0.783	S	S	*	*			trans	32.8	121.5	140	-68.4	4.6	0	0	0	122.1
106	E	22.3	Very low	28.7	Very low	168 Å²	168	130.2 Å²	130.2	79%	0.785	78%	0.778	S	S	*	*				135.7	136.2	99.9	-110	175.8	-138.9	0	0	116.8
107	V	26.2	Very low	28.5	Very low	131 Å²	131	130.5 Å²	130.5	79%	0.794	78%	0.78	S	S	*	*			trans	91.1	113.9	159.1	-154.9	0	0	0	0	119.8
108	S	22.9	Very low	28	Very low	104 Å²	104	131 Å²	131	73%	0.727	78%	0.78	S	S	*	*			trans	-83.8	-172.7	172.3	53.3	0	0	0	0	111.7
109	P	35.6	Very low	29	Very low	107 Å²	107	132.3 Å²	132.3	70%	0.695	78%	0.777	S	S	*	*			cis	-143.4	168.5	6.4	40.9	-19.7	0	0	0	118.9
110	C	21.8	Very low	30.5	Very low	116 Å²	116	131.7 Å²	131.7	78%	0.784	76%	0.764	S	S	*	*			trans	77	109.6	146.3	-71.4	0	0	0	0	122.5
111	K	27.6	Very low	32	Very low	210 Å²	210	134.7 Å²	134.7	91%	0.913	77%	0.769	S	S	*	*				-167.3	139.7	101.3	-98.8	171.5	-176.1	179	0	111.8
112	E	25.7	Very low	34.7	Very low	193 Å²	193	128.9 Å²	128.9	90%	0.902	74%	0.738	S	S	*	*			trans	-72.3	142.5	-157.6	-63.3	171.9	136.1	0	0	116.1
113	S	25.7	Very low	37.8	Very low	107 Å²	107	126.7 Å²	126.7	75%	0.748	72%	0.721	S	S	*	*			trans	-122.7	161.5	164.8	63.5	0	0	0	0	109.1
114	P	30.7	Very low	39.9	Very low	126 Å²	126	127.1 Å²	127.1	82%	0.818	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-68	140.6	-151.7	29.6	-35.8	0	0	0	113.6	S116	P114-S116 PolarHBondContact O-N 3.02Å
115	K	27.5	Very low	42.9	Very low	197 Å²	197	123.2 Å²	123.2	86%	0.857	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-55.1	121.9	-176.8	-68.4	178.5	178.9	178.1	0	112
116	S	29.3	Very low	45.9	Very low	95 Å²	95	116.5 Å²	116.5	66%	0.664	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-55.7	158.2	161.5	49.4	0	0	0	0	111.5	P114 V118	P114-S116 PolarHBondContact O-N 3.02Å; S116-V118 PolarHBondContact O-N 3.09Å
117	P	36.2	Very low	49.1	Very low	118 Å²	118	113.3 Å²	113.3	77%	0.766	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-60.3	127.6	177.6	-7.7	21.1	0	0	0	109	V119	P117-V119 PolarHBondContact O-N 3.32Å; P117-V119 VanDerWaalsContact O-N 3.07Å
118	V	35.2	Very low	52.1	Low	125 Å²	125	110.2 Å²	110.2	76%	0.758	62%	0.621	S	S	*	*			trans	-59	112.7	175.5	178.4	0	0	0	0	108.2	S116 V120	S116-V118 PolarHBondContact O-N 3.09Å; V118-V120 PolarHBondContact O-N 2.93Å; V118-V120 VanDerWaalsContact O-N 3.1Å
119	V	44	Very low	55.3	Low	128 Å²	128	105.5 Å²	105.5	78%	0.776	59%	0.588	S	S	*	*			trans	-66.3	106	164.4	178.1	0	0	0	0	105.6	P117 E121	P117-V119 PolarHBondContact O-N 3.32Å; P117-V119 VanDerWaalsContact O-N 3.07Å; V119-E121 PolarHBondContact O-N 3.18Å; V119-E121 VanDerWaalsContact O-N 3.08Å
120	V	55.1	Low	57.9	Low	79 Å²	79	101.3 Å²	101.3	48%	0.479	56%	0.559	S	S	.	*			trans	-66.8	107.9	173.3	179.9	0	0	0	0	106.4	V118 I122	V118-V120 PolarHBondContact O-N 2.93Å; V118-V120 VanDerWaalsContact O-N 3.1Å; V120-I122 PolarHBondContact O-N 3.37Å
121	E	69.9	Low	61.2	Low	172 Å²	172	101.5 Å²	101.5	80%	0.804	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-61.5	120.6	174	-76.9	-172.4	155.8	0	0	109.4	V119 P123	V119-E121 PolarHBondContact O-N 3.18Å; V119-E121 VanDerWaalsContact O-N 3.08Å; E121-P123 WeakPolarHBondContact O-CD 3.4Å
122	I	80.4	Confident	64.2	Low	45 Å²	45	96.2 Å²	96.2	23%	0.231	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-71.8	121.7	177.9	-57.1	176.1	0	0	0	108.1	V120 V126 K127	V120-I122 PolarHBondContact O-N 3.37Å; I122-V126 HydrophobicContact CG2-CB 3.72Å; I122-V126 HydrophobicContact CG2-CG1 3.65Å; I122-K127 HydrophobicContact CB-CG 4.2Å; I122-K127 HydrophobicContact CG2-CG 3.81Å; I122-K127 WeakPolarHBondContact O-CE 3.45Å
123	P	87.4	Confident	67.2	Low	61 Å²	61	87 Å²	87	40%	0.396	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-58.7	149.5	177.7	-24.1	33.2	0	0	0	112	E121 A125 V126 K127	E121-P123 WeakPolarHBondContact O-CD 3.4Å; P123-A125 VanDerWaalsContact C-N 3.31Å; P123-A125 PolarHBondContact O-N 3.34Å; P123-V126 HydrophobicContact CB-CG2 4.22Å; P123-V126 HydrophobicContact CG-CG2 4.29Å; P123-V126 WeakPolarHBondContact O-CA 3.45Å; P123-V126 WeakPolarHBondContact O-CB 3.35Å; P123-V126 PolarHBondContact O-N 2.87Å; P123-K127 PolarHBondContact O-N 3.15Å
124	Q	86.3	Confident	70.3	Confident	117 Å²	117	83.6 Å²	83.6	55%	0.547	46%	0.456	S	S	.	.	H	α-helix	trans	-58.3	-41.5	-176.4	-170.7	58.6	39.2	0	0	112.6	V126 K127 D128	Q124-V126 PolarHBondContact O-N 2.85Å; Q124-K127 WeakPolarHBondContact O-CB 3.2Å; Q124-K127 PolarHBondContact O-N 3.01Å; Q124-D128 PolarHBondContact NE2-OD1 3.48Å; Q124-D128 PolarHBondContact O-N 3.02Å
125	A	85.4	Confident	73.2	Confident	48 Å²	48	81.7 Å²	81.7	40%	0.397	44%	0.438	S	S	.	.	H	α-helix	trans	-58	-32.8	176	0	0	0	0	0	113.1	P123 Y129	P123-A125 VanDerWaalsContact C-N 3.31Å; P123-A125 PolarHBondContact O-N 3.34Å; A125-Y129 PolarHBondContact O-N 3.12Å; A125-Y129 VanDerWaalsContact O-N 3.09Å
126	V	88.6	Confident	76	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-77.4	-38.6	177.5	-178.5	0	0	0	0	110.7	I122 P123 Q124 D128 Y129 I130 F238 V276 Q279	I122-V126 HydrophobicContact CG2-CB 3.72Å; I122-V126 HydrophobicContact CG2-CG1 3.65Å; P123-V126 HydrophobicContact CB-CG2 4.22Å; P123-V126 HydrophobicContact CG-CG2 4.29Å; P123-V126 WeakPolarHBondContact O-CA 3.45Å; P123-V126 WeakPolarHBondContact O-CB 3.35Å; P123-V126 PolarHBondContact O-N 2.87Å; Q124-V126 PolarHBondContact O-N 2.85Å; V126-D128 VanDerWaalsContact C-N 3.34Å; V126-Y129 PolarHBondContact O-N 3.31Å; V126-I130 HydrophobicContact CG1-CD1 4.15Å; V126-I130 VanDerWaalsContact O-CG1 3.27Å; V126-I130 WeakPolarHBondContact O-CG1 3.3Å; V126-I130 PolarHBondContact O-N 3.12Å; V126-F238 HydrophobicContact CG1-CE1 4.32Å; V126-F238 HydrophobicContact CG1-CZ 3.67Å; V126-V276 HydrophobicContact CB-CG2 4.48Å; V126-V276 HydrophobicContact CG1-CG2 4.44Å; V126-V276 HydrophobicContact CG2-CG2 4.01Å; V126-Q279 HydrophobicContact CB-CG 4.4Å; V126-Q279 HydrophobicContact CG1-CB 4.15Å; V126-Q279 HydrophobicContact CG1-CG 4.08Å; V126-Q279 HydrophobicContact CG2-CG 3.89Å
127	K	89.3	Confident	78.9	Confident	100 Å²	100	70.1 Å²	70.1	44%	0.435	38%	0.376	S	S	.	.	H	α-helix	trans	-60.3	-44.6	171.6	-67.3	177.4	177.3	166.3	0	111.5	I122 P123 Q124 Y129 I130 Q131	I122-K127 HydrophobicContact CB-CG 4.2Å; I122-K127 HydrophobicContact CG2-CG 3.81Å; I122-K127 WeakPolarHBondContact O-CE 3.45Å; P123-K127 PolarHBondContact O-N 3.15Å; Q124-K127 WeakPolarHBondContact O-CB 3.2Å; Q124-K127 PolarHBondContact O-N 3.01Å; K127-Y129 VanDerWaalsContact C-N 3.32Å; K127-Y129 PolarHBondContact O-N 3.39Å; K127-I130 PolarHBondContact O-N 2.92Å; K127-Q131 PolarHBondContact O-N 3.03Å
128	D	89.2	Confident	81.3	Confident	66 Å²	66	66 Å²	66	35%	0.353	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-42.3	177.8	-62.2	-17.8	0	0	0	110.8	Q124 V126 Q131 Q132	Q124-D128 PolarHBondContact NE2-OD1 3.48Å; Q124-D128 PolarHBondContact O-N 3.02Å; V126-D128 VanDerWaalsContact C-N 3.34Å; D128-Q131 PolarHBondContact O-N 3.06Å; D128-Q132 VanDerWaalsContact O-CG 3.32Å; D128-Q132 WeakPolarHBondContact O-CG 3.49Å; D128-Q132 PolarHBondContact O-N 2.77Å
129	Y	90.3	Very high	83.7	Confident	6 Å²	6	65.6 Å²	65.6	2%	0.024	34%	0.34	C	S	.	.	H	α-helix	trans	-62.9	-45	174.3	179.5	-97.7	0	0	0	112.4	A125 V126 K127 Q131 Q132 L133 F238 L261 P268 C270 V276	A125-Y129 PolarHBondContact O-N 3.12Å; A125-Y129 VanDerWaalsContact O-N 3.09Å; V126-Y129 PolarHBondContact O-N 3.31Å; K127-Y129 VanDerWaalsContact C-N 3.32Å; K127-Y129 PolarHBondContact O-N 3.39Å; Y129-Q131 VanDerWaalsContact C-N 3.29Å; Y129-Q131 PolarHBondContact O-N 3.14Å; Y129-Q132 PolarHBondContact O-N 3.26Å; Y129-L133 HydrophobicContact CE1-CD2 4.3Å; Y129-L133 WeakPolarHBondContact O-CB 3.19Å; Y129-L133 PolarHBondContact O-N 2.89Å; Y129-F238 HydrophobicContact CD1-CE1 4.19Å; Y129-F238 HydrophobicContact CE1-CE1 4.44Å; Y129-L261 HydrophobicContact CE1-CD2 4.05Å; Y129-L261 WeakPolarHBondContact OH-CD2 3.29Å; Y129-P268 HydrophobicContact CD2-CG 4.28Å; Y129-P268 HydrophobicContact CE2-CG 3.7Å; Y129-C270 HydrophobicContact CD2-CB 3.99Å; Y129-C270 HydrophobicContact CE2-CB 3.66Å; Y129-V276 HydrophobicContact CD1-CG1 3.75Å; Y129-V276 HydrophobicContact CD1-CG2 4.07Å; Y129-V276 HydrophobicContact CE1-CG1 3.88Å; Y129-V276 HydrophobicContact CG-CG1 4.41Å; Y129-V276 HydrophobicContact CG-CG2 3.94Å
130	I	90.3	Very high	85.5	Confident	19 Å²	19	62.2 Å²	62.2	10%	0.097	32%	0.32	C	S	.	.	H	α-helix	trans	-58.8	-44.3	176.7	-68.9	164	0	0	0	110.1	V126 K127 L133 K134 W228 D237 F238	V126-I130 HydrophobicContact CG1-CD1 4.15Å; V126-I130 VanDerWaalsContact O-CG1 3.27Å; V126-I130 WeakPolarHBondContact O-CG1 3.3Å; V126-I130 PolarHBondContact O-N 3.12Å; K127-I130 PolarHBondContact O-N 2.92Å; I130-L133 WeakPolarHBondContact O-CB 3.37Å; I130-L133 PolarHBondContact O-N 3.38Å; I130-K134 HydrophobicContact CG2-CD 4.49Å; I130-K134 WeakPolarHBondContact O-CG 3.32Å; I130-K134 PolarHBondContact O-N 2.96Å; I130-W228 HydrophobicContact CG2-CZ2 4.48Å; I130-D237 HydrophobicContact CD1-CB 4.25Å; I130-F238 HydrophobicContact CD1-CE1 4.08Å; I130-F238 HydrophobicContact CD1-CE2 4.44Å; I130-F238 HydrophobicContact CD1-CZ 3.92Å; I130-F238 HydrophobicContact CG1-CD1 4.14Å; I130-F238 HydrophobicContact CG1-CE1 3.63Å; I130-F238 HydrophobicContact CG1-CZ 4.01Å
131	Q	90.9	Very high	87	Confident	120 Å²	120	58.4 Å²	58.4	56%	0.561	30%	0.297	S	S	*	.	H	α-helix	trans	-64.4	-43.1	177.9	-171.7	175.2	2.6	0	0	112	K127 D128 Y129 L133 K134 I135	K127-Q131 PolarHBondContact O-N 3.03Å; D128-Q131 PolarHBondContact O-N 3.06Å; Y129-Q131 VanDerWaalsContact C-N 3.29Å; Y129-Q131 PolarHBondContact O-N 3.14Å; Q131-L133 VanDerWaalsContact C-N 3.32Å; Q131-L133 PolarHBondContact O-N 3.19Å; Q131-K134 PolarHBondContact O-N 3.39Å; Q131-I135 HydrophobicContact CG-CD1 4.12Å; Q131-I135 VanDerWaalsContact O-CG1 3.31Å; Q131-I135 WeakPolarHBondContact O-CG1 3.33Å; Q131-I135 PolarHBondContact O-N 2.74Å
132	Q	90.1	Very high	87.7	Confident	98 Å²	98	53.8 Å²	53.8	46%	0.458	28%	0.275	S	S	.	.	H	α-helix	trans	-61.8	-40.7	174.2	-73.6	178.1	12.4	0	0	112.1	D128 Y129 I135 H136 P268	D128-Q132 VanDerWaalsContact O-CG 3.32Å; D128-Q132 WeakPolarHBondContact O-CG 3.49Å; D128-Q132 PolarHBondContact O-N 2.77Å; Y129-Q132 PolarHBondContact O-N 3.26Å; Q132-I135 PolarHBondContact O-N 2.74Å; Q132-H136 WeakPolarHBondContact O-CB 3.44Å; Q132-H136 PolarHBondContact O-N 3.32Å; Q132-P268 HydrophobicContact CB-CB 4.45Å; Q132-P268 HydrophobicContact CB-CG 4.3Å
133	L	89.1	Confident	87.8	Confident	1 Å²	1	56 Å²	56	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-46	176.5	179.4	62.5	0	0	0	110.7	Y129 I130 Q131 H136 M137 W228 F266 P268	Y129-L133 HydrophobicContact CE1-CD2 4.3Å; Y129-L133 WeakPolarHBondContact O-CB 3.19Å; Y129-L133 PolarHBondContact O-N 2.89Å; I130-L133 WeakPolarHBondContact O-CB 3.37Å; I130-L133 PolarHBondContact O-N 3.38Å; Q131-L133 VanDerWaalsContact C-N 3.32Å; Q131-L133 PolarHBondContact O-N 3.19Å; L133-H136 PolarHBondContact O-N 2.95Å; L133-M137 VanDerWaalsContact O-CB 3.22Å; L133-M137 WeakPolarHBondContact O-CB 3.27Å; L133-M137 PolarHBondContact O-N 2.78Å; L133-W228 HydrophobicContact CB-CH2 4.35Å; L133-W228 HydrophobicContact CD2-CH2 3.76Å; L133-W228 HydrophobicContact CD2-CZ3 4.38Å; L133-W228 HydrophobicContact CG-CH2 3.81Å; L133-W228 HydrophobicContact CG-CZ3 4.07Å; L133-F266 VanDerWaalsContact CD1-O 3.27Å; L133-F266 WeakPolarHBondContact CD1-O 3.43Å; L133-P268 HydrophobicContact CB-CG 4.15Å; L133-P268 HydrophobicContact CD1-CG 4.36Å
134	K	91.8	Very high	87.5	Confident	34 Å²	34	54.6 Å²	54.6	15%	0.148	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-48.5	174.9	-74	-178.2	168.1	179.1	0	112.4	I130 Q131 H136 M137 S138 W228 S229 D231	I130-K134 HydrophobicContact CG2-CD 4.49Å; I130-K134 WeakPolarHBondContact O-CG 3.32Å; I130-K134 PolarHBondContact O-N 2.96Å; Q131-K134 PolarHBondContact O-N 3.39Å; K134-H136 PolarHBondContact O-N 3.22Å; K134-M137 PolarHBondContact O-N 3.45Å; K134-S138 WeakPolarHBondContact O-CB 3.25Å; K134-S138 PolarHBondContact O-N 2.94Å; K134-W228 HydrophobicContact CB-CZ3 4.35Å; K134-W228 HydrophobicContact CG-CE3 4.11Å; K134-W228 HydrophobicContact CG-CH2 3.5Å; K134-W228 VanDerWaalsContact CG-CH2 3.5Å; K134-W228 HydrophobicContact CG-CZ2 3.96Å; K134-W228 HydrophobicContact CG-CZ3 3.59Å; K134-S229 WeakPolarHBondContact O-CB 3.43Å; K134-D231 IonicContact NZ-OD1 2.85Å; K134-D231 PolarHBondContact NZ-OD1 3.01Å; K134-D231 IonicContact NZ-OD2 2.65Å; K134-D231 PolarHBondContact NZ-OD2 3.08Å
135	I	90.2	Very high	86.7	Confident	86 Å²	86	54 Å²	54	44%	0.441	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-47.4	179.2	-68.3	165.5	0	0	0	110.5	Q131 Q132 S138 Q139	Q131-I135 HydrophobicContact CG-CD1 4.12Å; Q131-I135 VanDerWaalsContact O-CG1 3.31Å; Q131-I135 WeakPolarHBondContact O-CG1 3.33Å; Q131-I135 PolarHBondContact O-N 2.74Å; Q132-I135 PolarHBondContact O-N 2.74Å; I135-S138 WeakPolarHBondContact O-CB 3.34Å; I135-S138 PolarHBondContact O-N 3.24Å; I135-Q139 WeakPolarHBondContact O-CG 3.38Å; I135-Q139 PolarHBondContact O-N 3.08Å; I135-Q139 VanDerWaalsContact O-N 3.08Å
136	H	87.6	Confident	85.8	Confident	49 Å²	49	54.9 Å²	54.9	23%	0.227	28%	0.28	C	S	.	.	H	α-helix	trans	-64.8	-43.8	-179.3	-168.6	58.2	0	0	0	111.8	Q132 L133 K134 S138 Q139 V140 F266	Q132-H136 WeakPolarHBondContact O-CB 3.44Å; Q132-H136 PolarHBondContact O-N 3.32Å; L133-H136 PolarHBondContact O-N 2.95Å; K134-H136 PolarHBondContact O-N 3.22Å; H136-S138 VanDerWaalsContact C-N 3.32Å; H136-S138 PolarHBondContact O-N 3.41Å; H136-Q139 PolarHBondContact O-N 3.32Å; H136-V140 WeakPolarHBondContact O-CG2 3.34Å; H136-V140 PolarHBondContact O-N 3.41Å; H136-F266 PolarHBondContact CD2-O 2.95Å
137	M	88.8	Confident	85	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.6	-39.8	176.7	-162.7	174.3	-135.4	0	0	111.8	L133 K134 Q139 V140 C141 C225 W228 V239 F266	L133-M137 VanDerWaalsContact O-CB 3.22Å; L133-M137 WeakPolarHBondContact O-CB 3.27Å; L133-M137 PolarHBondContact O-N 2.78Å; K134-M137 PolarHBondContact O-N 3.45Å; M137-Q139 VanDerWaalsContact C-N 3.32Å; M137-Q139 PolarHBondContact O-N 3Å; M137-V140 PolarHBondContact O-N 3.13Å; M137-C141 VanDerWaalsContact O-CB 3.24Å; M137-C141 WeakPolarHBondContact O-CB 3.48Å; M137-C141 PolarHBondContact O-N 3.06Å; M137-C141 PolarHBondContact O-SG 3.03Å; M137-C225 HydrophobicContact CE-CB 3.39Å; M137-C225 WeakPolarHBondContact CE-SG 3.33Å; M137-C225 HydrophobicContact CG-CB 3.81Å; M137-C225 HydrophobicContact SD-CB 3.59Å; M137-C225 VanDerWaalsContact SD-CB 3.59Å; M137-W228 HydrophobicContact SD-CE3 3.44Å; M137-W228 HydrophobicContact SD-CZ3 3.6Å; M137-V239 HydrophobicContact CE-CB 4.29Å; M137-V239 HydrophobicContact CE-CG1 3.83Å; M137-F266 HydrophobicContact CE-CD2 3.48Å; M137-F266 VanDerWaalsContact CE-CD2 3.48Å; M137-F266 HydrophobicContact CE-CE2 3.94Å; M137-F266 HydrophobicContact CG-CD2 3.85Å; M137-F266 HydrophobicContact CG-CE2 4.32Å; M137-F266 HydrophobicContact CG-CG 4.37Å; M137-F266 HydrophobicContact SD-CD2 4.48Å
138	S	88	Confident	84.7	Confident	33 Å²	33	54.5 Å²	54.5	23%	0.231	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-41.7	174.3	-170.8	0	0	0	0	112.2	K134 I135 H136 Q142 L226	K134-S138 WeakPolarHBondContact O-CB 3.25Å; K134-S138 PolarHBondContact O-N 2.94Å; I135-S138 WeakPolarHBondContact O-CB 3.34Å; I135-S138 PolarHBondContact O-N 3.24Å; H136-S138 VanDerWaalsContact C-N 3.32Å; H136-S138 PolarHBondContact O-N 3.41Å; S138-Q142 WeakPolarHBondContact O-CG 3.36Å; S138-Q142 PolarHBondContact O-NE2 3.5Å; S138-Q142 VanDerWaalsContact O-NE2 3.09Å; S138-L226 WeakPolarHBondContact O-CD2 3.36Å
139	Q	85.6	Confident	84.6	Confident	116 Å²	116	58 Å²	58	54%	0.542	31%	0.309	S	S	.	.	H	α-helix	trans	-71.1	-47.1	179.1	-70.1	170.2	-8.1	0	0	112.2	I135 H136 M137	I135-Q139 WeakPolarHBondContact O-CG 3.38Å; I135-Q139 PolarHBondContact O-N 3.08Å; I135-Q139 VanDerWaalsContact O-N 3.08Å; H136-Q139 PolarHBondContact O-N 3.32Å; M137-Q139 VanDerWaalsContact C-N 3.32Å; M137-Q139 PolarHBondContact O-N 3Å
140	V	82.3	Confident	84.5	Confident	56 Å²	56	58.2 Å²	58.2	34%	0.339	31%	0.31	S	S	.	.	H	α-helix	trans	-75.6	-32.1	-173.6	-175.6	0	0	0	0	112.3	H136 M137 Q142 F266	H136-V140 WeakPolarHBondContact O-CG2 3.34Å; H136-V140 PolarHBondContact O-N 3.41Å; M137-V140 PolarHBondContact O-N 3.13Å; V140-Q142 VanDerWaalsContact C-N 3.31Å; V140-Q142 PolarHBondContact O-N 3.35Å; V140-F266 HydrophobicContact CB-CD1 3.84Å; V140-F266 HydrophobicContact CB-CE1 3.9Å; V140-F266 HydrophobicContact CG1-CD1 3.64Å; V140-F266 HydrophobicContact CG1-CE1 3.35Å; V140-F266 HydrophobicContact CG1-CZ 4.43Å; V140-F266 HydrophobicContact CG2-CD1 4.38Å
141	C	86.3	Confident	84.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.9	-179.3	-63.7	0	0	0	0	113.8	M137 D143 K222 L226 F266	M137-C141 VanDerWaalsContact O-CB 3.24Å; M137-C141 WeakPolarHBondContact O-CB 3.48Å; M137-C141 PolarHBondContact O-N 3.06Å; M137-C141 PolarHBondContact O-SG 3.03Å; C141-D143 VanDerWaalsContact C-N 3.3Å; C141-D143 PolarHBondContact O-N 3.48Å; C141-K222 HydrophobicContact CB-CB 4.27Å; C141-L226 HydrophobicContact CB-CD1 4.25Å; C141-L226 HydrophobicContact CB-CD2 3.54Å; C141-L226 HydrophobicContact CB-CG 3.56Å; C141-F266 WeakPolarHBondContact SG-CE2 3.33Å; C141-F266 WeakPolarHBondContact SG-CZ 3.29Å
142	Q	84.9	Confident	84.1	Confident	75 Å²	75	59.8 Å²	59.8	35%	0.35	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-30.5	175.6	-85.5	171	39.1	0	0	112.9	S138 V140 R149 M150	S138-Q142 WeakPolarHBondContact O-CG 3.36Å; S138-Q142 PolarHBondContact O-NE2 3.5Å; S138-Q142 VanDerWaalsContact O-NE2 3.09Å; V140-Q142 VanDerWaalsContact C-N 3.31Å; V140-Q142 PolarHBondContact O-N 3.35Å; Q142-R149 WeakPolarHBondContact O-CA 3.37Å; Q142-M150 WeakPolarHBondContact O-CB 2.92Å; Q142-M150 PolarHBondContact O-N 3.14Å
143	D	81.8	Confident	84.1	Confident	90 Å²	90	56.6 Å²	56.6	48%	0.481	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-82.5	121.4	-179.7	-68	-27.4	0	0	0	111.1	C141 K222	C141-D143 VanDerWaalsContact C-N 3.3Å; C141-D143 PolarHBondContact O-N 3.48Å; D143-K222 PolarHBondContact O-NZ 3.28Å
144	M	80.1	Confident	84.2	Confident	33 Å²	33	57.9 Å²	57.9	16%	0.163	32%	0.32	C	S	.	.			trans	-88.2	178.4	165.8	-62.5	175.5	69.1	0	0	109.7	L148 R149 M150 H153 T219	M144-L148 WeakPolarHBondContact CA-O 3.33Å; M144-L148 HydrophobicContact CB-CB 3.86Å; M144-L148 WeakPolarHBondContact CB-O 3.48Å; M144-L148 PolarHBondContact N-O 2.68Å; M144-L148 HydrophobicContact SD-CB 4.35Å; M144-R149 VanDerWaalsContact SD-C 3.57Å; M144-M150 HydrophobicContact CG-CB 4.21Å; M144-M150 HydrophobicContact CG-CE 3.88Å; M144-M150 HydrophobicContact CG-SD 4.08Å; M144-M150 HydrophobicContact SD-SD 4.09Å; M144-H153 HydrophobicContact SD-CB 4.24Å; M144-T219 HydrophobicContact CE-CG2 4.02Å
145	E	70.3	Confident	84.1	Confident	103 Å²	103	56.7 Å²	56.7	48%	0.481	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-70.9	156.8	175.5	-66.7	175	176	0	0	111.5	G147 L148	E145-G147 VanDerWaalsContact C-N 3.28Å; E145-G147 PolarHBondContact O-N 3.27Å; E145-L148 PolarHBondContact O-N 3.37Å
146	A	67.1	Low	84	Confident	67 Å²	67	57.6 Å²	57.6	55%	0.554	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	58.8	27.8	174.9	0	0	0	0	0	116.3	L148	A146-L148 VanDerWaalsContact C-N 3.3Å; A146-L148 PolarHBondContact O-N 2.95Å
147	G	71.2	Confident	84	Confident	74 Å²	74	55.7 Å²	55.7	76%	0.763	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	82.7	5	177.4	0	0	0	0	0	114.3	E145	E145-G147 VanDerWaalsContact C-N 3.28Å; E145-G147 PolarHBondContact O-N 3.27Å
148	L	83.6	Confident	83.9	Confident	18 Å²	18	57.5 Å²	57.5	9%	0.094	33%	0.325	C	S	.	.			trans	-76	157.9	171.8	-59.4	-178.9	0	0	0	110.8	M144 E145 A146 H153 Y378 Y382	M144-L148 WeakPolarHBondContact CA-O 3.33Å; M144-L148 HydrophobicContact CB-CB 3.86Å; M144-L148 WeakPolarHBondContact CB-O 3.48Å; M144-L148 PolarHBondContact N-O 2.68Å; M144-L148 HydrophobicContact SD-CB 4.35Å; E145-L148 PolarHBondContact O-N 3.37Å; A146-L148 VanDerWaalsContact C-N 3.3Å; A146-L148 PolarHBondContact O-N 2.95Å; L148-H153 HydrophobicContact CB-CB 4.36Å; L148-Y378 VanDerWaalsContact CD1-OH 3.29Å; L148-Y378 WeakPolarHBondContact CD1-OH 3.16Å; L148-Y382 HydrophobicContact CD1-CD2 4.43Å; L148-Y382 HydrophobicContact CD1-CE2 4.45Å; L148-Y382 HydrophobicContact CD2-CD2 4.15Å; L148-Y382 HydrophobicContact CD2-CE2 4.15Å
149	R	87.3	Confident	83.9	Confident	140 Å²	140	55.9 Å²	55.9	53%	0.528	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-124.5	141.5	178.7	-67.6	-173.4	173.1	177.9	-0.3	112.1	Q142 M144 N151 A152 H153	Q142-R149 WeakPolarHBondContact O-CA 3.37Å; M144-R149 VanDerWaalsContact SD-C 3.57Å; R149-N151 VanDerWaalsContact C-N 3.29Å; R149-N151 VanDerWaalsContact CB-OD1 3.29Å; R149-N151 WeakPolarHBondContact CB-OD1 3.5Å; R149-N151 PolarHBondContact O-N 2.99Å; R149-A152 PolarHBondContact O-N 3.39Å; R149-H153 PolarHBondContact N-ND1 3.36Å; R149-H153 PolarHBondContact O-N 3.19Å; R149-H153 PolarHBondContact O-ND1 2.87Å
150	M	87.9	Confident	84.1	Confident	10 Å²	10	50.4 Å²	50.4	5%	0.049	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-32.5	-176.3	-162.7	68.7	73.4	0	0	112.9	Q142 M144 A152 Y154 T219 K222 K223 L226	Q142-M150 WeakPolarHBondContact O-CB 2.92Å; Q142-M150 PolarHBondContact O-N 3.14Å; M144-M150 HydrophobicContact CG-CB 4.21Å; M144-M150 HydrophobicContact CG-CE 3.88Å; M144-M150 HydrophobicContact CG-SD 4.08Å; M144-M150 HydrophobicContact SD-SD 4.09Å; M150-A152 VanDerWaalsContact C-N 3.33Å; M150-A152 PolarHBondContact O-N 2.96Å; M150-Y154 HydrophobicContact CG-CG 4.26Å; M150-Y154 WeakPolarHBondContact O-CB 3.41Å; M150-Y154 HydrophobicContact SD-CD1 4.28Å; M150-Y154 HydrophobicContact SD-CD2 3.25Å; M150-Y154 WeakPolarHBondContact SD-CD2 3.38Å; M150-Y154 HydrophobicContact SD-CE2 3.91Å; M150-Y154 HydrophobicContact SD-CG 3.45Å; M150-T219 HydrophobicContact CE-CG2 3.77Å; M150-T219 HydrophobicContact SD-CG2 3.99Å; M150-K222 HydrophobicContact CE-CB 3.84Å; M150-K222 HydrophobicContact CE-CD 4.47Å; M150-K223 HydrophobicContact CG-CD 4.4Å; M150-L226 HydrophobicContact CB-CD1 3.97Å; M150-L226 HydrophobicContact CG-CD1 3.55Å
151	N	85.9	Confident	84.3	Confident	122 Å²	122	50.1 Å²	50.1	65%	0.652	28%	0.284	S	S	*	.	H	α-helix	trans	-75.7	-19.5	179.4	60.7	-7.2	0	0	0	114.2	R149	R149-N151 VanDerWaalsContact C-N 3.29Å; R149-N151 VanDerWaalsContact CB-OD1 3.29Å; R149-N151 WeakPolarHBondContact CB-OD1 3.5Å; R149-N151 PolarHBondContact O-N 2.99Å
152	A	86.6	Confident	84.1	Confident	51 Å²	51	51.6 Å²	51.6	42%	0.421	29%	0.289	S	S	.	.	H	α-helix	trans	-112.2	-32.4	-173.3	0	0	0	0	0	113.5	R149 M150 Q381	R149-A152 PolarHBondContact O-N 3.39Å; M150-A152 VanDerWaalsContact C-N 3.33Å; M150-A152 PolarHBondContact O-N 2.96Å; A152-Q381 PolarHBondContact O-OE1 3.38Å
153	H	90.7	Very high	83.5	Confident	31 Å²	31	52.7 Å²	52.7	14%	0.144	29%	0.294	C	S	.	.	H	α-helix	trans	-120.8	0.6	-169.5	-52.7	84.4	0	0	0	113.6	M144 L148 R149 V155 Q381	M144-H153 HydrophobicContact SD-CB 4.24Å; L148-H153 HydrophobicContact CB-CB 4.36Å; R149-H153 PolarHBondContact N-ND1 3.36Å; R149-H153 PolarHBondContact O-N 3.19Å; R149-H153 PolarHBondContact O-ND1 2.87Å; H153-V155 PolarHBondContact O-N 3.11Å; H153-Q381 VanDerWaalsContact C-OE1 3.25Å; H153-Q381 PolarHBondContact CD2-O 2.85Å; H153-Q381 PolarHBondContact O-OE1 3.44Å
154	Y	90.1	Very high	83	Confident	28 Å²	28	50 Å²	50	11%	0.11	28%	0.28	C	S	.	.			trans	-77.9	126.6	-179.6	-176.6	-115	0	0	0	111	M150 N156 Q194 T219 K223	M150-Y154 HydrophobicContact CG-CG 4.26Å; M150-Y154 WeakPolarHBondContact O-CB 3.41Å; M150-Y154 HydrophobicContact SD-CD1 4.28Å; M150-Y154 HydrophobicContact SD-CD2 3.25Å; M150-Y154 WeakPolarHBondContact SD-CD2 3.38Å; M150-Y154 HydrophobicContact SD-CE2 3.91Å; M150-Y154 HydrophobicContact SD-CG 3.45Å; Y154-N156 WeakPolarHBondContact CE1-OD1 3.42Å; Y154-Q194 PolarHBondContact OH-NE2 2.99Å; Y154-Q194 PolarHBondContact OH-OE1 3.29Å; Y154-T219 HydrophobicContact CD2-CG2 3.81Å; Y154-T219 HydrophobicContact CE2-CG2 3.69Å; Y154-K223 HydrophobicContact CD1-CD 4.03Å; Y154-K223 HydrophobicContact CD1-CG 4.34Å; Y154-K223 HydrophobicContact CE1-CB 4.13Å; Y154-K223 HydrophobicContact CE1-CD 3.7Å; Y154-K223 HydrophobicContact CE1-CG 3.53Å; Y154-K223 HydrophobicContact CE2-CB 4.37Å
155	V	91	Very high	82	Confident	9 Å²	9	50.5 Å²	50.5	6%	0.055	29%	0.289	C	S	.	.			trans	-109.1	127.9	170.6	178.9	0	0	0	0	108.2	H153 V157 F370 N374 T377 Y378	H153-V155 PolarHBondContact O-N 3.11Å; V155-V157 PolarHBondContact O-N 3.37Å; V155-V157 VanDerWaalsContact O-N 3.11Å; V155-F370 HydrophobicContact CB-CE1 4.02Å; V155-F370 HydrophobicContact CB-CZ 4.21Å; V155-F370 HydrophobicContact CG1-CE1 4.18Å; V155-N374 HydrophobicContact CG1-CB 3.73Å; V155-N374 VanDerWaalsContact CG1-ND2 3.29Å; V155-N374 WeakPolarHBondContact CG1-ND2 3.3Å; V155-T377 HydrophobicContact CG2-CG2 3.92Å; V155-Y378 HydrophobicContact CG2-CD2 4.05Å; V155-Y378 HydrophobicContact CG2-CG 4.46Å
156	N	86.8	Confident	81.3	Confident	105 Å²	105	52.8 Å²	52.8	56%	0.561	29%	0.293	S	S	*	.			trans	-62.3	115.5	178.3	-77.8	-37.8	0	0	0	110.1	Y154 N374	Y154-N156 WeakPolarHBondContact CE1-OD1 3.42Å; N156-N374 PolarHBondContact O-ND2 3.43Å
157	V	87	Confident	80.2	Confident	9 Å²	9	53.1 Å²	53.1	6%	0.055	30%	0.296	C	S	.	.			trans	-93.4	133.5	173.5	-177.8	0	0	0	0	108.9	V155 Q194 V367 C368 F370	V155-V157 PolarHBondContact O-N 3.37Å; V155-V157 VanDerWaalsContact O-N 3.11Å; V157-Q194 PolarHBondContact O-NE2 3.31Å; V157-V367 HydrophobicContact CB-CG1 4.42Å; V157-V367 HydrophobicContact CG1-CG1 3.55Å; V157-C368 WeakPolarHBondContact CG1-O 3.43Å; V157-F370 HydrophobicContact CG2-CD1 3.88Å; V157-F370 HydrophobicContact CG2-CE1 3.51Å
158	S	86.8	Confident	78.7	Confident	37 Å²	37	51.9 Å²	51.9	26%	0.259	28%	0.283	S	S	.	.			trans	-74.9	149.3	177.8	67.4	0	0	0	0	111.8	S191 C368	S158-S191 VanDerWaalsContact CB-OG 3.23Å; S158-S191 WeakPolarHBondContact CB-OG 3.49Å; S158-S191 PolarHBondContact OG-OG 2.61Å; S158-C368 WeakPolarHBondContact O-CB 3.5Å; S158-C368 PolarHBondContact O-N 2.95Å; S158-C368 WeakPolarHBondContact OG-CB 3.48Å
159	V	89.4	Confident	77	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.1	177.8	179	0	0	0	0	108.1	M192 I197 L209 L365 E366	V159-M192 PolarHBondContact N-O 2.79Å; V159-M192 PolarHBondContact O-N 2.85Å; V159-I197 HydrophobicContact CB-CD1 4.4Å; V159-I197 HydrophobicContact CG2-CD1 4.11Å; V159-L209 HydrophobicContact CG1-CD1 4Å; V159-L365 HydrophobicContact CG1-CB 3.78Å; V159-L365 HydrophobicContact CG1-CD1 4.45Å; V159-L365 HydrophobicContact CG1-CD2 4.32Å; V159-L365 HydrophobicContact CG1-CG 4.4Å; V159-E366 CarbonylContact C-O 3.3Å; V159-E366 WeakPolarHBondContact CA-O 3.24Å
160	S	88.3	Confident	74.3	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.007	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	140.8	178.8	-176.3	0	0	0	0	111	R187 N190 L365 E366	S160-R187 PolarHBondContact OG-O 3.48Å; S160-N190 WeakPolarHBondContact CA-O 3.28Å; S160-L365 CarbonylContact O-C 3.59Å; S160-L365 WeakPolarHBondContact O-CA 2.98Å; S160-E366 PolarHBondContact N-O 3.46Å; S160-E366 PolarHBondContact O-N 3.36Å
161	Q	87.1	Confident	71.5	Confident	50 Å²	50	64.8 Å²	64.8	23%	0.234	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	136.8	166.7	-168.9	164.1	31.8	0	0	110.4	N190 S363	Q161-N190 HydrophobicContact CB-CB 4.45Å; Q161-N190 PolarHBondContact N-O 3.1Å; Q161-N190 VanDerWaalsContact N-O 3.07Å; Q161-S363 PolarHBondContact NE2-OG 2.94Å; Q161-S363 VanDerWaalsContact NE2-OG 3.09Å
162	R	81.6	Confident	69	Low	31 Å²	31	67.5 Å²	67.5	12%	0.117	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	142.8	177.8	-80.3	-90.6	-169.6	160	1.1	110.4	L179 I180 F364 E366	R162-L179 HydrophobicContact CB-CD2 4.32Å; R162-I180 PolarHBondContact NH1-O 3.02Å; R162-F364 HydrophobicContact CB-CB 3.95Å; R162-F364 PolarHBondContact N-O 3.24Å; R162-E366 HydrophobicContact CG-CB 4.01Å; R162-E366 IonicContact CZ-OE1 2.7Å; R162-E366 IonicContact CZ-OE2 3.15Å; R162-E366 IonicContact NE-OE1 2.73Å; R162-E366 IonicContact NE-OE2 3.8Å; R162-E366 PolarHBondContact NE-OE2 3.1Å; R162-E366 IonicContact NH2-OE1 2.91Å; R162-E366 PolarHBondContact NH2-OE1 3.37Å; R162-E366 IonicContact NH2-OE2 3.23Å; R162-E366 PolarHBondContact NH2-OE2 2.92Å
163	E	73.9	Confident	66.7	Low	97 Å²	97	75.9 Å²	75.9	45%	0.453	40%	0.395	S	S	.	.			trans	-97.8	161.3	171.3	-63.5	-170.8	168.8	0	0	111.8	I180 Q744	E163-I180 HydrophobicContact CB-CD1 4.14Å; E163-I180 PolarHBondContact O-N 2.91Å; E163-Q744 PolarHBondContact OE2-NE2 3.45Å
164	I	70.9	Confident	64.2	Low	35 Å²	35	80 Å²	80	18%	0.179	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.1	177.1	-68.4	-171.8	0	0	0	109.2	R166 K177 L179 L358 F364	I164-R166 PolarHBondContact O-N 2.99Å; I164-K177 HydrophobicContact CG2-CB 3.86Å; I164-K177 HydrophobicContact CG2-CD 4.15Å; I164-K177 HydrophobicContact CG2-CG 4.17Å; I164-L179 HydrophobicContact CG1-CD2 4.18Å; I164-L358 HydrophobicContact CD1-CB 3.96Å; I164-L358 HydrophobicContact CD1-CD2 3.77Å; I164-L358 HydrophobicContact CD1-CG 4.36Å; I164-F364 HydrophobicContact CD1-CD1 4.29Å; I164-F364 HydrophobicContact CD1-CD2 3.49Å; I164-F364 VanDerWaalsContact CD1-CD2 3.49Å; I164-F364 HydrophobicContact CD1-CE1 3.86Å; I164-F364 HydrophobicContact CD1-CE2 3.03Å; I164-F364 HydrophobicContact CD1-CG 4.11Å; I164-F364 HydrophobicContact CD1-CZ 3.21Å; I164-F364 HydrophobicContact CG1-CD2 3.77Å; I164-F364 HydrophobicContact CG1-CE2 3.8Å; I164-F364 HydrophobicContact CG1-CG 4.39Å; I164-F364 HydrophobicContact CG1-CZ 4.36Å
165	A	59.7	Low	61.8	Low	43 Å²	43	84.2 Å²	84.2	36%	0.355	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	122.1	170.1	0	0	0	0	0	109.3	E178 I180	A165-E178 PolarHBondContact N-O 3.12Å; A165-I180 HydrophobicContact CB-CD1 4.01Å; A165-I180 HydrophobicContact CB-CG1 3.8Å; A165-I180 VanDerWaalsContact N-CG1 3.33Å
166	R	54.2	Low	59.8	Low	151 Å²	151	89.4 Å²	89.4	57%	0.57	48%	0.477	S	S	*	.			trans	-82.1	114.2	162.7	-67.7	-176.8	-179	171.2	3.1	106.3	I164 G168 E794	I164-R166 PolarHBondContact O-N 2.99Å; R166-G168 PolarHBondContact O-N 3.45Å; R166-G168 VanDerWaalsContact O-N 3.11Å; R166-E794 IonicContact NH1-OE2 3.27Å; R166-E794 PolarHBondContact NH1-OE2 3.25Å
167	A	43.9	Very low	58.3	Low	74 Å²	74	88.2 Å²	88.2	61%	0.612	47%	0.467	S	S	*	.			trans	-57.3	119.3	179.2	0	0	0	0	0	110.6
168	G	40.5	Very low	57.3	Low	47 Å²	47	94.4 Å²	94.4	49%	0.485	50%	0.495	S	S	.	.			trans	-58.3	147.6	169.1	0	0	0	0	0	111.5	R166 N170	R166-G168 PolarHBondContact O-N 3.45Å; R166-G168 VanDerWaalsContact O-N 3.11Å; G168-N170 PolarHBondContact O-N 3.41Å
169	K	47	Very low	56.5	Low	166 Å²	166	94.3 Å²	94.3	72%	0.722	49%	0.492	S	S	*	.			trans	-63.8	115.7	-168.5	-66.3	169.1	-176.5	164	0	111.5
170	N	30.3	Very low	55.9	Low	150 Å²	150	95.7 Å²	95.7	80%	0.802	50%	0.499	S	S	*	.			trans	-156.7	117.4	140	-97.2	-30.3	0	0	0	112.6	G168	G168-N170 PolarHBondContact O-N 3.41Å
171	T	30.4	Very low	55.6	Low	124 Å²	124	96.6 Å²	96.6	76%	0.761	50%	0.503	S	S	*	.	S	Bend	trans	58.1	99.5	162.2	65.2	0	0	0	0	118.9	R173	T171-R173 PolarHBondContact O-N 3.24Å
172	N	33.5	Very low	55.3	Low	179 Å²	179	94.7 Å²	94.7	96%	0.957	50%	0.495	S	S	*	.	S	Bend	trans	41.2	21.2	147.5	-76.1	-17.4	0	0	0	121
173	R	37.9	Very low	55.3	Low	226 Å²	226	93.6 Å²	93.6	85%	0.853	49%	0.493	S	S	*	.			trans	-135.9	55.8	164.8	-76	-171.3	179	170.8	3.8	110.2	T171 L175	T171-R173 PolarHBondContact O-N 3.24Å; R173-L175 VanDerWaalsContact C-N 3.34Å; R173-L175 PolarHBondContact O-N 2.94Å
174	C	37	Very low	55.9	Low	118 Å²	118	89.5 Å²	89.5	80%	0.797	47%	0.474	S	S	*	.			trans	-76.1	87.5	166.5	-173.4	0	0	0	0	108.3
175	L	41.6	Very low	56.6	Low	116 Å²	116	89.1 Å²	89.1	61%	0.607	47%	0.472	S	S	*	.			trans	-131.4	-22	-179.7	-77.9	175.7	0	0	0	116.4	R173	R173-L175 VanDerWaalsContact C-N 3.34Å; R173-L175 PolarHBondContact O-N 2.94Å
176	D	47.2	Very low	57.8	Low	118 Å²	118	87.5 Å²	87.5	63%	0.631	46%	0.458	S	S	*	.			trans	-119.3	102.4	-174.2	-63.8	-39.3	0	0	0	110.9
177	K	56.8	Low	59.3	Low	80 Å²	80	82 Å²	82	35%	0.348	44%	0.437	S	S	.	.			trans	-72.9	129.6	158.5	-71.8	-178.7	176.2	-164.2	0	106.3	I164 L358 R359	I164-K177 HydrophobicContact CG2-CB 3.86Å; I164-K177 HydrophobicContact CG2-CD 4.15Å; I164-K177 HydrophobicContact CG2-CG 4.17Å; K177-L358 HydrophobicContact CB-CB 4.02Å; K177-L358 HydrophobicContact CB-CD1 4.33Å; K177-L358 HydrophobicContact CD-CB 4.33Å; K177-L358 VanDerWaalsContact CD-O 3.23Å; K177-L358 WeakPolarHBondContact CD-O 3.06Å; K177-L358 PolarHBondContact NZ-O 3.41Å; K177-L358 VanDerWaalsContact NZ-O 3.15Å; K177-L358 WeakPolarHBondContact O-CD1 3.4Å; K177-R359 HydrophobicContact CD-CG 4.15Å
178	E	65.5	Low	61.2	Low	139 Å²	139	83.5 Å²	83.5	65%	0.65	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	148.5	174.4	-68.2	-172.1	165.3	0	0	110.4	A165	A165-E178 PolarHBondContact N-O 3.12Å
179	L	70.5	Confident	63.3	Low	35 Å²	35	87.2 Å²	87.2	18%	0.183	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127.7	173.9	-72.3	165.4	0	0	0	108.5	R162 I164 F210 P350 L358 F364	R162-L179 HydrophobicContact CB-CD2 4.32Å; I164-L179 HydrophobicContact CG1-CD2 4.18Å; L179-F210 HydrophobicContact CD1-CD2 3.87Å; L179-F210 HydrophobicContact CD1-CE1 4.32Å; L179-F210 HydrophobicContact CD1-CE2 3.58Å; L179-F210 HydrophobicContact CD1-CG 4.34Å; L179-F210 HydrophobicContact CD1-CZ 3.84Å; L179-F210 HydrophobicContact CD2-CD2 4.37Å; L179-F210 HydrophobicContact CD2-CE2 3.74Å; L179-F210 HydrophobicContact CD2-CZ 4.43Å; L179-F210 HydrophobicContact CG-CE2 4.27Å; L179-P350 HydrophobicContact CD1-CB 4.37Å; L179-L358 HydrophobicContact CD1-CD2 4.34Å; L179-L358 HydrophobicContact CD2-CD2 3.7Å; L179-L358 HydrophobicContact CG-CD1 4.4Å; L179-L358 HydrophobicContact CG-CD2 3.85Å; L179-F364 HydrophobicContact CD2-CB 4.25Å; L179-F364 HydrophobicContact CD2-CD1 4.44Å; L179-F364 HydrophobicContact CD2-CG 4.28Å
180	I	76	Confident	65	Low	29 Å²	29	82 Å²	82	15%	0.149	41%	0.414	C	S	.	.			trans	-72.3	134.3	176.7	-55	176.7	0	0	0	108.3	R162 E163 A165 T182 Q744	R162-I180 PolarHBondContact NH1-O 3.02Å; E163-I180 HydrophobicContact CB-CD1 4.14Å; E163-I180 PolarHBondContact O-N 2.91Å; A165-I180 HydrophobicContact CB-CD1 4.01Å; A165-I180 HydrophobicContact CB-CG1 3.8Å; A165-I180 VanDerWaalsContact N-CG1 3.33Å; I180-T182 HydrophobicContact CG2-CG2 4.35Å; I180-Q744 HydrophobicContact CD1-CG 4.49Å; I180-Q744 VanDerWaalsContact CD1-NE2 3.28Å
181	I	82	Confident	67.5	Low	21 Å²	21	76.8 Å²	76.8	11%	0.108	39%	0.39	C	S	.	.			trans	-91.9	103.5	170.1	-56.2	178.2	0	0	0	107	G654 P656 D685 S686	I181-G654 VanDerWaalsContact CD1-C 3.43Å; I181-G654 WeakPolarHBondContact CD1-O 3.36Å; I181-P656 HydrophobicContact CD1-CB 4.21Å; I181-P656 HydrophobicContact CD1-CG 4.4Å; I181-D685 VanDerWaalsContact CB-O 3.24Å; I181-D685 WeakPolarHBondContact CB-O 3.43Å; I181-D685 WeakPolarHBondContact CD1-O 3.37Å; I181-D685 WeakPolarHBondContact CG2-O 3.28Å; I181-S686 VanDerWaalsContact CG2-C 3.47Å
182	T	80.1	Confident	70	Confident	10 Å²	10	72 Å²	72	6%	0.061	36%	0.359	C	S	.	.			trans	-82.3	156.6	179	55.1	0	0	0	0	111.1	I180 G687	I180-T182 HydrophobicContact CG2-CG2 4.35Å; T182-G687 WeakPolarHBondContact O-CA 3.4Å
183	G	82.4	Confident	72	Confident	7 Å²	7	65 Å²	65	7%	0.072	33%	0.329	C	S	.	.			trans	-59.1	163.7	170.3	0	0	0	0	0	112.9	I185 D186 R187 D711	G183-I185 VanDerWaalsContact C-N 3.34Å; G183-I185 PolarHBondContact O-N 3.1Å; G183-D186 PolarHBondContact O-N 3.22Å; G183-R187 WeakPolarHBondContact O-CB 3.29Å; G183-R187 PolarHBondContact O-N 3.21Å; G183-D711 WeakPolarHBondContact CA-OD2 3.32Å
184	D	85.9	Confident	73.6	Confident	11 Å²	11	54.7 Å²	54.7	6%	0.059	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-43.4	-178.2	-168.2	20.8	0	0	0	111.7	R187 Q188 Q689 I690 D711	D184-R187 VanDerWaalsContact CG-NH2 3.32Å; D184-R187 WeakPolarHBondContact O-CB 3.46Å; D184-R187 PolarHBondContact O-N 2.93Å; D184-R187 IonicContact OD1-CZ 3.97Å; D184-R187 IonicContact OD1-NE 3.16Å; D184-R187 IonicContact OD1-NH2 3.02Å; D184-R187 PolarHBondContact OD1-NH2 3.31Å; D184-Q188 VanDerWaalsContact CG-NE2 3.33Å; D184-Q188 VanDerWaalsContact O-CG 3.28Å; D184-Q188 WeakPolarHBondContact O-CG 3.45Å; D184-Q188 PolarHBondContact O-N 3.38Å; D184-Q188 PolarHBondContact OD1-NE2 3.1Å; D184-Q188 VanDerWaalsContact OD1-NE2 3.11Å; D184-Q188 PolarHBondContact OD2-NE2 3.13Å; D184-Q689 WeakPolarHBondContact OD2-CA 3.32Å; D184-I690 HydrophobicContact CB-CG1 4.47Å; D184-I690 PolarHBondContact OD2-N 3.17Å; D184-D711 VanDerWaalsContact N-CG 3.35Å; D184-D711 PolarHBondContact N-OD1 3.17Å; D184-D711 VanDerWaalsContact N-OD1 3.1Å; D184-D711 PolarHBondContact N-OD2 3Å
185	I	86.6	Confident	75	Confident	27 Å²	27	52.3 Å²	52.3	14%	0.138	28%	0.276	C	S	.	.	H	α-helix	trans	-62.9	-44.7	178.5	-70.1	-62.6	0	0	0	112.1	G183 R187 Q188 K189 I690 A710 D711 T714	G183-I185 VanDerWaalsContact C-N 3.34Å; G183-I185 PolarHBondContact O-N 3.1Å; I185-R187 VanDerWaalsContact C-N 3.34Å; I185-Q188 PolarHBondContact O-N 3.04Å; I185-K189 HydrophobicContact CG2-CD 4.32Å; I185-K189 WeakPolarHBondContact O-CG 3.37Å; I185-K189 PolarHBondContact O-N 2.92Å; I185-I690 HydrophobicContact CD1-CD1 3.84Å; I185-I690 HydrophobicContact CG1-CD1 4.16Å; I185-A710 HydrophobicContact CB-CB 4.07Å; I185-A710 HydrophobicContact CG1-CB 4.44Å; I185-A710 HydrophobicContact CG2-CB 4.09Å; I185-D711 WeakPolarHBondContact CB-OD1 3.39Å; I185-D711 VanDerWaalsContact CG1-OD1 3.3Å; I185-D711 WeakPolarHBondContact CG1-OD1 3.36Å; I185-D711 PolarHBondContact N-OD1 2.86Å; I185-T714 HydrophobicContact CD1-CG2 4.06Å; I185-T714 WeakPolarHBondContact CG1-OG1 3.05Å
186	D	84.9	Confident	76.5	Confident	10 Å²	10	51.6 Å²	51.6	5%	0.053	27%	0.269	C	S	.	.	H	α-helix	trans	-68.6	-37.3	179	-66	-30.2	0	0	0	111.7	G183 Q188 K189 N190 H750	G183-D186 PolarHBondContact O-N 3.22Å; D186-Q188 VanDerWaalsContact C-N 3.29Å; D186-Q188 PolarHBondContact O-N 2.96Å; D186-K189 PolarHBondContact O-N 3.32Å; D186-K189 IonicContact OD1-NZ 3.51Å; D186-K189 PolarHBondContact OD1-NZ 2.97Å; D186-N190 WeakPolarHBondContact O-CB 3.23Å; D186-N190 PolarHBondContact O-N 3.17Å; D186-N190 PolarHBondContact O-ND2 2.8Å; D186-H750 IonicContact OD1-CE1 3.83Å; D186-H750 PolarHBondContact OD1-CE1 2.67Å; D186-H750 VanDerWaalsContact OD1-CE1 3.28Å; D186-H750 IonicContact OD1-NE2 2.71Å; D186-H750 PolarHBondContact OD1-NE2 3.08Å; D186-H750 IonicContact OD2-CE1 3.43Å; D186-H750 PolarHBondContact OD2-CE1 3.4Å
187	R	84.3	Confident	78.1	Confident	36 Å²	36	46 Å²	46	14%	0.136	24%	0.239	C	C	.	.	H	α-helix	trans	-60.4	-39.9	171.9	177.9	178.8	57.3	-162.9	-10.4	111.4	S160 G183 D184 I185 S191 G687	S160-R187 PolarHBondContact OG-O 3.48Å; G183-R187 WeakPolarHBondContact O-CB 3.29Å; G183-R187 PolarHBondContact O-N 3.21Å; D184-R187 VanDerWaalsContact CG-NH2 3.32Å; D184-R187 WeakPolarHBondContact O-CB 3.46Å; D184-R187 PolarHBondContact O-N 2.93Å; D184-R187 IonicContact OD1-CZ 3.97Å; D184-R187 IonicContact OD1-NE 3.16Å; D184-R187 IonicContact OD1-NH2 3.02Å; D184-R187 PolarHBondContact OD1-NH2 3.31Å; I185-R187 VanDerWaalsContact C-N 3.34Å; R187-S191 PolarHBondContact O-N 3.41Å; R187-S191 VanDerWaalsContact O-N 3.17Å; R187-G687 PolarHBondContact NH1-O 3.28Å; R187-G687 PolarHBondContact NH2-O 3.27Å
188	Q	84.4	Confident	79.3	Confident	105 Å²	105	43.2 Å²	43.2	49%	0.491	23%	0.227	S	C	.	.	H	α-helix	trans	-69.7	-40.6	176	-71.5	175.2	27.3	0	0	112.2	D184 I185 D186 N190 S191	D184-Q188 VanDerWaalsContact CG-NE2 3.33Å; D184-Q188 VanDerWaalsContact O-CG 3.28Å; D184-Q188 WeakPolarHBondContact O-CG 3.45Å; D184-Q188 PolarHBondContact O-N 3.38Å; D184-Q188 PolarHBondContact OD1-NE2 3.1Å; D184-Q188 VanDerWaalsContact OD1-NE2 3.11Å; D184-Q188 PolarHBondContact OD2-NE2 3.13Å; I185-Q188 PolarHBondContact O-N 3.04Å; D186-Q188 VanDerWaalsContact C-N 3.29Å; D186-Q188 PolarHBondContact O-N 2.96Å; Q188-N190 VanDerWaalsContact C-N 3.3Å; Q188-N190 PolarHBondContact O-N 2.72Å; Q188-S191 WeakPolarHBondContact O-CB 3.14Å; Q188-S191 PolarHBondContact O-N 3.42Å; Q188-S191 VanDerWaalsContact O-N 3.11Å
189	K	84.3	Confident	79.6	Confident	124 Å²	124	41.4 Å²	41.4	54%	0.539	22%	0.222	S	C	.	.	H	α-helix	trans	-61.7	-38.2	174.3	-72.2	173.4	-172.3	163.1	0	112.4	I185 D186 S191	I185-K189 HydrophobicContact CG2-CD 4.32Å; I185-K189 WeakPolarHBondContact O-CG 3.37Å; I185-K189 PolarHBondContact O-N 2.92Å; D186-K189 PolarHBondContact O-N 3.32Å; D186-K189 IonicContact OD1-NZ 3.51Å; D186-K189 PolarHBondContact OD1-NZ 2.97Å; K189-S191 PolarHBondContact O-N 3.35Å
190	N	83.1	Confident	79.2	Confident	57 Å²	57	42 Å²	42	31%	0.305	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	7.1	177.7	-66.9	-27.4	0	0	0	113.2	S160 Q161 D186 Q188	S160-N190 WeakPolarHBondContact CA-O 3.28Å; Q161-N190 HydrophobicContact CB-CB 4.45Å; Q161-N190 PolarHBondContact N-O 3.1Å; Q161-N190 VanDerWaalsContact N-O 3.07Å; D186-N190 WeakPolarHBondContact O-CB 3.23Å; D186-N190 PolarHBondContact O-N 3.17Å; D186-N190 PolarHBondContact O-ND2 2.8Å; Q188-N190 VanDerWaalsContact C-N 3.3Å; Q188-N190 PolarHBondContact O-N 2.72Å
191	S	82.9	Confident	79.1	Confident	41 Å²	41	40.8 Å²	40.8	29%	0.287	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	137.7	179.8	-156.6	0	0	0	0	110.8	S158 R187 Q188 K189	S158-S191 VanDerWaalsContact CB-OG 3.23Å; S158-S191 WeakPolarHBondContact CB-OG 3.49Å; S158-S191 PolarHBondContact OG-OG 2.61Å; R187-S191 PolarHBondContact O-N 3.41Å; R187-S191 VanDerWaalsContact O-N 3.17Å; Q188-S191 WeakPolarHBondContact O-CB 3.14Å; Q188-S191 PolarHBondContact O-N 3.42Å; Q188-S191 VanDerWaalsContact O-N 3.11Å; K189-S191 PolarHBondContact O-N 3.35Å
192	M	83.1	Confident	78.3	Confident	22 Å²	22	47 Å²	47	11%	0.108	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	151	-177.2	-50	-176.4	-25.1	0	0	110.7	V159 I197 S200	V159-M192 PolarHBondContact N-O 2.79Å; V159-M192 PolarHBondContact O-N 2.85Å; M192-I197 HydrophobicContact CE-CG1 4.45Å; M192-S200 WeakPolarHBondContact SD-CB 3.4Å; M192-S200 PolarHBondContact SD-OG 3.48Å
193	G	76.3	Confident	77.7	Confident	33 Å²	33	49.4 Å²	49.4	34%	0.34	28%	0.283	S	S	.	.			trans	-67	152.2	166.8	0	0	0	0	0	111.2	S195 Q196 I197	G193-S195 VanDerWaalsContact C-N 3.29Å; G193-S195 PolarHBondContact O-N 3.39Å; G193-Q196 WeakPolarHBondContact O-CB 3.19Å; G193-Q196 PolarHBondContact O-N 3.23Å; G193-I197 PolarHBondContact O-N 3.41Å
194	Q	71.6	Confident	77.5	Confident	10 Å²	10	53 Å²	53	5%	0.047	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-62.3	-36.4	-177.7	-65.2	173	-0.3	0	0	112.9	Y154 V157 Q196 I197	Y154-Q194 PolarHBondContact OH-NE2 2.99Å; Y154-Q194 PolarHBondContact OH-OE1 3.29Å; V157-Q194 PolarHBondContact O-NE2 3.31Å; Q194-Q196 PolarHBondContact O-N 3.14Å; Q194-I197 HydrophobicContact CB-CD1 4.36Å; Q194-I197 WeakPolarHBondContact O-CB 3.28Å; Q194-I197 VanDerWaalsContact O-CG1 3.31Å; Q194-I197 WeakPolarHBondContact O-CG1 3.34Å; Q194-I197 PolarHBondContact O-N 3.11Å
195	S	66.2	Low	77.4	Confident	68 Å²	68	55.5 Å²	55.5	48%	0.476	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-64.2	-25.2	175.2	49.8	0	0	0	0	113.1	G193	G193-S195 VanDerWaalsContact C-N 3.29Å; G193-S195 PolarHBondContact O-N 3.39Å
196	Q	73.1	Confident	77.4	Confident	100 Å²	100	54.4 Å²	54.4	47%	0.467	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-90.9	-3.7	-178.6	-62.4	170.4	-8.1	0	0	112.6	G193 Q194 F198 D199 S200	G193-Q196 WeakPolarHBondContact O-CB 3.19Å; G193-Q196 PolarHBondContact O-N 3.23Å; Q194-Q196 PolarHBondContact O-N 3.14Å; Q196-F198 VanDerWaalsContact C-N 3.3Å; Q196-F198 PolarHBondContact O-N 3.21Å; Q196-D199 PolarHBondContact O-N 3.37Å; Q196-D199 VanDerWaalsContact O-N 3.17Å; Q196-S200 PolarHBondContact O-N 3.48Å; Q196-S200 PolarHBondContact O-OG 3.22Å
197	I	80.4	Confident	77.7	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-48.8	-175.8	-73.1	172.8	0	0	0	110.8	V159 M192 G193 Q194 L201 L224 L365	V159-I197 HydrophobicContact CB-CD1 4.4Å; V159-I197 HydrophobicContact CG2-CD1 4.11Å; M192-I197 HydrophobicContact CE-CG1 4.45Å; G193-I197 PolarHBondContact O-N 3.41Å; Q194-I197 HydrophobicContact CB-CD1 4.36Å; Q194-I197 WeakPolarHBondContact O-CB 3.28Å; Q194-I197 VanDerWaalsContact O-CG1 3.31Å; Q194-I197 WeakPolarHBondContact O-CG1 3.34Å; Q194-I197 PolarHBondContact O-N 3.11Å; I197-L201 HydrophobicContact CG2-CD1 4.22Å; I197-L201 WeakPolarHBondContact O-CD1 3.3Å; I197-L201 WeakPolarHBondContact O-CG 3.43Å; I197-L224 HydrophobicContact CD1-CD1 4.33Å; I197-L224 HydrophobicContact CD1-CD2 4.31Å; I197-L365 HydrophobicContact CG2-CD1 3.79Å
198	F	81.1	Confident	78	Confident	20 Å²	20	52.2 Å²	52.2	9%	0.088	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-21.1	-176.8	-64.1	-71.6	0	0	0	114.2	Q196 L201 L224 I233 F236 L288 T343 L345	Q196-F198 VanDerWaalsContact C-N 3.3Å; Q196-F198 PolarHBondContact O-N 3.21Å; F198-L201 HydrophobicContact CD1-CD1 4.21Å; F198-L224 HydrophobicContact CE2-CD2 4.39Å; F198-I233 HydrophobicContact CD2-CD1 4.11Å; F198-I233 HydrophobicContact CD2-CG2 3.85Å; F198-I233 HydrophobicContact CE2-CD1 4.15Å; F198-I233 HydrophobicContact CE2-CG2 4.48Å; F198-F236 HydrophobicContact CB-CE2 4.39Å; F198-F236 AromaticContact CD1-CE2 3.93Å; F198-F236 HydrophobicContact CD1-CE2 3.93Å; F198-F236 AromaticContact CD1-CZ 3.99Å; F198-F236 HydrophobicContact CD1-CZ 3.99Å; F198-F236 HydrophobicContact CD2-CE2 4.03Å; F198-F236 HydrophobicContact CE1-CE2 4.18Å; F198-F236 HydrophobicContact CE1-CZ 4.3Å; F198-F236 HydrophobicContact CE2-CE2 4.27Å; F198-F236 AromaticContact CG-CE2 3.85Å; F198-F236 HydrophobicContact CG-CE2 3.85Å; F198-F236 HydrophobicContact CG-CZ 4.29Å; F198-F236 HydrophobicContact CZ-CE2 4.34Å; F198-L288 HydrophobicContact CE1-CD1 3.93Å; F198-L288 HydrophobicContact CE1-CD2 4.35Å; F198-L288 HydrophobicContact CE2-CD2 4.07Å; F198-L288 HydrophobicContact CZ-CD1 3.92Å; F198-L288 HydrophobicContact CZ-CD2 3.63Å; F198-L288 HydrophobicContact CZ-CG 4.47Å; F198-T343 HydrophobicContact CD1-CG2 4.35Å; F198-T343 HydrophobicContact CE1-CG2 4.07Å; F198-L345 HydrophobicContact CZ-CD2 4.35Å
199	D	71.8	Confident	78.3	Confident	102 Å²	102	47.3 Å²	47.3	55%	0.545	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-45.3	179.5	-63.3	-16.9	0	0	0	110.6	Q196 L201 Q235	Q196-D199 PolarHBondContact O-N 3.37Å; Q196-D199 VanDerWaalsContact O-N 3.17Å; D199-L201 PolarHBondContact O-N 2.94Å; D199-Q235 PolarHBondContact OD1-NE2 3.46Å
200	S	63.2	Low	78.6	Confident	48 Å²	48	41.5 Å²	41.5	34%	0.336	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-10.5	179	-56.4	0	0	0	0	114	M192 Q196 N202	M192-S200 WeakPolarHBondContact SD-CB 3.4Å; M192-S200 PolarHBondContact SD-OG 3.48Å; Q196-S200 PolarHBondContact O-N 3.48Å; Q196-S200 PolarHBondContact O-OG 3.22Å; S200-N202 VanDerWaalsContact C-N 3.31Å; S200-N202 PolarHBondContact O-N 3.06Å
201	L	73.3	Confident	78.9	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.016	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-4.5	-178.2	-76.3	172.3	0	0	0	113.7	I197 F198 D199 G203 K204 N207 S363	I197-L201 HydrophobicContact CG2-CD1 4.22Å; I197-L201 WeakPolarHBondContact O-CD1 3.3Å; I197-L201 WeakPolarHBondContact O-CG 3.43Å; F198-L201 HydrophobicContact CD1-CD1 4.21Å; D199-L201 PolarHBondContact O-N 2.94Å; L201-G203 VanDerWaalsContact C-N 3.26Å; L201-G203 PolarHBondContact O-N 3.24Å; L201-G203 VanDerWaalsContact O-N 3.07Å; L201-K204 HydrophobicContact CB-CB 4.22Å; L201-K204 HydrophobicContact CD2-CB 4.41Å; L201-K204 HydrophobicContact CD2-CD 4.2Å; L201-K204 WeakPolarHBondContact O-CB 3.46Å; L201-K204 WeakPolarHBondContact O-CD 3.39Å; L201-K204 WeakPolarHBondContact O-CG 3.29Å; L201-K204 PolarHBondContact O-N 3.02Å; L201-N207 HydrophobicContact CD1-CB 4.37Å; L201-N207 WeakPolarHBondContact CD1-OD1 3.31Å; L201-N207 WeakPolarHBondContact CD2-OD1 3.39Å; L201-S363 WeakPolarHBondContact CD2-OG 3.18Å
202	N	65.8	Low	79.1	Confident	150 Å²	150	38.7 Å²	38.7	80%	0.802	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.4	43.8	170.7	-75.7	-17.6	0	0	0	114.5	S200 K204	S200-N202 VanDerWaalsContact C-N 3.31Å; S200-N202 PolarHBondContact O-N 3.06Å; N202-K204 VanDerWaalsContact C-N 3.34Å; N202-K204 PolarHBondContact O-N 3.41Å
203	G	67.6	Low	79.3	Confident	61 Å²	61	38 Å²	38	63%	0.629	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	80	7.4	179.4	0	0	0	0	0	115.7	L201 R205	L201-G203 VanDerWaalsContact C-N 3.26Å; L201-G203 PolarHBondContact O-N 3.24Å; L201-G203 VanDerWaalsContact O-N 3.07Å; G203-R205 WeakPolarHBondContact O-CG 3.12Å
204	K	78.2	Confident	79.9	Confident	82 Å²	82	37.2 Å²	37.2	36%	0.357	21%	0.214	S	C	.	.			trans	-65.9	128	167	-66.1	173.6	-178.8	-169.1	0	110.1	L201 N202 N207 D362	L201-K204 HydrophobicContact CB-CB 4.22Å; L201-K204 HydrophobicContact CD2-CB 4.41Å; L201-K204 HydrophobicContact CD2-CD 4.2Å; L201-K204 WeakPolarHBondContact O-CB 3.46Å; L201-K204 WeakPolarHBondContact O-CD 3.39Å; L201-K204 WeakPolarHBondContact O-CG 3.29Å; L201-K204 PolarHBondContact O-N 3.02Å; N202-K204 VanDerWaalsContact C-N 3.34Å; N202-K204 PolarHBondContact O-N 3.41Å; K204-N207 PolarHBondContact O-ND2 3.49Å; K204-D362 HydrophobicContact CB-CB 3.67Å; K204-D362 HydrophobicContact CD-CB 4.38Å; K204-D362 WeakPolarHBondContact CD-O 3.38Å; K204-D362 HydrophobicContact CG-CB 3.88Å
205	R	82.9	Confident	80.8	Confident	64 Å²	64	37.1 Å²	37.1	24%	0.242	21%	0.214	C	C	.	.			trans	-117.9	-5.3	-169.5	-67.6	177.3	-166.3	-122.7	-9.9	113.7	G203 K285 G341 T343 L344 D362	G203-R205 WeakPolarHBondContact O-CG 3.12Å; R205-K285 VanDerWaalsContact NH1-CB 3.27Å; R205-G341 PolarHBondContact NH1-O 2.89Å; R205-T343 CarbonylContact O-C 3.58Å; R205-T343 WeakPolarHBondContact O-CA 3.44Å; R205-L344 PolarHBondContact O-N 2.79Å; R205-D362 PolarHBondContact N-OD2 2.9Å
206	Y	87.7	Confident	82	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	103.3	172.5	-166.3	148.2	0	0	0	108.3	V208 R336 L344 L346 L357 R360 A361 D362 S363	Y206-V208 HydrophobicContact CD2-CG2 4.35Å; Y206-V208 HydrophobicContact CE2-CG2 4.07Å; Y206-R336 VanDerWaalsContact CB-NH2 3.32Å; Y206-L344 HydrophobicContact CD1-CD1 4.46Å; Y206-L346 HydrophobicContact CD2-CD1 4.05Å; Y206-L346 HydrophobicContact CE2-CD1 3.57Å; Y206-L346 HydrophobicContact CE2-CD2 4.04Å; Y206-L346 HydrophobicContact CE2-CG 4.41Å; Y206-L357 WeakPolarHBondContact OH-CD2 3.45Å; Y206-R360 HydrophobicContact CD1-CB 4.48Å; Y206-R360 HydrophobicContact CE1-CB 4Å; Y206-A361 HydrophobicContact CD2-CB 3.53Å; Y206-A361 HydrophobicContact CE2-CB 3.89Å; Y206-A361 HydrophobicContact CG-CB 4.11Å; Y206-A361 CarbonylContact O-C 3.49Å; Y206-D362 PolarHBondContact N-OD2 3.16Å; Y206-D362 WeakPolarHBondContact O-CA 3.26Å; Y206-D362 WeakPolarHBondContact O-CB 3.43Å; Y206-D362 PolarHBondContact O-N 3.03Å; Y206-S363 PolarHBondContact O-N 3.22Å; Y206-S363 VanDerWaalsContact O-N 3.17Å
207	N	90.1	Very high	82.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139.5	-174.7	-52.1	-65.5	0	0	0	109.8	L201 K204 L344 L345 L346 S363	L201-N207 HydrophobicContact CD1-CB 4.37Å; L201-N207 WeakPolarHBondContact CD1-OD1 3.31Å; L201-N207 WeakPolarHBondContact CD2-OD1 3.39Å; K204-N207 PolarHBondContact O-ND2 3.49Å; N207-L344 PolarHBondContact N-O 2.99Å; N207-L345 HydrophobicContact CB-CD1 4.04Å; N207-L345 CarbonylContact O-C 3.48Å; N207-L345 WeakPolarHBondContact O-CA 3.44Å; N207-L346 PolarHBondContact O-N 3.23Å; N207-S363 WeakPolarHBondContact CA-O 3.3Å; N207-S363 WeakPolarHBondContact OD1-CB 3.32Å
208	V	90.6	Very high	83.2	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.6	177.2	-177.7	0	0	0	0	108.9	Y206 F210 L346 T348 L357 A361 S363 F364 L365	Y206-V208 HydrophobicContact CD2-CG2 4.35Å; Y206-V208 HydrophobicContact CE2-CG2 4.07Å; V208-F210 HydrophobicContact CB-CE2 4.37Å; V208-F210 HydrophobicContact CB-CZ 4.23Å; V208-F210 HydrophobicContact CG1-CD1 4.12Å; V208-F210 HydrophobicContact CG1-CD2 4.43Å; V208-F210 HydrophobicContact CG1-CE1 3.56Å; V208-F210 HydrophobicContact CG1-CE2 3.94Å; V208-F210 HydrophobicContact CG1-CZ 3.46Å; V208-F210 VanDerWaalsContact CG1-CZ 3.46Å; V208-L346 CarbonylContact C-O 3.19Å; V208-L346 VanDerWaalsContact CA-O 3.32Å; V208-L346 WeakPolarHBondContact CA-O 3.34Å; V208-L346 HydrophobicContact CG2-CB 4.47Å; V208-T348 HydrophobicContact CG1-CG2 3.86Å; V208-L357 HydrophobicContact CG1-CD1 4.31Å; V208-L357 HydrophobicContact CG2-CB 4.25Å; V208-L357 HydrophobicContact CG2-CD1 4.42Å; V208-A361 HydrophobicContact CG2-CB 3.55Å; V208-S363 PolarHBondContact N-O 2.9Å; V208-F364 HydrophobicContact CB-CD1 4.11Å; V208-F364 HydrophobicContact CB-CE1 4.48Å; V208-F364 HydrophobicContact CG2-CD1 4.47Å; V208-F364 HydrophobicContact CG2-CE1 4.36Å; V208-L365 PolarHBondContact O-N 3.28Å
209	L	92.1	Very high	83.7	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	112.1	177.5	-176	66.4	0	0	0	110.1	V159 V220 L345 L346 A347 T348 L365 V367	V159-L209 HydrophobicContact CG1-CD1 4Å; L209-V220 HydrophobicContact CD2-CG1 4.45Å; L209-L345 HydrophobicContact CB-CD1 4.14Å; L209-L346 PolarHBondContact N-O 2.95Å; L209-A347 HydrophobicContact CB-CB 4.43Å; L209-A347 VanDerWaalsContact O-CA 3.31Å; L209-A347 WeakPolarHBondContact O-CA 3.45Å; L209-T348 PolarHBondContact O-N 2.96Å; L209-L365 CarbonylContact C-O 3.48Å; L209-L365 WeakPolarHBondContact CA-O 3.16Å; L209-L365 HydrophobicContact CD1-CB 3.72Å; L209-V367 HydrophobicContact CD1-CG2 3.62Å; L209-V367 HydrophobicContact CD2-CG2 3.96Å; L209-V367 HydrophobicContact CG-CG2 3.82Å
210	F	90.4	Very high	84.7	Confident	3 Å²	3	29 Å²	29	1%	0.013	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	155.7	178	-63.6	-64.2	0	0	0	112.5	L179 V208 T348 P350 A354 L358 F364 L365 E366 V367	L179-F210 HydrophobicContact CD1-CD2 3.87Å; L179-F210 HydrophobicContact CD1-CE1 4.32Å; L179-F210 HydrophobicContact CD1-CE2 3.58Å; L179-F210 HydrophobicContact CD1-CG 4.34Å; L179-F210 HydrophobicContact CD1-CZ 3.84Å; L179-F210 HydrophobicContact CD2-CD2 4.37Å; L179-F210 HydrophobicContact CD2-CE2 3.74Å; L179-F210 HydrophobicContact CD2-CZ 4.43Å; L179-F210 HydrophobicContact CG-CE2 4.27Å; V208-F210 HydrophobicContact CB-CE2 4.37Å; V208-F210 HydrophobicContact CB-CZ 4.23Å; V208-F210 HydrophobicContact CG1-CD1 4.12Å; V208-F210 HydrophobicContact CG1-CD2 4.43Å; V208-F210 HydrophobicContact CG1-CE1 3.56Å; V208-F210 HydrophobicContact CG1-CE2 3.94Å; V208-F210 HydrophobicContact CG1-CZ 3.46Å; V208-F210 VanDerWaalsContact CG1-CZ 3.46Å; F210-T348 WeakPolarHBondContact CA-O 3.46Å; F210-T348 HydrophobicContact CD1-CG2 3.67Å; F210-T348 HydrophobicContact CE1-CG2 3.49Å; F210-T348 VanDerWaalsContact CE1-CG2 3.49Å; F210-P350 HydrophobicContact CD1-CB 4.31Å; F210-A354 HydrophobicContact CE1-CB 3.68Å; F210-A354 HydrophobicContact CZ-CB 4.29Å; F210-L358 HydrophobicContact CE2-CD2 4.33Å; F210-L358 HydrophobicContact CZ-CD2 3.93Å; F210-F364 HydrophobicContact CD2-CB 4.49Å; F210-F364 HydrophobicContact CE2-CB 4Å; F210-F364 AromaticContact CE2-CD1 3.61Å; F210-F364 HydrophobicContact CE2-CD1 3.61Å; F210-F364 HydrophobicContact CE2-CG 4.22Å; F210-F364 HydrophobicContact CZ-CD1 4.03Å; F210-L365 PolarHBondContact N-O 2.87Å; F210-E366 HydrophobicContact CB-CB 4.49Å; F210-E366 WeakPolarHBondContact O-CA 3.26Å; F210-V367 PolarHBondContact O-N 3.18Å
211	G	88.9	Confident	86.1	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.01	16%	0.159	C	C	.	.			trans	172	144.5	169.1	0	0	0	0	0	110.1	K217 T348	G211-K217 WeakPolarHBondContact O-CE 3.45Å; G211-K217 PolarHBondContact O-NZ 3.36Å; G211-T348 PolarHBondContact N-O 3.07Å
212	N	87	Confident	86.9	Confident	38 Å²	38	28.8 Å²	28.8	20%	0.203	17%	0.167	C	C	.	.			trans	-64.2	174	174.6	-72.3	-9.2	0	0	0	111.7	G214 M215 K217 P350 E554	N212-G214 PolarHBondContact O-N 3.1Å; N212-M215 HydrophobicContact CB-CE 4.01Å; N212-M215 HydrophobicContact CB-CG 4.03Å; N212-M215 WeakPolarHBondContact O-CG 3.34Å; N212-M215 PolarHBondContact O-N 3.03Å; N212-K217 PolarHBondContact O-NZ 3.24Å; N212-P350 WeakPolarHBondContact OD1-CG 3.46Å; N212-E554 VanDerWaalsContact CB-OE1 3.27Å; N212-E554 WeakPolarHBondContact CB-OE1 3.35Å
213	A	87.3	Confident	88.1	Confident	8 Å²	8	23.6 Å²	23.6	7%	0.066	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	134.1	175.4	0	0	0	0	0	110.6	M215 N408 P513 E554	A213-M215 VanDerWaalsContact C-N 3.31Å; A213-M215 PolarHBondContact O-N 3.46Å; A213-N408 PolarHBondContact O-ND2 3.5Å; A213-P513 HydrophobicContact CB-CB 4.31Å; A213-P513 HydrophobicContact CB-CG 4.21Å; A213-E554 PolarHBondContact N-OE1 3Å
214	G	88.9	Confident	89.3	Confident	16 Å²	16	21.2 Å²	21.2	17%	0.165	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	-4.7	178.2	0	0	0	0	0	117	N212 G216 N408 A410	N212-G214 PolarHBondContact O-N 3.1Å; G214-G216 PolarHBondContact O-N 3.24Å; G214-N408 VanDerWaalsContact C-OD1 3.28Å; G214-N408 PolarHBondContact O-OD1 2.81Å; G214-N408 VanDerWaalsContact O-OD1 3.09Å; G214-A410 VanDerWaalsContact CA-CB 3.46Å; G214-A410 WeakPolarHBondContact O-CB 3.32Å; G214-A410 PolarHBondContact O-N 3.25Å
215	M	91	Very high	89.9	Confident	8 Å²	8	17.4 Å²	17.4	4%	0.039	9%	0.094	C	C	.	.	S	Bend	trans	-65.8	-5.7	179.8	-67.8	-58	166	0	0	115.3	N212 A213 V367 W407 N408	N212-M215 HydrophobicContact CB-CE 4.01Å; N212-M215 HydrophobicContact CB-CG 4.03Å; N212-M215 WeakPolarHBondContact O-CG 3.34Å; N212-M215 PolarHBondContact O-N 3.03Å; A213-M215 VanDerWaalsContact C-N 3.31Å; A213-M215 PolarHBondContact O-N 3.46Å; M215-V367 VanDerWaalsContact O-CG1 3.25Å; M215-V367 WeakPolarHBondContact O-CG1 3.46Å; M215-W407 HydrophobicContact CE-CE3 3.76Å; M215-W407 HydrophobicContact CE-CH2 3.46Å; M215-W407 VanDerWaalsContact CE-CH2 3.46Å; M215-W407 HydrophobicContact CE-CZ2 4.5Å; M215-W407 HydrophobicContact CE-CZ3 3.03Å; M215-W407 HydrophobicContact SD-CE3 4.49Å; M215-W407 HydrophobicContact SD-CH2 4.12Å; M215-W407 HydrophobicContact SD-CZ3 4.04Å; M215-N408 HydrophobicContact CE-CB 4.3Å; M215-N408 WeakPolarHBondContact CE-ND2 3.42Å
216	G	90.1	Very high	90.3	Very high	13 Å²	13	15.4 Å²	15.4	13%	0.134	9%	0.088	C	C	.	.			trans	88	19.1	177.1	0	0	0	0	0	115.6	G214 T218 T219 V220	G214-G216 PolarHBondContact O-N 3.24Å; G216-T218 VanDerWaalsContact C-N 3.35Å; G216-T218 PolarHBondContact O-N 3.23Å; G216-T219 WeakPolarHBondContact O-CA 3.38Å; G216-T219 WeakPolarHBondContact O-CB 3.23Å; G216-T219 PolarHBondContact O-N 2.84Å; G216-V220 WeakPolarHBondContact O-CG2 3.42Å; G216-V220 PolarHBondContact O-N 2.96Å
217	K	90.9	Very high	90.4	Very high	21 Å²	21	16 Å²	16	9%	0.091	9%	0.091	C	C	.	.	H	α-helix	trans	-47.6	-52.7	175.2	-63.6	-176.7	-63.8	-68.9	0	112.9	G211 N212 T219 V220 I221 A347 V367	G211-K217 WeakPolarHBondContact O-CE 3.45Å; G211-K217 PolarHBondContact O-NZ 3.36Å; N212-K217 PolarHBondContact O-NZ 3.24Å; K217-T219 VanDerWaalsContact C-N 3.33Å; K217-T219 PolarHBondContact O-N 3.19Å; K217-V220 PolarHBondContact O-N 3.37Å; K217-I221 WeakPolarHBondContact O-CG1 3.49Å; K217-I221 PolarHBondContact O-N 3.35Å; K217-A347 HydrophobicContact CB-CB 4.36Å; K217-A347 HydrophobicContact CD-CB 4.42Å; K217-V367 HydrophobicContact CG-CG2 4.11Å
218	T	89.4	Confident	90.5	Very high	48 Å²	48	16.1 Å²	16.1	29%	0.294	9%	0.092	S	C	.	.	H	α-helix	trans	-61.4	-39.2	177	-59.1	0	0	0	0	112.2	G216 I221 K222 D292	G216-T218 VanDerWaalsContact C-N 3.35Å; G216-T218 PolarHBondContact O-N 3.23Å; T218-I221 PolarHBondContact O-N 3Å; T218-K222 WeakPolarHBondContact O-CG 3.45Å; T218-K222 PolarHBondContact O-N 3.39Å; T218-D292 WeakPolarHBondContact CA-OD2 3.41Å; T218-D292 VanDerWaalsContact CB-OD2 3.22Å; T218-D292 WeakPolarHBondContact CB-OD2 3.33Å; T218-D292 WeakPolarHBondContact CG2-OD2 3.35Å; T218-D292 PolarHBondContact OG1-OD1 2.76Å; T218-D292 PolarHBondContact OG1-OD2 3.47Å
219	T	91.2	Very high	90.6	Very high	37 Å²	37	16.8 Å²	16.8	23%	0.227	10%	0.097	C	C	.	.	H	α-helix	trans	-63.7	-44.2	176.6	-44.9	0	0	0	0	111.5	M144 M150 Y154 G216 K217 K222 K223	M144-T219 HydrophobicContact CE-CG2 4.02Å; M150-T219 HydrophobicContact CE-CG2 3.77Å; M150-T219 HydrophobicContact SD-CG2 3.99Å; Y154-T219 HydrophobicContact CD2-CG2 3.81Å; Y154-T219 HydrophobicContact CE2-CG2 3.69Å; G216-T219 WeakPolarHBondContact O-CA 3.38Å; G216-T219 WeakPolarHBondContact O-CB 3.23Å; G216-T219 PolarHBondContact O-N 2.84Å; K217-T219 VanDerWaalsContact C-N 3.33Å; K217-T219 PolarHBondContact O-N 3.19Å; T219-K222 PolarHBondContact O-N 3.2Å; T219-K223 WeakPolarHBondContact O-CB 3.45Å; T219-K223 PolarHBondContact O-N 3.32Å
220	V	91.6	Very high	90.5	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-43.4	174.9	172.6	0	0	0	0	110.6	L209 G216 K217 K223 L224 V367	L209-V220 HydrophobicContact CD2-CG1 4.45Å; G216-V220 WeakPolarHBondContact O-CG2 3.42Å; G216-V220 PolarHBondContact O-N 2.96Å; K217-V220 PolarHBondContact O-N 3.37Å; V220-K223 PolarHBondContact O-N 3.3Å; V220-L224 HydrophobicContact CG1-CD1 4.36Å; V220-L224 WeakPolarHBondContact O-CG 3.44Å; V220-L224 PolarHBondContact O-N 3.48Å; V220-V367 HydrophobicContact CG2-CG1 4.28Å; V220-V367 HydrophobicContact CG2-CG2 4.47Å
221	I	92.2	Very high	90.5	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-60.4	-49.2	175.4	-74.2	164.7	0	0	0	111.1	K217 T218 K223 L224 C225 L241 V290 D292 A347	K217-I221 WeakPolarHBondContact O-CG1 3.49Å; K217-I221 PolarHBondContact O-N 3.35Å; T218-I221 PolarHBondContact O-N 3Å; I221-K223 VanDerWaalsContact C-N 3.25Å; I221-K223 PolarHBondContact O-N 2.89Å; I221-L224 WeakPolarHBondContact O-CB 3.34Å; I221-L224 PolarHBondContact O-N 3.18Å; I221-L224 VanDerWaalsContact O-N 3.14Å; I221-C225 PolarHBondContact O-N 3.1Å; I221-C225 PolarHBondContact O-SG 2.86Å; I221-L241 HydrophobicContact CG2-CD1 3.61Å; I221-L241 HydrophobicContact CG2-CD2 4.42Å; I221-V290 HydrophobicContact CB-CG1 4.45Å; I221-V290 HydrophobicContact CD1-CG1 3.88Å; I221-V290 HydrophobicContact CG1-CG1 3.91Å; I221-V290 HydrophobicContact CG2-CG1 3.69Å; I221-D292 HydrophobicContact CD1-CB 3.92Å; I221-A347 HydrophobicContact CD1-CB 3.53Å
222	K	91	Very high	90.5	Very high	46 Å²	46	29.3 Å²	29.3	20%	0.2	17%	0.167	C	C	.	.	H	α-helix	trans	-57.6	-40	176	-77	-178.7	171.1	-171.8	0	111.7	C141 D143 M150 T218 T219 C225 L226	C141-K222 HydrophobicContact CB-CB 4.27Å; D143-K222 PolarHBondContact O-NZ 3.28Å; M150-K222 HydrophobicContact CE-CB 3.84Å; M150-K222 HydrophobicContact CE-CD 4.47Å; T218-K222 WeakPolarHBondContact O-CG 3.45Å; T218-K222 PolarHBondContact O-N 3.39Å; T219-K222 PolarHBondContact O-N 3.2Å; K222-C225 WeakPolarHBondContact O-CB 3.37Å; K222-C225 PolarHBondContact O-N 3.12Å; K222-L226 WeakPolarHBondContact O-CG 3.24Å; K222-L226 PolarHBondContact O-N 3.45Å
223	K	91.6	Very high	90.5	Very high	40 Å²	40	27.7 Å²	27.7	17%	0.174	16%	0.158	C	C	.	.	H	α-helix	trans	-64.7	-43.3	175.7	-177.8	62.8	169	66.1	0	112.3	M150 Y154 T219 V220 I221 C225 L226 D227	M150-K223 HydrophobicContact CG-CD 4.4Å; Y154-K223 HydrophobicContact CD1-CD 4.03Å; Y154-K223 HydrophobicContact CD1-CG 4.34Å; Y154-K223 HydrophobicContact CE1-CB 4.13Å; Y154-K223 HydrophobicContact CE1-CD 3.7Å; Y154-K223 HydrophobicContact CE1-CG 3.53Å; Y154-K223 HydrophobicContact CE2-CB 4.37Å; T219-K223 WeakPolarHBondContact O-CB 3.45Å; T219-K223 PolarHBondContact O-N 3.32Å; V220-K223 PolarHBondContact O-N 3.3Å; I221-K223 VanDerWaalsContact C-N 3.25Å; I221-K223 PolarHBondContact O-N 2.89Å; K223-C225 VanDerWaalsContact C-N 3.26Å; K223-C225 PolarHBondContact O-N 3.14Å; K223-L226 WeakPolarHBondContact O-CB 3.05Å; K223-L226 PolarHBondContact O-N 3.42Å; K223-L226 VanDerWaalsContact O-N 3.13Å; K223-D227 IonicContact NZ-OD1 2.69Å; K223-D227 PolarHBondContact NZ-OD1 3.32Å; K223-D227 IonicContact NZ-OD2 3.06Å; K223-D227 PolarHBondContact NZ-OD2 3.02Å; K223-D227 PolarHBondContact O-N 3.21Å
224	L	91.7	Very high	90.6	Very high	11 Å²	11	31.1 Å²	31.1	6%	0.058	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-39	174.1	-72.5	171.7	0	0	0	111.9	I197 F198 V220 I221 D227 W228 I233 L345	I197-L224 HydrophobicContact CD1-CD1 4.33Å; I197-L224 HydrophobicContact CD1-CD2 4.31Å; F198-L224 HydrophobicContact CE2-CD2 4.39Å; V220-L224 HydrophobicContact CG1-CD1 4.36Å; V220-L224 WeakPolarHBondContact O-CG 3.44Å; V220-L224 PolarHBondContact O-N 3.48Å; I221-L224 WeakPolarHBondContact O-CB 3.34Å; I221-L224 PolarHBondContact O-N 3.18Å; I221-L224 VanDerWaalsContact O-N 3.14Å; L224-D227 PolarHBondContact O-N 3.31Å; L224-W228 PolarHBondContact O-N 3.47Å; L224-I233 HydrophobicContact CD2-CD1 3.96Å; L224-L345 HydrophobicContact CD1-CD2 3.96Å
225	C	91.5	Very high	90.6	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.014	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-41.5	174.3	-65.4	0	0	0	0	112.2	M137 I221 K222 K223 S229	M137-C225 HydrophobicContact CE-CB 3.39Å; M137-C225 WeakPolarHBondContact CE-SG 3.33Å; M137-C225 HydrophobicContact CG-CB 3.81Å; M137-C225 HydrophobicContact SD-CB 3.59Å; M137-C225 VanDerWaalsContact SD-CB 3.59Å; I221-C225 PolarHBondContact O-N 3.1Å; I221-C225 PolarHBondContact O-SG 2.86Å; K222-C225 WeakPolarHBondContact O-CB 3.37Å; K222-C225 PolarHBondContact O-N 3.12Å; K223-C225 VanDerWaalsContact C-N 3.26Å; K223-C225 PolarHBondContact O-N 3.14Å; C225-S229 PolarHBondContact O-N 3.36Å; C225-S229 VanDerWaalsContact O-N 3.08Å
226	L	91.1	Very high	90.6	Very high	22 Å²	22	33.4 Å²	33.4	12%	0.115	19%	0.186	C	C	.	.	H	α-helix	trans	-63.4	-44.8	172.7	-71	175.1	0	0	0	111.8	S138 C141 M150 K222 K223 W228 S229 I230	S138-L226 WeakPolarHBondContact O-CD2 3.36Å; C141-L226 HydrophobicContact CB-CD1 4.25Å; C141-L226 HydrophobicContact CB-CD2 3.54Å; C141-L226 HydrophobicContact CB-CG 3.56Å; M150-L226 HydrophobicContact CB-CD1 3.97Å; M150-L226 HydrophobicContact CG-CD1 3.55Å; K222-L226 WeakPolarHBondContact O-CG 3.24Å; K222-L226 PolarHBondContact O-N 3.45Å; K223-L226 WeakPolarHBondContact O-CB 3.05Å; K223-L226 PolarHBondContact O-N 3.42Å; K223-L226 VanDerWaalsContact O-N 3.13Å; L226-W228 VanDerWaalsContact C-N 3.3Å; L226-W228 PolarHBondContact O-N 3.44Å; L226-S229 WeakPolarHBondContact O-CA 3.3Å; L226-S229 WeakPolarHBondContact O-CB 3.45Å; L226-S229 PolarHBondContact O-N 3.14Å; L226-S229 PolarHBondContact O-OG 3.27Å; L226-I230 PolarHBondContact O-N 2.93Å
227	D	90.6	Very high	90.7	Very high	16 Å²	16	34.2 Å²	34.2	9%	0.086	19%	0.187	C	C	.	.	H	α-helix	trans	-62	-39.9	179.9	-72.5	-19.5	0	0	0	111.7	K223 L224 S229 I230 D231 C232 I233	K223-D227 IonicContact NZ-OD1 2.69Å; K223-D227 PolarHBondContact NZ-OD1 3.32Å; K223-D227 IonicContact NZ-OD2 3.06Å; K223-D227 PolarHBondContact NZ-OD2 3.02Å; K223-D227 PolarHBondContact O-N 3.21Å; L224-D227 PolarHBondContact O-N 3.31Å; D227-S229 VanDerWaalsContact C-N 3.34Å; D227-S229 PolarHBondContact O-N 2.92Å; D227-I230 CarbonylContact O-C 3.2Å; D227-I230 VanDerWaalsContact O-CG1 3.31Å; D227-I230 WeakPolarHBondContact O-CG1 3.05Å; D227-I230 PolarHBondContact O-N 3.22Å; D227-D231 PolarHBondContact O-N 3.41Å; D227-C232 HydrophobicContact CB-CB 4Å; D227-C232 WeakPolarHBondContact O-CB 3.3Å; D227-C232 PolarHBondContact O-N 3.27Å; D227-I233 HydrophobicContact CB-CD1 4.32Å
228	W	92.2	Very high	90.8	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.015	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-38	171.1	174.3	76.5	0	0	0	112.8	I130 L133 K134 M137 L224 L226 I230 D231 F236 D237 V239	I130-W228 HydrophobicContact CG2-CZ2 4.48Å; L133-W228 HydrophobicContact CB-CH2 4.35Å; L133-W228 HydrophobicContact CD2-CH2 3.76Å; L133-W228 HydrophobicContact CD2-CZ3 4.38Å; L133-W228 HydrophobicContact CG-CH2 3.81Å; L133-W228 HydrophobicContact CG-CZ3 4.07Å; K134-W228 HydrophobicContact CB-CZ3 4.35Å; K134-W228 HydrophobicContact CG-CE3 4.11Å; K134-W228 HydrophobicContact CG-CH2 3.5Å; K134-W228 VanDerWaalsContact CG-CH2 3.5Å; K134-W228 HydrophobicContact CG-CZ2 3.96Å; K134-W228 HydrophobicContact CG-CZ3 3.59Å; M137-W228 HydrophobicContact SD-CE3 3.44Å; M137-W228 HydrophobicContact SD-CZ3 3.6Å; L224-W228 PolarHBondContact O-N 3.47Å; L226-W228 VanDerWaalsContact C-N 3.3Å; L226-W228 PolarHBondContact O-N 3.44Å; W228-I230 PolarHBondContact O-N 3.48Å; W228-D231 PolarHBondContact O-N 3.16Å; W228-D231 VanDerWaalsContact O-N 3.08Å; W228-F236 PolarHBondContact NE1-O 3.44Å; W228-D237 WeakPolarHBondContact CZ2-O 3.24Å; W228-V239 HydrophobicContact CB-CG2 4.16Å; W228-V239 HydrophobicContact CD2-CB 3.96Å; W228-V239 HydrophobicContact CD2-CG2 3.41Å; W228-V239 VanDerWaalsContact CD2-CG2 3.41Å; W228-V239 HydrophobicContact CE3-CB 4.1Å; W228-V239 HydrophobicContact CE3-CG2 4.06Å; W228-V239 HydrophobicContact CG-CB 4.37Å; W228-V239 HydrophobicContact CG-CG2 3.41Å; W228-V239 VanDerWaalsContact CG-CG2 3.41Å; W228-V239 HydrophobicContact CZ2-CG2 4.26Å; W228-V239 HydrophobicContact CZ3-CB 4.44Å
229	S	91.7	Very high	91	Very high	14 Å²	14	31.4 Å²	31.4	10%	0.098	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-23.9	179.3	78.8	0	0	0	0	114	K134 C225 L226 D227	K134-S229 WeakPolarHBondContact O-CB 3.43Å; C225-S229 PolarHBondContact O-N 3.36Å; C225-S229 VanDerWaalsContact O-N 3.08Å; L226-S229 WeakPolarHBondContact O-CA 3.3Å; L226-S229 WeakPolarHBondContact O-CB 3.45Å; L226-S229 PolarHBondContact O-N 3.14Å; L226-S229 PolarHBondContact O-OG 3.27Å; D227-S229 VanDerWaalsContact C-N 3.34Å; D227-S229 PolarHBondContact O-N 2.92Å
230	I	91.1	Very high	91	Very high	108 Å²	108	29.7 Å²	29.7	55%	0.554	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.3	20.7	176	63.9	169.3	0	0	0	112.9	L226 D227 W228 C232	L226-I230 PolarHBondContact O-N 2.93Å; D227-I230 CarbonylContact O-C 3.2Å; D227-I230 VanDerWaalsContact O-CG1 3.31Å; D227-I230 WeakPolarHBondContact O-CG1 3.05Å; D227-I230 PolarHBondContact O-N 3.22Å; W228-I230 PolarHBondContact O-N 3.48Å; I230-C232 VanDerWaalsContact C-N 3.32Å; I230-C232 PolarHBondContact O-N 2.9Å
231	D	89.3	Confident	91	Very high	92 Å²	92	30.2 Å²	30.2	49%	0.492	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	22.4	173.3	-72.1	-66.4	0	0	0	116.4	K134 D227 W228 I233	K134-D231 IonicContact NZ-OD1 2.85Å; K134-D231 PolarHBondContact NZ-OD1 3.01Å; K134-D231 IonicContact NZ-OD2 2.65Å; K134-D231 PolarHBondContact NZ-OD2 3.08Å; D227-D231 PolarHBondContact O-N 3.41Å; W228-D231 PolarHBondContact O-N 3.16Å; W228-D231 VanDerWaalsContact O-N 3.08Å; D231-I233 VanDerWaalsContact C-N 3.27Å; D231-I233 PolarHBondContact O-N 3.31Å
232	C	88.4	Confident	90.7	Very high	68 Å²	68	30.1 Å²	30.1	46%	0.459	16%	0.163	S	C	.	.	S	Bend	trans	-74.7	-14.9	173.7	-67.7	0	0	0	0	113.8	D227 I230 P234	D227-C232 HydrophobicContact CB-CB 4Å; D227-C232 WeakPolarHBondContact O-CB 3.3Å; D227-C232 PolarHBondContact O-N 3.27Å; I230-C232 VanDerWaalsContact C-N 3.32Å; I230-C232 PolarHBondContact O-N 2.9Å; C232-P234 VanDerWaalsContact C-CD 3.48Å
233	I	88.3	Confident	90.2	Very high	5 Å²	5	29 Å²	29	3%	0.026	16%	0.159	C	C	.	.	S	Bend	trans	-127.6	67.2	178.9	-47.5	175	0	0	0	109	F198 L224 D227 D231 Q235 F236	F198-I233 HydrophobicContact CD2-CD1 4.11Å; F198-I233 HydrophobicContact CD2-CG2 3.85Å; F198-I233 HydrophobicContact CE2-CD1 4.15Å; F198-I233 HydrophobicContact CE2-CG2 4.48Å; L224-I233 HydrophobicContact CD2-CD1 3.96Å; D227-I233 HydrophobicContact CB-CD1 4.32Å; D231-I233 VanDerWaalsContact C-N 3.27Å; D231-I233 PolarHBondContact O-N 3.31Å; I233-Q235 VanDerWaalsContact CA-OE1 3.29Å; I233-Q235 HydrophobicContact CG2-CG 4.08Å; I233-Q235 PolarHBondContact O-N 3.02Å; I233-F236 HydrophobicContact CG2-CD2 3.65Å; I233-F236 HydrophobicContact CG2-CE2 3.82Å
234	P	88.2	Confident	89.5	Confident	80 Å²	80	27.1 Å²	27.1	52%	0.519	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-4.9	-168.1	32.3	-38	0	0	0	114.4	C232 F236 R286	C232-P234 VanDerWaalsContact C-CD 3.48Å; P234-F236 PolarHBondContact O-N 2.84Å; P234-R286 PolarHBondContact O-NH2 3.32Å
235	Q	88.9	Confident	88.8	Confident	57 Å²	57	29.1 Å²	29.1	27%	0.266	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.6	175.7	61	-92.5	55.8	0	0	113.5	D199 I233 R286	D199-Q235 PolarHBondContact OD1-NE2 3.46Å; I233-Q235 VanDerWaalsContact CA-OE1 3.29Å; I233-Q235 HydrophobicContact CG2-CG 4.08Å; I233-Q235 PolarHBondContact O-N 3.02Å; Q235-R286 PolarHBondContact O-NH1 2.62Å
236	F	92.3	Very high	87.9	Confident	14 Å²	14	30.4 Å²	30.4	6%	0.061	17%	0.165	C	C	.	.			trans	-116.3	130.1	179.3	-54.7	-62.1	0	0	0	112.2	F198 W228 I233 P234 V239 R286 L288 T343	F198-F236 HydrophobicContact CB-CE2 4.39Å; F198-F236 AromaticContact CD1-CE2 3.93Å; F198-F236 HydrophobicContact CD1-CE2 3.93Å; F198-F236 AromaticContact CD1-CZ 3.99Å; F198-F236 HydrophobicContact CD1-CZ 3.99Å; F198-F236 HydrophobicContact CD2-CE2 4.03Å; F198-F236 HydrophobicContact CE1-CE2 4.18Å; F198-F236 HydrophobicContact CE1-CZ 4.3Å; F198-F236 HydrophobicContact CE2-CE2 4.27Å; F198-F236 AromaticContact CG-CE2 3.85Å; F198-F236 HydrophobicContact CG-CE2 3.85Å; F198-F236 HydrophobicContact CG-CZ 4.29Å; F198-F236 HydrophobicContact CZ-CE2 4.34Å; W228-F236 PolarHBondContact NE1-O 3.44Å; I233-F236 HydrophobicContact CG2-CD2 3.65Å; I233-F236 HydrophobicContact CG2-CE2 3.82Å; P234-F236 PolarHBondContact O-N 2.84Å; F236-V239 HydrophobicContact CB-CG2 4.37Å; F236-R286 CarbonylContact C-O 3.59Å; F236-R286 VanDerWaalsContact CA-O 3.32Å; F236-R286 WeakPolarHBondContact CA-O 3.12Å; F236-L288 HydrophobicContact CB-CB 4.4Å; F236-L288 HydrophobicContact CD1-CB 3.89Å; F236-L288 HydrophobicContact CD2-CB 4.01Å; F236-L288 HydrophobicContact CD2-CD2 4.05Å; F236-L288 HydrophobicContact CE1-CB 4.14Å; F236-L288 HydrophobicContact CE2-CB 4.25Å; F236-L288 HydrophobicContact CE2-CD2 4.06Å; F236-L288 HydrophobicContact CG-CB 3.83Å; F236-L288 HydrophobicContact CZ-CB 4.31Å; F236-T343 HydrophobicContact CE1-CG2 4.41Å; F236-T343 WeakPolarHBondContact CE1-OG1 3.21Å; F236-T343 HydrophobicContact CZ-CG2 4.07Å
237	D	92.1	Very high	87.1	Confident	30 Å²	30	29.6 Å²	29.6	16%	0.16	16%	0.161	C	C	.	.	S	Bend	trans	-86.6	-28.8	171.5	-60.9	-26.4	0	0	0	111.9	I130 W228 R286	I130-D237 HydrophobicContact CD1-CB 4.25Å; W228-D237 WeakPolarHBondContact CZ2-O 3.24Å; D237-R286 HydrophobicContact CB-CB 4.27Å; D237-R286 PolarHBondContact N-O 3.08Å; D237-R286 IonicContact OD1-CZ 3.84Å; D237-R286 VanDerWaalsContact OD1-CZ 3.23Å; D237-R286 IonicContact OD1-NE 3.5Å; D237-R286 PolarHBondContact OD1-NE 3.5Å; D237-R286 IonicContact OD1-NH2 3.97Å; D237-R286 PolarHBondContact OD1-NH2 3.49Å; D237-R286 WeakPolarHBondContact OD2-CB 3.43Å; D237-R286 WeakPolarHBondContact OD2-CD 3.24Å; D237-R286 IonicContact OD2-CZ 2.97Å; D237-R286 IonicContact OD2-NE 3.95Å; D237-R286 PolarHBondContact OD2-NE 2.86Å
238	F	92.8	Very high	86	Confident	6 Å²	6	31.1 Å²	31.1	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	130.8	-178.4	-59.3	-83.1	0	0	0	111.1	V126 Y129 I130 F240 V276 I280 R286 V287 L288	V126-F238 HydrophobicContact CG1-CE1 4.32Å; V126-F238 HydrophobicContact CG1-CZ 3.67Å; Y129-F238 HydrophobicContact CD1-CE1 4.19Å; Y129-F238 HydrophobicContact CE1-CE1 4.44Å; I130-F238 HydrophobicContact CD1-CE1 4.08Å; I130-F238 HydrophobicContact CD1-CE2 4.44Å; I130-F238 HydrophobicContact CD1-CZ 3.92Å; I130-F238 HydrophobicContact CG1-CD1 4.14Å; I130-F238 HydrophobicContact CG1-CE1 3.63Å; I130-F238 HydrophobicContact CG1-CZ 4.01Å; F238-F240 HydrophobicContact CB-CD2 4.38Å; F238-F240 HydrophobicContact CB-CE2 3.62Å; F238-F240 HydrophobicContact CB-CZ 3.93Å; F238-F240 HydrophobicContact CD1-CZ 4.11Å; F238-F240 HydrophobicContact CG-CE2 4.31Å; F238-F240 HydrophobicContact CG-CZ 4.28Å; F238-V276 HydrophobicContact CE1-CG1 3.93Å; F238-V276 HydrophobicContact CZ-CG1 4.35Å; F238-I280 HydrophobicContact CD1-CG1 4.33Å; F238-I280 HydrophobicContact CD2-CG1 3.93Å; F238-I280 HydrophobicContact CE1-CG1 4.3Å; F238-I280 HydrophobicContact CE2-CG1 3.9Å; F238-I280 HydrophobicContact CG-CG1 4.14Å; F238-I280 HydrophobicContact CZ-CG1 4.08Å; F238-R286 PolarHBondContact N-O 2.91Å; F238-V287 HydrophobicContact CB-CG1 4.42Å; F238-V287 HydrophobicContact CB-CG2 4.37Å; F238-V287 HydrophobicContact CD2-CG2 4.17Å; F238-L288 PolarHBondContact O-N 3.39Å
239	V	93.3	Very high	84.7	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.024	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119	171.2	-177.8	0	0	0	0	109.3	M137 W228 F236 L288 V290	M137-V239 HydrophobicContact CE-CB 4.29Å; M137-V239 HydrophobicContact CE-CG1 3.83Å; W228-V239 HydrophobicContact CB-CG2 4.16Å; W228-V239 HydrophobicContact CD2-CB 3.96Å; W228-V239 HydrophobicContact CD2-CG2 3.41Å; W228-V239 VanDerWaalsContact CD2-CG2 3.41Å; W228-V239 HydrophobicContact CE3-CB 4.1Å; W228-V239 HydrophobicContact CE3-CG2 4.06Å; W228-V239 HydrophobicContact CG-CB 4.37Å; W228-V239 HydrophobicContact CG-CG2 3.41Å; W228-V239 VanDerWaalsContact CG-CG2 3.41Å; W228-V239 HydrophobicContact CZ2-CG2 4.26Å; W228-V239 HydrophobicContact CZ3-CB 4.44Å; F236-V239 HydrophobicContact CB-CG2 4.37Å; V239-L288 WeakPolarHBondContact CA-O 3.27Å; V239-L288 HydrophobicContact CG1-CD2 4.09Å; V239-L288 HydrophobicContact CG1-CG 4.36Å; V239-L288 HydrophobicContact CG2-CB 4.18Å; V239-L288 HydrophobicContact CG2-CD2 4.15Å; V239-V290 HydrophobicContact CG1-CG2 4.41Å
240	F	92.1	Very high	83.3	Confident	1 Å²	1	33.2 Å²	33.2	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	119.2	177.3	-60.8	-70.5	0	0	0	110.3	F238 L260 L261 I280 V287 L288 I289 V290	F238-F240 HydrophobicContact CB-CD2 4.38Å; F238-F240 HydrophobicContact CB-CE2 3.62Å; F238-F240 HydrophobicContact CB-CZ 3.93Å; F238-F240 HydrophobicContact CD1-CZ 4.11Å; F238-F240 HydrophobicContact CG-CE2 4.31Å; F238-F240 HydrophobicContact CG-CZ 4.28Å; F240-L260 HydrophobicContact CB-CD2 4.12Å; F240-L260 HydrophobicContact CD1-CB 4.13Å; F240-L260 HydrophobicContact CD1-CD2 4.48Å; F240-L260 WeakPolarHBondContact CD1-O 3.43Å; F240-L260 HydrophobicContact CD2-CB 4.49Å; F240-L260 HydrophobicContact CD2-CD2 3.91Å; F240-L260 HydrophobicContact CE1-CB 4.06Å; F240-L260 HydrophobicContact CE2-CB 4.4Å; F240-L260 HydrophobicContact CE2-CD1 4.32Å; F240-L260 HydrophobicContact CE2-CD2 4.48Å; F240-L260 HydrophobicContact CG-CB 4.35Å; F240-L260 HydrophobicContact CG-CD2 3.9Å; F240-L260 HydrophobicContact CZ-CB 4.2Å; F240-L261 HydrophobicContact CE1-CD2 4.07Å; F240-L261 HydrophobicContact CZ-CD2 4.2Å; F240-I280 HydrophobicContact CE2-CD1 3.95Å; F240-I280 HydrophobicContact CE2-CG1 4.47Å; F240-I280 HydrophobicContact CZ-CD1 3.58Å; F240-I280 HydrophobicContact CZ-CG1 4.43Å; F240-V287 HydrophobicContact CD2-CG1 3.93Å; F240-V287 HydrophobicContact CE2-CG1 3.93Å; F240-L288 PolarHBondContact N-O 2.95Å; F240-I289 HydrophobicContact CD2-CG1 4.49Å; F240-V290 PolarHBondContact O-N 3.11Å
241	L	90.2	Very high	81.9	Confident	12 Å²	12	36 Å²	36	6%	0.063	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.4	171.2	-177.5	64.4	0	0	0	110.2	I221 S264 S265 F266 V290 D292	I221-L241 HydrophobicContact CG2-CD1 3.61Å; I221-L241 HydrophobicContact CG2-CD2 4.42Å; L241-S264 WeakPolarHBondContact O-CA 3.29Å; L241-S264 WeakPolarHBondContact O-CB 3.42Å; L241-S265 PolarHBondContact O-N 3.07Å; L241-F266 HydrophobicContact CB-CD2 3.96Å; L241-F266 HydrophobicContact CB-CE2 3.89Å; L241-F266 HydrophobicContact CD2-CD2 4.11Å; L241-F266 HydrophobicContact CD2-CE2 3.24Å; L241-F266 HydrophobicContact CD2-CZ 3.52Å; L241-F266 HydrophobicContact CG-CE2 4.18Å; L241-V290 HydrophobicContact CD1-CB 3.84Å; L241-V290 HydrophobicContact CD1-CG1 3.77Å; L241-D292 HydrophobicContact CD1-CB 4.15Å
242	L	87.1	Confident	80.4	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	103.3	177.7	-64.6	-178.1	0	0	0	108.8	G244 L247 L259 I289 V290 F291 D292	L242-G244 PolarHBondContact O-N 3.33Å; L242-L247 HydrophobicContact CB-CD1 3.97Å; L242-L259 HydrophobicContact CD1-CD2 4.48Å; L242-L259 HydrophobicContact CD2-CD1 4.31Å; L242-L259 HydrophobicContact CD2-CG 4.36Å; L242-I289 HydrophobicContact CD1-CG2 3.67Å; L242-I289 HydrophobicContact CG-CG2 4.27Å; L242-V290 PolarHBondContact N-O 2.91Å; L242-F291 HydrophobicContact CB-CD1 3.64Å; L242-F291 HydrophobicContact CB-CE1 3.89Å; L242-F291 HydrophobicContact CD1-CD1 3.92Å; L242-F291 HydrophobicContact CD1-CE1 3.25Å; L242-F291 HydrophobicContact CD1-CZ 3.83Å; L242-F291 HydrophobicContact CG-CD1 4.37Å; L242-F291 HydrophobicContact CG-CE1 4.16Å; L242-F291 WeakPolarHBondContact O-CA 3.41Å; L242-D292 PolarHBondContact O-N 3.04Å; L242-D292 VanDerWaalsContact O-N 3.08Å
243	D	81.1	Confident	79.1	Confident	21 Å²	21	33 Å²	33	11%	0.112	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115.3	178.5	-178.6	-15.2	0	0	0	110.5	K245 Q246 L247 S265 Q495	D243-K245 PolarHBondContact O-N 2.86Å; D243-K245 VanDerWaalsContact OD1-CB 3.28Å; D243-K245 WeakPolarHBondContact OD1-CB 3.48Å; D243-K245 PolarHBondContact OD1-N 3.34Å; D243-Q246 HydrophobicContact CB-CB 4.14Å; D243-Q246 HydrophobicContact CB-CG 3.96Å; D243-Q246 PolarHBondContact O-N 3.46Å; D243-Q246 VanDerWaalsContact O-N 3.16Å; D243-L247 WeakPolarHBondContact O-CG 3.24Å; D243-L247 PolarHBondContact O-N 3.36Å; D243-S265 WeakPolarHBondContact CB-OG 3.48Å; D243-Q495 PolarHBondContact OD2-NE2 2.87Å
244	G	76.1	Confident	77.9	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-31.4	179.8	0	0	0	0	0	113.4	L242 A248 D292 L297	L242-G244 PolarHBondContact O-N 3.33Å; G244-A248 WeakPolarHBondContact O-CB 3.48Å; G244-A248 PolarHBondContact O-N 3Å; G244-D292 WeakPolarHBondContact CA-O 3.42Å; G244-D292 PolarHBondContact N-O 3.03Å; G244-L297 WeakPolarHBondContact O-CD2 3.34Å
245	K	76.2	Confident	77.4	Confident	54 Å²	54	36.4 Å²	36.4	24%	0.235	20%	0.195	C	C	.	.	H	α-helix	trans	-69.7	-42.2	177.4	-57.2	-178.5	-168.6	-167.5	0	111	D243 L249 E296 S470 V471 L509	D243-K245 PolarHBondContact O-N 2.86Å; D243-K245 VanDerWaalsContact OD1-CB 3.28Å; D243-K245 WeakPolarHBondContact OD1-CB 3.48Å; D243-K245 PolarHBondContact OD1-N 3.34Å; K245-L249 WeakPolarHBondContact O-CG 3.36Å; K245-E296 HydrophobicContact CG-CG 3.99Å; K245-S470 WeakPolarHBondContact CD-OG 3.41Å; K245-S470 WeakPolarHBondContact CE-OG 3.47Å; K245-S470 PolarHBondContact NZ-OG 3.47Å; K245-V471 HydrophobicContact CB-CG2 3.93Å; K245-V471 HydrophobicContact CD-CG2 4.49Å; K245-V471 HydrophobicContact CG-CG2 4.21Å; K245-L509 HydrophobicContact CB-CD2 4.31Å; K245-L509 HydrophobicContact CD-CD1 4.25Å; K245-L509 HydrophobicContact CD-CD2 3.94Å
246	Q	73.1	Confident	77.1	Confident	28 Å²	28	34 Å²	34	13%	0.131	18%	0.184	C	C	.	.	H	α-helix	trans	-66.9	-44.9	175.1	-66.2	-178.2	-0.7	0	0	111	D243 A248 L249 T250 S265	D243-Q246 HydrophobicContact CB-CB 4.14Å; D243-Q246 HydrophobicContact CB-CG 3.96Å; D243-Q246 PolarHBondContact O-N 3.46Å; D243-Q246 VanDerWaalsContact O-N 3.16Å; Q246-A248 VanDerWaalsContact C-N 3.32Å; Q246-A248 PolarHBondContact O-N 3.47Å; Q246-L249 CarbonylContact O-C 3.52Å; Q246-L249 PolarHBondContact O-N 3.13Å; Q246-T250 PolarHBondContact O-N 3.39Å; Q246-T250 PolarHBondContact O-OG1 2.96Å; Q246-S265 PolarHBondContact OE1-OG 3.2Å
247	L	73.3	Confident	76.8	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-34.5	-178.5	-72.1	-178.4	0	0	0	113.4	L242 D243 L249 T250 L259 L297 V326	L242-L247 HydrophobicContact CB-CD1 3.97Å; D243-L247 WeakPolarHBondContact O-CG 3.24Å; D243-L247 PolarHBondContact O-N 3.36Å; L247-L249 PolarHBondContact O-N 2.86Å; L247-T250 VanDerWaalsContact CA-OG1 3.27Å; L247-T250 WeakPolarHBondContact CA-OG1 3.37Å; L247-T250 PolarHBondContact O-OG1 3.46Å; L247-L259 HydrophobicContact CD2-CD1 3.81Å; L247-L297 HydrophobicContact CB-CD2 4.21Å; L247-V326 HydrophobicContact CB-CG1 4.34Å; L247-V326 HydrophobicContact CD2-CG1 4Å
248	A	68.8	Low	76.3	Confident	48 Å²	48	35.4 Å²	35.4	40%	0.397	19%	0.192	S	C	.	.	H	α-helix	trans	-62.8	-24.3	174	0	0	0	0	0	112.7	G244 Q246 L297	G244-A248 WeakPolarHBondContact O-CB 3.48Å; G244-A248 PolarHBondContact O-N 3Å; Q246-A248 VanDerWaalsContact C-N 3.32Å; Q246-A248 PolarHBondContact O-N 3.47Å; A248-L297 HydrophobicContact CB-CD2 4.3Å
249	L	64.5	Low	75.9	Confident	29 Å²	29	35.2 Å²	35.2	15%	0.152	19%	0.191	C	C	.	.	H	α-helix	trans	-103.8	-13.1	-175.9	-63.1	177.6	0	0	0	113.7	K245 Q246 L247 V471 K474 I507	K245-L249 WeakPolarHBondContact O-CG 3.36Å; Q246-L249 CarbonylContact O-C 3.52Å; Q246-L249 PolarHBondContact O-N 3.13Å; L247-L249 PolarHBondContact O-N 2.86Å; L249-V471 HydrophobicContact CD1-CG1 3.5Å; L249-V471 HydrophobicContact CD2-CG1 4.02Å; L249-V471 HydrophobicContact CG-CG1 4.15Å; L249-K474 HydrophobicContact CD2-CD 4.04Å; L249-K474 VanDerWaalsContact CD2-CE 3.48Å; L249-K474 HydrophobicContact CD2-CG 3.97Å; L249-K474 PolarHBondContact O-NZ 3.25Å; L249-I507 HydrophobicContact CB-CD1 4.29Å; L249-I507 HydrophobicContact CD1-CB 4.21Å; L249-I507 HydrophobicContact CD1-CD1 3.39Å; L249-I507 HydrophobicContact CD1-CG1 3.7Å; L249-I507 HydrophobicContact CD1-CG2 3.43Å; L249-I507 VanDerWaalsContact CD1-CG2 3.43Å
250	T	63.3	Low	75.5	Confident	34 Å²	34	35 Å²	35	21%	0.209	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-70.7	142.1	178.4	27.1	0	0	0	0	113.2	Q246 L247	Q246-T250 PolarHBondContact O-N 3.39Å; Q246-T250 PolarHBondContact O-OG1 2.96Å; L247-T250 VanDerWaalsContact CA-OG1 3.27Å; L247-T250 WeakPolarHBondContact CA-OG1 3.37Å; L247-T250 PolarHBondContact O-OG1 3.46Å
251	E	59.8	Low	75.1	Confident	165 Å²	165	35.2 Å²	35.2	77%	0.771	19%	0.191	S	C	*	.	P	Polyproline II helix	trans	-63.3	164.4	166.7	-80.2	-178	-167.8	0	0	111.6	V253	E251-V253 PolarHBondContact O-N 3.35Å; E251-V253 VanDerWaalsContact O-N 3.12Å
252	P	59.6	Low	74.6	Confident	90 Å²	90	35.9 Å²	35.9	58%	0.584	20%	0.196	S	C	*	.	P	Polyproline II helix	trans	-51.8	122.1	177.9	20.3	-33.5	0	0	0	111.5	T325	P252-T325 HydrophobicContact CB-CG2 4.38Å
253	V	60.3	Low	74	Confident	8 Å²	8	38.2 Å²	38.2	5%	0.048	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-76.5	154.3	178.4	174.5	0	0	0	0	109.8	E251 S255 T258 L259 Q263 F324 V326 L329	E251-V253 PolarHBondContact O-N 3.35Å; E251-V253 VanDerWaalsContact O-N 3.12Å; V253-S255 WeakPolarHBondContact CG1-O 3.41Å; V253-T258 HydrophobicContact CG1-CG2 4.05Å; V253-L259 HydrophobicContact CG1-CB 4.32Å; V253-Q263 HydrophobicContact CG2-CG 4.35Å; V253-F324 CarbonylContact C-O 3.42Å; V253-F324 CarbonylContact O-C 3.49Å; V253-F324 VanDerWaalsContact O-C 3.29Å; V253-F324 PolarHBondContact O-N 3.35Å; V253-V326 HydrophobicContact CB-CG2 4.03Å; V253-V326 HydrophobicContact CG2-CG2 3.35Å; V253-L329 HydrophobicContact CB-CD1 4.44Å; V253-L329 HydrophobicContact CG1-CD1 4.2Å
254	H	62.2	Low	73.9	Confident	124 Å²	124	37.7 Å²	37.7	57%	0.574	21%	0.206	S	C	*	.	S	Bend	trans	-84.4	-41.1	-178.8	-60	-70.7	0	0	0	112.2	Q322 A323 F324	H254-Q322 CarbonylContact O-C 3.58Å; H254-A323 WeakPolarHBondContact O-CA 3.36Å; H254-F324 PolarHBondContact O-N 3.49Å
255	S	78.9	Confident	73.7	Confident	32 Å²	32	39.1 Å²	39.1	22%	0.224	22%	0.215	C	C	.	.			trans	-153.9	165.9	-176	71.5	0	0	0	0	113.9	V253 Q257 T258 L259	V253-S255 WeakPolarHBondContact CG1-O 3.41Å; S255-Q257 VanDerWaalsContact C-N 3.27Å; S255-Q257 PolarHBondContact O-N 2.87Å; S255-T258 PolarHBondContact O-N 3.02Å; S255-T258 PolarHBondContact OG-N 3Å; S255-T258 PolarHBondContact OG-OG1 3.33Å; S255-L259 PolarHBondContact O-N 3.13Å
256	L	82.2	Confident	73.6	Confident	8 Å²	8	37.2 Å²	37.2	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-37.9	172.5	-179.8	63	0	0	0	111.9	T258 L259 L260 Y277 L329 I333 L338 L339	L256-T258 PolarHBondContact O-N 3.31Å; L256-L259 HydrophobicContact CD1-CD2 4.35Å; L256-L259 WeakPolarHBondContact O-CB 3.3Å; L256-L259 PolarHBondContact O-N 3.49Å; L256-L260 HydrophobicContact CD1-CD1 4.2Å; L256-L260 HydrophobicContact CD1-CG 4.19Å; L256-L260 HydrophobicContact CG-CD1 4.12Å; L256-L260 HydrophobicContact CG-CG 4.46Å; L256-L260 WeakPolarHBondContact O-CG 3.37Å; L256-L260 PolarHBondContact O-N 3.19Å; L256-Y277 HydrophobicContact CB-CE2 4.43Å; L256-Y277 HydrophobicContact CD2-CE2 4.3Å; L256-Y277 HydrophobicContact CG-CE2 4.2Å; L256-L329 HydrophobicContact CB-CD2 4.13Å; L256-I333 HydrophobicContact CD1-CD1 3.8Å; L256-I333 HydrophobicContact CD1-CG1 4.32Å; L256-L338 HydrophobicContact CD2-CB 4.15Å; L256-L338 HydrophobicContact CD2-CD1 4.21Å; L256-L339 HydrophobicContact CD2-CD1 4.07Å; L256-L339 HydrophobicContact CD2-CG 4.15Å
257	Q	85.3	Confident	73.9	Confident	38 Å²	38	36.6 Å²	36.6	18%	0.178	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-46	175.4	-177.4	-172.8	43.4	0	0	111.2	S255 L259 L260 L261 P273 D274 Y277	S255-Q257 VanDerWaalsContact C-N 3.27Å; S255-Q257 PolarHBondContact O-N 2.87Å; Q257-L259 VanDerWaalsContact C-N 3.33Å; Q257-L259 PolarHBondContact O-N 3.47Å; Q257-L260 PolarHBondContact O-N 3.18Å; Q257-L261 HydrophobicContact CG-CD1 3.82Å; Q257-L261 HydrophobicContact CG-CG 4.44Å; Q257-L261 WeakPolarHBondContact O-CB 3.46Å; Q257-L261 PolarHBondContact O-N 3.35Å; Q257-P273 PolarHBondContact NE2-O 3.23Å; Q257-D274 PolarHBondContact NE2-OD1 3.23Å; Q257-Y277 HydrophobicContact CB-CD1 4.14Å; Q257-Y277 HydrophobicContact CB-CD2 3.76Å; Q257-Y277 HydrophobicContact CB-CE1 4.27Å; Q257-Y277 HydrophobicContact CB-CE2 3.91Å; Q257-Y277 HydrophobicContact CB-CG 3.89Å; Q257-Y277 HydrophobicContact CG-CD1 4.31Å; Q257-Y277 HydrophobicContact CG-CD2 3.99Å; Q257-Y277 HydrophobicContact CG-CG 3.82Å
258	T	82.6	Confident	74.2	Confident	34 Å²	34	37.2 Å²	37.2	21%	0.209	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-39.5	176.1	-59.5	0	0	0	0	111.5	V253 S255 L256 S262 Q263	V253-T258 HydrophobicContact CG1-CG2 4.05Å; S255-T258 PolarHBondContact O-N 3.02Å; S255-T258 PolarHBondContact OG-N 3Å; S255-T258 PolarHBondContact OG-OG1 3.33Å; L256-T258 PolarHBondContact O-N 3.31Å; T258-S262 CarbonylContact O-C 3.29Å; T258-S262 WeakPolarHBondContact O-CA 3.22Å; T258-S262 VanDerWaalsContact O-CB 3.27Å; T258-S262 WeakPolarHBondContact O-CB 2.96Å; T258-S262 PolarHBondContact O-N 3.17Å; T258-Q263 HydrophobicContact CG2-CG 4.39Å; T258-Q263 PolarHBondContact O-N 2.8Å
259	L	83.3	Confident	74.7	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-48.6	176.5	-176.7	64.5	0	0	0	111.4	L242 L247 V253 S255 L256 Q257 Q263 S264 L329 I333	L242-L259 HydrophobicContact CD1-CD2 4.48Å; L242-L259 HydrophobicContact CD2-CD1 4.31Å; L242-L259 HydrophobicContact CD2-CG 4.36Å; L247-L259 HydrophobicContact CD2-CD1 3.81Å; V253-L259 HydrophobicContact CG1-CB 4.32Å; S255-L259 PolarHBondContact O-N 3.13Å; L256-L259 HydrophobicContact CD1-CD2 4.35Å; L256-L259 WeakPolarHBondContact O-CB 3.3Å; L256-L259 PolarHBondContact O-N 3.49Å; Q257-L259 VanDerWaalsContact C-N 3.33Å; Q257-L259 PolarHBondContact O-N 3.47Å; L259-Q263 HydrophobicContact CD1-CB 4.26Å; L259-Q263 CarbonylContact O-C 3.43Å; L259-Q263 PolarHBondContact O-N 2.89Å; L259-S264 PolarHBondContact O-N 3.31Å; L259-S264 VanDerWaalsContact O-N 3.13Å; L259-L329 HydrophobicContact CB-CD1 4.36Å; L259-L329 HydrophobicContact CD2-CB 4.18Å; L259-L329 HydrophobicContact CD2-CD1 4.29Å; L259-I333 HydrophobicContact CD2-CD1 4.29Å
260	L	85.3	Confident	75.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-76.6	-48	-175.5	-62.4	177.8	0	0	0	112.8	F240 L256 Q257 S264 I280 I289 L339	F240-L260 HydrophobicContact CB-CD2 4.12Å; F240-L260 HydrophobicContact CD1-CB 4.13Å; F240-L260 HydrophobicContact CD1-CD2 4.48Å; F240-L260 WeakPolarHBondContact CD1-O 3.43Å; F240-L260 HydrophobicContact CD2-CB 4.49Å; F240-L260 HydrophobicContact CD2-CD2 3.91Å; F240-L260 HydrophobicContact CE1-CB 4.06Å; F240-L260 HydrophobicContact CE2-CB 4.4Å; F240-L260 HydrophobicContact CE2-CD1 4.32Å; F240-L260 HydrophobicContact CE2-CD2 4.48Å; F240-L260 HydrophobicContact CG-CB 4.35Å; F240-L260 HydrophobicContact CG-CD2 3.9Å; F240-L260 HydrophobicContact CZ-CB 4.2Å; L256-L260 HydrophobicContact CD1-CD1 4.2Å; L256-L260 HydrophobicContact CD1-CG 4.19Å; L256-L260 HydrophobicContact CG-CD1 4.12Å; L256-L260 HydrophobicContact CG-CG 4.46Å; L256-L260 WeakPolarHBondContact O-CG 3.37Å; L256-L260 PolarHBondContact O-N 3.19Å; Q257-L260 PolarHBondContact O-N 3.18Å; L260-S264 WeakPolarHBondContact O-CB 3.47Å; L260-S264 PolarHBondContact O-OG 3.29Å; L260-I280 HydrophobicContact CD1-CG2 4.29Å; L260-I289 HydrophobicContact CD2-CD1 4.23Å; L260-L339 HydrophobicContact CD1-CD1 4.02Å
261	L	84.4	Confident	76.3	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-93.1	-7.4	-170.2	-55.9	-176.8	0	0	0	113.9	Y129 F240 Q257 A267 P273 V276 I280	Y129-L261 HydrophobicContact CE1-CD2 4.05Å; Y129-L261 WeakPolarHBondContact OH-CD2 3.29Å; F240-L261 HydrophobicContact CE1-CD2 4.07Å; F240-L261 HydrophobicContact CZ-CD2 4.2Å; Q257-L261 HydrophobicContact CG-CD1 3.82Å; Q257-L261 HydrophobicContact CG-CG 4.44Å; Q257-L261 WeakPolarHBondContact O-CB 3.46Å; Q257-L261 PolarHBondContact O-N 3.35Å; L261-A267 WeakPolarHBondContact O-CB 3.37Å; L261-P273 HydrophobicContact CD1-CB 4.12Å; L261-P273 WeakPolarHBondContact CD1-O 3.46Å; L261-V276 HydrophobicContact CD1-CB 4.38Å; L261-V276 HydrophobicContact CD1-CG1 4.23Å; L261-V276 HydrophobicContact CD2-CG1 3.81Å; L261-I280 HydrophobicContact CD2-CD1 4.05Å
262	S	78.3	Confident	77.6	Confident	26 Å²	26	43.7 Å²	43.7	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-134.8	-25.1	-177.7	-65.2	0	0	0	0	115.2	T258 R499	T258-S262 CarbonylContact O-C 3.29Å; T258-S262 WeakPolarHBondContact O-CA 3.22Å; T258-S262 VanDerWaalsContact O-CB 3.27Å; T258-S262 WeakPolarHBondContact O-CB 2.96Å; T258-S262 PolarHBondContact O-N 3.17Å; S262-R499 PolarHBondContact OG-NH1 3.02Å; S262-R499 PolarHBondContact OG-NH2 3.34Å
263	Q	75.3	Confident	78.8	Confident	51 Å²	51	41.7 Å²	41.7	24%	0.238	23%	0.233	C	C	.	.	S	Bend	trans	-110.4	-6.2	-177.9	-61.3	-68.2	-29.1	0	0	113.4	V253 T258 L259	V253-Q263 HydrophobicContact CG2-CG 4.35Å; T258-Q263 HydrophobicContact CG2-CG 4.39Å; T258-Q263 PolarHBondContact O-N 2.8Å; L259-Q263 HydrophobicContact CD1-CB 4.26Å; L259-Q263 CarbonylContact O-C 3.43Å; L259-Q263 PolarHBondContact O-N 2.89Å
264	S	79.2	Confident	80	Confident	10 Å²	10	46.7 Å²	46.7	7%	0.07	26%	0.259	C	S	.	.	S	Bend	trans	-69.9	144.9	171.6	66.8	0	0	0	0	110.4	L241 L259 L260 F266 A267	L241-S264 WeakPolarHBondContact O-CA 3.29Å; L241-S264 WeakPolarHBondContact O-CB 3.42Å; L259-S264 PolarHBondContact O-N 3.31Å; L259-S264 VanDerWaalsContact O-N 3.13Å; L260-S264 WeakPolarHBondContact O-CB 3.47Å; L260-S264 PolarHBondContact O-OG 3.29Å; S264-F266 PolarHBondContact O-N 2.6Å; S264-A267 PolarHBondContact O-N 3.22Å; S264-A267 VanDerWaalsContact O-N 3.1Å; S264-A267 WeakPolarHBondContact OG-CB 3.43Å
265	S	72.3	Confident	81.2	Confident	31 Å²	31	41.8 Å²	41.8	22%	0.217	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-15	-166.9	-55.5	0	0	0	0	114	L241 D243 Q246	L241-S265 PolarHBondContact O-N 3.07Å; D243-S265 WeakPolarHBondContact CB-OG 3.48Å; Q246-S265 PolarHBondContact OE1-OG 3.2Å
266	F	73.9	Confident	81.7	Confident	14 Å²	14	40.3 Å²	40.3	6%	0.061	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.5	23.4	179.3	-47.2	-49.4	0	0	0	113.5	L133 H136 M137 V140 C141 L241 S264 P268	L133-F266 VanDerWaalsContact CD1-O 3.27Å; L133-F266 WeakPolarHBondContact CD1-O 3.43Å; H136-F266 PolarHBondContact CD2-O 2.95Å; M137-F266 HydrophobicContact CE-CD2 3.48Å; M137-F266 VanDerWaalsContact CE-CD2 3.48Å; M137-F266 HydrophobicContact CE-CE2 3.94Å; M137-F266 HydrophobicContact CG-CD2 3.85Å; M137-F266 HydrophobicContact CG-CE2 4.32Å; M137-F266 HydrophobicContact CG-CG 4.37Å; M137-F266 HydrophobicContact SD-CD2 4.48Å; V140-F266 HydrophobicContact CB-CD1 3.84Å; V140-F266 HydrophobicContact CB-CE1 3.9Å; V140-F266 HydrophobicContact CG1-CD1 3.64Å; V140-F266 HydrophobicContact CG1-CE1 3.35Å; V140-F266 HydrophobicContact CG1-CZ 4.43Å; V140-F266 HydrophobicContact CG2-CD1 4.38Å; C141-F266 WeakPolarHBondContact SG-CE2 3.33Å; C141-F266 WeakPolarHBondContact SG-CZ 3.29Å; L241-F266 HydrophobicContact CB-CD2 3.96Å; L241-F266 HydrophobicContact CB-CE2 3.89Å; L241-F266 HydrophobicContact CD2-CD2 4.11Å; L241-F266 HydrophobicContact CD2-CE2 3.24Å; L241-F266 HydrophobicContact CD2-CZ 3.52Å; L241-F266 HydrophobicContact CG-CE2 4.18Å; S264-F266 PolarHBondContact O-N 2.6Å; F266-P268 WeakPolarHBondContact O-CD 3.43Å
267	A	78.6	Confident	82	Confident	15 Å²	15	42.2 Å²	42.2	12%	0.124	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-68.2	116.5	177.6	0	0	0	0	0	111.8	L261 S264	L261-A267 WeakPolarHBondContact O-CB 3.37Å; S264-A267 PolarHBondContact O-N 3.22Å; S264-A267 VanDerWaalsContact O-N 3.1Å; S264-A267 WeakPolarHBondContact OG-CB 3.43Å
268	P	81.1	Confident	82.1	Confident	18 Å²	18	43.1 Å²	43.1	12%	0.117	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-73.8	172.8	168.7	34.4	-36.5	0	0	0	110.5	Y129 Q132 L133 F266 C270	Y129-P268 HydrophobicContact CD2-CG 4.28Å; Y129-P268 HydrophobicContact CE2-CG 3.7Å; Q132-P268 HydrophobicContact CB-CB 4.45Å; Q132-P268 HydrophobicContact CB-CG 4.3Å; L133-P268 HydrophobicContact CB-CG 4.15Å; L133-P268 HydrophobicContact CD1-CG 4.36Å; F266-P268 WeakPolarHBondContact O-CD 3.43Å; P268-C270 PolarHBondContact O-N 3.02Å
269	R	79.2	Confident	82.5	Confident	203 Å²	203	42.9 Å²	42.9	77%	0.766	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-65.4	124.8	173.9	-68.2	-175.3	-177.5	170.5	4.8	109.7
270	C	80.4	Confident	82.8	Confident	28 Å²	28	42.8 Å²	42.8	19%	0.189	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-96.2	117.4	177.5	-165.8	0	0	0	0	110.1	Y129 P268 D272 P273	Y129-C270 HydrophobicContact CD2-CB 3.99Å; Y129-C270 HydrophobicContact CE2-CB 3.66Å; P268-C270 PolarHBondContact O-N 3.02Å; C270-D272 VanDerWaalsContact SG-C 3.53Å; C270-D272 PolarHBondContact SG-O 3.23Å; C270-P273 HydrophobicContact CB-CG 4.18Å; C270-P273 VanDerWaalsContact SG-CA 3.53Å
271	A	81.1	Confident	83	Confident	112 Å²	112	47 Å²	47	93%	0.926	27%	0.27	S	S	*	.	S	Bend	trans	-73.2	-36.1	177.8	0	0	0	0	0	112.4
272	D	85.3	Confident	83.3	Confident	68 Å²	68	50 Å²	50	36%	0.364	30%	0.295	S	S	.	.			trans	-125.1	79.7	175.2	177.6	16.3	0	0	0	110.8	C270 D274 G275 V276	C270-D272 VanDerWaalsContact SG-C 3.53Å; C270-D272 PolarHBondContact SG-O 3.23Å; D272-D274 PolarHBondContact O-N 3.15Å; D272-D274 PolarHBondContact OD1-N 3.41Å; D272-G275 PolarHBondContact OD1-N 3.39Å; D272-G275 WeakPolarHBondContact OD2-CA 3.33Å; D272-V276 WeakPolarHBondContact O-CG2 3.45Å; D272-V276 PolarHBondContact O-N 3.3Å
273	P	85.3	Confident	83.8	Confident	49 Å²	49	50.2 Å²	50.2	32%	0.318	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-32.2	179.9	-22.1	33.4	0	0	0	113.7	Q257 L261 C270 Y277	Q257-P273 PolarHBondContact NE2-O 3.23Å; L261-P273 HydrophobicContact CD1-CB 4.12Å; L261-P273 WeakPolarHBondContact CD1-O 3.46Å; C270-P273 HydrophobicContact CB-CG 4.18Å; C270-P273 VanDerWaalsContact SG-CA 3.53Å; P273-Y277 WeakPolarHBondContact O-CB 3.41Å; P273-Y277 PolarHBondContact O-N 3.35Å
274	D	86.3	Confident	84.5	Confident	113 Å²	113	49 Å²	49	60%	0.604	30%	0.295	S	S	*	.	H	α-helix	trans	-77.2	-43.7	-174.5	-67.1	-32.3	0	0	0	111.2	Q257 D272 Y277 A278	Q257-D274 PolarHBondContact NE2-OD1 3.23Å; D272-D274 PolarHBondContact O-N 3.15Å; D272-D274 PolarHBondContact OD1-N 3.41Å; D274-Y277 PolarHBondContact O-N 2.87Å; D274-A278 WeakPolarHBondContact O-CB 3.29Å; D274-A278 PolarHBondContact O-N 3.31Å
275	G	86.9	Confident	85.1	Confident	20 Å²	20	55.1 Å²	55.1	21%	0.206	32%	0.321	C	S	.	.	H	α-helix	trans	-63.3	-42.9	174.3	0	0	0	0	0	112.8	D272 A278 Q279	D272-G275 PolarHBondContact OD1-N 3.39Å; D272-G275 WeakPolarHBondContact OD2-CA 3.33Å; G275-A278 PolarHBondContact O-N 3.08Å; G275-Q279 PolarHBondContact O-N 3.31Å; G275-Q279 VanDerWaalsContact O-N 3.15Å
276	V	88.8	Confident	86	Confident	1 Å²	1	58 Å²	58	1%	0.006	33%	0.327	C	S	.	.	H	α-helix	trans	-63	-44.9	175	173.9	0	0	0	0	110.8	V126 Y129 F238 L261 D272 A278 Q279 I280	V126-V276 HydrophobicContact CB-CG2 4.48Å; V126-V276 HydrophobicContact CG1-CG2 4.44Å; V126-V276 HydrophobicContact CG2-CG2 4.01Å; Y129-V276 HydrophobicContact CD1-CG1 3.75Å; Y129-V276 HydrophobicContact CD1-CG2 4.07Å; Y129-V276 HydrophobicContact CE1-CG1 3.88Å; Y129-V276 HydrophobicContact CG-CG1 4.41Å; Y129-V276 HydrophobicContact CG-CG2 3.94Å; F238-V276 HydrophobicContact CE1-CG1 3.93Å; F238-V276 HydrophobicContact CZ-CG1 4.35Å; L261-V276 HydrophobicContact CD1-CB 4.38Å; L261-V276 HydrophobicContact CD1-CG1 4.23Å; L261-V276 HydrophobicContact CD2-CG1 3.81Å; D272-V276 WeakPolarHBondContact O-CG2 3.45Å; D272-V276 PolarHBondContact O-N 3.3Å; V276-A278 PolarHBondContact O-N 3.38Å; V276-Q279 PolarHBondContact O-N 3.33Å; V276-I280 HydrophobicContact CG1-CD1 4.01Å; V276-I280 WeakPolarHBondContact O-CG1 3.29Å; V276-I280 PolarHBondContact O-N 2.81Å
277	Y	89.6	Confident	86.9	Confident	49 Å²	49	57.3 Å²	57.3	19%	0.192	32%	0.324	C	S	.	.	H	α-helix	trans	-66.5	-37.6	179.5	-172.7	-116.1	0	0	0	112.8	L256 Q257 P273 D274 Q279 I280 L281	L256-Y277 HydrophobicContact CB-CE2 4.43Å; L256-Y277 HydrophobicContact CD2-CE2 4.3Å; L256-Y277 HydrophobicContact CG-CE2 4.2Å; Q257-Y277 HydrophobicContact CB-CD1 4.14Å; Q257-Y277 HydrophobicContact CB-CD2 3.76Å; Q257-Y277 HydrophobicContact CB-CE1 4.27Å; Q257-Y277 HydrophobicContact CB-CE2 3.91Å; Q257-Y277 HydrophobicContact CB-CG 3.89Å; Q257-Y277 HydrophobicContact CG-CD1 4.31Å; Q257-Y277 HydrophobicContact CG-CD2 3.99Å; Q257-Y277 HydrophobicContact CG-CG 3.82Å; P273-Y277 WeakPolarHBondContact O-CB 3.41Å; P273-Y277 PolarHBondContact O-N 3.35Å; D274-Y277 PolarHBondContact O-N 2.87Å; Y277-Q279 VanDerWaalsContact C-N 3.3Å; Y277-Q279 PolarHBondContact O-N 2.71Å; Y277-I280 WeakPolarHBondContact O-CB 3.48Å; Y277-I280 PolarHBondContact O-N 3.3Å; Y277-L281 HydrophobicContact CD1-CD1 3.97Å; Y277-L281 HydrophobicContact CD1-CG 4.49Å; Y277-L281 HydrophobicContact CE1-CD1 3.57Å; Y277-L281 HydrophobicContact CE1-CG 4.19Å; Y277-L281 HydrophobicContact CE2-CG 4.48Å; Y277-L281 WeakPolarHBondContact O-CG 3.38Å; Y277-L281 PolarHBondContact O-N 3.43Å
278	A	87.5	Confident	87.7	Confident	56 Å²	56	57 Å²	57	46%	0.463	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-40.7	173	0	0	0	0	0	111.8	D274 G275 V276 L281 A282	D274-A278 WeakPolarHBondContact O-CB 3.29Å; D274-A278 PolarHBondContact O-N 3.31Å; G275-A278 PolarHBondContact O-N 3.08Å; V276-A278 PolarHBondContact O-N 3.38Å; A278-L281 PolarHBondContact O-N 3.19Å; A278-A282 WeakPolarHBondContact O-CB 3.34Å; A278-A282 PolarHBondContact O-N 3.4Å
279	Q	90.3	Very high	88.2	Confident	30 Å²	30	56.1 Å²	56.1	14%	0.14	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-40.6	175.5	-72.3	-61	-18.7	0	0	113	V126 G275 V276 Y277 L281 A282 A283	V126-Q279 HydrophobicContact CB-CG 4.4Å; V126-Q279 HydrophobicContact CG1-CB 4.15Å; V126-Q279 HydrophobicContact CG1-CG 4.08Å; V126-Q279 HydrophobicContact CG2-CG 3.89Å; G275-Q279 PolarHBondContact O-N 3.31Å; G275-Q279 VanDerWaalsContact O-N 3.15Å; V276-Q279 PolarHBondContact O-N 3.33Å; Y277-Q279 VanDerWaalsContact C-N 3.3Å; Y277-Q279 PolarHBondContact O-N 2.71Å; Q279-L281 VanDerWaalsContact C-N 3.27Å; Q279-L281 PolarHBondContact O-N 3.49Å; Q279-A282 PolarHBondContact O-N 2.9Å; Q279-A283 PolarHBondContact O-N 2.97Å
280	I	90.9	Very high	88.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.2	-41.8	174	-68.8	166.3	0	0	0	110.9	F238 F240 L260 L261 V276 Y277 V287 L339	F238-I280 HydrophobicContact CD1-CG1 4.33Å; F238-I280 HydrophobicContact CD2-CG1 3.93Å; F238-I280 HydrophobicContact CE1-CG1 4.3Å; F238-I280 HydrophobicContact CE2-CG1 3.9Å; F238-I280 HydrophobicContact CG-CG1 4.14Å; F238-I280 HydrophobicContact CZ-CG1 4.08Å; F240-I280 HydrophobicContact CE2-CD1 3.95Å; F240-I280 HydrophobicContact CE2-CG1 4.47Å; F240-I280 HydrophobicContact CZ-CD1 3.58Å; F240-I280 HydrophobicContact CZ-CG1 4.43Å; L260-I280 HydrophobicContact CD1-CG2 4.29Å; L261-I280 HydrophobicContact CD2-CD1 4.05Å; V276-I280 HydrophobicContact CG1-CD1 4.01Å; V276-I280 WeakPolarHBondContact O-CG1 3.29Å; V276-I280 PolarHBondContact O-N 2.81Å; Y277-I280 WeakPolarHBondContact O-CB 3.48Å; Y277-I280 PolarHBondContact O-N 3.3Å; I280-V287 HydrophobicContact CG2-CG2 4.09Å; I280-L339 HydrophobicContact CG2-CD1 4.33Å; I280-L339 HydrophobicContact CG2-CD2 3.98Å
281	L	89	Confident	89.3	Confident	90 Å²	90	45.4 Å²	45.4	47%	0.471	27%	0.27	S	S	.	.	H	α-helix	trans	-72.7	-32.6	177.4	-67.8	177.9	0	0	0	113.2	Y277 A278 Q279 P284 L339	Y277-L281 HydrophobicContact CD1-CD1 3.97Å; Y277-L281 HydrophobicContact CD1-CG 4.49Å; Y277-L281 HydrophobicContact CE1-CD1 3.57Å; Y277-L281 HydrophobicContact CE1-CG 4.19Å; Y277-L281 HydrophobicContact CE2-CG 4.48Å; Y277-L281 WeakPolarHBondContact O-CG 3.38Å; Y277-L281 PolarHBondContact O-N 3.43Å; A278-L281 PolarHBondContact O-N 3.19Å; Q279-L281 VanDerWaalsContact C-N 3.27Å; Q279-L281 PolarHBondContact O-N 3.49Å; L281-P284 WeakPolarHBondContact O-CD 3.48Å; L281-L339 HydrophobicContact CD2-CD2 3.89Å
282	A	89.2	Confident	89.7	Confident	65 Å²	65	40.8 Å²	40.8	54%	0.537	23%	0.23	S	C	.	.	H	α-helix	trans	-71.5	-38.6	178.7	0	0	0	0	0	112.5	A278 Q279 P284	A278-A282 WeakPolarHBondContact O-CB 3.34Å; A278-A282 PolarHBondContact O-N 3.4Å; Q279-A282 PolarHBondContact O-N 2.9Å; A282-P284 VanDerWaalsContact C-CD 3.43Å; A282-P284 WeakPolarHBondContact O-CD 3.42Å
283	A	90.1	Very high	89.5	Confident	32 Å²	32	38 Å²	38	26%	0.264	22%	0.217	S	C	.	.			trans	-124.7	58.2	-176.4	0	0	0	0	0	113.2	Q279 K285 R286	Q279-A283 PolarHBondContact O-N 2.97Å; A283-K285 PolarHBondContact O-N 3.32Å; A283-R286 PolarHBondContact O-N 3.4Å
284	P	89.8	Confident	89.2	Confident	26 Å²	26	35.8 Å²	35.8	17%	0.169	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-62.5	-22.4	-175	26.8	-35.5	0	0	0	112.4	L281 A282 R286 V287 L339 G341 C342	L281-P284 WeakPolarHBondContact O-CD 3.48Å; A282-P284 VanDerWaalsContact C-CD 3.43Å; A282-P284 WeakPolarHBondContact O-CD 3.42Å; P284-R286 PolarHBondContact O-N 3.01Å; P284-V287 PolarHBondContact O-N 3.19Å; P284-L339 HydrophobicContact CB-CD2 4.17Å; P284-G341 CarbonylContact O-C 3.55Å; P284-C342 WeakPolarHBondContact O-CA 3.3Å; P284-C342 PolarHBondContact O-N 3.34Å
285	K	90.9	Very high	88.7	Confident	137 Å²	137	30.9 Å²	30.9	60%	0.596	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-64.7	-21.7	176.7	-56.2	-163.7	170.6	173.4	0	113.7	R205 A283 G341	R205-K285 VanDerWaalsContact NH1-CB 3.27Å; A283-K285 PolarHBondContact O-N 3.32Å; K285-G341 WeakPolarHBondContact CA-O 3.23Å
286	R	92.1	Very high	88	Confident	92 Å²	92	30.8 Å²	30.8	35%	0.347	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-98.3	15.2	179.4	-58.3	-166.8	60.3	75.1	10.8	112.3	P234 Q235 F236 D237 F238 A283 P284	P234-R286 PolarHBondContact O-NH2 3.32Å; Q235-R286 PolarHBondContact O-NH1 2.62Å; F236-R286 CarbonylContact C-O 3.59Å; F236-R286 VanDerWaalsContact CA-O 3.32Å; F236-R286 WeakPolarHBondContact CA-O 3.12Å; D237-R286 HydrophobicContact CB-CB 4.27Å; D237-R286 PolarHBondContact N-O 3.08Å; D237-R286 IonicContact OD1-CZ 3.84Å; D237-R286 VanDerWaalsContact OD1-CZ 3.23Å; D237-R286 IonicContact OD1-NE 3.5Å; D237-R286 PolarHBondContact OD1-NE 3.5Å; D237-R286 IonicContact OD1-NH2 3.97Å; D237-R286 PolarHBondContact OD1-NH2 3.49Å; D237-R286 WeakPolarHBondContact OD2-CB 3.43Å; D237-R286 WeakPolarHBondContact OD2-CD 3.24Å; D237-R286 IonicContact OD2-CZ 2.97Å; D237-R286 IonicContact OD2-NE 3.95Å; D237-R286 PolarHBondContact OD2-NE 2.86Å; F238-R286 PolarHBondContact N-O 2.91Å; A283-R286 PolarHBondContact O-N 3.4Å; P284-R286 PolarHBondContact O-N 3.01Å
287	V	93.6	Very high	87.2	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128	179.7	-177.5	0	0	0	0	109.7	F238 F240 I280 P284 I289 C342 T343	F238-V287 HydrophobicContact CB-CG1 4.42Å; F238-V287 HydrophobicContact CB-CG2 4.37Å; F238-V287 HydrophobicContact CD2-CG2 4.17Å; F240-V287 HydrophobicContact CD2-CG1 3.93Å; F240-V287 HydrophobicContact CE2-CG1 3.93Å; I280-V287 HydrophobicContact CG2-CG2 4.09Å; P284-V287 PolarHBondContact O-N 3.19Å; V287-I289 HydrophobicContact CG1-CG1 4.14Å; V287-C342 HydrophobicContact CB-CB 4.17Å; V287-C342 HydrophobicContact CG1-CB 4.4Å; V287-T343 PolarHBondContact O-N 3.33Å
288	L	93.6	Very high	85.8	Confident	7 Å²	7	30.9 Å²	30.9	4%	0.037	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.9	169.9	173.8	63.5	0	0	0	109.5	F198 F236 F238 V239 F240 V290 T343 L345	F198-L288 HydrophobicContact CE1-CD1 3.93Å; F198-L288 HydrophobicContact CE1-CD2 4.35Å; F198-L288 HydrophobicContact CE2-CD2 4.07Å; F198-L288 HydrophobicContact CZ-CD1 3.92Å; F198-L288 HydrophobicContact CZ-CD2 3.63Å; F198-L288 HydrophobicContact CZ-CG 4.47Å; F236-L288 HydrophobicContact CB-CB 4.4Å; F236-L288 HydrophobicContact CD1-CB 3.89Å; F236-L288 HydrophobicContact CD2-CB 4.01Å; F236-L288 HydrophobicContact CD2-CD2 4.05Å; F236-L288 HydrophobicContact CE1-CB 4.14Å; F236-L288 HydrophobicContact CE2-CB 4.25Å; F236-L288 HydrophobicContact CE2-CD2 4.06Å; F236-L288 HydrophobicContact CG-CB 3.83Å; F236-L288 HydrophobicContact CZ-CB 4.31Å; F238-L288 PolarHBondContact O-N 3.39Å; V239-L288 WeakPolarHBondContact CA-O 3.27Å; V239-L288 HydrophobicContact CG1-CD2 4.09Å; V239-L288 HydrophobicContact CG1-CG 4.36Å; V239-L288 HydrophobicContact CG2-CB 4.18Å; V239-L288 HydrophobicContact CG2-CD2 4.15Å; F240-L288 PolarHBondContact N-O 2.95Å; L288-V290 HydrophobicContact CD1-CG2 4.29Å; L288-V290 HydrophobicContact CD2-CG2 4.04Å; L288-V290 HydrophobicContact CG-CG2 3.91Å; L288-T343 WeakPolarHBondContact CA-O 3.25Å; L288-T343 HydrophobicContact CD1-CG2 3.83Å; L288-L345 HydrophobicContact CD1-CB 4.39Å
289	I	92.9	Very high	84.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.3	172	-55.3	177.6	0	0	0	108	F240 L242 L260 V287 F291 I333 L339 T343 L344 L345	F240-I289 HydrophobicContact CD2-CG1 4.49Å; L242-I289 HydrophobicContact CD1-CG2 3.67Å; L242-I289 HydrophobicContact CG-CG2 4.27Å; L260-I289 HydrophobicContact CD2-CD1 4.23Å; V287-I289 HydrophobicContact CG1-CG1 4.14Å; I289-F291 HydrophobicContact CB-CE2 4.49Å; I289-F291 HydrophobicContact CG2-CD2 4.23Å; I289-F291 HydrophobicContact CG2-CE1 4.2Å; I289-F291 HydrophobicContact CG2-CE2 3.66Å; I289-F291 HydrophobicContact CG2-CZ 3.66Å; I289-I333 HydrophobicContact CD1-CG2 4.26Å; I289-L339 HydrophobicContact CD1-CD1 4.02Å; I289-T343 PolarHBondContact N-O 3.11Å; I289-L344 HydrophobicContact CB-CD2 3.81Å; I289-L344 HydrophobicContact CD1-CD2 4.31Å; I289-L344 HydrophobicContact CG1-CD2 4.41Å; I289-L344 HydrophobicContact CG2-CD2 4.48Å; I289-L344 WeakPolarHBondContact O-CA 3.3Å; I289-L345 PolarHBondContact O-N 2.93Å
290	V	92.8	Very high	83.1	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.024	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.8	177.5	-172.7	0	0	0	0	108.9	I221 V239 F240 L241 L242 L288 L345	I221-V290 HydrophobicContact CB-CG1 4.45Å; I221-V290 HydrophobicContact CD1-CG1 3.88Å; I221-V290 HydrophobicContact CG1-CG1 3.91Å; I221-V290 HydrophobicContact CG2-CG1 3.69Å; V239-V290 HydrophobicContact CG1-CG2 4.41Å; F240-V290 PolarHBondContact O-N 3.11Å; L241-V290 HydrophobicContact CD1-CB 3.84Å; L241-V290 HydrophobicContact CD1-CG1 3.77Å; L242-V290 PolarHBondContact N-O 2.91Å; L288-V290 HydrophobicContact CD1-CG2 4.29Å; L288-V290 HydrophobicContact CD2-CG2 4.04Å; L288-V290 HydrophobicContact CG-CG2 3.91Å; V290-L345 CarbonylContact C-O 3.6Å; V290-L345 WeakPolarHBondContact CA-O 3.2Å; V290-L345 HydrophobicContact CG1-CB 4.39Å; V290-L345 HydrophobicContact CG1-CD2 4.23Å; V290-L345 HydrophobicContact CG1-CG 4.41Å; V290-L345 HydrophobicContact CG2-CB 4.34Å; V290-L345 HydrophobicContact CG2-CD2 4.45Å
291	F	88.9	Confident	81.6	Confident	3 Å²	3	38.5 Å²	38.5	1%	0.013	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	112.5	173.3	-65.3	-76.6	0	0	0	109	L242 I289 F330 I333 L334 L344 L345 L346 A347	L242-F291 HydrophobicContact CB-CD1 3.64Å; L242-F291 HydrophobicContact CB-CE1 3.89Å; L242-F291 HydrophobicContact CD1-CD1 3.92Å; L242-F291 HydrophobicContact CD1-CE1 3.25Å; L242-F291 HydrophobicContact CD1-CZ 3.83Å; L242-F291 HydrophobicContact CG-CD1 4.37Å; L242-F291 HydrophobicContact CG-CE1 4.16Å; L242-F291 WeakPolarHBondContact O-CA 3.41Å; I289-F291 HydrophobicContact CB-CE2 4.49Å; I289-F291 HydrophobicContact CG2-CD2 4.23Å; I289-F291 HydrophobicContact CG2-CE1 4.2Å; I289-F291 HydrophobicContact CG2-CE2 3.66Å; I289-F291 HydrophobicContact CG2-CZ 3.66Å; F291-F330 HydrophobicContact CD1-CD2 4.11Å; F291-F330 AromaticContact CD1-CE2 3.46Å; F291-F330 HydrophobicContact CD1-CE2 3.46Å; F291-F330 VanDerWaalsContact CD1-CE2 3.46Å; F291-F330 HydrophobicContact CD1-CZ 4.48Å; F291-F330 AromaticContact CE1-CD2 3.49Å; F291-F330 HydrophobicContact CE1-CD2 3.49Å; F291-F330 VanDerWaalsContact CE1-CD2 3.49Å; F291-F330 AromaticContact CE1-CE2 3.31Å; F291-F330 HydrophobicContact CE1-CE2 3.31Å; F291-F330 HydrophobicContact CG-CE2 4.13Å; F291-F330 AromaticContact CZ-CD2 4Å; F291-F330 HydrophobicContact CZ-CD2 4Å; F291-F330 AromaticContact CZ-CE2 3.92Å; F291-F330 HydrophobicContact CZ-CE2 3.92Å; F291-I333 HydrophobicContact CE2-CG2 4.33Å; F291-I333 HydrophobicContact CZ-CG2 4.19Å; F291-L334 HydrophobicContact CE2-CD2 4.17Å; F291-L344 HydrophobicContact CE2-CD2 4.16Å; F291-L345 PolarHBondContact N-O 3.47Å; F291-L346 HydrophobicContact CB-CG 4.24Å; F291-L346 HydrophobicContact CD2-CD1 4.11Å; F291-L346 HydrophobicContact CD2-CG 3.96Å; F291-A347 PolarHBondContact O-N 3.11Å
292	D	89.6	Confident	80.2	Confident	15 Å²	15	38.7 Å²	38.7	8%	0.08	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	134.5	176.3	-165	9.1	0	0	0	110.9	T218 I221 L241 L242 G244	T218-D292 WeakPolarHBondContact CA-OD2 3.41Å; T218-D292 VanDerWaalsContact CB-OD2 3.22Å; T218-D292 WeakPolarHBondContact CB-OD2 3.33Å; T218-D292 WeakPolarHBondContact CG2-OD2 3.35Å; T218-D292 PolarHBondContact OG1-OD1 2.76Å; T218-D292 PolarHBondContact OG1-OD2 3.47Å; I221-D292 HydrophobicContact CD1-CB 3.92Å; L241-D292 HydrophobicContact CD1-CB 4.15Å; L242-D292 PolarHBondContact O-N 3.04Å; L242-D292 VanDerWaalsContact O-N 3.08Å; G244-D292 WeakPolarHBondContact CA-O 3.42Å; G244-D292 PolarHBondContact N-O 3.03Å
293	G	82.4	Confident	78.6	Confident	8 Å²	8	37 Å²	37	8%	0.082	18%	0.181	C	C	.	.			trans	71.2	45.6	179.2	0	0	0	0	0	115	D295 E296 A347	G293-D295 PolarHBondContact O-N 2.92Å; G293-D295 VanDerWaalsContact O-N 3.13Å; G293-E296 WeakPolarHBondContact O-CB 3.37Å; G293-E296 PolarHBondContact O-N 3.2Å; G293-E296 VanDerWaalsContact O-N 3.11Å; G293-A347 PolarHBondContact N-O 3.19Å
294	F	78.4	Confident	77.2	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.018	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-58.3	-24.7	177.4	-175.5	-89.3	0	0	0	113.3	E296 L297 L304 F330 L334 L346 A347 L357	F294-E296 PolarHBondContact O-N 2.71Å; F294-L297 PolarHBondContact O-N 2.94Å; F294-L304 HydrophobicContact CZ-CD1 4.3Å; F294-F330 HydrophobicContact CD2-CE1 4.23Å; F294-F330 AromaticContact CD2-CZ 3.6Å; F294-F330 HydrophobicContact CD2-CZ 3.6Å; F294-F330 AromaticContact CE2-CE1 3.54Å; F294-F330 HydrophobicContact CE2-CE1 3.54Å; F294-F330 AromaticContact CE2-CZ 3.36Å; F294-F330 HydrophobicContact CE2-CZ 3.36Å; F294-F330 HydrophobicContact CZ-CE1 4.36Å; F294-L334 HydrophobicContact CE2-CD1 3.88Å; F294-L334 HydrophobicContact CZ-CD1 4.45Å; F294-L346 HydrophobicContact CD2-CD2 3.76Å; F294-L346 HydrophobicContact CE2-CD2 3.86Å; F294-L346 HydrophobicContact CG-CD2 4.44Å; F294-A347 WeakPolarHBondContact CB-O 3.49Å; F294-A347 PolarHBondContact N-O 3.15Å; F294-L357 HydrophobicContact CD1-CD1 3.84Å; F294-L357 HydrophobicContact CE1-CD1 3.79Å; F294-L357 HydrophobicContact CE1-CD2 4.08Å; F294-L357 HydrophobicContact CE1-CG 4.1Å; F294-L357 HydrophobicContact CE2-CD2 4.3Å; F294-L357 HydrophobicContact CG-CD1 4.39Å; F294-L357 HydrophobicContact CZ-CD1 4.28Å; F294-L357 HydrophobicContact CZ-CD2 3.81Å; F294-L357 HydrophobicContact CZ-CG 4.35Å
295	D	75.4	Confident	75.7	Confident	10 Å²	10	40.9 Å²	40.9	5%	0.053	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-63.1	-18	176.4	52.8	-59.2	0	0	0	114.5	G293 R298 R349	G293-D295 PolarHBondContact O-N 2.92Å; G293-D295 VanDerWaalsContact O-N 3.13Å; D295-R298 VanDerWaalsContact O-CG 3.28Å; D295-R298 WeakPolarHBondContact O-CG 3.37Å; D295-R298 PolarHBondContact O-NE 3.48Å; D295-R349 IonicContact OD2-CZ 3.66Å; D295-R349 IonicContact OD2-NE 2.93Å; D295-R349 PolarHBondContact OD2-NE 3.4Å; D295-R349 IonicContact OD2-NH2 2.79Å; D295-R349 PolarHBondContact OD2-NH2 3.32Å
296	E	73.1	Confident	74.3	Confident	17 Å²	17	36 Å²	36	8%	0.079	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-81.6	-16.4	174.5	-61.2	-82.1	-174.8	0	0	111.7	K245 G293 F294 R298 S469 S470	K245-E296 HydrophobicContact CG-CG 3.99Å; G293-E296 WeakPolarHBondContact O-CB 3.37Å; G293-E296 PolarHBondContact O-N 3.2Å; G293-E296 VanDerWaalsContact O-N 3.11Å; F294-E296 PolarHBondContact O-N 2.71Å; E296-R298 PolarHBondContact O-N 3.44Å; E296-S469 VanDerWaalsContact OE2-CA 3.3Å; E296-S469 WeakPolarHBondContact OE2-CA 3.43Å; E296-S469 WeakPolarHBondContact OE2-CB 3.48Å; E296-S469 PolarHBondContact OE2-OG 3.39Å; E296-S470 PolarHBondContact OE1-N 3.48Å; E296-S470 PolarHBondContact OE1-OG 3.32Å
297	L	70.6	Confident	72.9	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.016	19%	0.186	C	C	.	.			trans	-95.2	42.9	-175	-61	177	0	0	0	113.2	G244 L247 A248 F294 H299 Y300 F330	G244-L297 WeakPolarHBondContact O-CD2 3.34Å; L247-L297 HydrophobicContact CB-CD2 4.21Å; A248-L297 HydrophobicContact CB-CD2 4.3Å; F294-L297 PolarHBondContact O-N 2.94Å; L297-H299 PolarHBondContact O-N 2.83Å; L297-Y300 HydrophobicContact CB-CD2 3.67Å; L297-Y300 HydrophobicContact CB-CE2 4.18Å; L297-Y300 HydrophobicContact CB-CG 4.45Å; L297-Y300 HydrophobicContact CD2-CD2 4.03Å; L297-Y300 HydrophobicContact CD2-CE2 3.62Å; L297-Y300 HydrophobicContact CG-CD2 4.41Å; L297-Y300 HydrophobicContact CG-CE2 4.47Å; L297-Y300 WeakPolarHBondContact O-CB 3.38Å; L297-Y300 VanDerWaalsContact O-CD2 3.3Å; L297-Y300 WeakPolarHBondContact O-CD2 3.47Å; L297-Y300 PolarHBondContact O-N 2.89Å; L297-Y300 VanDerWaalsContact O-N 3.14Å; L297-F330 HydrophobicContact CD1-CD2 4.45Å; L297-F330 HydrophobicContact CD1-CE1 4.19Å; L297-F330 HydrophobicContact CD1-CE2 3.63Å; L297-F330 HydrophobicContact CD1-CZ 3.47Å; L297-F330 VanDerWaalsContact CD1-CZ 3.47Å
298	R	61.2	Low	71.6	Confident	49 Å²	49	43.5 Å²	43.5	19%	0.185	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-62.9	-36.5	-173.3	-61.5	177.7	178.5	-139.6	-20.9	114.8	D295 E296 Y300 E301 T353 N468 R553	D295-R298 VanDerWaalsContact O-CG 3.28Å; D295-R298 WeakPolarHBondContact O-CG 3.37Å; D295-R298 PolarHBondContact O-NE 3.48Å; E296-R298 PolarHBondContact O-N 3.44Å; R298-Y300 PolarHBondContact O-N 3.34Å; R298-E301 WeakPolarHBondContact O-CB 3.44Å; R298-E301 WeakPolarHBondContact O-CG 3.45Å; R298-E301 PolarHBondContact O-N 3.02Å; R298-E301 VanDerWaalsContact O-N 3.11Å; R298-T353 HydrophobicContact CG-CG2 4.16Å; R298-N468 PolarHBondContact NH2-ND2 2.97Å; R298-N468 PolarHBondContact NH2-OD1 3.42Å; R298-R553 VanDerWaalsContact NH1-NH1 3.12Å
299	H	61.3	Low	70.1	Confident	153 Å²	153	51.4 Å²	51.4	71%	0.708	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-66.3	-9.9	179.5	-59.1	92	0	0	0	113.4	L297 K327	L297-H299 PolarHBondContact O-N 2.83Å; H299-K327 WeakPolarHBondContact O-CE 3.32Å; H299-K327 PolarHBondContact O-NZ 2.84Å
300	Y	60	Low	68.7	Low	33 Å²	33	57 Å²	57	13%	0.129	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-93	-9.2	179	-56.7	-98	0	0	0	112.5	L297 R298 V302 L303 K327 F330	L297-Y300 HydrophobicContact CB-CD2 3.67Å; L297-Y300 HydrophobicContact CB-CE2 4.18Å; L297-Y300 HydrophobicContact CB-CG 4.45Å; L297-Y300 HydrophobicContact CD2-CD2 4.03Å; L297-Y300 HydrophobicContact CD2-CE2 3.62Å; L297-Y300 HydrophobicContact CG-CD2 4.41Å; L297-Y300 HydrophobicContact CG-CE2 4.47Å; L297-Y300 WeakPolarHBondContact O-CB 3.38Å; L297-Y300 VanDerWaalsContact O-CD2 3.3Å; L297-Y300 WeakPolarHBondContact O-CD2 3.47Å; L297-Y300 PolarHBondContact O-N 2.89Å; L297-Y300 VanDerWaalsContact O-N 3.14Å; R298-Y300 PolarHBondContact O-N 3.34Å; Y300-V302 VanDerWaalsContact C-N 3.32Å; Y300-V302 PolarHBondContact O-N 3.43Å; Y300-L303 WeakPolarHBondContact O-CB 3.47Å; Y300-L303 PolarHBondContact O-N 2.95Å; Y300-K327 HydrophobicContact CD1-CB 3.7Å; Y300-K327 HydrophobicContact CD1-CD 4.02Å; Y300-K327 HydrophobicContact CD1-CG 3.54Å; Y300-K327 HydrophobicContact CE1-CB 3.26Å; Y300-K327 HydrophobicContact CE1-CD 4.09Å; Y300-K327 HydrophobicContact CE1-CG 3.63Å; Y300-F330 HydrophobicContact CD1-CD1 4.3Å; Y300-F330 HydrophobicContact CG-CD1 4.46Å
301	E	57.7	Low	67.5	Low	60 Å²	60	57 Å²	57	28%	0.28	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-54.4	-43.2	177.3	-73.9	171.2	-145.5	0	0	113.1	R298 L303 L304 T353 Q356	R298-E301 WeakPolarHBondContact O-CB 3.44Å; R298-E301 WeakPolarHBondContact O-CG 3.45Å; R298-E301 PolarHBondContact O-N 3.02Å; R298-E301 VanDerWaalsContact O-N 3.11Å; E301-L303 PolarHBondContact O-N 2.96Å; E301-L303 VanDerWaalsContact O-N 3.09Å; E301-L304 PolarHBondContact O-N 2.89Å; E301-L304 VanDerWaalsContact O-N 3.16Å; E301-T353 HydrophobicContact CG-CG2 4.12Å; E301-T353 WeakPolarHBondContact OE1-CG2 3.33Å; E301-Q356 PolarHBondContact O-OE1 2.84Å
302	V	60.6	Low	66.6	Low	94 Å²	94	59.2 Å²	59.2	57%	0.57	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-58.9	-27.3	179.6	-179.4	0	0	0	0	111.6	Y300 Q305 T306	Y300-V302 VanDerWaalsContact C-N 3.32Å; Y300-V302 PolarHBondContact O-N 3.43Å; V302-Q305 WeakPolarHBondContact O-CB 3.3Å; V302-Q305 PolarHBondContact O-N 3.26Å; V302-T306 PolarHBondContact O-N 3.22Å
303	L	56.3	Low	65.5	Low	30 Å²	30	61 Å²	61	16%	0.157	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-80.1	-21.1	-177.2	-62.9	-172.3	0	0	0	114.7	Y300 E301 Q305 T306 K327 S331 Q335	Y300-L303 WeakPolarHBondContact O-CB 3.47Å; Y300-L303 PolarHBondContact O-N 2.95Å; E301-L303 PolarHBondContact O-N 2.96Å; E301-L303 VanDerWaalsContact O-N 3.09Å; L303-Q305 PolarHBondContact O-N 3.5Å; L303-T306 PolarHBondContact O-N 3.48Å; L303-K327 HydrophobicContact CD1-CB 4.39Å; L303-K327 HydrophobicContact CD1-CD 3.96Å; L303-K327 VanDerWaalsContact CD1-CE 3.4Å; L303-K327 HydrophobicContact CD1-CG 3.2Å; L303-K327 VanDerWaalsContact CD1-O 3.29Å; L303-K327 WeakPolarHBondContact CD1-O 3.3Å; L303-K327 HydrophobicContact CG-CG 4.27Å; L303-S331 PolarHBondContact O-OG 3.36Å; L303-Q335 PolarHBondContact O-NE2 2.96Å; L303-Q335 VanDerWaalsContact O-NE2 3.13Å
304	L	59.6	Low	64.7	Low	13 Å²	13	62.4 Å²	62.4	7%	0.068	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-73.1	-10.4	169.8	-64	176	0	0	0	111.4	F294 E301 L334 Q356 L357 R360	F294-L304 HydrophobicContact CZ-CD1 4.3Å; E301-L304 PolarHBondContact O-N 2.89Å; E301-L304 VanDerWaalsContact O-N 3.16Å; L304-L334 HydrophobicContact CD2-CB 4.05Å; L304-L334 HydrophobicContact CD2-CD1 3.98Å; L304-Q356 HydrophobicContact CD1-CB 4.2Å; L304-L357 HydrophobicContact CD1-CD2 4.11Å; L304-R360 PolarHBondContact O-NH2 2.87Å
305	Q	59	Low	64.2	Low	126 Å²	126	63.3 Å²	63.3	59%	0.589	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-22.1	173.3	-53.8	-178.8	0.3	0	0	112.7	V302 L303	V302-Q305 WeakPolarHBondContact O-CB 3.3Å; V302-Q305 PolarHBondContact O-N 3.26Å; L303-Q305 PolarHBondContact O-N 3.5Å
306	T	62.2	Low	63.8	Low	36 Å²	36	69 Å²	69	22%	0.221	34%	0.341	C	S	.	.	S	Bend	trans	-62.6	134.9	176.8	-50.2	0	0	0	0	110.9	V302 L303 E310	V302-T306 PolarHBondContact O-N 3.22Å; L303-T306 PolarHBondContact O-N 3.48Å; T306-E310 HydrophobicContact CG2-CB 4Å
307	Q	62.6	Low	63.3	Low	128 Å²	128	76.3 Å²	76.3	60%	0.598	37%	0.373	S	S	*	.			trans	-67.9	140	-179.8	-66.1	-167.1	12.9	0	0	110.9	K309 E310 L311	Q307-K309 PolarHBondContact O-N 3.5Å; Q307-E310 HydrophobicContact CB-CG 4.44Å; Q307-E310 PolarHBondContact O-N 3.08Å; Q307-L311 PolarHBondContact O-N 3.39Å; Q307-L311 VanDerWaalsContact O-N 3.14Å
308	K	65.3	Low	62.6	Low	120 Å²	120	78.5 Å²	78.5	52%	0.522	38%	0.384	S	S	.	.	H	α-helix	trans	-50.1	-34.5	178.2	-172.4	172.9	-179.9	168.9	0	113	V312 V337	K308-V312 VanDerWaalsContact O-CG2 3.26Å; K308-V312 WeakPolarHBondContact O-CG2 3.26Å; K308-V312 PolarHBondContact O-N 3.49Å; K308-V337 HydrophobicContact CD-CG2 4.43Å; K308-V337 HydrophobicContact CG-CG2 3.98Å
309	K	62	Low	62.3	Low	174 Å²	174	79.4 Å²	79.4	76%	0.757	40%	0.398	S	S	*	.	H	α-helix	trans	-67.6	-40.7	177.9	-67.6	-177.4	178.3	-179.6	0	113.2	Q307 A313	Q307-K309 PolarHBondContact O-N 3.5Å; K309-A313 WeakPolarHBondContact O-CB 3.41Å; K309-A313 PolarHBondContact O-N 3.23Å
310	E	64.4	Low	61.8	Low	116 Å²	116	81.6 Å²	81.6	54%	0.542	41%	0.406	S	S	.	.	H	α-helix	trans	-69.6	-38.3	177.1	-68.5	173	166.5	0	0	111.1	T306 Q307 A313 S314	T306-E310 HydrophobicContact CG2-CB 4Å; Q307-E310 HydrophobicContact CB-CG 4.44Å; Q307-E310 PolarHBondContact O-N 3.08Å; E310-A313 PolarHBondContact O-N 3.11Å; E310-S314 PolarHBondContact O-N 2.85Å
311	L	67.7	Low	61.6	Low	5 Å²	5	83.5 Å²	83.5	3%	0.026	43%	0.428	C	S	.	.	H	α-helix	trans	-63.1	-47.2	175.7	-162.6	82.8	0	0	0	111.3	Q307 A313 S314 L315 S332 Q335 V337	Q307-L311 PolarHBondContact O-N 3.39Å; Q307-L311 VanDerWaalsContact O-N 3.14Å; L311-A313 VanDerWaalsContact C-N 3.33Å; L311-A313 PolarHBondContact O-N 3.35Å; L311-S314 PolarHBondContact O-N 3.28Å; L311-S314 PolarHBondContact O-OG 3.27Å; L311-L315 WeakPolarHBondContact O-CG 3.5Å; L311-L315 PolarHBondContact O-N 3.22Å; L311-S332 WeakPolarHBondContact CD2-OG 3.46Å; L311-Q335 HydrophobicContact CD2-CB 4.28Å; L311-Q335 HydrophobicContact CD2-CG 4.4Å; L311-V337 HydrophobicContact CD2-CG2 4.22Å
312	V	68.9	Low	61.5	Low	50 Å²	50	88.2 Å²	88.2	30%	0.303	45%	0.45	S	S	.	.	H	α-helix	trans	-60.8	-42	176.5	171.6	0	0	0	0	111.3	K308 S314 L315 Q316 V337	K308-V312 VanDerWaalsContact O-CG2 3.26Å; K308-V312 WeakPolarHBondContact O-CG2 3.26Å; K308-V312 PolarHBondContact O-N 3.49Å; V312-S314 PolarHBondContact O-N 3.06Å; V312-L315 PolarHBondContact O-N 2.84Å; V312-Q316 HydrophobicContact CG1-CG 4.45Å; V312-Q316 WeakPolarHBondContact O-CB 3.24Å; V312-Q316 VanDerWaalsContact O-CG 3.27Å; V312-Q316 WeakPolarHBondContact O-CG 3.3Å; V312-Q316 PolarHBondContact O-N 3.38Å; V312-V337 HydrophobicContact CG2-CG1 3.96Å; V312-V337 HydrophobicContact CG2-CG2 4.23Å
313	A	66	Low	61.5	Low	52 Å²	52	86 Å²	86	43%	0.43	44%	0.442	S	S	.	.	H	α-helix	trans	-63.6	-38.7	175.5	0	0	0	0	0	112.5	K309 E310 L311 Q316 K317	K309-A313 WeakPolarHBondContact O-CB 3.41Å; K309-A313 PolarHBondContact O-N 3.23Å; E310-A313 PolarHBondContact O-N 3.11Å; L311-A313 VanDerWaalsContact C-N 3.33Å; L311-A313 PolarHBondContact O-N 3.35Å; A313-Q316 PolarHBondContact O-N 2.83Å; A313-K317 WeakPolarHBondContact O-CB 3.48Å; A313-K317 PolarHBondContact O-N 3.37Å
314	S	67.1	Low	62.2	Low	37 Å²	37	86.4 Å²	86.4	26%	0.259	44%	0.443	S	S	.	.	H	α-helix	trans	-65.2	-43.7	175.3	73.6	0	0	0	0	112.2	E310 L311 V312 Q316 K317 D318	E310-S314 PolarHBondContact O-N 2.85Å; L311-S314 PolarHBondContact O-N 3.28Å; L311-S314 PolarHBondContact O-OG 3.27Å; V312-S314 PolarHBondContact O-N 3.06Å; S314-Q316 VanDerWaalsContact C-N 3.31Å; S314-Q316 PolarHBondContact O-N 3.29Å; S314-K317 PolarHBondContact O-N 3.21Å; S314-D318 WeakPolarHBondContact O-CB 3.43Å; S314-D318 PolarHBondContact O-N 3.01Å
315	L	67.1	Low	63	Low	23 Å²	23	88.3 Å²	88.3	12%	0.12	46%	0.455	C	S	.	.	H	α-helix	trans	-63.3	-38.1	175.9	-68.8	170	0	0	0	111.8	L311 V312 S319 F324 S332 V337	L311-L315 WeakPolarHBondContact O-CG 3.5Å; L311-L315 PolarHBondContact O-N 3.22Å; V312-L315 PolarHBondContact O-N 2.84Å; L315-S319 WeakPolarHBondContact O-CB 3.22Å; L315-S319 PolarHBondContact O-N 3.24Å; L315-F324 HydrophobicContact CB-CE1 4.47Å; L315-F324 HydrophobicContact CD2-CD1 3.77Å; L315-F324 HydrophobicContact CD2-CE1 3.62Å; L315-F324 HydrophobicContact CD2-CZ 4.38Å; L315-S332 WeakPolarHBondContact CD1-OG 3.35Å; L315-V337 HydrophobicContact CD1-CG1 3.71Å
316	Q	67	Low	63.7	Low	130 Å²	130	82.6 Å²	82.6	61%	0.607	43%	0.429	S	S	*	.	H	α-helix	trans	-69.5	-38.9	176.8	-74.9	174.4	-11.4	0	0	112.2	V312 A313 S314 S319	V312-Q316 HydrophobicContact CG1-CG 4.45Å; V312-Q316 WeakPolarHBondContact O-CB 3.24Å; V312-Q316 VanDerWaalsContact O-CG 3.27Å; V312-Q316 WeakPolarHBondContact O-CG 3.3Å; V312-Q316 PolarHBondContact O-N 3.38Å; A313-Q316 PolarHBondContact O-N 2.83Å; S314-Q316 VanDerWaalsContact C-N 3.31Å; S314-Q316 PolarHBondContact O-N 3.29Å; Q316-S319 PolarHBondContact O-OG 3.04Å
317	K	62	Low	64.2	Low	170 Å²	170	84.3 Å²	84.3	74%	0.739	43%	0.433	S	S	*	.	H	α-helix	trans	-65.9	-42	176.7	-169.9	179.4	179.1	-175.8	0	111.9	A313 S314	A313-K317 WeakPolarHBondContact O-CB 3.48Å; A313-K317 PolarHBondContact O-N 3.37Å; S314-K317 PolarHBondContact O-N 3.21Å
318	D	56.1	Low	64.8	Low	49 Å²	49	80 Å²	80	26%	0.262	41%	0.413	S	S	.	.	H	α-helix	trans	-86	-9.7	-177.3	-63.7	-18.8	0	0	0	113.1	S314 K320 A321 Q322 F324 Q328	S314-D318 WeakPolarHBondContact O-CB 3.43Å; S314-D318 PolarHBondContact O-N 3.01Å; D318-K320 PolarHBondContact O-N 3.06Å; D318-K320 VanDerWaalsContact O-N 3.11Å; D318-A321 PolarHBondContact O-N 3.35Å; D318-Q322 PolarHBondContact O-N 3.34Å; D318-F324 HydrophobicContact CB-CD1 4.43Å; D318-F324 HydrophobicContact CB-CE1 4.01Å; D318-Q328 PolarHBondContact OD2-NE2 3.31Å
319	S	55.1	Low	65.5	Low	68 Å²	68	74.4 Å²	74.4	48%	0.476	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.9	173.5	71.3	0	0	0	0	113.5	L315 Q316 A321	L315-S319 WeakPolarHBondContact O-CB 3.22Å; L315-S319 PolarHBondContact O-N 3.24Å; Q316-S319 PolarHBondContact O-OG 3.04Å; S319-A321 VanDerWaalsContact C-N 3.3Å; S319-A321 PolarHBondContact O-N 2.73Å
320	K	51.8	Low	66.2	Low	200 Å²	200	66.4 Å²	66.4	87%	0.87	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-16.9	174.4	-66.9	-174.7	178.1	-176.2	0	113.7	D318	D318-K320 PolarHBondContact O-N 3.06Å; D318-K320 VanDerWaalsContact O-N 3.11Å
321	A	54.8	Low	66.8	Low	72 Å²	72	61 Å²	61	60%	0.595	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-7.9	-176.7	0	0	0	0	0	114	D318 S319 A323	D318-A321 PolarHBondContact O-N 3.35Å; S319-A321 VanDerWaalsContact C-N 3.3Å; S319-A321 PolarHBondContact O-N 2.73Å; A321-A323 PolarHBondContact O-N 3.19Å
322	Q	55.4	Low	67.4	Low	159 Å²	159	60.7 Å²	60.7	74%	0.743	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	26.8	178.6	-64.8	-171.7	-3.7	0	0	115.8	H254 D318	H254-Q322 CarbonylContact O-C 3.58Å; D318-Q322 PolarHBondContact O-N 3.34Å
323	A	61.7	Low	68.1	Low	49 Å²	49	58.4 Å²	58.4	41%	0.405	31%	0.313	S	S	.	.			trans	-131.7	114.2	177.3	0	0	0	0	0	109.8	H254 A321	H254-A323 WeakPolarHBondContact O-CA 3.36Å; A321-A323 PolarHBondContact O-N 3.19Å
324	F	71.3	Confident	68.8	Low	37 Å²	37	56.1 Å²	56.1	16%	0.162	29%	0.294	C	S	.	.			trans	-116.8	123.6	178.7	-62.2	-74.4	0	0	0	110.9	V253 H254 L315 D318 L329	V253-F324 CarbonylContact C-O 3.42Å; V253-F324 CarbonylContact O-C 3.49Å; V253-F324 VanDerWaalsContact O-C 3.29Å; V253-F324 PolarHBondContact O-N 3.35Å; H254-F324 PolarHBondContact O-N 3.49Å; L315-F324 HydrophobicContact CB-CE1 4.47Å; L315-F324 HydrophobicContact CD2-CD1 3.77Å; L315-F324 HydrophobicContact CD2-CE1 3.62Å; L315-F324 HydrophobicContact CD2-CZ 4.38Å; D318-F324 HydrophobicContact CB-CD1 4.43Å; D318-F324 HydrophobicContact CB-CE1 4.01Å; F324-L329 HydrophobicContact CB-CD1 4.19Å; F324-L329 HydrophobicContact CB-CD2 3.75Å; F324-L329 HydrophobicContact CB-CG 3.69Å; F324-L329 HydrophobicContact CD2-CD2 4.19Å; F324-L329 HydrophobicContact CG-CD2 4.11Å
325	T	74.6	Confident	69.3	Low	54 Å²	54	55.1 Å²	55.1	33%	0.331	29%	0.285	S	S	.	.			trans	-54.4	147.5	172.8	60.8	0	0	0	0	110.9	P252 K327 Q328 L329	P252-T325 HydrophobicContact CB-CG2 4.38Å; T325-K327 PolarHBondContact O-N 3.17Å; T325-Q328 PolarHBondContact O-N 3.37Å; T325-Q328 WeakPolarHBondContact OG1-CG 3.37Å; T325-Q328 PolarHBondContact OG1-N 2.83Å; T325-Q328 VanDerWaalsContact OG1-N 3.13Å; T325-Q328 PolarHBondContact OG1-OE1 3.18Å; T325-L329 PolarHBondContact O-N 3.34Å; T325-L329 VanDerWaalsContact O-N 3.1Å
326	V	74.3	Confident	70	Confident	6 Å²	6	57.6 Å²	57.6	4%	0.036	29%	0.293	C	S	.	.	H	α-helix	trans	-46.8	-35.2	170.8	176.7	0	0	0	0	110.1	L247 V253 L329 F330	L247-V326 HydrophobicContact CB-CG1 4.34Å; L247-V326 HydrophobicContact CD2-CG1 4Å; V253-V326 HydrophobicContact CB-CG2 4.03Å; V253-V326 HydrophobicContact CG2-CG2 3.35Å; V326-L329 PolarHBondContact O-N 3.22Å; V326-F330 WeakPolarHBondContact O-CB 3.49Å; V326-F330 PolarHBondContact O-N 3.23Å
327	K	73.2	Confident	70.8	Confident	72 Å²	72	53.1 Å²	53.1	31%	0.313	27%	0.274	S	S	.	.	H	α-helix	trans	-59.6	-47.8	176.2	-174.6	155	-174.6	-177	0	115.6	H299 Y300 L303 T325 S331	H299-K327 WeakPolarHBondContact O-CE 3.32Å; H299-K327 PolarHBondContact O-NZ 2.84Å; Y300-K327 HydrophobicContact CD1-CB 3.7Å; Y300-K327 HydrophobicContact CD1-CD 4.02Å; Y300-K327 HydrophobicContact CD1-CG 3.54Å; Y300-K327 HydrophobicContact CE1-CB 3.26Å; Y300-K327 HydrophobicContact CE1-CD 4.09Å; Y300-K327 HydrophobicContact CE1-CG 3.63Å; L303-K327 HydrophobicContact CD1-CB 4.39Å; L303-K327 HydrophobicContact CD1-CD 3.96Å; L303-K327 VanDerWaalsContact CD1-CE 3.4Å; L303-K327 HydrophobicContact CD1-CG 3.2Å; L303-K327 VanDerWaalsContact CD1-O 3.29Å; L303-K327 WeakPolarHBondContact CD1-O 3.3Å; L303-K327 HydrophobicContact CG-CG 4.27Å; T325-K327 PolarHBondContact O-N 3.17Å; K327-S331 WeakPolarHBondContact O-CB 3.31Å; K327-S331 PolarHBondContact O-N 3.24Å
328	Q	75.9	Confident	71.8	Confident	37 Å²	37	47.1 Å²	47.1	17%	0.173	25%	0.25	C	C	.	.	H	α-helix	trans	-69.7	-45.1	175.5	-71.9	161.5	-52.4	0	0	111.3	D318 T325 F330 S332	D318-Q328 PolarHBondContact OD2-NE2 3.31Å; T325-Q328 PolarHBondContact O-N 3.37Å; T325-Q328 WeakPolarHBondContact OG1-CG 3.37Å; T325-Q328 PolarHBondContact OG1-N 2.83Å; T325-Q328 VanDerWaalsContact OG1-N 3.13Å; T325-Q328 PolarHBondContact OG1-OE1 3.18Å; Q328-F330 PolarHBondContact O-N 2.87Å; Q328-S332 VanDerWaalsContact O-CB 3.32Å; Q328-S332 WeakPolarHBondContact O-CB 3.14Å; Q328-S332 PolarHBondContact O-N 3.46Å; Q328-S332 PolarHBondContact O-OG 3.2Å
329	L	79.2	Confident	73.2	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-61	-47.8	-179.8	-67.6	175.5	0	0	0	111.6	V253 L256 L259 F324 T325 V326 S332 I333 L338	V253-L329 HydrophobicContact CB-CD1 4.44Å; V253-L329 HydrophobicContact CG1-CD1 4.2Å; L256-L329 HydrophobicContact CB-CD2 4.13Å; L259-L329 HydrophobicContact CB-CD1 4.36Å; L259-L329 HydrophobicContact CD2-CB 4.18Å; L259-L329 HydrophobicContact CD2-CD1 4.29Å; F324-L329 HydrophobicContact CB-CD1 4.19Å; F324-L329 HydrophobicContact CB-CD2 3.75Å; F324-L329 HydrophobicContact CB-CG 3.69Å; F324-L329 HydrophobicContact CD2-CD2 4.19Å; F324-L329 HydrophobicContact CG-CD2 4.11Å; T325-L329 PolarHBondContact O-N 3.34Å; T325-L329 VanDerWaalsContact O-N 3.1Å; V326-L329 PolarHBondContact O-N 3.22Å; L329-S332 WeakPolarHBondContact O-CB 3.29Å; L329-S332 PolarHBondContact O-N 3.47Å; L329-S332 VanDerWaalsContact O-N 3.16Å; L329-I333 WeakPolarHBondContact O-CG1 3.38Å; L329-I333 PolarHBondContact O-N 2.91Å; L329-L338 HydrophobicContact CD2-CD1 3.84Å
330	F	77.5	Confident	74.6	Confident	7 Å²	7	45.8 Å²	45.8	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-60.2	-51	179.7	-174.1	-99.7	0	0	0	112.3	F291 F294 L297 Y300 V326 Q328 S332 I333 L334	F291-F330 HydrophobicContact CD1-CD2 4.11Å; F291-F330 AromaticContact CD1-CE2 3.46Å; F291-F330 HydrophobicContact CD1-CE2 3.46Å; F291-F330 VanDerWaalsContact CD1-CE2 3.46Å; F291-F330 HydrophobicContact CD1-CZ 4.48Å; F291-F330 AromaticContact CE1-CD2 3.49Å; F291-F330 HydrophobicContact CE1-CD2 3.49Å; F291-F330 VanDerWaalsContact CE1-CD2 3.49Å; F291-F330 AromaticContact CE1-CE2 3.31Å; F291-F330 HydrophobicContact CE1-CE2 3.31Å; F291-F330 HydrophobicContact CG-CE2 4.13Å; F291-F330 AromaticContact CZ-CD2 4Å; F291-F330 HydrophobicContact CZ-CD2 4Å; F291-F330 AromaticContact CZ-CE2 3.92Å; F291-F330 HydrophobicContact CZ-CE2 3.92Å; F294-F330 HydrophobicContact CD2-CE1 4.23Å; F294-F330 AromaticContact CD2-CZ 3.6Å; F294-F330 HydrophobicContact CD2-CZ 3.6Å; F294-F330 AromaticContact CE2-CE1 3.54Å; F294-F330 HydrophobicContact CE2-CE1 3.54Å; F294-F330 AromaticContact CE2-CZ 3.36Å; F294-F330 HydrophobicContact CE2-CZ 3.36Å; F294-F330 HydrophobicContact CZ-CE1 4.36Å; L297-F330 HydrophobicContact CD1-CD2 4.45Å; L297-F330 HydrophobicContact CD1-CE1 4.19Å; L297-F330 HydrophobicContact CD1-CE2 3.63Å; L297-F330 HydrophobicContact CD1-CZ 3.47Å; L297-F330 VanDerWaalsContact CD1-CZ 3.47Å; Y300-F330 HydrophobicContact CD1-CD1 4.3Å; Y300-F330 HydrophobicContact CG-CD1 4.46Å; V326-F330 WeakPolarHBondContact O-CB 3.49Å; V326-F330 PolarHBondContact O-N 3.23Å; Q328-F330 PolarHBondContact O-N 2.87Å; F330-S332 PolarHBondContact O-N 3.03Å; F330-I333 PolarHBondContact O-N 3.39Å; F330-L334 HydrophobicContact CD1-CD1 3.76Å; F330-L334 HydrophobicContact CD1-CG 4.42Å; F330-L334 HydrophobicContact CE1-CD1 3.32Å; F330-L334 HydrophobicContact CE1-CG 4.28Å; F330-L334 HydrophobicContact CZ-CD1 3.8Å; F330-L334 WeakPolarHBondContact O-CG 3.29Å; F330-L334 PolarHBondContact O-N 3.3Å
331	S	76.2	Confident	76.2	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-58.6	-37.1	176	-178.6	0	0	0	0	111.9	L303 K327 L334 Q335	L303-S331 PolarHBondContact O-OG 3.36Å; K327-S331 WeakPolarHBondContact O-CB 3.31Å; K327-S331 PolarHBondContact O-N 3.24Å; S331-L334 PolarHBondContact O-N 3.33Å; S331-Q335 VanDerWaalsContact O-CB 3.26Å; S331-Q335 WeakPolarHBondContact O-CB 3.5Å; S331-Q335 VanDerWaalsContact O-CG 3.24Å; S331-Q335 WeakPolarHBondContact O-CG 3.46Å; S331-Q335 PolarHBondContact O-N 2.86Å; S331-Q335 PolarHBondContact OG-NE2 3.19Å
332	S	79.4	Confident	77.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-70.4	-36	-179.8	-55.1	0	0	0	0	113.1	L311 L315 Q328 L329 F330 R336 V337 L338	L311-S332 WeakPolarHBondContact CD2-OG 3.46Å; L315-S332 WeakPolarHBondContact CD1-OG 3.35Å; Q328-S332 VanDerWaalsContact O-CB 3.32Å; Q328-S332 WeakPolarHBondContact O-CB 3.14Å; Q328-S332 PolarHBondContact O-N 3.46Å; Q328-S332 PolarHBondContact O-OG 3.2Å; L329-S332 WeakPolarHBondContact O-CB 3.29Å; L329-S332 PolarHBondContact O-N 3.47Å; L329-S332 VanDerWaalsContact O-N 3.16Å; F330-S332 PolarHBondContact O-N 3.03Å; S332-R336 PolarHBondContact O-N 3.33Å; S332-V337 PolarHBondContact O-N 3.14Å; S332-L338 PolarHBondContact O-N 2.85Å; S332-L338 VanDerWaalsContact O-N 3.12Å
333	I	84.5	Confident	79.7	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-66.3	-48.5	172.5	-65.5	164.8	0	0	0	109.9	L256 L259 I289 F291 L329 F330 Q335 R336 L338 L344	L256-I333 HydrophobicContact CD1-CD1 3.8Å; L256-I333 HydrophobicContact CD1-CG1 4.32Å; L259-I333 HydrophobicContact CD2-CD1 4.29Å; I289-I333 HydrophobicContact CD1-CG2 4.26Å; F291-I333 HydrophobicContact CE2-CG2 4.33Å; F291-I333 HydrophobicContact CZ-CG2 4.19Å; L329-I333 WeakPolarHBondContact O-CG1 3.38Å; L329-I333 PolarHBondContact O-N 2.91Å; F330-I333 PolarHBondContact O-N 3.39Å; I333-Q335 VanDerWaalsContact C-N 3.26Å; I333-Q335 PolarHBondContact O-N 3.32Å; I333-R336 WeakPolarHBondContact O-CA 3.27Å; I333-R336 PolarHBondContact O-N 2.93Å; I333-L338 HydrophobicContact CG1-CB 4.22Å; I333-L344 HydrophobicContact CG2-CD1 4.16Å; I333-L344 HydrophobicContact CG2-CD2 3.74Å
334	L	79.8	Confident	81.1	Confident	5 Å²	5	24.1 Å²	24.1	3%	0.026	13%	0.127	C	C	.	.	H	α-helix	trans	-66.3	-27	180	-63.3	-175.8	0	0	0	113.6	F291 F294 L304 F330 S331 L344 L346	F291-L334 HydrophobicContact CE2-CD2 4.17Å; F294-L334 HydrophobicContact CE2-CD1 3.88Å; F294-L334 HydrophobicContact CZ-CD1 4.45Å; L304-L334 HydrophobicContact CD2-CB 4.05Å; L304-L334 HydrophobicContact CD2-CD1 3.98Å; F330-L334 HydrophobicContact CD1-CD1 3.76Å; F330-L334 HydrophobicContact CD1-CG 4.42Å; F330-L334 HydrophobicContact CE1-CD1 3.32Å; F330-L334 HydrophobicContact CE1-CG 4.28Å; F330-L334 HydrophobicContact CZ-CD1 3.8Å; F330-L334 WeakPolarHBondContact O-CG 3.29Å; F330-L334 PolarHBondContact O-N 3.3Å; S331-L334 PolarHBondContact O-N 3.33Å; L334-L344 HydrophobicContact CD2-CD1 4.14Å; L334-L346 HydrophobicContact CD2-CD1 4.23Å; L334-L346 HydrophobicContact CD2-CD2 3.83Å; L334-L346 HydrophobicContact CD2-CG 4.43Å
335	Q	78.6	Confident	82.1	Confident	16 Å²	16	22.5 Å²	22.5	8%	0.075	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	1.6	172.4	-73.1	-173.1	51.1	0	0	113.3	L303 L311 S331 I333 V337	L303-Q335 PolarHBondContact O-NE2 2.96Å; L303-Q335 VanDerWaalsContact O-NE2 3.13Å; L311-Q335 HydrophobicContact CD2-CB 4.28Å; L311-Q335 HydrophobicContact CD2-CG 4.4Å; S331-Q335 VanDerWaalsContact O-CB 3.26Å; S331-Q335 WeakPolarHBondContact O-CB 3.5Å; S331-Q335 VanDerWaalsContact O-CG 3.24Å; S331-Q335 WeakPolarHBondContact O-CG 3.46Å; S331-Q335 PolarHBondContact O-N 2.86Å; S331-Q335 PolarHBondContact OG-NE2 3.19Å; I333-Q335 VanDerWaalsContact C-N 3.26Å; I333-Q335 PolarHBondContact O-N 3.32Å; Q335-V337 HydrophobicContact CB-CG2 3.94Å; Q335-V337 PolarHBondContact O-N 3.22Å
336	R	81.5	Confident	82.9	Confident	74 Å²	74	19.9 Å²	19.9	28%	0.279	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	36.3	-174.1	-63.5	-172.1	175.3	171.3	2.3	111.9	Y206 S332 I333 P340 D362	Y206-R336 VanDerWaalsContact CB-NH2 3.32Å; S332-R336 PolarHBondContact O-N 3.33Å; I333-R336 WeakPolarHBondContact O-CA 3.27Å; I333-R336 PolarHBondContact O-N 2.93Å; R336-P340 HydrophobicContact CB-CB 4.36Å; R336-P340 WeakPolarHBondContact O-CB 3.45Å; R336-D362 IonicContact CZ-OD2 3.39Å; R336-D362 IonicContact NH2-OD2 3.82Å; R336-D362 PolarHBondContact NH2-OD2 3.13Å
337	V	83.4	Confident	83.7	Confident	37 Å²	37	19.6 Å²	19.6	22%	0.224	10%	0.103	C	C	.	.	S	Bend	trans	-84.5	-43	170.4	175.3	0	0	0	0	109	K308 L311 V312 L315 S332 Q335	K308-V337 HydrophobicContact CD-CG2 4.43Å; K308-V337 HydrophobicContact CG-CG2 3.98Å; L311-V337 HydrophobicContact CD2-CG2 4.22Å; V312-V337 HydrophobicContact CG2-CG1 3.96Å; V312-V337 HydrophobicContact CG2-CG2 4.23Å; L315-V337 HydrophobicContact CD1-CG1 3.71Å; S332-V337 PolarHBondContact O-N 3.14Å; Q335-V337 HydrophobicContact CB-CG2 3.94Å; Q335-V337 PolarHBondContact O-N 3.22Å
338	L	84.4	Confident	84.4	Confident	43 Å²	43	16.2 Å²	16.2	23%	0.225	9%	0.088	C	C	.	.	S	Bend	trans	-98.1	137	169	-63.8	176.2	0	0	0	109.2	L256 L329 S332 I333	L256-L338 HydrophobicContact CD2-CB 4.15Å; L256-L338 HydrophobicContact CD2-CD1 4.21Å; L329-L338 HydrophobicContact CD2-CD1 3.84Å; S332-L338 PolarHBondContact O-N 2.85Å; S332-L338 VanDerWaalsContact O-N 3.12Å; I333-L338 HydrophobicContact CG1-CB 4.22Å
339	L	85.5	Confident	84.8	Confident	8 Å²	8	15.6 Å²	15.6	4%	0.042	8%	0.084	C	C	.	.	S	Bend	trans	49.3	57.1	-179.8	-62.2	171.7	0	0	0	113.9	L256 L260 I280 L281 P284 I289 G341 C342	L256-L339 HydrophobicContact CD2-CD1 4.07Å; L256-L339 HydrophobicContact CD2-CG 4.15Å; L260-L339 HydrophobicContact CD1-CD1 4.02Å; I280-L339 HydrophobicContact CG2-CD1 4.33Å; I280-L339 HydrophobicContact CG2-CD2 3.98Å; L281-L339 HydrophobicContact CD2-CD2 3.89Å; P284-L339 HydrophobicContact CB-CD2 4.17Å; I289-L339 HydrophobicContact CD1-CD1 4.02Å; L339-G341 PolarHBondContact O-N 3.42Å; L339-C342 HydrophobicContact CB-CB 4.13Å; L339-C342 PolarHBondContact O-N 3.34Å; L339-C342 PolarHBondContact O-SG 3.13Å
340	P	82.6	Confident	84.6	Confident	82 Å²	82	17.3 Å²	17.3	53%	0.532	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.1	-172.8	24.6	-35	0	0	0	114.9	R336	R336-P340 HydrophobicContact CB-CB 4.36Å; R336-P340 WeakPolarHBondContact O-CB 3.45Å
341	G	85.4	Confident	84.4	Confident	12 Å²	12	22.1 Å²	22.1	12%	0.124	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-8.9	178.1	0	0	0	0	0	115.3	R205 P284 K285 L339	R205-G341 PolarHBondContact NH1-O 2.89Å; P284-G341 CarbonylContact O-C 3.55Å; K285-G341 WeakPolarHBondContact CA-O 3.23Å; L339-G341 PolarHBondContact O-N 3.42Å
342	C	91.4	Very high	84	Confident	3 Å²	3	24.8 Å²	24.8	2%	0.02	14%	0.141	C	C	.	.			trans	-69.8	155.5	-176.7	71.1	0	0	0	0	112.9	P284 V287 L339 L344	P284-C342 WeakPolarHBondContact O-CA 3.3Å; P284-C342 PolarHBondContact O-N 3.34Å; V287-C342 HydrophobicContact CB-CB 4.17Å; V287-C342 HydrophobicContact CG1-CB 4.4Å; L339-C342 HydrophobicContact CB-CB 4.13Å; L339-C342 PolarHBondContact O-N 3.34Å; L339-C342 PolarHBondContact O-SG 3.13Å; C342-L344 VanDerWaalsContact SG-CD2 3.52Å
343	T	93	Very high	83.2	Confident	9 Å²	9	25.1 Å²	25.1	6%	0.055	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	132	170	-59.2	0	0	0	0	108.7	F198 R205 F236 V287 L288 I289	F198-T343 HydrophobicContact CD1-CG2 4.35Å; F198-T343 HydrophobicContact CE1-CG2 4.07Å; R205-T343 CarbonylContact O-C 3.58Å; R205-T343 WeakPolarHBondContact O-CA 3.44Å; F236-T343 HydrophobicContact CE1-CG2 4.41Å; F236-T343 WeakPolarHBondContact CE1-OG1 3.21Å; F236-T343 HydrophobicContact CZ-CG2 4.07Å; V287-T343 PolarHBondContact O-N 3.33Å; L288-T343 WeakPolarHBondContact CA-O 3.25Å; L288-T343 HydrophobicContact CD1-CG2 3.83Å; I289-T343 PolarHBondContact N-O 3.11Å
344	L	91.9	Very high	82.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	132.6	179.2	-56.8	-177.3	0	0	0	109.3	R205 Y206 N207 I289 F291 I333 L334 C342 L346	R205-L344 PolarHBondContact O-N 2.79Å; Y206-L344 HydrophobicContact CD1-CD1 4.46Å; N207-L344 PolarHBondContact N-O 2.99Å; I289-L344 HydrophobicContact CB-CD2 3.81Å; I289-L344 HydrophobicContact CD1-CD2 4.31Å; I289-L344 HydrophobicContact CG1-CD2 4.41Å; I289-L344 HydrophobicContact CG2-CD2 4.48Å; I289-L344 WeakPolarHBondContact O-CA 3.3Å; F291-L344 HydrophobicContact CE2-CD2 4.16Å; I333-L344 HydrophobicContact CG2-CD1 4.16Å; I333-L344 HydrophobicContact CG2-CD2 3.74Å; L334-L344 HydrophobicContact CD2-CD1 4.14Å; C342-L344 VanDerWaalsContact SG-CD2 3.52Å; L344-L346 HydrophobicContact CB-CD1 3.85Å
345	L	92.5	Very high	81.6	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	112.1	169.7	179.9	64.1	0	0	0	108.8	F198 N207 L209 L224 L288 I289 V290 F291	F198-L345 HydrophobicContact CZ-CD2 4.35Å; N207-L345 HydrophobicContact CB-CD1 4.04Å; N207-L345 CarbonylContact O-C 3.48Å; N207-L345 WeakPolarHBondContact O-CA 3.44Å; L209-L345 HydrophobicContact CB-CD1 4.14Å; L224-L345 HydrophobicContact CD1-CD2 3.96Å; L288-L345 HydrophobicContact CD1-CB 4.39Å; I289-L345 PolarHBondContact O-N 2.93Å; V290-L345 CarbonylContact C-O 3.6Å; V290-L345 WeakPolarHBondContact CA-O 3.2Å; V290-L345 HydrophobicContact CG1-CB 4.39Å; V290-L345 HydrophobicContact CG1-CD2 4.23Å; V290-L345 HydrophobicContact CG1-CG 4.41Å; V290-L345 HydrophobicContact CG2-CB 4.34Å; V290-L345 HydrophobicContact CG2-CD2 4.45Å; F291-L345 PolarHBondContact N-O 3.47Å
346	L	90.6	Very high	81.1	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	117.5	-179.5	-70.7	74.9	0	0	0	110.2	Y206 N207 V208 L209 F291 F294 L334 L344 L357	Y206-L346 HydrophobicContact CD2-CD1 4.05Å; Y206-L346 HydrophobicContact CE2-CD1 3.57Å; Y206-L346 HydrophobicContact CE2-CD2 4.04Å; Y206-L346 HydrophobicContact CE2-CG 4.41Å; N207-L346 PolarHBondContact O-N 3.23Å; V208-L346 CarbonylContact C-O 3.19Å; V208-L346 VanDerWaalsContact CA-O 3.32Å; V208-L346 WeakPolarHBondContact CA-O 3.34Å; V208-L346 HydrophobicContact CG2-CB 4.47Å; L209-L346 PolarHBondContact N-O 2.95Å; F291-L346 HydrophobicContact CB-CG 4.24Å; F291-L346 HydrophobicContact CD2-CD1 4.11Å; F291-L346 HydrophobicContact CD2-CG 3.96Å; F294-L346 HydrophobicContact CD2-CD2 3.76Å; F294-L346 HydrophobicContact CE2-CD2 3.86Å; F294-L346 HydrophobicContact CG-CD2 4.44Å; L334-L346 HydrophobicContact CD2-CD1 4.23Å; L334-L346 HydrophobicContact CD2-CD2 3.83Å; L334-L346 HydrophobicContact CD2-CG 4.43Å; L344-L346 HydrophobicContact CB-CD1 3.85Å; L346-L357 HydrophobicContact CD2-CD1 4.17Å; L346-L357 HydrophobicContact CD2-CD2 3.88Å
347	A	91.4	Very high	80.6	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128.1	171.4	0	0	0	0	0	111.4	L209 K217 I221 F291 G293 F294	L209-A347 HydrophobicContact CB-CB 4.43Å; L209-A347 VanDerWaalsContact O-CA 3.31Å; L209-A347 WeakPolarHBondContact O-CA 3.45Å; K217-A347 HydrophobicContact CB-CB 4.36Å; K217-A347 HydrophobicContact CD-CB 4.42Å; I221-A347 HydrophobicContact CD1-CB 3.53Å; F291-A347 PolarHBondContact O-N 3.11Å; G293-A347 PolarHBondContact N-O 3.19Å; F294-A347 WeakPolarHBondContact CB-O 3.49Å; F294-A347 PolarHBondContact N-O 3.15Å
348	T	87.4	Confident	80.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	170.6	-179.3	-164.3	0	0	0	0	111.7	V208 L209 F210 G211 L357	V208-T348 HydrophobicContact CG1-CG2 3.86Å; L209-T348 PolarHBondContact O-N 2.96Å; F210-T348 WeakPolarHBondContact CA-O 3.46Å; F210-T348 HydrophobicContact CD1-CG2 3.67Å; F210-T348 HydrophobicContact CE1-CG2 3.49Å; F210-T348 VanDerWaalsContact CE1-CG2 3.49Å; G211-T348 PolarHBondContact N-O 3.07Å; T348-L357 HydrophobicContact CG2-CD1 4.15Å
349	R	84.5	Confident	79.4	Confident	25 Å²	25	27.2 Å²	27.2	9%	0.094	15%	0.154	C	C	.	.			trans	-85.3	147.1	171.3	-56.6	-172.9	-154.1	-170	3.2	110.4	D295 R351 E554 E555	D295-R349 IonicContact OD2-CZ 3.66Å; D295-R349 IonicContact OD2-NE 2.93Å; D295-R349 PolarHBondContact OD2-NE 3.4Å; D295-R349 IonicContact OD2-NH2 2.79Å; D295-R349 PolarHBondContact OD2-NH2 3.32Å; R349-R351 VanDerWaalsContact C-N 3.3Å; R349-R351 PolarHBondContact O-N 3.12Å; R349-E554 VanDerWaalsContact CD-OE2 3.32Å; R349-E554 WeakPolarHBondContact CD-OE2 3.31Å; R349-E554 IonicContact NH1-OE2 3.83Å; R349-E555 IonicContact CZ-OE1 2.85Å; R349-E555 IonicContact NH1-OE1 2.61Å; R349-E555 PolarHBondContact NH1-OE1 2.91Å; R349-E555 IonicContact NH2-OE1 3.47Å; R349-E555 PolarHBondContact NH2-OE1 2.99Å
350	P	75.5	Confident	78.9	Confident	38 Å²	38	30.6 Å²	30.6	25%	0.247	17%	0.166	C	C	.	.	S	Bend	trans	-66.3	-31.9	-179.2	25.1	-32.9	0	0	0	112.5	L179 F210 N212 A354	L179-P350 HydrophobicContact CD1-CB 4.37Å; F210-P350 HydrophobicContact CD1-CB 4.31Å; N212-P350 WeakPolarHBondContact OD1-CG 3.46Å; P350-A354 VanDerWaalsContact O-CB 3.3Å; P350-A354 WeakPolarHBondContact O-CB 3.43Å
351	R	72.6	Confident	78.8	Confident	107 Å²	107	27.4 Å²	27.4	40%	0.404	15%	0.147	S	C	.	.	S	Bend	trans	-85.1	139.5	175.1	-62.9	-174.4	-178.3	-177.3	7.9	111.1	R349 E557	R349-R351 VanDerWaalsContact C-N 3.3Å; R349-R351 PolarHBondContact O-N 3.12Å; R351-E557 IonicContact CZ-OE2 2.85Å; R351-E557 IonicContact NH1-OE1 2.56Å; R351-E557 PolarHBondContact NH1-OE1 2.94Å; R351-E557 IonicContact NH1-OE2 3.34Å; R351-E557 PolarHBondContact NH1-OE2 3.48Å
352	G	68.6	Low	78.8	Confident	58 Å²	58	29.9 Å²	29.9	60%	0.598	16%	0.157	S	C	*	.	S	Bend	trans	99.2	-116.9	175	0	0	0	0	0	113.6	A354	G352-A354 PolarHBondContact O-N 3.06Å; G352-A354 VanDerWaalsContact O-N 3.1Å
353	T	61.2	Low	78.6	Confident	7 Å²	7	29.8 Å²	29.8	4%	0.043	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.1	-168.7	61.6	0	0	0	0	114.6	R298 E301 S355	R298-T353 HydrophobicContact CG-CG2 4.16Å; E301-T353 HydrophobicContact CG-CG2 4.12Å; E301-T353 WeakPolarHBondContact OE1-CG2 3.33Å; T353-S355 PolarHBondContact O-N 2.61Å
354	A	64.3	Low	78.3	Confident	2 Å²	2	30.1 Å²	30.1	2%	0.017	16%	0.158	C	C	.	.	H	α-helix	trans	-60.2	-37.1	-178	0	0	0	0	0	114	F210 P350 G352 Q356 L357 L358	F210-A354 HydrophobicContact CE1-CB 3.68Å; F210-A354 HydrophobicContact CZ-CB 4.29Å; P350-A354 VanDerWaalsContact O-CB 3.3Å; P350-A354 WeakPolarHBondContact O-CB 3.43Å; G352-A354 PolarHBondContact O-N 3.06Å; G352-A354 VanDerWaalsContact O-N 3.1Å; A354-Q356 PolarHBondContact O-N 3.5Å; A354-Q356 VanDerWaalsContact O-N 3.1Å; A354-L357 WeakPolarHBondContact O-CA 3.46Å; A354-L357 WeakPolarHBondContact O-CB 3.36Å; A354-L357 PolarHBondContact O-N 3.4Å; A354-L358 WeakPolarHBondContact O-CG 3.4Å; A354-L358 PolarHBondContact O-N 3.31Å
355	S	66.7	Low	78.2	Confident	61 Å²	61	30.2 Å²	30.2	43%	0.427	16%	0.158	S	C	.	.	H	α-helix	trans	-57.8	-32.8	-171.7	61.1	0	0	0	0	113.7	T353	T353-S355 PolarHBondContact O-N 2.61Å
356	Q	68.4	Low	78.2	Confident	22 Å²	22	31.6 Å²	31.6	10%	0.103	17%	0.165	C	C	.	.	H	α-helix	trans	-72.7	-32.6	176.8	-61.3	-175.1	7.6	0	0	112.6	E301 L304 A354	E301-Q356 PolarHBondContact O-OE1 2.84Å; L304-Q356 HydrophobicContact CD1-CB 4.2Å; A354-Q356 PolarHBondContact O-N 3.5Å; A354-Q356 VanDerWaalsContact O-N 3.1Å
357	L	71.3	Confident	78.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-71.9	-33.1	178.5	-59.5	177.8	0	0	0	111.8	Y206 V208 F294 L304 L346 T348 A354 R359 R360 A361	Y206-L357 WeakPolarHBondContact OH-CD2 3.45Å; V208-L357 HydrophobicContact CG1-CD1 4.31Å; V208-L357 HydrophobicContact CG2-CB 4.25Å; V208-L357 HydrophobicContact CG2-CD1 4.42Å; F294-L357 HydrophobicContact CD1-CD1 3.84Å; F294-L357 HydrophobicContact CE1-CD1 3.79Å; F294-L357 HydrophobicContact CE1-CD2 4.08Å; F294-L357 HydrophobicContact CE1-CG 4.1Å; F294-L357 HydrophobicContact CE2-CD2 4.3Å; F294-L357 HydrophobicContact CG-CD1 4.39Å; F294-L357 HydrophobicContact CZ-CD1 4.28Å; F294-L357 HydrophobicContact CZ-CD2 3.81Å; F294-L357 HydrophobicContact CZ-CG 4.35Å; L304-L357 HydrophobicContact CD1-CD2 4.11Å; L346-L357 HydrophobicContact CD2-CD1 4.17Å; L346-L357 HydrophobicContact CD2-CD2 3.88Å; T348-L357 HydrophobicContact CG2-CD1 4.15Å; A354-L357 WeakPolarHBondContact O-CA 3.46Å; A354-L357 WeakPolarHBondContact O-CB 3.36Å; A354-L357 PolarHBondContact O-N 3.4Å; L357-R359 PolarHBondContact O-N 3.45Å; L357-R360 PolarHBondContact O-N 3.08Å; L357-A361 PolarHBondContact O-N 3.4Å
358	L	72	Confident	78.1	Confident	9 Å²	9	32.6 Å²	32.6	5%	0.047	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-22.5	177.8	-60.7	-179.5	0	0	0	113.4	I164 K177 L179 F210 A354 F364	I164-L358 HydrophobicContact CD1-CB 3.96Å; I164-L358 HydrophobicContact CD1-CD2 3.77Å; I164-L358 HydrophobicContact CD1-CG 4.36Å; K177-L358 HydrophobicContact CB-CB 4.02Å; K177-L358 HydrophobicContact CB-CD1 4.33Å; K177-L358 HydrophobicContact CD-CB 4.33Å; K177-L358 VanDerWaalsContact CD-O 3.23Å; K177-L358 WeakPolarHBondContact CD-O 3.06Å; K177-L358 PolarHBondContact NZ-O 3.41Å; K177-L358 VanDerWaalsContact NZ-O 3.15Å; K177-L358 WeakPolarHBondContact O-CD1 3.4Å; L179-L358 HydrophobicContact CD1-CD2 4.34Å; L179-L358 HydrophobicContact CD2-CD2 3.7Å; L179-L358 HydrophobicContact CG-CD1 4.4Å; L179-L358 HydrophobicContact CG-CD2 3.85Å; F210-L358 HydrophobicContact CE2-CD2 4.33Å; F210-L358 HydrophobicContact CZ-CD2 3.93Å; A354-L358 WeakPolarHBondContact O-CG 3.4Å; A354-L358 PolarHBondContact O-N 3.31Å; L358-F364 HydrophobicContact CD2-CD1 3.81Å; L358-F364 HydrophobicContact CD2-CE1 3.54Å; L358-F364 HydrophobicContact CD2-CZ 4.22Å
359	R	71.1	Confident	78.2	Confident	126 Å²	126	32.8 Å²	32.8	48%	0.475	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-23.6	177.3	-68.9	-168.3	-68.1	-154.9	-1.4	114.3	K177 L357	K177-R359 HydrophobicContact CD-CG 4.15Å; L357-R359 PolarHBondContact O-N 3.45Å
360	R	73.9	Confident	78.6	Confident	78 Å²	78	32.1 Å²	32.1	29%	0.294	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-25	-165.7	-65.9	-177.1	174.7	-160.4	-0.6	114.5	Y206 L304 L357	Y206-R360 HydrophobicContact CD1-CB 4.48Å; Y206-R360 HydrophobicContact CE1-CB 4Å; L304-R360 PolarHBondContact O-NH2 2.87Å; L357-R360 PolarHBondContact O-N 3.08Å
361	A	81.9	Confident	79.4	Confident	15 Å²	15	33.2 Å²	33.2	12%	0.124	18%	0.177	C	C	.	.			trans	-74.4	146.6	180	0	0	0	0	0	111.6	Y206 V208 L357 F364	Y206-A361 HydrophobicContact CD2-CB 3.53Å; Y206-A361 HydrophobicContact CE2-CB 3.89Å; Y206-A361 HydrophobicContact CG-CB 4.11Å; Y206-A361 CarbonylContact O-C 3.49Å; V208-A361 HydrophobicContact CG2-CB 3.55Å; L357-A361 PolarHBondContact O-N 3.4Å; A361-F364 HydrophobicContact CB-CD1 4.43Å; A361-F364 HydrophobicContact CB-CE1 3.57Å; A361-F364 HydrophobicContact CB-CE2 4.48Å; A361-F364 HydrophobicContact CB-CZ 3.59Å
362	D	83.8	Confident	80.3	Confident	64 Å²	64	32.7 Å²	32.7	34%	0.342	19%	0.187	S	C	.	.	S	Bend	trans	-84.9	-28.6	179.2	-56.8	-36.7	0	0	0	111	K204 R205 Y206 R336	K204-D362 HydrophobicContact CB-CB 3.67Å; K204-D362 HydrophobicContact CD-CB 4.38Å; K204-D362 WeakPolarHBondContact CD-O 3.38Å; K204-D362 HydrophobicContact CG-CB 3.88Å; R205-D362 PolarHBondContact N-OD2 2.9Å; Y206-D362 PolarHBondContact N-OD2 3.16Å; Y206-D362 WeakPolarHBondContact O-CA 3.26Å; Y206-D362 WeakPolarHBondContact O-CB 3.43Å; Y206-D362 PolarHBondContact O-N 3.03Å; R336-D362 IonicContact CZ-OD2 3.39Å; R336-D362 IonicContact NH2-OD2 3.82Å; R336-D362 PolarHBondContact NH2-OD2 3.13Å
363	S	87.3	Confident	81.4	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.014	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	151.5	-179.6	-154.3	0	0	0	0	112.9	Q161 L201 Y206 N207 V208	Q161-S363 PolarHBondContact NE2-OG 2.94Å; Q161-S363 VanDerWaalsContact NE2-OG 3.09Å; L201-S363 WeakPolarHBondContact CD2-OG 3.18Å; Y206-S363 PolarHBondContact O-N 3.22Å; Y206-S363 VanDerWaalsContact O-N 3.17Å; N207-S363 WeakPolarHBondContact CA-O 3.3Å; N207-S363 WeakPolarHBondContact OD1-CB 3.32Å; V208-S363 PolarHBondContact N-O 2.9Å
364	F	87.6	Confident	83	Confident	16 Å²	16	33.8 Å²	33.8	7%	0.07	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.7	177.9	-54.8	-80	0	0	0	108.6	R162 I164 L179 V208 F210 L358 A361	R162-F364 HydrophobicContact CB-CB 3.95Å; R162-F364 PolarHBondContact N-O 3.24Å; I164-F364 HydrophobicContact CD1-CD1 4.29Å; I164-F364 HydrophobicContact CD1-CD2 3.49Å; I164-F364 VanDerWaalsContact CD1-CD2 3.49Å; I164-F364 HydrophobicContact CD1-CE1 3.86Å; I164-F364 HydrophobicContact CD1-CE2 3.03Å; I164-F364 HydrophobicContact CD1-CG 4.11Å; I164-F364 HydrophobicContact CD1-CZ 3.21Å; I164-F364 HydrophobicContact CG1-CD2 3.77Å; I164-F364 HydrophobicContact CG1-CE2 3.8Å; I164-F364 HydrophobicContact CG1-CG 4.39Å; I164-F364 HydrophobicContact CG1-CZ 4.36Å; L179-F364 HydrophobicContact CD2-CB 4.25Å; L179-F364 HydrophobicContact CD2-CD1 4.44Å; L179-F364 HydrophobicContact CD2-CG 4.28Å; V208-F364 HydrophobicContact CB-CD1 4.11Å; V208-F364 HydrophobicContact CB-CE1 4.48Å; V208-F364 HydrophobicContact CG2-CD1 4.47Å; V208-F364 HydrophobicContact CG2-CE1 4.36Å; F210-F364 HydrophobicContact CD2-CB 4.49Å; F210-F364 HydrophobicContact CE2-CB 4Å; F210-F364 AromaticContact CE2-CD1 3.61Å; F210-F364 HydrophobicContact CE2-CD1 3.61Å; F210-F364 HydrophobicContact CE2-CG 4.22Å; F210-F364 HydrophobicContact CZ-CD1 4.03Å; L358-F364 HydrophobicContact CD2-CD1 3.81Å; L358-F364 HydrophobicContact CD2-CE1 3.54Å; L358-F364 HydrophobicContact CD2-CZ 4.22Å; A361-F364 HydrophobicContact CB-CD1 4.43Å; A361-F364 HydrophobicContact CB-CE1 3.57Å; A361-F364 HydrophobicContact CB-CE2 4.48Å; A361-F364 HydrophobicContact CB-CZ 3.59Å
365	L	90.6	Very high	84.5	Confident	2 Å²	2	34 Å²	34	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.9	-178.1	-59.6	175.8	0	0	0	107.8	V159 S160 I197 V208 L209 F210	V159-L365 HydrophobicContact CG1-CB 3.78Å; V159-L365 HydrophobicContact CG1-CD1 4.45Å; V159-L365 HydrophobicContact CG1-CD2 4.32Å; V159-L365 HydrophobicContact CG1-CG 4.4Å; S160-L365 CarbonylContact O-C 3.59Å; S160-L365 WeakPolarHBondContact O-CA 2.98Å; I197-L365 HydrophobicContact CG2-CD1 3.79Å; V208-L365 PolarHBondContact O-N 3.28Å; L209-L365 CarbonylContact C-O 3.48Å; L209-L365 WeakPolarHBondContact CA-O 3.16Å; L209-L365 HydrophobicContact CD1-CB 3.72Å; F210-L365 PolarHBondContact N-O 2.87Å
366	E	90.8	Very high	85.8	Confident	32 Å²	32	36.2 Å²	36.2	15%	0.15	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132	173.7	-177.6	179.8	-142.4	0	0	110	V159 S160 R162 F210 C368	V159-E366 CarbonylContact C-O 3.3Å; V159-E366 WeakPolarHBondContact CA-O 3.24Å; S160-E366 PolarHBondContact N-O 3.46Å; S160-E366 PolarHBondContact O-N 3.36Å; R162-E366 HydrophobicContact CG-CB 4.01Å; R162-E366 IonicContact CZ-OE1 2.7Å; R162-E366 IonicContact CZ-OE2 3.15Å; R162-E366 IonicContact NE-OE1 2.73Å; R162-E366 IonicContact NE-OE2 3.8Å; R162-E366 PolarHBondContact NE-OE2 3.1Å; R162-E366 IonicContact NH2-OE1 2.91Å; R162-E366 PolarHBondContact NH2-OE1 3.37Å; R162-E366 IonicContact NH2-OE2 3.23Å; R162-E366 PolarHBondContact NH2-OE2 2.92Å; F210-E366 HydrophobicContact CB-CB 4.49Å; F210-E366 WeakPolarHBondContact O-CA 3.26Å; E366-C368 PolarHBondContact O-N 3.21Å
367	V	91.6	Very high	87.1	Confident	4 Å²	4	38 Å²	38	2%	0.024	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	116	170.6	-174.6	0	0	0	0	108.3	V157 L209 F210 M215 K217 V220	V157-V367 HydrophobicContact CB-CG1 4.42Å; V157-V367 HydrophobicContact CG1-CG1 3.55Å; L209-V367 HydrophobicContact CD1-CG2 3.62Å; L209-V367 HydrophobicContact CD2-CG2 3.96Å; L209-V367 HydrophobicContact CG-CG2 3.82Å; F210-V367 PolarHBondContact O-N 3.18Å; M215-V367 VanDerWaalsContact O-CG1 3.25Å; M215-V367 WeakPolarHBondContact O-CG1 3.46Å; K217-V367 HydrophobicContact CG-CG2 4.11Å; V220-V367 HydrophobicContact CG2-CG1 4.28Å; V220-V367 HydrophobicContact CG2-CG2 4.47Å
368	C	88.9	Confident	88.3	Confident	17 Å²	17	38.7 Å²	38.7	12%	0.115	21%	0.207	C	C	.	.			trans	-73.8	155.5	175.2	-59.2	0	0	0	0	110.3	V157 S158 E366	V157-C368 WeakPolarHBondContact CG1-O 3.43Å; S158-C368 WeakPolarHBondContact O-CB 3.5Å; S158-C368 PolarHBondContact O-N 2.95Å; S158-C368 WeakPolarHBondContact OG-CB 3.48Å; E366-C368 PolarHBondContact O-N 3.21Å
369	G	89.6	Confident	89.3	Confident	4 Å²	4	38.2 Å²	38.2	4%	0.041	21%	0.205	C	C	.	.			trans	-74.9	176.3	171.7	0	0	0	0	0	112.5	T371 W407	G369-T371 PolarHBondContact O-N 3.21Å; G369-W407 CarbonylContact C-O 3.57Å; G369-W407 VanDerWaalsContact CA-CE2 3.49Å; G369-W407 WeakPolarHBondContact CA-O 3.47Å
370	F	93.7	Very high	90.4	Very high	10 Å²	10	34 Å²	34	4%	0.044	20%	0.195	C	C	.	.			trans	-64.2	131.2	175.2	-76.2	-20.9	0	0	0	111.8	V155 V157 N374 V375 Y378 C406 W407 P409 C412	V155-F370 HydrophobicContact CB-CE1 4.02Å; V155-F370 HydrophobicContact CB-CZ 4.21Å; V155-F370 HydrophobicContact CG1-CE1 4.18Å; V157-F370 HydrophobicContact CG2-CD1 3.88Å; V157-F370 HydrophobicContact CG2-CE1 3.51Å; F370-N374 HydrophobicContact CB-CB 3.76Å; F370-N374 HydrophobicContact CD1-CB 3.7Å; F370-N374 HydrophobicContact CE1-CB 4.46Å; F370-N374 HydrophobicContact CG-CB 3.85Å; F370-V375 HydrophobicContact CB-CG2 3.81Å; F370-V375 HydrophobicContact CD2-CG2 4.39Å; F370-Y378 HydrophobicContact CE2-CD1 4.43Å; F370-Y378 AromaticContact CE2-CD2 4Å; F370-Y378 HydrophobicContact CE2-CD2 4Å; F370-Y378 AromaticContact CE2-CG 3.87Å; F370-Y378 HydrophobicContact CE2-CG 3.87Å; F370-Y378 AromaticContact CZ-CD2 3.92Å; F370-Y378 HydrophobicContact CZ-CD2 3.92Å; F370-Y378 HydrophobicContact CZ-CG 4.22Å; F370-C406 WeakPolarHBondContact CD2-O 3.11Å; F370-W407 PolarHBondContact N-O 2.85Å; F370-P409 HydrophobicContact CD1-CG 4Å; F370-P409 HydrophobicContact CD2-CB 4.31Å; F370-P409 HydrophobicContact CD2-CG 4.16Å; F370-P409 HydrophobicContact CE1-CB 4.22Å; F370-P409 HydrophobicContact CE1-CG 3.84Å; F370-P409 HydrophobicContact CE2-CB 3.75Å; F370-P409 HydrophobicContact CE2-CG 4Å; F370-P409 HydrophobicContact CG-CG 4.16Å; F370-P409 HydrophobicContact CZ-CB 3.7Å; F370-P409 HydrophobicContact CZ-CG 3.84Å; F370-C412 HydrophobicContact CD2-CB 4.19Å; F370-C412 HydrophobicContact CE2-CB 4.16Å
371	T	91.6	Very high	91.3	Very high	62 Å²	62	33.4 Å²	33.4	38%	0.38	20%	0.195	S	C	.	.			trans	-70.2	163.1	163.1	65.4	0	0	0	0	110.2	G369 A373 N374 V375	G369-T371 PolarHBondContact O-N 3.21Å; T371-A373 PolarHBondContact O-N 3.27Å; T371-N374 WeakPolarHBondContact CB-OD1 3.49Å; T371-N374 PolarHBondContact N-OD1 3.35Å; T371-N374 WeakPolarHBondContact O-CA 2.96Å; T371-N374 WeakPolarHBondContact O-CB 3.41Å; T371-N374 PolarHBondContact O-N 3.11Å; T371-N374 PolarHBondContact OG1-N 3.44Å; T371-N374 PolarHBondContact OG1-OD1 3.06Å; T371-V375 PolarHBondContact O-N 2.88Å
372	P	91.5	Very high	91.9	Very high	95 Å²	95	34.5 Å²	34.5	62%	0.617	20%	0.196	S	C	*	.	H	α-helix	trans	-51.6	-40.5	173.6	-28.5	36.3	0	0	0	113.3	N374 V375 E376	P372-N374 PolarHBondContact O-N 3.03Å; P372-V375 PolarHBondContact O-N 3.37Å; P372-E376 PolarHBondContact O-N 2.66Å
373	A	92.9	Very high	92.3	Very high	58 Å²	58	31.8 Å²	31.8	48%	0.479	18%	0.182	S	C	.	.	H	α-helix	trans	-65.3	-36.5	175.3	0	0	0	0	0	112.8	T371 T377	T371-A373 PolarHBondContact O-N 3.27Å; A373-T377 WeakPolarHBondContact O-CB 3.5Å; A373-T377 PolarHBondContact O-N 2.85Å; A373-T377 PolarHBondContact O-OG1 3.3Å
374	N	94.7	Very high	92.3	Very high	30 Å²	30	36.8 Å²	36.8	16%	0.16	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-39.7	173.7	-64.1	130.7	0	0	0	111.8	V155 N156 F370 T371 P372 T377 Y378	V155-N374 HydrophobicContact CG1-CB 3.73Å; V155-N374 VanDerWaalsContact CG1-ND2 3.29Å; V155-N374 WeakPolarHBondContact CG1-ND2 3.3Å; N156-N374 PolarHBondContact O-ND2 3.43Å; F370-N374 HydrophobicContact CB-CB 3.76Å; F370-N374 HydrophobicContact CD1-CB 3.7Å; F370-N374 HydrophobicContact CE1-CB 4.46Å; F370-N374 HydrophobicContact CG-CB 3.85Å; T371-N374 WeakPolarHBondContact CB-OD1 3.49Å; T371-N374 PolarHBondContact N-OD1 3.35Å; T371-N374 WeakPolarHBondContact O-CA 2.96Å; T371-N374 WeakPolarHBondContact O-CB 3.41Å; T371-N374 PolarHBondContact O-N 3.11Å; T371-N374 PolarHBondContact OG1-N 3.44Å; T371-N374 PolarHBondContact OG1-OD1 3.06Å; P372-N374 PolarHBondContact O-N 3.03Å; N374-T377 PolarHBondContact O-N 3.25Å; N374-Y378 WeakPolarHBondContact O-CB 3.35Å; N374-Y378 PolarHBondContact O-N 3.46Å
375	V	95.2	Very high	92.5	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.036	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-51	176.3	175.8	0	0	0	0	110	F370 T371 P372 T377 Y378 V379 L396 C406	F370-V375 HydrophobicContact CB-CG2 3.81Å; F370-V375 HydrophobicContact CD2-CG2 4.39Å; T371-V375 PolarHBondContact O-N 2.88Å; P372-V375 PolarHBondContact O-N 3.37Å; V375-T377 VanDerWaalsContact C-N 3.3Å; V375-T377 PolarHBondContact O-N 3.08Å; V375-Y378 PolarHBondContact O-N 3.18Å; V375-V379 HydrophobicContact CG1-CG2 4.19Å; V375-V379 WeakPolarHBondContact O-CB 3.21Å; V375-V379 VanDerWaalsContact O-CG2 3.23Å; V375-V379 WeakPolarHBondContact O-CG2 3.39Å; V375-V379 PolarHBondContact O-N 2.95Å; V375-L396 HydrophobicContact CG1-CD1 4.49Å; V375-C406 HydrophobicContact CB-CB 4.41Å; V375-C406 HydrophobicContact CG1-CB 3.66Å; V375-C406 HydrophobicContact CG2-CB 3.78Å
376	E	94.6	Very high	92.5	Very high	109 Å²	109	44 Å²	44	51%	0.509	26%	0.261	S	S	.	.	H	α-helix	trans	-57.9	-42.8	177.6	-71.3	179.4	-178.6	0	0	112.1	P372 S380 L393	P372-E376 PolarHBondContact O-N 2.66Å; E376-S380 VanDerWaalsContact O-CB 3.25Å; E376-S380 WeakPolarHBondContact O-CB 3.45Å; E376-S380 PolarHBondContact O-N 3.36Å; E376-S380 PolarHBondContact O-OG 3.16Å; E376-L393 HydrophobicContact CG-CD2 4.37Å
377	T	95.4	Very high	92.4	Very high	60 Å²	60	44.6 Å²	44.6	37%	0.368	28%	0.275	S	S	.	.	H	α-helix	trans	-63.2	-46.9	176.9	-56.8	0	0	0	0	111.2	V155 A373 N374 V375 S380 Q381	V155-T377 HydrophobicContact CG2-CG2 3.92Å; A373-T377 WeakPolarHBondContact O-CB 3.5Å; A373-T377 PolarHBondContact O-N 2.85Å; A373-T377 PolarHBondContact O-OG1 3.3Å; N374-T377 PolarHBondContact O-N 3.25Å; V375-T377 VanDerWaalsContact C-N 3.3Å; V375-T377 PolarHBondContact O-N 3.08Å; T377-S380 PolarHBondContact O-N 3.33Å; T377-Q381 VanDerWaalsContact O-CG 3.32Å; T377-Q381 WeakPolarHBondContact O-CG 3.47Å; T377-Q381 PolarHBondContact O-N 3.3Å
378	Y	95.2	Very high	92.3	Very high	13 Å²	13	48.2 Å²	48.2	5%	0.051	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-47.4	-178.8	-175.9	-92.8	0	0	0	111.4	L148 V155 F370 N374 V375 S380 Q381 Y382 C412 H413	L148-Y378 VanDerWaalsContact CD1-OH 3.29Å; L148-Y378 WeakPolarHBondContact CD1-OH 3.16Å; V155-Y378 HydrophobicContact CG2-CD2 4.05Å; V155-Y378 HydrophobicContact CG2-CG 4.46Å; F370-Y378 HydrophobicContact CE2-CD1 4.43Å; F370-Y378 AromaticContact CE2-CD2 4Å; F370-Y378 HydrophobicContact CE2-CD2 4Å; F370-Y378 AromaticContact CE2-CG 3.87Å; F370-Y378 HydrophobicContact CE2-CG 3.87Å; F370-Y378 AromaticContact CZ-CD2 3.92Å; F370-Y378 HydrophobicContact CZ-CD2 3.92Å; F370-Y378 HydrophobicContact CZ-CG 4.22Å; N374-Y378 WeakPolarHBondContact O-CB 3.35Å; N374-Y378 PolarHBondContact O-N 3.46Å; V375-Y378 PolarHBondContact O-N 3.18Å; Y378-S380 VanDerWaalsContact C-N 3.29Å; Y378-S380 PolarHBondContact O-N 2.56Å; Y378-Q381 PolarHBondContact O-N 3.19Å; Y378-Y382 HydrophobicContact CE1-CD2 4.35Å; Y378-Y382 WeakPolarHBondContact O-CB 3.47Å; Y378-Y382 PolarHBondContact O-N 2.9Å; Y378-C412 HydrophobicContact CD1-CB 4.43Å; Y378-C412 VanDerWaalsContact CD1-SG 3.52Å; Y378-H413 PolarHBondContact OH-ND1 3.43Å
379	V	94.6	Very high	92.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.6	-43.4	176.7	173.4	0	0	0	0	110.1	V375 Q381 Y382 F383 A392 L393 L396	V375-V379 HydrophobicContact CG1-CG2 4.19Å; V375-V379 WeakPolarHBondContact O-CB 3.21Å; V375-V379 VanDerWaalsContact O-CG2 3.23Å; V375-V379 WeakPolarHBondContact O-CG2 3.39Å; V375-V379 PolarHBondContact O-N 2.95Å; V379-Q381 VanDerWaalsContact C-N 3.33Å; V379-Q381 PolarHBondContact O-N 3.42Å; V379-Y382 PolarHBondContact O-N 3.04Å; V379-F383 HydrophobicContact CG1-CD2 3.8Å; V379-F383 HydrophobicContact CG1-CE2 3.95Å; V379-F383 VanDerWaalsContact O-CD2 3.32Å; V379-F383 WeakPolarHBondContact O-CD2 3.47Å; V379-F383 PolarHBondContact O-N 3.19Å; V379-F383 VanDerWaalsContact O-N 3.08Å; V379-A392 HydrophobicContact CG1-CB 4.3Å; V379-L393 HydrophobicContact CB-CD2 4.02Å; V379-L393 HydrophobicContact CG1-CD2 3.69Å; V379-L393 HydrophobicContact CG1-CG 3.99Å; V379-L396 HydrophobicContact CG1-CD1 4.39Å; V379-L396 HydrophobicContact CG2-CD1 3.67Å
380	S	93.6	Very high	92.7	Very high	37 Å²	37	57.3 Å²	57.3	26%	0.259	33%	0.33	S	S	.	.	H	α-helix	trans	-63.4	-37.3	177.8	-61.8	0	0	0	0	113.2	E376 T377 Y378 R389	E376-S380 VanDerWaalsContact O-CB 3.25Å; E376-S380 WeakPolarHBondContact O-CB 3.45Å; E376-S380 PolarHBondContact O-N 3.36Å; E376-S380 PolarHBondContact O-OG 3.16Å; T377-S380 PolarHBondContact O-N 3.33Å; Y378-S380 VanDerWaalsContact C-N 3.29Å; Y378-S380 PolarHBondContact O-N 2.56Å; S380-R389 PolarHBondContact O-NE 3.36Å; S380-R389 PolarHBondContact O-NH2 3.28Å; S380-R389 VanDerWaalsContact O-NH2 3.13Å
381	Q	93.4	Very high	92.6	Very high	66 Å²	66	59 Å²	59	31%	0.308	34%	0.343	S	S	.	.	H	α-helix	trans	-74.7	-32.3	176	-71.8	173.8	-1.5	0	0	112.6	A152 H153 T377 Y378 V379	A152-Q381 PolarHBondContact O-OE1 3.38Å; H153-Q381 VanDerWaalsContact C-OE1 3.25Å; H153-Q381 PolarHBondContact CD2-O 2.85Å; H153-Q381 PolarHBondContact O-OE1 3.44Å; T377-Q381 VanDerWaalsContact O-CG 3.32Å; T377-Q381 WeakPolarHBondContact O-CG 3.47Å; T377-Q381 PolarHBondContact O-N 3.3Å; Y378-Q381 PolarHBondContact O-N 3.19Å; V379-Q381 VanDerWaalsContact C-N 3.33Å; V379-Q381 PolarHBondContact O-N 3.42Å
382	Y	92.8	Very high	92.6	Very high	37 Å²	37	56.1 Å²	56.1	15%	0.145	33%	0.326	C	S	.	.	H	α-helix	trans	-68.8	-48.2	179.7	-173.6	-86.7	0	0	0	112.1	L148 Y378 V379 S384 H413 C416	L148-Y382 HydrophobicContact CD1-CD2 4.43Å; L148-Y382 HydrophobicContact CD1-CE2 4.45Å; L148-Y382 HydrophobicContact CD2-CD2 4.15Å; L148-Y382 HydrophobicContact CD2-CE2 4.15Å; Y378-Y382 HydrophobicContact CE1-CD2 4.35Å; Y378-Y382 WeakPolarHBondContact O-CB 3.47Å; Y378-Y382 PolarHBondContact O-N 2.9Å; V379-Y382 PolarHBondContact O-N 3.04Å; Y382-S384 PolarHBondContact O-N 3.37Å; Y382-H413 AromaticContact CE2-CE1 3.79Å; Y382-H413 AromaticContact CE2-ND1 3.66Å; Y382-C416 HydrophobicContact CD1-CB 3.58Å; Y382-C416 HydrophobicContact CD2-CB 4.1Å; Y382-C416 HydrophobicContact CE1-CB 3.57Å; Y382-C416 HydrophobicContact CE2-CB 4.1Å; Y382-C416 HydrophobicContact CG-CB 3.84Å
383	F	92.3	Very high	92.7	Very high	8 Å²	8	53.3 Å²	53.3	4%	0.035	31%	0.306	C	S	.	.			trans	-86.1	103.4	-179.2	-67.9	-77.5	0	0	0	110.6	V379 D385 L388 R389 A392 C416 L419 E420	V379-F383 HydrophobicContact CG1-CD2 3.8Å; V379-F383 HydrophobicContact CG1-CE2 3.95Å; V379-F383 VanDerWaalsContact O-CD2 3.32Å; V379-F383 WeakPolarHBondContact O-CD2 3.47Å; V379-F383 PolarHBondContact O-N 3.19Å; V379-F383 VanDerWaalsContact O-N 3.08Å; F383-D385 VanDerWaalsContact C-N 3.29Å; F383-L388 HydrophobicContact CD1-CB 4.06Å; F383-R389 HydrophobicContact CB-CB 3.75Å; F383-R389 HydrophobicContact CB-CG 4.28Å; F383-R389 PolarHBondContact O-NE 3.11Å; F383-R389 PolarHBondContact O-NH2 2.96Å; F383-A392 HydrophobicContact CD2-CB 3.95Å; F383-A392 HydrophobicContact CE2-CB 3.53Å; F383-A392 HydrophobicContact CZ-CB 3.86Å; F383-C416 HydrophobicContact CE2-CB 4.1Å; F383-C416 HydrophobicContact CZ-CB 4.2Å; F383-C416 WeakPolarHBondContact CZ-O 3.44Å; F383-L419 HydrophobicContact CZ-CB 4.12Å; F383-E420 HydrophobicContact CE1-CB 4.08Å; F383-E420 HydrophobicContact CE1-CG 4.41Å
384	S	88.9	Confident	92.7	Very high	106 Å²	106	54.6 Å²	54.6	74%	0.741	31%	0.305	S	S	*	.			trans	-64.7	-34.8	173.4	-60.8	0	0	0	0	112.3	Y382	Y382-S384 PolarHBondContact O-N 3.37Å
385	D	90.1	Very high	92.5	Very high	86 Å²	86	54.2 Å²	54.2	46%	0.46	30%	0.301	S	S	.	.	S	Bend	trans	-79.2	123	178.9	-175.7	-77.6	0	0	0	111.2	F383 G387 L388 R389	F383-D385 VanDerWaalsContact C-N 3.29Å; D385-G387 PolarHBondContact O-N 3.47Å; D385-G387 WeakPolarHBondContact OD1-CA 3.47Å; D385-G387 PolarHBondContact OD1-N 2.73Å; D385-L388 HydrophobicContact CB-CB 4.16Å; D385-L388 HydrophobicContact CB-CD1 4.08Å; D385-L388 HydrophobicContact CB-CG 4.18Å; D385-L388 PolarHBondContact OD1-N 2.78Å; D385-R389 WeakPolarHBondContact O-CB 3.48Å; D385-R389 PolarHBondContact O-N 2.85Å
386	P	90.8	Very high	92.4	Very high	85 Å²	85	54.2 Å²	54.2	55%	0.552	30%	0.301	S	S	*	.	H	α-helix	trans	-62.2	-36	-178.8	-24.1	34.1	0	0	0	114.5	R389 E390	P386-R389 WeakPolarHBondContact O-CB 3.46Å; P386-R389 PolarHBondContact O-N 3.3Å; P386-E390 PolarHBondContact O-N 2.83Å
387	G	89.8	Confident	92.2	Very high	44 Å²	44	55.8 Å²	55.8	45%	0.454	31%	0.306	S	S	.	.	H	α-helix	trans	-71.9	-42.6	-178.4	0	0	0	0	0	112	D385 R389 S391	D385-G387 PolarHBondContact O-N 3.47Å; D385-G387 WeakPolarHBondContact OD1-CA 3.47Å; D385-G387 PolarHBondContact OD1-N 2.73Å; G387-R389 VanDerWaalsContact C-N 3.29Å; G387-R389 PolarHBondContact O-N 3.15Å; G387-S391 VanDerWaalsContact O-CB 3.3Å; G387-S391 WeakPolarHBondContact O-CB 3.38Å; G387-S391 PolarHBondContact O-N 3.5Å; G387-S391 VanDerWaalsContact O-N 3.11Å
388	L	89.9	Confident	91.8	Very high	79 Å²	79	55.8 Å²	55.8	41%	0.414	31%	0.309	S	S	.	.	H	α-helix	trans	-64.8	-35.2	172.3	-66.3	178.8	0	0	0	111.7	F383 D385 A392	F383-L388 HydrophobicContact CD1-CB 4.06Å; D385-L388 HydrophobicContact CB-CB 4.16Å; D385-L388 HydrophobicContact CB-CD1 4.08Å; D385-L388 HydrophobicContact CB-CG 4.18Å; D385-L388 PolarHBondContact OD1-N 2.78Å; L388-A392 WeakPolarHBondContact O-CB 3.25Å; L388-A392 PolarHBondContact O-N 3.16Å
389	R	93.7	Very high	91.6	Very high	79 Å²	79	56.1 Å²	56.1	30%	0.298	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-51.5	177.1	-175.8	-172	-59.5	171.1	3	112.3	S380 F383 D385 P386 G387 A392 L393	S380-R389 PolarHBondContact O-NE 3.36Å; S380-R389 PolarHBondContact O-NH2 3.28Å; S380-R389 VanDerWaalsContact O-NH2 3.13Å; F383-R389 HydrophobicContact CB-CB 3.75Å; F383-R389 HydrophobicContact CB-CG 4.28Å; F383-R389 PolarHBondContact O-NE 3.11Å; F383-R389 PolarHBondContact O-NH2 2.96Å; D385-R389 WeakPolarHBondContact O-CB 3.48Å; D385-R389 PolarHBondContact O-N 2.85Å; P386-R389 WeakPolarHBondContact O-CB 3.46Å; P386-R389 PolarHBondContact O-N 3.3Å; G387-R389 VanDerWaalsContact C-N 3.29Å; G387-R389 PolarHBondContact O-N 3.15Å; R389-A392 PolarHBondContact O-N 3.47Å; R389-L393 HydrophobicContact CG-CD1 4.35Å; R389-L393 WeakPolarHBondContact O-CG 3.35Å; R389-L393 PolarHBondContact O-N 2.97Å
390	E	91.8	Very high	91.3	Very high	133 Å²	133	59.2 Å²	59.2	62%	0.621	34%	0.335	S	S	*	.	H	α-helix	trans	-61.3	-46.9	178.6	-74	-176.6	174.2	0	0	110.8	P386 A392 L393 D394	P386-E390 PolarHBondContact O-N 2.83Å; E390-A392 VanDerWaalsContact C-N 3.34Å; E390-A392 PolarHBondContact O-N 3.25Å; E390-L393 PolarHBondContact O-N 3.04Å; E390-D394 PolarHBondContact O-N 3.32Å
391	S	92	Very high	91.3	Very high	45 Å²	45	57.9 Å²	57.9	32%	0.315	32%	0.324	S	S	.	.	H	α-helix	trans	-57.1	-44.6	175.7	-176.1	0	0	0	0	112.5	G387 L393 D394 F395	G387-S391 VanDerWaalsContact O-CB 3.3Å; G387-S391 WeakPolarHBondContact O-CB 3.38Å; G387-S391 PolarHBondContact O-N 3.5Å; G387-S391 VanDerWaalsContact O-N 3.11Å; S391-L393 PolarHBondContact O-N 3.04Å; S391-D394 PolarHBondContact O-N 3.31Å; S391-F395 WeakPolarHBondContact O-CB 3.2Å; S391-F395 WeakPolarHBondContact O-CD2 3.34Å; S391-F395 VanDerWaalsContact O-CG 3.29Å; S391-F395 WeakPolarHBondContact O-CG 3.34Å; S391-F395 PolarHBondContact O-N 3.12Å; S391-F395 WeakPolarHBondContact OG-CE2 3.45Å
392	A	92.7	Very high	91.3	Very high	3 Å²	3	54.8 Å²	54.8	3%	0.025	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-41.7	177.2	0	0	0	0	0	112.5	V379 F383 L388 R389 E390 D394 F395 L396 L419	V379-A392 HydrophobicContact CG1-CB 4.3Å; F383-A392 HydrophobicContact CD2-CB 3.95Å; F383-A392 HydrophobicContact CE2-CB 3.53Å; F383-A392 HydrophobicContact CZ-CB 3.86Å; L388-A392 WeakPolarHBondContact O-CB 3.25Å; L388-A392 PolarHBondContact O-N 3.16Å; R389-A392 PolarHBondContact O-N 3.47Å; E390-A392 VanDerWaalsContact C-N 3.34Å; E390-A392 PolarHBondContact O-N 3.25Å; A392-D394 VanDerWaalsContact C-N 3.35Å; A392-F395 PolarHBondContact O-N 2.91Å; A392-L396 WeakPolarHBondContact O-CG 3.4Å; A392-L396 PolarHBondContact O-N 3.09Å; A392-L419 HydrophobicContact CB-CB 4.3Å; A392-L419 HydrophobicContact CB-CD1 4.06Å
393	L	92.9	Very high	91.4	Very high	36 Å²	36	56 Å²	56	19%	0.188	32%	0.319	C	S	.	.	H	α-helix	trans	-65.4	-39	176.4	-71.8	172.1	0	0	0	111.6	E376 V379 R389 E390 S391 L396 K397	E376-L393 HydrophobicContact CG-CD2 4.37Å; V379-L393 HydrophobicContact CB-CD2 4.02Å; V379-L393 HydrophobicContact CG1-CD2 3.69Å; V379-L393 HydrophobicContact CG1-CG 3.99Å; R389-L393 HydrophobicContact CG-CD1 4.35Å; R389-L393 WeakPolarHBondContact O-CG 3.35Å; R389-L393 PolarHBondContact O-N 2.97Å; E390-L393 PolarHBondContact O-N 3.04Å; S391-L393 PolarHBondContact O-N 3.04Å; L393-L396 PolarHBondContact O-N 3.09Å; L393-K397 WeakPolarHBondContact O-CG 3.24Å; L393-K397 PolarHBondContact O-N 3.44Å
394	D	91.6	Very high	91.5	Very high	85 Å²	85	58 Å²	58	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-70.3	-40.5	177.4	-71	-17	0	0	0	111.7	E390 S391 A392 L396 K397 S398	E390-D394 PolarHBondContact O-N 3.32Å; S391-D394 PolarHBondContact O-N 3.31Å; A392-D394 VanDerWaalsContact C-N 3.35Å; D394-L396 VanDerWaalsContact C-N 3.31Å; D394-L396 PolarHBondContact O-N 3.38Å; D394-K397 PolarHBondContact O-N 3.35Å; D394-K397 VanDerWaalsContact O-N 3.15Å; D394-K397 IonicContact OD1-NZ 3.09Å; D394-K397 PolarHBondContact OD1-NZ 3.42Å; D394-K397 VanDerWaalsContact OD1-NZ 3.09Å; D394-S398 PolarHBondContact O-N 2.61Å
395	F	92	Very high	91.8	Very high	22 Å²	22	53.1 Å²	53.1	10%	0.096	30%	0.295	C	S	.	.	H	α-helix	trans	-59.5	-40.2	170.4	-71.1	-36.3	0	0	0	112.4	S391 A392 S398 S399 L419 C422 E425 L428	S391-F395 WeakPolarHBondContact O-CB 3.2Å; S391-F395 WeakPolarHBondContact O-CD2 3.34Å; S391-F395 VanDerWaalsContact O-CG 3.29Å; S391-F395 WeakPolarHBondContact O-CG 3.34Å; S391-F395 PolarHBondContact O-N 3.12Å; S391-F395 WeakPolarHBondContact OG-CE2 3.45Å; A392-F395 PolarHBondContact O-N 2.91Å; F395-S398 PolarHBondContact O-N 3.25Å; F395-S398 PolarHBondContact O-OG 3.49Å; F395-S399 PolarHBondContact O-N 2.87Å; F395-S399 VanDerWaalsContact O-N 3.14Å; F395-L419 HydrophobicContact CB-CD2 3.73Å; F395-L419 HydrophobicContact CD2-CD2 4.09Å; F395-L419 HydrophobicContact CG-CD2 4.3Å; F395-C422 HydrophobicContact CE2-CB 4.42Å; F395-E425 HydrophobicContact CD1-CG 3.67Å; F395-E425 HydrophobicContact CE1-CG 3.64Å; F395-L428 HydrophobicContact CB-CD1 4.01Å; F395-L428 HydrophobicContact CB-CD2 4.25Å; F395-L428 HydrophobicContact CD1-CD1 4.14Å; F395-L428 HydrophobicContact CG-CD1 4.28Å; F395-L428 HydrophobicContact CG-CD2 4.43Å
396	L	91.6	Very high	92.1	Very high	6 Å²	6	49 Å²	49	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-39.7	174.5	-76.6	173.1	0	0	0	112.3	V375 V379 A392 L393 D394 S398 S399 L402 V415 L419	V375-L396 HydrophobicContact CG1-CD1 4.49Å; V379-L396 HydrophobicContact CG1-CD1 4.39Å; V379-L396 HydrophobicContact CG2-CD1 3.67Å; A392-L396 WeakPolarHBondContact O-CG 3.4Å; A392-L396 PolarHBondContact O-N 3.09Å; L393-L396 PolarHBondContact O-N 3.09Å; D394-L396 VanDerWaalsContact C-N 3.31Å; D394-L396 PolarHBondContact O-N 3.38Å; L396-S398 VanDerWaalsContact C-N 3.31Å; L396-S398 PolarHBondContact O-N 3.45Å; L396-S399 CarbonylContact O-C 3.58Å; L396-S399 PolarHBondContact O-N 3.31Å; L396-S399 VanDerWaalsContact O-O 3.13Å; L396-L402 HydrophobicContact CD2-CB 4.43Å; L396-V415 HydrophobicContact CD2-CG1 3.65Å; L396-L419 HydrophobicContact CD1-CD1 4.24Å; L396-L419 HydrophobicContact CD2-CD1 4.04Å; L396-L419 HydrophobicContact CG-CD1 3.8Å
397	K	90.4	Very high	92.3	Very high	142 Å²	142	46.4 Å²	46.4	62%	0.617	25%	0.252	S	S	*	.	H	α-helix	trans	-65	-36	174.7	-69	168.3	-165.4	159.4	0	111.8	L393 D394 S399	L393-K397 WeakPolarHBondContact O-CG 3.24Å; L393-K397 PolarHBondContact O-N 3.44Å; D394-K397 PolarHBondContact O-N 3.35Å; D394-K397 VanDerWaalsContact O-N 3.15Å; D394-K397 IonicContact OD1-NZ 3.09Å; D394-K397 PolarHBondContact OD1-NZ 3.42Å; D394-K397 VanDerWaalsContact OD1-NZ 3.09Å; K397-S399 VanDerWaalsContact C-N 3.34Å
398	S	89	Confident	92.6	Very high	59 Å²	59	44.8 Å²	44.8	41%	0.413	23%	0.233	S	C	.	.	H	α-helix	trans	-69.1	-29.1	178.2	79.4	0	0	0	0	113.3	D394 F395 L396	D394-S398 PolarHBondContact O-N 2.61Å; F395-S398 PolarHBondContact O-N 3.25Å; F395-S398 PolarHBondContact O-OG 3.49Å; L396-S398 VanDerWaalsContact C-N 3.31Å; L396-S398 PolarHBondContact O-N 3.45Å
399	S	88.9	Confident	92.8	Very high	20 Å²	20	42 Å²	42	14%	0.14	22%	0.219	C	C	.	.			trans	-113.8	97	-176.3	-176.9	0	0	0	0	112.2	F395 L396 K397 Y401 L402 N403	F395-S399 PolarHBondContact O-N 2.87Å; F395-S399 VanDerWaalsContact O-N 3.14Å; L396-S399 CarbonylContact O-C 3.58Å; L396-S399 PolarHBondContact O-N 3.31Å; L396-S399 VanDerWaalsContact O-O 3.13Å; K397-S399 VanDerWaalsContact C-N 3.34Å; S399-Y401 VanDerWaalsContact C-N 3.33Å; S399-Y401 PolarHBondContact O-N 2.92Å; S399-L402 PolarHBondContact O-N 3.21Å; S399-L402 WeakPolarHBondContact OG-CG 3.29Å; S399-N403 PolarHBondContact O-N 3.32Å; S399-N403 VanDerWaalsContact O-N 3.14Å
400	S	89.6	Confident	92.8	Very high	66 Å²	66	39.1 Å²	39.1	46%	0.462	21%	0.213	S	C	.	.	H	α-helix	trans	-57.3	-42.7	-178.5	58.7	0	0	0	0	113	L404 F663	S400-L404 WeakPolarHBondContact O-CD1 3.43Å; S400-L404 WeakPolarHBondContact O-CG 3.48Å; S400-L404 PolarHBondContact O-N 3.5Å; S400-L404 VanDerWaalsContact O-N 3.1Å; S400-F663 WeakPolarHBondContact OG-CE2 3.49Å
401	Y	92.9	Very high	92.9	Very high	8 Å²	8	33.2 Å²	33.2	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-42.9	-177.3	-173.4	-114.8	0	0	0	112.3	S399 N403 L404 L405 R430 Y621 E622 P660 F663 T664	S399-Y401 VanDerWaalsContact C-N 3.33Å; S399-Y401 PolarHBondContact O-N 2.92Å; Y401-N403 VanDerWaalsContact C-N 3.33Å; Y401-N403 PolarHBondContact O-N 3.45Å; Y401-L404 PolarHBondContact O-N 3.47Å; Y401-L405 HydrophobicContact CD1-CD1 4.04Å; Y401-L405 HydrophobicContact CD1-CG 4.29Å; Y401-L405 HydrophobicContact CE1-CD1 3.79Å; Y401-L405 HydrophobicContact CE1-CD2 4.14Å; Y401-L405 HydrophobicContact CE1-CG 4.08Å; Y401-L405 HydrophobicContact CE2-CD2 4.39Å; Y401-L405 WeakPolarHBondContact O-CG 3.42Å; Y401-L405 PolarHBondContact O-N 3.27Å; Y401-R430 WeakPolarHBondContact CD1-O 3.42Å; Y401-Y621 AromaticContact CD1-CE1 3.96Å; Y401-Y621 HydrophobicContact CD1-CE1 3.96Å; Y401-Y621 HydrophobicContact CD2-CE1 4.15Å; Y401-Y621 AromaticContact CE1-CE1 3.63Å; Y401-Y621 HydrophobicContact CE1-CE1 3.63Å; Y401-Y621 HydrophobicContact CE2-CD1 4.41Å; Y401-Y621 AromaticContact CE2-CE1 3.84Å; Y401-Y621 HydrophobicContact CE2-CE1 3.84Å; Y401-Y621 HydrophobicContact CG-CE1 4.19Å; Y401-Y621 AromaticContact CZ-CE1 3.54Å; Y401-E622 PolarHBondContact OH-OE1 3.04Å; Y401-P660 HydrophobicContact CE2-CB 4.09Å; Y401-F663 HydrophobicContact CD2-CB 4.19Å; Y401-F663 AromaticContact CD2-CD1 3.35Å; Y401-F663 HydrophobicContact CD2-CD1 3.35Å; Y401-F663 AromaticContact CD2-CE1 3.88Å; Y401-F663 HydrophobicContact CD2-CE1 3.88Å; Y401-F663 AromaticContact CD2-CG 3.86Å; Y401-F663 HydrophobicContact CD2-CG 3.86Å; Y401-F663 HydrophobicContact CE2-CD1 4.04Å; Y401-F663 HydrophobicContact CG-CD1 4.09Å; Y401-F663 HydrophobicContact CG-CE1 4.17Å; Y401-T664 HydrophobicContact CE2-CG2 4.21Å
402	L	93.4	Very high	93.1	Very high	2 Å²	2	31 Å²	31	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-40.2	177.9	-69.4	-177.2	0	0	0	112.1	L396 S399 L404 L405 C406 V415 L428 P429	L396-L402 HydrophobicContact CD2-CB 4.43Å; S399-L402 PolarHBondContact O-N 3.21Å; S399-L402 WeakPolarHBondContact OG-CG 3.29Å; L402-L404 VanDerWaalsContact C-N 3.32Å; L402-L404 PolarHBondContact O-N 2.97Å; L402-L405 HydrophobicContact CD2-CD1 4.09Å; L402-L405 PolarHBondContact O-N 3.43Å; L402-C406 PolarHBondContact O-N 2.91Å; L402-C406 PolarHBondContact O-SG 3.48Å; L402-V415 HydrophobicContact CD2-CG2 4.37Å; L402-L428 HydrophobicContact CD1-CB 4.19Å; L402-L428 HydrophobicContact CD1-CD2 4.29Å; L402-P429 HydrophobicContact CD1-CG 4.08Å; L402-P429 WeakPolarHBondContact CD1-O 3.49Å; L402-P429 HydrophobicContact CD2-CB 4.48Å; L402-P429 HydrophobicContact CD2-CG 4.01Å; L402-P429 VanDerWaalsContact CD2-O 3.3Å; L402-P429 WeakPolarHBondContact CD2-O 3.11Å; L402-P429 VanDerWaalsContact CG-O 3.28Å; L402-P429 WeakPolarHBondContact CG-O 3.48Å
403	N	94.8	Very high	93.2	Very high	62 Å²	62	32.6 Å²	32.6	33%	0.332	18%	0.177	S	C	.	.	H	α-helix	trans	-61.1	-42.7	174.6	-167.8	12.3	0	0	0	111.4	S399 Y401 L405 C406	S399-N403 PolarHBondContact O-N 3.32Å; S399-N403 VanDerWaalsContact O-N 3.14Å; Y401-N403 VanDerWaalsContact C-N 3.33Å; Y401-N403 PolarHBondContact O-N 3.45Å; N403-L405 PolarHBondContact O-N 3.03Å; N403-C406 VanDerWaalsContact O-CB 3.28Å; N403-C406 WeakPolarHBondContact O-CB 3.4Å; N403-C406 PolarHBondContact O-N 3.11Å; N403-C406 VanDerWaalsContact O-N 3.12Å
404	L	95.4	Very high	93.2	Very high	50 Å²	50	31 Å²	31	26%	0.262	17%	0.169	S	C	.	.	H	α-helix	trans	-67.4	-33.2	177	-65.4	168.9	0	0	0	112.8	S400 Y401 L402 C406 W407 P659 P660 F663	S400-L404 WeakPolarHBondContact O-CD1 3.43Å; S400-L404 WeakPolarHBondContact O-CG 3.48Å; S400-L404 PolarHBondContact O-N 3.5Å; S400-L404 VanDerWaalsContact O-N 3.1Å; Y401-L404 PolarHBondContact O-N 3.47Å; L402-L404 VanDerWaalsContact C-N 3.32Å; L402-L404 PolarHBondContact O-N 2.97Å; L404-C406 PolarHBondContact O-N 3.16Å; L404-W407 VanDerWaalsContact O-CB 3.25Å; L404-W407 WeakPolarHBondContact O-CB 3.25Å; L404-W407 PolarHBondContact O-N 2.81Å; L404-P659 HydrophobicContact CB-CB 4.3Å; L404-P659 HydrophobicContact CD2-CB 3.7Å; L404-P660 HydrophobicContact CB-CG 4.44Å; L404-P660 WeakPolarHBondContact O-CG 3.17Å; L404-F663 HydrophobicContact CD1-CB 3.78Å; L404-F663 HydrophobicContact CD1-CD2 3.78Å; L404-F663 HydrophobicContact CD1-CG 4.08Å
405	L	95.4	Very high	93.4	Very high	3 Å²	3	27 Å²	27	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-31.6	172.3	-68.4	177.6	0	0	0	111.8	Y401 L402 N403 W407 N408 L411 L435 P660	Y401-L405 HydrophobicContact CD1-CD1 4.04Å; Y401-L405 HydrophobicContact CD1-CG 4.29Å; Y401-L405 HydrophobicContact CE1-CD1 3.79Å; Y401-L405 HydrophobicContact CE1-CD2 4.14Å; Y401-L405 HydrophobicContact CE1-CG 4.08Å; Y401-L405 HydrophobicContact CE2-CD2 4.39Å; Y401-L405 WeakPolarHBondContact O-CG 3.42Å; Y401-L405 PolarHBondContact O-N 3.27Å; L402-L405 HydrophobicContact CD2-CD1 4.09Å; L402-L405 PolarHBondContact O-N 3.43Å; N403-L405 PolarHBondContact O-N 3.03Å; L405-W407 PolarHBondContact O-N 2.99Å; L405-W407 VanDerWaalsContact O-N 3.11Å; L405-N408 PolarHBondContact O-N 3.21Å; L405-L411 HydrophobicContact CB-CB 4.43Å; L405-L411 HydrophobicContact CB-CD1 4.28Å; L405-L411 HydrophobicContact CD2-CD1 3.99Å; L405-L411 WeakPolarHBondContact O-CB 3.46Å; L405-L435 HydrophobicContact CD1-CD2 4.07Å; L405-P660 HydrophobicContact CD2-CB 3.97Å; L405-P660 HydrophobicContact CD2-CG 3.92Å
406	C	96	Very high	93.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-10.9	178.5	-63.4	0	0	0	0	113.7	F370 V375 L402 N403 L404 N408 C412	F370-C406 WeakPolarHBondContact CD2-O 3.11Å; V375-C406 HydrophobicContact CB-CB 4.41Å; V375-C406 HydrophobicContact CG1-CB 3.66Å; V375-C406 HydrophobicContact CG2-CB 3.78Å; L402-C406 PolarHBondContact O-N 2.91Å; L402-C406 PolarHBondContact O-SG 3.48Å; N403-C406 VanDerWaalsContact O-CB 3.28Å; N403-C406 WeakPolarHBondContact O-CB 3.4Å; N403-C406 PolarHBondContact O-N 3.11Å; N403-C406 VanDerWaalsContact O-N 3.12Å; L404-C406 PolarHBondContact O-N 3.16Å; C406-N408 PolarHBondContact O-N 3.24Å; C406-C412 HydrophobicContact CB-CB 3.9Å
407	W	95.1	Very high	93.5	Very high	30 Å²	30	26.6 Å²	26.6	11%	0.114	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.1	166.7	178.1	79.3	0	0	0	112.2	M215 G369 F370 L404 L405 P409 N658 P659	M215-W407 HydrophobicContact CE-CE3 3.76Å; M215-W407 HydrophobicContact CE-CH2 3.46Å; M215-W407 VanDerWaalsContact CE-CH2 3.46Å; M215-W407 HydrophobicContact CE-CZ2 4.5Å; M215-W407 HydrophobicContact CE-CZ3 3.03Å; M215-W407 HydrophobicContact SD-CE3 4.49Å; M215-W407 HydrophobicContact SD-CH2 4.12Å; M215-W407 HydrophobicContact SD-CZ3 4.04Å; G369-W407 CarbonylContact C-O 3.57Å; G369-W407 VanDerWaalsContact CA-CE2 3.49Å; G369-W407 WeakPolarHBondContact CA-O 3.47Å; F370-W407 PolarHBondContact N-O 2.85Å; L404-W407 VanDerWaalsContact O-CB 3.25Å; L404-W407 WeakPolarHBondContact O-CB 3.25Å; L404-W407 PolarHBondContact O-N 2.81Å; L405-W407 PolarHBondContact O-N 2.99Å; L405-W407 VanDerWaalsContact O-N 3.11Å; W407-P409 WeakPolarHBondContact O-CD 3.26Å; W407-N658 HydrophobicContact CE3-CB 4.12Å; W407-N658 HydrophobicContact CH2-CB 4.11Å; W407-N658 WeakPolarHBondContact CH2-OD1 3.3Å; W407-N658 HydrophobicContact CZ3-CB 3.63Å; W407-N658 WeakPolarHBondContact CZ3-OD1 3.47Å; W407-P659 HydrophobicContact CB-CG 4.07Å; W407-P659 HydrophobicContact CD2-CG 4.04Å; W407-P659 HydrophobicContact CG-CG 3.7Å
408	N	95	Very high	93.6	Very high	11 Å²	11	19.9 Å²	19.9	6%	0.059	12%	0.12	C	C	.	.	S	Bend	trans	-88.8	118.5	171.2	-176.4	-56.9	0	0	0	109.7	A213 G214 M215 L405 C406 A410 L411 C412	A213-N408 PolarHBondContact O-ND2 3.5Å; G214-N408 VanDerWaalsContact C-OD1 3.28Å; G214-N408 PolarHBondContact O-OD1 2.81Å; G214-N408 VanDerWaalsContact O-OD1 3.09Å; M215-N408 HydrophobicContact CE-CB 4.3Å; M215-N408 WeakPolarHBondContact CE-ND2 3.42Å; L405-N408 PolarHBondContact O-N 3.21Å; C406-N408 PolarHBondContact O-N 3.24Å; N408-A410 VanDerWaalsContact C-N 3.3Å; N408-A410 PolarHBondContact O-N 3.04Å; N408-A410 PolarHBondContact OD1-N 2.94Å; N408-A410 VanDerWaalsContact OD1-N 3.09Å; N408-L411 HydrophobicContact CB-CB 4.05Å; N408-L411 HydrophobicContact CB-CD1 3.94Å; N408-L411 HydrophobicContact CB-CG 4.02Å; N408-L411 PolarHBondContact O-N 3.44Å; N408-L411 PolarHBondContact OD1-N 2.92Å; N408-C412 PolarHBondContact O-N 3.49Å
409	P	94.4	Very high	93.8	Very high	19 Å²	19	17.6 Å²	17.6	12%	0.123	10%	0.103	C	C	.	.	H	α-helix	trans	-55.2	-39.1	-176.5	-29.1	36	0	0	0	114.9	F370 W407 C412 H413	F370-P409 HydrophobicContact CD1-CG 4Å; F370-P409 HydrophobicContact CD2-CB 4.31Å; F370-P409 HydrophobicContact CD2-CG 4.16Å; F370-P409 HydrophobicContact CE1-CB 4.22Å; F370-P409 HydrophobicContact CE1-CG 3.84Å; F370-P409 HydrophobicContact CE2-CB 3.75Å; F370-P409 HydrophobicContact CE2-CG 4Å; F370-P409 HydrophobicContact CG-CG 4.16Å; F370-P409 HydrophobicContact CZ-CB 3.7Å; F370-P409 HydrophobicContact CZ-CG 3.84Å; W407-P409 WeakPolarHBondContact O-CD 3.26Å; P409-C412 WeakPolarHBondContact O-CB 3.42Å; P409-C412 PolarHBondContact O-N 3.26Å; P409-H413 PolarHBondContact O-N 3.28Å
410	A	93.3	Very high	93.7	Very high	19 Å²	19	21.5 Å²	21.5	16%	0.157	12%	0.119	C	C	.	.	H	α-helix	trans	-71.2	-31.8	178.3	0	0	0	0	0	112.6	G214 N408 L414 F514	G214-A410 VanDerWaalsContact CA-CB 3.46Å; G214-A410 WeakPolarHBondContact O-CB 3.32Å; G214-A410 PolarHBondContact O-N 3.25Å; N408-A410 VanDerWaalsContact C-N 3.3Å; N408-A410 PolarHBondContact O-N 3.04Å; N408-A410 PolarHBondContact OD1-N 2.94Å; N408-A410 VanDerWaalsContact OD1-N 3.09Å; A410-L414 WeakPolarHBondContact O-CG 3.21Å; A410-L414 PolarHBondContact O-N 3.4Å; A410-F514 HydrophobicContact CB-CD2 4.43Å; A410-F514 HydrophobicContact CB-CE2 3.99Å
411	L	95.4	Very high	93.3	Very high	9 Å²	9	22.8 Å²	22.8	5%	0.047	12%	0.118	C	C	.	.	H	α-helix	trans	-73.7	-38.6	171.2	-67.1	-179.9	0	0	0	111.4	L405 N408 H413 L414 V415 L432 F514	L405-L411 HydrophobicContact CB-CB 4.43Å; L405-L411 HydrophobicContact CB-CD1 4.28Å; L405-L411 HydrophobicContact CD2-CD1 3.99Å; L405-L411 WeakPolarHBondContact O-CB 3.46Å; N408-L411 HydrophobicContact CB-CB 4.05Å; N408-L411 HydrophobicContact CB-CD1 3.94Å; N408-L411 HydrophobicContact CB-CG 4.02Å; N408-L411 PolarHBondContact O-N 3.44Å; N408-L411 PolarHBondContact OD1-N 2.92Å; L411-H413 PolarHBondContact O-N 3.3Å; L411-L414 HydrophobicContact CD2-CD1 4.14Å; L411-L414 CarbonylContact O-C 3.38Å; L411-L414 PolarHBondContact O-N 2.9Å; L411-V415 WeakPolarHBondContact O-CG2 3.49Å; L411-V415 PolarHBondContact O-N 2.94Å; L411-L432 HydrophobicContact CD1-CD1 4.33Å; L411-L432 HydrophobicContact CD2-CD1 3.58Å; L411-F514 HydrophobicContact CD1-CE1 4.02Å; L411-F514 HydrophobicContact CD1-CZ 4.02Å; L411-F514 HydrophobicContact CD2-CB 4.2Å; L411-F514 HydrophobicContact CD2-CD1 3.61Å; L411-F514 HydrophobicContact CD2-CD2 3.56Å; L411-F514 HydrophobicContact CD2-CE1 3.79Å; L411-F514 HydrophobicContact CD2-CE2 3.73Å; L411-F514 HydrophobicContact CD2-CG 3.5Å; L411-F514 HydrophobicContact CD2-CZ 3.85Å; L411-F514 HydrophobicContact CG-CD1 4.33Å; L411-F514 HydrophobicContact CG-CD2 4.11Å; L411-F514 HydrophobicContact CG-CE1 3.99Å; L411-F514 HydrophobicContact CG-CE2 3.74Å; L411-F514 HydrophobicContact CG-CG 4.39Å; L411-F514 HydrophobicContact CG-CZ 3.69Å
412	C	95.5	Very high	92.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-54.2	-42.5	173.3	-168.2	0	0	0	0	111.1	F370 Y378 C406 N408 P409 V415 C416	F370-C412 HydrophobicContact CD2-CB 4.19Å; F370-C412 HydrophobicContact CE2-CB 4.16Å; Y378-C412 HydrophobicContact CD1-CB 4.43Å; Y378-C412 VanDerWaalsContact CD1-SG 3.52Å; C406-C412 HydrophobicContact CB-CB 3.9Å; N408-C412 PolarHBondContact O-N 3.49Å; P409-C412 WeakPolarHBondContact O-CB 3.42Å; P409-C412 PolarHBondContact O-N 3.26Å; C412-V415 PolarHBondContact O-N 2.94Å; C412-C416 PolarHBondContact O-N 3.22Å; C412-C416 PolarHBondContact O-SG 3.01Å
413	H	93.9	Very high	91.9	Very high	35 Å²	35	32.5 Å²	32.5	16%	0.162	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-45.9	173.4	-179.9	77.1	0	0	0	113	Y378 Y382 P409 L411 V415 C416 A417	Y378-H413 PolarHBondContact OH-ND1 3.43Å; Y382-H413 AromaticContact CE2-CE1 3.79Å; Y382-H413 AromaticContact CE2-ND1 3.66Å; P409-H413 PolarHBondContact O-N 3.28Å; L411-H413 PolarHBondContact O-N 3.3Å; H413-V415 VanDerWaalsContact C-N 3.32Å; H413-V415 PolarHBondContact O-N 2.89Å; H413-C416 PolarHBondContact O-N 3.01Å; H413-A417 PolarHBondContact O-N 3.03Å
414	L	94.6	Very high	91.3	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-63.4	-38.3	176.7	-65.2	-177.8	0	0	0	111.9	A410 L411 A417 A418 L435 V439 F514 L515	A410-L414 WeakPolarHBondContact O-CG 3.21Å; A410-L414 PolarHBondContact O-N 3.4Å; L411-L414 HydrophobicContact CD2-CD1 4.14Å; L411-L414 CarbonylContact O-C 3.38Å; L411-L414 PolarHBondContact O-N 2.9Å; L414-A417 PolarHBondContact O-N 2.95Å; L414-A418 PolarHBondContact O-N 3.05Å; L414-L435 HydrophobicContact CB-CD2 4.27Å; L414-L435 HydrophobicContact CB-CG 4.41Å; L414-V439 HydrophobicContact CB-CG2 4.26Å; L414-V439 HydrophobicContact CD2-CG1 3.87Å; L414-V439 WeakPolarHBondContact O-CG2 3.33Å; L414-F514 HydrophobicContact CD1-CB 4.08Å; L414-L515 HydrophobicContact CD2-CD1 4.2Å; L414-L515 HydrophobicContact CD2-CG 4.29Å
415	V	95.6	Very high	90.3	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-63.2	-46.7	174.9	174.8	0	0	0	0	110.3	L396 L402 L411 C412 H413 A417 A418 L419 L435	L396-V415 HydrophobicContact CD2-CG1 3.65Å; L402-V415 HydrophobicContact CD2-CG2 4.37Å; L411-V415 WeakPolarHBondContact O-CG2 3.49Å; L411-V415 PolarHBondContact O-N 2.94Å; C412-V415 PolarHBondContact O-N 2.94Å; H413-V415 VanDerWaalsContact C-N 3.32Å; H413-V415 PolarHBondContact O-N 2.89Å; V415-A417 VanDerWaalsContact C-N 3.33Å; V415-A417 PolarHBondContact O-N 2.86Å; V415-A418 PolarHBondContact O-N 3.09Å; V415-A418 VanDerWaalsContact O-N 3.11Å; V415-L419 HydrophobicContact CG1-CD1 3.77Å; V415-L419 HydrophobicContact CG1-CG 4.14Å; V415-L419 WeakPolarHBondContact O-CB 3.43Å; V415-L419 VanDerWaalsContact O-CG 3.27Å; V415-L419 WeakPolarHBondContact O-CG 3.35Å; V415-L419 PolarHBondContact O-N 3.09Å; V415-L435 HydrophobicContact CG2-CD1 4.08Å; V415-L435 HydrophobicContact CG2-CD2 3.6Å
416	C	94.3	Very high	89.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-44.7	175.5	-64.2	0	0	0	0	111.7	Y382 F383 C412 H413 A418 L419 E420	Y382-C416 HydrophobicContact CD1-CB 3.58Å; Y382-C416 HydrophobicContact CD2-CB 4.1Å; Y382-C416 HydrophobicContact CE1-CB 3.57Å; Y382-C416 HydrophobicContact CE2-CB 4.1Å; Y382-C416 HydrophobicContact CG-CB 3.84Å; F383-C416 HydrophobicContact CE2-CB 4.1Å; F383-C416 HydrophobicContact CZ-CB 4.2Å; F383-C416 WeakPolarHBondContact CZ-O 3.44Å; C412-C416 PolarHBondContact O-N 3.22Å; C412-C416 PolarHBondContact O-SG 3.01Å; H413-C416 PolarHBondContact O-N 3.01Å; C416-A418 VanDerWaalsContact C-N 3.29Å; C416-A418 PolarHBondContact O-N 2.86Å; C416-L419 PolarHBondContact O-N 3.09Å; C416-E420 PolarHBondContact O-N 2.93Å
417	A	91.8	Very high	88.5	Confident	18 Å²	18	42 Å²	42	15%	0.149	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-35.5	176.2	0	0	0	0	0	112.8	H413 L414 V415 L442	H413-A417 PolarHBondContact O-N 3.03Å; L414-A417 PolarHBondContact O-N 2.95Å; V415-A417 VanDerWaalsContact C-N 3.33Å; V415-A417 PolarHBondContact O-N 2.86Å; A417-L442 WeakPolarHBondContact O-CD1 3.44Å
418	A	92.2	Very high	88.1	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.017	23%	0.231	C	C	.	.	H	α-helix	trans	-72.1	-38.4	174.8	0	0	0	0	0	112.3	L414 V415 C416 C422 L435 V439	L414-A418 PolarHBondContact O-N 3.05Å; V415-A418 PolarHBondContact O-N 3.09Å; V415-A418 VanDerWaalsContact O-N 3.11Å; C416-A418 VanDerWaalsContact C-N 3.29Å; C416-A418 PolarHBondContact O-N 2.86Å; A418-C422 PolarHBondContact O-SG 3.45Å; A418-L435 HydrophobicContact CB-CD1 3.73Å; A418-V439 HydrophobicContact CB-CG2 4.09Å
419	L	91.9	Very high	87.8	Confident	10 Å²	10	41.2 Å²	41.2	5%	0.052	23%	0.23	C	C	.	.	H	α-helix	trans	-69.3	-32.5	-179.8	-70.8	174.8	0	0	0	112.7	F383 A392 F395 L396 V415 C416 Q421 C422 L428	F383-L419 HydrophobicContact CZ-CB 4.12Å; A392-L419 HydrophobicContact CB-CB 4.3Å; A392-L419 HydrophobicContact CB-CD1 4.06Å; F395-L419 HydrophobicContact CB-CD2 3.73Å; F395-L419 HydrophobicContact CD2-CD2 4.09Å; F395-L419 HydrophobicContact CG-CD2 4.3Å; L396-L419 HydrophobicContact CD1-CD1 4.24Å; L396-L419 HydrophobicContact CD2-CD1 4.04Å; L396-L419 HydrophobicContact CG-CD1 3.8Å; V415-L419 HydrophobicContact CG1-CD1 3.77Å; V415-L419 HydrophobicContact CG1-CG 4.14Å; V415-L419 WeakPolarHBondContact O-CB 3.43Å; V415-L419 VanDerWaalsContact O-CG 3.27Å; V415-L419 WeakPolarHBondContact O-CG 3.35Å; V415-L419 PolarHBondContact O-N 3.09Å; C416-L419 PolarHBondContact O-N 3.09Å; L419-Q421 PolarHBondContact O-N 3.38Å; L419-C422 PolarHBondContact O-N 2.79Å; L419-L428 HydrophobicContact CD2-CD2 3.4Å; L419-L428 VanDerWaalsContact CD2-CD2 3.4Å
420	E	87.8	Confident	87.6	Confident	102 Å²	102	47.9 Å²	47.9	48%	0.477	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-28.6	178.1	-168.7	178.4	-158.8	0	0	113.3	F383 C416	F383-E420 HydrophobicContact CE1-CB 4.08Å; F383-E420 HydrophobicContact CE1-CG 4.41Å; C416-E420 PolarHBondContact O-N 2.93Å
421	Q	81.6	Confident	87.6	Confident	93 Å²	93	47.1 Å²	47.1	44%	0.435	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	6.1	-179.7	-56.7	-156.8	17.7	0	0	114.2	L419 K423 L442	L419-Q421 PolarHBondContact O-N 3.38Å; Q421-K423 PolarHBondContact O-N 3.46Å; Q421-L442 HydrophobicContact CB-CD1 4.34Å; Q421-L442 HydrophobicContact CB-CD2 4.15Å; Q421-L442 HydrophobicContact CG-CD1 4.26Å; Q421-L442 HydrophobicContact CG-CD2 4.14Å
422	C	81	Confident	87.5	Confident	13 Å²	13	47 Å²	47	9%	0.088	25%	0.246	C	C	.	.			trans	-80.3	122.4	178.1	-78.4	0	0	0	0	111.2	F395 A418 L419 L428 K438	F395-C422 HydrophobicContact CE2-CB 4.42Å; A418-C422 PolarHBondContact O-SG 3.45Å; L419-C422 PolarHBondContact O-N 2.79Å; C422-L428 HydrophobicContact CB-CD2 4.29Å; C422-K438 PolarHBondContact SG-NZ 2.77Å; C422-K438 VanDerWaalsContact SG-NZ 3.38Å
423	K	75.8	Confident	87.5	Confident	202 Å²	202	47 Å²	47	88%	0.878	25%	0.246	S	C	*	.			trans	-96.5	-13	178.3	-61.2	-177.6	-179.3	178.6	0	113.7	Q421	Q421-K423 PolarHBondContact O-N 3.46Å
424	S	80.8	Confident	87.5	Confident	62 Å²	62	46 Å²	46	43%	0.434	24%	0.244	S	C	.	.	S	Bend	trans	-157.8	150.3	-175.2	176.8	0	0	0	0	110.7	A426 A427	S424-A426 PolarHBondContact O-N 2.83Å; S424-A426 PolarHBondContact OG-N 3Å; S424-A427 PolarHBondContact O-N 3.07Å; S424-A427 VanDerWaalsContact O-N 3.12Å
425	E	75.4	Confident	87.5	Confident	119 Å²	119	45.8 Å²	45.8	56%	0.556	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-55.7	-35.8	173.6	-67.3	-175.5	170.1	0	0	113.1	F395 A427 L428	F395-E425 HydrophobicContact CD1-CG 3.67Å; F395-E425 HydrophobicContact CE1-CG 3.64Å; E425-A427 PolarHBondContact O-N 2.66Å; E425-A427 VanDerWaalsContact O-N 3.14Å; E425-L428 HydrophobicContact CB-CD1 4.4Å; E425-L428 VanDerWaalsContact O-CB 3.3Å; E425-L428 WeakPolarHBondContact O-CB 3.28Å; E425-L428 WeakPolarHBondContact O-CG 3.22Å; E425-L428 PolarHBondContact O-N 2.88Å
426	A	74.2	Confident	87.4	Confident	88 Å²	88	45.8 Å²	45.8	73%	0.727	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-63.7	-21.6	-179.6	0	0	0	0	0	113.1	S424 L428	S424-A426 PolarHBondContact O-N 2.83Å; S424-A426 PolarHBondContact OG-N 3Å; A426-L428 VanDerWaalsContact C-N 3.35Å
427	A	79.7	Confident	87.4	Confident	46 Å²	46	46 Å²	46	38%	0.38	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-90.6	4	179	0	0	0	0	0	113.3	S424 E425 K438	S424-A427 PolarHBondContact O-N 3.07Å; S424-A427 VanDerWaalsContact O-N 3.12Å; E425-A427 PolarHBondContact O-N 2.66Å; E425-A427 VanDerWaalsContact O-N 3.14Å; A427-K438 PolarHBondContact O-NZ 3.33Å
428	L	85.9	Confident	87.4	Confident	15 Å²	15	47.6 Å²	47.6	8%	0.079	25%	0.247	C	C	.	.	S	Bend	trans	-75.8	133.6	-179.5	-69	172.6	0	0	0	111.3	F395 L402 L419 C422 E425 A426 R430	F395-L428 HydrophobicContact CB-CD1 4.01Å; F395-L428 HydrophobicContact CB-CD2 4.25Å; F395-L428 HydrophobicContact CD1-CD1 4.14Å; F395-L428 HydrophobicContact CG-CD1 4.28Å; F395-L428 HydrophobicContact CG-CD2 4.43Å; L402-L428 HydrophobicContact CD1-CB 4.19Å; L402-L428 HydrophobicContact CD1-CD2 4.29Å; L419-L428 HydrophobicContact CD2-CD2 3.4Å; L419-L428 VanDerWaalsContact CD2-CD2 3.4Å; C422-L428 HydrophobicContact CB-CD2 4.29Å; E425-L428 HydrophobicContact CB-CD1 4.4Å; E425-L428 VanDerWaalsContact O-CB 3.3Å; E425-L428 WeakPolarHBondContact O-CB 3.28Å; E425-L428 WeakPolarHBondContact O-CG 3.22Å; E425-L428 PolarHBondContact O-N 2.88Å; A426-L428 VanDerWaalsContact C-N 3.35Å; L428-R430 PolarHBondContact O-N 3.39Å
429	P	89.8	Confident	87.4	Confident	8 Å²	8	47.7 Å²	47.7	5%	0.052	25%	0.248	C	C	.	.			trans	-63.8	134.8	175.4	21.5	-26.8	0	0	0	111	L402 A434 L435	L402-P429 HydrophobicContact CD1-CG 4.08Å; L402-P429 WeakPolarHBondContact CD1-O 3.49Å; L402-P429 HydrophobicContact CD2-CB 4.48Å; L402-P429 HydrophobicContact CD2-CG 4.01Å; L402-P429 VanDerWaalsContact CD2-O 3.3Å; L402-P429 WeakPolarHBondContact CD2-O 3.11Å; L402-P429 VanDerWaalsContact CG-O 3.28Å; L402-P429 WeakPolarHBondContact CG-O 3.48Å; P429-A434 HydrophobicContact CB-CB 3.76Å; P429-L435 HydrophobicContact CB-CB 4.05Å; P429-L435 HydrophobicContact CG-CB 4.09Å; P429-L435 HydrophobicContact CG-CD1 3.91Å
430	R	89.4	Confident	87.3	Confident	159 Å²	159	47.3 Å²	47.3	60%	0.6	25%	0.245	S	C	*	.			trans	-97.4	-15.3	179.6	-62.3	-175.7	-179.2	-177.1	-0.9	113.8	Y401 L428 Y621 F625	Y401-R430 WeakPolarHBondContact CD1-O 3.42Å; L428-R430 PolarHBondContact O-N 3.39Å; R430-Y621 PolarHBondContact O-OH 2.81Å; R430-F625 HydrophobicContact CB-CD1 3.96Å; R430-F625 HydrophobicContact CB-CE1 3.85Å; R430-F625 HydrophobicContact CB-CG 4.38Å; R430-F625 HydrophobicContact CB-CZ 4.16Å; R430-F625 HydrophobicContact CG-CD1 4.5Å; R430-F625 HydrophobicContact CG-CE1 4.39Å
431	T	93	Very high	87.4	Confident	4 Å²	4	44 Å²	44	3%	0.025	23%	0.233	C	C	.	.	S	Bend	trans	-129.9	162.8	-177.6	65.9	0	0	0	0	110.8	T433 A434 L435 Y621 E622 F625	T431-T433 PolarHBondContact O-N 3.4Å; T431-A434 PolarHBondContact O-N 3.03Å; T431-A434 WeakPolarHBondContact OG1-CB 3.35Å; T431-A434 PolarHBondContact OG1-N 2.88Å; T431-L435 PolarHBondContact O-N 3.35Å; T431-Y621 HydrophobicContact CG2-CE1 4.17Å; T431-E622 WeakPolarHBondContact CB-OE2 3.29Å; T431-F625 HydrophobicContact CG2-CB 4.29Å; T431-F625 HydrophobicContact CG2-CD2 3.1Å; T431-F625 HydrophobicContact CG2-CE2 3.51Å; T431-F625 HydrophobicContact CG2-CG 3.87Å
432	L	94.6	Very high	87.7	Confident	6 Å²	6	40.6 Å²	40.6	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-37.1	173.8	176.6	58	0	0	0	110.4	L411 L435 C436 F514 L558 E622	L411-L432 HydrophobicContact CD1-CD1 4.33Å; L411-L432 HydrophobicContact CD2-CD1 3.58Å; L432-L435 HydrophobicContact CD1-CD2 4.39Å; L432-L435 PolarHBondContact O-N 3.01Å; L432-C436 PolarHBondContact O-N 2.92Å; L432-C436 PolarHBondContact O-SG 3.04Å; L432-F514 HydrophobicContact CD2-CD1 4.49Å; L432-L558 HydrophobicContact CD2-CD1 3.61Å; L432-E622 VanDerWaalsContact CB-OE1 3.3Å; L432-E622 WeakPolarHBondContact CB-OE1 3.46Å; L432-E622 PolarHBondContact N-OE1 2.95Å; L432-E622 PolarHBondContact N-OE2 3.36Å
433	T	94.8	Very high	88	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-58.9	-48.8	174.8	-58.1	0	0	0	0	111.6	T431 L435 C436 H437 Y518 I562 L566 E622	T431-T433 PolarHBondContact O-N 3.4Å; T433-L435 VanDerWaalsContact C-N 3.33Å; T433-L435 PolarHBondContact O-N 3.19Å; T433-C436 PolarHBondContact O-N 2.79Å; T433-H437 WeakPolarHBondContact O-CB 3.3Å; T433-H437 PolarHBondContact O-N 3.37Å; T433-Y518 HydrophobicContact CG2-CE2 4.35Å; T433-I562 HydrophobicContact CG2-CG2 4Å; T433-I562 WeakPolarHBondContact OG1-CA 3.48Å; T433-L566 HydrophobicContact CG2-CD2 3.96Å; T433-L566 HydrophobicContact CG2-CG 3.82Å; T433-E622 VanDerWaalsContact CB-OE2 3.23Å; T433-E622 WeakPolarHBondContact CB-OE2 3.13Å; T433-E622 PolarHBondContact N-OE2 2.88Å; T433-E622 PolarHBondContact OG1-OE2 3.16Å
434	A	93.1	Very high	88.5	Confident	13 Å²	13	33.5 Å²	33.5	11%	0.107	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-37.5	178.8	0	0	0	0	0	111.9	P429 T431 H437 K438	P429-A434 HydrophobicContact CB-CB 3.76Å; T431-A434 PolarHBondContact O-N 3.03Å; T431-A434 WeakPolarHBondContact OG1-CB 3.35Å; T431-A434 PolarHBondContact OG1-N 2.88Å; A434-H437 PolarHBondContact O-N 3.25Å; A434-K438 WeakPolarHBondContact O-CB 3.27Å; A434-K438 PolarHBondContact O-N 2.67Å
435	L	94.4	Very high	88.5	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.5	-51.3	175.1	174.9	64.6	0	0	0	111.1	L405 L414 V415 A418 P429 T431 L432 T433 H437 K438 V439	L405-L435 HydrophobicContact CD1-CD2 4.07Å; L414-L435 HydrophobicContact CB-CD2 4.27Å; L414-L435 HydrophobicContact CB-CG 4.41Å; V415-L435 HydrophobicContact CG2-CD1 4.08Å; V415-L435 HydrophobicContact CG2-CD2 3.6Å; A418-L435 HydrophobicContact CB-CD1 3.73Å; P429-L435 HydrophobicContact CB-CB 4.05Å; P429-L435 HydrophobicContact CG-CB 4.09Å; P429-L435 HydrophobicContact CG-CD1 3.91Å; T431-L435 PolarHBondContact O-N 3.35Å; L432-L435 HydrophobicContact CD1-CD2 4.39Å; L432-L435 PolarHBondContact O-N 3.01Å; T433-L435 VanDerWaalsContact C-N 3.33Å; T433-L435 PolarHBondContact O-N 3.19Å; L435-H437 VanDerWaalsContact C-N 3.34Å; L435-H437 PolarHBondContact O-N 3.03Å; L435-K438 PolarHBondContact O-N 3.19Å; L435-V439 HydrophobicContact CD1-CG2 4.27Å; L435-V439 WeakPolarHBondContact O-CG2 3.44Å; L435-V439 PolarHBondContact O-N 2.98Å
436	C	94.9	Very high	88.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-40.9	178.3	-72.3	0	0	0	0	112	L432 T433 L440 L515 Y518	L432-C436 PolarHBondContact O-N 2.92Å; L432-C436 PolarHBondContact O-SG 3.04Å; T433-C436 PolarHBondContact O-N 2.79Å; C436-L440 WeakPolarHBondContact O-CB 3.42Å; C436-L440 PolarHBondContact O-N 3.37Å; C436-L515 HydrophobicContact CB-CD2 4.29Å; C436-Y518 HydrophobicContact CB-CD2 3.33Å; C436-Y518 HydrophobicContact CB-CE2 4.13Å; C436-Y518 HydrophobicContact CB-CG 3.61Å
437	H	92.9	Very high	88	Confident	6 Å²	6	34.6 Å²	34.6	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-57.8	-54	174.9	-178.2	63.3	0	0	0	110.9	T433 A434 L435 V439 L440 C441 Y518 H569	T433-H437 WeakPolarHBondContact O-CB 3.3Å; T433-H437 PolarHBondContact O-N 3.37Å; A434-H437 PolarHBondContact O-N 3.25Å; L435-H437 VanDerWaalsContact C-N 3.34Å; L435-H437 PolarHBondContact O-N 3.03Å; H437-V439 PolarHBondContact O-N 3.49Å; H437-L440 WeakPolarHBondContact O-CB 3.39Å; H437-L440 PolarHBondContact O-N 3.41Å; H437-L440 VanDerWaalsContact O-N 3.13Å; H437-C441 VanDerWaalsContact CE1-SG 3.59Å; H437-C441 PolarHBondContact O-N 3.34Å; H437-C441 PolarHBondContact O-SG 2.98Å; H437-C441 VanDerWaalsContact O-SG 3.38Å; H437-Y518 HydrophobicContact CB-CE2 3.78Å; H437-Y518 AromaticContact ND1-CZ 3.87Å; H437-Y518 PolarHBondContact ND1-OH 3.32Å; H437-H569 AromaticContact CD2-CD2 3.84Å; H437-H569 AromaticContact CD2-NE2 3.27Å; H437-H569 PolarHBondContact CD2-NE2 3.33Å; H437-H569 VanDerWaalsContact CD2-NE2 3.27Å; H437-H569 AromaticContact CG-NE2 3.79Å
438	K	91.6	Very high	87	Confident	51 Å²	51	43 Å²	43	22%	0.222	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-47.6	-179	-175	147.5	-179.9	166.3	0	111.9	C422 A427 A434 L435 L440 C441 L442	C422-K438 PolarHBondContact SG-NZ 2.77Å; C422-K438 VanDerWaalsContact SG-NZ 3.38Å; A427-K438 PolarHBondContact O-NZ 3.33Å; A434-K438 WeakPolarHBondContact O-CB 3.27Å; A434-K438 PolarHBondContact O-N 2.67Å; L435-K438 PolarHBondContact O-N 3.19Å; K438-L440 VanDerWaalsContact C-N 3.32Å; K438-L440 PolarHBondContact O-N 2.86Å; K438-C441 PolarHBondContact O-N 2.65Å; K438-L442 WeakPolarHBondContact O-CG 3.43Å; K438-L442 PolarHBondContact O-N 3.38Å
439	V	92.4	Very high	85.7	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-64.8	-36	178.6	177.4	0	0	0	0	112.1	L414 A418 L435 H437 L442 K443 L515	L414-V439 HydrophobicContact CB-CG2 4.26Å; L414-V439 HydrophobicContact CD2-CG1 3.87Å; L414-V439 WeakPolarHBondContact O-CG2 3.33Å; A418-V439 HydrophobicContact CB-CG2 4.09Å; L435-V439 HydrophobicContact CD1-CG2 4.27Å; L435-V439 WeakPolarHBondContact O-CG2 3.44Å; L435-V439 PolarHBondContact O-N 2.98Å; H437-V439 PolarHBondContact O-N 3.49Å; V439-L442 PolarHBondContact O-N 3.21Å; V439-K443 HydrophobicContact CG1-CD 4.41Å; V439-K443 WeakPolarHBondContact O-CG 3.4Å; V439-K443 PolarHBondContact O-N 2.87Å; V439-L515 HydrophobicContact CG1-CD1 4.39Å; V439-L515 HydrophobicContact CG1-CD2 4.48Å
440	L	91.3	Very high	84.3	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-47.4	173.6	180	66.1	0	0	0	111.1	C436 H437 K438 L442 K443 M444 L491 Y518 M519 L577	C436-L440 WeakPolarHBondContact O-CB 3.42Å; C436-L440 PolarHBondContact O-N 3.37Å; H437-L440 WeakPolarHBondContact O-CB 3.39Å; H437-L440 PolarHBondContact O-N 3.41Å; H437-L440 VanDerWaalsContact O-N 3.13Å; K438-L440 VanDerWaalsContact C-N 3.32Å; K438-L440 PolarHBondContact O-N 2.86Å; L440-L442 VanDerWaalsContact C-N 3.33Å; L440-L442 PolarHBondContact O-N 3.43Å; L440-K443 WeakPolarHBondContact O-CB 3.39Å; L440-K443 PolarHBondContact O-N 3.48Å; L440-K443 VanDerWaalsContact O-N 3.1Å; L440-M444 HydrophobicContact CD1-CG 4.41Å; L440-M444 HydrophobicContact CD1-SD 4.38Å; L440-M444 HydrophobicContact CD2-SD 4.38Å; L440-M444 HydrophobicContact CG-CG 4.43Å; L440-M444 HydrophobicContact CG-SD 3.98Å; L440-M444 WeakPolarHBondContact O-CG 3.46Å; L440-M444 PolarHBondContact O-N 3.49Å; L440-L491 HydrophobicContact CD1-CD1 3.94Å; L440-L491 HydrophobicContact CD1-CD2 3.7Å; L440-L491 HydrophobicContact CD1-CG 4.45Å; L440-Y518 HydrophobicContact CB-CE1 4.4Å; L440-Y518 HydrophobicContact CD2-CD1 3.97Å; L440-Y518 HydrophobicContact CD2-CE1 3.44Å; L440-Y518 VanDerWaalsContact CD2-CE1 3.44Å; L440-M519 HydrophobicContact CD1-SD 4.35Å; L440-M519 HydrophobicContact CD2-CG 4.49Å; L440-L577 HydrophobicContact CD2-CD2 4.26Å
441	C	89.1	Confident	83.1	Confident	32 Å²	32	42.6 Å²	42.6	22%	0.216	22%	0.22	C	C	.	.	H	α-helix	trans	-57.2	-45.8	176.7	-67.6	0	0	0	0	111.4	H437 K438 K443 M444 E445	H437-C441 VanDerWaalsContact CE1-SG 3.59Å; H437-C441 PolarHBondContact O-N 3.34Å; H437-C441 PolarHBondContact O-SG 2.98Å; H437-C441 VanDerWaalsContact O-SG 3.38Å; K438-C441 PolarHBondContact O-N 2.65Å; C441-K443 VanDerWaalsContact C-N 3.28Å; C441-K443 PolarHBondContact O-N 2.91Å; C441-M444 WeakPolarHBondContact O-CB 3.24Å; C441-M444 PolarHBondContact O-N 3.36Å; C441-E445 WeakPolarHBondContact O-CG 3.45Å; C441-E445 PolarHBondContact O-N 3.27Å
442	L	88.4	Confident	81.9	Confident	22 Å²	22	51.1 Å²	51.1	12%	0.115	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-36.9	176	-67.2	-176.6	0	0	0	113	A417 Q421 K438 V439 L440	A417-L442 WeakPolarHBondContact O-CD1 3.44Å; Q421-L442 HydrophobicContact CB-CD1 4.34Å; Q421-L442 HydrophobicContact CB-CD2 4.15Å; Q421-L442 HydrophobicContact CG-CD1 4.26Å; Q421-L442 HydrophobicContact CG-CD2 4.14Å; K438-L442 WeakPolarHBondContact O-CG 3.43Å; K438-L442 PolarHBondContact O-N 3.38Å; V439-L442 PolarHBondContact O-N 3.21Å; L440-L442 VanDerWaalsContact C-N 3.33Å; L440-L442 PolarHBondContact O-N 3.43Å
443	K	87.4	Confident	81.1	Confident	45 Å²	45	51.7 Å²	51.7	20%	0.196	26%	0.264	C	S	.	.	H	α-helix	trans	-69.9	-34.2	174.4	-77.4	175.7	168.4	-80.7	0	112.2	V439 L440 C441 T489 G490 L491 L515	V439-K443 HydrophobicContact CG1-CD 4.41Å; V439-K443 WeakPolarHBondContact O-CG 3.4Å; V439-K443 PolarHBondContact O-N 2.87Å; L440-K443 WeakPolarHBondContact O-CB 3.39Å; L440-K443 PolarHBondContact O-N 3.48Å; L440-K443 VanDerWaalsContact O-N 3.1Å; C441-K443 VanDerWaalsContact C-N 3.28Å; C441-K443 PolarHBondContact O-N 2.91Å; K443-T489 PolarHBondContact NZ-O 3.49Å; K443-G490 PolarHBondContact NZ-O 2.96Å; K443-L491 HydrophobicContact CD-CD2 3.84Å; K443-L491 HydrophobicContact CD-CG 4.49Å; K443-L515 HydrophobicContact CD-CD1 4.03Å
444	M	84.8	Confident	80.7	Confident	22 Å²	22	51.7 Å²	51.7	11%	0.108	26%	0.264	C	S	.	.	H	α-helix	trans	-75.4	-33.3	178.9	-70.5	177.6	62.4	0	0	113	L440 C441 K446 D447 T451 L454 L577	L440-M444 HydrophobicContact CD1-CG 4.41Å; L440-M444 HydrophobicContact CD1-SD 4.38Å; L440-M444 HydrophobicContact CD2-SD 4.38Å; L440-M444 HydrophobicContact CG-CG 4.43Å; L440-M444 HydrophobicContact CG-SD 3.98Å; L440-M444 WeakPolarHBondContact O-CG 3.46Å; L440-M444 PolarHBondContact O-N 3.49Å; C441-M444 WeakPolarHBondContact O-CB 3.24Å; C441-M444 PolarHBondContact O-N 3.36Å; M444-K446 PolarHBondContact O-N 3.37Å; M444-K446 VanDerWaalsContact O-N 3.12Å; M444-D447 CarbonylContact O-C 3.59Å; M444-D447 PolarHBondContact O-N 2.99Å; M444-T451 HydrophobicContact CE-CG2 3.88Å; M444-L454 HydrophobicContact CE-CD2 3.85Å; M444-L454 HydrophobicContact SD-CD1 4.37Å; M444-L454 HydrophobicContact SD-CD2 3.94Å; M444-L577 HydrophobicContact SD-CD2 4.36Å
445	E	80.5	Confident	80.4	Confident	105 Å²	105	54 Å²	54	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-59.3	-25.2	177	-76.3	-175.7	170.3	0	0	113.3	C441 D447	C441-E445 WeakPolarHBondContact O-CG 3.45Å; C441-E445 PolarHBondContact O-N 3.27Å; E445-D447 PolarHBondContact O-N 3.49Å
446	K	71.7	Confident	80.2	Confident	164 Å²	164	57.6 Å²	57.6	71%	0.713	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.7	174.4	-61.9	-175.6	-179.9	-175.2	0	113.2	M444	M444-K446 PolarHBondContact O-N 3.37Å; M444-K446 VanDerWaalsContact O-N 3.12Å
447	D	68.9	Low	79.9	Confident	23 Å²	23	57.6 Å²	57.6	12%	0.123	30%	0.295	C	S	.	.			trans	-144.7	79.9	-179.1	-162	21.3	0	0	0	111.8	M444 E445 G449 S450 F485 R488 T489	M444-D447 CarbonylContact O-C 3.59Å; M444-D447 PolarHBondContact O-N 2.99Å; E445-D447 PolarHBondContact O-N 3.49Å; D447-G449 PolarHBondContact O-N 2.82Å; D447-S450 PolarHBondContact OD2-OG 3.35Å; D447-F485 HydrophobicContact CB-CE2 4.47Å; D447-F485 WeakPolarHBondContact OD2-CD2 3.46Å; D447-R488 VanDerWaalsContact CG-NH1 3.27Å; D447-R488 IonicContact OD1-CZ 3.47Å; D447-R488 IonicContact OD1-NH1 2.8Å; D447-R488 PolarHBondContact OD1-NH1 2.76Å; D447-R488 IonicContact OD1-NH2 3.12Å; D447-R488 PolarHBondContact OD1-NH2 3Å; D447-R488 IonicContact OD2-CZ 3.03Å; D447-R488 IonicContact OD2-NE 3.22Å; D447-R488 IonicContact OD2-NH1 3.22Å; D447-R488 PolarHBondContact OD2-NH1 3.13Å; D447-R488 IonicContact OD2-NH2 3.77Å; D447-R488 PolarHBondContact OD2-NH2 3.08Å; D447-T489 HydrophobicContact CB-CG2 4.36Å
448	R	58.4	Low	79.9	Confident	222 Å²	222	57.5 Å²	57.5	84%	0.838	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	4.7	-174.5	-66.5	-171.6	-178.8	-117.8	-2.5	115.6
449	G	57.8	Low	79.9	Confident	71 Å²	71	55.9 Å²	55.9	73%	0.732	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-3	-167.7	0	0	0	0	0	117.6	D447	D447-G449 PolarHBondContact O-N 2.82Å
450	S	60.9	Low	79.8	Confident	20 Å²	20	55.8 Å²	55.8	14%	0.14	29%	0.289	C	S	.	.			trans	-144.6	43.5	-167.5	53.2	0	0	0	0	115.2	D447 E452 S453 F485	D447-S450 PolarHBondContact OD2-OG 3.35Å; S450-E452 PolarHBondContact O-N 3.38Å; S450-S453 PolarHBondContact O-N 2.93Å; S450-F485 WeakPolarHBondContact OG-CD2 3.44Å; S450-F485 WeakPolarHBondContact OG-CE2 3.46Å
451	T	64	Low	79.9	Confident	83 Å²	83	55.8 Å²	55.8	51%	0.509	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-62.4	-23.1	171	45.3	0	0	0	0	112.9	M444 S453 L454	M444-T451 HydrophobicContact CE-CG2 3.88Å; T451-S453 PolarHBondContact O-N 3.29Å; T451-L454 WeakPolarHBondContact O-CB 3.45Å; T451-L454 PolarHBondContact O-N 3.09Å
452	E	68.8	Low	80	Confident	183 Å²	183	54.8 Å²	54.8	86%	0.855	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-62.2	-24.9	176.8	-62.1	-171.5	165.5	0	0	113.7	S450 P455	S450-E452 PolarHBondContact O-N 3.38Å; E452-P455 WeakPolarHBondContact O-CD 3.44Å
453	S	77.1	Confident	80.1	Confident	17 Å²	17	57.2 Å²	57.2	12%	0.119	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-83.8	-10.6	-179	-59.6	0	0	0	0	113.8	S450 T451 L457 L482	S450-S453 PolarHBondContact O-N 2.93Å; T451-S453 PolarHBondContact O-N 3.29Å; S453-L457 PolarHBondContact O-N 3.13Å; S453-L482 WeakPolarHBondContact O-CD1 3.24Å
454	L	86.1	Confident	80	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-67.4	-43.4	-174.4	-175.5	68.4	0	0	0	114.2	M444 T451 E456 L457 C458 M519 L577	M444-L454 HydrophobicContact CE-CD2 3.85Å; M444-L454 HydrophobicContact SD-CD1 4.37Å; M444-L454 HydrophobicContact SD-CD2 3.94Å; T451-L454 WeakPolarHBondContact O-CB 3.45Å; T451-L454 PolarHBondContact O-N 3.09Å; L454-E456 VanDerWaalsContact C-N 3.3Å; L454-E456 PolarHBondContact O-N 3.06Å; L454-L457 PolarHBondContact O-N 3.32Å; L454-C458 PolarHBondContact O-N 3.33Å; L454-C458 PolarHBondContact O-SG 3.27Å; L454-M519 HydrophobicContact CD1-CE 3.57Å; L454-L577 HydrophobicContact CD2-CB 4.21Å; L454-L577 HydrophobicContact CD2-CD2 3.78Å
455	P	87.9	Confident	80.2	Confident	61 Å²	61	54.1 Å²	54.1	40%	0.396	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-36.7	-179.1	-24.4	35.7	0	0	0	113.1	E452 C458 S459	E452-P455 WeakPolarHBondContact O-CD 3.44Å; P455-C458 PolarHBondContact O-N 3.45Å; P455-S459 PolarHBondContact O-N 3.02Å
456	E	88.3	Confident	80.4	Confident	75 Å²	75	54.6 Å²	54.6	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-45.2	175.6	-170	179.7	179.2	0	0	110.7	L454 C458 S459 I460 L482	L454-E456 VanDerWaalsContact C-N 3.3Å; L454-E456 PolarHBondContact O-N 3.06Å; E456-C458 VanDerWaalsContact C-N 3.33Å; E456-C458 PolarHBondContact O-N 2.78Å; E456-S459 WeakPolarHBondContact O-CB 3.49Å; E456-S459 PolarHBondContact O-N 3.08Å; E456-I460 WeakPolarHBondContact O-CG1 3.34Å; E456-I460 PolarHBondContact O-N 3.15Å; E456-L482 HydrophobicContact CB-CD2 4.17Å; E456-L482 VanDerWaalsContact CD-CD2 3.49Å; E456-L482 HydrophobicContact CG-CD2 3.78Å
457	L	89.8	Confident	80.7	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-39.8	176.9	-164.3	50.8	0	0	0	112.3	S453 L454 S459 I460 A461 L482 F485 L491 L492 W510 M519	S453-L457 PolarHBondContact O-N 3.13Å; L454-L457 PolarHBondContact O-N 3.32Å; L457-S459 VanDerWaalsContact C-N 3.34Å; L457-S459 PolarHBondContact O-N 3.17Å; L457-I460 PolarHBondContact O-N 2.81Å; L457-A461 PolarHBondContact O-N 3.14Å; L457-L482 HydrophobicContact CB-CD1 4Å; L457-L482 HydrophobicContact CD1-CD1 4.39Å; L457-L482 HydrophobicContact CD2-CD1 4.45Å; L457-F485 HydrophobicContact CD2-CD1 4.47Å; L457-F485 HydrophobicContact CD2-CE1 4.24Å; L457-L491 HydrophobicContact CD2-CD1 3.9Å; L457-L492 HydrophobicContact CD1-CD1 4.01Å; L457-L492 HydrophobicContact CD1-CG 4.45Å; L457-W510 HydrophobicContact CD1-CH2 3.77Å; L457-W510 HydrophobicContact CD1-CZ2 4.24Å; L457-W510 HydrophobicContact CG-CH2 3.87Å; L457-M519 HydrophobicContact CB-CE 3.77Å; L457-M519 HydrophobicContact CD2-CE 3.67Å; L457-M519 HydrophobicContact CD2-SD 4.5Å; L457-M519 HydrophobicContact CG-CE 3.49Å; L457-M519 VanDerWaalsContact CG-CE 3.49Å; L457-M519 HydrophobicContact CG-SD 4.47Å
458	C	92.4	Very high	81.2	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.02	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-36.8	175.5	-64.9	0	0	0	0	112.2	L454 P455 E456 A461 W462 M519 H523	L454-C458 PolarHBondContact O-N 3.33Å; L454-C458 PolarHBondContact O-SG 3.27Å; P455-C458 PolarHBondContact O-N 3.45Å; E456-C458 VanDerWaalsContact C-N 3.33Å; E456-C458 PolarHBondContact O-N 2.78Å; C458-A461 WeakPolarHBondContact O-CB 3.47Å; C458-A461 PolarHBondContact O-N 3.01Å; C458-W462 PolarHBondContact O-N 3.38Å; C458-W462 VanDerWaalsContact O-N 3.09Å; C458-M519 VanDerWaalsContact CB-O 3.26Å; C458-M519 WeakPolarHBondContact CB-O 3.44Å; C458-H523 HydrophobicContact CB-CB 3.87Å; C458-H523 WeakPolarHBondContact O-CB 3.32Å
459	S	91.9	Very high	82.2	Confident	18 Å²	18	39.6 Å²	39.6	13%	0.126	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-42.6	172.8	171.6	0	0	0	0	112	P455 E456 L457 A461 W462 E463 R476	P455-S459 PolarHBondContact O-N 3.02Å; E456-S459 WeakPolarHBondContact O-CB 3.49Å; E456-S459 PolarHBondContact O-N 3.08Å; L457-S459 VanDerWaalsContact C-N 3.34Å; L457-S459 PolarHBondContact O-N 3.17Å; S459-A461 VanDerWaalsContact C-N 3.31Å; S459-A461 PolarHBondContact O-N 3.27Å; S459-W462 PolarHBondContact O-N 2.88Å; S459-E463 PolarHBondContact O-N 3.24Å; S459-E463 VanDerWaalsContact O-N 3.13Å; S459-R476 PolarHBondContact OG-NH1 3.26Å; S459-R476 PolarHBondContact OG-NH2 3.26Å
460	I	91.1	Very high	83.2	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-41.3	175.5	-65.2	168.8	0	0	0	110.5	E456 L457 W462 E463 G464 V472 R476 V478 L482 W510	E456-I460 WeakPolarHBondContact O-CG1 3.34Å; E456-I460 PolarHBondContact O-N 3.15Å; L457-I460 PolarHBondContact O-N 2.81Å; I460-W462 VanDerWaalsContact C-N 3.32Å; I460-W462 PolarHBondContact O-N 3.3Å; I460-E463 PolarHBondContact O-N 2.9Å; I460-G464 PolarHBondContact O-N 2.87Å; I460-V472 HydrophobicContact CG2-CG1 3.94Å; I460-V472 HydrophobicContact CG2-CG2 4.26Å; I460-R476 VanDerWaalsContact CG1-NH1 3.32Å; I460-V478 HydrophobicContact CD1-CG2 4.25Å; I460-L482 HydrophobicContact CD1-CD2 3.99Å; I460-W510 HydrophobicContact CG2-CZ2 4.3Å
461	A	92.4	Very high	84.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-45.1	176.5	0	0	0	0	0	111.5	L457 C458 S459 E463 G464 V465 W510 Q516 M519 A520	L457-A461 PolarHBondContact O-N 3.14Å; C458-A461 WeakPolarHBondContact O-CB 3.47Å; C458-A461 PolarHBondContact O-N 3.01Å; S459-A461 VanDerWaalsContact C-N 3.31Å; S459-A461 PolarHBondContact O-N 3.27Å; A461-E463 PolarHBondContact O-N 3.32Å; A461-G464 WeakPolarHBondContact O-CA 3.2Å; A461-G464 PolarHBondContact O-N 2.92Å; A461-V465 WeakPolarHBondContact O-CG2 3.2Å; A461-V465 PolarHBondContact O-N 3.23Å; A461-W510 VanDerWaalsContact CA-CZ2 3.43Å; A461-W510 HydrophobicContact CB-CH2 3.57Å; A461-W510 HydrophobicContact CB-CZ2 3.45Å; A461-W510 VanDerWaalsContact CB-CZ2 3.45Å; A461-W510 HydrophobicContact CB-CZ3 4.46Å; A461-Q516 HydrophobicContact CB-CG 4.35Å; A461-M519 HydrophobicContact CB-CB 3.83Å; A461-A520 HydrophobicContact CB-CB 4.04Å
462	W	92.3	Very high	85	Confident	12 Å²	12	32.9 Å²	32.9	5%	0.045	17%	0.173	C	C	.	.	H	α-helix	trans	-63.3	-39.6	178.6	177.1	-131.2	0	0	0	113.5	C458 S459 I460 G464 V465 K466 A520 H523 L524 T538 M556 T559	C458-W462 PolarHBondContact O-N 3.38Å; C458-W462 VanDerWaalsContact O-N 3.09Å; S459-W462 PolarHBondContact O-N 2.88Å; I460-W462 VanDerWaalsContact C-N 3.32Å; I460-W462 PolarHBondContact O-N 3.3Å; W462-G464 VanDerWaalsContact C-N 3.34Å; W462-V465 HydrophobicContact CE3-CB 4.43Å; W462-V465 HydrophobicContact CE3-CG1 4.47Å; W462-V465 HydrophobicContact CZ3-CG1 4.38Å; W462-V465 PolarHBondContact O-N 2.71Å; W462-K466 HydrophobicContact CD2-CD 4.34Å; W462-K466 HydrophobicContact CD2-CG 4.35Å; W462-K466 HydrophobicContact CZ2-CD 4.27Å; W462-K466 HydrophobicContact CZ2-CG 4.3Å; W462-K466 VanDerWaalsContact NE1-CE 3.3Å; W462-K466 WeakPolarHBondContact O-CG 3.37Å; W462-K466 PolarHBondContact O-N 3.02Å; W462-A520 HydrophobicContact CB-CB 4.23Å; W462-A520 HydrophobicContact CE3-CB 4.25Å; W462-H523 HydrophobicContact CB-CB 4.34Å; W462-H523 AromaticContact CD1-CD2 3.37Å; W462-H523 AromaticContact CD1-NE2 3.78Å; W462-H523 AromaticContact CG-CD2 3.74Å; W462-L524 HydrophobicContact CH2-CD1 3.81Å; W462-L524 HydrophobicContact CH2-CD2 3.84Å; W462-L524 HydrophobicContact CH2-CG 4.38Å; W462-L524 HydrophobicContact CZ2-CD1 3.56Å; W462-L524 HydrophobicContact CZ2-CD2 4.45Å; W462-L524 HydrophobicContact CZ3-CD1 4.45Å; W462-L524 HydrophobicContact CZ3-CD2 3.98Å; W462-T538 HydrophobicContact CH2-CG2 4.11Å; W462-T538 HydrophobicContact CZ2-CG2 3.98Å; W462-M556 HydrophobicContact CH2-CE 3.94Å; W462-M556 HydrophobicContact CH2-SD 3.84Å; W462-M556 HydrophobicContact CZ3-CE 3.89Å; W462-M556 HydrophobicContact CZ3-SD 3.77Å; W462-T559 HydrophobicContact CE3-CG2 4.21Å; W462-T559 HydrophobicContact CZ3-CG2 4.01Å
463	E	89.1	Confident	85.1	Confident	73 Å²	73	26.4 Å²	26.4	34%	0.341	15%	0.147	S	C	.	.	H	α-helix	trans	-64.1	-40.2	172.8	-72.5	171.8	-171.9	0	0	111.9	S459 I460 A461 K466 S467 R476	S459-E463 PolarHBondContact O-N 3.24Å; S459-E463 VanDerWaalsContact O-N 3.13Å; I460-E463 PolarHBondContact O-N 2.9Å; A461-E463 PolarHBondContact O-N 3.32Å; E463-K466 PolarHBondContact O-N 3.29Å; E463-S467 WeakPolarHBondContact O-CB 3.31Å; E463-S467 PolarHBondContact O-N 3.25Å; E463-S467 PolarHBondContact O-OG 2.61Å; E463-R476 IonicContact OE1-CZ 2.75Å; E463-R476 IonicContact OE1-NH1 3.52Å; E463-R476 PolarHBondContact OE1-NH1 3.37Å; E463-R476 IonicContact OE1-NH2 2.67Å; E463-R476 IonicContact OE2-CZ 3.37Å; E463-R476 IonicContact OE2-NH1 3.72Å; E463-R476 PolarHBondContact OE2-NH1 2.75Å
464	G	86.6	Confident	84.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.6	-50	172.4	0	0	0	0	0	112	I460 A461 W462 K466 S467 N468 S469	I460-G464 PolarHBondContact O-N 2.87Å; A461-G464 WeakPolarHBondContact O-CA 3.2Å; A461-G464 PolarHBondContact O-N 2.92Å; W462-G464 VanDerWaalsContact C-N 3.34Å; G464-K466 PolarHBondContact O-N 2.57Å; G464-S467 WeakPolarHBondContact CA-OG 3.49Å; G464-S467 CarbonylContact O-C 3.45Å; G464-S467 PolarHBondContact O-N 3.22Å; G464-S467 PolarHBondContact O-OG 2.97Å; G464-N468 CarbonylContact O-C 3.56Å; G464-N468 VanDerWaalsContact O-CA 3.3Å; G464-N468 WeakPolarHBondContact O-CA 3.39Å; G464-N468 PolarHBondContact O-N 3Å; G464-S469 CarbonylContact C-O 3.45Å; G464-S469 WeakPolarHBondContact CA-O 3.33Å; G464-S469 PolarHBondContact O-N 2.86Å
465	V	88.1	Confident	82.9	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-41.6	177.7	171.3	0	0	0	0	112	A461 W462 S467 N468 Q516 A520 E555 M556 T559	A461-V465 WeakPolarHBondContact O-CG2 3.2Å; A461-V465 PolarHBondContact O-N 3.23Å; W462-V465 HydrophobicContact CE3-CB 4.43Å; W462-V465 HydrophobicContact CE3-CG1 4.47Å; W462-V465 HydrophobicContact CZ3-CG1 4.38Å; W462-V465 PolarHBondContact O-N 2.71Å; V465-S467 PolarHBondContact O-N 3.36Å; V465-N468 PolarHBondContact O-N 3.41Å; V465-N468 VanDerWaalsContact O-N 3.13Å; V465-Q516 HydrophobicContact CG2-CG 4.45Å; V465-A520 HydrophobicContact CB-CB 4.35Å; V465-A520 HydrophobicContact CG2-CB 3.69Å; V465-E555 HydrophobicContact CG1-CB 4.35Å; V465-M556 HydrophobicContact CG1-CE 3.96Å; V465-M556 HydrophobicContact CG1-SD 4.31Å; V465-T559 HydrophobicContact CG1-CG2 4.48Å
466	K	85.3	Confident	81.7	Confident	116 Å²	116	36.9 Å²	36.9	50%	0.504	21%	0.206	S	C	.	.	H	α-helix	trans	-61.1	-43.2	175.6	-81.6	174.7	162.7	168.4	0	112.4	W462 E463 G464 N468 R553 M556	W462-K466 HydrophobicContact CD2-CD 4.34Å; W462-K466 HydrophobicContact CD2-CG 4.35Å; W462-K466 HydrophobicContact CZ2-CD 4.27Å; W462-K466 HydrophobicContact CZ2-CG 4.3Å; W462-K466 VanDerWaalsContact NE1-CE 3.3Å; W462-K466 WeakPolarHBondContact O-CG 3.37Å; W462-K466 PolarHBondContact O-N 3.02Å; E463-K466 PolarHBondContact O-N 3.29Å; G464-K466 PolarHBondContact O-N 2.57Å; K466-N468 VanDerWaalsContact C-N 3.27Å; K466-R553 PolarHBondContact O-NH1 2.94Å; K466-R553 VanDerWaalsContact O-NH1 3.17Å; K466-M556 HydrophobicContact CG-CE 4.26Å
467	S	78.4	Confident	80.4	Confident	63 Å²	63	39.7 Å²	39.7	44%	0.441	23%	0.229	S	C	.	.	H	α-helix	trans	-77.7	-14.6	176.5	56.7	0	0	0	0	112.9	E463 G464 V465	E463-S467 WeakPolarHBondContact O-CB 3.31Å; E463-S467 PolarHBondContact O-N 3.25Å; E463-S467 PolarHBondContact O-OG 2.61Å; G464-S467 WeakPolarHBondContact CA-OG 3.49Å; G464-S467 CarbonylContact O-C 3.45Å; G464-S467 PolarHBondContact O-N 3.22Å; G464-S467 PolarHBondContact O-OG 2.97Å; V465-S467 PolarHBondContact O-N 3.36Å
468	N	78	Confident	79.6	Confident	8 Å²	8	41.2 Å²	41.2	4%	0.043	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	57.4	-168	-165.8	127.4	0	0	0	110.6	R298 G464 V465 K466	R298-N468 PolarHBondContact NH2-ND2 2.97Å; R298-N468 PolarHBondContact NH2-OD1 3.42Å; G464-N468 CarbonylContact O-C 3.56Å; G464-N468 VanDerWaalsContact O-CA 3.3Å; G464-N468 WeakPolarHBondContact O-CA 3.39Å; G464-N468 PolarHBondContact O-N 3Å; V465-N468 PolarHBondContact O-N 3.41Å; V465-N468 VanDerWaalsContact O-N 3.13Å; K466-N468 VanDerWaalsContact C-N 3.27Å
469	S	78.9	Confident	79	Confident	22 Å²	22	43.3 Å²	43.3	15%	0.154	25%	0.253	C	S	.	.			trans	-131.7	138.9	173	-166.5	0	0	0	0	110.4	E296 G464 V471 Q516	E296-S469 VanDerWaalsContact OE2-CA 3.3Å; E296-S469 WeakPolarHBondContact OE2-CA 3.43Å; E296-S469 WeakPolarHBondContact OE2-CB 3.48Å; E296-S469 PolarHBondContact OE2-OG 3.39Å; G464-S469 CarbonylContact C-O 3.45Å; G464-S469 WeakPolarHBondContact CA-O 3.33Å; G464-S469 PolarHBondContact O-N 2.86Å; S469-V471 WeakPolarHBondContact OG-CB 3.31Å; S469-V471 PolarHBondContact OG-N 2.69Å; S469-Q516 PolarHBondContact O-NE2 3.41Å
470	S	80.3	Confident	78.3	Confident	10 Å²	10	48 Å²	48	7%	0.07	28%	0.281	C	S	.	.	S	Bend	trans	-85.4	4.6	169.5	60.4	0	0	0	0	112.7	K245 E296 W510	K245-S470 WeakPolarHBondContact CD-OG 3.41Å; K245-S470 WeakPolarHBondContact CE-OG 3.47Å; K245-S470 PolarHBondContact NZ-OG 3.47Å; E296-S470 PolarHBondContact OE1-N 3.48Å; E296-S470 PolarHBondContact OE1-OG 3.32Å; S470-W510 VanDerWaalsContact O-CD1 3.3Å; S470-W510 PolarHBondContact O-N 3.04Å
471	V	81.5	Confident	77.8	Confident	8 Å²	8	54.9 Å²	54.9	5%	0.048	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-101.6	137.4	-178.2	-173.8	0	0	0	0	110.5	K245 L249 S469 I507 L509	K245-V471 HydrophobicContact CB-CG2 3.93Å; K245-V471 HydrophobicContact CD-CG2 4.49Å; K245-V471 HydrophobicContact CG-CG2 4.21Å; L249-V471 HydrophobicContact CD1-CG1 3.5Å; L249-V471 HydrophobicContact CD2-CG1 4.02Å; L249-V471 HydrophobicContact CG-CG1 4.15Å; S469-V471 WeakPolarHBondContact OG-CB 3.31Å; S469-V471 PolarHBondContact OG-N 2.69Å; V471-I507 HydrophobicContact CG1-CG2 4.05Å; V471-L509 HydrophobicContact CB-CD2 4.14Å; V471-L509 HydrophobicContact CG1-CD2 4.22Å; V471-L509 HydrophobicContact CG2-CD2 3.63Å
472	V	81.4	Confident	77.4	Confident	15 Å²	15	54.9 Å²	54.9	9%	0.091	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-71.1	128.2	173.1	-179.7	0	0	0	0	110.3	I460 K474 V478 L492 L508	I460-V472 HydrophobicContact CG2-CG1 3.94Å; I460-V472 HydrophobicContact CG2-CG2 4.26Å; V472-K474 PolarHBondContact O-N 3.42Å; V472-V478 HydrophobicContact CG1-CG2 3.88Å; V472-L492 HydrophobicContact CG2-CD1 4.02Å; V472-L492 HydrophobicContact CG2-CD2 4.14Å; V472-L508 HydrophobicContact CB-CB 4.08Å; V472-L508 HydrophobicContact CG2-CB 3.77Å; V472-L508 PolarHBondContact N-O 2.92Å
473	P	69.5	Low	77	Confident	47 Å²	47	56.2 Å²	56.2	31%	0.305	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-60.8	132.2	-175.8	-24.1	33.1	0	0	0	114	G475 R476	P473-G475 PolarHBondContact O-N 3.42Å; P473-G475 VanDerWaalsContact O-N 3.15Å; P473-R476 PolarHBondContact O-N 2.61Å
474	K	59.9	Low	76.7	Confident	142 Å²	142	54.9 Å²	54.9	62%	0.617	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.8	-178.9	-71.3	-171.7	174.1	-167.3	0	115.5	L249 V472	L249-K474 HydrophobicContact CD2-CD 4.04Å; L249-K474 VanDerWaalsContact CD2-CE 3.48Å; L249-K474 HydrophobicContact CD2-CG 3.97Å; L249-K474 PolarHBondContact O-NZ 3.25Å; V472-K474 PolarHBondContact O-N 3.42Å
475	G	57.9	Low	76.7	Confident	84 Å²	84	55 Å²	55	87%	0.866	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-5.9	-176.4	0	0	0	0	0	114.9	P473	P473-G475 PolarHBondContact O-N 3.42Å; P473-G475 VanDerWaalsContact O-N 3.15Å
476	R	63.6	Low	76.5	Confident	74 Å²	74	55 Å²	55	28%	0.279	32%	0.319	S	S	.	.	S	Bend	trans	-105.9	116.4	-179.2	-146.4	-179.1	-176.9	171.7	-2.5	108.7	S459 I460 E463 P473 V478	S459-R476 PolarHBondContact OG-NH1 3.26Å; S459-R476 PolarHBondContact OG-NH2 3.26Å; I460-R476 VanDerWaalsContact CG1-NH1 3.32Å; E463-R476 IonicContact OE1-CZ 2.75Å; E463-R476 IonicContact OE1-NH1 3.52Å; E463-R476 PolarHBondContact OE1-NH1 3.37Å; E463-R476 IonicContact OE1-NH2 2.67Å; E463-R476 IonicContact OE2-CZ 3.37Å; E463-R476 IonicContact OE2-NH1 3.72Å; E463-R476 PolarHBondContact OE2-NH1 2.75Å; P473-R476 PolarHBondContact O-N 2.61Å; R476-V478 PolarHBondContact O-N 2.62Å
477	T	60.8	Low	76.5	Confident	135 Å²	135	52.3 Å²	52.3	83%	0.828	31%	0.311	S	S	*	.			trans	-70.3	97.2	174.2	48.6	0	0	0	0	108.9	S479	T477-S479 PolarHBondContact O-N 2.88Å
478	V	72.1	Confident	76.8	Confident	32 Å²	32	56.6 Å²	56.6	19%	0.194	32%	0.317	C	S	.	.			trans	-67.9	121.1	169.4	-179.5	0	0	0	0	107.5	I460 V472 R476 L482 R483 L508	I460-V478 HydrophobicContact CD1-CG2 4.25Å; V472-V478 HydrophobicContact CG1-CG2 3.88Å; R476-V478 PolarHBondContact O-N 2.62Å; V478-L482 HydrophobicContact CG1-CB 4.01Å; V478-L482 HydrophobicContact CG1-CD2 3.85Å; V478-L482 HydrophobicContact CG1-CG 3.82Å; V478-R483 HydrophobicContact CG1-CB 4.16Å; V478-L508 HydrophobicContact CG1-CD1 4.41Å
479	S	79	Confident	77.1	Confident	48 Å²	48	56.5 Å²	56.5	34%	0.336	32%	0.317	S	S	.	.			trans	-57.7	148.3	178.2	72.9	0	0	0	0	110.8	T477 Q481 L482 R483	T477-S479 PolarHBondContact O-N 2.88Å; S479-Q481 PolarHBondContact O-N 3.36Å; S479-L482 PolarHBondContact O-N 3.14Å; S479-L482 VanDerWaalsContact O-N 3.13Å; S479-L482 WeakPolarHBondContact OG-CB 3.45Å; S479-L482 PolarHBondContact OG-N 2.9Å; S479-L482 VanDerWaalsContact OG-N 3.16Å; S479-R483 PolarHBondContact O-N 3.38Å
480	T	79.2	Confident	77.3	Confident	116 Å²	116	56.4 Å²	56.4	71%	0.712	32%	0.319	S	S	*	.	H	α-helix	trans	-58.3	-33.6	178.9	36.7	0	0	0	0	112.3	A484	T480-A484 WeakPolarHBondContact O-CB 3.38Å; T480-A484 PolarHBondContact O-N 3.44Å
481	Q	80.3	Confident	77.7	Confident	147 Å²	147	56 Å²	56	69%	0.687	32%	0.316	S	S	*	.	H	α-helix	trans	-65.7	-49.2	174.1	-68.4	176.4	-10.7	0	0	111.8	S479 R483 A484 F485	S479-Q481 PolarHBondContact O-N 3.36Å; Q481-R483 VanDerWaalsContact C-N 3.3Å; Q481-R483 PolarHBondContact O-N 3.13Å; Q481-A484 PolarHBondContact O-N 3.2Å; Q481-F485 WeakPolarHBondContact O-CB 3.35Å; Q481-F485 PolarHBondContact O-N 3.08Å
482	L	82.7	Confident	77.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-37.9	177.8	177.3	60.5	0	0	0	111.7	S453 E456 L457 I460 V478 S479 F485 S486	S453-L482 WeakPolarHBondContact O-CD1 3.24Å; E456-L482 HydrophobicContact CB-CD2 4.17Å; E456-L482 VanDerWaalsContact CD-CD2 3.49Å; E456-L482 HydrophobicContact CG-CD2 3.78Å; L457-L482 HydrophobicContact CB-CD1 4Å; L457-L482 HydrophobicContact CD1-CD1 4.39Å; L457-L482 HydrophobicContact CD2-CD1 4.45Å; I460-L482 HydrophobicContact CD1-CD2 3.99Å; V478-L482 HydrophobicContact CG1-CB 4.01Å; V478-L482 HydrophobicContact CG1-CD2 3.85Å; V478-L482 HydrophobicContact CG1-CG 3.82Å; S479-L482 PolarHBondContact O-N 3.14Å; S479-L482 VanDerWaalsContact O-N 3.13Å; S479-L482 WeakPolarHBondContact OG-CB 3.45Å; S479-L482 PolarHBondContact OG-N 2.9Å; S479-L482 VanDerWaalsContact OG-N 3.16Å; L482-F485 HydrophobicContact CD1-CD1 4.32Å; L482-S486 VanDerWaalsContact O-CB 3.31Å; L482-S486 WeakPolarHBondContact O-CB 3.29Å; L482-S486 PolarHBondContact O-N 2.98Å; L482-S486 PolarHBondContact O-OG 3.31Å
483	R	84.6	Confident	77.9	Confident	39 Å²	39	58.2 Å²	58.2	15%	0.147	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-48.9	173.3	-175.6	175.9	-174.9	115.9	12	111.6	V478 S479 Q481 F485 S486 L487 S494 D505 G506 L508	V478-R483 HydrophobicContact CG1-CB 4.16Å; S479-R483 PolarHBondContact O-N 3.38Å; Q481-R483 VanDerWaalsContact C-N 3.3Å; Q481-R483 PolarHBondContact O-N 3.13Å; R483-F485 PolarHBondContact O-N 3.44Å; R483-S486 WeakPolarHBondContact CA-OG 3.48Å; R483-S486 PolarHBondContact O-N 3.48Å; R483-S486 PolarHBondContact O-OG 2.88Å; R483-L487 HydrophobicContact CG-CD1 4.02Å; R483-L487 WeakPolarHBondContact O-CB 3.35Å; R483-L487 VanDerWaalsContact O-CG 3.26Å; R483-L487 WeakPolarHBondContact O-CG 3.4Å; R483-L487 PolarHBondContact O-N 2.99Å; R483-L487 VanDerWaalsContact O-N 3.11Å; R483-S494 PolarHBondContact NH2-OG 3.01Å; R483-D505 IonicContact NH1-OD1 3.83Å; R483-G506 PolarHBondContact NH1-O 3.17Å; R483-G506 VanDerWaalsContact NH1-O 3.16Å; R483-G506 PolarHBondContact NH2-O 2.98Å; R483-L508 HydrophobicContact CG-CD1 4.12Å; R483-L508 HydrophobicContact CG-CD2 4.37Å
484	A	82.9	Confident	78.3	Confident	45 Å²	45	58.9 Å²	58.9	37%	0.372	33%	0.332	S	S	.	.	H	α-helix	trans	-64.3	-39.9	178.8	0	0	0	0	0	112.3	T480 Q481 R488	T480-A484 WeakPolarHBondContact O-CB 3.38Å; T480-A484 PolarHBondContact O-N 3.44Å; Q481-A484 PolarHBondContact O-N 3.2Å; A484-R488 WeakPolarHBondContact O-CB 3.36Å; A484-R488 VanDerWaalsContact O-CG 3.29Å; A484-R488 WeakPolarHBondContact O-CG 3.31Å; A484-R488 PolarHBondContact O-N 2.93Å; A484-R488 VanDerWaalsContact O-N 3.08Å; A484-R488 PolarHBondContact O-NE 2.82Å
485	F	85.4	Confident	78.7	Confident	3 Å²	3	54.6 Å²	54.6	1%	0.013	32%	0.315	C	S	.	.	H	α-helix	trans	-61	-52.8	174.5	169.6	-111.4	0	0	0	112.1	D447 S450 L457 Q481 L482 R483 L487 R488 T489	D447-F485 HydrophobicContact CB-CE2 4.47Å; D447-F485 WeakPolarHBondContact OD2-CD2 3.46Å; S450-F485 WeakPolarHBondContact OG-CD2 3.44Å; S450-F485 WeakPolarHBondContact OG-CE2 3.46Å; L457-F485 HydrophobicContact CD2-CD1 4.47Å; L457-F485 HydrophobicContact CD2-CE1 4.24Å; Q481-F485 WeakPolarHBondContact O-CB 3.35Å; Q481-F485 PolarHBondContact O-N 3.08Å; L482-F485 HydrophobicContact CD1-CD1 4.32Å; R483-F485 PolarHBondContact O-N 3.44Å; F485-L487 VanDerWaalsContact C-N 3.31Å; F485-L487 PolarHBondContact O-N 3.33Å; F485-R488 PolarHBondContact O-N 3.41Å; F485-T489 HydrophobicContact CD2-CG2 3.88Å; F485-T489 HydrophobicContact CE2-CG2 3.53Å; F485-T489 HydrophobicContact CZ-CG2 3.98Å; F485-T489 WeakPolarHBondContact O-CG2 3.4Å; F485-T489 PolarHBondContact O-N 2.92Å; F485-T489 PolarHBondContact O-OG1 3.48Å
486	S	85	Confident	78.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.5	-32.6	-176.8	55	0	0	0	0	113.7	L482 R483 T489 G490 L491 L492	L482-S486 VanDerWaalsContact O-CB 3.31Å; L482-S486 WeakPolarHBondContact O-CB 3.29Å; L482-S486 PolarHBondContact O-N 2.98Å; L482-S486 PolarHBondContact O-OG 3.31Å; R483-S486 WeakPolarHBondContact CA-OG 3.48Å; R483-S486 PolarHBondContact O-N 3.48Å; R483-S486 PolarHBondContact O-OG 2.88Å; S486-T489 PolarHBondContact O-OG1 2.99Å; S486-G490 PolarHBondContact O-N 3.21Å; S486-L491 PolarHBondContact O-N 3.35Å; S486-L492 PolarHBondContact O-N 3.11Å; S486-L492 VanDerWaalsContact O-N 3.13Å
487	L	85.7	Confident	77.7	Confident	61 Å²	61	55.4 Å²	55.4	32%	0.319	31%	0.312	S	S	.	.	H	α-helix	trans	-73.9	-42.4	174	-67.5	174.1	0	0	0	112.5	R483 F485 G490 L508	R483-L487 HydrophobicContact CG-CD1 4.02Å; R483-L487 WeakPolarHBondContact O-CB 3.35Å; R483-L487 VanDerWaalsContact O-CG 3.26Å; R483-L487 WeakPolarHBondContact O-CG 3.4Å; R483-L487 PolarHBondContact O-N 2.99Å; R483-L487 VanDerWaalsContact O-N 3.11Å; F485-L487 VanDerWaalsContact C-N 3.31Å; F485-L487 PolarHBondContact O-N 3.33Å; L487-G490 PolarHBondContact O-N 3.49Å; L487-G490 VanDerWaalsContact O-N 3.16Å; L487-L508 HydrophobicContact CD2-CD2 3.92Å; L487-L508 HydrophobicContact CG-CD2 4.35Å
488	R	83.1	Confident	76.7	Confident	153 Å²	153	55.4 Å²	55.4	58%	0.577	30%	0.304	S	S	*	.	H	α-helix	trans	-66	-40.2	179.2	-77.3	-174.3	-66	143.7	4.4	112.9	D447 A484 F485 G490	D447-R488 VanDerWaalsContact CG-NH1 3.27Å; D447-R488 IonicContact OD1-CZ 3.47Å; D447-R488 IonicContact OD1-NH1 2.8Å; D447-R488 PolarHBondContact OD1-NH1 2.76Å; D447-R488 IonicContact OD1-NH2 3.12Å; D447-R488 PolarHBondContact OD1-NH2 3Å; D447-R488 IonicContact OD2-CZ 3.03Å; D447-R488 IonicContact OD2-NE 3.22Å; D447-R488 IonicContact OD2-NH1 3.22Å; D447-R488 PolarHBondContact OD2-NH1 3.13Å; D447-R488 IonicContact OD2-NH2 3.77Å; D447-R488 PolarHBondContact OD2-NH2 3.08Å; A484-R488 WeakPolarHBondContact O-CB 3.36Å; A484-R488 VanDerWaalsContact O-CG 3.29Å; A484-R488 WeakPolarHBondContact O-CG 3.31Å; A484-R488 PolarHBondContact O-N 2.93Å; A484-R488 VanDerWaalsContact O-N 3.08Å; A484-R488 PolarHBondContact O-NE 2.82Å; F485-R488 PolarHBondContact O-N 3.41Å; R488-G490 PolarHBondContact O-N 2.78Å
489	T	84.7	Confident	75	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.031	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-15	174.9	54.4	0	0	0	0	112.7	K443 D447 F485 S486 L491	K443-T489 PolarHBondContact NZ-O 3.49Å; D447-T489 HydrophobicContact CB-CG2 4.36Å; F485-T489 HydrophobicContact CD2-CG2 3.88Å; F485-T489 HydrophobicContact CE2-CG2 3.53Å; F485-T489 HydrophobicContact CZ-CG2 3.98Å; F485-T489 WeakPolarHBondContact O-CG2 3.4Å; F485-T489 PolarHBondContact O-N 2.92Å; F485-T489 PolarHBondContact O-OG1 3.48Å; S486-T489 PolarHBondContact O-OG1 2.99Å; T489-L491 VanDerWaalsContact C-N 3.29Å; T489-L491 PolarHBondContact O-N 3.43Å
490	G	84.6	Confident	73.2	Confident	20 Å²	20	69 Å²	69	21%	0.206	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	64	34.1	-175.9	0	0	0	0	0	112.6	K443 S486 L487 R488	K443-G490 PolarHBondContact NZ-O 2.96Å; S486-G490 PolarHBondContact O-N 3.21Å; L487-G490 PolarHBondContact O-N 3.49Å; L487-G490 VanDerWaalsContact O-N 3.16Å; R488-G490 PolarHBondContact O-N 2.78Å
491	L	87.6	Confident	71	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.01	35%	0.346	C	S	.	.	S	Bend	trans	-83.5	-37.5	170.7	-70.3	172.3	0	0	0	110.7	L440 K443 L457 S486 T489 A511 L515 M519	L440-L491 HydrophobicContact CD1-CD1 3.94Å; L440-L491 HydrophobicContact CD1-CD2 3.7Å; L440-L491 HydrophobicContact CD1-CG 4.45Å; K443-L491 HydrophobicContact CD-CD2 3.84Å; K443-L491 HydrophobicContact CD-CG 4.49Å; L457-L491 HydrophobicContact CD2-CD1 3.9Å; S486-L491 PolarHBondContact O-N 3.35Å; T489-L491 VanDerWaalsContact C-N 3.29Å; T489-L491 PolarHBondContact O-N 3.43Å; L491-A511 WeakPolarHBondContact O-CB 3.42Å; L491-A511 PolarHBondContact O-N 2.88Å; L491-L515 HydrophobicContact CD2-CD1 4.27Å; L491-M519 HydrophobicContact CD1-CE 4.4Å; L491-M519 HydrophobicContact CD1-SD 4.12Å; L491-M519 HydrophobicContact CD2-SD 4.21Å
492	L	86.9	Confident	68.7	Low	3 Å²	3	71 Å²	71	2%	0.016	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	149.2	169.6	-62.1	-179.4	0	0	0	110.1	L457 V472 S486 L508 L509 W510	L457-L492 HydrophobicContact CD1-CD1 4.01Å; L457-L492 HydrophobicContact CD1-CG 4.45Å; V472-L492 HydrophobicContact CG2-CD1 4.02Å; V472-L492 HydrophobicContact CG2-CD2 4.14Å; S486-L492 PolarHBondContact O-N 3.11Å; S486-L492 VanDerWaalsContact O-N 3.13Å; L492-L508 HydrophobicContact CD1-CB 4.18Å; L492-L508 HydrophobicContact CD1-CD1 4.15Å; L492-L509 CarbonylContact C-O 3.47Å; L492-L509 WeakPolarHBondContact CA-O 3.46Å; L492-L509 WeakPolarHBondContact CD2-O 3.3Å; L492-W510 HydrophobicContact CD2-CD2 3.56Å; L492-W510 HydrophobicContact CD2-CE3 3.7Å; L492-W510 HydrophobicContact CD2-CG 3.97Å; L492-W510 HydrophobicContact CD2-CH2 4.37Å; L492-W510 HydrophobicContact CD2-CZ2 4.24Å; L492-W510 HydrophobicContact CD2-CZ3 4.11Å
493	L	81.3	Confident	66.9	Low	67 Å²	67	75.2 Å²	75.2	35%	0.351	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.2	170.1	-59.2	176.3	0	0	0	108.7	L508 L509 A511	L493-L508 WeakPolarHBondContact O-CA 3.49Å; L493-L509 PolarHBondContact N-O 3.37Å; L493-L509 PolarHBondContact O-N 3.44Å; L493-A511 HydrophobicContact CD1-CB 4.1Å; L493-A511 HydrophobicContact CD2-CB 4.19Å; L493-A511 HydrophobicContact CG-CB 3.77Å
494	S	76.1	Confident	65	Low	60 Å²	60	83.4 Å²	83.4	42%	0.42	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	113.8	171	-175.7	0	0	0	0	108.8	R483 I507	R483-S494 PolarHBondContact NH2-OG 3.01Å; S494-I507 WeakPolarHBondContact CA-O 3.49Å
495	Q	68.3	Low	63.7	Low	52 Å²	52	86 Å²	86	24%	0.243	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.4	171.4	-152.5	177.7	25.9	0	0	108.9	D243 L497 I507 L509	D243-Q495 PolarHBondContact OD2-NE2 2.87Å; Q495-L497 PolarHBondContact O-N 3.24Å; Q495-I507 PolarHBondContact N-O 2.86Å; Q495-I507 PolarHBondContact O-N 3.3Å; Q495-I507 VanDerWaalsContact O-N 3.09Å; Q495-L509 HydrophobicContact CB-CD1 4.16Å
496	S	53.8	Low	62.6	Low	95 Å²	95	86.9 Å²	86.9	66%	0.664	44%	0.442	S	S	*	.			trans	-73.3	115.1	173.5	55.6	0	0	0	0	109.5	M498	S496-M498 PolarHBondContact O-N 2.72Å
497	L	47.3	Very low	62.1	Low	81 Å²	81	87.7 Å²	87.7	42%	0.424	45%	0.446	S	S	.	.			trans	-63.4	118	163.6	-81.5	160.7	0	0	0	108.1	Q495 R499 I507	Q495-L497 PolarHBondContact O-N 3.24Å; L497-R499 PolarHBondContact O-N 2.9Å; L497-I507 HydrophobicContact CD1-CD1 3.59Å; L497-I507 HydrophobicContact CD1-CG1 3.67Å; L497-I507 HydrophobicContact CD2-CD1 3.59Å; L497-I507 HydrophobicContact CG-CD1 3.44Å; L497-I507 VanDerWaalsContact CG-CD1 3.44Å; L497-I507 HydrophobicContact CG-CG1 3.9Å
498	M	39	Very low	62	Low	134 Å²	134	85.3 Å²	85.3	66%	0.66	43%	0.434	S	S	*	.	S	Bend	trans	-71.1	77.3	169.8	-88.8	-79.1	-105.9	0	0	109.7	S496	S496-M498 PolarHBondContact O-N 2.72Å
499	R	38.1	Very low	62	Low	146 Å²	146	78.7 Å²	78.7	55%	0.551	41%	0.41	S	S	*	.	S	Bend	trans	169	117	137.3	-93.7	171.2	-165.6	-164.7	8.7	114.1	S262 L497 T501	S262-R499 PolarHBondContact OG-NH1 3.02Å; S262-R499 PolarHBondContact OG-NH2 3.34Å; L497-R499 PolarHBondContact O-N 2.9Å; R499-T501 PolarHBondContact O-N 3.32Å
500	R	41.4	Very low	62.1	Low	221 Å²	221	79 Å²	79	83%	0.834	41%	0.411	S	S	*	.				53.4	20.2	117.1	-74.5	-175.1	173.4	171.8	-4.1	121.9
501	T	31.7	Very low	62.1	Low	120 Å²	120	78.9 Å²	78.9	74%	0.736	41%	0.408	S	S	*	.			trans	-113.7	146.4	156.2	45.4	0	0	0	0	110.6	R499 S503	R499-T501 PolarHBondContact O-N 3.32Å; T501-S503 PolarHBondContact O-N 2.87Å
502	L	33.3	Very low	62.1	Low	185 Å²	185	79.5 Å²	79.5	97%	0.969	41%	0.411	S	S	*	.	S	Bend	trans	-66.6	11.5	-154.3	-82.8	130.6	0	0	0	117.7	K504	L502-K504 PolarHBondContact O-N 3.33Å
503	S	43.3	Very low	62.2	Low	88 Å²	88	81 Å²	81	62%	0.615	42%	0.42	S	S	*	.			trans	-84.1	105.8	173.6	64.9	0	0	0	0	110.1	T501 D505	T501-S503 PolarHBondContact O-N 2.87Å; S503-D505 PolarHBondContact O-N 2.65Å
504	K	44.6	Very low	62.8	Low	210 Å²	210	78.4 Å²	78.4	91%	0.913	41%	0.406	S	S	*	.			trans	-58.8	-6.4	172.6	-79.3	-177.9	174.1	179.2	0	114.2	L502 G506	L502-K504 PolarHBondContact O-N 3.33Å; K504-G506 PolarHBondContact O-N 2.97Å
505	D	55.5	Low	63.7	Low	101 Å²	101	75.8 Å²	75.8	54%	0.54	39%	0.388	S	S	.	.			trans	-93.8	95.3	-174.9	-67.9	-36.5	0	0	0	111	R483 S503	R483-D505 IonicContact NH1-OD1 3.83Å; S503-D505 PolarHBondContact O-N 2.65Å
506	G	63.7	Low	64.9	Low	20 Å²	20	73.4 Å²	73.4	21%	0.206	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-58.2	166.1	172.2	0	0	0	0	0	113.7	R483 K504	R483-G506 PolarHBondContact NH1-O 3.17Å; R483-G506 VanDerWaalsContact NH1-O 3.16Å; R483-G506 PolarHBondContact NH2-O 2.98Å; K504-G506 PolarHBondContact O-N 2.97Å
507	I	74.6	Confident	66.8	Low	17 Å²	17	69 Å²	69	9%	0.087	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	133.6	177	-61.3	166.8	0	0	0	109	L249 V471 S494 Q495 L497 L509	L249-I507 HydrophobicContact CB-CD1 4.29Å; L249-I507 HydrophobicContact CD1-CB 4.21Å; L249-I507 HydrophobicContact CD1-CD1 3.39Å; L249-I507 HydrophobicContact CD1-CG1 3.7Å; L249-I507 HydrophobicContact CD1-CG2 3.43Å; L249-I507 VanDerWaalsContact CD1-CG2 3.43Å; V471-I507 HydrophobicContact CG1-CG2 4.05Å; S494-I507 WeakPolarHBondContact CA-O 3.49Å; Q495-I507 PolarHBondContact N-O 2.86Å; Q495-I507 PolarHBondContact O-N 3.3Å; Q495-I507 VanDerWaalsContact O-N 3.09Å; L497-I507 HydrophobicContact CD1-CD1 3.59Å; L497-I507 HydrophobicContact CD1-CG1 3.67Å; L497-I507 HydrophobicContact CD2-CD1 3.59Å; L497-I507 HydrophobicContact CG-CD1 3.44Å; L497-I507 VanDerWaalsContact CG-CD1 3.44Å; L497-I507 HydrophobicContact CG-CG1 3.9Å; I507-L509 HydrophobicContact CG2-CD2 3.99Å; I507-L509 HydrophobicContact CG2-CG 4.24Å
508	L	82.2	Confident	69.1	Low	11 Å²	11	65.1 Å²	65.1	6%	0.058	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.1	173.6	-63.6	173.7	0	0	0	110.5	V472 V478 R483 L487 L492 L493	V472-L508 HydrophobicContact CB-CB 4.08Å; V472-L508 HydrophobicContact CG2-CB 3.77Å; V472-L508 PolarHBondContact N-O 2.92Å; V478-L508 HydrophobicContact CG1-CD1 4.41Å; R483-L508 HydrophobicContact CG-CD1 4.12Å; R483-L508 HydrophobicContact CG-CD2 4.37Å; L487-L508 HydrophobicContact CD2-CD2 3.92Å; L487-L508 HydrophobicContact CG-CD2 4.35Å; L492-L508 HydrophobicContact CD1-CB 4.18Å; L492-L508 HydrophobicContact CD1-CD1 4.15Å; L493-L508 WeakPolarHBondContact O-CA 3.49Å
509	L	83.6	Confident	71.8	Confident	14 Å²	14	58.7 Å²	58.7	7%	0.073	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.6	179.9	-62.5	177	0	0	0	110.3	K245 V471 L492 L493 Q495 I507 A511	K245-L509 HydrophobicContact CB-CD2 4.31Å; K245-L509 HydrophobicContact CD-CD1 4.25Å; K245-L509 HydrophobicContact CD-CD2 3.94Å; V471-L509 HydrophobicContact CB-CD2 4.14Å; V471-L509 HydrophobicContact CG1-CD2 4.22Å; V471-L509 HydrophobicContact CG2-CD2 3.63Å; L492-L509 CarbonylContact C-O 3.47Å; L492-L509 WeakPolarHBondContact CA-O 3.46Å; L492-L509 WeakPolarHBondContact CD2-O 3.3Å; L493-L509 PolarHBondContact N-O 3.37Å; L493-L509 PolarHBondContact O-N 3.44Å; Q495-L509 HydrophobicContact CB-CD1 4.16Å; I507-L509 HydrophobicContact CG2-CD2 3.99Å; I507-L509 HydrophobicContact CG2-CG 4.24Å; L509-A511 PolarHBondContact O-N 2.83Å
510	W	86.8	Confident	74.5	Confident	13 Å²	13	51.8 Å²	51.8	5%	0.049	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	125.8	169.7	-71.6	99.4	0	0	0	110.6	L457 I460 A461 S470 L492 N512 Q516 M519	L457-W510 HydrophobicContact CD1-CH2 3.77Å; L457-W510 HydrophobicContact CD1-CZ2 4.24Å; L457-W510 HydrophobicContact CG-CH2 3.87Å; I460-W510 HydrophobicContact CG2-CZ2 4.3Å; A461-W510 VanDerWaalsContact CA-CZ2 3.43Å; A461-W510 HydrophobicContact CB-CH2 3.57Å; A461-W510 HydrophobicContact CB-CZ2 3.45Å; A461-W510 VanDerWaalsContact CB-CZ2 3.45Å; A461-W510 HydrophobicContact CB-CZ3 4.46Å; S470-W510 VanDerWaalsContact O-CD1 3.3Å; S470-W510 PolarHBondContact O-N 3.04Å; L492-W510 HydrophobicContact CD2-CD2 3.56Å; L492-W510 HydrophobicContact CD2-CE3 3.7Å; L492-W510 HydrophobicContact CD2-CG 3.97Å; L492-W510 HydrophobicContact CD2-CH2 4.37Å; L492-W510 HydrophobicContact CD2-CZ2 4.24Å; L492-W510 HydrophobicContact CD2-CZ3 4.11Å; W510-N512 VanDerWaalsContact C-N 3.35Å; W510-Q516 HydrophobicContact CB-CB 4.08Å; W510-Q516 HydrophobicContact CB-CG 4.34Å; W510-Q516 HydrophobicContact CD2-CB 3.8Å; W510-Q516 HydrophobicContact CD2-CG 3.67Å; W510-Q516 HydrophobicContact CE3-CB 3.93Å; W510-Q516 HydrophobicContact CE3-CG 4.22Å; W510-Q516 HydrophobicContact CG-CB 3.86Å; W510-Q516 VanDerWaalsContact CG-CD 3.47Å; W510-Q516 HydrophobicContact CG-CG 3.69Å; W510-M519 HydrophobicContact CH2-CE 4.39Å; W510-M519 HydrophobicContact CH2-SD 3.97Å; W510-M519 HydrophobicContact CZ3-SD 3.6Å; W510-M519 VanDerWaalsContact CZ3-SD 3.6Å
511	A	84.6	Confident	77.1	Confident	17 Å²	17	41.2 Å²	41.2	14%	0.14	23%	0.228	C	C	.	.	S	Bend	trans	-70.1	-32.3	-176.8	0	0	0	0	0	112.7	L491 L493 L509	L491-A511 WeakPolarHBondContact O-CB 3.42Å; L491-A511 PolarHBondContact O-N 2.88Å; L493-A511 HydrophobicContact CD1-CB 4.1Å; L493-A511 HydrophobicContact CD2-CB 4.19Å; L493-A511 HydrophobicContact CG-CB 3.77Å; L509-A511 PolarHBondContact O-N 2.83Å
512	N	87.7	Confident	80.1	Confident	15 Å²	15	36.1 Å²	36.1	8%	0.08	20%	0.196	C	C	.	.			trans	-143.3	127.6	-178.4	-176.3	-67.4	0	0	0	110	W510 F514 L515 Q516	W510-N512 VanDerWaalsContact C-N 3.35Å; N512-F514 VanDerWaalsContact C-N 3.32Å; N512-F514 PolarHBondContact O-N 2.71Å; N512-F514 WeakPolarHBondContact OD1-CA 3.04Å; N512-F514 VanDerWaalsContact OD1-CB 3.3Å; N512-F514 WeakPolarHBondContact OD1-CB 3.28Å; N512-F514 WeakPolarHBondContact OD1-CD2 3.23Å; N512-F514 PolarHBondContact OD1-N 3.1Å; N512-L515 HydrophobicContact CB-CB 4.23Å; N512-L515 HydrophobicContact CB-CD1 4.16Å; N512-L515 HydrophobicContact CB-CG 4.13Å; N512-L515 PolarHBondContact O-N 3.37Å; N512-L515 PolarHBondContact OD1-N 3.09Å; N512-Q516 PolarHBondContact O-N 3.33Å
513	P	89.3	Confident	83	Confident	33 Å²	33	28.3 Å²	28.3	21%	0.214	16%	0.155	C	C	.	.	H	α-helix	trans	-66.2	-31.8	-176.6	26	-34	0	0	0	113.1	A213 Q516 S517	A213-P513 HydrophobicContact CB-CB 4.31Å; A213-P513 HydrophobicContact CB-CG 4.21Å; P513-Q516 PolarHBondContact O-N 3.21Å; P513-S517 PolarHBondContact O-N 3.5Å; P513-S517 PolarHBondContact O-OG 3.45Å
514	F	94.3	Very high	85.4	Confident	13 Å²	13	24.3 Å²	24.3	6%	0.057	13%	0.127	C	C	.	.	H	α-helix	trans	-70.9	-38.8	178.3	-57.7	-83	0	0	0	111.7	A410 L411 L414 L432 N512 S517 Y518 L558	A410-F514 HydrophobicContact CB-CD2 4.43Å; A410-F514 HydrophobicContact CB-CE2 3.99Å; L411-F514 HydrophobicContact CD1-CE1 4.02Å; L411-F514 HydrophobicContact CD1-CZ 4.02Å; L411-F514 HydrophobicContact CD2-CB 4.2Å; L411-F514 HydrophobicContact CD2-CD1 3.61Å; L411-F514 HydrophobicContact CD2-CD2 3.56Å; L411-F514 HydrophobicContact CD2-CE1 3.79Å; L411-F514 HydrophobicContact CD2-CE2 3.73Å; L411-F514 HydrophobicContact CD2-CG 3.5Å; L411-F514 HydrophobicContact CD2-CZ 3.85Å; L411-F514 HydrophobicContact CG-CD1 4.33Å; L411-F514 HydrophobicContact CG-CD2 4.11Å; L411-F514 HydrophobicContact CG-CE1 3.99Å; L411-F514 HydrophobicContact CG-CE2 3.74Å; L411-F514 HydrophobicContact CG-CG 4.39Å; L411-F514 HydrophobicContact CG-CZ 3.69Å; L414-F514 HydrophobicContact CD1-CB 4.08Å; L432-F514 HydrophobicContact CD2-CD1 4.49Å; N512-F514 VanDerWaalsContact C-N 3.32Å; N512-F514 PolarHBondContact O-N 2.71Å; N512-F514 WeakPolarHBondContact OD1-CA 3.04Å; N512-F514 VanDerWaalsContact OD1-CB 3.3Å; N512-F514 WeakPolarHBondContact OD1-CB 3.28Å; N512-F514 WeakPolarHBondContact OD1-CD2 3.23Å; N512-F514 PolarHBondContact OD1-N 3.1Å; F514-S517 PolarHBondContact O-N 3.34Å; F514-Y518 WeakPolarHBondContact O-CB 3.43Å; F514-Y518 PolarHBondContact O-N 3.18Å; F514-L558 HydrophobicContact CD1-CD1 4.49Å; F514-L558 HydrophobicContact CD1-CD2 3.61Å; F514-L558 HydrophobicContact CE1-CD2 4Å
515	L	94.1	Very high	87.6	Confident	5 Å²	5	14.3 Å²	14.3	3%	0.026	8%	0.083	C	C	.	.	H	α-helix	trans	-68.3	-37	173.2	-64.2	-177.5	0	0	0	111.7	L414 C436 V439 K443 L491 N512 Y518 M519	L414-L515 HydrophobicContact CD2-CD1 4.2Å; L414-L515 HydrophobicContact CD2-CG 4.29Å; C436-L515 HydrophobicContact CB-CD2 4.29Å; V439-L515 HydrophobicContact CG1-CD1 4.39Å; V439-L515 HydrophobicContact CG1-CD2 4.48Å; K443-L515 HydrophobicContact CD-CD1 4.03Å; L491-L515 HydrophobicContact CD2-CD1 4.27Å; N512-L515 HydrophobicContact CB-CB 4.23Å; N512-L515 HydrophobicContact CB-CD1 4.16Å; N512-L515 HydrophobicContact CB-CG 4.13Å; N512-L515 PolarHBondContact O-N 3.37Å; N512-L515 PolarHBondContact OD1-N 3.09Å; L515-Y518 PolarHBondContact O-N 3.44Å; L515-M519 VanDerWaalsContact O-CG 3.29Å; L515-M519 WeakPolarHBondContact O-CG 3.44Å; L515-M519 PolarHBondContact O-N 3.02Å
516	Q	93.6	Very high	89.3	Confident	2 Å²	2	9.9 Å²	9.9	1%	0.009	6%	0.059	C	C	.	.	H	α-helix	trans	-59.3	-50.5	171.5	-179.4	-177.2	1.4	0	0	111.1	A461 V465 S469 W510 N512 P513 Y518 M519 A520	A461-Q516 HydrophobicContact CB-CG 4.35Å; V465-Q516 HydrophobicContact CG2-CG 4.45Å; S469-Q516 PolarHBondContact O-NE2 3.41Å; W510-Q516 HydrophobicContact CB-CB 4.08Å; W510-Q516 HydrophobicContact CB-CG 4.34Å; W510-Q516 HydrophobicContact CD2-CB 3.8Å; W510-Q516 HydrophobicContact CD2-CG 3.67Å; W510-Q516 HydrophobicContact CE3-CB 3.93Å; W510-Q516 HydrophobicContact CE3-CG 4.22Å; W510-Q516 HydrophobicContact CG-CB 3.86Å; W510-Q516 VanDerWaalsContact CG-CD 3.47Å; W510-Q516 HydrophobicContact CG-CG 3.69Å; N512-Q516 PolarHBondContact O-N 3.33Å; P513-Q516 PolarHBondContact O-N 3.21Å; Q516-Y518 VanDerWaalsContact C-N 3.31Å; Q516-Y518 PolarHBondContact O-N 3.01Å; Q516-M519 PolarHBondContact O-N 3.23Å; Q516-A520 WeakPolarHBondContact O-CB 3.48Å; Q516-A520 PolarHBondContact O-N 2.63Å
517	S	95	Very high	90.5	Very high	2 Å²	2	9.6 Å²	9.6	1%	0.014	5%	0.054	C	C	.	.	H	α-helix	trans	-61.4	-38.4	176.7	-71.6	0	0	0	0	112.4	P513 F514 A520 A521 T559	P513-S517 PolarHBondContact O-N 3.5Å; P513-S517 PolarHBondContact O-OG 3.45Å; F514-S517 PolarHBondContact O-N 3.34Å; S517-A520 PolarHBondContact O-N 3.31Å; S517-A521 VanDerWaalsContact O-CB 3.27Å; S517-A521 WeakPolarHBondContact O-CB 3.46Å; S517-A521 PolarHBondContact O-N 3.33Å; S517-T559 WeakPolarHBondContact CB-OG1 3.5Å; S517-T559 PolarHBondContact OG-OG1 3.15Å
518	Y	95.8	Very high	91.1	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63.6	-47.2	175.1	175	-83.6	0	0	0	112.1	T433 C436 H437 L440 F514 L515 Q516 A520 A521 V522 I562 L566	T433-Y518 HydrophobicContact CG2-CE2 4.35Å; C436-Y518 HydrophobicContact CB-CD2 3.33Å; C436-Y518 HydrophobicContact CB-CE2 4.13Å; C436-Y518 HydrophobicContact CB-CG 3.61Å; H437-Y518 HydrophobicContact CB-CE2 3.78Å; H437-Y518 AromaticContact ND1-CZ 3.87Å; H437-Y518 PolarHBondContact ND1-OH 3.32Å; L440-Y518 HydrophobicContact CB-CE1 4.4Å; L440-Y518 HydrophobicContact CD2-CD1 3.97Å; L440-Y518 HydrophobicContact CD2-CE1 3.44Å; L440-Y518 VanDerWaalsContact CD2-CE1 3.44Å; F514-Y518 WeakPolarHBondContact O-CB 3.43Å; F514-Y518 PolarHBondContact O-N 3.18Å; L515-Y518 PolarHBondContact O-N 3.44Å; Q516-Y518 VanDerWaalsContact C-N 3.31Å; Q516-Y518 PolarHBondContact O-N 3.01Å; Y518-A520 VanDerWaalsContact C-N 3.33Å; Y518-A520 PolarHBondContact O-N 3.38Å; Y518-A521 CarbonylContact O-C 3.58Å; Y518-A521 WeakPolarHBondContact O-CA 3.49Å; Y518-A521 VanDerWaalsContact O-CB 3.3Å; Y518-A521 WeakPolarHBondContact O-CB 3.37Å; Y518-A521 PolarHBondContact O-N 3.31Å; Y518-A521 VanDerWaalsContact O-N 3.08Å; Y518-V522 HydrophobicContact CD1-CG2 4.09Å; Y518-V522 HydrophobicContact CE1-CG2 3.48Å; Y518-V522 VanDerWaalsContact CE1-CG2 3.48Å; Y518-V522 WeakPolarHBondContact O-CG2 3.41Å; Y518-V522 PolarHBondContact O-N 3.27Å; Y518-I562 HydrophobicContact CD2-CG2 3.61Å; Y518-I562 HydrophobicContact CE2-CG2 4.35Å; Y518-I562 HydrophobicContact CG-CG2 4.31Å; Y518-L566 HydrophobicContact CE2-CD1 4.37Å; Y518-L566 HydrophobicContact CE2-CD2 3.63Å; Y518-L566 HydrophobicContact CE2-CG 4.24Å; Y518-L566 WeakPolarHBondContact OH-CD2 3.47Å
519	M	94.4	Very high	91.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.4	-37.3	178.7	-68.5	-173.4	71.5	0	0	112	L440 L454 L457 C458 A461 L491 W510 L515 Q516 A521 V522 H523	L440-M519 HydrophobicContact CD1-SD 4.35Å; L440-M519 HydrophobicContact CD2-CG 4.49Å; L454-M519 HydrophobicContact CD1-CE 3.57Å; L457-M519 HydrophobicContact CB-CE 3.77Å; L457-M519 HydrophobicContact CD2-CE 3.67Å; L457-M519 HydrophobicContact CD2-SD 4.5Å; L457-M519 HydrophobicContact CG-CE 3.49Å; L457-M519 VanDerWaalsContact CG-CE 3.49Å; L457-M519 HydrophobicContact CG-SD 4.47Å; C458-M519 VanDerWaalsContact CB-O 3.26Å; C458-M519 WeakPolarHBondContact CB-O 3.44Å; A461-M519 HydrophobicContact CB-CB 3.83Å; L491-M519 HydrophobicContact CD1-CE 4.4Å; L491-M519 HydrophobicContact CD1-SD 4.12Å; L491-M519 HydrophobicContact CD2-SD 4.21Å; W510-M519 HydrophobicContact CH2-CE 4.39Å; W510-M519 HydrophobicContact CH2-SD 3.97Å; W510-M519 HydrophobicContact CZ3-SD 3.6Å; W510-M519 VanDerWaalsContact CZ3-SD 3.6Å; L515-M519 VanDerWaalsContact O-CG 3.29Å; L515-M519 WeakPolarHBondContact O-CG 3.44Å; L515-M519 PolarHBondContact O-N 3.02Å; Q516-M519 PolarHBondContact O-N 3.23Å; M519-A521 VanDerWaalsContact C-N 3.28Å; M519-A521 PolarHBondContact O-N 3.09Å; M519-V522 PolarHBondContact O-N 2.81Å; M519-H523 PolarHBondContact O-N 2.9Å; M519-H523 VanDerWaalsContact O-N 3.08Å
520	A	95.4	Very high	91.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.3	-40.9	170.6	0	0	0	0	0	111.4	A461 W462 V465 Q516 S517 Y518 H523 L524 T559	A461-A520 HydrophobicContact CB-CB 4.04Å; W462-A520 HydrophobicContact CB-CB 4.23Å; W462-A520 HydrophobicContact CE3-CB 4.25Å; V465-A520 HydrophobicContact CB-CB 4.35Å; V465-A520 HydrophobicContact CG2-CB 3.69Å; Q516-A520 WeakPolarHBondContact O-CB 3.48Å; Q516-A520 PolarHBondContact O-N 2.63Å; S517-A520 PolarHBondContact O-N 3.31Å; Y518-A520 VanDerWaalsContact C-N 3.33Å; Y518-A520 PolarHBondContact O-N 3.38Å; A520-H523 PolarHBondContact O-N 3.25Å; A520-L524 WeakPolarHBondContact O-CB 3.4Å; A520-L524 PolarHBondContact O-N 2.92Å; A520-T559 HydrophobicContact CB-CG2 3.72Å
521	A	95.5	Very high	92	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66.2	-38	176.7	0	0	0	0	0	112.3	S517 Y518 M519 L524 S525 T559 I562 A563 L566	S517-A521 VanDerWaalsContact O-CB 3.27Å; S517-A521 WeakPolarHBondContact O-CB 3.46Å; S517-A521 PolarHBondContact O-N 3.33Å; Y518-A521 CarbonylContact O-C 3.58Å; Y518-A521 WeakPolarHBondContact O-CA 3.49Å; Y518-A521 VanDerWaalsContact O-CB 3.3Å; Y518-A521 WeakPolarHBondContact O-CB 3.37Å; Y518-A521 PolarHBondContact O-N 3.31Å; Y518-A521 VanDerWaalsContact O-N 3.08Å; M519-A521 VanDerWaalsContact C-N 3.28Å; M519-A521 PolarHBondContact O-N 3.09Å; A521-L524 PolarHBondContact O-N 2.97Å; A521-S525 WeakPolarHBondContact O-CB 3.31Å; A521-S525 PolarHBondContact O-N 2.79Å; A521-S525 PolarHBondContact O-OG 2.89Å; A521-T559 HydrophobicContact CB-CG2 4.08Å; A521-T559 WeakPolarHBondContact CB-O 2.82Å; A521-I562 HydrophobicContact CB-CB 3.89Å; A521-I562 HydrophobicContact CB-CG2 3.68Å; A521-A563 HydrophobicContact CB-CB 3.87Å; A521-L566 HydrophobicContact CB-CD1 3.84Å
522	V	94.3	Very high	92.3	Very high	12 Å²	12	24.9 Å²	24.9	7%	0.073	13%	0.133	C	C	.	.	H	α-helix	trans	-59.5	-46.3	171.9	171	0	0	0	0	110.5	Y518 M519 L524 L526 L566 L577	Y518-V522 HydrophobicContact CD1-CG2 4.09Å; Y518-V522 HydrophobicContact CE1-CG2 3.48Å; Y518-V522 VanDerWaalsContact CE1-CG2 3.48Å; Y518-V522 WeakPolarHBondContact O-CG2 3.41Å; Y518-V522 PolarHBondContact O-N 3.27Å; M519-V522 PolarHBondContact O-N 2.81Å; V522-L524 VanDerWaalsContact C-N 3.35Å; V522-L524 PolarHBondContact O-N 2.67Å; V522-L526 HydrophobicContact CG1-CD1 4.43Å; V522-L526 WeakPolarHBondContact O-CA 3.25Å; V522-L526 WeakPolarHBondContact O-CB 3.47Å; V522-L526 PolarHBondContact O-N 2.9Å; V522-L566 HydrophobicContact CB-CD1 4.4Å; V522-L566 HydrophobicContact CG2-CD1 3.69Å; V522-L566 HydrophobicContact CG2-CD2 4.47Å; V522-L577 HydrophobicContact CG1-CD1 4.48Å; V522-L577 HydrophobicContact CG2-CD1 4.19Å
523	H	94	Very high	92.5	Very high	22 Å²	22	30 Å²	30	10%	0.102	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-43.3	175.3	-178.5	79.5	0	0	0	111.9	C458 W462 M519 A520 S527 T529 V530	C458-H523 HydrophobicContact CB-CB 3.87Å; C458-H523 WeakPolarHBondContact O-CB 3.32Å; W462-H523 HydrophobicContact CB-CB 4.34Å; W462-H523 AromaticContact CD1-CD2 3.37Å; W462-H523 AromaticContact CD1-NE2 3.78Å; W462-H523 AromaticContact CG-CD2 3.74Å; M519-H523 PolarHBondContact O-N 2.9Å; M519-H523 VanDerWaalsContact O-N 3.08Å; A520-H523 PolarHBondContact O-N 3.25Å; H523-S527 WeakPolarHBondContact O-CB 3.46Å; H523-S527 PolarHBondContact O-N 2.69Å; H523-T529 PolarHBondContact CE1-OG1 2.83Å; H523-T529 VanDerWaalsContact CE1-OG1 3.26Å; H523-V530 WeakPolarHBondContact O-CG2 3.22Å
524	L	93.7	Very high	92.5	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-64.7	-45.9	-177.9	-172.9	59.4	0	0	0	112.7	W462 A520 A521 V522 V530 F535 T538 A563 K592	W462-L524 HydrophobicContact CH2-CD1 3.81Å; W462-L524 HydrophobicContact CH2-CD2 3.84Å; W462-L524 HydrophobicContact CH2-CG 4.38Å; W462-L524 HydrophobicContact CZ2-CD1 3.56Å; W462-L524 HydrophobicContact CZ2-CD2 4.45Å; W462-L524 HydrophobicContact CZ3-CD1 4.45Å; W462-L524 HydrophobicContact CZ3-CD2 3.98Å; A520-L524 WeakPolarHBondContact O-CB 3.4Å; A520-L524 PolarHBondContact O-N 2.92Å; A521-L524 PolarHBondContact O-N 2.97Å; V522-L524 VanDerWaalsContact C-N 3.35Å; V522-L524 PolarHBondContact O-N 2.67Å; L524-V530 HydrophobicContact CD1-CG1 4.2Å; L524-V530 WeakPolarHBondContact O-CG1 3.2Å; L524-F535 HydrophobicContact CD1-CD2 4.41Å; L524-F535 HydrophobicContact CG-CD2 4.04Å; L524-F535 HydrophobicContact CG-CE2 4.31Å; L524-T538 HydrophobicContact CD1-CG2 4.08Å; L524-T538 WeakPolarHBondContact CD1-OG1 3.36Å; L524-A563 HydrophobicContact CD2-CB 4.1Å; L524-K592 PolarHBondContact O-NZ 3.24Å
525	S	92.4	Very high	92.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-89.2	-38.9	-174.2	57.1	0	0	0	0	113.1	A521 K592	A521-S525 WeakPolarHBondContact O-CB 3.31Å; A521-S525 PolarHBondContact O-N 2.79Å; A521-S525 PolarHBondContact O-OG 2.89Å; S525-K592 WeakPolarHBondContact O-CD 3.47Å; S525-K592 WeakPolarHBondContact O-CE 2.81Å; S525-K592 PolarHBondContact O-NZ 2.89Å
526	L	90.8	Very high	92.2	Very high	8 Å²	8	32.2 Å²	32.2	4%	0.042	17%	0.169	C	C	.	.	H	α-helix	trans	-111.2	-2	-168.4	-49.2	-176.3	0	0	0	114.6	V522 L567 L574 F585 V589	V522-L526 HydrophobicContact CG1-CD1 4.43Å; V522-L526 WeakPolarHBondContact O-CA 3.25Å; V522-L526 WeakPolarHBondContact O-CB 3.47Å; V522-L526 PolarHBondContact O-N 2.9Å; L526-L567 HydrophobicContact CD2-CD2 4.3Å; L526-L574 HydrophobicContact CD1-CD1 4.32Å; L526-L574 HydrophobicContact CD1-CD2 4.27Å; L526-F585 HydrophobicContact CB-CE2 4.48Å; L526-F585 HydrophobicContact CD1-CE2 4.37Å; L526-F585 HydrophobicContact CD2-CE2 4.01Å; L526-F585 HydrophobicContact CD2-CZ 4.4Å; L526-V589 HydrophobicContact CD2-CG2 4.08Å
527	S	89.5	Confident	91.9	Very high	14 Å²	14	38 Å²	38	10%	0.098	20%	0.196	C	C	.	.			trans	-83.8	137.8	176	-173.1	0	0	0	0	112.9	H523 T529 V530	H523-S527 WeakPolarHBondContact O-CB 3.46Å; H523-S527 PolarHBondContact O-N 2.69Å; S527-T529 PolarHBondContact O-N 3.16Å; S527-T529 PolarHBondContact OG-N 3.32Å; S527-T529 VanDerWaalsContact OG-N 3.15Å; S527-T529 PolarHBondContact OG-OG1 2.86Å; S527-V530 PolarHBondContact O-N 2.98Å
528	R	86.1	Confident	91.5	Very high	127 Å²	127	39.2 Å²	39.2	48%	0.479	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.6	168.8	-69.2	-175.5	-175.5	-172.9	3.9	113.7	V530 Y580 M588	R528-V530 PolarHBondContact O-N 3.17Å; R528-Y580 HydrophobicContact CG-CE1 4.17Å; R528-Y580 HydrophobicContact CG-CE2 4.14Å; R528-M588 HydrophobicContact CG-CE 3.55Å
529	T	88	Confident	91	Very high	107 Å²	107	39.5 Å²	39.5	66%	0.656	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.1	177.5	62.2	0	0	0	0	112.4	H523 S527	H523-T529 PolarHBondContact CE1-OG1 2.83Å; H523-T529 VanDerWaalsContact CE1-OG1 3.26Å; S527-T529 PolarHBondContact O-N 3.16Å; S527-T529 PolarHBondContact OG-N 3.32Å; S527-T529 VanDerWaalsContact OG-N 3.15Å; S527-T529 PolarHBondContact OG-OG1 2.86Å
530	V	90.9	Very high	90.4	Very high	14 Å²	14	39.5 Å²	39.5	9%	0.085	21%	0.206	C	C	.	.	S	Bend	trans	-101.2	107.6	-179.8	-177.6	0	0	0	0	108.4	H523 L524 S527 R528 S534 F535 K592	H523-V530 WeakPolarHBondContact O-CG2 3.22Å; L524-V530 HydrophobicContact CD1-CG1 4.2Å; L524-V530 WeakPolarHBondContact O-CG1 3.2Å; S527-V530 PolarHBondContact O-N 2.98Å; R528-V530 PolarHBondContact O-N 3.17Å; V530-S534 WeakPolarHBondContact CG1-OG 3.18Å; V530-F535 HydrophobicContact CG1-CB 4.18Å; V530-K592 PolarHBondContact O-NZ 3.43Å
531	T	92.4	Very high	89.6	Confident	84 Å²	84	40.8 Å²	40.8	52%	0.515	21%	0.211	S	C	.	.			trans	-69.9	154.9	176.5	65.7	0	0	0	0	111.2	H533 S534 F535	T531-H533 PolarHBondContact O-N 2.86Å; T531-S534 PolarHBondContact N-OG 2.95Å; T531-S534 WeakPolarHBondContact O-CA 3.45Å; T531-S534 PolarHBondContact O-N 2.84Å; T531-S534 PolarHBondContact O-OG 3Å; T531-S534 WeakPolarHBondContact OG1-CB 3.45Å; T531-S534 PolarHBondContact OG1-N 2.85Å; T531-S534 PolarHBondContact OG1-OG 2.93Å; T531-F535 PolarHBondContact O-N 3.47Å
532	D	92.1	Very high	88.4	Confident	61 Å²	61	44.5 Å²	44.5	33%	0.326	23%	0.229	S	C	.	.	H	α-helix	trans	-52.7	-40.5	175.5	-76.5	2.5	0	0	0	113.1	F535 L536 S591 L595	D532-F535 PolarHBondContact O-N 3.43Å; D532-L536 WeakPolarHBondContact O-CB 3.15Å; D532-L536 PolarHBondContact O-N 3.22Å; D532-S591 PolarHBondContact OD2-OG 3.21Å; D532-L595 HydrophobicContact CB-CD1 3.7Å
533	H	90.2	Very high	86.7	Confident	123 Å²	123	50.4 Å²	50.4	57%	0.569	26%	0.257	S	S	*	.	H	α-helix	trans	-64	-44.3	174.7	179.8	-95.9	0	0	0	112.2	T531 F535 L536 Q537	T531-H533 PolarHBondContact O-N 2.86Å; H533-F535 VanDerWaalsContact C-N 3.33Å; H533-L536 PolarHBondContact O-N 2.76Å; H533-Q537 PolarHBondContact CE1-NE2 3Å; H533-Q537 WeakPolarHBondContact O-CG 3.4Å; H533-Q537 PolarHBondContact O-N 3.47Å; H533-Q537 VanDerWaalsContact O-N 3.12Å
534	S	90	Very high	84.8	Confident	37 Å²	37	50.9 Å²	50.9	26%	0.259	27%	0.268	S	S	.	.	H	α-helix	trans	-67	-35.7	177.3	70.2	0	0	0	0	112.3	V530 T531 T538	V530-S534 WeakPolarHBondContact CG1-OG 3.18Å; T531-S534 PolarHBondContact N-OG 2.95Å; T531-S534 WeakPolarHBondContact O-CA 3.45Å; T531-S534 PolarHBondContact O-N 2.84Å; T531-S534 PolarHBondContact O-OG 3Å; T531-S534 WeakPolarHBondContact OG1-CB 3.45Å; T531-S534 PolarHBondContact OG1-N 2.85Å; T531-S534 PolarHBondContact OG1-OG 2.93Å; S534-T538 VanDerWaalsContact O-CG2 3.32Å; S534-T538 WeakPolarHBondContact O-CG2 3.47Å; S534-T538 PolarHBondContact O-N 3.31Å
535	F	91.9	Very high	82.5	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.009	31%	0.313	C	S	.	.	H	α-helix	trans	-65.2	-47.1	174.1	176.9	-105.7	0	0	0	111.3	L524 V530 T531 D532 H533 Q537 T538 L539 L567 K592 L595 V596	L524-F535 HydrophobicContact CD1-CD2 4.41Å; L524-F535 HydrophobicContact CG-CD2 4.04Å; L524-F535 HydrophobicContact CG-CE2 4.31Å; V530-F535 HydrophobicContact CG1-CB 4.18Å; T531-F535 PolarHBondContact O-N 3.47Å; D532-F535 PolarHBondContact O-N 3.43Å; H533-F535 VanDerWaalsContact C-N 3.33Å; F535-Q537 VanDerWaalsContact C-N 3.3Å; F535-Q537 PolarHBondContact O-N 3.22Å; F535-T538 CarbonylContact O-C 3.6Å; F535-T538 WeakPolarHBondContact O-CA 3.32Å; F535-T538 PolarHBondContact O-N 3.06Å; F535-T538 PolarHBondContact O-OG1 3.46Å; F535-L539 HydrophobicContact CE1-CD2 3.83Å; F535-L539 HydrophobicContact CE1-CG 4.41Å; F535-L539 HydrophobicContact CE2-CD2 4.29Å; F535-L539 HydrophobicContact CZ-CD2 3.68Å; F535-L539 PolarHBondContact O-N 3.22Å; F535-L567 HydrophobicContact CE1-CD1 4.02Å; F535-L567 HydrophobicContact CE2-CD1 4.44Å; F535-L567 HydrophobicContact CZ-CD1 3.57Å; F535-K592 HydrophobicContact CD1-CB 4.17Å; F535-K592 HydrophobicContact CD1-CD 4.16Å; F535-K592 HydrophobicContact CD1-CG 3.94Å; F535-K592 HydrophobicContact CD2-CD 4.4Å; F535-K592 HydrophobicContact CE1-CB 3.98Å; F535-K592 HydrophobicContact CE1-CD 4.49Å; F535-K592 HydrophobicContact CE1-CG 4.26Å; F535-K592 HydrophobicContact CG-CD 4.12Å; F535-K592 HydrophobicContact CG-CG 4.36Å; F535-L595 HydrophobicContact CD1-CD1 4.35Å; F535-V596 HydrophobicContact CE1-CG2 3.9Å; F535-V596 HydrophobicContact CZ-CG2 4.02Å
536	L	89.3	Confident	80.1	Confident	58 Å²	58	65.5 Å²	65.5	30%	0.304	35%	0.353	S	S	.	.	H	α-helix	trans	-57.7	-42.2	177.6	-176.3	63.9	0	0	0	112.1	D532 H533 T538 L539 Q542	D532-L536 WeakPolarHBondContact O-CB 3.15Å; D532-L536 PolarHBondContact O-N 3.22Å; H533-L536 PolarHBondContact O-N 2.76Å; L536-T538 PolarHBondContact O-N 3.08Å; L536-L539 HydrophobicContact CD1-CD1 3.88Å; L536-L539 WeakPolarHBondContact O-CB 3.22Å; L536-L539 PolarHBondContact O-N 3.37Å; L536-L539 VanDerWaalsContact O-N 3.15Å; L536-Q542 PolarHBondContact O-NE2 3.48Å
537	Q	87.8	Confident	77.9	Confident	123 Å²	123	67.5 Å²	67.5	58%	0.575	38%	0.376	S	S	*	.	H	α-helix	trans	-64.1	-21.6	175.9	-73	-175.2	-18.7	0	0	113.8	H533 F535	H533-Q537 PolarHBondContact CE1-NE2 3Å; H533-Q537 WeakPolarHBondContact O-CG 3.4Å; H533-Q537 PolarHBondContact O-N 3.47Å; H533-Q537 VanDerWaalsContact O-N 3.12Å; F535-Q537 VanDerWaalsContact C-N 3.3Å; F535-Q537 PolarHBondContact O-N 3.22Å
538	T	86.1	Confident	75.6	Confident	29 Å²	29	77.1 Å²	77.1	18%	0.178	41%	0.41	C	S	.	.	H	α-helix	trans	-93.1	-7.7	177.5	62.2	0	0	0	0	113.5	W462 L524 S534 F535 L536 Q560	W462-T538 HydrophobicContact CH2-CG2 4.11Å; W462-T538 HydrophobicContact CZ2-CG2 3.98Å; L524-T538 HydrophobicContact CD1-CG2 4.08Å; L524-T538 WeakPolarHBondContact CD1-OG1 3.36Å; S534-T538 VanDerWaalsContact O-CG2 3.32Å; S534-T538 WeakPolarHBondContact O-CG2 3.47Å; S534-T538 PolarHBondContact O-N 3.31Å; F535-T538 CarbonylContact O-C 3.6Å; F535-T538 WeakPolarHBondContact O-CA 3.32Å; F535-T538 PolarHBondContact O-N 3.06Å; F535-T538 PolarHBondContact O-OG1 3.46Å; L536-T538 PolarHBondContact O-N 3.08Å; T538-Q560 VanDerWaalsContact O-CD 3.27Å; T538-Q560 VanDerWaalsContact O-CG 3.3Å; T538-Q560 WeakPolarHBondContact O-CG 3.38Å; T538-Q560 PolarHBondContact O-NE2 3.15Å
539	L	85.9	Confident	73.8	Confident	5 Å²	5	78.2 Å²	78.2	3%	0.026	41%	0.414	C	S	.	.	S	Bend	trans	-60.9	153.2	175.5	-70	-171.1	0	0	0	111.3	F535 L536 Q542 V596 H599	F535-L539 HydrophobicContact CE1-CD2 3.83Å; F535-L539 HydrophobicContact CE1-CG 4.41Å; F535-L539 HydrophobicContact CE2-CD2 4.29Å; F535-L539 HydrophobicContact CZ-CD2 3.68Å; F535-L539 PolarHBondContact O-N 3.22Å; L536-L539 HydrophobicContact CD1-CD1 3.88Å; L536-L539 WeakPolarHBondContact O-CB 3.22Å; L536-L539 PolarHBondContact O-N 3.37Å; L536-L539 VanDerWaalsContact O-N 3.15Å; L539-Q542 VanDerWaalsContact O-CG 3.23Å; L539-Q542 WeakPolarHBondContact O-CG 3.17Å; L539-V596 HydrophobicContact CD1-CG2 4.4Å; L539-V596 HydrophobicContact CD2-CG2 4.18Å; L539-H599 HydrophobicContact CD1-CB 3.67Å
540	P	81.1	Confident	71.8	Confident	1 Å²	1	82 Å²	82	1%	0.006	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	165.5	176.9	27.1	-33.9	0	0	0	111.1	Q542 H599 Y619	P540-Q542 PolarHBondContact O-N 2.95Å; P540-Q542 VanDerWaalsContact O-N 3.15Å; P540-H599 PolarHBondContact O-CE1 2.99Å; P540-H599 VanDerWaalsContact O-CE1 3.28Å; P540-H599 PolarHBondContact O-NE2 2.91Å; P540-Y619 HydrophobicContact CG-CD2 3.88Å; P540-Y619 HydrophobicContact CG-CE2 3.75Å; P540-Y619 HydrophobicContact CG-CG 4.48Å
541	F	79.1	Confident	70	Confident	27 Å²	27	87 Å²	87	12%	0.118	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	5.8	175.2	-36.8	-60.7	0	0	0	117.1	H599 L603 Q612 E615 A616	F541-H599 AromaticContact CD2-NE2 3.94Å; F541-L603 HydrophobicContact CB-CD2 4.08Å; F541-L603 HydrophobicContact CD2-CD1 3.59Å; F541-L603 HydrophobicContact CD2-CD2 4.29Å; F541-L603 HydrophobicContact CE2-CD1 3.96Å; F541-L603 HydrophobicContact CG-CD1 4.33Å; F541-L603 HydrophobicContact CG-CD2 4.47Å; F541-Q612 HydrophobicContact CD1-CB 3.98Å; F541-Q612 HydrophobicContact CD1-CG 3.98Å; F541-Q612 HydrophobicContact CE1-CB 3.77Å; F541-Q612 HydrophobicContact CE1-CG 4.09Å; F541-Q612 WeakPolarHBondContact CE1-O 3.22Å; F541-E615 HydrophobicContact CE1-CB 4.07Å; F541-E615 HydrophobicContact CE1-CG 4.31Å; F541-E615 HydrophobicContact CZ-CB 4.03Å; F541-E615 HydrophobicContact CZ-CG 4.07Å; F541-A616 HydrophobicContact CE2-CB 4.42Å; F541-A616 HydrophobicContact CZ-CB 4.03Å
542	Q	71.6	Confident	68.5	Low	78 Å²	78	86 Å²	86	36%	0.364	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-68.5	141.2	176.6	-67.3	-69	-21.1	0	0	113.3	L536 L539 P540 H599	L536-Q542 PolarHBondContact O-NE2 3.48Å; L539-Q542 VanDerWaalsContact O-CG 3.23Å; L539-Q542 WeakPolarHBondContact O-CG 3.17Å; P540-Q542 PolarHBondContact O-N 2.95Å; P540-Q542 VanDerWaalsContact O-N 3.15Å; Q542-H599 PolarHBondContact NE2-CE1 2.83Å; Q542-H599 PolarHBondContact NE2-ND1 3.23Å
543	M	57.8	Low	67.6	Low	135 Å²	135	88.2 Å²	88.2	67%	0.665	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-79	133.1	175.8	-70.5	-172.6	67.3	0	0	111.8
544	G	54.8	Low	66.9	Low	32 Å²	32	84.2 Å²	84.2	33%	0.33	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-71.1	157.1	177	0	0	0	0	0	113.4	K546 G547	G544-K546 PolarHBondContact O-N 2.93Å; G544-G547 PolarHBondContact O-N 3.27Å
545	A	45.1	Very low	66.6	Low	117 Å²	117	82.7 Å²	82.7	97%	0.967	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-0.5	-175.2	0	0	0	0	0	117.3
546	K	41.7	Very low	66.3	Low	193 Å²	193	84.2 Å²	84.2	84%	0.839	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.3	17.2	177.1	-67	-171.3	176.5	-176.5	0	113.2	G544 R548	G544-K546 PolarHBondContact O-N 2.93Å; K546-R548 PolarHBondContact O-N 2.98Å
547	G	43.8	Very low	66.2	Low	51 Å²	51	82.8 Å²	82.8	53%	0.526	42%	0.418	S	S	.	.	S	Bend	trans	66.5	-2	-173.4	0	0	0	0	0	114.5	G544	G544-G547 PolarHBondContact O-N 3.27Å
548	R	41.4	Very low	66.4	Low	215 Å²	215	77.9 Å²	77.9	81%	0.811	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-95.3	121.2	172.9	-68.7	-172.4	-179.4	179.8	0.9	109.7	K546 K550	K546-R548 PolarHBondContact O-N 2.98Å; R548-K550 PolarHBondContact O-N 2.86Å
549	R	48.5	Very low	66.8	Low	150 Å²	150	76.5 Å²	76.5	57%	0.566	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-64.5	124.5	177	-62	179.3	-178.1	175.5	0.5	108.8
550	K	47	Very low	67.1	Low	186 Å²	186	76.7 Å²	76.7	81%	0.809	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-78.6	132	173.7	-117.1	179.5	-179	177	0	107.5	R548 Q552	R548-K550 PolarHBondContact O-N 2.86Å; K550-Q552 PolarHBondContact O-N 2.93Å; K550-Q552 VanDerWaalsContact O-N 3.07Å
551	P	51.8	Low	67.6	Low	121 Å²	121	78.3 Å²	78.3	79%	0.786	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-58.7	117.6	170.6	22.1	-29.5	0	0	0	108.4
552	Q	60.7	Low	68.3	Low	63 Å²	63	77 Å²	77	29%	0.294	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-72.2	146.9	178.3	-78.8	-177.8	-23.7	0	0	109.3	K550 E557	K550-Q552 PolarHBondContact O-N 2.93Å; K550-Q552 VanDerWaalsContact O-N 3.07Å; Q552-E557 HydrophobicContact CB-CG 3.77Å; Q552-E557 WeakPolarHBondContact CB-OE1 3.32Å
553	R	72.8	Confident	69.4	Low	107 Å²	107	73.3 Å²	73.3	40%	0.404	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-91.7	143.5	-175.7	-62.8	174.8	-179.2	175.5	1	108.2	R298 K466 E555 M556 E557	R298-R553 VanDerWaalsContact NH1-NH1 3.12Å; K466-R553 PolarHBondContact O-NH1 2.94Å; K466-R553 VanDerWaalsContact O-NH1 3.17Å; R553-E555 VanDerWaalsContact C-N 3.31Å; R553-E555 PolarHBondContact O-N 3.32Å; R553-M556 HydrophobicContact CB-CB 4.35Å; R553-M556 WeakPolarHBondContact O-CA 3.27Å; R553-M556 WeakPolarHBondContact O-CB 3.06Å; R553-M556 PolarHBondContact O-N 3.43Å; R553-E557 PolarHBondContact O-N 3.15Å
554	E	76.6	Confident	71	Confident	39 Å²	39	66.9 Å²	66.9	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-49.3	-46.8	-178.9	-172.4	-172	166.9	0	0	113.1	N212 A213 R349 M556 E557 L558	N212-E554 VanDerWaalsContact CB-OE1 3.27Å; N212-E554 WeakPolarHBondContact CB-OE1 3.35Å; A213-E554 PolarHBondContact N-OE1 3Å; R349-E554 VanDerWaalsContact CD-OE2 3.32Å; R349-E554 WeakPolarHBondContact CD-OE2 3.31Å; R349-E554 IonicContact NH1-OE2 3.83Å; E554-M556 VanDerWaalsContact C-N 3.34Å; E554-M556 PolarHBondContact O-N 3.41Å; E554-E557 PolarHBondContact O-N 3.49Å; E554-L558 WeakPolarHBondContact O-CB 3.23Å; E554-L558 PolarHBondContact O-N 3.19Å
555	E	83	Confident	72.8	Confident	5 Å²	5	65.5 Å²	65.5	2%	0.023	33%	0.325	C	S	.	.	H	α-helix	trans	-66.2	-33.6	178.2	-76.5	170.2	-171.9	0	0	113.6	R349 V465 R553 T559	R349-E555 IonicContact CZ-OE1 2.85Å; R349-E555 IonicContact NH1-OE1 2.61Å; R349-E555 PolarHBondContact NH1-OE1 2.91Å; R349-E555 IonicContact NH2-OE1 3.47Å; R349-E555 PolarHBondContact NH2-OE1 2.99Å; V465-E555 HydrophobicContact CG1-CB 4.35Å; R553-E555 VanDerWaalsContact C-N 3.31Å; R553-E555 PolarHBondContact O-N 3.32Å; E555-T559 VanDerWaalsContact O-CB 3.3Å; E555-T559 WeakPolarHBondContact O-CB 3.46Å; E555-T559 PolarHBondContact O-N 2.77Å; E555-T559 PolarHBondContact O-OG1 3.22Å
556	M	87.1	Confident	75	Confident	34 Å²	34	60 Å²	60	17%	0.167	28%	0.279	C	S	.	.	H	α-helix	trans	-72.2	-45.8	178.8	-178.1	61.3	69.6	0	0	110.3	W462 V465 K466 R553 E554 L558 T559 Q560	W462-M556 HydrophobicContact CH2-CE 3.94Å; W462-M556 HydrophobicContact CH2-SD 3.84Å; W462-M556 HydrophobicContact CZ3-CE 3.89Å; W462-M556 HydrophobicContact CZ3-SD 3.77Å; V465-M556 HydrophobicContact CG1-CE 3.96Å; V465-M556 HydrophobicContact CG1-SD 4.31Å; K466-M556 HydrophobicContact CG-CE 4.26Å; R553-M556 HydrophobicContact CB-CB 4.35Å; R553-M556 WeakPolarHBondContact O-CA 3.27Å; R553-M556 WeakPolarHBondContact O-CB 3.06Å; R553-M556 PolarHBondContact O-N 3.43Å; E554-M556 VanDerWaalsContact C-N 3.34Å; E554-M556 PolarHBondContact O-N 3.41Å; M556-L558 VanDerWaalsContact C-N 3.34Å; M556-L558 PolarHBondContact O-N 2.79Å; M556-T559 PolarHBondContact O-N 3.28Å; M556-Q560 HydrophobicContact CG-CG 4.39Å; M556-Q560 WeakPolarHBondContact O-CB 3.45Å; M556-Q560 WeakPolarHBondContact O-CG 3.29Å; M556-Q560 PolarHBondContact O-N 3.31Å; M556-Q560 HydrophobicContact SD-CG 4.29Å
557	E	87.4	Confident	77.3	Confident	28 Å²	28	50.9 Å²	50.9	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-57.6	-48.5	175.3	-69.4	172.3	-171.4	0	0	110.5	R351 Q552 R553 E554 T559 Q560 R561	R351-E557 IonicContact CZ-OE2 2.85Å; R351-E557 IonicContact NH1-OE1 2.56Å; R351-E557 PolarHBondContact NH1-OE1 2.94Å; R351-E557 IonicContact NH1-OE2 3.34Å; R351-E557 PolarHBondContact NH1-OE2 3.48Å; Q552-E557 HydrophobicContact CB-CG 3.77Å; Q552-E557 WeakPolarHBondContact CB-OE1 3.32Å; R553-E557 PolarHBondContact O-N 3.15Å; E554-E557 PolarHBondContact O-N 3.49Å; E557-T559 VanDerWaalsContact C-N 3.34Å; E557-T559 PolarHBondContact O-N 3.23Å; E557-Q560 PolarHBondContact O-N 2.84Å; E557-R561 WeakPolarHBondContact O-CB 3.47Å; E557-R561 PolarHBondContact O-N 2.7Å
558	L	90.9	Very high	79.5	Confident	19 Å²	19	48.8 Å²	48.8	10%	0.099	22%	0.216	C	C	.	.	H	α-helix	trans	-58.4	-44.5	175.8	179.3	62.1	0	0	0	112.4	L432 F514 E554 M556 R561 I562	L432-L558 HydrophobicContact CD2-CD1 3.61Å; F514-L558 HydrophobicContact CD1-CD1 4.49Å; F514-L558 HydrophobicContact CD1-CD2 3.61Å; F514-L558 HydrophobicContact CE1-CD2 4Å; E554-L558 WeakPolarHBondContact O-CB 3.23Å; E554-L558 PolarHBondContact O-N 3.19Å; M556-L558 VanDerWaalsContact C-N 3.34Å; M556-L558 PolarHBondContact O-N 2.79Å; L558-R561 PolarHBondContact O-N 2.93Å; L558-I562 HydrophobicContact CD1-CD1 3.85Å; L558-I562 HydrophobicContact CD1-CG1 4.25Å; L558-I562 HydrophobicContact CG-CD1 3.92Å; L558-I562 VanDerWaalsContact O-CG1 3.29Å; L558-I562 WeakPolarHBondContact O-CG1 3.44Å; L558-I562 PolarHBondContact O-N 3.36Å
559	T	93.9	Very high	81.6	Confident	0 Å²	0	40 Å²	40	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.1	-42	178.9	-58.8	0	0	0	0	111.7	W462 V465 S517 A520 A521 E555 M556 E557 R561 I562 A563	W462-T559 HydrophobicContact CE3-CG2 4.21Å; W462-T559 HydrophobicContact CZ3-CG2 4.01Å; V465-T559 HydrophobicContact CG1-CG2 4.48Å; S517-T559 WeakPolarHBondContact CB-OG1 3.5Å; S517-T559 PolarHBondContact OG-OG1 3.15Å; A520-T559 HydrophobicContact CB-CG2 3.72Å; A521-T559 HydrophobicContact CB-CG2 4.08Å; A521-T559 WeakPolarHBondContact CB-O 2.82Å; E555-T559 VanDerWaalsContact O-CB 3.3Å; E555-T559 WeakPolarHBondContact O-CB 3.46Å; E555-T559 PolarHBondContact O-N 2.77Å; E555-T559 PolarHBondContact O-OG1 3.22Å; M556-T559 PolarHBondContact O-N 3.28Å; E557-T559 VanDerWaalsContact C-N 3.34Å; E557-T559 PolarHBondContact O-N 3.23Å; T559-R561 VanDerWaalsContact C-N 3.35Å; T559-I562 PolarHBondContact O-N 3.23Å; T559-A563 VanDerWaalsContact O-CB 3.24Å; T559-A563 WeakPolarHBondContact O-CB 3.42Å; T559-A563 PolarHBondContact O-N 3.32Å
560	Q	92.1	Very high	83.3	Confident	10 Å²	10	33.8 Å²	33.8	5%	0.047	16%	0.162	C	C	.	.	H	α-helix	trans	-62.9	-42.9	176.9	-72.9	166.8	-19.4	0	0	111.6	T538 M556 E557 A563 A564	T538-Q560 VanDerWaalsContact O-CD 3.27Å; T538-Q560 VanDerWaalsContact O-CG 3.3Å; T538-Q560 WeakPolarHBondContact O-CG 3.38Å; T538-Q560 PolarHBondContact O-NE2 3.15Å; M556-Q560 HydrophobicContact CG-CG 4.39Å; M556-Q560 WeakPolarHBondContact O-CB 3.45Å; M556-Q560 WeakPolarHBondContact O-CG 3.29Å; M556-Q560 PolarHBondContact O-N 3.31Å; M556-Q560 HydrophobicContact SD-CG 4.29Å; E557-Q560 PolarHBondContact O-N 2.84Å; Q560-A563 PolarHBondContact O-N 3.31Å; Q560-A564 PolarHBondContact O-N 3.25Å; Q560-A564 VanDerWaalsContact O-N 3.11Å
561	R	92.1	Very high	84.9	Confident	34 Å²	34	29 Å²	29	13%	0.128	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-49	177.2	-165.9	-165.7	-61.7	172.6	-2.7	111.8	E557 L558 T559 A563 A564 G565 E615 N618 E622	E557-R561 WeakPolarHBondContact O-CB 3.47Å; E557-R561 PolarHBondContact O-N 2.7Å; L558-R561 PolarHBondContact O-N 2.93Å; T559-R561 VanDerWaalsContact C-N 3.35Å; R561-A563 VanDerWaalsContact C-N 3.3Å; R561-A563 PolarHBondContact O-N 3.12Å; R561-A564 PolarHBondContact O-N 3.25Å; R561-G565 PolarHBondContact O-N 2.56Å; R561-E615 IonicContact CZ-OE1 3.51Å; R561-E615 IonicContact CZ-OE2 3.48Å; R561-E615 IonicContact NE-OE1 3.45Å; R561-E615 PolarHBondContact NE-OE1 3.32Å; R561-E615 IonicContact NE-OE2 3.65Å; R561-E615 VanDerWaalsContact NH2-CD 3.33Å; R561-E615 IonicContact NH2-OE1 3.82Å; R561-E615 PolarHBondContact NH2-OE1 2.63Å; R561-E615 IonicContact NH2-OE2 2.73Å; R561-E615 PolarHBondContact NH2-OE2 2.93Å; R561-N618 PolarHBondContact NH2-ND2 2.81Å; R561-E622 HydrophobicContact CG-CB 4.2Å; R561-E622 HydrophobicContact CG-CG 3.8Å
562	I	94.9	Very high	86.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.1	-37.5	176.7	-64.9	168.4	0	0	0	110.9	T433 Y518 A521 L558 T559 A564 G565 L566	T433-I562 HydrophobicContact CG2-CG2 4Å; T433-I562 WeakPolarHBondContact OG1-CA 3.48Å; Y518-I562 HydrophobicContact CD2-CG2 3.61Å; Y518-I562 HydrophobicContact CE2-CG2 4.35Å; Y518-I562 HydrophobicContact CG-CG2 4.31Å; A521-I562 HydrophobicContact CB-CB 3.89Å; A521-I562 HydrophobicContact CB-CG2 3.68Å; L558-I562 HydrophobicContact CD1-CD1 3.85Å; L558-I562 HydrophobicContact CD1-CG1 4.25Å; L558-I562 HydrophobicContact CG-CD1 3.92Å; L558-I562 VanDerWaalsContact O-CG1 3.29Å; L558-I562 WeakPolarHBondContact O-CG1 3.44Å; L558-I562 PolarHBondContact O-N 3.36Å; T559-I562 PolarHBondContact O-N 3.23Å; I562-A564 VanDerWaalsContact C-N 3.28Å; I562-A564 PolarHBondContact O-N 3.43Å; I562-G565 PolarHBondContact O-N 3.08Å; I562-L566 HydrophobicContact CG2-CD1 4.17Å; I562-L566 HydrophobicContact CG2-CG 4.25Å; I562-L566 WeakPolarHBondContact O-CB 3.5Å; I562-L566 WeakPolarHBondContact O-CG 3.2Å; I562-L566 PolarHBondContact O-N 3.32Å
563	A	94.3	Very high	87.1	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.008	13%	0.126	C	C	.	.	H	α-helix	trans	-62.7	-36.4	178.6	0	0	0	0	0	112.1	A521 L524 T559 Q560 R561 L567	A521-A563 HydrophobicContact CB-CB 3.87Å; L524-A563 HydrophobicContact CD2-CB 4.1Å; T559-A563 VanDerWaalsContact O-CB 3.24Å; T559-A563 WeakPolarHBondContact O-CB 3.42Å; T559-A563 PolarHBondContact O-N 3.32Å; Q560-A563 PolarHBondContact O-N 3.31Å; R561-A563 VanDerWaalsContact C-N 3.3Å; R561-A563 PolarHBondContact O-N 3.12Å; A563-L567 WeakPolarHBondContact O-CG 3.48Å; A563-L567 PolarHBondContact O-N 3.42Å
564	A	90.9	Very high	87.6	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-68.4	-49.1	171.8	0	0	0	0	0	111.5	Q560 R561 I562 L566 L567 F568 Y619	Q560-A564 PolarHBondContact O-N 3.25Å; Q560-A564 VanDerWaalsContact O-N 3.11Å; R561-A564 PolarHBondContact O-N 3.25Å; I562-A564 VanDerWaalsContact C-N 3.28Å; I562-A564 PolarHBondContact O-N 3.43Å; A564-L566 PolarHBondContact O-N 2.92Å; A564-L567 WeakPolarHBondContact O-CB 3.49Å; A564-L567 PolarHBondContact O-N 2.85Å; A564-F568 WeakPolarHBondContact O-CD2 3.48Å; A564-Y619 HydrophobicContact CB-CD2 3.9Å; A564-Y619 HydrophobicContact CB-CE1 4.1Å; A564-Y619 HydrophobicContact CB-CE2 3.21Å; A564-Y619 WeakPolarHBondContact CB-OH 3.49Å
565	G	92	Very high	87.5	Confident	3 Å²	3	23.9 Å²	23.9	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-55.4	-38.2	176.9	0	0	0	0	0	113.2	R561 I562 L567 F568 H569 E622	R561-G565 PolarHBondContact O-N 2.56Å; I562-G565 PolarHBondContact O-N 3.08Å; G565-L567 VanDerWaalsContact C-N 3.33Å; G565-L567 PolarHBondContact O-N 3.32Å; G565-F568 CarbonylContact O-C 3.57Å; G565-F568 PolarHBondContact O-N 3.02Å; G565-F568 VanDerWaalsContact O-N 3.15Å; G565-H569 PolarHBondContact O-N 3.5Å; G565-E622 VanDerWaalsContact CA-O 3.24Å; G565-E622 WeakPolarHBondContact CA-O 3.31Å
566	L	92.1	Very high	87.2	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.1	-40.2	177	-81.8	172.4	0	0	0	112.3	T433 Y518 A521 V522 I562 A564 F568 H569 L574	T433-L566 HydrophobicContact CG2-CD2 3.96Å; T433-L566 HydrophobicContact CG2-CG 3.82Å; Y518-L566 HydrophobicContact CE2-CD1 4.37Å; Y518-L566 HydrophobicContact CE2-CD2 3.63Å; Y518-L566 HydrophobicContact CE2-CG 4.24Å; Y518-L566 WeakPolarHBondContact OH-CD2 3.47Å; A521-L566 HydrophobicContact CB-CD1 3.84Å; V522-L566 HydrophobicContact CB-CD1 4.4Å; V522-L566 HydrophobicContact CG2-CD1 3.69Å; V522-L566 HydrophobicContact CG2-CD2 4.47Å; I562-L566 HydrophobicContact CG2-CD1 4.17Å; I562-L566 HydrophobicContact CG2-CG 4.25Å; I562-L566 WeakPolarHBondContact O-CB 3.5Å; I562-L566 WeakPolarHBondContact O-CG 3.2Å; I562-L566 PolarHBondContact O-N 3.32Å; A564-L566 PolarHBondContact O-N 2.92Å; L566-F568 PolarHBondContact O-N 2.97Å; L566-H569 PolarHBondContact O-N 3.08Å; L566-L574 HydrophobicContact CD2-CD2 3.76Å; L566-L574 VanDerWaalsContact O-CD1 3.24Å; L566-L574 WeakPolarHBondContact O-CD1 3.42Å
567	L	90.8	Very high	86.8	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-24.6	179.4	-69.6	171.6	0	0	0	112.5	L526 F535 A563 A564 G565 V589 K592 Q593 V596	L526-L567 HydrophobicContact CD2-CD2 4.3Å; F535-L567 HydrophobicContact CE1-CD1 4.02Å; F535-L567 HydrophobicContact CE2-CD1 4.44Å; F535-L567 HydrophobicContact CZ-CD1 3.57Å; A563-L567 WeakPolarHBondContact O-CG 3.48Å; A563-L567 PolarHBondContact O-N 3.42Å; A564-L567 WeakPolarHBondContact O-CB 3.49Å; A564-L567 PolarHBondContact O-N 2.85Å; G565-L567 VanDerWaalsContact C-N 3.33Å; G565-L567 PolarHBondContact O-N 3.32Å; L567-V589 HydrophobicContact CD2-CG1 4.33Å; L567-K592 HydrophobicContact CD1-CB 3.82Å; L567-K592 HydrophobicContact CD2-CB 3.78Å; L567-K592 HydrophobicContact CD2-CD 4.43Å; L567-K592 HydrophobicContact CG-CB 4.49Å; L567-Q593 HydrophobicContact CB-CG 3.97Å; L567-Q593 PolarHBondContact O-NE2 3.44Å; L567-V596 HydrophobicContact CD1-CG2 3.84Å
568	F	88.8	Confident	86.4	Confident	7 Å²	7	26 Å²	26	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-104.8	0.2	179.2	-65	-89.4	0	0	0	113.5	A564 G565 L566 Q593 V596 M597 A623 T626 T634 M638	A564-F568 WeakPolarHBondContact O-CD2 3.48Å; G565-F568 CarbonylContact O-C 3.57Å; G565-F568 PolarHBondContact O-N 3.02Å; G565-F568 VanDerWaalsContact O-N 3.15Å; L566-F568 PolarHBondContact O-N 2.97Å; F568-Q593 HydrophobicContact CE1-CG 4.19Å; F568-Q593 HydrophobicContact CE2-CG 4.38Å; F568-Q593 HydrophobicContact CZ-CB 4.22Å; F568-Q593 HydrophobicContact CZ-CG 4.08Å; F568-V596 HydrophobicContact CE2-CB 4.46Å; F568-V596 HydrophobicContact CE2-CG1 4.07Å; F568-M597 HydrophobicContact CZ-CG 4.49Å; F568-M597 HydrophobicContact CZ-SD 4.21Å; F568-A623 VanDerWaalsContact CB-O 3.3Å; F568-A623 WeakPolarHBondContact CB-O 3.4Å; F568-A623 HydrophobicContact CD2-CB 3.64Å; F568-A623 HydrophobicContact CE2-CB 4Å; F568-A623 HydrophobicContact CG-CB 4.26Å; F568-A623 WeakPolarHBondContact CG-O 3.32Å; F568-T626 HydrophobicContact CD1-CG2 4.48Å; F568-T634 HydrophobicContact CE1-CG2 4.4Å; F568-M638 HydrophobicContact CE1-SD 4.07Å; F568-M638 HydrophobicContact CE2-SD 4.06Å; F568-M638 HydrophobicContact CZ-SD 3.7Å
569	H	86.7	Confident	85.7	Confident	30 Å²	30	30.8 Å²	30.8	14%	0.139	17%	0.166	C	C	.	.	S	Bend	trans	-72.6	169.5	177.3	-163.2	59.2	0	0	0	112.6	H437 G565 L566 R571 E573 L574	H437-H569 AromaticContact CD2-CD2 3.84Å; H437-H569 AromaticContact CD2-NE2 3.27Å; H437-H569 PolarHBondContact CD2-NE2 3.33Å; H437-H569 VanDerWaalsContact CD2-NE2 3.27Å; H437-H569 AromaticContact CG-NE2 3.79Å; G565-H569 PolarHBondContact O-N 3.5Å; L566-H569 PolarHBondContact O-N 3.08Å; H569-R571 PolarHBondContact O-N 2.92Å; H569-R571 VanDerWaalsContact O-N 3.1Å; H569-E573 IonicContact NE2-OE2 3.52Å; H569-L574 HydrophobicContact CB-CD1 4.19Å; H569-L574 HydrophobicContact CB-CG 4.49Å
570	N	82.6	Confident	85.1	Confident	21 Å²	21	33.6 Å²	33.6	11%	0.112	18%	0.177	C	C	.	.			trans	-60.1	115.5	-178.2	-173.3	-6.9	0	0	0	111.2	T572 E573 L574	N570-T572 VanDerWaalsContact C-N 3.32Å; N570-T572 PolarHBondContact ND2-OG1 3.47Å; N570-T572 PolarHBondContact O-N 3.29Å; N570-T572 PolarHBondContact OD1-N 2.83Å; N570-T572 PolarHBondContact OD1-OG1 3.25Å; N570-E573 HydrophobicContact CB-CB 4.18Å; N570-E573 HydrophobicContact CB-CG 4.06Å; N570-E573 PolarHBondContact ND2-OE1 3.33Å; N570-E573 PolarHBondContact O-N 3.41Å; N570-L574 WeakPolarHBondContact O-CG 3.3Å; N570-L574 PolarHBondContact O-N 2.86Å; N570-L574 VanDerWaalsContact O-N 3.13Å
571	R	81.2	Confident	84.6	Confident	84 Å²	84	36 Å²	36	32%	0.317	20%	0.195	S	C	.	.	H	α-helix	trans	-62.4	-37.8	-175.2	-69.6	179.8	177.4	169.5	-1.2	112.2	H569 E573 L574 Q575	H569-R571 PolarHBondContact O-N 2.92Å; H569-R571 VanDerWaalsContact O-N 3.1Å; R571-E573 VanDerWaalsContact C-N 3.3Å; R571-E573 PolarHBondContact O-N 3.37Å; R571-L574 PolarHBondContact O-N 3.46Å; R571-Q575 WeakPolarHBondContact O-CG 3.46Å; R571-Q575 PolarHBondContact O-N 2.92Å; R571-Q575 VanDerWaalsContact O-N 3.14Å
572	T	78.6	Confident	84.1	Confident	72 Å²	72	40.7 Å²	40.7	44%	0.442	22%	0.218	S	C	.	.	H	α-helix	trans	-66.5	-34.8	-179.7	60.4	0	0	0	0	111.6	N570	N570-T572 VanDerWaalsContact C-N 3.32Å; N570-T572 PolarHBondContact ND2-OG1 3.47Å; N570-T572 PolarHBondContact O-N 3.29Å; N570-T572 PolarHBondContact OD1-N 2.83Å; N570-T572 PolarHBondContact OD1-OG1 3.25Å
573	E	80.6	Confident	83.6	Confident	80 Å²	80	44.1 Å²	44.1	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-71.6	-38.3	176.9	-67.8	173.6	-151.5	0	0	111.3	H569 N570 R571 Q575 S576	H569-E573 IonicContact NE2-OE2 3.52Å; N570-E573 HydrophobicContact CB-CB 4.18Å; N570-E573 HydrophobicContact CB-CG 4.06Å; N570-E573 PolarHBondContact ND2-OE1 3.33Å; N570-E573 PolarHBondContact O-N 3.41Å; R571-E573 VanDerWaalsContact C-N 3.3Å; R571-E573 PolarHBondContact O-N 3.37Å; E573-Q575 VanDerWaalsContact C-N 3.33Å; E573-Q575 PolarHBondContact O-N 3.44Å; E573-S576 WeakPolarHBondContact O-CB 3.4Å; E573-S576 PolarHBondContact O-N 3.33Å; E573-S576 PolarHBondContact O-OG 3.32Å
574	L	82.9	Confident	83.2	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-69.2	-25.5	177.6	-66	178.1	0	0	0	114.3	L526 L566 H569 N570 R571 S576 L577 F585	L526-L574 HydrophobicContact CD1-CD1 4.32Å; L526-L574 HydrophobicContact CD1-CD2 4.27Å; L566-L574 HydrophobicContact CD2-CD2 3.76Å; L566-L574 VanDerWaalsContact O-CD1 3.24Å; L566-L574 WeakPolarHBondContact O-CD1 3.42Å; H569-L574 HydrophobicContact CB-CD1 4.19Å; H569-L574 HydrophobicContact CB-CG 4.49Å; N570-L574 WeakPolarHBondContact O-CG 3.3Å; N570-L574 PolarHBondContact O-N 2.86Å; N570-L574 VanDerWaalsContact O-N 3.13Å; R571-L574 PolarHBondContact O-N 3.46Å; L574-S576 PolarHBondContact O-N 2.95Å; L574-S576 VanDerWaalsContact O-N 3.1Å; L574-L577 HydrophobicContact CD2-CD1 3.84Å; L574-L577 WeakPolarHBondContact O-CB 3.44Å; L574-L577 PolarHBondContact O-N 2.85Å; L574-F585 HydrophobicContact CB-CE1 4.32Å; L574-F585 HydrophobicContact CB-CZ 3.87Å; L574-F585 HydrophobicContact CD1-CZ 4.34Å
575	Q	75.1	Confident	83	Confident	71 Å²	71	46.9 Å²	46.9	33%	0.332	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-56	-28.2	177.3	-77.5	174.1	3	0	0	112.1	R571 E573 L577 H578 F585	R571-Q575 WeakPolarHBondContact O-CG 3.46Å; R571-Q575 PolarHBondContact O-N 2.92Å; R571-Q575 VanDerWaalsContact O-N 3.14Å; E573-Q575 VanDerWaalsContact C-N 3.33Å; E573-Q575 PolarHBondContact O-N 3.44Å; Q575-L577 PolarHBondContact O-N 3.11Å; Q575-H578 PolarHBondContact O-N 3.25Å; Q575-H578 VanDerWaalsContact O-O 3.05Å; Q575-F585 HydrophobicContact CG-CD1 4.37Å; Q575-F585 HydrophobicContact CG-CE1 4.44Å
576	S	75.7	Confident	82.8	Confident	66 Å²	66	51.9 Å²	51.9	46%	0.462	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-62.9	-18.2	176.5	68.5	0	0	0	0	114.4	E573 L574	E573-S576 WeakPolarHBondContact O-CB 3.4Å; E573-S576 PolarHBondContact O-N 3.33Å; E573-S576 PolarHBondContact O-OG 3.32Å; L574-S576 PolarHBondContact O-N 2.95Å; L574-S576 VanDerWaalsContact O-N 3.1Å
577	L	79.7	Confident	82.6	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.052	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-88.9	-7.5	-174.6	-55.8	177.4	0	0	0	113.5	L440 M444 L454 V522 L574 Q575	L440-L577 HydrophobicContact CD2-CD2 4.26Å; M444-L577 HydrophobicContact SD-CD2 4.36Å; L454-L577 HydrophobicContact CD2-CB 4.21Å; L454-L577 HydrophobicContact CD2-CD2 3.78Å; V522-L577 HydrophobicContact CG1-CD1 4.48Å; V522-L577 HydrophobicContact CG2-CD1 4.19Å; L574-L577 HydrophobicContact CD2-CD1 3.84Å; L574-L577 WeakPolarHBondContact O-CB 3.44Å; L574-L577 PolarHBondContact O-N 2.85Å; Q575-L577 PolarHBondContact O-N 3.11Å
578	H	77.9	Confident	82.5	Confident	35 Å²	35	57.2 Å²	57.2	16%	0.162	30%	0.302	C	S	.	.			trans	-147.2	164.1	-176.6	67.2	58.8	0	0	0	113.1	Q575 Y580 F585	Q575-H578 PolarHBondContact O-N 3.25Å; Q575-H578 VanDerWaalsContact O-O 3.05Å; H578-Y580 HydrophobicContact CB-CD2 3.74Å; H578-Y580 HydrophobicContact CB-CE2 3.92Å; H578-Y580 HydrophobicContact CB-CG 4.26Å; H578-Y580 AromaticContact CG-CD2 3.57Å; H578-Y580 AromaticContact ND1-CD2 3.83Å; H578-Y580 AromaticContact ND1-CG 3.92Å; H578-Y580 PolarHBondContact ND1-N 2.85Å; H578-Y580 VanDerWaalsContact ND1-N 3.11Å; H578-F585 AromaticContact CD2-CD2 3.48Å; H578-F585 VanDerWaalsContact CD2-CD2 3.48Å; H578-F585 WeakPolarHBondContact CD2-CD2 3.45Å; H578-F585 AromaticContact CD2-CE2 3.48Å; H578-F585 VanDerWaalsContact CD2-CE2 3.48Å; H578-F585 WeakPolarHBondContact CD2-CE2 3.5Å; H578-F585 AromaticContact CE1-CD2 3.89Å; H578-F585 AromaticContact CE1-CG 3.67Å; H578-F585 AromaticContact NE2-CD1 3.43Å; H578-F585 WeakPolarHBondContact NE2-CD1 3.46Å; H578-F585 AromaticContact NE2-CD2 2.98Å; H578-F585 WeakPolarHBondContact NE2-CD2 3.45Å; H578-F585 AromaticContact NE2-CE1 3.67Å; H578-F585 AromaticContact NE2-CE2 3.24Å; H578-F585 WeakPolarHBondContact NE2-CE2 3.32Å; H578-F585 AromaticContact NE2-CG 3.06Å; H578-F585 WeakPolarHBondContact NE2-CG 3.23Å; H578-F585 AromaticContact NE2-CZ 3.57Å
579	S	77.3	Confident	82.6	Confident	119 Å²	119	56.9 Å²	56.9	83%	0.832	30%	0.3	S	S	*	.			trans	-99.9	10.8	175.9	56.4	0	0	0	0	114.5
580	Y	80.6	Confident	82.7	Confident	60 Å²	60	57.5 Å²	57.5	24%	0.235	31%	0.31	C	S	.	.			trans	-69.8	151.4	-178.8	-52	-38	0	0	0	113.1	R528 H578 M588	R528-Y580 HydrophobicContact CG-CE1 4.17Å; R528-Y580 HydrophobicContact CG-CE2 4.14Å; H578-Y580 HydrophobicContact CB-CD2 3.74Å; H578-Y580 HydrophobicContact CB-CE2 3.92Å; H578-Y580 HydrophobicContact CB-CG 4.26Å; H578-Y580 AromaticContact CG-CD2 3.57Å; H578-Y580 AromaticContact ND1-CD2 3.83Å; H578-Y580 AromaticContact ND1-CG 3.92Å; H578-Y580 PolarHBondContact ND1-N 2.85Å; H578-Y580 VanDerWaalsContact ND1-N 3.11Å; Y580-M588 HydrophobicContact CD2-CE 4.32Å; Y580-M588 HydrophobicContact CE2-CE 4.14Å
581	S	81.1	Confident	83.1	Confident	61 Å²	61	58.7 Å²	58.7	43%	0.427	32%	0.32	S	S	.	.			trans	-62.9	146.1	168.7	66.5	0	0	0	0	111	T583 V584 F585	S581-T583 VanDerWaalsContact C-N 3.26Å; S581-T583 PolarHBondContact O-N 3.34Å; S581-T583 PolarHBondContact OG-OG1 3.45Å; S581-V584 PolarHBondContact O-N 2.86Å; S581-V584 WeakPolarHBondContact OG-CG2 3.38Å; S581-F585 PolarHBondContact O-N 3.24Å
582	E	82.9	Confident	83.6	Confident	132 Å²	132	54.7 Å²	54.7	62%	0.617	31%	0.305	S	S	*	.	H	α-helix	trans	-54.1	-41.6	-177.7	-176.5	179.8	-171.6	0	0	112.8	F585 R586	E582-F585 PolarHBondContact O-N 2.95Å; E582-R586 VanDerWaalsContact O-CB 3.28Å; E582-R586 WeakPolarHBondContact O-CB 3.48Å; E582-R586 PolarHBondContact O-N 3.3Å
583	T	84.7	Confident	84.3	Confident	71 Å²	71	52.9 Å²	52.9	44%	0.436	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-49.7	179.6	50.9	0	0	0	0	112.5	S581 F585 R586 D587	S581-T583 VanDerWaalsContact C-N 3.26Å; S581-T583 PolarHBondContact O-N 3.34Å; S581-T583 PolarHBondContact OG-OG1 3.45Å; T583-F585 VanDerWaalsContact C-N 3.34Å; T583-F585 PolarHBondContact O-N 3.39Å; T583-R586 PolarHBondContact O-N 3.31Å; T583-D587 PolarHBondContact O-N 2.82Å
584	V	85.3	Confident	84.7	Confident	57 Å²	57	51.8 Å²	51.8	35%	0.345	30%	0.297	S	S	.	.	H	α-helix	trans	-69.4	-36.7	-177.5	-179.2	0	0	0	0	111	S581 M588	S581-V584 PolarHBondContact O-N 2.86Å; S581-V584 WeakPolarHBondContact OG-CG2 3.38Å; V584-M588 WeakPolarHBondContact O-CB 3.41Å; V584-M588 PolarHBondContact O-N 3.43Å; V584-M588 VanDerWaalsContact O-N 3.08Å
585	F	86.9	Confident	85.2	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.009	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-48.4	175.1	177.4	-117.2	0	0	0	111.6	L526 L574 Q575 H578 S581 E582 T583 D587 M588 V589	L526-F585 HydrophobicContact CB-CE2 4.48Å; L526-F585 HydrophobicContact CD1-CE2 4.37Å; L526-F585 HydrophobicContact CD2-CE2 4.01Å; L526-F585 HydrophobicContact CD2-CZ 4.4Å; L574-F585 HydrophobicContact CB-CE1 4.32Å; L574-F585 HydrophobicContact CB-CZ 3.87Å; L574-F585 HydrophobicContact CD1-CZ 4.34Å; Q575-F585 HydrophobicContact CG-CD1 4.37Å; Q575-F585 HydrophobicContact CG-CE1 4.44Å; H578-F585 AromaticContact CD2-CD2 3.48Å; H578-F585 VanDerWaalsContact CD2-CD2 3.48Å; H578-F585 WeakPolarHBondContact CD2-CD2 3.45Å; H578-F585 AromaticContact CD2-CE2 3.48Å; H578-F585 VanDerWaalsContact CD2-CE2 3.48Å; H578-F585 WeakPolarHBondContact CD2-CE2 3.5Å; H578-F585 AromaticContact CE1-CD2 3.89Å; H578-F585 AromaticContact CE1-CG 3.67Å; H578-F585 AromaticContact NE2-CD1 3.43Å; H578-F585 WeakPolarHBondContact NE2-CD1 3.46Å; H578-F585 AromaticContact NE2-CD2 2.98Å; H578-F585 WeakPolarHBondContact NE2-CD2 3.45Å; H578-F585 AromaticContact NE2-CE1 3.67Å; H578-F585 AromaticContact NE2-CE2 3.24Å; H578-F585 WeakPolarHBondContact NE2-CE2 3.32Å; H578-F585 AromaticContact NE2-CG 3.06Å; H578-F585 WeakPolarHBondContact NE2-CG 3.23Å; H578-F585 AromaticContact NE2-CZ 3.57Å; S581-F585 PolarHBondContact O-N 3.24Å; E582-F585 PolarHBondContact O-N 2.95Å; T583-F585 VanDerWaalsContact C-N 3.34Å; T583-F585 PolarHBondContact O-N 3.39Å; F585-D587 VanDerWaalsContact C-N 3.34Å; F585-D587 PolarHBondContact O-N 3.01Å; F585-M588 PolarHBondContact O-N 2.84Å; F585-V589 HydrophobicContact CD2-CG2 4.02Å; F585-V589 HydrophobicContact CE1-CG2 4.19Å; F585-V589 HydrophobicContact CE2-CG2 3.63Å; F585-V589 HydrophobicContact CG-CG2 4.48Å; F585-V589 HydrophobicContact CZ-CG2 3.72Å; F585-V589 WeakPolarHBondContact O-CG2 3.5Å; F585-V589 PolarHBondContact O-N 2.96Å
586	R	86.9	Confident	85.9	Confident	108 Å²	108	50.1 Å²	50.1	41%	0.408	29%	0.29	S	S	.	.	H	α-helix	trans	-56.9	-47.1	177.6	-178.6	-163.7	64.5	-142.2	-5.1	111.7	E582 T583 V589 A590	E582-R586 VanDerWaalsContact O-CB 3.28Å; E582-R586 WeakPolarHBondContact O-CB 3.48Å; E582-R586 PolarHBondContact O-N 3.3Å; T583-R586 PolarHBondContact O-N 3.31Å; R586-V589 PolarHBondContact O-N 3.32Å; R586-A590 VanDerWaalsContact O-CB 3.3Å; R586-A590 WeakPolarHBondContact O-CB 3.33Å; R586-A590 PolarHBondContact O-N 3.28Å
587	D	88.1	Confident	86.5	Confident	89 Å²	89	48.2 Å²	48.2	48%	0.476	27%	0.274	S	S	.	.	H	α-helix	trans	-68.2	-37.8	-176.6	-61.5	-11.3	0	0	0	111.4	T583 F585 S591	T583-D587 PolarHBondContact O-N 2.82Å; F585-D587 VanDerWaalsContact C-N 3.34Å; F585-D587 PolarHBondContact O-N 3.01Å; D587-S591 PolarHBondContact O-N 2.88Å
588	M	89.6	Confident	87.1	Confident	25 Å²	25	55.1 Å²	55.1	12%	0.123	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-49.8	172.9	-176.5	-153.4	-54.8	0	0	111.8	R528 Y580 V584 F585 A590 S591 K592	R528-M588 HydrophobicContact CG-CE 3.55Å; Y580-M588 HydrophobicContact CD2-CE 4.32Å; Y580-M588 HydrophobicContact CE2-CE 4.14Å; V584-M588 WeakPolarHBondContact O-CB 3.41Å; V584-M588 PolarHBondContact O-N 3.43Å; V584-M588 VanDerWaalsContact O-N 3.08Å; F585-M588 PolarHBondContact O-N 2.84Å; M588-A590 VanDerWaalsContact C-N 3.33Å; M588-A590 PolarHBondContact O-N 3.38Å; M588-S591 PolarHBondContact O-N 3.17Å; M588-K592 PolarHBondContact O-N 3.11Å; M588-K592 VanDerWaalsContact O-N 3.09Å
589	V	89.1	Confident	87.6	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.006	30%	0.301	C	S	.	.	H	α-helix	trans	-61.6	-44.9	179.8	171.1	0	0	0	0	109.9	L526 L567 F585 R586 S591 K592 Q593	L526-V589 HydrophobicContact CD2-CG2 4.08Å; L567-V589 HydrophobicContact CD2-CG1 4.33Å; F585-V589 HydrophobicContact CD2-CG2 4.02Å; F585-V589 HydrophobicContact CE1-CG2 4.19Å; F585-V589 HydrophobicContact CE2-CG2 3.63Å; F585-V589 HydrophobicContact CG-CG2 4.48Å; F585-V589 HydrophobicContact CZ-CG2 3.72Å; F585-V589 WeakPolarHBondContact O-CG2 3.5Å; F585-V589 PolarHBondContact O-N 2.96Å; R586-V589 PolarHBondContact O-N 3.32Å; V589-S591 PolarHBondContact O-N 3.34Å; V589-K592 PolarHBondContact O-N 3.25Å; V589-Q593 HydrophobicContact CG1-CG 4.07Å; V589-Q593 WeakPolarHBondContact O-CB 3.42Å; V589-Q593 VanDerWaalsContact O-CG 3.24Å; V589-Q593 WeakPolarHBondContact O-CG 3.42Å; V589-Q593 PolarHBondContact O-N 3.43Å
590	A	89.8	Confident	88.1	Confident	42 Å²	42	49.1 Å²	49.1	35%	0.347	26%	0.262	S	S	.	.	H	α-helix	trans	-60.2	-42.7	177.8	0	0	0	0	0	112.5	R586 M588 Q593 A594	R586-A590 VanDerWaalsContact O-CB 3.3Å; R586-A590 WeakPolarHBondContact O-CB 3.33Å; R586-A590 PolarHBondContact O-N 3.28Å; M588-A590 VanDerWaalsContact C-N 3.33Å; M588-A590 PolarHBondContact O-N 3.38Å; A590-Q593 PolarHBondContact O-N 2.93Å; A590-A594 PolarHBondContact O-N 2.89Å
591	S	91.7	Very high	88.6	Confident	46 Å²	46	51.7 Å²	51.7	32%	0.322	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-49.4	176.1	-168	0	0	0	0	111.6	D532 D587 M588 V589 A594 L595	D532-S591 PolarHBondContact OD2-OG 3.21Å; D587-S591 PolarHBondContact O-N 2.88Å; M588-S591 PolarHBondContact O-N 3.17Å; V589-S591 PolarHBondContact O-N 3.34Å; S591-A594 WeakPolarHBondContact O-CB 3.37Å; S591-A594 PolarHBondContact O-N 3.16Å; S591-L595 WeakPolarHBondContact O-CG 3.32Å; S591-L595 PolarHBondContact O-N 3.07Å; S591-L595 VanDerWaalsContact O-N 3.11Å
592	K	92	Very high	88.9	Confident	1 Å²	1	51.9 Å²	51.9	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-69.3	-34.6	-179.9	-70.3	-177.8	-179	179	0	113.1	L524 S525 V530 F535 L567 M588 V589 A594 L595 V596	L524-K592 PolarHBondContact O-NZ 3.24Å; S525-K592 WeakPolarHBondContact O-CD 3.47Å; S525-K592 WeakPolarHBondContact O-CE 2.81Å; S525-K592 PolarHBondContact O-NZ 2.89Å; V530-K592 PolarHBondContact O-NZ 3.43Å; F535-K592 HydrophobicContact CD1-CB 4.17Å; F535-K592 HydrophobicContact CD1-CD 4.16Å; F535-K592 HydrophobicContact CD1-CG 3.94Å; F535-K592 HydrophobicContact CD2-CD 4.4Å; F535-K592 HydrophobicContact CE1-CB 3.98Å; F535-K592 HydrophobicContact CE1-CD 4.49Å; F535-K592 HydrophobicContact CE1-CG 4.26Å; F535-K592 HydrophobicContact CG-CD 4.12Å; F535-K592 HydrophobicContact CG-CG 4.36Å; L567-K592 HydrophobicContact CD1-CB 3.82Å; L567-K592 HydrophobicContact CD2-CB 3.78Å; L567-K592 HydrophobicContact CD2-CD 4.43Å; L567-K592 HydrophobicContact CG-CB 4.49Å; M588-K592 PolarHBondContact O-N 3.11Å; M588-K592 VanDerWaalsContact O-N 3.09Å; V589-K592 PolarHBondContact O-N 3.25Å; K592-A594 VanDerWaalsContact C-N 3.35Å; K592-L595 WeakPolarHBondContact O-CB 3.24Å; K592-L595 PolarHBondContact O-N 2.91Å; K592-V596 WeakPolarHBondContact O-CG2 3.46Å; K592-V596 PolarHBondContact O-N 3.17Å
593	Q	91.4	Very high	89.1	Confident	33 Å²	33	47 Å²	47	15%	0.154	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-47.3	170.4	-77.5	178.2	-41.8	0	0	110.7	L567 F568 V589 A590 L595 V596 M597	L567-Q593 HydrophobicContact CB-CG 3.97Å; L567-Q593 PolarHBondContact O-NE2 3.44Å; F568-Q593 HydrophobicContact CE1-CG 4.19Å; F568-Q593 HydrophobicContact CE2-CG 4.38Å; F568-Q593 HydrophobicContact CZ-CB 4.22Å; F568-Q593 HydrophobicContact CZ-CG 4.08Å; V589-Q593 HydrophobicContact CG1-CG 4.07Å; V589-Q593 WeakPolarHBondContact O-CB 3.42Å; V589-Q593 VanDerWaalsContact O-CG 3.24Å; V589-Q593 WeakPolarHBondContact O-CG 3.42Å; V589-Q593 PolarHBondContact O-N 3.43Å; A590-Q593 PolarHBondContact O-N 2.93Å; Q593-L595 VanDerWaalsContact C-N 3.29Å; Q593-L595 PolarHBondContact O-N 3.14Å; Q593-V596 PolarHBondContact O-N 3.31Å; Q593-V596 VanDerWaalsContact O-N 3.16Å; Q593-M597 WeakPolarHBondContact O-CG 3.27Å; Q593-M597 PolarHBondContact O-N 2.94Å
594	A	90.8	Very high	89.2	Confident	58 Å²	58	47 Å²	47	48%	0.479	27%	0.269	S	S	.	.	H	α-helix	trans	-61.7	-36.4	177.9	0	0	0	0	0	112.6	A590 S591 K592 M597 K598	A590-A594 PolarHBondContact O-N 2.89Å; S591-A594 WeakPolarHBondContact O-CB 3.37Å; S591-A594 PolarHBondContact O-N 3.16Å; K592-A594 VanDerWaalsContact C-N 3.35Å; A594-M597 PolarHBondContact O-N 3.1Å; A594-K598 VanDerWaalsContact O-CB 3.3Å; A594-K598 WeakPolarHBondContact O-CB 3.31Å; A594-K598 PolarHBondContact O-N 3.28Å
595	L	92.3	Very high	89.3	Confident	37 Å²	37	44.6 Å²	44.6	19%	0.194	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-42.5	173.9	-67	171.6	0	0	0	112.3	D532 F535 S591 K592 Q593 H599	D532-L595 HydrophobicContact CB-CD1 3.7Å; F535-L595 HydrophobicContact CD1-CD1 4.35Å; S591-L595 WeakPolarHBondContact O-CG 3.32Å; S591-L595 PolarHBondContact O-N 3.07Å; S591-L595 VanDerWaalsContact O-N 3.11Å; K592-L595 WeakPolarHBondContact O-CB 3.24Å; K592-L595 PolarHBondContact O-N 2.91Å; Q593-L595 VanDerWaalsContact C-N 3.29Å; Q593-L595 PolarHBondContact O-N 3.14Å; L595-H599 WeakPolarHBondContact O-CB 3.16Å; L595-H599 PolarHBondContact O-N 3.39Å
596	V	90.9	Very high	89.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-46.4	176.3	169.2	0	0	0	0	111	F535 L539 L567 F568 K592 Q593 H599 L600 Y619 M638	F535-V596 HydrophobicContact CE1-CG2 3.9Å; F535-V596 HydrophobicContact CZ-CG2 4.02Å; L539-V596 HydrophobicContact CD1-CG2 4.4Å; L539-V596 HydrophobicContact CD2-CG2 4.18Å; L567-V596 HydrophobicContact CD1-CG2 3.84Å; F568-V596 HydrophobicContact CE2-CB 4.46Å; F568-V596 HydrophobicContact CE2-CG1 4.07Å; K592-V596 WeakPolarHBondContact O-CG2 3.46Å; K592-V596 PolarHBondContact O-N 3.17Å; Q593-V596 PolarHBondContact O-N 3.31Å; Q593-V596 VanDerWaalsContact O-N 3.16Å; V596-H599 PolarHBondContact O-N 3.23Å; V596-L600 PolarHBondContact O-N 2.69Å; V596-Y619 HydrophobicContact CG1-CE1 3.77Å; V596-Y619 VanDerWaalsContact CG1-OH 3.26Å; V596-Y619 WeakPolarHBondContact CG1-OH 3.41Å; V596-Y619 WeakPolarHBondContact CG2-OH 3.22Å; V596-M638 HydrophobicContact CG1-CE 3.91Å
597	M	88.5	Confident	89.1	Confident	25 Å²	25	47.5 Å²	47.5	12%	0.123	29%	0.291	C	S	.	.	H	α-helix	trans	-58.4	-54	177.2	-68	-60.4	-63	0	0	111.2	F568 Q593 A594 H599 L600 E601 T634 M638	F568-M597 HydrophobicContact CZ-CG 4.49Å; F568-M597 HydrophobicContact CZ-SD 4.21Å; Q593-M597 WeakPolarHBondContact O-CG 3.27Å; Q593-M597 PolarHBondContact O-N 2.94Å; A594-M597 PolarHBondContact O-N 3.1Å; M597-H599 PolarHBondContact O-N 3.35Å; M597-L600 PolarHBondContact O-N 3.28Å; M597-L600 VanDerWaalsContact O-N 3.14Å; M597-E601 WeakPolarHBondContact O-CB 3.46Å; M597-E601 WeakPolarHBondContact O-CG 3.46Å; M597-E601 PolarHBondContact O-N 3.34Å; M597-T634 HydrophobicContact CE-CG2 4.15Å; M597-T634 HydrophobicContact SD-CG2 4.04Å; M597-M638 HydrophobicContact CE-CG 3.6Å; M597-M638 HydrophobicContact SD-CE 4.25Å; M597-M638 HydrophobicContact SD-CG 3.16Å; M597-M638 WeakPolarHBondContact SD-CG 3.37Å; M597-M638 HydrophobicContact SD-SD 3.45Å
598	K	90.6	Very high	89.1	Confident	156 Å²	156	44.5 Å²	44.5	68%	0.678	28%	0.275	S	S	*	.	H	α-helix	trans	-61	-35.1	-179.7	-175.3	178	-179.6	178.4	0	112.3	A594 G602	A594-K598 VanDerWaalsContact O-CB 3.3Å; A594-K598 WeakPolarHBondContact O-CB 3.31Å; A594-K598 PolarHBondContact O-N 3.28Å; K598-G602 PolarHBondContact O-N 3.04Å; K598-G602 VanDerWaalsContact O-N 3.15Å
599	H	89.5	Confident	89.1	Confident	24 Å²	24	46 Å²	46	11%	0.111	29%	0.288	C	S	.	.	H	α-helix	trans	-65.7	-46.6	176.2	-179.2	70.5	0	0	0	111.3	L539 P540 F541 Q542 L595 V596 M597 G602 L603	L539-H599 HydrophobicContact CD1-CB 3.67Å; P540-H599 PolarHBondContact O-CE1 2.99Å; P540-H599 VanDerWaalsContact O-CE1 3.28Å; P540-H599 PolarHBondContact O-NE2 2.91Å; F541-H599 AromaticContact CD2-NE2 3.94Å; Q542-H599 PolarHBondContact NE2-CE1 2.83Å; Q542-H599 PolarHBondContact NE2-ND1 3.23Å; L595-H599 WeakPolarHBondContact O-CB 3.16Å; L595-H599 PolarHBondContact O-N 3.39Å; V596-H599 PolarHBondContact O-N 3.23Å; M597-H599 PolarHBondContact O-N 3.35Å; H599-G602 PolarHBondContact O-N 3.42Å; H599-L603 WeakPolarHBondContact O-CG 3.36Å
600	L	88.3	Confident	89.2	Confident	3 Å²	3	47 Å²	47	2%	0.016	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-44.3	177.7	-171.1	73.8	0	0	0	111.7	V596 M597 G602 L603 F605 V620 M638	V596-L600 PolarHBondContact O-N 2.69Å; M597-L600 PolarHBondContact O-N 3.28Å; M597-L600 VanDerWaalsContact O-N 3.14Å; L600-G602 PolarHBondContact O-N 2.93Å; L600-L603 HydrophobicContact CD1-CD1 4.06Å; L600-L603 WeakPolarHBondContact O-CB 3.46Å; L600-L603 PolarHBondContact O-N 3.02Å; L600-L603 VanDerWaalsContact O-N 3.08Å; L600-F605 HydrophobicContact CD1-CZ 4.11Å; L600-V620 HydrophobicContact CD1-CG2 3.88Å; L600-V620 HydrophobicContact CD2-CG2 3.63Å; L600-V620 HydrophobicContact CG-CG2 4.44Å; L600-M638 HydrophobicContact CD2-CB 4.12Å; L600-M638 HydrophobicContact CD2-CE 3.77Å; L600-M638 HydrophobicContact CD2-CG 4.31Å
601	E	89.4	Confident	89.1	Confident	114 Å²	114	47 Å²	47	53%	0.533	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-25.8	177.1	-72.7	171	-178.4	0	0	113.1	M597 H641	M597-E601 WeakPolarHBondContact O-CB 3.46Å; M597-E601 WeakPolarHBondContact O-CG 3.46Å; M597-E601 PolarHBondContact O-N 3.34Å; E601-H641 WeakPolarHBondContact CA-NE2 3.35Å
602	G	87.4	Confident	89	Confident	66 Å²	66	46.3 Å²	46.3	68%	0.68	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.7	176.9	0	0	0	0	0	114.8	K598 H599 L600	K598-G602 PolarHBondContact O-N 3.04Å; K598-G602 VanDerWaalsContact O-N 3.15Å; H599-G602 PolarHBondContact O-N 3.42Å; L600-G602 PolarHBondContact O-N 2.93Å
603	L	87.8	Confident	89	Confident	28 Å²	28	46.7 Å²	46.7	15%	0.147	29%	0.288	C	S	.	.			trans	-81.8	130.6	-178	-61.8	-178.1	0	0	0	111.8	F541 H599 L600 F605	F541-L603 HydrophobicContact CB-CD2 4.08Å; F541-L603 HydrophobicContact CD2-CD1 3.59Å; F541-L603 HydrophobicContact CD2-CD2 4.29Å; F541-L603 HydrophobicContact CE2-CD1 3.96Å; F541-L603 HydrophobicContact CG-CD1 4.33Å; F541-L603 HydrophobicContact CG-CD2 4.47Å; H599-L603 WeakPolarHBondContact O-CG 3.36Å; L600-L603 HydrophobicContact CD1-CD1 4.06Å; L600-L603 WeakPolarHBondContact O-CB 3.46Å; L600-L603 PolarHBondContact O-N 3.02Å; L600-L603 VanDerWaalsContact O-N 3.08Å; L603-F605 HydrophobicContact CB-CE2 4.24Å; L603-F605 HydrophobicContact CB-CZ 4.24Å; L603-F605 HydrophobicContact CD1-CZ 4.49Å
604	C	88.1	Confident	89.1	Confident	73 Å²	73	45.6 Å²	45.6	49%	0.493	28%	0.284	S	S	.	.			trans	-89.4	100.1	165.1	-176	0	0	0	0	109.2	G606 D607	C604-G606 PolarHBondContact O-N 3.39Å; C604-D607 HydrophobicContact CB-CB 4.4Å; C604-D607 WeakPolarHBondContact CB-OD2 3.49Å; C604-D607 PolarHBondContact O-N 3.4Å; C604-D607 VanDerWaalsContact O-N 3.08Å; C604-D607 PolarHBondContact SG-OD2 3.16Å
605	F	85.8	Confident	89.2	Confident	5 Å²	5	43.5 Å²	43.5	2%	0.022	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-64.8	-22.9	-175.9	-66.8	-87.4	0	0	0	113.9	L600 L603 D607 L608 A616 L642 N645 L646	L600-F605 HydrophobicContact CD1-CZ 4.11Å; L603-F605 HydrophobicContact CB-CE2 4.24Å; L603-F605 HydrophobicContact CB-CZ 4.24Å; L603-F605 HydrophobicContact CD1-CZ 4.49Å; F605-D607 VanDerWaalsContact C-N 3.28Å; F605-D607 PolarHBondContact O-N 3.26Å; F605-L608 HydrophobicContact CD1-CD1 3.7Å; F605-L608 HydrophobicContact CE1-CD1 4.23Å; F605-L608 HydrophobicContact CG-CD1 4.35Å; F605-L608 PolarHBondContact O-N 2.72Å; F605-A616 HydrophobicContact CE1-CB 4.03Å; F605-L642 HydrophobicContact CD1-CD1 3.93Å; F605-L642 HydrophobicContact CE1-CD1 3.27Å; F605-L642 HydrophobicContact CZ-CD1 3.68Å; F605-N645 WeakPolarHBondContact CB-O 3.44Å; F605-N645 HydrophobicContact CD2-CB 3.53Å; F605-N645 HydrophobicContact CE2-CB 3.86Å; F605-N645 HydrophobicContact CG-CB 4.5Å; F605-L646 HydrophobicContact CD1-CD2 4.47Å
606	G	84.1	Confident	89.2	Confident	58 Å²	58	41.7 Å²	41.7	60%	0.598	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-67.7	-24	173	0	0	0	0	0	114.3	C604	C604-G606 PolarHBondContact O-N 3.39Å
607	D	86.8	Confident	89.4	Confident	114 Å²	114	41.9 Å²	41.9	61%	0.61	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-94.6	-2.2	180	-63.7	-36.8	0	0	0	113.2	C604 F605	C604-D607 HydrophobicContact CB-CB 4.4Å; C604-D607 WeakPolarHBondContact CB-OD2 3.49Å; C604-D607 PolarHBondContact O-N 3.4Å; C604-D607 VanDerWaalsContact O-N 3.08Å; C604-D607 PolarHBondContact SG-OD2 3.16Å; F605-D607 VanDerWaalsContact C-N 3.28Å; F605-D607 PolarHBondContact O-N 3.26Å
608	L	88.4	Confident	89.7	Confident	26 Å²	26	40.8 Å²	40.8	14%	0.136	25%	0.25	C	S	.	.	S	Bend	trans	-81.9	138.8	179.4	-62.1	-174.7	0	0	0	110.4	F605 Q612 I613	F605-L608 HydrophobicContact CD1-CD1 3.7Å; F605-L608 HydrophobicContact CE1-CD1 4.23Å; F605-L608 HydrophobicContact CG-CD1 4.35Å; F605-L608 PolarHBondContact O-N 2.72Å; L608-Q612 HydrophobicContact CB-CB 4Å; L608-Q612 HydrophobicContact CD2-CB 4.32Å; L608-I613 HydrophobicContact CB-CG1 3.86Å
609	S	89.1	Confident	89.7	Confident	57 Å²	57	33.4 Å²	33.4	40%	0.399	22%	0.218	S	C	.	.			trans	-68.7	159.3	168.4	61.3	0	0	0	0	111.1	A611 Q612 I613	S609-A611 VanDerWaalsContact C-N 3.25Å; S609-A611 PolarHBondContact O-N 2.7Å; S609-A611 VanDerWaalsContact O-N 3.16Å; S609-Q612 WeakPolarHBondContact O-CA 3.34Å; S609-Q612 WeakPolarHBondContact O-CB 3.35Å; S609-Q612 PolarHBondContact O-N 2.81Å; S609-Q612 VanDerWaalsContact OG-CG 3.29Å; S609-Q612 WeakPolarHBondContact OG-CG 3.46Å; S609-Q612 PolarHBondContact OG-OE1 2.75Å; S609-I613 PolarHBondContact O-N 3.45Å
610	S	90.1	Very high	89.9	Confident	22 Å²	22	32.3 Å²	32.3	15%	0.154	21%	0.213	C	C	.	.	H	α-helix	trans	-46.4	-45	175.2	-56.7	0	0	0	0	114.1	Q612 I613 L614 T651 V655	S610-Q612 VanDerWaalsContact C-N 3.3Å; S610-Q612 PolarHBondContact O-N 3.42Å; S610-I613 PolarHBondContact O-N 2.77Å; S610-L614 PolarHBondContact O-N 2.98Å; S610-L614 VanDerWaalsContact O-N 3.08Å; S610-T651 WeakPolarHBondContact CB-O 3.04Å; S610-T651 PolarHBondContact OG-O 3.44Å; S610-V655 VanDerWaalsContact CB-CG2 3.48Å
611	A	88.1	Confident	90.1	Very high	40 Å²	40	32.6 Å²	32.6	33%	0.331	21%	0.214	S	C	.	.	H	α-helix	trans	-67.5	-33	179.4	0	0	0	0	0	112.1	S609 E615 V655	S609-A611 VanDerWaalsContact C-N 3.25Å; S609-A611 PolarHBondContact O-N 2.7Å; S609-A611 VanDerWaalsContact O-N 3.16Å; A611-E615 WeakPolarHBondContact O-CB 3.35Å; A611-E615 PolarHBondContact O-N 2.97Å; A611-V655 HydrophobicContact CB-CG1 4.39Å; A611-V655 HydrophobicContact CB-CG2 4Å
612	Q	89.6	Confident	90.3	Very high	33 Å²	33	27.4 Å²	27.4	15%	0.154	19%	0.19	C	C	.	.	H	α-helix	trans	-75.1	-35.6	177.3	-68.7	171.8	-64.7	0	0	112	F541 L608 S609 S610 L614 E615 A616	F541-Q612 HydrophobicContact CD1-CB 3.98Å; F541-Q612 HydrophobicContact CD1-CG 3.98Å; F541-Q612 HydrophobicContact CE1-CB 3.77Å; F541-Q612 HydrophobicContact CE1-CG 4.09Å; F541-Q612 WeakPolarHBondContact CE1-O 3.22Å; L608-Q612 HydrophobicContact CB-CB 4Å; L608-Q612 HydrophobicContact CD2-CB 4.32Å; S609-Q612 WeakPolarHBondContact O-CA 3.34Å; S609-Q612 WeakPolarHBondContact O-CB 3.35Å; S609-Q612 PolarHBondContact O-N 2.81Å; S609-Q612 VanDerWaalsContact OG-CG 3.29Å; S609-Q612 WeakPolarHBondContact OG-CG 3.46Å; S609-Q612 PolarHBondContact OG-OE1 2.75Å; S610-Q612 VanDerWaalsContact C-N 3.3Å; S610-Q612 PolarHBondContact O-N 3.42Å; Q612-L614 VanDerWaalsContact C-N 3.35Å; Q612-E615 PolarHBondContact O-N 3.27Å; Q612-A616 WeakPolarHBondContact O-CB 3.37Å; Q612-A616 PolarHBondContact O-N 3.08Å
613	I	92.7	Very high	90.4	Very high	9 Å²	9	24.2 Å²	24.2	5%	0.046	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-46	172.8	-66.7	174.6	0	0	0	109.9	L608 S609 S610 E615 A616 C617 L646 P647 L650 F652	L608-I613 HydrophobicContact CB-CG1 3.86Å; S609-I613 PolarHBondContact O-N 3.45Å; S610-I613 PolarHBondContact O-N 2.77Å; I613-E615 VanDerWaalsContact C-N 3.34Å; I613-E615 PolarHBondContact O-N 3.4Å; I613-A616 PolarHBondContact O-N 2.86Å; I613-C617 PolarHBondContact O-N 3.23Å; I613-C617 PolarHBondContact O-SG 3.34Å; I613-L646 HydrophobicContact CG2-CD2 4Å; I613-P647 HydrophobicContact CD1-CG 4.21Å; I613-L650 HydrophobicContact CD1-CD2 4.29Å; I613-L650 HydrophobicContact CG2-CD2 3.86Å; I613-F652 HydrophobicContact CG2-CE1 4.3Å; I613-F652 HydrophobicContact CG2-CZ 4.26Å
614	L	93.6	Very high	90.1	Very high	10 Å²	10	23.8 Å²	23.8	5%	0.052	16%	0.157	C	C	.	.	H	α-helix	trans	-58.5	-47	174.1	174.6	59.1	0	0	0	111.4	S610 Q612 A616 C617 N618 F652 V655 L657 D661 V665	S610-L614 PolarHBondContact O-N 2.98Å; S610-L614 VanDerWaalsContact O-N 3.08Å; Q612-L614 VanDerWaalsContact C-N 3.35Å; L614-A616 VanDerWaalsContact C-N 3.28Å; L614-A616 PolarHBondContact O-N 2.83Å; L614-C617 WeakPolarHBondContact O-CB 3.37Å; L614-C617 PolarHBondContact O-N 2.67Å; L614-N618 PolarHBondContact O-N 2.87Å; L614-F652 HydrophobicContact CB-CD1 4.34Å; L614-F652 HydrophobicContact CB-CE1 3.96Å; L614-V655 HydrophobicContact CD2-CG1 3.72Å; L614-L657 HydrophobicContact CD1-CD2 4.03Å; L614-L657 HydrophobicContact CD2-CD2 3.94Å; L614-D661 HydrophobicContact CD1-CB 3.71Å; L614-D661 HydrophobicContact CD2-CB 4.25Å; L614-V665 HydrophobicContact CD1-CG2 3.69Å
615	E	91.9	Very high	89.2	Confident	13 Å²	13	23.4 Å²	23.4	6%	0.061	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-36.7	178.4	-169.6	56.9	-141.7	0	0	111.9	F541 R561 A611 Q612 I613 N618 Y619	F541-E615 HydrophobicContact CE1-CB 4.07Å; F541-E615 HydrophobicContact CE1-CG 4.31Å; F541-E615 HydrophobicContact CZ-CB 4.03Å; F541-E615 HydrophobicContact CZ-CG 4.07Å; R561-E615 IonicContact CZ-OE1 3.51Å; R561-E615 IonicContact CZ-OE2 3.48Å; R561-E615 IonicContact NE-OE1 3.45Å; R561-E615 PolarHBondContact NE-OE1 3.32Å; R561-E615 IonicContact NE-OE2 3.65Å; R561-E615 VanDerWaalsContact NH2-CD 3.33Å; R561-E615 IonicContact NH2-OE1 3.82Å; R561-E615 PolarHBondContact NH2-OE1 2.63Å; R561-E615 IonicContact NH2-OE2 2.73Å; R561-E615 PolarHBondContact NH2-OE2 2.93Å; A611-E615 WeakPolarHBondContact O-CB 3.35Å; A611-E615 PolarHBondContact O-N 2.97Å; Q612-E615 PolarHBondContact O-N 3.27Å; I613-E615 VanDerWaalsContact C-N 3.34Å; I613-E615 PolarHBondContact O-N 3.4Å; E615-N618 PolarHBondContact O-N 3.02Å; E615-Y619 WeakPolarHBondContact O-CB 3.39Å; E615-Y619 PolarHBondContact O-N 3.5Å
616	A	92.7	Very high	87.9	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.6	-40.4	175.7	0	0	0	0	0	111.9	F541 F605 Q612 I613 L614 Y619 V620 L642	F541-A616 HydrophobicContact CE2-CB 4.42Å; F541-A616 HydrophobicContact CZ-CB 4.03Å; F605-A616 HydrophobicContact CE1-CB 4.03Å; Q612-A616 WeakPolarHBondContact O-CB 3.37Å; Q612-A616 PolarHBondContact O-N 3.08Å; I613-A616 PolarHBondContact O-N 2.86Å; L614-A616 VanDerWaalsContact C-N 3.28Å; L614-A616 PolarHBondContact O-N 2.83Å; A616-Y619 PolarHBondContact O-N 3.39Å; A616-V620 WeakPolarHBondContact O-CB 3.44Å; A616-V620 WeakPolarHBondContact O-CG2 3.37Å; A616-V620 PolarHBondContact O-N 2.99Å; A616-L642 HydrophobicContact CB-CD1 4.34Å
617	C	94.7	Very high	86.2	Confident	4 Å²	4	29.6 Å²	29.6	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-60.9	-47.5	174	-62.4	0	0	0	0	111.2	I613 L614 Y621 V665	I613-C617 PolarHBondContact O-N 3.23Å; I613-C617 PolarHBondContact O-SG 3.34Å; L614-C617 WeakPolarHBondContact O-CB 3.37Å; L614-C617 PolarHBondContact O-N 2.67Å; C617-Y621 VanDerWaalsContact O-CB 3.27Å; C617-Y621 WeakPolarHBondContact O-CB 3.46Å; C617-Y621 PolarHBondContact O-N 3.33Å; C617-V665 HydrophobicContact CB-CG2 4.3Å
618	N	94.2	Very high	84.3	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.011	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-42.5	176.6	-78.4	-30.7	0	0	0	112.4	R561 L614 E615 Y621 E622 D661 T664	R561-N618 PolarHBondContact NH2-ND2 2.81Å; L614-N618 PolarHBondContact O-N 2.87Å; E615-N618 PolarHBondContact O-N 3.02Å; N618-Y621 PolarHBondContact O-N 2.68Å; N618-E622 WeakPolarHBondContact O-CG 3.43Å; N618-E622 PolarHBondContact O-N 2.75Å; N618-D661 PolarHBondContact ND2-OD1 3.27Å; N618-T664 WeakPolarHBondContact OD1-CB 3.46Å; N618-T664 WeakPolarHBondContact OD1-CG2 3.43Å; N618-T664 PolarHBondContact OD1-OG1 3.11Å
619	Y	92.3	Very high	82	Confident	1 Å²	1	39 Å²	39	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-48.6	179.9	-173.9	-97.9	0	0	0	112	P540 A564 V596 E615 A616 E622 A623	P540-Y619 HydrophobicContact CG-CD2 3.88Å; P540-Y619 HydrophobicContact CG-CE2 3.75Å; P540-Y619 HydrophobicContact CG-CG 4.48Å; A564-Y619 HydrophobicContact CB-CD2 3.9Å; A564-Y619 HydrophobicContact CB-CE1 4.1Å; A564-Y619 HydrophobicContact CB-CE2 3.21Å; A564-Y619 WeakPolarHBondContact CB-OH 3.49Å; V596-Y619 HydrophobicContact CG1-CE1 3.77Å; V596-Y619 VanDerWaalsContact CG1-OH 3.26Å; V596-Y619 WeakPolarHBondContact CG1-OH 3.41Å; V596-Y619 WeakPolarHBondContact CG2-OH 3.22Å; E615-Y619 WeakPolarHBondContact O-CB 3.39Å; E615-Y619 PolarHBondContact O-N 3.5Å; A616-Y619 PolarHBondContact O-N 3.39Å; Y619-E622 PolarHBondContact O-N 2.66Å; Y619-A623 WeakPolarHBondContact O-CB 3.42Å; Y619-A623 PolarHBondContact O-N 2.8Å
620	V	92.8	Very high	79.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.8	-43.2	177.1	171.8	0	0	0	0	110.5	L600 A616 E622 A623 S624 M638 L639 L642	L600-V620 HydrophobicContact CD1-CG2 3.88Å; L600-V620 HydrophobicContact CD2-CG2 3.63Å; L600-V620 HydrophobicContact CG-CG2 4.44Å; A616-V620 WeakPolarHBondContact O-CB 3.44Å; A616-V620 WeakPolarHBondContact O-CG2 3.37Å; A616-V620 PolarHBondContact O-N 2.99Å; V620-E622 PolarHBondContact O-N 3.43Å; V620-A623 CarbonylContact O-C 3.49Å; V620-A623 PolarHBondContact O-N 3.32Å; V620-A623 VanDerWaalsContact O-N 3.1Å; V620-S624 WeakPolarHBondContact O-CB 3.24Å; V620-S624 PolarHBondContact O-N 3.13Å; V620-S624 PolarHBondContact O-OG 2.75Å; V620-M638 HydrophobicContact CG1-CB 4.1Å; V620-L639 HydrophobicContact CG1-CB 4.24Å; V620-L639 HydrophobicContact CG1-CD1 4.23Å; V620-L642 HydrophobicContact CB-CD2 3.85Å; V620-L642 HydrophobicContact CG1-CB 4.42Å; V620-L642 HydrophobicContact CG1-CD2 4.06Å; V620-L642 HydrophobicContact CG2-CB 4.24Å; V620-L642 HydrophobicContact CG2-CD2 3.93Å
621	Y	93.4	Very high	77.3	Confident	10 Å²	10	44 Å²	44	4%	0.039	25%	0.253	C	S	.	.	H	α-helix	trans	-56.3	-48	177.7	-178.9	-95.8	0	0	0	112.2	Y401 R430 T431 C617 N618 A623 S624 F625 F663 T664 N667	Y401-Y621 AromaticContact CD1-CE1 3.96Å; Y401-Y621 HydrophobicContact CD1-CE1 3.96Å; Y401-Y621 HydrophobicContact CD2-CE1 4.15Å; Y401-Y621 AromaticContact CE1-CE1 3.63Å; Y401-Y621 HydrophobicContact CE1-CE1 3.63Å; Y401-Y621 HydrophobicContact CE2-CD1 4.41Å; Y401-Y621 AromaticContact CE2-CE1 3.84Å; Y401-Y621 HydrophobicContact CE2-CE1 3.84Å; Y401-Y621 HydrophobicContact CG-CE1 4.19Å; Y401-Y621 AromaticContact CZ-CE1 3.54Å; R430-Y621 PolarHBondContact O-OH 2.81Å; T431-Y621 HydrophobicContact CG2-CE1 4.17Å; C617-Y621 VanDerWaalsContact O-CB 3.27Å; C617-Y621 WeakPolarHBondContact O-CB 3.46Å; C617-Y621 PolarHBondContact O-N 3.33Å; N618-Y621 PolarHBondContact O-N 2.68Å; Y621-A623 VanDerWaalsContact C-N 3.27Å; Y621-A623 PolarHBondContact O-N 2.94Å; Y621-S624 PolarHBondContact O-N 2.89Å; Y621-F625 HydrophobicContact CD1-CE2 4.39Å; Y621-F625 HydrophobicContact CD2-CE2 4.11Å; Y621-F625 AromaticContact CE1-CE2 3.93Å; Y621-F625 HydrophobicContact CE1-CE2 3.93Å; Y621-F625 AromaticContact CE2-CE2 3.61Å; Y621-F625 HydrophobicContact CE2-CE2 3.61Å; Y621-F625 AromaticContact CE2-CZ 3.76Å; Y621-F625 HydrophobicContact CE2-CZ 3.76Å; Y621-F625 HydrophobicContact CG-CE2 4.47Å; Y621-F625 AromaticContact CZ-CE2 3.5Å; Y621-F625 AromaticContact CZ-CZ 3.74Å; Y621-F625 WeakPolarHBondContact O-CD2 3.46Å; Y621-F625 WeakPolarHBondContact O-CE2 3.4Å; Y621-F663 HydrophobicContact CE2-CD1 4.05Å; Y621-F663 AromaticContact CE2-CE1 3.57Å; Y621-F663 HydrophobicContact CE2-CE1 3.57Å; Y621-F663 AromaticContact CZ-CE1 3.63Å; Y621-F663 WeakPolarHBondContact OH-CE1 3.45Å; Y621-T664 HydrophobicContact CD1-CG2 3.73Å; Y621-T664 HydrophobicContact CD2-CG2 4.25Å; Y621-T664 HydrophobicContact CE1-CG2 4.45Å; Y621-T664 HydrophobicContact CG-CG2 3.62Å; Y621-N667 HydrophobicContact CD2-CB 4.32Å
622	E	92.5	Very high	75.4	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.019	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-32	178.3	-70.7	-71.3	142.9	0	0	112.4	Y401 T431 L432 T433 R561 G565 N618 Y619 V620	Y401-E622 PolarHBondContact OH-OE1 3.04Å; T431-E622 WeakPolarHBondContact CB-OE2 3.29Å; L432-E622 VanDerWaalsContact CB-OE1 3.3Å; L432-E622 WeakPolarHBondContact CB-OE1 3.46Å; L432-E622 PolarHBondContact N-OE1 2.95Å; L432-E622 PolarHBondContact N-OE2 3.36Å; T433-E622 VanDerWaalsContact CB-OE2 3.23Å; T433-E622 WeakPolarHBondContact CB-OE2 3.13Å; T433-E622 PolarHBondContact N-OE2 2.88Å; T433-E622 PolarHBondContact OG1-OE2 3.16Å; R561-E622 HydrophobicContact CG-CB 4.2Å; R561-E622 HydrophobicContact CG-CG 3.8Å; G565-E622 VanDerWaalsContact CA-O 3.24Å; G565-E622 WeakPolarHBondContact CA-O 3.31Å; N618-E622 WeakPolarHBondContact O-CG 3.43Å; N618-E622 PolarHBondContact O-N 2.75Å; Y619-E622 PolarHBondContact O-N 2.66Å; V620-E622 PolarHBondContact O-N 3.43Å
623	A	89.4	Confident	74	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-84.5	-4.9	176.6	0	0	0	0	0	114.8	F568 Y619 V620 Y621 M638	F568-A623 VanDerWaalsContact CB-O 3.3Å; F568-A623 WeakPolarHBondContact CB-O 3.4Å; F568-A623 HydrophobicContact CD2-CB 3.64Å; F568-A623 HydrophobicContact CE2-CB 4Å; F568-A623 HydrophobicContact CG-CB 4.26Å; F568-A623 WeakPolarHBondContact CG-O 3.32Å; Y619-A623 WeakPolarHBondContact O-CB 3.42Å; Y619-A623 PolarHBondContact O-N 2.8Å; V620-A623 CarbonylContact O-C 3.49Å; V620-A623 PolarHBondContact O-N 3.32Å; V620-A623 VanDerWaalsContact O-N 3.1Å; Y621-A623 VanDerWaalsContact C-N 3.27Å; Y621-A623 PolarHBondContact O-N 2.94Å; A623-M638 HydrophobicContact CB-CE 3.82Å; A623-M638 HydrophobicContact CB-SD 3.9Å
624	S	81.3	Confident	72.7	Confident	19 Å²	19	50.8 Å²	50.8	13%	0.133	29%	0.29	C	S	.	.			trans	-89.8	1.3	-170.1	-67.9	0	0	0	0	115.3	V620 Y621 S635	V620-S624 WeakPolarHBondContact O-CB 3.24Å; V620-S624 PolarHBondContact O-N 3.13Å; V620-S624 PolarHBondContact O-OG 2.75Å; Y621-S624 PolarHBondContact O-N 2.89Å; S624-S635 VanDerWaalsContact C-CB 3.46Å; S624-S635 WeakPolarHBondContact O-CB 3.28Å
625	F	69.8	Low	71.2	Confident	64 Å²	64	50.5 Å²	50.5	28%	0.281	29%	0.289	S	S	.	.			trans	-111.1	101.4	-175.8	-68	-87.8	0	0	0	111.6	R430 T431 Y621	R430-F625 HydrophobicContact CB-CD1 3.96Å; R430-F625 HydrophobicContact CB-CE1 3.85Å; R430-F625 HydrophobicContact CB-CG 4.38Å; R430-F625 HydrophobicContact CB-CZ 4.16Å; R430-F625 HydrophobicContact CG-CD1 4.5Å; R430-F625 HydrophobicContact CG-CE1 4.39Å; T431-F625 HydrophobicContact CG2-CB 4.29Å; T431-F625 HydrophobicContact CG2-CD2 3.1Å; T431-F625 HydrophobicContact CG2-CE2 3.51Å; T431-F625 HydrophobicContact CG2-CG 3.87Å; Y621-F625 HydrophobicContact CD1-CE2 4.39Å; Y621-F625 HydrophobicContact CD2-CE2 4.11Å; Y621-F625 AromaticContact CE1-CE2 3.93Å; Y621-F625 HydrophobicContact CE1-CE2 3.93Å; Y621-F625 AromaticContact CE2-CE2 3.61Å; Y621-F625 HydrophobicContact CE2-CE2 3.61Å; Y621-F625 AromaticContact CE2-CZ 3.76Å; Y621-F625 HydrophobicContact CE2-CZ 3.76Å; Y621-F625 HydrophobicContact CG-CE2 4.47Å; Y621-F625 AromaticContact CZ-CE2 3.5Å; Y621-F625 AromaticContact CZ-CZ 3.74Å; Y621-F625 WeakPolarHBondContact O-CD2 3.46Å; Y621-F625 WeakPolarHBondContact O-CE2 3.4Å
626	T	57.5	Low	70.4	Confident	60 Å²	60	51.7 Å²	51.7	37%	0.368	30%	0.301	S	S	.	.			trans	-105.9	142.1	171.3	58.8	0	0	0	0	110.8	F568 S635	F568-T626 HydrophobicContact CD1-CG2 4.48Å; T626-S635 WeakPolarHBondContact CG2-OG 3.17Å; T626-S635 PolarHBondContact OG1-OG 3.44Å
627	H	50.1	Low	70	Confident	133 Å²	133	57.4 Å²	57.4	62%	0.616	33%	0.325	S	S	*	.			trans	-76.3	128.8	159.2	-100	-79.7	0	0	0	108	E629	H627-E629 PolarHBondContact O-N 3.46Å
628	Q	45.3	Very low	69.7	Low	192 Å²	192	57.2 Å²	57.2	90%	0.897	32%	0.324	S	S	*	.	S	Bend	trans	-60.6	96.3	-179.9	-74	177.2	-18.7	0	0	111.2
629	E	40.8	Very low	69.5	Low	147 Å²	147	58.5 Å²	58.5	69%	0.687	33%	0.331	S	S	*	.	S	Bend	trans	-123.1	-8.6	168.3	-76.7	-168.5	157.6	0	0	113.8	H627	H627-E629 PolarHBondContact O-N 3.46Å
630	S	40.1	Very low	69.4	Low	91 Å²	91	61.7 Å²	61.7	64%	0.636	35%	0.351	S	S	*	.	S	Bend	trans	-149	132.9	172	59.7	0	0	0	0	110.9	T632	S630-T632 PolarHBondContact O-N 3.24Å
631	G	40.5	Very low	69.3	Low	93 Å²	93	64 Å²	64	96%	0.959	36%	0.361	S	S	*	.	S	Bend	trans	-65.4	31.8	-168.6	0	0	0	0	0	117.6
632	T	48.1	Very low	69.3	Low	83 Å²	83	63.5 Å²	63.5	51%	0.509	36%	0.36	S	S	.	.			trans	-125.2	101.3	169.2	50.2	0	0	0	0	109.1	S630 T634	S630-T632 PolarHBondContact O-N 3.24Å; T632-T634 PolarHBondContact O-N 3Å; T632-T634 PolarHBondContact O-OG1 2.81Å
633	D	60.9	Low	69.3	Low	93 Å²	93	63.3 Å²	63.3	50%	0.497	36%	0.359	S	S	.	.			trans	-71.4	77.4	-178.5	-164.6	-13.6	0	0	0	111	S635 A636 K637	D633-S635 PolarHBondContact O-N 2.94Å; D633-S635 PolarHBondContact OD1-OG 3.23Å; D633-A636 HydrophobicContact CB-CB 3.97Å; D633-A636 PolarHBondContact O-N 3.42Å; D633-A636 WeakPolarHBondContact OD1-CB 3.41Å; D633-A636 PolarHBondContact OD1-N 3.38Å; D633-A636 WeakPolarHBondContact OD2-CB 3.32Å; D633-K637 PolarHBondContact O-N 2.99Å
634	T	64.2	Low	69.5	Low	47 Å²	47	65.7 Å²	65.7	29%	0.288	38%	0.375	S	S	.	.	H	α-helix	trans	-67	-28.4	-177	-51.7	0	0	0	0	111.1	F568 M597 T632 K637 M638	F568-T634 HydrophobicContact CE1-CG2 4.4Å; M597-T634 HydrophobicContact CE-CG2 4.15Å; M597-T634 HydrophobicContact SD-CG2 4.04Å; T632-T634 PolarHBondContact O-N 3Å; T632-T634 PolarHBondContact O-OG1 2.81Å; T634-K637 WeakPolarHBondContact O-CB 3.41Å; T634-K637 PolarHBondContact O-N 2.8Å; T634-M638 PolarHBondContact O-N 2.81Å
635	S	64	Low	70	Confident	4 Å²	4	68.4 Å²	68.4	3%	0.028	39%	0.388	C	S	.	.	H	α-helix	trans	-61.1	-50.4	170.5	22	0	0	0	0	112.5	S624 T626 D633 K637 M638 L639	S624-S635 VanDerWaalsContact C-CB 3.46Å; S624-S635 WeakPolarHBondContact O-CB 3.28Å; T626-S635 WeakPolarHBondContact CG2-OG 3.17Å; T626-S635 PolarHBondContact OG1-OG 3.44Å; D633-S635 PolarHBondContact O-N 2.94Å; D633-S635 PolarHBondContact OD1-OG 3.23Å; S635-K637 PolarHBondContact O-N 3.29Å; S635-M638 PolarHBondContact O-N 2.85Å; S635-L639 PolarHBondContact O-N 3.42Å
636	A	75.1	Confident	71.2	Confident	38 Å²	38	65.5 Å²	65.5	31%	0.314	38%	0.376	S	S	.	.	H	α-helix	trans	-59.3	-37.2	176.1	0	0	0	0	0	111.4	D633 M638 L639 T640	D633-A636 HydrophobicContact CB-CB 3.97Å; D633-A636 PolarHBondContact O-N 3.42Å; D633-A636 WeakPolarHBondContact OD1-CB 3.41Å; D633-A636 PolarHBondContact OD1-N 3.38Å; D633-A636 WeakPolarHBondContact OD2-CB 3.32Å; A636-M638 PolarHBondContact O-N 3.21Å; A636-L639 PolarHBondContact O-N 3.08Å; A636-T640 VanDerWaalsContact O-CB 3.27Å; A636-T640 WeakPolarHBondContact O-CB 3.46Å; A636-T640 PolarHBondContact O-N 3.02Å; A636-T640 PolarHBondContact O-OG1 2.93Å; A636-T640 VanDerWaalsContact O-OG1 3.08Å
637	K	84	Confident	73	Confident	120 Å²	120	64.3 Å²	64.3	52%	0.522	37%	0.369	S	S	.	.	H	α-helix	trans	-60.1	-40	177.1	-66.4	178.5	-175.6	179.5	0	113.3	D633 T634 S635 H641	D633-K637 PolarHBondContact O-N 2.99Å; T634-K637 WeakPolarHBondContact O-CB 3.41Å; T634-K637 PolarHBondContact O-N 2.8Å; S635-K637 PolarHBondContact O-N 3.29Å; K637-H641 WeakPolarHBondContact O-CB 3.28Å; K637-H641 PolarHBondContact O-N 3.07Å
638	M	87.9	Confident	75.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-66.6	-44.9	178.2	-68	-178.7	75.2	0	0	111.9	F568 V596 M597 L600 V620 A623 T634 S635 A636 H641 L642	F568-M638 HydrophobicContact CE1-SD 4.07Å; F568-M638 HydrophobicContact CE2-SD 4.06Å; F568-M638 HydrophobicContact CZ-SD 3.7Å; V596-M638 HydrophobicContact CG1-CE 3.91Å; M597-M638 HydrophobicContact CE-CG 3.6Å; M597-M638 HydrophobicContact SD-CE 4.25Å; M597-M638 HydrophobicContact SD-CG 3.16Å; M597-M638 WeakPolarHBondContact SD-CG 3.37Å; M597-M638 HydrophobicContact SD-SD 3.45Å; L600-M638 HydrophobicContact CD2-CB 4.12Å; L600-M638 HydrophobicContact CD2-CE 3.77Å; L600-M638 HydrophobicContact CD2-CG 4.31Å; V620-M638 HydrophobicContact CG1-CB 4.1Å; A623-M638 HydrophobicContact CB-CE 3.82Å; A623-M638 HydrophobicContact CB-SD 3.9Å; T634-M638 PolarHBondContact O-N 2.81Å; S635-M638 PolarHBondContact O-N 2.85Å; A636-M638 PolarHBondContact O-N 3.21Å; M638-H641 PolarHBondContact O-N 3.18Å; M638-L642 WeakPolarHBondContact O-CB 3.32Å; M638-L642 PolarHBondContact O-N 3.01Å
639	L	90.6	Very high	77.5	Confident	30 Å²	30	60.1 Å²	60.1	16%	0.157	35%	0.352	C	S	.	.	H	α-helix	trans	-65.4	-45	179.5	-177.7	60.1	0	0	0	111.2	V620 S635 A636 L642 A643 A671	V620-L639 HydrophobicContact CG1-CB 4.24Å; V620-L639 HydrophobicContact CG1-CD1 4.23Å; S635-L639 PolarHBondContact O-N 3.42Å; A636-L639 PolarHBondContact O-N 3.08Å; L639-L642 PolarHBondContact O-N 3.23Å; L639-A643 WeakPolarHBondContact O-CB 3.35Å; L639-A643 PolarHBondContact O-N 3.19Å; L639-A671 HydrophobicContact CD1-CB 4.11Å; L639-A671 HydrophobicContact CD2-CB 4.01Å; L639-A671 HydrophobicContact CG-CB 3.74Å
640	T	89.5	Confident	80.1	Confident	68 Å²	68	53.2 Å²	53.2	42%	0.417	32%	0.32	S	S	.	.	H	α-helix	trans	-59.3	-46.8	173	-69.6	0	0	0	0	111.1	A636 L642 A643 S644 E675	A636-T640 VanDerWaalsContact O-CB 3.27Å; A636-T640 WeakPolarHBondContact O-CB 3.46Å; A636-T640 PolarHBondContact O-N 3.02Å; A636-T640 PolarHBondContact O-OG1 2.93Å; A636-T640 VanDerWaalsContact O-OG1 3.08Å; T640-L642 PolarHBondContact O-N 3.45Å; T640-A643 PolarHBondContact O-N 2.96Å; T640-S644 VanDerWaalsContact O-CB 3.3Å; T640-S644 WeakPolarHBondContact O-CB 3.43Å; T640-S644 PolarHBondContact O-N 3.32Å; T640-S644 PolarHBondContact O-OG 3.09Å; T640-E675 WeakPolarHBondContact CA-OE1 3.45Å; T640-E675 VanDerWaalsContact CB-OE1 3.3Å; T640-E675 WeakPolarHBondContact CB-OE1 3.29Å; T640-E675 WeakPolarHBondContact CG2-OE1 3.28Å; T640-E675 PolarHBondContact OG1-OE1 2.69Å
641	H	91.4	Very high	82.7	Confident	47 Å²	47	51.2 Å²	51.2	22%	0.218	30%	0.304	C	S	.	.	H	α-helix	trans	-61.1	-45.4	177.9	-178.8	80.3	0	0	0	112.2	E601 K637 M638 N645	E601-H641 WeakPolarHBondContact CA-NE2 3.35Å; K637-H641 WeakPolarHBondContact O-CB 3.28Å; K637-H641 PolarHBondContact O-N 3.07Å; M638-H641 PolarHBondContact O-N 3.18Å; H641-N645 PolarHBondContact CE1-ND2 3.29Å; H641-N645 VanDerWaalsContact CE1-ND2 3.33Å; H641-N645 PolarHBondContact ND1-ND2 3.25Å; H641-N645 WeakPolarHBondContact O-CB 3.48Å; H641-N645 PolarHBondContact O-N 3.26Å; H641-N645 PolarHBondContact O-ND2 3.19Å
642	L	93.2	Very high	85.2	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-54.3	173.9	175	67.2	0	0	0	110.3	F605 A616 V620 M638 L639 T640 S644 N645 L646 A668	F605-L642 HydrophobicContact CD1-CD1 3.93Å; F605-L642 HydrophobicContact CE1-CD1 3.27Å; F605-L642 HydrophobicContact CZ-CD1 3.68Å; A616-L642 HydrophobicContact CB-CD1 4.34Å; V620-L642 HydrophobicContact CB-CD2 3.85Å; V620-L642 HydrophobicContact CG1-CB 4.42Å; V620-L642 HydrophobicContact CG1-CD2 4.06Å; V620-L642 HydrophobicContact CG2-CB 4.24Å; V620-L642 HydrophobicContact CG2-CD2 3.93Å; M638-L642 WeakPolarHBondContact O-CB 3.32Å; M638-L642 PolarHBondContact O-N 3.01Å; L639-L642 PolarHBondContact O-N 3.23Å; T640-L642 PolarHBondContact O-N 3.45Å; L642-S644 PolarHBondContact O-N 3.17Å; L642-N645 PolarHBondContact O-N 3.39Å; L642-N645 VanDerWaalsContact O-N 3.08Å; L642-L646 HydrophobicContact CD1-CD2 3.98Å; L642-L646 HydrophobicContact CD1-CG 4.2Å; L642-L646 HydrophobicContact CG-CD1 4.42Å; L642-L646 HydrophobicContact CG-CG 4.33Å; L642-L646 WeakPolarHBondContact O-CG 3.39Å; L642-L646 PolarHBondContact O-N 2.8Å; L642-A668 HydrophobicContact CD2-CB 3.89Å
643	A	92.6	Very high	87.1	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.5	-45.1	-177.2	0	0	0	0	0	113.1	L639 T640 N645 A671	L639-A643 WeakPolarHBondContact O-CB 3.35Å; L639-A643 PolarHBondContact O-N 3.19Å; T640-A643 PolarHBondContact O-N 2.96Å; A643-N645 VanDerWaalsContact C-N 3.27Å; A643-N645 PolarHBondContact O-N 2.93Å; A643-A671 HydrophobicContact CB-CB 3.87Å
644	S	92.3	Very high	88.2	Confident	49 Å²	49	45.1 Å²	45.1	34%	0.343	25%	0.251	S	S	.	.	H	α-helix	trans	-64.1	-27.8	177.4	-75.8	0	0	0	0	113.5	T640 L642 E675 R677	T640-S644 VanDerWaalsContact O-CB 3.3Å; T640-S644 WeakPolarHBondContact O-CB 3.43Å; T640-S644 PolarHBondContact O-N 3.32Å; T640-S644 PolarHBondContact O-OG 3.09Å; L642-S644 PolarHBondContact O-N 3.17Å; S644-E675 WeakPolarHBondContact CA-OE2 3.46Å; S644-E675 WeakPolarHBondContact CB-OE2 3.33Å; S644-E675 PolarHBondContact N-OE2 3.06Å; S644-E675 VanDerWaalsContact N-OE2 3.16Å; S644-E675 PolarHBondContact OG-OE2 3.02Å; S644-R677 PolarHBondContact O-NH1 3.15Å
645	N	93.3	Very high	89.3	Confident	77 Å²	77	43.4 Å²	43.4	41%	0.412	24%	0.24	S	C	.	.	H	α-helix	trans	-108.9	-4	-172	-68.9	-80.1	0	0	0	114.3	F605 H641 L642 A643	F605-N645 WeakPolarHBondContact CB-O 3.44Å; F605-N645 HydrophobicContact CD2-CB 3.53Å; F605-N645 HydrophobicContact CE2-CB 3.86Å; F605-N645 HydrophobicContact CG-CB 4.5Å; H641-N645 PolarHBondContact CE1-ND2 3.29Å; H641-N645 VanDerWaalsContact CE1-ND2 3.33Å; H641-N645 PolarHBondContact ND1-ND2 3.25Å; H641-N645 WeakPolarHBondContact O-CB 3.48Å; H641-N645 PolarHBondContact O-N 3.26Å; H641-N645 PolarHBondContact O-ND2 3.19Å; L642-N645 PolarHBondContact O-N 3.39Å; L642-N645 VanDerWaalsContact O-N 3.08Å; A643-N645 VanDerWaalsContact C-N 3.27Å; A643-N645 PolarHBondContact O-N 2.93Å
646	L	95.1	Very high	90.5	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.016	25%	0.253	C	S	.	.	S	Bend	trans	-60.1	141.1	173.2	-77.9	173	0	0	0	111	F605 I613 L642 L650 A668 R677 F679	F605-L646 HydrophobicContact CD1-CD2 4.47Å; I613-L646 HydrophobicContact CG2-CD2 4Å; L642-L646 HydrophobicContact CD1-CD2 3.98Å; L642-L646 HydrophobicContact CD1-CG 4.2Å; L642-L646 HydrophobicContact CG-CD1 4.42Å; L642-L646 HydrophobicContact CG-CG 4.33Å; L642-L646 WeakPolarHBondContact O-CG 3.39Å; L642-L646 PolarHBondContact O-N 2.8Å; L646-L650 HydrophobicContact CD2-CD2 4.05Å; L646-A668 HydrophobicContact CD1-CB 4.13Å; L646-R677 PolarHBondContact O-NH2 3.31Å; L646-F679 HydrophobicContact CB-CE1 3.84Å; L646-F679 HydrophobicContact CB-CZ 4.42Å
647	P	93.9	Very high	91.3	Very high	34 Å²	34	43.9 Å²	43.9	22%	0.221	24%	0.24	C	C	.	.			trans	-63.8	150.1	173.1	27.6	-34.4	0	0	0	110.5	I613 L650 F679	I613-P647 HydrophobicContact CD1-CG 4.21Å; P647-L650 HydrophobicContact CG-CD2 3.67Å; P647-L650 HydrophobicContact CG-CG 4.42Å; P647-L650 WeakPolarHBondContact O-CG 3.3Å; P647-F679 WeakPolarHBondContact O-CD1 3.39Å
648	E	94.6	Very high	91.7	Very high	124 Å²	124	39.7 Å²	39.7	58%	0.579	22%	0.223	S	C	*	.	S	Bend	trans	-65.1	-40.3	177.5	-66.7	-175.7	170.4	0	0	112	F679 C680	E648-F679 CarbonylContact O-C 3.57Å; E648-F679 VanDerWaalsContact O-CA 3.29Å; E648-F679 WeakPolarHBondContact O-CA 3.38Å; E648-C680 PolarHBondContact O-N 3.42Å
649	L	95.3	Very high	92	Very high	113 Å²	113	40.2 Å²	40.2	59%	0.592	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	109.4	171.8	179.9	65	0	0	0	109.8	C680	L649-C680 WeakPolarHBondContact CA-O 3.38Å; L649-C680 HydrophobicContact CD1-CB 3.85Å
650	L	95.7	Very high	92.2	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	111.1	176.7	-69.9	162.8	0	0	0	109.5	I613 L646 P647 F652 L669 F679 C680 L681 D682	I613-L650 HydrophobicContact CD1-CD2 4.29Å; I613-L650 HydrophobicContact CG2-CD2 3.86Å; L646-L650 HydrophobicContact CD2-CD2 4.05Å; P647-L650 HydrophobicContact CG-CD2 3.67Å; P647-L650 HydrophobicContact CG-CG 4.42Å; P647-L650 WeakPolarHBondContact O-CG 3.3Å; L650-F652 HydrophobicContact CB-CE2 4.14Å; L650-L669 HydrophobicContact CD1-CD2 3.5Å; L650-L669 VanDerWaalsContact CD1-CD2 3.5Å; L650-F679 HydrophobicContact CD1-CB 4.43Å; L650-F679 HydrophobicContact CD1-CD1 3.79Å; L650-F679 HydrophobicContact CD1-CE1 4.36Å; L650-F679 HydrophobicContact CD1-CG 4.25Å; L650-C680 PolarHBondContact N-O 3.03Å; L650-L681 HydrophobicContact CB-CD2 3.93Å; L650-L681 HydrophobicContact CD1-CD2 4.11Å; L650-L681 CarbonylContact O-C 3.51Å; L650-L681 WeakPolarHBondContact O-CA 3.48Å; L650-D682 PolarHBondContact O-N 3.22Å
651	T	93.9	Very high	92.5	Very high	48 Å²	48	37.2 Å²	37.2	29%	0.294	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	130.3	175.7	-179.8	0	0	0	0	111.1	S610 R653	S610-T651 WeakPolarHBondContact CB-O 3.04Å; S610-T651 PolarHBondContact OG-O 3.44Å; T651-R653 PolarHBondContact OG1-N 3.08Å
652	F	93.8	Very high	92.8	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.009	20%	0.201	C	C	.	.			trans	-114.8	22	172.7	-63.7	-77.9	0	0	0	111.6	I613 L614 L650 G654 V655 L657 V665 D682 L683	I613-F652 HydrophobicContact CG2-CE1 4.3Å; I613-F652 HydrophobicContact CG2-CZ 4.26Å; L614-F652 HydrophobicContact CB-CD1 4.34Å; L614-F652 HydrophobicContact CB-CE1 3.96Å; L650-F652 HydrophobicContact CB-CE2 4.14Å; F652-G654 PolarHBondContact O-N 2.83Å; F652-V655 WeakPolarHBondContact O-CB 3.37Å; F652-V655 PolarHBondContact O-N 2.83Å; F652-L657 HydrophobicContact CB-CD1 3.88Å; F652-L657 HydrophobicContact CB-CG 4.28Å; F652-L657 HydrophobicContact CD1-CD2 4.04Å; F652-L657 HydrophobicContact CD2-CD1 4.27Å; F652-L657 HydrophobicContact CG-CD1 4.02Å; F652-L657 HydrophobicContact CG-CD2 4.25Å; F652-L657 HydrophobicContact CG-CG 4.48Å; F652-V665 HydrophobicContact CE1-CG2 4.29Å; F652-V665 HydrophobicContact CE2-CG1 4.13Å; F652-V665 HydrophobicContact CZ-CG1 4.03Å; F652-V665 HydrophobicContact CZ-CG2 3.93Å; F652-D682 PolarHBondContact N-O 3.11Å; F652-L683 HydrophobicContact CB-CD2 4.43Å; F652-L683 HydrophobicContact CD2-CD2 3.8Å
653	R	87.3	Confident	92.9	Very high	92 Å²	92	36.7 Å²	36.7	35%	0.347	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	128.6	179	-171.9	-177.5	-63.8	-93	-0.7	111.6	T651 V655 D682 E684 D685	T651-R653 PolarHBondContact OG1-N 3.08Å; R653-V655 PolarHBondContact O-N 3.33Å; R653-D682 IonicContact CZ-OD2 3.69Å; R653-D682 IonicContact NE-OD2 2.79Å; R653-D682 IonicContact NH2-OD1 2.72Å; R653-D682 PolarHBondContact NH2-OD1 3.13Å; R653-D682 IonicContact NH2-OD2 2.81Å; R653-D682 PolarHBondContact NH2-OD2 3.42Å; R653-D682 VanDerWaalsContact NH2-OD2 3.15Å; R653-E684 VanDerWaalsContact CA-O 3.28Å; R653-E684 WeakPolarHBondContact CA-O 3.38Å; R653-E684 IonicContact CZ-OE2 2.76Å; R653-E684 IonicContact NH1-OE2 3.76Å; R653-E684 PolarHBondContact NH1-OE2 3Å; R653-E684 IonicContact NH2-OE2 3.36Å; R653-E684 PolarHBondContact NH2-OE2 3.38Å; R653-D685 HydrophobicContact CG-CB 4.17Å; R653-D685 IonicContact CZ-OD2 2.59Å; R653-D685 IonicContact NH1-OD2 3.25Å; R653-D685 PolarHBondContact NH1-OD2 3.37Å
654	G	84	Confident	93.1	Very high	48 Å²	48	36.8 Å²	36.8	50%	0.495	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	8.8	-178.4	0	0	0	0	0	114.1	I181 F652 D685	I181-G654 VanDerWaalsContact CD1-C 3.43Å; I181-G654 WeakPolarHBondContact CD1-O 3.36Å; F652-G654 PolarHBondContact O-N 2.83Å; G654-D685 PolarHBondContact N-O 2.95Å
655	V	87.9	Confident	93.3	Very high	11 Å²	11	34.6 Å²	34.6	7%	0.067	19%	0.192	C	C	.	.			trans	-111.5	116.7	175.9	-176.5	0	0	0	0	109.1	S610 A611 L614 F652 R653 L657 S686	S610-V655 VanDerWaalsContact CB-CG2 3.48Å; A611-V655 HydrophobicContact CB-CG1 4.39Å; A611-V655 HydrophobicContact CB-CG2 4Å; L614-V655 HydrophobicContact CD2-CG1 3.72Å; F652-V655 WeakPolarHBondContact O-CB 3.37Å; F652-V655 PolarHBondContact O-N 2.83Å; R653-V655 PolarHBondContact O-N 3.33Å; V655-L657 PolarHBondContact O-N 3.14Å; V655-S686 WeakPolarHBondContact O-CA 3.44Å
656	P	88.8	Confident	93.4	Very high	45 Å²	45	31.6 Å²	31.6	29%	0.292	18%	0.175	S	C	.	.			trans	-67.7	121.7	-179.9	26.8	-31.7	0	0	0	110.4	I181 S686	I181-P656 HydrophobicContact CD1-CB 4.21Å; I181-P656 HydrophobicContact CD1-CG 4.4Å; P656-S686 CarbonylContact C-O 3.57Å; P656-S686 VanDerWaalsContact CA-O 3.31Å; P656-S686 WeakPolarHBondContact CA-O 3.38Å
657	L	92.8	Very high	93.4	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	19%	0.186	C	C	.	.			trans	-98.8	98.9	177.2	-71.2	177.7	0	0	0	110.4	L614 F652 V655 D661 V662 L683 S686 I688	L614-L657 HydrophobicContact CD1-CD2 4.03Å; L614-L657 HydrophobicContact CD2-CD2 3.94Å; F652-L657 HydrophobicContact CB-CD1 3.88Å; F652-L657 HydrophobicContact CB-CG 4.28Å; F652-L657 HydrophobicContact CD1-CD2 4.04Å; F652-L657 HydrophobicContact CD2-CD1 4.27Å; F652-L657 HydrophobicContact CG-CD1 4.02Å; F652-L657 HydrophobicContact CG-CD2 4.25Å; F652-L657 HydrophobicContact CG-CG 4.48Å; V655-L657 PolarHBondContact O-N 3.14Å; L657-D661 HydrophobicContact CD2-CB 4.36Å; L657-V662 HydrophobicContact CB-CG2 4.11Å; L657-L683 HydrophobicContact CD1-CD2 3.72Å; L657-S686 PolarHBondContact N-O 2.61Å; L657-I688 HydrophobicContact CB-CB 4.39Å; L657-I688 HydrophobicContact CD1-CD1 4.48Å
658	N	92.2	Very high	93.5	Very high	32 Å²	32	32 Å²	32	17%	0.171	18%	0.175	C	C	.	.			trans	-79.6	164.3	176	-48.9	-66.8	0	0	0	110.8	W407 D661 V662	W407-N658 HydrophobicContact CE3-CB 4.12Å; W407-N658 HydrophobicContact CH2-CB 4.11Å; W407-N658 WeakPolarHBondContact CH2-OD1 3.3Å; W407-N658 HydrophobicContact CZ3-CB 3.63Å; W407-N658 WeakPolarHBondContact CZ3-OD1 3.47Å; N658-D661 VanDerWaalsContact CB-OD2 3.32Å; N658-D661 WeakPolarHBondContact CB-OD2 3.42Å; N658-D661 PolarHBondContact N-OD2 2.84Å; N658-D661 PolarHBondContact ND2-OD2 2.91Å; N658-D661 WeakPolarHBondContact O-CA 3.29Å; N658-D661 VanDerWaalsContact O-CB 3.3Å; N658-D661 WeakPolarHBondContact O-CB 3.21Å; N658-D661 PolarHBondContact O-N 3.21Å; N658-V662 PolarHBondContact O-N 2.71Å
659	P	94.9	Very high	93.6	Very high	12 Å²	12	26.1 Å²	26.1	8%	0.078	15%	0.148	C	C	.	.	H	α-helix	trans	-56	-40.9	-175.4	-24.6	34.9	0	0	0	115.1	L404 W407 V662 F663	L404-P659 HydrophobicContact CB-CB 4.3Å; L404-P659 HydrophobicContact CD2-CB 3.7Å; W407-P659 HydrophobicContact CB-CG 4.07Å; W407-P659 HydrophobicContact CD2-CG 4.04Å; W407-P659 HydrophobicContact CG-CG 3.7Å; P659-V662 PolarHBondContact O-N 3.35Å; P659-F663 PolarHBondContact O-N 3.03Å
660	P	94.6	Very high	93.6	Very high	17 Å²	17	26.9 Å²	26.9	11%	0.11	14%	0.143	C	C	.	.	H	α-helix	trans	-65.7	-34.7	172.8	-22.3	34.5	0	0	0	114	Y401 L404 L405 F663 T664	Y401-P660 HydrophobicContact CE2-CB 4.09Å; L404-P660 HydrophobicContact CB-CG 4.44Å; L404-P660 WeakPolarHBondContact O-CG 3.17Å; L405-P660 HydrophobicContact CD2-CB 3.97Å; L405-P660 HydrophobicContact CD2-CG 3.92Å; P660-F663 WeakPolarHBondContact O-CB 3.3Å; P660-F663 PolarHBondContact O-N 2.85Å; P660-T664 PolarHBondContact O-N 2.97Å
661	D	95.4	Very high	93.5	Very high	18 Å²	18	27.7 Å²	27.7	10%	0.096	15%	0.15	C	C	.	.	H	α-helix	trans	-65.5	-41.5	178.3	-66.3	-47.3	0	0	0	110.7	L614 N618 L657 N658 F663 T664 V665	L614-D661 HydrophobicContact CD1-CB 3.71Å; L614-D661 HydrophobicContact CD2-CB 4.25Å; N618-D661 PolarHBondContact ND2-OD1 3.27Å; L657-D661 HydrophobicContact CD2-CB 4.36Å; N658-D661 VanDerWaalsContact CB-OD2 3.32Å; N658-D661 WeakPolarHBondContact CB-OD2 3.42Å; N658-D661 PolarHBondContact N-OD2 2.84Å; N658-D661 PolarHBondContact ND2-OD2 2.91Å; N658-D661 WeakPolarHBondContact O-CA 3.29Å; N658-D661 VanDerWaalsContact O-CB 3.3Å; N658-D661 WeakPolarHBondContact O-CB 3.21Å; N658-D661 PolarHBondContact O-N 3.21Å; D661-F663 PolarHBondContact O-N 3.48Å; D661-T664 PolarHBondContact O-N 3.22Å; D661-T664 PolarHBondContact O-OG1 2.85Å; D661-V665 WeakPolarHBondContact O-CG2 3.27Å; D661-V665 PolarHBondContact O-N 2.74Å; D661-V665 VanDerWaalsContact O-N 3.07Å
662	V	96.9	Very high	93.5	Very high	6 Å²	6	25.4 Å²	25.4	4%	0.036	14%	0.136	C	C	.	.	H	α-helix	trans	-60.3	-38.1	174.7	178	0	0	0	0	110.9	L657 N658 P659 Q666 I688 L696	L657-V662 HydrophobicContact CB-CG2 4.11Å; N658-V662 PolarHBondContact O-N 2.71Å; P659-V662 PolarHBondContact O-N 3.35Å; V662-Q666 VanDerWaalsContact O-CB 3.24Å; V662-Q666 WeakPolarHBondContact O-CB 3.35Å; V662-Q666 PolarHBondContact O-N 2.76Å; V662-I688 HydrophobicContact CG1-CD1 4.36Å; V662-I688 HydrophobicContact CG2-CD1 3.87Å; V662-I688 HydrophobicContact CG2-CG1 3.86Å; V662-L696 HydrophobicContact CG1-CD1 4.09Å; V662-L696 HydrophobicContact CG1-CD2 4.22Å; V662-L696 HydrophobicContact CG1-CG 3.92Å
663	F	96.2	Very high	93.5	Very high	31 Å²	31	26.5 Å²	26.5	14%	0.136	15%	0.148	C	C	.	.	H	α-helix	trans	-64.6	-44.9	178.7	-174	-91.4	0	0	0	112.6	S400 Y401 L404 Y621 P659 P660 D661 Q666 N667	S400-F663 WeakPolarHBondContact OG-CE2 3.49Å; Y401-F663 HydrophobicContact CD2-CB 4.19Å; Y401-F663 AromaticContact CD2-CD1 3.35Å; Y401-F663 HydrophobicContact CD2-CD1 3.35Å; Y401-F663 AromaticContact CD2-CE1 3.88Å; Y401-F663 HydrophobicContact CD2-CE1 3.88Å; Y401-F663 AromaticContact CD2-CG 3.86Å; Y401-F663 HydrophobicContact CD2-CG 3.86Å; Y401-F663 HydrophobicContact CE2-CD1 4.04Å; Y401-F663 HydrophobicContact CG-CD1 4.09Å; Y401-F663 HydrophobicContact CG-CE1 4.17Å; L404-F663 HydrophobicContact CD1-CB 3.78Å; L404-F663 HydrophobicContact CD1-CD2 3.78Å; L404-F663 HydrophobicContact CD1-CG 4.08Å; Y621-F663 HydrophobicContact CE2-CD1 4.05Å; Y621-F663 AromaticContact CE2-CE1 3.57Å; Y621-F663 HydrophobicContact CE2-CE1 3.57Å; Y621-F663 AromaticContact CZ-CE1 3.63Å; Y621-F663 WeakPolarHBondContact OH-CE1 3.45Å; P659-F663 PolarHBondContact O-N 3.03Å; P660-F663 WeakPolarHBondContact O-CB 3.3Å; P660-F663 PolarHBondContact O-N 2.85Å; D661-F663 PolarHBondContact O-N 3.48Å; F663-Q666 WeakPolarHBondContact O-CB 3.28Å; F663-Q666 PolarHBondContact O-N 2.9Å; F663-N667 PolarHBondContact O-N 2.81Å
664	T	95.6	Very high	93.7	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	17%	0.168	C	C	.	.	H	α-helix	trans	-69.4	-38.4	-179.6	62.2	0	0	0	0	111.7	Y401 N618 Y621 P660 D661 N667 A668	Y401-T664 HydrophobicContact CE2-CG2 4.21Å; N618-T664 WeakPolarHBondContact OD1-CB 3.46Å; N618-T664 WeakPolarHBondContact OD1-CG2 3.43Å; N618-T664 PolarHBondContact OD1-OG1 3.11Å; Y621-T664 HydrophobicContact CD1-CG2 3.73Å; Y621-T664 HydrophobicContact CD2-CG2 4.25Å; Y621-T664 HydrophobicContact CE1-CG2 4.45Å; Y621-T664 HydrophobicContact CG-CG2 3.62Å; P660-T664 PolarHBondContact O-N 2.97Å; D661-T664 PolarHBondContact O-N 3.22Å; D661-T664 PolarHBondContact O-OG1 2.85Å; T664-N667 PolarHBondContact O-N 3.45Å; T664-A668 PolarHBondContact O-N 3.36Å; T664-A668 VanDerWaalsContact O-N 3.12Å
665	V	96.9	Very high	94	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-46.5	171.5	172	0	0	0	0	110.5	L614 C617 F652 D661 N667 A668 L669 L696	L614-V665 HydrophobicContact CD1-CG2 3.69Å; C617-V665 HydrophobicContact CB-CG2 4.3Å; F652-V665 HydrophobicContact CE1-CG2 4.29Å; F652-V665 HydrophobicContact CE2-CG1 4.13Å; F652-V665 HydrophobicContact CZ-CG1 4.03Å; F652-V665 HydrophobicContact CZ-CG2 3.93Å; D661-V665 WeakPolarHBondContact O-CG2 3.27Å; D661-V665 PolarHBondContact O-N 2.74Å; D661-V665 VanDerWaalsContact O-N 3.07Å; V665-N667 VanDerWaalsContact C-N 3.27Å; V665-N667 PolarHBondContact O-N 3.13Å; V665-A668 PolarHBondContact O-N 2.79Å; V665-L669 HydrophobicContact CG1-CD1 3.76Å; V665-L669 HydrophobicContact CG1-CG 4.26Å; V665-L669 VanDerWaalsContact O-CG 3.3Å; V665-L669 WeakPolarHBondContact O-CG 3.4Å; V665-L669 PolarHBondContact O-N 2.82Å; V665-L696 HydrophobicContact CG1-CD2 4.41Å
666	Q	96.5	Very high	94.3	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.065	19%	0.191	C	C	.	.	H	α-helix	trans	-57.9	-41.1	176.4	-170.9	-175.5	31.8	0	0	111.6	V662 F663 L669 R670 T695 L696 L699	V662-Q666 VanDerWaalsContact O-CB 3.24Å; V662-Q666 WeakPolarHBondContact O-CB 3.35Å; V662-Q666 PolarHBondContact O-N 2.76Å; F663-Q666 WeakPolarHBondContact O-CB 3.28Å; F663-Q666 PolarHBondContact O-N 2.9Å; Q666-L669 PolarHBondContact O-N 2.82Å; Q666-R670 HydrophobicContact CG-CG 4.43Å; Q666-R670 WeakPolarHBondContact O-CB 3.2Å; Q666-R670 VanDerWaalsContact O-CG 3.31Å; Q666-R670 WeakPolarHBondContact O-CG 3.11Å; Q666-R670 PolarHBondContact O-N 3.08Å; Q666-T695 PolarHBondContact NE2-O 3.42Å; Q666-L696 HydrophobicContact CB-CD2 3.83Å; Q666-L696 HydrophobicContact CG-CD2 4.25Å; Q666-L699 HydrophobicContact CG-CD1 4.14Å; Q666-L699 HydrophobicContact CG-CD2 4.3Å
667	N	94.4	Very high	94.7	Very high	43 Å²	43	31.2 Å²	31.2	23%	0.23	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-43.8	178.8	-167.7	52.5	0	0	0	112.2	Y621 F663 T664 V665 A671	Y621-N667 HydrophobicContact CD2-CB 4.32Å; F663-N667 PolarHBondContact O-N 2.81Å; T664-N667 PolarHBondContact O-N 3.45Å; V665-N667 VanDerWaalsContact C-N 3.27Å; V665-N667 PolarHBondContact O-N 3.13Å; N667-A671 PolarHBondContact O-N 2.8Å; N667-A671 VanDerWaalsContact O-N 3.13Å
668	A	95.2	Very high	94.8	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-64.7	-42.9	175.8	0	0	0	0	0	112.2	L642 L646 T664 V665 A671 G672	L642-A668 HydrophobicContact CD2-CB 3.89Å; L646-A668 HydrophobicContact CD1-CB 4.13Å; T664-A668 PolarHBondContact O-N 3.36Å; T664-A668 VanDerWaalsContact O-N 3.12Å; V665-A668 PolarHBondContact O-N 2.79Å; A668-A671 PolarHBondContact O-N 3.06Å; A668-G672 PolarHBondContact O-N 3.05Å
669	L	96.6	Very high	95.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-38.9	178.4	-69.1	173.3	0	0	0	112.8	L650 V665 Q666 G672 G673 F679 L681 L696 L699 N701 I702	L650-L669 HydrophobicContact CD1-CD2 3.5Å; L650-L669 VanDerWaalsContact CD1-CD2 3.5Å; V665-L669 HydrophobicContact CG1-CD1 3.76Å; V665-L669 HydrophobicContact CG1-CG 4.26Å; V665-L669 VanDerWaalsContact O-CG 3.3Å; V665-L669 WeakPolarHBondContact O-CG 3.4Å; V665-L669 PolarHBondContact O-N 2.82Å; Q666-L669 PolarHBondContact O-N 2.82Å; L669-G672 PolarHBondContact O-N 2.84Å; L669-G673 PolarHBondContact O-N 2.98Å; L669-F679 HydrophobicContact CD2-CB 4.12Å; L669-F679 HydrophobicContact CD2-CD1 4.16Å; L669-F679 HydrophobicContact CD2-CD2 3.56Å; L669-F679 HydrophobicContact CD2-CE2 3.95Å; L669-F679 HydrophobicContact CD2-CG 3.68Å; L669-F679 HydrophobicContact CD2-CZ 4.41Å; L669-L681 HydrophobicContact CD1-CD1 4.19Å; L669-L681 HydrophobicContact CD1-CD2 4.07Å; L669-L681 HydrophobicContact CD2-CD2 4.41Å; L669-L696 HydrophobicContact CD1-CD2 4.03Å; L669-L699 HydrophobicContact CB-CD1 3.67Å; L669-L699 HydrophobicContact CD1-CD1 4.16Å; L669-N701 PolarHBondContact O-ND2 3.43Å; L669-I702 HydrophobicContact CD1-CD1 4.27Å; L669-I702 HydrophobicContact CD2-CD1 4.44Å
670	R	95.1	Very high	95.2	Very high	130 Å²	130	32.3 Å²	32.3	49%	0.491	20%	0.199	S	C	.	.	H	α-helix	trans	-62.4	-44.2	173.9	-77.8	179.3	-171.7	-177.1	5.1	111.7	Q666 G672 G673 A674 L699	Q666-R670 HydrophobicContact CG-CG 4.43Å; Q666-R670 WeakPolarHBondContact O-CB 3.2Å; Q666-R670 VanDerWaalsContact O-CG 3.31Å; Q666-R670 WeakPolarHBondContact O-CG 3.11Å; Q666-R670 PolarHBondContact O-N 3.08Å; R670-G672 VanDerWaalsContact C-N 3.32Å; R670-G672 PolarHBondContact O-N 3.21Å; R670-G673 PolarHBondContact O-N 3.21Å; R670-A674 PolarHBondContact O-N 3.25Å; R670-L699 HydrophobicContact CG-CD1 4.49Å; R670-L699 HydrophobicContact CG-CD2 3.46Å; R670-L699 VanDerWaalsContact CG-CD2 3.46Å
671	A	93.5	Very high	95.3	Very high	19 Å²	19	31.7 Å²	31.7	16%	0.157	20%	0.195	C	C	.	.	H	α-helix	trans	-60.8	-42.9	175.3	0	0	0	0	0	111.2	L639 A643 N667 A668 G673 A674 E675	L639-A671 HydrophobicContact CD1-CB 4.11Å; L639-A671 HydrophobicContact CD2-CB 4.01Å; L639-A671 HydrophobicContact CG-CB 3.74Å; A643-A671 HydrophobicContact CB-CB 3.87Å; N667-A671 PolarHBondContact O-N 2.8Å; N667-A671 VanDerWaalsContact O-N 3.13Å; A668-A671 PolarHBondContact O-N 3.06Å; A671-G673 VanDerWaalsContact C-N 3.31Å; A671-G673 PolarHBondContact O-N 2.96Å; A671-A674 WeakPolarHBondContact O-CB 3.04Å; A671-A674 PolarHBondContact O-N 3.13Å; A671-E675 PolarHBondContact O-N 3.3Å
672	G	94.4	Very high	95.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-38.2	174.1	0	0	0	0	0	112.8	A668 L669 R670 A674 E675 G676 R677	A668-G672 PolarHBondContact O-N 3.05Å; L669-G672 PolarHBondContact O-N 2.84Å; R670-G672 VanDerWaalsContact C-N 3.32Å; R670-G672 PolarHBondContact O-N 3.21Å; G672-A674 VanDerWaalsContact C-N 3.34Å; G672-A674 PolarHBondContact O-N 3.44Å; G672-E675 CarbonylContact O-C 3.5Å; G672-E675 WeakPolarHBondContact O-CA 3.38Å; G672-E675 WeakPolarHBondContact O-CB 3.46Å; G672-E675 PolarHBondContact O-N 2.89Å; G672-G676 PolarHBondContact O-N 2.65Å; G672-R677 VanDerWaalsContact O-CB 3.3Å; G672-R677 WeakPolarHBondContact O-CB 3.35Å; G672-R677 PolarHBondContact O-N 2.85Å
673	G	93.8	Very high	95.3	Very high	25 Å²	25	31.4 Å²	31.4	26%	0.258	19%	0.193	S	C	.	.	H	α-helix	trans	-62.3	-39.5	174.5	0	0	0	0	0	113	L669 R670 A671 E675 G676 N701	L669-G673 PolarHBondContact O-N 2.98Å; R670-G673 PolarHBondContact O-N 3.21Å; A671-G673 VanDerWaalsContact C-N 3.31Å; A671-G673 PolarHBondContact O-N 2.96Å; G673-E675 PolarHBondContact O-N 2.92Å; G673-G676 PolarHBondContact O-N 3.16Å; G673-N701 WeakPolarHBondContact CA-ND2 3.16Å; G673-N701 PolarHBondContact N-ND2 3.34Å; G673-N701 VanDerWaalsContact N-ND2 3.15Å
674	A	91.9	Very high	94.9	Very high	94 Å²	94	31 Å²	31	78%	0.777	19%	0.192	S	C	*	.	H	α-helix	trans	-64.5	-24.8	173.6	0	0	0	0	0	112.8	R670 A671 G672 G676	R670-A674 PolarHBondContact O-N 3.25Å; A671-A674 WeakPolarHBondContact O-CB 3.04Å; A671-A674 PolarHBondContact O-N 3.13Å; G672-A674 VanDerWaalsContact C-N 3.34Å; G672-A674 PolarHBondContact O-N 3.44Å; A674-G676 VanDerWaalsContact C-N 3.32Å
675	E	90.9	Very high	94.5	Very high	65 Å²	65	33.4 Å²	33.4	30%	0.304	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	4.5	173.1	-66.1	173.6	-168.6	0	0	113.4	T640 S644 A671 G672 G673 R677	T640-E675 WeakPolarHBondContact CA-OE1 3.45Å; T640-E675 VanDerWaalsContact CB-OE1 3.3Å; T640-E675 WeakPolarHBondContact CB-OE1 3.29Å; T640-E675 WeakPolarHBondContact CG2-OE1 3.28Å; T640-E675 PolarHBondContact OG1-OE1 2.69Å; S644-E675 WeakPolarHBondContact CA-OE2 3.46Å; S644-E675 WeakPolarHBondContact CB-OE2 3.33Å; S644-E675 PolarHBondContact N-OE2 3.06Å; S644-E675 VanDerWaalsContact N-OE2 3.16Å; S644-E675 PolarHBondContact OG-OE2 3.02Å; A671-E675 PolarHBondContact O-N 3.3Å; G672-E675 CarbonylContact O-C 3.5Å; G672-E675 WeakPolarHBondContact O-CA 3.38Å; G672-E675 WeakPolarHBondContact O-CB 3.46Å; G672-E675 PolarHBondContact O-N 2.89Å; G673-E675 PolarHBondContact O-N 2.92Å; E675-R677 VanDerWaalsContact C-N 3.33Å
676	G	93.8	Very high	94.2	Very high	71 Å²	71	33.3 Å²	33.3	73%	0.732	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.6	13.7	-179.7	0	0	0	0	0	114.5	G672 G673 A674	G672-G676 PolarHBondContact O-N 2.65Å; G673-G676 PolarHBondContact O-N 3.16Å; A674-G676 VanDerWaalsContact C-N 3.32Å
677	R	96.1	Very high	93.9	Very high	66 Å²	66	33 Å²	33	25%	0.249	21%	0.205	C	C	.	.			trans	-82.2	138.7	175.4	-66.1	-68.9	-55.9	-100.5	-10.8	111.1	S644 L646 G672 E675 F679 N701	S644-R677 PolarHBondContact O-NH1 3.15Å; L646-R677 PolarHBondContact O-NH2 3.31Å; G672-R677 VanDerWaalsContact O-CB 3.3Å; G672-R677 WeakPolarHBondContact O-CB 3.35Å; G672-R677 PolarHBondContact O-N 2.85Å; E675-R677 VanDerWaalsContact C-N 3.33Å; R677-F679 HydrophobicContact CB-CE2 3.86Å; R677-F679 HydrophobicContact CB-CZ 3.73Å; R677-N701 WeakPolarHBondContact O-CB 3.23Å; R677-N701 PolarHBondContact O-ND2 2.76Å; R677-N701 VanDerWaalsContact O-ND2 3.11Å
678	S	96.7	Very high	93.9	Very high	41 Å²	41	31.1 Å²	31.1	29%	0.287	20%	0.195	S	C	.	.			trans	-110.9	148.2	170.4	63.7	0	0	0	0	112.2	N701 N703	S678-N701 CarbonylContact C-O 3.58Å; S678-N701 WeakPolarHBondContact CA-O 3.37Å; S678-N703 VanDerWaalsContact CB-ND2 3.28Å; S678-N703 WeakPolarHBondContact CB-ND2 3.47Å; S678-N703 PolarHBondContact OG-ND2 2.97Å
679	F	97.4	Very high	93.8	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	156.3	-175.7	-55.8	-83.8	0	0	0	112.8	L646 P647 E648 L650 L669 R677 N701 I702 N703	L646-F679 HydrophobicContact CB-CE1 3.84Å; L646-F679 HydrophobicContact CB-CZ 4.42Å; P647-F679 WeakPolarHBondContact O-CD1 3.39Å; E648-F679 CarbonylContact O-C 3.57Å; E648-F679 VanDerWaalsContact O-CA 3.29Å; E648-F679 WeakPolarHBondContact O-CA 3.38Å; L650-F679 HydrophobicContact CD1-CB 4.43Å; L650-F679 HydrophobicContact CD1-CD1 3.79Å; L650-F679 HydrophobicContact CD1-CE1 4.36Å; L650-F679 HydrophobicContact CD1-CG 4.25Å; L669-F679 HydrophobicContact CD2-CB 4.12Å; L669-F679 HydrophobicContact CD2-CD1 4.16Å; L669-F679 HydrophobicContact CD2-CD2 3.56Å; L669-F679 HydrophobicContact CD2-CE2 3.95Å; L669-F679 HydrophobicContact CD2-CG 3.68Å; L669-F679 HydrophobicContact CD2-CZ 4.41Å; R677-F679 HydrophobicContact CB-CE2 3.86Å; R677-F679 HydrophobicContact CB-CZ 3.73Å; F679-N701 WeakPolarHBondContact CD2-ND2 3.3Å; F679-N701 PolarHBondContact N-O 3.22Å; F679-I702 HydrophobicContact CB-CD1 3.84Å; F679-I702 CarbonylContact O-C 3.51Å; F679-I702 WeakPolarHBondContact O-CA 3.44Å; F679-N703 PolarHBondContact O-N 3.12Å
680	C	97.4	Very high	93.7	Very high	31 Å²	31	33.4 Å²	33.4	21%	0.209	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.4	168	-61.3	0	0	0	0	108.5	E648 L649 L650 T704	E648-C680 PolarHBondContact O-N 3.42Å; L649-C680 WeakPolarHBondContact CA-O 3.38Å; L649-C680 HydrophobicContact CD1-CB 3.85Å; L650-C680 PolarHBondContact N-O 3.03Å; C680-T704 CarbonylContact C-O 3.46Å; C680-T704 WeakPolarHBondContact CA-O 3.38Å; C680-T704 VanDerWaalsContact CB-OG1 3.29Å; C680-T704 WeakPolarHBondContact CB-OG1 3.27Å; C680-T704 PolarHBondContact SG-OG1 3.42Å
681	L	97.3	Very high	93.5	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.021	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.7	-175.5	-56.5	-178.2	0	0	0	111.2	L650 L669 L683 L696 I702 T704 Y705 R706	L650-L681 HydrophobicContact CB-CD2 3.93Å; L650-L681 HydrophobicContact CD1-CD2 4.11Å; L650-L681 CarbonylContact O-C 3.51Å; L650-L681 WeakPolarHBondContact O-CA 3.48Å; L669-L681 HydrophobicContact CD1-CD1 4.19Å; L669-L681 HydrophobicContact CD1-CD2 4.07Å; L669-L681 HydrophobicContact CD2-CD2 4.41Å; L681-L683 HydrophobicContact CB-CD1 4.45Å; L681-L683 HydrophobicContact CB-CD2 4.44Å; L681-L683 HydrophobicContact CB-CG 4.16Å; L681-L696 HydrophobicContact CD1-CB 4.11Å; L681-L696 HydrophobicContact CD1-CD1 4.35Å; L681-I702 HydrophobicContact CD1-CD1 3.92Å; L681-I702 HydrophobicContact CD1-CG1 4.26Å; L681-I702 HydrophobicContact CD1-CG2 4.26Å; L681-I702 HydrophobicContact CD2-CD1 4.28Å; L681-I702 HydrophobicContact CG-CD1 4.01Å; L681-I702 HydrophobicContact CG-CG2 4.23Å; L681-T704 PolarHBondContact N-O 3.19Å; L681-Y705 CarbonylContact O-C 3.57Å; L681-Y705 WeakPolarHBondContact O-CA 3.28Å; L681-R706 PolarHBondContact O-N 3.36Å
682	D	95.7	Very high	93.6	Very high	17 Å²	17	29.7 Å²	29.7	9%	0.091	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	102.6	165.7	-177	11.4	0	0	0	109.4	L650 F652 R653 E684	L650-D682 PolarHBondContact O-N 3.22Å; F652-D682 PolarHBondContact N-O 3.11Å; R653-D682 IonicContact CZ-OD2 3.69Å; R653-D682 IonicContact NE-OD2 2.79Å; R653-D682 IonicContact NH2-OD1 2.72Å; R653-D682 PolarHBondContact NH2-OD1 3.13Å; R653-D682 IonicContact NH2-OD2 2.81Å; R653-D682 PolarHBondContact NH2-OD2 3.42Å; R653-D682 VanDerWaalsContact NH2-OD2 3.15Å; D682-E684 PolarHBondContact OD1-N 3.28Å
683	L	94.9	Very high	93.7	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.01	20%	0.199	C	C	.	.			trans	-108	12.2	-177.9	-51	170.7	0	0	0	112.1	F652 L657 L681 S686 I688 L693 L696 R706 A707	F652-L683 HydrophobicContact CB-CD2 4.43Å; F652-L683 HydrophobicContact CD2-CD2 3.8Å; L657-L683 HydrophobicContact CD1-CD2 3.72Å; L681-L683 HydrophobicContact CB-CD1 4.45Å; L681-L683 HydrophobicContact CB-CD2 4.44Å; L681-L683 HydrophobicContact CB-CG 4.16Å; L683-S686 WeakPolarHBondContact O-CB 3.32Å; L683-S686 PolarHBondContact O-N 2.99Å; L683-S686 PolarHBondContact O-OG 2.98Å; L683-I688 HydrophobicContact CB-CG2 4.48Å; L683-I688 HydrophobicContact CD1-CD1 4.11Å; L683-L693 HydrophobicContact CD1-CD1 3.74Å; L683-L696 HydrophobicContact CD1-CD1 4.04Å; L683-L696 HydrophobicContact CD2-CD1 4.37Å; L683-R706 WeakPolarHBondContact CA-O 3.19Å; L683-R706 VanDerWaalsContact CB-O 3.23Å; L683-R706 WeakPolarHBondContact CB-O 3.44Å; L683-R706 PolarHBondContact N-O 3.03Å; L683-A707 HydrophobicContact CB-CB 4.25Å
684	E	89.6	Confident	93.8	Very high	22 Å²	22	32.6 Å²	32.6	10%	0.103	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	144.7	172.6	-72.7	-174.2	-174.6	0	0	110.8	R653 D682 S686 R706	R653-E684 VanDerWaalsContact CA-O 3.28Å; R653-E684 WeakPolarHBondContact CA-O 3.38Å; R653-E684 IonicContact CZ-OE2 2.76Å; R653-E684 IonicContact NH1-OE2 3.76Å; R653-E684 PolarHBondContact NH1-OE2 3Å; R653-E684 IonicContact NH2-OE2 3.36Å; R653-E684 PolarHBondContact NH2-OE2 3.38Å; D682-E684 PolarHBondContact OD1-N 3.28Å; E684-S686 PolarHBondContact O-N 3.04Å; E684-S686 VanDerWaalsContact O-N 3.08Å; E684-R706 HydrophobicContact CG-CB 4.09Å; E684-R706 IonicContact OE1-CZ 3.28Å; E684-R706 IonicContact OE1-NE 2.63Å; E684-R706 PolarHBondContact OE1-NE 3.19Å; E684-R706 IonicContact OE1-NH2 2.72Å; E684-R706 PolarHBondContact OE1-NH2 3Å; E684-R706 IonicContact OE2-CZ 3.1Å; E684-R706 IonicContact OE2-NE 2.92Å; E684-R706 IonicContact OE2-NH2 2.7Å; E684-R706 PolarHBondContact OE2-NH2 3.49Å
685	D	86.6	Confident	94	Very high	52 Å²	52	30.1 Å²	30.1	28%	0.278	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	29.7	-179.3	-44.7	-48.1	0	0	0	114.1	I181 R653 G654	I181-D685 VanDerWaalsContact CB-O 3.24Å; I181-D685 WeakPolarHBondContact CB-O 3.43Å; I181-D685 WeakPolarHBondContact CD1-O 3.37Å; I181-D685 WeakPolarHBondContact CG2-O 3.28Å; R653-D685 HydrophobicContact CG-CB 4.17Å; R653-D685 IonicContact CZ-OD2 2.59Å; R653-D685 IonicContact NH1-OD2 3.25Å; R653-D685 PolarHBondContact NH1-OD2 3.37Å; G654-D685 PolarHBondContact N-O 2.95Å
686	S	91.2	Very high	94.3	Very high	2 Å²	2	27 Å²	27	1%	0.014	16%	0.163	C	C	.	.	S	Bend	trans	-101	-16	177.6	70.4	0	0	0	0	113.8	I181 V655 P656 L657 L683 E684 I688	I181-S686 VanDerWaalsContact CG2-C 3.47Å; V655-S686 WeakPolarHBondContact O-CA 3.44Å; P656-S686 CarbonylContact C-O 3.57Å; P656-S686 VanDerWaalsContact CA-O 3.31Å; P656-S686 WeakPolarHBondContact CA-O 3.38Å; L657-S686 PolarHBondContact N-O 2.61Å; L683-S686 WeakPolarHBondContact O-CB 3.32Å; L683-S686 PolarHBondContact O-N 2.99Å; L683-S686 PolarHBondContact O-OG 2.98Å; E684-S686 PolarHBondContact O-N 3.04Å; E684-S686 VanDerWaalsContact O-N 3.08Å; S686-I688 PolarHBondContact O-N 3.07Å
687	G	89.4	Confident	94.4	Very high	8 Å²	8	23.8 Å²	23.8	8%	0.082	13%	0.129	C	C	.	.			trans	63.5	19.3	-178.6	0	0	0	0	0	114.4	T182 R187	T182-G687 WeakPolarHBondContact O-CA 3.4Å; R187-G687 PolarHBondContact NH1-O 3.28Å; R187-G687 PolarHBondContact NH2-O 3.27Å
688	I	94.6	Very high	94.3	Very high	3 Å²	3	23 Å²	23	2%	0.015	14%	0.137	C	C	.	.			trans	-54.1	134.3	176.8	-171.9	169.5	0	0	0	110.6	L657 V662 L683 S686 L693 L696	L657-I688 HydrophobicContact CB-CB 4.39Å; L657-I688 HydrophobicContact CD1-CD1 4.48Å; V662-I688 HydrophobicContact CG1-CD1 4.36Å; V662-I688 HydrophobicContact CG2-CD1 3.87Å; V662-I688 HydrophobicContact CG2-CG1 3.86Å; L683-I688 HydrophobicContact CB-CG2 4.48Å; L683-I688 HydrophobicContact CD1-CD1 4.11Å; S686-I688 PolarHBondContact O-N 3.07Å; I688-L693 HydrophobicContact CD1-CB 4.35Å; I688-L696 HydrophobicContact CD1-CD1 3.71Å
689	Q	92.6	Very high	94.3	Very high	39 Å²	39	21.8 Å²	21.8	18%	0.182	13%	0.127	C	C	.	.			trans	-71	149.3	175	-69.9	-178	-17.9	0	0	111.2	D184 C691 G692 L693	D184-Q689 WeakPolarHBondContact OD2-CA 3.32Å; Q689-C691 PolarHBondContact O-N 2.77Å; Q689-C691 VanDerWaalsContact O-N 3.16Å; Q689-G692 CarbonylContact O-C 3.6Å; Q689-G692 WeakPolarHBondContact O-CA 3.27Å; Q689-G692 PolarHBondContact O-N 2.96Å; Q689-L693 PolarHBondContact O-N 3.45Å
690	I	94.2	Very high	94.2	Very high	10 Å²	10	26.9 Å²	26.9	5%	0.051	16%	0.162	C	C	.	.	H	α-helix	trans	-54.6	-39.6	-179.6	-62.5	168.1	0	0	0	111.5	D184 I185 G692 L693 R694 D711 T714 L715	D184-I690 HydrophobicContact CB-CG1 4.47Å; D184-I690 PolarHBondContact OD2-N 3.17Å; I185-I690 HydrophobicContact CD1-CD1 3.84Å; I185-I690 HydrophobicContact CG1-CD1 4.16Å; I690-G692 VanDerWaalsContact C-N 3.33Å; I690-G692 PolarHBondContact O-N 3.46Å; I690-L693 PolarHBondContact O-N 2.7Å; I690-R694 PolarHBondContact O-N 3.05Å; I690-D711 HydrophobicContact CG1-CB 4.35Å; I690-T714 HydrophobicContact CD1-CG2 3.67Å; I690-L715 HydrophobicContact CG2-CB 4.1Å; I690-L715 HydrophobicContact CG2-CD1 4.27Å
691	C	92.3	Very high	94.1	Very high	64 Å²	64	26.3 Å²	26.3	43%	0.432	16%	0.157	S	C	.	.	H	α-helix	trans	-62.4	-38.2	176.8	62.6	0	0	0	0	112.8	Q689 T695	Q689-C691 PolarHBondContact O-N 2.77Å; Q689-C691 VanDerWaalsContact O-N 3.16Å; C691-T695 WeakPolarHBondContact O-CG2 3.31Å; C691-T695 PolarHBondContact O-N 3.28Å
692	G	94.8	Very high	94.2	Very high	8 Å²	8	26.1 Å²	26.1	8%	0.082	16%	0.157	C	C	.	.	H	α-helix	trans	-74.3	-35.6	175.5	0	0	0	0	0	112.9	Q689 I690 R694 T695 L696	Q689-G692 CarbonylContact O-C 3.6Å; Q689-G692 WeakPolarHBondContact O-CA 3.27Å; Q689-G692 PolarHBondContact O-N 2.96Å; I690-G692 VanDerWaalsContact C-N 3.33Å; I690-G692 PolarHBondContact O-N 3.46Å; G692-R694 VanDerWaalsContact C-N 3.33Å; G692-R694 PolarHBondContact O-N 2.96Å; G692-T695 WeakPolarHBondContact CA-OG1 3.32Å; G692-T695 PolarHBondContact O-N 2.8Å; G692-T695 PolarHBondContact O-OG1 3.33Å; G692-L696 PolarHBondContact O-N 2.72Å
693	L	96.6	Very high	94.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.5	-45.6	172.1	-178.9	63.5	0	0	0	110.5	L683 I688 Q689 I690 T695 L696 V697 Y705 A707 V712 L715	L683-L693 HydrophobicContact CD1-CD1 3.74Å; I688-L693 HydrophobicContact CD1-CB 4.35Å; Q689-L693 PolarHBondContact O-N 3.45Å; I690-L693 PolarHBondContact O-N 2.7Å; L693-T695 VanDerWaalsContact C-N 3.31Å; L693-T695 PolarHBondContact O-N 3.12Å; L693-L696 PolarHBondContact O-N 2.91Å; L693-V697 HydrophobicContact CD1-CG2 3.96Å; L693-V697 HydrophobicContact CG-CG2 4.24Å; L693-V697 WeakPolarHBondContact O-CB 3.45Å; L693-V697 VanDerWaalsContact O-CG2 3.29Å; L693-V697 WeakPolarHBondContact O-CG2 3.32Å; L693-V697 PolarHBondContact O-N 2.73Å; L693-Y705 HydrophobicContact CD1-CD2 4.32Å; L693-Y705 HydrophobicContact CD1-CE2 4.4Å; L693-A707 HydrophobicContact CD1-CB 3.98Å; L693-A707 HydrophobicContact CD2-CB 4.29Å; L693-V712 HydrophobicContact CD2-CG2 3.98Å; L693-L715 HydrophobicContact CD2-CD2 3.96Å; L693-L715 HydrophobicContact CG-CD2 3.92Å
694	R	96.4	Very high	94.3	Very high	85 Å²	85	31.1 Å²	31.1	32%	0.321	19%	0.185	S	C	.	.	H	α-helix	trans	-55.9	-43.5	175.2	-170.3	178.4	69.2	118.3	0.6	112.4	I690 G692 L696 A698 L715 L719 L727	I690-R694 PolarHBondContact O-N 3.05Å; G692-R694 VanDerWaalsContact C-N 3.33Å; G692-R694 PolarHBondContact O-N 2.96Å; R694-L696 VanDerWaalsContact C-N 3.35Å; R694-L696 PolarHBondContact O-N 3.28Å; R694-A698 VanDerWaalsContact O-CB 3.24Å; R694-A698 WeakPolarHBondContact O-CB 3.49Å; R694-A698 PolarHBondContact O-N 3.18Å; R694-L715 HydrophobicContact CB-CD1 3.67Å; R694-L715 HydrophobicContact CG-CD1 3.87Å; R694-L719 HydrophobicContact CG-CD2 4.46Å; R694-L727 HydrophobicContact CG-CD2 4.02Å
695	T	95.8	Very high	94.7	Very high	42 Å²	42	30.1 Å²	30.1	26%	0.258	18%	0.18	S	C	.	.	H	α-helix	trans	-69.8	-31.2	-177.5	58	0	0	0	0	113.1	Q666 C691 G692 L693	Q666-T695 PolarHBondContact NE2-O 3.42Å; C691-T695 WeakPolarHBondContact O-CG2 3.31Å; C691-T695 PolarHBondContact O-N 3.28Å; G692-T695 WeakPolarHBondContact CA-OG1 3.32Å; G692-T695 PolarHBondContact O-N 2.8Å; G692-T695 PolarHBondContact O-OG1 3.33Å; L693-T695 VanDerWaalsContact C-N 3.31Å; L693-T695 PolarHBondContact O-N 3.12Å
696	L	96.9	Very high	95.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-77.4	-43.8	175	-65.3	-179	0	0	0	112.1	V662 V665 Q666 L669 L681 L683 I688 G692 L693 R694 A698 L699	V662-L696 HydrophobicContact CG1-CD1 4.09Å; V662-L696 HydrophobicContact CG1-CD2 4.22Å; V662-L696 HydrophobicContact CG1-CG 3.92Å; V665-L696 HydrophobicContact CG1-CD2 4.41Å; Q666-L696 HydrophobicContact CB-CD2 3.83Å; Q666-L696 HydrophobicContact CG-CD2 4.25Å; L669-L696 HydrophobicContact CD1-CD2 4.03Å; L681-L696 HydrophobicContact CD1-CB 4.11Å; L681-L696 HydrophobicContact CD1-CD1 4.35Å; L683-L696 HydrophobicContact CD1-CD1 4.04Å; L683-L696 HydrophobicContact CD2-CD1 4.37Å; I688-L696 HydrophobicContact CD1-CD1 3.71Å; G692-L696 PolarHBondContact O-N 2.72Å; L693-L696 PolarHBondContact O-N 2.91Å; R694-L696 VanDerWaalsContact C-N 3.35Å; R694-L696 PolarHBondContact O-N 3.28Å; L696-A698 VanDerWaalsContact C-N 3.26Å; L696-A698 PolarHBondContact O-N 3.44Å; L696-L699 WeakPolarHBondContact O-CB 3.4Å; L696-L699 WeakPolarHBondContact O-CG 3.36Å; L696-L699 PolarHBondContact O-N 2.87Å
697	V	95.1	Very high	95.3	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-66.1	-30	-180	174	0	0	0	0	112	L693 L699 Y705 L727 A731	L693-V697 HydrophobicContact CD1-CG2 3.96Å; L693-V697 HydrophobicContact CG-CG2 4.24Å; L693-V697 WeakPolarHBondContact O-CB 3.45Å; L693-V697 VanDerWaalsContact O-CG2 3.29Å; L693-V697 WeakPolarHBondContact O-CG2 3.32Å; L693-V697 PolarHBondContact O-N 2.73Å; V697-L699 PolarHBondContact O-N 3.07Å; V697-Y705 HydrophobicContact CG1-CD1 4.4Å; V697-Y705 HydrophobicContact CG1-CE1 3.88Å; V697-Y705 HydrophobicContact CG2-CD1 3.93Å; V697-Y705 HydrophobicContact CG2-CD2 4.01Å; V697-Y705 HydrophobicContact CG2-CE1 3.84Å; V697-Y705 HydrophobicContact CG2-CE2 3.93Å; V697-Y705 HydrophobicContact CG2-CG 4Å; V697-L727 HydrophobicContact CG1-CD1 4.47Å; V697-A731 HydrophobicContact CG1-CB 3.8Å
698	A	95.8	Very high	95.5	Very high	51 Å²	51	30.2 Å²	30.2	42%	0.421	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-4.2	175.9	0	0	0	0	0	114.7	R694 L696 L727	R694-A698 VanDerWaalsContact O-CB 3.24Å; R694-A698 WeakPolarHBondContact O-CB 3.49Å; R694-A698 PolarHBondContact O-N 3.18Å; L696-A698 VanDerWaalsContact C-N 3.26Å; L696-A698 PolarHBondContact O-N 3.44Å; A698-L727 VanDerWaalsContact CA-CD1 3.5Å; A698-L727 HydrophobicContact CB-CD1 3.75Å; A698-L727 HydrophobicContact CB-CD2 4.05Å
699	L	96.4	Very high	95.6	Very high	15 Å²	15	30.6 Å²	30.6	8%	0.079	18%	0.179	C	C	.	.			trans	-77.9	125.5	174.4	-63.8	-179	0	0	0	110.1	Q666 L669 R670 L696 V697 N701 I702	Q666-L699 HydrophobicContact CG-CD1 4.14Å; Q666-L699 HydrophobicContact CG-CD2 4.3Å; L669-L699 HydrophobicContact CB-CD1 3.67Å; L669-L699 HydrophobicContact CD1-CD1 4.16Å; R670-L699 HydrophobicContact CG-CD1 4.49Å; R670-L699 HydrophobicContact CG-CD2 3.46Å; R670-L699 VanDerWaalsContact CG-CD2 3.46Å; L696-L699 WeakPolarHBondContact O-CB 3.4Å; L696-L699 WeakPolarHBondContact O-CG 3.36Å; L696-L699 PolarHBondContact O-N 2.87Å; V697-L699 PolarHBondContact O-N 3.07Å; L699-N701 PolarHBondContact O-N 2.87Å; L699-I702 HydrophobicContact CB-CG1 3.74Å; L699-I702 HydrophobicContact CD1-CG1 4.41Å; L699-I702 PolarHBondContact O-N 3.44Å
700	S	94.7	Very high	95.7	Very high	106 Å²	106	29.1 Å²	29.1	74%	0.741	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.7	-176.8	57.8	0	0	0	0	113.6	I702	S700-I702 VanDerWaalsContact C-N 3.29Å; S700-I702 PolarHBondContact O-N 2.93Å
701	N	96.3	Very high	95.7	Very high	19 Å²	19	28.7 Å²	28.7	10%	0.102	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	10.8	179.6	71.1	-43.1	0	0	0	114.1	L669 G673 R677 S678 F679 L699	L669-N701 PolarHBondContact O-ND2 3.43Å; G673-N701 WeakPolarHBondContact CA-ND2 3.16Å; G673-N701 PolarHBondContact N-ND2 3.34Å; G673-N701 VanDerWaalsContact N-ND2 3.15Å; R677-N701 WeakPolarHBondContact O-CB 3.23Å; R677-N701 PolarHBondContact O-ND2 2.76Å; R677-N701 VanDerWaalsContact O-ND2 3.11Å; S678-N701 CarbonylContact C-O 3.58Å; S678-N701 WeakPolarHBondContact CA-O 3.37Å; F679-N701 WeakPolarHBondContact CD2-ND2 3.3Å; F679-N701 PolarHBondContact N-O 3.22Å; L699-N701 PolarHBondContact O-N 2.87Å
702	I	97.6	Very high	96	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	115.7	170.9	-57.5	-55.8	0	0	0	109.1	L669 F679 L681 L699 S700 K734	L669-I702 HydrophobicContact CD1-CD1 4.27Å; L669-I702 HydrophobicContact CD2-CD1 4.44Å; F679-I702 HydrophobicContact CB-CD1 3.84Å; F679-I702 CarbonylContact O-C 3.51Å; F679-I702 WeakPolarHBondContact O-CA 3.44Å; L681-I702 HydrophobicContact CD1-CD1 3.92Å; L681-I702 HydrophobicContact CD1-CG1 4.26Å; L681-I702 HydrophobicContact CD1-CG2 4.26Å; L681-I702 HydrophobicContact CD2-CD1 4.28Å; L681-I702 HydrophobicContact CG-CD1 4.01Å; L681-I702 HydrophobicContact CG-CG2 4.23Å; L699-I702 HydrophobicContact CB-CG1 3.74Å; L699-I702 HydrophobicContact CD1-CG1 4.41Å; L699-I702 PolarHBondContact O-N 3.44Å; S700-I702 VanDerWaalsContact C-N 3.29Å; S700-I702 PolarHBondContact O-N 2.93Å; I702-K734 VanDerWaalsContact O-CD 3.25Å; I702-K734 WeakPolarHBondContact O-CD 3.48Å; I702-K734 WeakPolarHBondContact O-CE 3.43Å; I702-K734 PolarHBondContact O-NZ 3.42Å
703	N	96.1	Very high	96	Very high	84 Å²	84	25.3 Å²	25.3	45%	0.449	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-43.2	-177.1	-67.9	-13.6	0	0	0	111.8	S678 F679 K734	S678-N703 VanDerWaalsContact CB-ND2 3.28Å; S678-N703 WeakPolarHBondContact CB-ND2 3.47Å; S678-N703 PolarHBondContact OG-ND2 2.97Å; F679-N703 PolarHBondContact O-N 3.12Å; N703-K734 WeakPolarHBondContact O-CG 3.29Å
704	T	97.4	Very high	95.9	Very high	40 Å²	40	26.6 Å²	26.6	25%	0.245	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	154.9	177.5	66.1	0	0	0	0	110.8	C680 L681 K734 K736	C680-T704 CarbonylContact C-O 3.46Å; C680-T704 WeakPolarHBondContact CA-O 3.38Å; C680-T704 VanDerWaalsContact CB-OG1 3.29Å; C680-T704 WeakPolarHBondContact CB-OG1 3.27Å; C680-T704 PolarHBondContact SG-OG1 3.42Å; L681-T704 PolarHBondContact N-O 3.19Å; T704-K734 CarbonylContact C-O 3.6Å; T704-K734 VanDerWaalsContact CA-O 3.22Å; T704-K734 WeakPolarHBondContact CA-O 3.35Å; T704-K736 HydrophobicContact CG2-CG 4.13Å
705	Y	97.6	Very high	95.9	Very high	1 Å²	1	22.5 Å²	22.5	0%	0.004	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	150.1	170.6	73.7	-83.3	0	0	0	112.5	L681 L693 V697 A707 V712 A731 K734 F735 K736	L681-Y705 CarbonylContact O-C 3.57Å; L681-Y705 WeakPolarHBondContact O-CA 3.28Å; L693-Y705 HydrophobicContact CD1-CD2 4.32Å; L693-Y705 HydrophobicContact CD1-CE2 4.4Å; V697-Y705 HydrophobicContact CG1-CD1 4.4Å; V697-Y705 HydrophobicContact CG1-CE1 3.88Å; V697-Y705 HydrophobicContact CG2-CD1 3.93Å; V697-Y705 HydrophobicContact CG2-CD2 4.01Å; V697-Y705 HydrophobicContact CG2-CE1 3.84Å; V697-Y705 HydrophobicContact CG2-CE2 3.93Å; V697-Y705 HydrophobicContact CG2-CG 4Å; Y705-A707 HydrophobicContact CD2-CB 4.48Å; Y705-V712 HydrophobicContact CE2-CG1 4.41Å; Y705-V712 HydrophobicContact CE2-CG2 3.95Å; Y705-A731 VanDerWaalsContact CE1-O 3.24Å; Y705-A731 WeakPolarHBondContact CE1-O 3.37Å; Y705-A731 PolarHBondContact OH-O 3.08Å; Y705-K734 HydrophobicContact CD1-CB 3.81Å; Y705-K734 HydrophobicContact CE1-CB 3.93Å; Y705-K734 PolarHBondContact N-O 3.15Å; Y705-F735 HydrophobicContact CD2-CD2 4.05Å; Y705-F735 HydrophobicContact CE1-CB 4Å; Y705-F735 HydrophobicContact CE2-CB 4.26Å; Y705-F735 AromaticContact CE2-CD2 3.59Å; Y705-F735 HydrophobicContact CE2-CD2 3.59Å; Y705-F735 HydrophobicContact CE2-CE2 4.38Å; Y705-F735 HydrophobicContact CE2-CG 4.28Å; Y705-F735 AromaticContact CZ-CD2 3.98Å; Y705-F735 WeakPolarHBondContact O-CA 3.37Å; Y705-K736 PolarHBondContact O-N 3.08Å
706	R	96	Very high	95.8	Very high	38 Å²	38	20.5 Å²	20.5	14%	0.143	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	142.9	167.3	-55.1	-177.3	61.2	-178.9	9.1	109.1	L681 L683 E684 K736 P739	L681-R706 PolarHBondContact O-N 3.36Å; L683-R706 WeakPolarHBondContact CA-O 3.19Å; L683-R706 VanDerWaalsContact CB-O 3.23Å; L683-R706 WeakPolarHBondContact CB-O 3.44Å; L683-R706 PolarHBondContact N-O 3.03Å; E684-R706 HydrophobicContact CG-CB 4.09Å; E684-R706 IonicContact OE1-CZ 3.28Å; E684-R706 IonicContact OE1-NE 2.63Å; E684-R706 PolarHBondContact OE1-NE 3.19Å; E684-R706 IonicContact OE1-NH2 2.72Å; E684-R706 PolarHBondContact OE1-NH2 3Å; E684-R706 IonicContact OE2-CZ 3.1Å; E684-R706 IonicContact OE2-NE 2.92Å; E684-R706 IonicContact OE2-NH2 2.7Å; E684-R706 PolarHBondContact OE2-NH2 3.49Å; R706-K736 HydrophobicContact CG-CB 4.17Å; R706-K736 WeakPolarHBondContact CG-O 3.43Å; R706-P739 PolarHBondContact NH2-O 3.45Å
707	A	95.5	Very high	95.6	Very high	1 Å²	1	22 Å²	22	1%	0.008	13%	0.134	C	C	.	.			trans	-160.9	173.6	176.2	0	0	0	0	0	109	L683 L693 Y705 I709 V712	L683-A707 HydrophobicContact CB-CB 4.25Å; L693-A707 HydrophobicContact CD1-CB 3.98Å; L693-A707 HydrophobicContact CD2-CB 4.29Å; Y705-A707 HydrophobicContact CD2-CB 4.48Å; A707-I709 PolarHBondContact O-N 3.38Å; A707-V712 HydrophobicContact CB-CG2 3.7Å
708	C	93.6	Very high	95.5	Very high	24 Å²	24	24.9 Å²	24.9	16%	0.162	15%	0.147	C	C	.	.			trans	-55	125.7	173.7	178.4	0	0	0	0	110.6	A710 D711 V712	C708-A710 VanDerWaalsContact C-N 3.26Å; C708-A710 PolarHBondContact O-N 3.21Å; C708-D711 HydrophobicContact CB-CB 4.2Å; C708-D711 VanDerWaalsContact CB-OD2 3.32Å; C708-D711 WeakPolarHBondContact CB-OD2 3.41Å; C708-D711 PolarHBondContact O-N 3.07Å; C708-D711 VanDerWaalsContact O-N 3.09Å; C708-V712 WeakPolarHBondContact O-CG2 3.49Å; C708-V712 PolarHBondContact O-N 2.74Å
709	I	95.6	Very high	95.4	Very high	12 Å²	12	22.5 Å²	22.5	6%	0.062	13%	0.128	C	C	.	.	H	α-helix	trans	-56.5	-40	-176.2	-64.9	169.1	0	0	0	111.4	A707 D711 V712 V713 F735 I737 L740 H750 L754	A707-I709 PolarHBondContact O-N 3.38Å; I709-D711 PolarHBondContact O-N 3.09Å; I709-V712 PolarHBondContact O-N 2.87Å; I709-V713 HydrophobicContact CG2-CG2 4.24Å; I709-V713 VanDerWaalsContact O-CG2 3.31Å; I709-V713 WeakPolarHBondContact O-CG2 3.5Å; I709-V713 PolarHBondContact O-N 2.86Å; I709-F735 HydrophobicContact CG1-CZ 4.12Å; I709-I737 HydrophobicContact CD1-CG2 4.18Å; I709-I737 HydrophobicContact CG1-CG2 4.03Å; I709-L740 HydrophobicContact CD1-CD1 4.4Å; I709-L740 HydrophobicContact CD1-CD2 4.39Å; I709-H750 HydrophobicContact CB-CB 3.78Å; I709-H750 HydrophobicContact CG2-CB 3.85Å; I709-H750 WeakPolarHBondContact CG2-O 3.48Å; I709-L754 HydrophobicContact CD1-CD2 4.4Å; I709-L754 HydrophobicContact CG1-CD2 4.49Å; I709-L754 HydrophobicContact CG2-CB 3.82Å; I709-L754 HydrophobicContact CG2-CD1 4.47Å; I709-L754 HydrophobicContact CG2-CD2 4Å; I709-L754 HydrophobicContact CG2-CG 4.32Å
710	A	94.8	Very high	95.1	Very high	7 Å²	7	23.5 Å²	23.5	6%	0.058	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-41.7	178.3	0	0	0	0	0	113.2	I185 C708 V712 T714	I185-A710 HydrophobicContact CB-CB 4.07Å; I185-A710 HydrophobicContact CG1-CB 4.44Å; I185-A710 HydrophobicContact CG2-CB 4.09Å; C708-A710 VanDerWaalsContact C-N 3.26Å; C708-A710 PolarHBondContact O-N 3.21Å; A710-V712 VanDerWaalsContact C-N 3.33Å; A710-T714 WeakPolarHBondContact O-CB 3.41Å; A710-T714 PolarHBondContact O-N 3.15Å; A710-T714 PolarHBondContact O-OG1 2.93Å
711	D	95.6	Very high	94.8	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.011	13%	0.13	C	C	.	.	H	α-helix	trans	-67.7	-38.4	179.5	-59.9	-21.2	0	0	0	110.3	G183 D184 I185 I690 C708 I709 T714 L715	G183-D711 WeakPolarHBondContact CA-OD2 3.32Å; D184-D711 VanDerWaalsContact N-CG 3.35Å; D184-D711 PolarHBondContact N-OD1 3.17Å; D184-D711 VanDerWaalsContact N-OD1 3.1Å; D184-D711 PolarHBondContact N-OD2 3Å; I185-D711 WeakPolarHBondContact CB-OD1 3.39Å; I185-D711 VanDerWaalsContact CG1-OD1 3.3Å; I185-D711 WeakPolarHBondContact CG1-OD1 3.36Å; I185-D711 PolarHBondContact N-OD1 2.86Å; I690-D711 HydrophobicContact CG1-CB 4.35Å; C708-D711 HydrophobicContact CB-CB 4.2Å; C708-D711 VanDerWaalsContact CB-OD2 3.32Å; C708-D711 WeakPolarHBondContact CB-OD2 3.41Å; C708-D711 PolarHBondContact O-N 3.07Å; C708-D711 VanDerWaalsContact O-N 3.09Å; I709-D711 PolarHBondContact O-N 3.09Å; D711-T714 PolarHBondContact O-N 3.19Å; D711-L715 WeakPolarHBondContact O-CB 3.12Å; D711-L715 PolarHBondContact O-N 2.88Å
712	V	96.8	Very high	94.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.5	-47.1	176.6	174.6	0	0	0	0	111.9	L693 Y705 A707 C708 I709 A710 T714 L715 W716 F735	L693-V712 HydrophobicContact CD2-CG2 3.98Å; Y705-V712 HydrophobicContact CE2-CG1 4.41Å; Y705-V712 HydrophobicContact CE2-CG2 3.95Å; A707-V712 HydrophobicContact CB-CG2 3.7Å; C708-V712 WeakPolarHBondContact O-CG2 3.49Å; C708-V712 PolarHBondContact O-N 2.74Å; I709-V712 PolarHBondContact O-N 2.87Å; A710-V712 VanDerWaalsContact C-N 3.33Å; V712-T714 VanDerWaalsContact C-N 3.29Å; V712-T714 PolarHBondContact O-N 3.02Å; V712-L715 WeakPolarHBondContact O-CB 3.43Å; V712-L715 PolarHBondContact O-N 3.03Å; V712-W716 HydrophobicContact CG1-CD2 4.14Å; V712-W716 VanDerWaalsContact CG1-CE2 3.43Å; V712-W716 HydrophobicContact CG1-CH2 4.23Å; V712-W716 HydrophobicContact CG1-CZ2 3.48Å; V712-W716 VanDerWaalsContact CG1-CZ2 3.48Å; V712-W716 VanDerWaalsContact O-CG 3.31Å; V712-W716 PolarHBondContact O-N 2.75Å; V712-F735 HydrophobicContact CB-CE2 4.25Å; V712-F735 HydrophobicContact CB-CZ 4.19Å; V712-F735 HydrophobicContact CG1-CD1 4Å; V712-F735 HydrophobicContact CG1-CD2 4.04Å; V712-F735 HydrophobicContact CG1-CE1 4.03Å; V712-F735 HydrophobicContact CG1-CE2 4.11Å; V712-F735 HydrophobicContact CG1-CG 4Å; V712-F735 HydrophobicContact CG1-CZ 4.08Å; V712-F735 HydrophobicContact CG2-CD2 4.09Å; V712-F735 HydrophobicContact CG2-CE2 3.67Å; V712-F735 HydrophobicContact CG2-CZ 4.04Å
713	V	95.3	Very high	94	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-40.5	177.3	170.8	0	0	0	0	110.5	I709 L715 W716 E717 R753 L754 I757	I709-V713 HydrophobicContact CG2-CG2 4.24Å; I709-V713 VanDerWaalsContact O-CG2 3.31Å; I709-V713 WeakPolarHBondContact O-CG2 3.5Å; I709-V713 PolarHBondContact O-N 2.86Å; V713-L715 PolarHBondContact O-N 3.34Å; V713-W716 HydrophobicContact CG2-CE3 4.38Å; V713-W716 HydrophobicContact CG2-CZ3 4.46Å; V713-W716 WeakPolarHBondContact O-CB 3.34Å; V713-W716 PolarHBondContact O-N 3.46Å; V713-E717 WeakPolarHBondContact O-CG 3.49Å; V713-E717 PolarHBondContact O-N 3.23Å; V713-R753 HydrophobicContact CG1-CG 4.4Å; V713-L754 HydrophobicContact CG2-CD1 4.05Å; V713-I757 HydrophobicContact CB-CD1 4.5Å; V713-I757 HydrophobicContact CG1-CD1 3.63Å; V713-I757 HydrophobicContact CG2-CD1 4.01Å
714	T	95.2	Very high	93.7	Very high	26 Å²	26	35.5 Å²	35.5	16%	0.16	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-39.8	175.9	-51	0	0	0	0	111.7	I185 I690 A710 D711 V712 W716 E717 E718	I185-T714 HydrophobicContact CD1-CG2 4.06Å; I185-T714 WeakPolarHBondContact CG1-OG1 3.05Å; I690-T714 HydrophobicContact CD1-CG2 3.67Å; A710-T714 WeakPolarHBondContact O-CB 3.41Å; A710-T714 PolarHBondContact O-N 3.15Å; A710-T714 PolarHBondContact O-OG1 2.93Å; D711-T714 PolarHBondContact O-N 3.19Å; V712-T714 VanDerWaalsContact C-N 3.29Å; V712-T714 PolarHBondContact O-N 3.02Å; T714-W716 VanDerWaalsContact C-N 3.32Å; T714-W716 PolarHBondContact O-N 3.04Å; T714-E717 PolarHBondContact O-N 3.03Å; T714-E718 WeakPolarHBondContact O-CG 3.41Å; T714-E718 PolarHBondContact O-N 3.23Å
715	L	95.8	Very high	93.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.6	-45.8	172.5	173.8	60.8	0	0	0	111.2	I690 L693 R694 D711 V712 V713 E717 E718 L719	I690-L715 HydrophobicContact CG2-CB 4.1Å; I690-L715 HydrophobicContact CG2-CD1 4.27Å; L693-L715 HydrophobicContact CD2-CD2 3.96Å; L693-L715 HydrophobicContact CG-CD2 3.92Å; R694-L715 HydrophobicContact CB-CD1 3.67Å; R694-L715 HydrophobicContact CG-CD1 3.87Å; D711-L715 WeakPolarHBondContact O-CB 3.12Å; D711-L715 PolarHBondContact O-N 2.88Å; V712-L715 WeakPolarHBondContact O-CB 3.43Å; V712-L715 PolarHBondContact O-N 3.03Å; V713-L715 PolarHBondContact O-N 3.34Å; L715-E717 VanDerWaalsContact C-N 3.32Å; L715-E717 PolarHBondContact O-N 3.5Å; L715-E718 PolarHBondContact O-N 3.18Å; L715-L719 HydrophobicContact CD1-CD1 4.03Å; L715-L719 HydrophobicContact CD1-CD2 4.46Å; L715-L719 HydrophobicContact CD1-CG 4.01Å; L715-L719 HydrophobicContact CG-CD1 4.01Å; L715-L719 HydrophobicContact CG-CG 4.41Å; L715-L719 VanDerWaalsContact O-CG 3.29Å; L715-L719 WeakPolarHBondContact O-CG 3.36Å; L715-L719 PolarHBondContact O-N 3.18Å
716	W	94.7	Very high	92.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-42.5	178.1	-63	-13.7	0	0	0	112	V712 V713 T714 L719 E720 L728 V732 F735 L754 L763 V778	V712-W716 HydrophobicContact CG1-CD2 4.14Å; V712-W716 VanDerWaalsContact CG1-CE2 3.43Å; V712-W716 HydrophobicContact CG1-CH2 4.23Å; V712-W716 HydrophobicContact CG1-CZ2 3.48Å; V712-W716 VanDerWaalsContact CG1-CZ2 3.48Å; V712-W716 VanDerWaalsContact O-CG 3.31Å; V712-W716 PolarHBondContact O-N 2.75Å; V713-W716 HydrophobicContact CG2-CE3 4.38Å; V713-W716 HydrophobicContact CG2-CZ3 4.46Å; V713-W716 WeakPolarHBondContact O-CB 3.34Å; V713-W716 PolarHBondContact O-N 3.46Å; T714-W716 VanDerWaalsContact C-N 3.32Å; T714-W716 PolarHBondContact O-N 3.04Å; W716-L719 PolarHBondContact O-N 3.01Å; W716-E720 WeakPolarHBondContact O-CB 3.45Å; W716-E720 PolarHBondContact O-N 3.27Å; W716-L728 HydrophobicContact CB-CD1 3.67Å; W716-L728 HydrophobicContact CG-CD1 3.94Å; W716-V732 HydrophobicContact CD2-CG2 3.79Å; W716-V732 HydrophobicContact CE3-CG2 4.23Å; W716-V732 HydrophobicContact CG-CG2 4.19Å; W716-V732 HydrophobicContact CH2-CG2 4.31Å; W716-V732 HydrophobicContact CZ2-CB 4.28Å; W716-V732 HydrophobicContact CZ2-CG2 3.89Å; W716-V732 HydrophobicContact CZ3-CG2 4.46Å; W716-F735 AromaticContact CH2-CD1 3.8Å; W716-F735 HydrophobicContact CH2-CD1 3.8Å; W716-F735 HydrophobicContact CH2-CE1 4.37Å; W716-F735 HydrophobicContact CZ2-CB 4.02Å; W716-F735 AromaticContact CZ2-CD1 3.71Å; W716-F735 HydrophobicContact CZ2-CD1 3.71Å; W716-F735 HydrophobicContact CZ2-CG 4.1Å; W716-L754 HydrophobicContact CH2-CD1 3.84Å; W716-L754 HydrophobicContact CZ3-CD1 3.62Å; W716-L763 HydrophobicContact CB-CD1 4.31Å; W716-L763 HydrophobicContact CB-CD2 4.1Å; W716-L763 HydrophobicContact CE3-CD2 3.81Å; W716-V778 HydrophobicContact CH2-CG1 3.91Å; W716-V778 HydrophobicContact CZ3-CG1 4.36Å; W716-V778 HydrophobicContact CZ3-CG2 4.37Å
717	E	92.6	Very high	92.7	Very high	31 Å²	31	40.2 Å²	40.2	15%	0.145	21%	0.21	C	C	.	.	H	α-helix	trans	-64.7	-37.6	175.3	-70	169.9	-169.9	0	0	112.8	V713 T714 L715 K721 R753	V713-E717 WeakPolarHBondContact O-CG 3.49Å; V713-E717 PolarHBondContact O-N 3.23Å; T714-E717 PolarHBondContact O-N 3.03Å; L715-E717 VanDerWaalsContact C-N 3.32Å; L715-E717 PolarHBondContact O-N 3.5Å; E717-K721 WeakPolarHBondContact O-CB 3.28Å; E717-K721 WeakPolarHBondContact O-CD 3.49Å; E717-K721 WeakPolarHBondContact O-CG 3.32Å; E717-K721 PolarHBondContact O-N 2.87Å; E717-R753 IonicContact OE1-CZ 3.19Å; E717-R753 IonicContact OE1-NE 3.84Å; E717-R753 IonicContact OE1-NH2 3.84Å; E717-R753 PolarHBondContact OE1-NH2 2.98Å; E717-R753 IonicContact OE2-NH2 2.86Å; E717-R753 PolarHBondContact OE2-NH2 3.37Å
718	E	92.9	Very high	92.6	Very high	63 Å²	63	40.7 Å²	40.7	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-66.6	-39.3	174.3	-74.8	-171.4	173.6	0	0	112.4	T714 L715 R722	T714-E718 WeakPolarHBondContact O-CG 3.41Å; T714-E718 PolarHBondContact O-N 3.23Å; L715-E718 PolarHBondContact O-N 3.18Å; E718-R722 WeakPolarHBondContact O-CB 3.44Å; E718-R722 VanDerWaalsContact O-CG 3.29Å; E718-R722 WeakPolarHBondContact O-CG 3.41Å; E718-R722 PolarHBondContact O-N 3.28Å; E718-R722 VanDerWaalsContact O-N 3.1Å
719	L	92.6	Very high	92.5	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-69.6	-40	177.4	-66.6	173.5	0	0	0	111.5	R694 L715 W716 R722 S723 D724 L727 L728 A731	R694-L719 HydrophobicContact CG-CD2 4.46Å; L715-L719 HydrophobicContact CD1-CD1 4.03Å; L715-L719 HydrophobicContact CD1-CD2 4.46Å; L715-L719 HydrophobicContact CD1-CG 4.01Å; L715-L719 HydrophobicContact CG-CD1 4.01Å; L715-L719 HydrophobicContact CG-CG 4.41Å; L715-L719 VanDerWaalsContact O-CG 3.29Å; L715-L719 WeakPolarHBondContact O-CG 3.36Å; L715-L719 PolarHBondContact O-N 3.18Å; W716-L719 PolarHBondContact O-N 3.01Å; L719-R722 CarbonylContact O-C 3.49Å; L719-R722 PolarHBondContact O-N 2.94Å; L719-S723 PolarHBondContact O-N 3.35Å; L719-S723 VanDerWaalsContact O-N 3.07Å; L719-D724 HydrophobicContact CD2-CB 4.12Å; L719-D724 PolarHBondContact O-N 3.18Å; L719-L727 HydrophobicContact CD1-CB 4.46Å; L719-L727 HydrophobicContact CD1-CD2 4.39Å; L719-L727 HydrophobicContact CD1-CG 4Å; L719-L727 HydrophobicContact CD2-CB 4.41Å; L719-L727 HydrophobicContact CD2-CD2 3.75Å; L719-L727 HydrophobicContact CD2-CG 4.14Å; L719-L728 HydrophobicContact CB-CB 4.11Å; L719-L728 HydrophobicContact CB-CD1 4.32Å; L719-L728 HydrophobicContact CD1-CB 4.44Å; L719-A731 HydrophobicContact CD1-CB 4.38Å
720	E	89.8	Confident	92.3	Very high	36 Å²	36	48.7 Å²	48.7	17%	0.168	25%	0.247	C	C	.	.	H	α-helix	trans	-59.3	-48.8	172.8	-176.2	179.6	-141.1	0	0	110.7	W716 R722 S723 L728 L763 S764 S767 S770	W716-E720 WeakPolarHBondContact O-CB 3.45Å; W716-E720 PolarHBondContact O-N 3.27Å; E720-R722 PolarHBondContact O-N 2.77Å; E720-S723 PolarHBondContact O-N 3.42Å; E720-L728 HydrophobicContact CB-CD2 4.32Å; E720-L763 HydrophobicContact CB-CD1 4.49Å; E720-S764 PolarHBondContact OE2-OG 2.95Å; E720-S767 WeakPolarHBondContact OE1-CB 3.15Å; E720-S767 PolarHBondContact OE1-OG 3.17Å; E720-S770 WeakPolarHBondContact OE1-CB 3.49Å
721	K	90.1	Very high	92.3	Very high	161 Å²	161	48.4 Å²	48.4	70%	0.7	24%	0.244	S	C	*	.	H	α-helix	trans	-61.5	-29.3	177.9	-74.4	168.5	-173.5	168	0	113.6	E717	E717-K721 WeakPolarHBondContact O-CB 3.28Å; E717-K721 WeakPolarHBondContact O-CD 3.49Å; E717-K721 WeakPolarHBondContact O-CG 3.32Å; E717-K721 PolarHBondContact O-N 2.87Å
722	R	89.4	Confident	92.3	Very high	146 Å²	146	48.6 Å²	48.6	55%	0.551	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.9	177.7	-71	178	-177	177.8	7.5	113.4	E718 L719 E720 D724	E718-R722 WeakPolarHBondContact O-CB 3.44Å; E718-R722 VanDerWaalsContact O-CG 3.29Å; E718-R722 WeakPolarHBondContact O-CG 3.41Å; E718-R722 PolarHBondContact O-N 3.28Å; E718-R722 VanDerWaalsContact O-N 3.1Å; L719-R722 CarbonylContact O-C 3.49Å; L719-R722 PolarHBondContact O-N 2.94Å; E720-R722 PolarHBondContact O-N 2.77Å; R722-D724 PolarHBondContact O-N 2.92Å
723	S	87	Confident	92.2	Very high	93 Å²	93	51.4 Å²	51.4	65%	0.65	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	35	-174.9	-51	0	0	0	0	113.5	L719 E720 E725	L719-S723 PolarHBondContact O-N 3.35Å; L719-S723 VanDerWaalsContact O-N 3.07Å; E720-S723 PolarHBondContact O-N 3.42Å; S723-E725 PolarHBondContact O-N 3.09Å
724	D	89.3	Confident	92.2	Very high	62 Å²	62	52.5 Å²	52.5	33%	0.332	27%	0.27	S	S	.	.			trans	-93	69.4	176.4	-167.8	-9.4	0	0	0	110.3	L719 R722 G726 L727 L728	L719-D724 HydrophobicContact CD2-CB 4.12Å; L719-D724 PolarHBondContact O-N 3.18Å; R722-D724 PolarHBondContact O-N 2.92Å; D724-G726 PolarHBondContact O-N 3.42Å; D724-L727 PolarHBondContact O-N 3.2Å; D724-L727 WeakPolarHBondContact OD1-CB 3.29Å; D724-L727 PolarHBondContact OD1-N 2.89Å; D724-L728 WeakPolarHBondContact O-CB 3.39Å; D724-L728 PolarHBondContact O-N 3.12Å
725	E	86.4	Confident	92.3	Very high	115 Å²	115	51.3 Å²	51.3	54%	0.537	26%	0.262	S	S	.	.	H	α-helix	trans	-65	-36.1	-171.5	-65.6	-160.2	166.4	0	0	113.4	S723 L728 Q729	S723-E725 PolarHBondContact O-N 3.09Å; E725-L728 PolarHBondContact O-N 3.38Å; E725-Q729 WeakPolarHBondContact O-CB 3.06Å; E725-Q729 PolarHBondContact O-N 3.1Å
726	G	90.3	Very high	92.4	Very high	44 Å²	44	53.6 Å²	53.6	45%	0.454	27%	0.273	S	S	.	.	H	α-helix	trans	-62.3	-49.3	179.6	0	0	0	0	0	111.5	D724 L728 Q729 E730	D724-G726 PolarHBondContact O-N 3.42Å; G726-L728 VanDerWaalsContact C-N 3.34Å; G726-L728 PolarHBondContact O-N 3.1Å; G726-Q729 PolarHBondContact O-N 3.14Å; G726-E730 PolarHBondContact O-N 3.11Å; G726-E730 VanDerWaalsContact O-N 3.08Å
727	L	93.1	Very high	92.4	Very high	19 Å²	19	53.7 Å²	53.7	10%	0.099	27%	0.273	C	S	.	.	H	α-helix	trans	-69.3	-33.9	177.9	-173.9	56.4	0	0	0	112	R694 V697 A698 L719 D724 E730 A731	R694-L727 HydrophobicContact CG-CD2 4.02Å; V697-L727 HydrophobicContact CG1-CD1 4.47Å; A698-L727 VanDerWaalsContact CA-CD1 3.5Å; A698-L727 HydrophobicContact CB-CD1 3.75Å; A698-L727 HydrophobicContact CB-CD2 4.05Å; L719-L727 HydrophobicContact CD1-CB 4.46Å; L719-L727 HydrophobicContact CD1-CD2 4.39Å; L719-L727 HydrophobicContact CD1-CG 4Å; L719-L727 HydrophobicContact CD2-CB 4.41Å; L719-L727 HydrophobicContact CD2-CD2 3.75Å; L719-L727 HydrophobicContact CD2-CG 4.14Å; D724-L727 PolarHBondContact O-N 3.2Å; D724-L727 WeakPolarHBondContact OD1-CB 3.29Å; D724-L727 PolarHBondContact OD1-N 2.89Å; L727-E730 PolarHBondContact O-N 3.04Å; L727-A731 VanDerWaalsContact O-CB 3.23Å; L727-A731 WeakPolarHBondContact O-CB 3.18Å; L727-A731 PolarHBondContact O-N 2.89Å
728	L	93.4	Very high	92.2	Very high	11 Å²	11	55.8 Å²	55.8	6%	0.058	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-45.8	174.3	178.5	59.4	0	0	0	111.6	W716 L719 E720 D724 E725 G726 A731 V732 L763 L773	W716-L728 HydrophobicContact CB-CD1 3.67Å; W716-L728 HydrophobicContact CG-CD1 3.94Å; L719-L728 HydrophobicContact CB-CB 4.11Å; L719-L728 HydrophobicContact CB-CD1 4.32Å; L719-L728 HydrophobicContact CD1-CB 4.44Å; E720-L728 HydrophobicContact CB-CD2 4.32Å; D724-L728 WeakPolarHBondContact O-CB 3.39Å; D724-L728 PolarHBondContact O-N 3.12Å; E725-L728 PolarHBondContact O-N 3.38Å; G726-L728 VanDerWaalsContact C-N 3.34Å; G726-L728 PolarHBondContact O-N 3.1Å; L728-A731 PolarHBondContact O-N 2.97Å; L728-V732 HydrophobicContact CD1-CG2 4.11Å; L728-V732 WeakPolarHBondContact O-CG2 3.38Å; L728-V732 PolarHBondContact O-N 2.97Å; L728-L763 HydrophobicContact CD1-CD1 4.09Å; L728-L763 HydrophobicContact CD2-CD1 4Å; L728-L773 HydrophobicContact CD2-CD1 4.36Å; L728-L773 HydrophobicContact CG-CD1 4.17Å
729	Q	91.6	Very high	91.9	Very high	126 Å²	126	55.7 Å²	55.7	59%	0.589	29%	0.288	S	S	*	.	H	α-helix	trans	-62.9	-44.1	177.8	-171.4	-179.6	0.4	0	0	111.7	E725 G726 S733 L773	E725-Q729 WeakPolarHBondContact O-CB 3.06Å; E725-Q729 PolarHBondContact O-N 3.1Å; G726-Q729 PolarHBondContact O-N 3.14Å; Q729-S733 WeakPolarHBondContact O-CB 3.39Å; Q729-S733 PolarHBondContact O-N 3.28Å; Q729-S733 PolarHBondContact O-OG 3.33Å; Q729-L773 HydrophobicContact CB-CD1 3.72Å; Q729-L773 HydrophobicContact CG-CD1 4.22Å
730	E	92.3	Very high	91.9	Very high	78 Å²	78	56.1 Å²	56.1	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-62.9	-43.6	174.4	-72.9	-164.9	-172.5	0	0	112	G726 L727 S733 K734	G726-E730 PolarHBondContact O-N 3.11Å; G726-E730 VanDerWaalsContact O-N 3.08Å; L727-E730 PolarHBondContact O-N 3.04Å; E730-S733 WeakPolarHBondContact CA-OG 3.4Å; E730-S733 PolarHBondContact O-N 3Å; E730-S733 PolarHBondContact O-OG 3.19Å; E730-S733 VanDerWaalsContact O-OG 3.09Å; E730-K734 HydrophobicContact CB-CD 4.28Å; E730-K734 VanDerWaalsContact O-CB 3.26Å; E730-K734 WeakPolarHBondContact O-CB 3.29Å; E730-K734 WeakPolarHBondContact O-CD 3.44Å; E730-K734 WeakPolarHBondContact O-CG 3.36Å; E730-K734 PolarHBondContact O-N 3.37Å; E730-K734 IonicContact OE2-NZ 2.67Å; E730-K734 PolarHBondContact OE2-NZ 3.23Å
731	A	95	Very high	92	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-47.6	178.8	0	0	0	0	0	111.6	V697 Y705 L719 L727 L728 S733 F735	V697-A731 HydrophobicContact CG1-CB 3.8Å; Y705-A731 VanDerWaalsContact CE1-O 3.24Å; Y705-A731 WeakPolarHBondContact CE1-O 3.37Å; Y705-A731 PolarHBondContact OH-O 3.08Å; L719-A731 HydrophobicContact CD1-CB 4.38Å; L727-A731 VanDerWaalsContact O-CB 3.23Å; L727-A731 WeakPolarHBondContact O-CB 3.18Å; L727-A731 PolarHBondContact O-N 2.89Å; L728-A731 PolarHBondContact O-N 2.97Å; A731-S733 PolarHBondContact O-N 2.99Å; A731-F735 WeakPolarHBondContact O-CB 3.42Å; A731-F735 PolarHBondContact O-N 3.2Å
732	V	95	Very high	92	Very high	6 Å²	6	51.1 Å²	51.1	4%	0.036	27%	0.267	C	S	.	.	H	α-helix	trans	-64.7	-42.3	179.6	172.7	0	0	0	0	111.8	W716 L728 L773 L774	W716-V732 HydrophobicContact CD2-CG2 3.79Å; W716-V732 HydrophobicContact CE3-CG2 4.23Å; W716-V732 HydrophobicContact CG-CG2 4.19Å; W716-V732 HydrophobicContact CH2-CG2 4.31Å; W716-V732 HydrophobicContact CZ2-CB 4.28Å; W716-V732 HydrophobicContact CZ2-CG2 3.89Å; W716-V732 HydrophobicContact CZ3-CG2 4.46Å; L728-V732 HydrophobicContact CD1-CG2 4.11Å; L728-V732 WeakPolarHBondContact O-CG2 3.38Å; L728-V732 PolarHBondContact O-N 2.97Å; V732-L773 HydrophobicContact CB-CD2 4.31Å; V732-L773 HydrophobicContact CG1-CD2 4.38Å; V732-L773 HydrophobicContact CG2-CD2 4.06Å; V732-L774 HydrophobicContact CG1-CD2 3.89Å
733	S	94.6	Very high	91.9	Very high	59 Å²	59	47.2 Å²	47.2	41%	0.413	26%	0.26	S	S	.	.	H	α-helix	trans	-72.8	-35.3	-176.2	57.9	0	0	0	0	113.7	Q729 E730 A731	Q729-S733 WeakPolarHBondContact O-CB 3.39Å; Q729-S733 PolarHBondContact O-N 3.28Å; Q729-S733 PolarHBondContact O-OG 3.33Å; E730-S733 WeakPolarHBondContact CA-OG 3.4Å; E730-S733 PolarHBondContact O-N 3Å; E730-S733 PolarHBondContact O-OG 3.19Å; E730-S733 VanDerWaalsContact O-OG 3.09Å; A731-S733 PolarHBondContact O-N 2.99Å
734	K	96.1	Very high	91.8	Very high	25 Å²	25	43.3 Å²	43.3	11%	0.109	23%	0.231	C	C	.	.	H	α-helix	trans	-82.9	-16.2	-178.9	-64	169	174.7	177.1	0	113.1	I702 N703 T704 Y705 E730	I702-K734 VanDerWaalsContact O-CD 3.25Å; I702-K734 WeakPolarHBondContact O-CD 3.48Å; I702-K734 WeakPolarHBondContact O-CE 3.43Å; I702-K734 PolarHBondContact O-NZ 3.42Å; N703-K734 WeakPolarHBondContact O-CG 3.29Å; T704-K734 CarbonylContact C-O 3.6Å; T704-K734 VanDerWaalsContact CA-O 3.22Å; T704-K734 WeakPolarHBondContact CA-O 3.35Å; Y705-K734 HydrophobicContact CD1-CB 3.81Å; Y705-K734 HydrophobicContact CE1-CB 3.93Å; Y705-K734 PolarHBondContact N-O 3.15Å; E730-K734 HydrophobicContact CB-CD 4.28Å; E730-K734 VanDerWaalsContact O-CB 3.26Å; E730-K734 WeakPolarHBondContact O-CB 3.29Å; E730-K734 WeakPolarHBondContact O-CD 3.44Å; E730-K734 WeakPolarHBondContact O-CG 3.36Å; E730-K734 PolarHBondContact O-N 3.37Å; E730-K734 IonicContact OE2-NZ 2.67Å; E730-K734 PolarHBondContact OE2-NZ 3.23Å
735	F	97.7	Very high	91.7	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-70.5	134.9	-176.6	-177.8	-129.6	0	0	0	112.8	Y705 I709 V712 W716 A731 I737 L754 A780	Y705-F735 HydrophobicContact CD2-CD2 4.05Å; Y705-F735 HydrophobicContact CE1-CB 4Å; Y705-F735 HydrophobicContact CE2-CB 4.26Å; Y705-F735 AromaticContact CE2-CD2 3.59Å; Y705-F735 HydrophobicContact CE2-CD2 3.59Å; Y705-F735 HydrophobicContact CE2-CE2 4.38Å; Y705-F735 HydrophobicContact CE2-CG 4.28Å; Y705-F735 AromaticContact CZ-CD2 3.98Å; Y705-F735 WeakPolarHBondContact O-CA 3.37Å; I709-F735 HydrophobicContact CG1-CZ 4.12Å; V712-F735 HydrophobicContact CB-CE2 4.25Å; V712-F735 HydrophobicContact CB-CZ 4.19Å; V712-F735 HydrophobicContact CG1-CD1 4Å; V712-F735 HydrophobicContact CG1-CD2 4.04Å; V712-F735 HydrophobicContact CG1-CE1 4.03Å; V712-F735 HydrophobicContact CG1-CE2 4.11Å; V712-F735 HydrophobicContact CG1-CG 4Å; V712-F735 HydrophobicContact CG1-CZ 4.08Å; V712-F735 HydrophobicContact CG2-CD2 4.09Å; V712-F735 HydrophobicContact CG2-CE2 3.67Å; V712-F735 HydrophobicContact CG2-CZ 4.04Å; W716-F735 AromaticContact CH2-CD1 3.8Å; W716-F735 HydrophobicContact CH2-CD1 3.8Å; W716-F735 HydrophobicContact CH2-CE1 4.37Å; W716-F735 HydrophobicContact CZ2-CB 4.02Å; W716-F735 AromaticContact CZ2-CD1 3.71Å; W716-F735 HydrophobicContact CZ2-CD1 3.71Å; W716-F735 HydrophobicContact CZ2-CG 4.1Å; A731-F735 WeakPolarHBondContact O-CB 3.42Å; A731-F735 PolarHBondContact O-N 3.2Å; F735-I737 HydrophobicContact CD1-CG2 4.33Å; F735-I737 HydrophobicContact CE1-CG2 3.44Å; F735-I737 VanDerWaalsContact CE1-CG2 3.44Å; F735-I737 HydrophobicContact CE2-CG2 4.1Å; F735-I737 HydrophobicContact CZ-CG2 3.3Å; F735-L754 HydrophobicContact CE1-CD1 4.5Å; F735-L754 HydrophobicContact CE1-CD2 4.06Å; F735-A780 HydrophobicContact CD1-CB 3.7Å; F735-A780 HydrophobicContact CE1-CB 4.19Å; F735-A780 HydrophobicContact CG-CB 4.41Å; F735-A780 WeakPolarHBondContact O-CB 3.38Å
736	K	96.4	Very high	91.8	Very high	49 Å²	49	37.6 Å²	37.6	21%	0.213	21%	0.207	C	C	.	.			trans	-129.4	146.8	175.9	-57.4	-63.8	180	-164.4	0	110.8	T704 Y705 R706 E783	T704-K736 HydrophobicContact CG2-CG 4.13Å; Y705-K736 PolarHBondContact O-N 3.08Å; R706-K736 HydrophobicContact CG-CB 4.17Å; R706-K736 WeakPolarHBondContact CG-O 3.43Å; K736-E783 WeakPolarHBondContact CD-OE2 3.32Å; K736-E783 VanDerWaalsContact CE-OE2 3.32Å; K736-E783 WeakPolarHBondContact CE-OE2 3.45Å; K736-E783 IonicContact NZ-OE1 3.52Å; K736-E783 PolarHBondContact NZ-OE1 3.24Å; K736-E783 IonicContact NZ-OE2 2.57Å; K736-E783 PolarHBondContact NZ-OE2 3.44Å
737	I	94.8	Very high	91.8	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.193	C	C	.	.			trans	-125.3	-3.2	174.6	60.3	174	0	0	0	113.5	I709 F735 P739 L740 L751 L754 A780 L784	I709-I737 HydrophobicContact CD1-CG2 4.18Å; I709-I737 HydrophobicContact CG1-CG2 4.03Å; F735-I737 HydrophobicContact CD1-CG2 4.33Å; F735-I737 HydrophobicContact CE1-CG2 3.44Å; F735-I737 VanDerWaalsContact CE1-CG2 3.44Å; F735-I737 HydrophobicContact CE2-CG2 4.1Å; F735-I737 HydrophobicContact CZ-CG2 3.3Å; I737-P739 CarbonylContact O-C 3.58Å; I737-L740 WeakPolarHBondContact O-CB 3.44Å; I737-L740 PolarHBondContact O-N 2.94Å; I737-L751 HydrophobicContact CD1-CD1 4.15Å; I737-L754 HydrophobicContact CD1-CD2 3.97Å; I737-L754 HydrophobicContact CG2-CD2 4.24Å; I737-A780 HydrophobicContact CG1-CB 4.19Å; I737-A780 VanDerWaalsContact CG1-O 3.31Å; I737-A780 WeakPolarHBondContact CG1-O 3.4Å; I737-A780 HydrophobicContact CG2-CB 4.37Å; I737-L784 HydrophobicContact CD1-CB 4.11Å; I737-L784 HydrophobicContact CD1-CD1 4.31Å; I737-L784 HydrophobicContact CD1-CD2 3.92Å; I737-L784 HydrophobicContact CD1-CG 4.33Å; I737-L784 HydrophobicContact CG1-CB 4.33Å; I737-L784 HydrophobicContact CG1-CD1 4.21Å
738	H	88.6	Confident	91.9	Very high	75 Å²	75	36.2 Å²	36.2	35%	0.347	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-89.4	139.1	-173.7	177.4	76.8	0	0	0	112.8	Y785	H738-Y785 PolarHBondContact ND1-N 3.1Å
739	P	87.4	Confident	91.9	Very high	62 Å²	62	38.9 Å²	38.9	40%	0.403	20%	0.201	S	C	.	.	S	Bend	cis	-71.8	147.4	-17.4	31.3	-34.5	0	0	0	111.1	R706 I737 K786	R706-P739 PolarHBondContact NH2-O 3.45Å; I737-P739 CarbonylContact O-C 3.58Å; P739-K786 HydrophobicContact CB-CB 4.11Å; P739-K786 HydrophobicContact CB-CD 4.21Å; P739-K786 HydrophobicContact CB-CG 4.41Å
740	L	92.8	Very high	92	Very high	11 Å²	11	33.4 Å²	33.4	6%	0.058	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.8	-179.8	-174.4	61.7	0	0	0	110.7	I709 I737 L751 L784 K786 L787 E788	I709-L740 HydrophobicContact CD1-CD1 4.4Å; I709-L740 HydrophobicContact CD1-CD2 4.39Å; I737-L740 WeakPolarHBondContact O-CB 3.44Å; I737-L740 PolarHBondContact O-N 2.94Å; L740-L751 HydrophobicContact CD2-CB 4.39Å; L740-L751 HydrophobicContact CD2-CD1 3.79Å; L740-L751 HydrophobicContact CD2-CD2 3.71Å; L740-L751 HydrophobicContact CD2-CG 4.17Å; L740-L784 HydrophobicContact CB-CD1 3.64Å; L740-L784 HydrophobicContact CD2-CD2 4.33Å; L740-K786 PolarHBondContact N-O 3.33Å; L740-K786 VanDerWaalsContact N-O 3.09Å; L740-L787 HydrophobicContact CB-CD1 4.14Å; L740-L787 HydrophobicContact CD2-CD1 3.95Å; L740-L787 HydrophobicContact CG-CD1 4.02Å; L740-L787 WeakPolarHBondContact O-CA 3.45Å; L740-E788 PolarHBondContact O-N 3.4Å
741	K	91.3	Very high	92.2	Very high	91 Å²	91	29.7 Å²	29.7	40%	0.396	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	109.8	175.4	-172.3	172.3	178.7	156.7	0	110.1	T743 H747 E788 E790	K741-T743 HydrophobicContact CD-CG2 4.42Å; K741-T743 HydrophobicContact CG-CG2 4.06Å; K741-T743 PolarHBondContact O-N 3.2Å; K741-H747 PolarHBondContact O-ND1 3.02Å; K741-E788 CarbonylContact C-O 3.23Å; K741-E788 WeakPolarHBondContact CA-O 3.47Å; K741-E788 HydrophobicContact CB-CB 4.45Å; K741-E788 HydrophobicContact CG-CB 4.15Å; K741-E790 WeakPolarHBondContact CE-OE2 2.77Å; K741-E790 IonicContact NZ-OE2 2.85Å; K741-E790 PolarHBondContact NZ-OE2 3.23Å
742	A	90.9	Very high	92.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	101.9	178.3	0	0	0	0	0	109.9	H747 I748 E788 E790	A742-H747 HydrophobicContact CB-CB 4.1Å; A742-I748 HydrophobicContact CB-CD1 3.46Å; A742-I748 VanDerWaalsContact CB-CD1 3.46Å; A742-I748 HydrophobicContact CB-CG1 4.07Å; A742-E788 PolarHBondContact N-O 3.24Å; A742-E790 CarbonylContact O-C 3.33Å; A742-E790 PolarHBondContact O-N 3.22Å
743	T	86.3	Confident	92.2	Very high	64 Å²	64	38.2 Å²	38.2	39%	0.393	19%	0.192	S	C	.	.			trans	-101.7	-15.1	177.1	55.2	0	0	0	0	112.7	K741 H747 L791	K741-T743 HydrophobicContact CD-CG2 4.42Å; K741-T743 HydrophobicContact CG-CG2 4.06Å; K741-T743 PolarHBondContact O-N 3.2Å; T743-H747 PolarHBondContact N-ND1 3.26Å; T743-H747 PolarHBondContact OG1-CE1 3.05Å; T743-L791 WeakPolarHBondContact O-CD2 3.36Å
744	Q	84.9	Confident	92.3	Very high	12 Å²	12	35.4 Å²	35.4	6%	0.056	17%	0.172	C	C	.	.	S	Bend	trans	-128.9	153.4	-179.1	-63	-172.3	-42.8	0	0	111.2	E163 I180 C746 H747	E163-Q744 PolarHBondContact OE2-NE2 3.45Å; I180-Q744 HydrophobicContact CD1-CG 4.49Å; I180-Q744 VanDerWaalsContact CD1-NE2 3.28Å; Q744-C746 VanDerWaalsContact C-N 3.27Å; Q744-C746 PolarHBondContact O-N 3.46Å; Q744-H747 WeakPolarHBondContact O-CB 3.35Å; Q744-H747 PolarHBondContact O-N 2.68Å; Q744-H747 VanDerWaalsContact O-N 3.11Å
745	V	87.1	Confident	92.2	Very high	34 Å²	34	34.5 Å²	34.5	21%	0.206	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-41.9	-179.6	176.1	0	0	0	0	109.9	H747 I748 E749 L791 N795 L798 A799	V745-H747 PolarHBondContact O-N 3.04Å; V745-I748 PolarHBondContact O-N 3.07Å; V745-E749 PolarHBondContact O-N 2.86Å; V745-L791 HydrophobicContact CG2-CD2 3.99Å; V745-N795 HydrophobicContact CG2-CB 3.91Å; V745-L798 HydrophobicContact CG1-CB 4.45Å; V745-A799 HydrophobicContact CG1-CB 4.2Å; V745-A799 HydrophobicContact CG2-CB 4.46Å
746	C	87.8	Confident	92	Very high	22 Å²	22	37.6 Å²	37.6	15%	0.149	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-29.7	177.8	62.5	0	0	0	0	113.1	Q744 I748 E749 H750	Q744-C746 VanDerWaalsContact C-N 3.27Å; Q744-C746 PolarHBondContact O-N 3.46Å; C746-I748 PolarHBondContact O-N 3.01Å; C746-E749 PolarHBondContact O-N 3.35Å; C746-E749 VanDerWaalsContact O-N 3.14Å; C746-H750 WeakPolarHBondContact O-CB 3.36Å; C746-H750 PolarHBondContact O-CD2 3.09Å; C746-H750 VanDerWaalsContact O-CD2 3.25Å; C746-H750 PolarHBondContact O-N 3Å; C746-H750 PolarHBondContact O-ND1 3.35Å
747	H	91.6	Very high	91.8	Very high	33 Å²	33	35.7 Å²	35.7	15%	0.153	18%	0.182	C	C	.	.	H	α-helix	trans	-59.7	-38	176.7	-65.8	-174.1	0	0	0	111.5	K741 A742 T743 Q744 V745 L751	K741-H747 PolarHBondContact O-ND1 3.02Å; A742-H747 HydrophobicContact CB-CB 4.1Å; T743-H747 PolarHBondContact N-ND1 3.26Å; T743-H747 PolarHBondContact OG1-CE1 3.05Å; Q744-H747 WeakPolarHBondContact O-CB 3.35Å; Q744-H747 PolarHBondContact O-N 2.68Å; Q744-H747 VanDerWaalsContact O-N 3.11Å; V745-H747 PolarHBondContact O-N 3.04Å; H747-L751 WeakPolarHBondContact O-CB 3.44Å; H747-L751 PolarHBondContact O-N 3.27Å
748	I	94.1	Very high	91.7	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-73.2	-39.1	177.1	-59.3	-57.8	0	0	0	111	A742 V745 C746 H750 L751 E752 F789 L791 A799 K802 L803 L806	A742-I748 HydrophobicContact CB-CD1 3.46Å; A742-I748 VanDerWaalsContact CB-CD1 3.46Å; A742-I748 HydrophobicContact CB-CG1 4.07Å; V745-I748 PolarHBondContact O-N 3.07Å; C746-I748 PolarHBondContact O-N 3.01Å; I748-H750 VanDerWaalsContact C-N 3.28Å; I748-H750 PolarHBondContact O-N 2.83Å; I748-L751 PolarHBondContact O-N 3.5Å; I748-E752 VanDerWaalsContact O-CB 3.29Å; I748-E752 WeakPolarHBondContact O-CB 3.3Å; I748-E752 PolarHBondContact O-N 3.46Å; I748-F789 HydrophobicContact CD1-CD2 3.89Å; I748-F789 HydrophobicContact CD1-CE2 4.12Å; I748-F789 HydrophobicContact CG1-CD2 4.15Å; I748-F789 HydrophobicContact CG1-CE2 3.88Å; I748-L791 HydrophobicContact CG1-CD1 4.49Å; I748-A799 HydrophobicContact CB-CB 4.26Å; I748-A799 HydrophobicContact CG1-CB 4.1Å; I748-A799 HydrophobicContact CG2-CB 4.48Å; I748-K802 HydrophobicContact CG2-CB 3.93Å; I748-L803 HydrophobicContact CD1-CD1 4.4Å; I748-L803 HydrophobicContact CG2-CB 4.19Å; I748-L806 HydrophobicContact CG2-CD2 3.97Å
749	E	93.2	Very high	91.8	Very high	68 Å²	68	37 Å²	37	32%	0.318	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-36.7	174.7	-49.1	-168.6	138.9	0	0	112	V745 C746 R753 K802	V745-E749 PolarHBondContact O-N 2.86Å; C746-E749 PolarHBondContact O-N 3.35Å; C746-E749 VanDerWaalsContact O-N 3.14Å; E749-R753 PolarHBondContact O-N 2.88Å; E749-R753 VanDerWaalsContact O-N 3.08Å; E749-K802 VanDerWaalsContact CD-NZ 3.25Å; E749-K802 HydrophobicContact CG-CD 3.97Å; E749-K802 VanDerWaalsContact CG-NZ 3.33Å; E749-K802 IonicContact OE1-NZ 3.17Å; E749-K802 PolarHBondContact OE1-NZ 3.24Å
750	H	94.7	Very high	91.9	Very high	10 Å²	10	36.7 Å²	36.7	5%	0.046	19%	0.194	C	C	.	.	H	α-helix	trans	-73	-41.4	177.6	-56.8	160.9	0	0	0	111.4	D186 I709 C746 I748 E752 R753 L754	D186-H750 IonicContact OD1-CE1 3.83Å; D186-H750 PolarHBondContact OD1-CE1 2.67Å; D186-H750 VanDerWaalsContact OD1-CE1 3.28Å; D186-H750 IonicContact OD1-NE2 2.71Å; D186-H750 PolarHBondContact OD1-NE2 3.08Å; D186-H750 IonicContact OD2-CE1 3.43Å; D186-H750 PolarHBondContact OD2-CE1 3.4Å; I709-H750 HydrophobicContact CB-CB 3.78Å; I709-H750 HydrophobicContact CG2-CB 3.85Å; I709-H750 WeakPolarHBondContact CG2-O 3.48Å; C746-H750 WeakPolarHBondContact O-CB 3.36Å; C746-H750 PolarHBondContact O-CD2 3.09Å; C746-H750 VanDerWaalsContact O-CD2 3.25Å; C746-H750 PolarHBondContact O-N 3Å; C746-H750 PolarHBondContact O-ND1 3.35Å; I748-H750 VanDerWaalsContact C-N 3.28Å; I748-H750 PolarHBondContact O-N 2.83Å; H750-E752 VanDerWaalsContact C-N 3.33Å; H750-R753 PolarHBondContact O-N 2.88Å; H750-L754 PolarHBondContact O-N 2.98Å
751	L	96.3	Very high	91.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-43.1	173.3	-177.4	62.8	0	0	0	111.2	I737 L740 H747 I748 R753 L754 V755 L784 L787 L806 L810	I737-L751 HydrophobicContact CD1-CD1 4.15Å; L740-L751 HydrophobicContact CD2-CB 4.39Å; L740-L751 HydrophobicContact CD2-CD1 3.79Å; L740-L751 HydrophobicContact CD2-CD2 3.71Å; L740-L751 HydrophobicContact CD2-CG 4.17Å; H747-L751 WeakPolarHBondContact O-CB 3.44Å; H747-L751 PolarHBondContact O-N 3.27Å; I748-L751 PolarHBondContact O-N 3.5Å; L751-R753 VanDerWaalsContact C-N 3.34Å; L751-R753 PolarHBondContact O-N 2.98Å; L751-L754 PolarHBondContact O-N 3Å; L751-L754 VanDerWaalsContact O-N 3.17Å; L751-V755 HydrophobicContact CD1-CG2 4.16Å; L751-V755 HydrophobicContact CG-CG2 4.27Å; L751-V755 WeakPolarHBondContact O-CB 3.2Å; L751-V755 VanDerWaalsContact O-CG2 3.28Å; L751-V755 WeakPolarHBondContact O-CG2 3.04Å; L751-V755 PolarHBondContact O-N 2.86Å; L751-L784 HydrophobicContact CD1-CD2 4.17Å; L751-L787 HydrophobicContact CD2-CD1 4.31Å; L751-L787 HydrophobicContact CD2-CD2 4.18Å; L751-L806 HydrophobicContact CB-CD2 4.32Å; L751-L806 HydrophobicContact CD2-CD1 3.82Å; L751-L806 HydrophobicContact CD2-CD2 4.15Å; L751-L806 HydrophobicContact CG-CD1 4.16Å; L751-L806 HydrophobicContact CG-CD2 4.16Å; L751-L810 HydrophobicContact CD2-CD1 4.41Å
752	E	95.4	Very high	91.4	Very high	63 Å²	63	41.4 Å²	41.4	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-55.2	-48.9	174.6	177.6	-173.3	-155.2	0	0	110.8	I748 H750 L754 V755 S756 K802 L806	I748-E752 VanDerWaalsContact O-CB 3.29Å; I748-E752 WeakPolarHBondContact O-CB 3.3Å; I748-E752 PolarHBondContact O-N 3.46Å; H750-E752 VanDerWaalsContact C-N 3.33Å; E752-L754 VanDerWaalsContact C-N 3.35Å; E752-L754 PolarHBondContact O-N 2.79Å; E752-V755 PolarHBondContact O-N 2.95Å; E752-S756 WeakPolarHBondContact O-CB 3.35Å; E752-S756 PolarHBondContact O-N 3.1Å; E752-K802 VanDerWaalsContact OE2-CD 3.28Å; E752-K802 WeakPolarHBondContact OE2-CD 3.38Å; E752-K802 IonicContact OE2-NZ 2.62Å; E752-L806 HydrophobicContact CB-CB 4.49Å; E752-L806 HydrophobicContact CB-CD2 3.96Å
753	R	94.3	Very high	90.9	Very high	123 Å²	123	42.1 Å²	42.1	46%	0.464	21%	0.214	S	C	.	.	H	α-helix	trans	-59.7	-44.3	176	-173.1	176.2	-174.3	149.1	-3.3	112.1	V713 E717 E749 H750 L751 S756 I757	V713-R753 HydrophobicContact CG1-CG 4.4Å; E717-R753 IonicContact OE1-CZ 3.19Å; E717-R753 IonicContact OE1-NE 3.84Å; E717-R753 IonicContact OE1-NH2 3.84Å; E717-R753 PolarHBondContact OE1-NH2 2.98Å; E717-R753 IonicContact OE2-NH2 2.86Å; E717-R753 PolarHBondContact OE2-NH2 3.37Å; E749-R753 PolarHBondContact O-N 2.88Å; E749-R753 VanDerWaalsContact O-N 3.08Å; H750-R753 PolarHBondContact O-N 2.88Å; L751-R753 VanDerWaalsContact C-N 3.34Å; L751-R753 PolarHBondContact O-N 2.98Å; R753-S756 WeakPolarHBondContact O-CB 3.39Å; R753-S756 PolarHBondContact O-N 3.42Å; R753-I757 HydrophobicContact CG-CD1 4.41Å; R753-I757 WeakPolarHBondContact O-CG1 3.4Å; R753-I757 PolarHBondContact O-N 2.89Å
754	L	95.8	Very high	90.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.4	-39.3	179.3	-171.9	67.4	0	0	0	112.3	I709 V713 W716 F735 I737 H750 L751 E752 I757 H758 V778 V781	I709-L754 HydrophobicContact CD1-CD2 4.4Å; I709-L754 HydrophobicContact CG1-CD2 4.49Å; I709-L754 HydrophobicContact CG2-CB 3.82Å; I709-L754 HydrophobicContact CG2-CD1 4.47Å; I709-L754 HydrophobicContact CG2-CD2 4Å; I709-L754 HydrophobicContact CG2-CG 4.32Å; V713-L754 HydrophobicContact CG2-CD1 4.05Å; W716-L754 HydrophobicContact CH2-CD1 3.84Å; W716-L754 HydrophobicContact CZ3-CD1 3.62Å; F735-L754 HydrophobicContact CE1-CD1 4.5Å; F735-L754 HydrophobicContact CE1-CD2 4.06Å; I737-L754 HydrophobicContact CD1-CD2 3.97Å; I737-L754 HydrophobicContact CG2-CD2 4.24Å; H750-L754 PolarHBondContact O-N 2.98Å; L751-L754 PolarHBondContact O-N 3Å; L751-L754 VanDerWaalsContact O-N 3.17Å; E752-L754 VanDerWaalsContact C-N 3.35Å; E752-L754 PolarHBondContact O-N 2.79Å; L754-I757 PolarHBondContact O-N 3.05Å; L754-H758 WeakPolarHBondContact O-CB 3Å; L754-H758 PolarHBondContact O-N 3.03Å; L754-V778 HydrophobicContact CD1-CG1 4.15Å; L754-V781 HydrophobicContact CD2-CG2 3.84Å; L754-V781 HydrophobicContact CG-CG2 3.7Å
755	V	95.4	Very high	89.1	Confident	5 Å²	5	48 Å²	48	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-69	-36.3	175.3	173.1	0	0	0	0	111	L751 E752 H758 T759 V781 L806 L810	L751-V755 HydrophobicContact CD1-CG2 4.16Å; L751-V755 HydrophobicContact CG-CG2 4.27Å; L751-V755 WeakPolarHBondContact O-CB 3.2Å; L751-V755 VanDerWaalsContact O-CG2 3.28Å; L751-V755 WeakPolarHBondContact O-CG2 3.04Å; L751-V755 PolarHBondContact O-N 2.86Å; E752-V755 PolarHBondContact O-N 2.95Å; V755-H758 WeakPolarHBondContact O-CB 3.32Å; V755-H758 PolarHBondContact O-N 2.91Å; V755-T759 HydrophobicContact CG1-CG2 4.22Å; V755-T759 WeakPolarHBondContact O-CB 3.25Å; V755-T759 WeakPolarHBondContact O-CG2 3.13Å; V755-T759 PolarHBondContact O-N 2.95Å; V755-T759 PolarHBondContact O-OG1 3.01Å; V755-V781 HydrophobicContact CG2-CG1 4.18Å; V755-L806 HydrophobicContact CB-CB 4.46Å; V755-L806 HydrophobicContact CG1-CB 4.42Å; V755-L806 HydrophobicContact CG2-CD1 4.48Å; V755-L810 HydrophobicContact CG2-CD2 3.61Å; V755-L810 HydrophobicContact CG2-CG 4.31Å
756	S	93.4	Very high	87.5	Confident	66 Å²	66	51.7 Å²	51.7	46%	0.462	27%	0.274	S	S	.	.	H	α-helix	trans	-60.9	-44.7	172	-176.4	0	0	0	0	111.5	E752 R753 H758 T759 S760	E752-S756 WeakPolarHBondContact O-CB 3.35Å; E752-S756 PolarHBondContact O-N 3.1Å; R753-S756 WeakPolarHBondContact O-CB 3.39Å; R753-S756 PolarHBondContact O-N 3.42Å; S756-H758 VanDerWaalsContact C-N 3.34Å; S756-H758 PolarHBondContact O-N 3.3Å; S756-T759 WeakPolarHBondContact CA-OG1 3.4Å; S756-T759 PolarHBondContact O-N 3.1Å; S756-T759 PolarHBondContact O-OG1 3.09Å; S756-T759 VanDerWaalsContact O-OG1 3.11Å; S756-S760 VanDerWaalsContact O-CB 3.24Å; S756-S760 WeakPolarHBondContact O-CB 3.47Å; S756-S760 PolarHBondContact O-N 3Å; S756-S760 PolarHBondContact O-OG 3.01Å
757	I	92.5	Very high	86	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-43.2	173.7	-68	165.4	0	0	0	110.8	V713 R753 L754 T759 K761 L763 L774 V778	V713-I757 HydrophobicContact CB-CD1 4.5Å; V713-I757 HydrophobicContact CG1-CD1 3.63Å; V713-I757 HydrophobicContact CG2-CD1 4.01Å; R753-I757 HydrophobicContact CG-CD1 4.41Å; R753-I757 WeakPolarHBondContact O-CG1 3.4Å; R753-I757 PolarHBondContact O-N 2.89Å; L754-I757 PolarHBondContact O-N 3.05Å; I757-T759 PolarHBondContact O-N 3.45Å; I757-K761 VanDerWaalsContact O-CA 3.31Å; I757-K761 WeakPolarHBondContact O-CA 3.13Å; I757-K761 PolarHBondContact O-N 3.38Å; I757-L763 HydrophobicContact CD1-CD2 4.23Å; I757-L763 HydrophobicContact CG2-CD2 3.83Å; I757-L774 HydrophobicContact CG2-CD1 3.67Å; I757-V778 HydrophobicContact CG2-CG2 3.8Å
758	H	92.6	Very high	84.2	Confident	23 Å²	23	57 Å²	57	11%	0.106	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-43.2	177.3	173.1	81.6	0	0	0	112.9	L754 V755 S756 V778 V781	L754-H758 WeakPolarHBondContact O-CB 3Å; L754-H758 PolarHBondContact O-N 3.03Å; V755-H758 WeakPolarHBondContact O-CB 3.32Å; V755-H758 PolarHBondContact O-N 2.91Å; S756-H758 VanDerWaalsContact C-N 3.34Å; S756-H758 PolarHBondContact O-N 3.3Å; H758-V778 HydrophobicContact CB-CB 4.15Å; H758-V778 HydrophobicContact CB-CG2 4.13Å; H758-V778 PolarHBondContact ND1-N 2.62Å; H758-V778 VanDerWaalsContact ND1-N 3.17Å; H758-V778 PolarHBondContact ND1-O 3.23Å; H758-V781 HydrophobicContact CB-CB 4.13Å; H758-V781 HydrophobicContact CB-CG1 4.13Å; H758-V781 HydrophobicContact CB-CG2 4.01Å
759	T	90.8	Very high	82.3	Confident	80 Å²	80	63.5 Å²	63.5	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-80.2	-40.7	-175.9	50.2	0	0	0	0	112.6	V755 S756 I757 K761	V755-T759 HydrophobicContact CG1-CG2 4.22Å; V755-T759 WeakPolarHBondContact O-CB 3.25Å; V755-T759 WeakPolarHBondContact O-CG2 3.13Å; V755-T759 PolarHBondContact O-N 2.95Å; V755-T759 PolarHBondContact O-OG1 3.01Å; S756-T759 WeakPolarHBondContact CA-OG1 3.4Å; S756-T759 PolarHBondContact O-N 3.1Å; S756-T759 PolarHBondContact O-OG1 3.09Å; S756-T759 VanDerWaalsContact O-OG1 3.11Å; I757-T759 PolarHBondContact O-N 3.45Å; T759-K761 VanDerWaalsContact C-N 3.29Å
760	S	88.6	Confident	80.5	Confident	57 Å²	57	60.7 Å²	60.7	40%	0.399	32%	0.322	S	S	.	.	H	α-helix	trans	-75.1	-19.1	175.6	65.7	0	0	0	0	113.3	S756 R762	S756-S760 VanDerWaalsContact O-CB 3.24Å; S756-S760 WeakPolarHBondContact O-CB 3.47Å; S756-S760 PolarHBondContact O-N 3Å; S756-S760 PolarHBondContact O-OG 3.01Å; S760-R762 PolarHBondContact O-N 2.8Å; S760-R762 PolarHBondContact OG-N 2.88Å; S760-R762 PolarHBondContact OG-O 3.11Å
761	K	88.3	Confident	78.7	Confident	98 Å²	98	62.7 Å²	62.7	43%	0.426	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	28.9	-174.4	-56.8	-179.7	178.3	-167.3	0	113	I757 T759 L774 A775	I757-K761 VanDerWaalsContact O-CA 3.31Å; I757-K761 WeakPolarHBondContact O-CA 3.13Å; I757-K761 PolarHBondContact O-N 3.38Å; T759-K761 VanDerWaalsContact C-N 3.29Å; K761-L774 WeakPolarHBondContact CB-O 3.49Å; K761-L774 WeakPolarHBondContact CG-O 3.34Å; K761-A775 WeakPolarHBondContact CD-O 3.5Å; K761-A775 VanDerWaalsContact CE-O 3.29Å; K761-A775 WeakPolarHBondContact CE-O 3.41Å; K761-A775 PolarHBondContact NZ-O 3.15Å
762	R	84.4	Confident	77.3	Confident	103 Å²	103	67.6 Å²	67.6	39%	0.389	37%	0.367	S	S	.	.			trans	-138.5	142.6	-176.5	-68.7	179.1	179.2	-171.6	-2.2	110.5	S760 N771	S760-R762 PolarHBondContact O-N 2.8Å; S760-R762 PolarHBondContact OG-N 2.88Å; S760-R762 PolarHBondContact OG-O 3.11Å; R762-N771 WeakPolarHBondContact CG-OD1 3.49Å; R762-N771 PolarHBondContact NE-OD1 3.35Å
763	L	81.3	Confident	76.4	Confident	14 Å²	14	67.4 Å²	67.4	7%	0.073	37%	0.368	C	S	.	.	S	Bend	trans	-84.2	-41.4	172.5	-70.4	170.8	0	0	0	111.3	W716 E720 L728 I757 L774	W716-L763 HydrophobicContact CB-CD1 4.31Å; W716-L763 HydrophobicContact CB-CD2 4.1Å; W716-L763 HydrophobicContact CE3-CD2 3.81Å; E720-L763 HydrophobicContact CB-CD1 4.49Å; L728-L763 HydrophobicContact CD1-CD1 4.09Å; L728-L763 HydrophobicContact CD2-CD1 4Å; I757-L763 HydrophobicContact CD1-CD2 4.23Å; I757-L763 HydrophobicContact CG2-CD2 3.83Å; L763-L774 HydrophobicContact CD2-CD1 3.96Å; L763-L774 HydrophobicContact CG-CD1 3.73Å
764	S	72.8	Confident	75.9	Confident	32 Å²	32	61.6 Å²	61.6	22%	0.224	35%	0.346	C	S	.	.			trans	-139.3	153.5	-178.9	61.1	0	0	0	0	111.7	E720 S766	E720-S764 PolarHBondContact OE2-OG 2.95Å; S764-S766 PolarHBondContact O-N 3Å; S764-S766 VanDerWaalsContact O-N 3.12Å
765	D	60	Low	75.2	Confident	168 Å²	168	63.9 Å²	63.9	90%	0.898	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-9	-178.9	-70.5	-33.2	0	0	0	113.8
766	S	54.7	Low	74.5	Confident	112 Å²	112	71 Å²	71	78%	0.783	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-2.6	-166.8	50.9	0	0	0	0	116.1	S764	S764-S766 PolarHBondContact O-N 3Å; S764-S766 VanDerWaalsContact O-N 3.12Å
767	S	54.9	Low	74.2	Confident	22 Å²	22	68.1 Å²	68.1	15%	0.154	38%	0.378	C	S	.	.			trans	-120.4	125.8	-172.8	76.9	0	0	0	0	113.9	E720 Q769 S770	E720-S767 WeakPolarHBondContact OE1-CB 3.15Å; E720-S767 PolarHBondContact OE1-OG 3.17Å; S767-Q769 PolarHBondContact O-N 3.49Å; S767-S770 PolarHBondContact O-OG 2.93Å; S767-S770 WeakPolarHBondContact OG-CB 3.45Å; S767-S770 PolarHBondContact OG-OG 3.22Å
768	D	55.6	Low	74.3	Confident	143 Å²	143	67.8 Å²	67.8	77%	0.765	38%	0.376	S	S	*	.	S	Bend	trans	-73.5	-16.1	168.2	-78.1	-33.5	0	0	0	112.2	N771	D768-N771 PolarHBondContact O-ND2 3.26Å
769	Q	52.8	Low	74.4	Confident	139 Å²	139	68.4 Å²	68.4	65%	0.65	38%	0.383	S	S	*	.	S	Bend	trans	-86.7	-31.7	-170.7	-68.1	171.8	-11.9	0	0	114.1	S767 N771 S772	S767-Q769 PolarHBondContact O-N 3.49Å; Q769-N771 PolarHBondContact O-N 2.85Å; Q769-N771 VanDerWaalsContact O-N 3.11Å; Q769-S772 PolarHBondContact O-N 3.16Å
770	S	56.1	Low	74.6	Confident	9 Å²	9	64.7 Å²	64.7	6%	0.063	36%	0.36	C	S	.	.	H	α-helix	trans	-62.7	-18.4	175.4	57.9	0	0	0	0	113.7	E720 S767 S772 L773 L774	E720-S770 WeakPolarHBondContact OE1-CB 3.49Å; S767-S770 PolarHBondContact O-OG 2.93Å; S767-S770 WeakPolarHBondContact OG-CB 3.45Å; S767-S770 PolarHBondContact OG-OG 3.22Å; S770-S772 VanDerWaalsContact C-N 3.29Å; S770-S772 PolarHBondContact O-N 3.33Å; S770-L773 PolarHBondContact O-N 3.45Å; S770-L774 PolarHBondContact O-N 3.1Å
771	N	57.8	Low	74.9	Confident	51 Å²	51	62.1 Å²	62.1	27%	0.273	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-27.4	-179.4	-65.9	-52	0	0	0	113.7	R762 D768 Q769 A775	R762-N771 WeakPolarHBondContact CG-OD1 3.49Å; R762-N771 PolarHBondContact NE-OD1 3.35Å; D768-N771 PolarHBondContact O-ND2 3.26Å; Q769-N771 PolarHBondContact O-N 2.85Å; Q769-N771 VanDerWaalsContact O-N 3.11Å; N771-A775 WeakPolarHBondContact O-CB 3.32Å; N771-A775 PolarHBondContact O-N 2.95Å
772	S	65.3	Low	75.2	Confident	104 Å²	104	61 Å²	61	73%	0.727	34%	0.337	S	S	*	.	H	α-helix	trans	-82	-38.7	179.5	-170.1	0	0	0	0	112.6	Q769 S770 A775	Q769-S772 PolarHBondContact O-N 3.16Å; S770-S772 VanDerWaalsContact C-N 3.29Å; S770-S772 PolarHBondContact O-N 3.33Å; S772-A775 WeakPolarHBondContact O-CB 3.16Å
773	L	78.1	Confident	75.7	Confident	59 Å²	59	59.1 Å²	59.1	31%	0.309	33%	0.332	S	S	.	.	H	α-helix	trans	-75.2	-39.4	-175.4	-174.4	143.9	0	0	0	112.1	L728 Q729 V732 S770	L728-L773 HydrophobicContact CD2-CD1 4.36Å; L728-L773 HydrophobicContact CG-CD1 4.17Å; Q729-L773 HydrophobicContact CB-CD1 3.72Å; Q729-L773 HydrophobicContact CG-CD1 4.22Å; V732-L773 HydrophobicContact CB-CD2 4.31Å; V732-L773 HydrophobicContact CG1-CD2 4.38Å; V732-L773 HydrophobicContact CG2-CD2 4.06Å; S770-L773 PolarHBondContact O-N 3.45Å
774	L	81.9	Confident	76.3	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	18.2	177.4	-64.5	178.7	0	0	0	112.7	V732 I757 K761 L763 S770 E776 G777 V778	V732-L774 HydrophobicContact CG1-CD2 3.89Å; I757-L774 HydrophobicContact CG2-CD1 3.67Å; K761-L774 WeakPolarHBondContact CB-O 3.49Å; K761-L774 WeakPolarHBondContact CG-O 3.34Å; L763-L774 HydrophobicContact CD2-CD1 3.96Å; L763-L774 HydrophobicContact CG-CD1 3.73Å; S770-L774 PolarHBondContact O-N 3.1Å; L774-E776 PolarHBondContact O-N 3.37Å; L774-E776 VanDerWaalsContact O-N 3.13Å; L774-G777 WeakPolarHBondContact O-CA 3.24Å; L774-G777 PolarHBondContact O-N 2.76Å; L774-V778 HydrophobicContact CD2-CG2 4.13Å
775	A	81	Confident	77.5	Confident	47 Å²	47	61 Å²	61	39%	0.388	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-36.1	179.4	0	0	0	0	0	112.4	K761 N771 S772	K761-A775 WeakPolarHBondContact CD-O 3.5Å; K761-A775 VanDerWaalsContact CE-O 3.29Å; K761-A775 WeakPolarHBondContact CE-O 3.41Å; K761-A775 PolarHBondContact NZ-O 3.15Å; N771-A775 WeakPolarHBondContact O-CB 3.32Å; N771-A775 PolarHBondContact O-N 2.95Å; S772-A775 WeakPolarHBondContact O-CB 3.16Å
776	E	82.1	Confident	79.2	Confident	156 Å²	156	56.2 Å²	56.2	73%	0.729	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-6.9	175	-62.8	-165.1	177.7	0	0	113.4	L774 K782	L774-E776 PolarHBondContact O-N 3.37Å; L774-E776 VanDerWaalsContact O-N 3.13Å; E776-K782 WeakPolarHBondContact O-CE 3.29Å; E776-K782 PolarHBondContact O-NZ 2.93Å
777	G	87.1	Confident	81.2	Confident	5 Å²	5	50.9 Å²	50.9	5%	0.052	27%	0.268	C	S	.	.			trans	82.1	177.2	-172.6	0	0	0	0	0	113	L774 P779	L774-G777 WeakPolarHBondContact O-CA 3.24Å; L774-G777 PolarHBondContact O-N 2.76Å; G777-P779 WeakPolarHBondContact O-CD 3.47Å
778	V	93.8	Very high	83.1	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.271	C	S	.	.			trans	-73.5	121.5	-176.9	-178.1	0	0	0	0	111.4	W716 L754 I757 H758 L774 A780 V781 K782	W716-V778 HydrophobicContact CH2-CG1 3.91Å; W716-V778 HydrophobicContact CZ3-CG1 4.36Å; W716-V778 HydrophobicContact CZ3-CG2 4.37Å; L754-V778 HydrophobicContact CD1-CG1 4.15Å; I757-V778 HydrophobicContact CG2-CG2 3.8Å; H758-V778 HydrophobicContact CB-CB 4.15Å; H758-V778 HydrophobicContact CB-CG2 4.13Å; H758-V778 PolarHBondContact ND1-N 2.62Å; H758-V778 VanDerWaalsContact ND1-N 3.17Å; H758-V778 PolarHBondContact ND1-O 3.23Å; L774-V778 HydrophobicContact CD2-CG2 4.13Å; V778-A780 HydrophobicContact CG1-CB 4.05Å; V778-A780 PolarHBondContact O-N 2.59Å; V778-V781 HydrophobicContact CB-CB 4.44Å; V778-V781 HydrophobicContact CB-CG2 4.04Å; V778-V781 HydrophobicContact CG1-CG2 4.14Å; V778-V781 PolarHBondContact O-N 3.01Å; V778-K782 PolarHBondContact O-N 3.13Å
779	P	94.3	Very high	84.9	Confident	37 Å²	37	45.4 Å²	45.4	24%	0.24	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-42.2	179.5	-26.4	35.7	0	0	0	113.5	G777 V781 K782 E783	G777-P779 WeakPolarHBondContact O-CD 3.47Å; P779-V781 PolarHBondContact O-N 3.31Å; P779-V781 VanDerWaalsContact O-N 3.16Å; P779-K782 WeakPolarHBondContact O-CB 3.26Å; P779-K782 PolarHBondContact O-N 2.88Å; P779-E783 WeakPolarHBondContact O-CG 3.43Å; P779-E783 PolarHBondContact O-N 3.09Å
780	A	95.6	Very high	86.5	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-55.5	-35.4	179.8	0	0	0	0	0	113.3	F735 I737 V778 L784	F735-A780 HydrophobicContact CD1-CB 3.7Å; F735-A780 HydrophobicContact CE1-CB 4.19Å; F735-A780 HydrophobicContact CG-CB 4.41Å; F735-A780 WeakPolarHBondContact O-CB 3.38Å; I737-A780 HydrophobicContact CG1-CB 4.19Å; I737-A780 VanDerWaalsContact CG1-O 3.31Å; I737-A780 WeakPolarHBondContact CG1-O 3.4Å; I737-A780 HydrophobicContact CG2-CB 4.37Å; V778-A780 HydrophobicContact CG1-CB 4.05Å; V778-A780 PolarHBondContact O-N 2.59Å; A780-L784 PolarHBondContact O-N 3Å
781	V	96	Very high	87.8	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.024	22%	0.223	C	C	.	.	H	α-helix	trans	-73.4	-41.4	177.5	178	0	0	0	0	111	L754 V755 H758 V778 P779 E783 L784 L810	L754-V781 HydrophobicContact CD2-CG2 3.84Å; L754-V781 HydrophobicContact CG-CG2 3.7Å; V755-V781 HydrophobicContact CG2-CG1 4.18Å; H758-V781 HydrophobicContact CB-CB 4.13Å; H758-V781 HydrophobicContact CB-CG1 4.13Å; H758-V781 HydrophobicContact CB-CG2 4.01Å; V778-V781 HydrophobicContact CB-CB 4.44Å; V778-V781 HydrophobicContact CB-CG2 4.04Å; V778-V781 HydrophobicContact CG1-CG2 4.14Å; V778-V781 PolarHBondContact O-N 3.01Å; P779-V781 PolarHBondContact O-N 3.31Å; P779-V781 VanDerWaalsContact O-N 3.16Å; V781-E783 PolarHBondContact O-N 2.84Å; V781-L784 WeakPolarHBondContact O-CB 3.23Å; V781-L784 PolarHBondContact O-N 3.07Å; V781-L810 HydrophobicContact CG1-CD2 3.68Å
782	K	93.3	Very high	88.9	Confident	74 Å²	74	43.2 Å²	43.2	32%	0.322	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-32	176.7	-66	-177.7	179.2	176.1	0	112.8	E776 V778 P779 L784 N812	E776-K782 WeakPolarHBondContact O-CE 3.29Å; E776-K782 PolarHBondContact O-NZ 2.93Å; V778-K782 PolarHBondContact O-N 3.13Å; P779-K782 WeakPolarHBondContact O-CB 3.26Å; P779-K782 PolarHBondContact O-N 2.88Å; K782-L784 VanDerWaalsContact C-N 3.34Å; K782-N812 VanDerWaalsContact O-CB 3.32Å; K782-N812 WeakPolarHBondContact O-CB 3.36Å; K782-N812 PolarHBondContact O-ND2 3.13Å
783	E	94.6	Very high	89.5	Confident	63 Å²	63	39.6 Å²	39.6	29%	0.294	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	4.8	-178.8	-64.2	175.9	-170.7	0	0	113.2	K736 P779 V781 Y785	K736-E783 WeakPolarHBondContact CD-OE2 3.32Å; K736-E783 VanDerWaalsContact CE-OE2 3.32Å; K736-E783 WeakPolarHBondContact CE-OE2 3.45Å; K736-E783 IonicContact NZ-OE1 3.52Å; K736-E783 PolarHBondContact NZ-OE1 3.24Å; K736-E783 IonicContact NZ-OE2 2.57Å; K736-E783 PolarHBondContact NZ-OE2 3.44Å; P779-E783 WeakPolarHBondContact O-CG 3.43Å; P779-E783 PolarHBondContact O-N 3.09Å; V781-E783 PolarHBondContact O-N 2.84Å; E783-Y785 HydrophobicContact CB-CE2 4.41Å; E783-Y785 WeakPolarHBondContact O-CD2 3.06Å; E783-Y785 VanDerWaalsContact O-CE2 3.23Å; E783-Y785 WeakPolarHBondContact O-CE2 3.46Å; E783-Y785 PolarHBondContact O-N 3.23Å; E783-Y785 VanDerWaalsContact O-N 3.13Å
784	L	95.6	Very high	89.7	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.213	C	C	.	.			trans	-80.1	94.1	176.2	-178	63	0	0	0	110.9	I737 L740 L751 A780 V781 K782 K786 L810 L813	I737-L784 HydrophobicContact CD1-CB 4.11Å; I737-L784 HydrophobicContact CD1-CD1 4.31Å; I737-L784 HydrophobicContact CD1-CD2 3.92Å; I737-L784 HydrophobicContact CD1-CG 4.33Å; I737-L784 HydrophobicContact CG1-CB 4.33Å; I737-L784 HydrophobicContact CG1-CD1 4.21Å; L740-L784 HydrophobicContact CB-CD1 3.64Å; L740-L784 HydrophobicContact CD2-CD2 4.33Å; L751-L784 HydrophobicContact CD1-CD2 4.17Å; A780-L784 PolarHBondContact O-N 3Å; V781-L784 WeakPolarHBondContact O-CB 3.23Å; V781-L784 PolarHBondContact O-N 3.07Å; K782-L784 VanDerWaalsContact C-N 3.34Å; L784-K786 VanDerWaalsContact CD1-O 3.32Å; L784-K786 WeakPolarHBondContact CD1-O 3.46Å; L784-L810 HydrophobicContact CD2-CD1 4.15Å; L784-L810 HydrophobicContact CD2-CD2 4.11Å; L784-L813 HydrophobicContact CG-CD1 4.38Å
785	Y	96.2	Very high	89.9	Confident	85 Å²	85	46 Å²	46	33%	0.333	23%	0.23	S	C	.	.			trans	-91.4	-19.3	178.4	-49.8	-63.8	0	0	0	114.3	H738 E783 N812 Q814 H815	H738-Y785 PolarHBondContact ND1-N 3.1Å; E783-Y785 HydrophobicContact CB-CE2 4.41Å; E783-Y785 WeakPolarHBondContact O-CD2 3.06Å; E783-Y785 VanDerWaalsContact O-CE2 3.23Å; E783-Y785 WeakPolarHBondContact O-CE2 3.46Å; E783-Y785 PolarHBondContact O-N 3.23Å; E783-Y785 VanDerWaalsContact O-N 3.13Å; Y785-N812 HydrophobicContact CD1-CB 4.4Å; Y785-N812 WeakPolarHBondContact CD1-O 3.3Å; Y785-N812 HydrophobicContact CE1-CB 4.21Å; Y785-Q814 HydrophobicContact CD1-CG 4.45Å; Y785-Q814 WeakPolarHBondContact O-CA 3.4Å; Y785-Q814 PolarHBondContact O-N 2.9Å; Y785-H815 PolarHBondContact O-N 2.91Å
786	K	96.9	Very high	90.1	Very high	67 Å²	67	43.8 Å²	43.8	29%	0.291	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	120.8	-173.1	-170.9	177.7	-162.1	-164.7	0	111.4	P739 L740 L784 E788 H815	P739-K786 HydrophobicContact CB-CB 4.11Å; P739-K786 HydrophobicContact CB-CD 4.21Å; P739-K786 HydrophobicContact CB-CG 4.41Å; L740-K786 PolarHBondContact N-O 3.33Å; L740-K786 VanDerWaalsContact N-O 3.09Å; L784-K786 VanDerWaalsContact CD1-O 3.32Å; L784-K786 WeakPolarHBondContact CD1-O 3.46Å; K786-E788 WeakPolarHBondContact CE-OE1 3.49Å; K786-E788 IonicContact NZ-OE1 2.72Å; K786-E788 PolarHBondContact NZ-OE1 3.24Å; K786-H815 HydrophobicContact CB-CB 4.33Å; K786-H815 WeakPolarHBondContact CE-CE1 3.45Å; K786-H815 VanDerWaalsContact CE-NE2 3.26Å; K786-H815 WeakPolarHBondContact CE-NE2 3.29Å; K786-H815 HydrophobicContact CG-CB 3.94Å; K786-H815 WeakPolarHBondContact CG-ND1 3.43Å
787	L	96.4	Very high	90.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.1	172.3	179.4	58.1	0	0	0	109.7	L740 L751 L803 L810 L813 H815 L816 D817	L740-L787 HydrophobicContact CB-CD1 4.14Å; L740-L787 HydrophobicContact CD2-CD1 3.95Å; L740-L787 HydrophobicContact CG-CD1 4.02Å; L740-L787 WeakPolarHBondContact O-CA 3.45Å; L751-L787 HydrophobicContact CD2-CD1 4.31Å; L751-L787 HydrophobicContact CD2-CD2 4.18Å; L787-L803 HydrophobicContact CD2-CD1 3.73Å; L787-L810 HydrophobicContact CD2-CD1 4.33Å; L787-L813 HydrophobicContact CB-CD1 3.83Å; L787-L813 HydrophobicContact CB-CD2 4.42Å; L787-H815 PolarHBondContact N-O 3.47Å; L787-L816 HydrophobicContact CB-CD1 4.4Å; L787-L816 HydrophobicContact CD2-CD1 4.13Å; L787-L816 HydrophobicContact CG-CD1 4.32Å; L787-D817 PolarHBondContact O-N 3.37Å
788	E	95	Very high	90.4	Very high	46 Å²	46	44.7 Å²	44.7	22%	0.215	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.1	173.1	-68.7	174.8	-167.7	0	0	109.4	L740 K741 A742 K786 D817	L740-E788 PolarHBondContact O-N 3.4Å; K741-E788 CarbonylContact C-O 3.23Å; K741-E788 WeakPolarHBondContact CA-O 3.47Å; K741-E788 HydrophobicContact CB-CB 4.45Å; K741-E788 HydrophobicContact CG-CB 4.15Å; A742-E788 PolarHBondContact N-O 3.24Å; K786-E788 WeakPolarHBondContact CE-OE1 3.49Å; K786-E788 IonicContact NZ-OE1 2.72Å; K786-E788 PolarHBondContact NZ-OE1 3.24Å; E788-D817 HydrophobicContact CG-CB 4.5Å
789	F	91.9	Very high	90.3	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.018	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	98	177.2	-173.3	-81.3	0	0	0	108.8	I748 L791 A799 L800 L803 D817 V818 S821	I748-F789 HydrophobicContact CD1-CD2 3.89Å; I748-F789 HydrophobicContact CD1-CE2 4.12Å; I748-F789 HydrophobicContact CG1-CD2 4.15Å; I748-F789 HydrophobicContact CG1-CE2 3.88Å; F789-L791 HydrophobicContact CD1-CB 4.18Å; F789-L791 HydrophobicContact CD1-CD1 4.34Å; F789-L791 HydrophobicContact CD2-CD1 4.11Å; F789-L791 HydrophobicContact CE1-CB 3.69Å; F789-L791 HydrophobicContact CE1-CD1 3.75Å; F789-L791 HydrophobicContact CE1-CG 4.29Å; F789-L791 HydrophobicContact CE2-CD1 3.5Å; F789-L791 VanDerWaalsContact CE2-CD1 3.5Å; F789-L791 HydrophobicContact CZ-CB 4.12Å; F789-L791 HydrophobicContact CZ-CD1 3.3Å; F789-L791 HydrophobicContact CZ-CG 4.3Å; F789-A799 HydrophobicContact CE2-CB 3.87Å; F789-A799 HydrophobicContact CZ-CB 3.86Å; F789-L800 HydrophobicContact CE1-CD2 4.02Å; F789-L800 HydrophobicContact CE2-CD2 4.24Å; F789-L800 HydrophobicContact CZ-CD2 3.74Å; F789-L800 HydrophobicContact CZ-CG 4.22Å; F789-L803 HydrophobicContact CD2-CD2 3.7Å; F789-L803 HydrophobicContact CE2-CD2 3.95Å; F789-L803 HydrophobicContact CG-CD2 4.38Å; F789-D817 VanDerWaalsContact CB-O 3.29Å; F789-D817 WeakPolarHBondContact CB-O 3.26Å; F789-D817 PolarHBondContact N-O 2.83Å; F789-V818 HydrophobicContact CB-CB 4.47Å; F789-V818 HydrophobicContact CB-CG1 4.11Å; F789-V818 HydrophobicContact CD1-CG1 3.81Å; F789-V818 HydrophobicContact CE1-CG1 4.33Å; F789-V818 HydrophobicContact CG-CG1 3.99Å; F789-S821 WeakPolarHBondContact CD1-OG 3.26Å; F789-S821 VanDerWaalsContact CE1-OG 3.24Å; F789-S821 WeakPolarHBondContact CE1-OG 3.02Å
790	E	86.9	Confident	90.3	Very high	86 Å²	86	43.4 Å²	43.4	40%	0.402	21%	0.214	S	C	.	.			trans	-115.3	59.4	-178.5	-164.8	-179.5	153.3	0	0	110	K741 A742	K741-E790 WeakPolarHBondContact CE-OE2 2.77Å; K741-E790 IonicContact NZ-OE2 2.85Å; K741-E790 PolarHBondContact NZ-OE2 3.23Å; A742-E790 CarbonylContact O-C 3.33Å; A742-E790 PolarHBondContact O-N 3.22Å
791	L	84.8	Confident	90.1	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.052	23%	0.229	C	C	.	.			trans	-91.6	146.2	173.9	-88.3	154.8	0	0	0	110.8	T743 V745 I748 F789 N795 S796 A799	T743-L791 WeakPolarHBondContact O-CD2 3.36Å; V745-L791 HydrophobicContact CG2-CD2 3.99Å; I748-L791 HydrophobicContact CG1-CD1 4.49Å; F789-L791 HydrophobicContact CD1-CB 4.18Å; F789-L791 HydrophobicContact CD1-CD1 4.34Å; F789-L791 HydrophobicContact CD2-CD1 4.11Å; F789-L791 HydrophobicContact CE1-CB 3.69Å; F789-L791 HydrophobicContact CE1-CD1 3.75Å; F789-L791 HydrophobicContact CE1-CG 4.29Å; F789-L791 HydrophobicContact CE2-CD1 3.5Å; F789-L791 VanDerWaalsContact CE2-CD1 3.5Å; F789-L791 HydrophobicContact CZ-CB 4.12Å; F789-L791 HydrophobicContact CZ-CD1 3.3Å; F789-L791 HydrophobicContact CZ-CG 4.3Å; L791-N795 HydrophobicContact CD2-CB 4Å; L791-S796 PolarHBondContact O-OG 3.46Å; L791-A799 HydrophobicContact CD1-CB 3.73Å
792	D	80.1	Confident	90	Very high	58 Å²	58	48.4 Å²	48.4	31%	0.31	24%	0.24	S	C	.	.			trans	-58.4	141.1	171.1	-81.9	-44.6	0	0	0	110.1	E794 N795 S796	D792-E794 PolarHBondContact O-N 3.34Å; D792-N795 PolarHBondContact O-N 2.95Å; D792-S796 PolarHBondContact O-N 3.24Å; D792-S796 PolarHBondContact O-OG 2.87Å
793	P	78.4	Confident	90.1	Very high	28 Å²	28	44.9 Å²	44.9	18%	0.182	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-10.6	-178.5	-22.8	30.4	0	0	0	115.4	N820 K822	P793-N820 WeakPolarHBondContact CG-ND2 3.35Å; P793-K822 HydrophobicContact CB-CD 4.04Å; P793-K822 VanDerWaalsContact CB-CE 3.44Å; P793-K822 HydrophobicContact CB-CG 4.08Å; P793-K822 VanDerWaalsContact O-CD 3.3Å; P793-K822 WeakPolarHBondContact O-CD 3.29Å; P793-K822 WeakPolarHBondContact O-CE 3.32Å; P793-K822 PolarHBondContact O-NZ 3.22Å
794	E	82.6	Confident	90.1	Very high	128 Å²	128	42.4 Å²	42.4	60%	0.598	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-35.3	173	-65.9	177.4	163.5	0	0	111.2	R166 D792	R166-E794 IonicContact NH1-OE2 3.27Å; R166-E794 PolarHBondContact NH1-OE2 3.25Å; D792-E794 PolarHBondContact O-N 3.34Å
795	N	84.1	Confident	90	Very high	67 Å²	67	48 Å²	48	36%	0.358	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-24.5	-175.9	-67.9	-26.5	0	0	0	113	V745 L791 D792 P797 L798	V745-N795 HydrophobicContact CG2-CB 3.91Å; L791-N795 HydrophobicContact CD2-CB 4Å; D792-N795 PolarHBondContact O-N 2.95Å; N795-P797 VanDerWaalsContact C-CD 3.45Å; N795-L798 WeakPolarHBondContact O-CB 3.37Å; N795-L798 PolarHBondContact O-N 3.28Å
796	S	86.3	Confident	89.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-49.3	-47	179.7	-50.3	0	0	0	0	113.5	L791 D792 L798 A799 L800 S821	L791-S796 PolarHBondContact O-OG 3.46Å; D792-S796 PolarHBondContact O-N 3.24Å; D792-S796 PolarHBondContact O-OG 2.87Å; S796-L798 PolarHBondContact O-N 2.99Å; S796-A799 PolarHBondContact O-N 2.88Å; S796-L800 WeakPolarHBondContact O-CG 3.43Å; S796-L800 PolarHBondContact O-N 2.86Å; S796-S821 VanDerWaalsContact CB-O 3.23Å; S796-S821 WeakPolarHBondContact CB-O 3.31Å
797	P	87.6	Confident	89.9	Confident	64 Å²	64	41 Å²	41	42%	0.416	21%	0.214	S	C	.	.	H	α-helix	trans	-60.7	-22.9	-178.7	-24.4	35.9	0	0	0	115	N795 P801	N795-P797 VanDerWaalsContact C-CD 3.45Å; P797-P801 VanDerWaalsContact O-CD 3.25Å; P797-P801 WeakPolarHBondContact O-CD 3.36Å
798	L	88.5	Confident	89.7	Confident	116 Å²	116	43.4 Å²	43.4	61%	0.607	23%	0.229	S	C	*	.	H	α-helix	trans	-75.8	-32.7	177	-59.7	173.9	0	0	0	111.8	V745 N795 S796	V745-L798 HydrophobicContact CG1-CB 4.45Å; N795-L798 WeakPolarHBondContact O-CB 3.37Å; N795-L798 PolarHBondContact O-N 3.28Å; S796-L798 PolarHBondContact O-N 2.99Å
799	A	92.1	Very high	89.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-94	-28.5	-176.5	0	0	0	0	0	113.4	V745 I748 F789 L791 S796 K802 L803	V745-A799 HydrophobicContact CG1-CB 4.2Å; V745-A799 HydrophobicContact CG2-CB 4.46Å; I748-A799 HydrophobicContact CB-CB 4.26Å; I748-A799 HydrophobicContact CG1-CB 4.1Å; I748-A799 HydrophobicContact CG2-CB 4.48Å; F789-A799 HydrophobicContact CE2-CB 3.87Å; F789-A799 HydrophobicContact CZ-CB 3.86Å; L791-A799 HydrophobicContact CD1-CB 3.73Å; S796-A799 PolarHBondContact O-N 2.88Å; A799-K802 PolarHBondContact O-N 3.36Å; A799-L803 PolarHBondContact O-N 3.39Å
800	L	92.8	Very high	89.8	Confident	10 Å²	10	41.4 Å²	41.4	5%	0.052	22%	0.222	C	C	.	.	H	α-helix	trans	-55.5	-43.5	-177	-73.3	-179.2	0	0	0	114.4	F789 S796 K802 L803 W804 V818 I823	F789-L800 HydrophobicContact CE1-CD2 4.02Å; F789-L800 HydrophobicContact CE2-CD2 4.24Å; F789-L800 HydrophobicContact CZ-CD2 3.74Å; F789-L800 HydrophobicContact CZ-CG 4.22Å; S796-L800 WeakPolarHBondContact O-CG 3.43Å; S796-L800 PolarHBondContact O-N 2.86Å; L800-K802 VanDerWaalsContact C-N 3.34Å; L800-K802 PolarHBondContact O-N 3.03Å; L800-L803 HydrophobicContact CD2-CD2 4.24Å; L800-L803 WeakPolarHBondContact O-CB 3.48Å; L800-L803 PolarHBondContact O-N 3.01Å; L800-W804 HydrophobicContact CB-CZ2 4.16Å; L800-W804 HydrophobicContact CD1-CZ2 4.27Å; L800-W804 HydrophobicContact CD2-CH2 3.77Å; L800-W804 HydrophobicContact CD2-CZ2 3.56Å; L800-W804 HydrophobicContact CG-CZ2 4.19Å; L800-W804 PolarHBondContact O-N 3.39Å; L800-W804 PolarHBondContact O-NE1 2.81Å; L800-V818 HydrophobicContact CD2-CG1 3.78Å; L800-I823 HydrophobicContact CD1-CB 4.44Å; L800-I823 HydrophobicContact CD1-CG1 3.85Å; L800-I823 HydrophobicContact CD2-CG1 4.39Å
801	P	92.2	Very high	90	Very high	50 Å²	50	42 Å²	42	33%	0.325	23%	0.225	S	C	.	.	H	α-helix	trans	-56.2	-48.1	177.9	-25.9	35.6	0	0	0	112.5	P797 L803 W804 D805	P797-P801 VanDerWaalsContact O-CD 3.25Å; P797-P801 WeakPolarHBondContact O-CD 3.36Å; P801-L803 VanDerWaalsContact C-N 3.33Å; P801-L803 PolarHBondContact O-N 2.86Å; P801-W804 PolarHBondContact O-N 3.25Å; P801-D805 VanDerWaalsContact O-CG 3.28Å; P801-D805 PolarHBondContact O-N 2.78Å; P801-D805 VanDerWaalsContact O-N 3.12Å
802	K	94.3	Very high	90.4	Very high	59 Å²	59	44.6 Å²	44.6	26%	0.257	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-38	177.6	-67.2	-179.9	167.6	-166	0	112.2	I748 E749 E752 A799 L800 W804 D805 L806	I748-K802 HydrophobicContact CG2-CB 3.93Å; E749-K802 VanDerWaalsContact CD-NZ 3.25Å; E749-K802 HydrophobicContact CG-CD 3.97Å; E749-K802 VanDerWaalsContact CG-NZ 3.33Å; E749-K802 IonicContact OE1-NZ 3.17Å; E749-K802 PolarHBondContact OE1-NZ 3.24Å; E752-K802 VanDerWaalsContact OE2-CD 3.28Å; E752-K802 WeakPolarHBondContact OE2-CD 3.38Å; E752-K802 IonicContact OE2-NZ 2.62Å; A799-K802 PolarHBondContact O-N 3.36Å; L800-K802 VanDerWaalsContact C-N 3.34Å; L800-K802 PolarHBondContact O-N 3.03Å; K802-W804 VanDerWaalsContact C-N 3.34Å; K802-W804 PolarHBondContact O-N 3.32Å; K802-D805 PolarHBondContact O-N 3.02Å; K802-L806 WeakPolarHBondContact O-CD2 3.46Å; K802-L806 WeakPolarHBondContact O-CG 3.32Å; K802-L806 PolarHBondContact O-N 3.3Å
803	L	95.2	Very high	91.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-45.9	174.5	179	62	0	0	0	110.9	I748 L787 F789 A799 L800 P801 D805 L806 L807 V818	I748-L803 HydrophobicContact CD1-CD1 4.4Å; I748-L803 HydrophobicContact CG2-CB 4.19Å; L787-L803 HydrophobicContact CD2-CD1 3.73Å; F789-L803 HydrophobicContact CD2-CD2 3.7Å; F789-L803 HydrophobicContact CE2-CD2 3.95Å; F789-L803 HydrophobicContact CG-CD2 4.38Å; A799-L803 PolarHBondContact O-N 3.39Å; L800-L803 HydrophobicContact CD2-CD2 4.24Å; L800-L803 WeakPolarHBondContact O-CB 3.48Å; L800-L803 PolarHBondContact O-N 3.01Å; P801-L803 VanDerWaalsContact C-N 3.33Å; P801-L803 PolarHBondContact O-N 2.86Å; L803-D805 VanDerWaalsContact C-N 3.3Å; L803-D805 PolarHBondContact O-N 3.28Å; L803-L806 HydrophobicContact CD1-CD1 4.22Å; L803-L806 HydrophobicContact CD1-CG 4.46Å; L803-L806 WeakPolarHBondContact O-CG 3.35Å; L803-L806 PolarHBondContact O-N 3.19Å; L803-L807 HydrophobicContact CD1-CD2 4.31Å; L803-L807 HydrophobicContact CD1-CG 4.36Å; L803-L807 HydrophobicContact CG-CG 4.49Å; L803-L807 VanDerWaalsContact O-CG 3.29Å; L803-L807 WeakPolarHBondContact O-CG 3.32Å; L803-L807 PolarHBondContact O-N 3.12Å; L803-L807 VanDerWaalsContact O-N 3.08Å; L803-V818 HydrophobicContact CD2-CG1 4.31Å; L803-V818 HydrophobicContact CD2-CG2 4.31Å
804	W	94.2	Very high	92.1	Very high	11 Å²	11	43.7 Å²	43.7	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-38.1	179.1	-51.5	147.1	0	0	0	112.5	L800 P801 K802 L807 P808 V818 I823 K830 L831	L800-W804 HydrophobicContact CB-CZ2 4.16Å; L800-W804 HydrophobicContact CD1-CZ2 4.27Å; L800-W804 HydrophobicContact CD2-CH2 3.77Å; L800-W804 HydrophobicContact CD2-CZ2 3.56Å; L800-W804 HydrophobicContact CG-CZ2 4.19Å; L800-W804 PolarHBondContact O-N 3.39Å; L800-W804 PolarHBondContact O-NE1 2.81Å; P801-W804 PolarHBondContact O-N 3.25Å; K802-W804 VanDerWaalsContact C-N 3.34Å; K802-W804 PolarHBondContact O-N 3.32Å; W804-L807 HydrophobicContact CE3-CD1 3.72Å; W804-L807 HydrophobicContact CZ3-CD1 4.02Å; W804-P808 WeakPolarHBondContact O-CD 3.29Å; W804-V818 HydrophobicContact CH2-CG1 4.2Å; W804-V818 HydrophobicContact CH2-CG2 4.5Å; W804-I823 HydrophobicContact CH2-CD1 4.13Å; W804-I823 HydrophobicContact CH2-CG1 4.48Å; W804-I823 HydrophobicContact CZ2-CD1 4.31Å; W804-I823 HydrophobicContact CZ2-CG1 4.22Å; W804-I823 HydrophobicContact CZ2-CG2 4.24Å; W804-K830 HydrophobicContact CG-CB 4.12Å; W804-L831 HydrophobicContact CE3-CB 4.4Å; W804-L831 HydrophobicContact CE3-CD1 4.02Å; W804-L831 HydrophobicContact CH2-CB 4.22Å; W804-L831 HydrophobicContact CH2-CD1 4.23Å; W804-L831 HydrophobicContact CH2-CD2 4.29Å; W804-L831 HydrophobicContact CH2-CG 4.48Å; W804-L831 HydrophobicContact CZ2-CB 4.31Å; W804-L831 HydrophobicContact CZ3-CB 4.29Å; W804-L831 HydrophobicContact CZ3-CD1 3.67Å; W804-L831 HydrophobicContact CZ3-CG 4.36Å
805	D	93.2	Very high	92.8	Very high	119 Å²	119	39.2 Å²	39.2	64%	0.636	21%	0.209	S	C	*	.	H	α-helix	trans	-71.2	-31.1	-179.3	-63.2	-22.6	0	0	0	112.2	P801 K802 L803 P808	P801-D805 VanDerWaalsContact O-CG 3.28Å; P801-D805 PolarHBondContact O-N 2.78Å; P801-D805 VanDerWaalsContact O-N 3.12Å; K802-D805 PolarHBondContact O-N 3.02Å; L803-D805 VanDerWaalsContact C-N 3.3Å; L803-D805 PolarHBondContact O-N 3.28Å; D805-P808 WeakPolarHBondContact O-CD 3.46Å
806	L	95.4	Very high	93.5	Very high	6 Å²	6	36 Å²	36	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-86.9	-25.2	179	75.3	83.1	0	0	0	114.3	I748 L751 E752 V755 K802 L803 P808 G809 L810	I748-L806 HydrophobicContact CG2-CD2 3.97Å; L751-L806 HydrophobicContact CB-CD2 4.32Å; L751-L806 HydrophobicContact CD2-CD1 3.82Å; L751-L806 HydrophobicContact CD2-CD2 4.15Å; L751-L806 HydrophobicContact CG-CD1 4.16Å; L751-L806 HydrophobicContact CG-CD2 4.16Å; E752-L806 HydrophobicContact CB-CB 4.49Å; E752-L806 HydrophobicContact CB-CD2 3.96Å; V755-L806 HydrophobicContact CB-CB 4.46Å; V755-L806 HydrophobicContact CG1-CB 4.42Å; V755-L806 HydrophobicContact CG2-CD1 4.48Å; K802-L806 WeakPolarHBondContact O-CD2 3.46Å; K802-L806 WeakPolarHBondContact O-CG 3.32Å; K802-L806 PolarHBondContact O-N 3.3Å; L803-L806 HydrophobicContact CD1-CD1 4.22Å; L803-L806 HydrophobicContact CD1-CG 4.46Å; L803-L806 WeakPolarHBondContact O-CG 3.35Å; L803-L806 PolarHBondContact O-N 3.19Å; L806-P808 VanDerWaalsContact C-CD 3.4Å; L806-P808 VanDerWaalsContact C-N 3.28Å; L806-G809 PolarHBondContact O-N 2.96Å; L806-L810 HydrophobicContact CD1-CD1 3.57Å; L806-L810 HydrophobicContact CD1-CG 4.1Å
807	L	95.3	Very high	93.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-52	-39.5	-177	-84.5	-179.5	0	0	0	113.4	L803 W804 G809 L810 L813 L816 L831 A834 L838	L803-L807 HydrophobicContact CD1-CD2 4.31Å; L803-L807 HydrophobicContact CD1-CG 4.36Å; L803-L807 HydrophobicContact CG-CG 4.49Å; L803-L807 VanDerWaalsContact O-CG 3.29Å; L803-L807 WeakPolarHBondContact O-CG 3.32Å; L803-L807 PolarHBondContact O-N 3.12Å; L803-L807 VanDerWaalsContact O-N 3.08Å; W804-L807 HydrophobicContact CE3-CD1 3.72Å; W804-L807 HydrophobicContact CZ3-CD1 4.02Å; L807-G809 PolarHBondContact O-N 2.97Å; L807-G809 VanDerWaalsContact O-N 3.12Å; L807-L810 HydrophobicContact CD2-CD1 4.36Å; L807-L810 PolarHBondContact O-N 2.99Å; L807-L813 HydrophobicContact CD2-CD2 3.98Å; L807-L816 HydrophobicContact CD1-CD2 3.96Å; L807-L816 HydrophobicContact CD2-CD1 4.37Å; L807-L816 HydrophobicContact CD2-CD2 4.09Å; L807-L831 HydrophobicContact CD1-CD1 3.81Å; L807-A834 HydrophobicContact CB-CB 4.04Å; L807-A834 HydrophobicContact CD1-CB 4.09Å; L807-L838 HydrophobicContact CD1-CD1 4.44Å; L807-L838 HydrophobicContact CD2-CD1 4.18Å; L807-L838 WeakPolarHBondContact O-CD2 3.37Å
808	P	93.6	Very high	94.3	Very high	49 Å²	49	34.5 Å²	34.5	32%	0.318	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-57.7	-25.6	177	-27.8	36.3	0	0	0	115.1	W804 D805 L806 L810 H811 S837	W804-P808 WeakPolarHBondContact O-CD 3.29Å; D805-P808 WeakPolarHBondContact O-CD 3.46Å; L806-P808 VanDerWaalsContact C-CD 3.4Å; L806-P808 VanDerWaalsContact C-N 3.28Å; P808-L810 VanDerWaalsContact C-N 3.32Å; P808-H811 PolarHBondContact O-CE1 2.73Å; P808-H811 PolarHBondContact O-ND1 2.82Å; P808-H811 PolarHBondContact O-NE2 3.35Å; P808-S837 VanDerWaalsContact CA-OG 3.28Å; P808-S837 WeakPolarHBondContact CA-OG 3.35Å; P808-S837 WeakPolarHBondContact CB-OG 3.48Å
809	G	93	Very high	94.4	Very high	7 Å²	7	32.5 Å²	32.5	7%	0.072	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-81.9	-3.8	175	0	0	0	0	0	114.7	L806 L807	L806-G809 PolarHBondContact O-N 2.96Å; L807-G809 PolarHBondContact O-N 2.97Å; L807-G809 VanDerWaalsContact O-N 3.12Å
810	L	94.9	Very high	94.3	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	18%	0.181	C	C	.	.			trans	-103.5	54.4	-177.9	-59.8	-175.1	0	0	0	112.3	L751 V755 V781 L784 L787 L806 L807 P808 N812 L813 L838	L751-L810 HydrophobicContact CD2-CD1 4.41Å; V755-L810 HydrophobicContact CG2-CD2 3.61Å; V755-L810 HydrophobicContact CG2-CG 4.31Å; V781-L810 HydrophobicContact CG1-CD2 3.68Å; L784-L810 HydrophobicContact CD2-CD1 4.15Å; L784-L810 HydrophobicContact CD2-CD2 4.11Å; L787-L810 HydrophobicContact CD2-CD1 4.33Å; L806-L810 HydrophobicContact CD1-CD1 3.57Å; L806-L810 HydrophobicContact CD1-CG 4.1Å; L807-L810 HydrophobicContact CD2-CD1 4.36Å; L807-L810 PolarHBondContact O-N 2.99Å; P808-L810 VanDerWaalsContact C-N 3.32Å; L810-N812 PolarHBondContact O-N 3.09Å; L810-L813 HydrophobicContact CB-CB 4.18Å; L810-L813 HydrophobicContact CD1-CD2 4.48Å; L810-L813 VanDerWaalsContact O-CB 3.29Å; L810-L813 WeakPolarHBondContact O-CB 3.23Å; L810-L813 PolarHBondContact O-N 2.97Å; L810-L838 VanDerWaalsContact O-CD2 3.29Å; L810-L838 WeakPolarHBondContact O-CD2 3.45Å
811	H	91.4	Very high	94.2	Very high	98 Å²	98	34.4 Å²	34.4	45%	0.454	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.6	-172.1	-52.4	-68.3	0	0	0	115.7	P808 S840	P808-H811 PolarHBondContact O-CE1 2.73Å; P808-H811 PolarHBondContact O-ND1 2.82Å; P808-H811 PolarHBondContact O-NE2 3.35Å; H811-S840 WeakPolarHBondContact O-CB 3.36Å; H811-S840 PolarHBondContact O-OG 3.06Å
812	N	94.3	Very high	94.1	Very high	65 Å²	65	37.1 Å²	37.1	35%	0.348	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	3.1	-178.7	-68.8	-19.9	0	0	0	113.4	K782 Y785 L810 Q814	K782-N812 VanDerWaalsContact O-CB 3.32Å; K782-N812 WeakPolarHBondContact O-CB 3.36Å; K782-N812 PolarHBondContact O-ND2 3.13Å; Y785-N812 HydrophobicContact CD1-CB 4.4Å; Y785-N812 WeakPolarHBondContact CD1-O 3.3Å; Y785-N812 HydrophobicContact CE1-CB 4.21Å; L810-N812 PolarHBondContact O-N 3.09Å; N812-Q814 PolarHBondContact O-N 2.64Å
813	L	96.8	Very high	94.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.176	C	C	.	.			trans	-63.2	124.1	-179.8	-167.8	70.2	0	0	0	110.5	L784 L787 L807 L810 L816 L838 S840 L841	L784-L813 HydrophobicContact CG-CD1 4.38Å; L787-L813 HydrophobicContact CB-CD1 3.83Å; L787-L813 HydrophobicContact CB-CD2 4.42Å; L807-L813 HydrophobicContact CD2-CD2 3.98Å; L810-L813 HydrophobicContact CB-CB 4.18Å; L810-L813 HydrophobicContact CD1-CD2 4.48Å; L810-L813 VanDerWaalsContact O-CB 3.29Å; L810-L813 WeakPolarHBondContact O-CB 3.23Å; L810-L813 PolarHBondContact O-N 2.97Å; L813-L816 HydrophobicContact CD2-CB 4.02Å; L813-L816 HydrophobicContact CD2-CD1 4.27Å; L813-L838 HydrophobicContact CB-CD2 4.49Å; L813-S840 CarbonylContact O-C 3.58Å; L813-S840 VanDerWaalsContact O-C 3.3Å; L813-L841 WeakPolarHBondContact O-CA 3.5Å; L813-L841 PolarHBondContact O-N 2.96Å
814	Q	97.1	Very high	94.1	Very high	66 Å²	66	35.7 Å²	35.7	31%	0.308	18%	0.184	S	C	.	.			trans	-103	-32.8	-180	-68	167.9	5.4	0	0	111.5	Y785 N812 E842 V843	Y785-Q814 HydrophobicContact CD1-CG 4.45Å; Y785-Q814 WeakPolarHBondContact O-CA 3.4Å; Y785-Q814 PolarHBondContact O-N 2.9Å; N812-Q814 PolarHBondContact O-N 2.64Å; Q814-E842 HydrophobicContact CB-CB 4.47Å; Q814-E842 WeakPolarHBondContact O-CA 3.38Å; Q814-E842 WeakPolarHBondContact O-CB 3.42Å; Q814-E842 PolarHBondContact O-N 3.06Å; Q814-V843 PolarHBondContact O-N 3Å
815	H	97.6	Very high	94.2	Very high	34 Å²	34	38 Å²	38	16%	0.157	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	120.7	-178.8	169.3	-65.4	0	0	0	110.7	Y785 K786 L787 D817 V843	Y785-H815 PolarHBondContact O-N 2.91Å; K786-H815 HydrophobicContact CB-CB 4.33Å; K786-H815 WeakPolarHBondContact CE-CE1 3.45Å; K786-H815 VanDerWaalsContact CE-NE2 3.26Å; K786-H815 WeakPolarHBondContact CE-NE2 3.29Å; K786-H815 HydrophobicContact CG-CB 3.94Å; K786-H815 WeakPolarHBondContact CG-ND1 3.43Å; L787-H815 PolarHBondContact N-O 3.47Å; H815-D817 WeakPolarHBondContact CE1-CB 3.46Å; H815-V843 WeakPolarHBondContact CA-O 3.39Å; H815-V843 HydrophobicContact CB-CB 4.35Å
816	L	97.2	Very high	94.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	116.2	171.1	179	59.1	0	0	0	109.5	L787 L807 L813 V818 L831 L841 V843 L844 N845	L787-L816 HydrophobicContact CB-CD1 4.4Å; L787-L816 HydrophobicContact CD2-CD1 4.13Å; L787-L816 HydrophobicContact CG-CD1 4.32Å; L807-L816 HydrophobicContact CD1-CD2 3.96Å; L807-L816 HydrophobicContact CD2-CD1 4.37Å; L807-L816 HydrophobicContact CD2-CD2 4.09Å; L813-L816 HydrophobicContact CD2-CB 4.02Å; L813-L816 HydrophobicContact CD2-CD1 4.27Å; L816-V818 HydrophobicContact CD1-CG2 3.65Å; L816-V818 HydrophobicContact CD2-CG2 4.27Å; L816-V818 HydrophobicContact CG-CG2 3.74Å; L816-L831 HydrophobicContact CD2-CD1 4.27Å; L816-L841 HydrophobicContact CB-CD1 3.88Å; L816-V843 PolarHBondContact N-O 2.99Å; L816-L844 HydrophobicContact CB-CD1 4.15Å; L816-L844 HydrophobicContact CD2-CD1 4Å; L816-L844 HydrophobicContact CG-CD1 4.13Å; L816-L844 WeakPolarHBondContact O-CA 3.22Å; L816-N845 PolarHBondContact O-N 3.13Å
817	D	96.2	Very high	94.2	Very high	33 Å²	33	41 Å²	41	18%	0.176	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	119.8	172.5	-171.1	-19.9	0	0	0	110.2	L787 E788 F789 H815 E819 N845	L787-D817 PolarHBondContact O-N 3.37Å; E788-D817 HydrophobicContact CG-CB 4.5Å; F789-D817 VanDerWaalsContact CB-O 3.29Å; F789-D817 WeakPolarHBondContact CB-O 3.26Å; F789-D817 PolarHBondContact N-O 2.83Å; H815-D817 WeakPolarHBondContact CE1-CB 3.46Å; D817-E819 VanDerWaalsContact OD1-CB 3.31Å; D817-E819 WeakPolarHBondContact OD1-CB 3.41Å; D817-E819 PolarHBondContact OD1-N 2.59Å; D817-N845 HydrophobicContact CB-CB 4.11Å; D817-N845 VanDerWaalsContact CG-ND2 3.26Å; D817-N845 PolarHBondContact OD1-ND2 3.22Å; D817-N845 VanDerWaalsContact OD1-ND2 3.09Å; D817-N845 PolarHBondContact OD2-ND2 3.21Å
818	V	94.3	Very high	94.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.			trans	-130.5	37.2	178.8	-156.7	0	0	0	0	110.2	F789 L800 L803 W804 L816 S821 I823 N845 L846 N849	F789-V818 HydrophobicContact CB-CB 4.47Å; F789-V818 HydrophobicContact CB-CG1 4.11Å; F789-V818 HydrophobicContact CD1-CG1 3.81Å; F789-V818 HydrophobicContact CE1-CG1 4.33Å; F789-V818 HydrophobicContact CG-CG1 3.99Å; L800-V818 HydrophobicContact CD2-CG1 3.78Å; L803-V818 HydrophobicContact CD2-CG1 4.31Å; L803-V818 HydrophobicContact CD2-CG2 4.31Å; W804-V818 HydrophobicContact CH2-CG1 4.2Å; W804-V818 HydrophobicContact CH2-CG2 4.5Å; L816-V818 HydrophobicContact CD1-CG2 3.65Å; L816-V818 HydrophobicContact CD2-CG2 4.27Å; L816-V818 HydrophobicContact CG-CG2 3.74Å; V818-S821 PolarHBondContact O-OG 3Å; V818-I823 HydrophobicContact CB-CD1 4.12Å; V818-I823 HydrophobicContact CG1-CD1 3.92Å; V818-I823 HydrophobicContact CG1-CG1 4.48Å; V818-N845 PolarHBondContact N-O 2.94Å; V818-L846 HydrophobicContact CB-CD2 4.47Å; V818-N849 PolarHBondContact O-ND2 3.01Å; V818-N849 PolarHBondContact O-OD1 3.06Å
819	E	92.3	Very high	94.3	Very high	74 Å²	74	42.3 Å²	42.3	35%	0.346	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	147.5	178.1	179.6	168.8	168.3	0	0	113	D817 S821 N845 S847	D817-E819 VanDerWaalsContact OD1-CB 3.31Å; D817-E819 WeakPolarHBondContact OD1-CB 3.41Å; D817-E819 PolarHBondContact OD1-N 2.59Å; E819-S821 VanDerWaalsContact C-N 3.29Å; E819-S821 PolarHBondContact O-N 2.9Å; E819-S821 VanDerWaalsContact O-N 3.13Å; E819-S821 PolarHBondContact O-OG 3.24Å; E819-N845 PolarHBondContact OE2-ND2 3.37Å; E819-S847 CarbonylContact C-O 3.51Å; E819-S847 WeakPolarHBondContact CA-O 3.31Å
820	N	90.1	Very high	94.4	Very high	50 Å²	50	47.2 Å²	47.2	27%	0.267	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	41.4	170.3	-173.7	36.7	0	0	0	114.6	P793 S847 E848	P793-N820 WeakPolarHBondContact CG-ND2 3.35Å; N820-S847 PolarHBondContact N-O 2.73Å; N820-E848 WeakPolarHBondContact CA-O 3.39Å; N820-E848 HydrophobicContact CB-CB 3.92Å
821	S	90.4	Very high	94.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.228	C	C	.	.	S	Bend	trans	-110.5	7	-172.6	-70.2	0	0	0	0	114.4	F789 S796 V818 E819 I823 N849	F789-S821 WeakPolarHBondContact CD1-OG 3.26Å; F789-S821 VanDerWaalsContact CE1-OG 3.24Å; F789-S821 WeakPolarHBondContact CE1-OG 3.02Å; S796-S821 VanDerWaalsContact CB-O 3.23Å; S796-S821 WeakPolarHBondContact CB-O 3.31Å; V818-S821 PolarHBondContact O-OG 3Å; E819-S821 VanDerWaalsContact C-N 3.29Å; E819-S821 PolarHBondContact O-N 2.9Å; E819-S821 VanDerWaalsContact O-N 3.13Å; E819-S821 PolarHBondContact O-OG 3.24Å; S821-I823 VanDerWaalsContact C-N 3.25Å; S821-I823 PolarHBondContact O-N 2.97Å; S821-N849 VanDerWaalsContact CA-OD1 3.31Å; S821-N849 WeakPolarHBondContact CA-OD1 3.46Å; S821-N849 WeakPolarHBondContact CB-OD1 3.5Å; S821-N849 PolarHBondContact N-OD1 2.68Å
822	K	89.6	Confident	94.6	Very high	107 Å²	107	42.7 Å²	42.7	47%	0.465	21%	0.208	S	C	.	.			trans	50.5	42.6	-177.8	-61.8	-178.1	-175.8	152.9	0	113.2	P793 G824 N849	P793-K822 HydrophobicContact CB-CD 4.04Å; P793-K822 VanDerWaalsContact CB-CE 3.44Å; P793-K822 HydrophobicContact CB-CG 4.08Å; P793-K822 VanDerWaalsContact O-CD 3.3Å; P793-K822 WeakPolarHBondContact O-CD 3.29Å; P793-K822 WeakPolarHBondContact O-CE 3.32Å; P793-K822 PolarHBondContact O-NZ 3.22Å; K822-G824 VanDerWaalsContact C-N 3.32Å; K822-G824 PolarHBondContact O-N 3.48Å; K822-N849 PolarHBondContact N-OD1 3.18Å
823	I	93.8	Very high	94.6	Very high	11 Å²	11	45.2 Å²	45.2	6%	0.056	22%	0.222	C	C	.	.			trans	-56.9	-45.2	-178.9	-65	172	0	0	0	111.5	L800 W804 V818 S821 G827 A828 L846 N849	L800-I823 HydrophobicContact CD1-CB 4.44Å; L800-I823 HydrophobicContact CD1-CG1 3.85Å; L800-I823 HydrophobicContact CD2-CG1 4.39Å; W804-I823 HydrophobicContact CH2-CD1 4.13Å; W804-I823 HydrophobicContact CH2-CG1 4.48Å; W804-I823 HydrophobicContact CZ2-CD1 4.31Å; W804-I823 HydrophobicContact CZ2-CG1 4.22Å; W804-I823 HydrophobicContact CZ2-CG2 4.24Å; V818-I823 HydrophobicContact CB-CD1 4.12Å; V818-I823 HydrophobicContact CG1-CD1 3.92Å; V818-I823 HydrophobicContact CG1-CG1 4.48Å; S821-I823 VanDerWaalsContact C-N 3.25Å; S821-I823 PolarHBondContact O-N 2.97Å; I823-G827 VanDerWaalsContact O-CA 3.32Å; I823-G827 WeakPolarHBondContact O-CA 3.26Å; I823-G827 PolarHBondContact O-N 3.16Å; I823-A828 HydrophobicContact CG2-CB 4.4Å; I823-A828 VanDerWaalsContact CG2-N 3.28Å; I823-L846 HydrophobicContact CD1-CD2 3.81Å; I823-N849 HydrophobicContact CB-CB 4.04Å; I823-N849 HydrophobicContact CD1-CB 4.16Å; I823-N849 VanDerWaalsContact CD1-CG 3.45Å; I823-N849 WeakPolarHBondContact CD1-ND2 3.34Å; I823-N849 HydrophobicContact CG1-CB 4.23Å; I823-N849 VanDerWaalsContact CG1-OD1 3.29Å; I823-N849 WeakPolarHBondContact CG1-OD1 3.39Å; I823-N849 PolarHBondContact N-O 2.94Å; I823-N849 PolarHBondContact N-OD1 3.36Å
824	G	94.8	Very high	94.5	Very high	18 Å²	18	45.6 Å²	45.6	19%	0.186	23%	0.225	C	C	.	.	H	α-helix	trans	60	-178.1	-175.3	0	0	0	0	0	114.1	K822 K826 G827 A828 N849	K822-G824 VanDerWaalsContact C-N 3.32Å; K822-G824 PolarHBondContact O-N 3.48Å; G824-K826 PolarHBondContact O-N 3.2Å; G824-G827 PolarHBondContact O-N 3.46Å; G824-A828 WeakPolarHBondContact O-CB 3.4Å; G824-A828 PolarHBondContact O-N 2.95Å; G824-N849 PolarHBondContact N-O 3.41Å
825	D	96.1	Very high	94.3	Very high	59 Å²	59	42.4 Å²	42.4	32%	0.316	21%	0.21	S	C	.	.	H	α-helix	trans	-63.8	-41.1	-175.9	-72.1	-24.8	0	0	0	113.7	A828 E829 G852 Q854 G855	D825-A828 PolarHBondContact O-N 3.37Å; D825-E829 PolarHBondContact O-N 3.06Å; D825-G852 VanDerWaalsContact OD1-C 3.32Å; D825-G852 VanDerWaalsContact OD1-CA 3.24Å; D825-G852 WeakPolarHBondContact OD1-CA 3.24Å; D825-G852 PolarHBondContact OD1-N 3Å; D825-Q854 HydrophobicContact CB-CB 4.5Å; D825-G855 VanDerWaalsContact CG-N 3.35Å; D825-G855 WeakPolarHBondContact OD1-CA 3.18Å; D825-G855 PolarHBondContact OD1-N 3.21Å
826	K	94.4	Very high	93.9	Very high	178 Å²	178	44.9 Å²	44.9	77%	0.774	23%	0.227	S	C	*	.	H	α-helix	trans	-66.1	-38.7	178.6	-68.7	-176.3	178.9	-179.2	0	112.1	G824 K830	G824-K826 PolarHBondContact O-N 3.2Å; K826-K830 PolarHBondContact O-N 2.98Å
827	G	94.4	Very high	93.5	Very high	9 Å²	9	46.1 Å²	46.1	9%	0.093	24%	0.236	C	C	.	.	H	α-helix	trans	-68.7	-38.2	175.2	0	0	0	0	0	111.6	I823 G824 E829 K830 L831	I823-G827 VanDerWaalsContact O-CA 3.32Å; I823-G827 WeakPolarHBondContact O-CA 3.26Å; I823-G827 PolarHBondContact O-N 3.16Å; G824-G827 PolarHBondContact O-N 3.46Å; G827-E829 VanDerWaalsContact C-N 3.33Å; G827-E829 PolarHBondContact O-N 3.29Å; G827-K830 PolarHBondContact O-N 3.35Å; G827-L831 WeakPolarHBondContact O-CB 3.44Å; G827-L831 PolarHBondContact O-N 3.5Å
828	A	96.1	Very high	93.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-38	176.3	0	0	0	0	0	112	I823 G824 D825 L831 A832 I851 L859	I823-A828 HydrophobicContact CG2-CB 4.4Å; I823-A828 VanDerWaalsContact CG2-N 3.28Å; G824-A828 WeakPolarHBondContact O-CB 3.4Å; G824-A828 PolarHBondContact O-N 2.95Å; D825-A828 PolarHBondContact O-N 3.37Å; A828-L831 PolarHBondContact O-N 2.93Å; A828-A832 WeakPolarHBondContact O-CB 3.39Å; A828-A832 PolarHBondContact O-N 3.17Å; A828-I851 HydrophobicContact CB-CD1 4.38Å; A828-I851 HydrophobicContact CB-CG1 4.41Å; A828-I851 HydrophobicContact CB-CG2 3.97Å; A828-L859 HydrophobicContact CB-CD1 3.86Å; A828-L859 HydrophobicContact CB-CG 4.04Å
829	E	95.8	Very high	93.3	Very high	77 Å²	77	49.8 Å²	49.8	36%	0.36	25%	0.252	S	S	.	.	H	α-helix	trans	-62.4	-44.7	172.1	178.6	169.9	-147.9	0	0	112.3	D825 G827 A832 N833 K858	D825-E829 PolarHBondContact O-N 3.06Å; G827-E829 VanDerWaalsContact C-N 3.33Å; G827-E829 PolarHBondContact O-N 3.29Å; E829-A832 WeakPolarHBondContact O-CB 3.46Å; E829-A832 PolarHBondContact O-N 2.76Å; E829-N833 PolarHBondContact O-N 3.47Å; E829-K858 HydrophobicContact CB-CB 4.34Å; E829-K858 HydrophobicContact CB-CG 4.22Å; E829-K858 HydrophobicContact CG-CD 4.23Å; E829-K858 HydrophobicContact CG-CG 4.25Å; E829-K858 WeakPolarHBondContact OE1-CE 3.32Å; E829-K858 IonicContact OE1-NZ 3.45Å; E829-K858 PolarHBondContact OE1-NZ 3.14Å
830	K	95.3	Very high	93.5	Very high	111 Å²	111	47.3 Å²	47.3	48%	0.483	24%	0.243	S	C	.	.	H	α-helix	trans	-63.9	-43.9	175.8	-71.7	-169.8	174.4	-164.1	0	112.2	W804 K826 G827 A832 N833 A834	W804-K830 HydrophobicContact CG-CB 4.12Å; K826-K830 PolarHBondContact O-N 2.98Å; G827-K830 PolarHBondContact O-N 3.35Å; K830-A832 VanDerWaalsContact C-N 3.33Å; K830-A832 PolarHBondContact O-N 3.22Å; K830-N833 PolarHBondContact O-N 3.43Å; K830-A834 PolarHBondContact O-N 3.3Å
831	L	95.8	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-45	175	173.3	60	0	0	0	110.8	W804 L807 L816 G827 A828 N833 A834 L835 L846 L859	W804-L831 HydrophobicContact CE3-CB 4.4Å; W804-L831 HydrophobicContact CE3-CD1 4.02Å; W804-L831 HydrophobicContact CH2-CB 4.22Å; W804-L831 HydrophobicContact CH2-CD1 4.23Å; W804-L831 HydrophobicContact CH2-CD2 4.29Å; W804-L831 HydrophobicContact CH2-CG 4.48Å; W804-L831 HydrophobicContact CZ2-CB 4.31Å; W804-L831 HydrophobicContact CZ3-CB 4.29Å; W804-L831 HydrophobicContact CZ3-CD1 3.67Å; W804-L831 HydrophobicContact CZ3-CG 4.36Å; L807-L831 HydrophobicContact CD1-CD1 3.81Å; L816-L831 HydrophobicContact CD2-CD1 4.27Å; G827-L831 WeakPolarHBondContact O-CB 3.44Å; G827-L831 PolarHBondContact O-N 3.5Å; A828-L831 PolarHBondContact O-N 2.93Å; L831-N833 PolarHBondContact O-N 3.27Å; L831-A834 CarbonylContact O-C 3.47Å; L831-A834 PolarHBondContact O-N 3.46Å; L831-L835 HydrophobicContact CD1-CD2 3.94Å; L831-L835 HydrophobicContact CD1-CG 3.92Å; L831-L835 HydrophobicContact CG-CD1 4.18Å; L831-L835 HydrophobicContact CG-CD2 4.48Å; L831-L835 HydrophobicContact CG-CG 4.08Å; L831-L835 WeakPolarHBondContact O-CG 3.24Å; L831-L835 PolarHBondContact O-N 2.79Å; L831-L846 HydrophobicContact CD2-CD1 3.85Å; L831-L846 HydrophobicContact CD2-CD2 3.46Å; L831-L846 VanDerWaalsContact CD2-CD2 3.46Å; L831-L846 HydrophobicContact CD2-CG 4.28Å; L831-L859 HydrophobicContact CD2-CD2 4.15Å; L831-L859 HydrophobicContact CG-CD2 4.24Å
832	A	95.3	Very high	94.2	Very high	5 Å²	5	47.8 Å²	47.8	4%	0.041	24%	0.243	C	C	.	.	H	α-helix	trans	-55	-40.5	178.1	0	0	0	0	0	112.3	A828 E829 K830 L835 K858 L859 A862	A828-A832 WeakPolarHBondContact O-CB 3.39Å; A828-A832 PolarHBondContact O-N 3.17Å; E829-A832 WeakPolarHBondContact O-CB 3.46Å; E829-A832 PolarHBondContact O-N 2.76Å; K830-A832 VanDerWaalsContact C-N 3.33Å; K830-A832 PolarHBondContact O-N 3.22Å; A832-L835 PolarHBondContact O-N 3.23Å; A832-K858 HydrophobicContact CB-CB 4.48Å; A832-L859 HydrophobicContact CB-CD2 4.2Å; A832-A862 HydrophobicContact CB-CB 4.03Å; A832-A862 VanDerWaalsContact O-CB 3.32Å; A832-A862 WeakPolarHBondContact O-CB 3.35Å
833	N	93.6	Very high	94.6	Very high	118 Å²	118	44.4 Å²	44.4	63%	0.631	23%	0.231	S	C	*	.	H	α-helix	trans	-65.7	-37.3	176	-63.8	-23	0	0	0	112.4	E829 K830 L831	E829-N833 PolarHBondContact O-N 3.47Å; K830-N833 PolarHBondContact O-N 3.43Å; L831-N833 PolarHBondContact O-N 3.27Å
834	A	93.7	Very high	94.8	Very high	7 Å²	7	43.9 Å²	43.9	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-76.4	-28.3	178.9	0	0	0	0	0	113.5	L807 K830 L831 V836 S837	L807-A834 HydrophobicContact CB-CB 4.04Å; L807-A834 HydrophobicContact CD1-CB 4.09Å; K830-A834 PolarHBondContact O-N 3.3Å; L831-A834 CarbonylContact O-C 3.47Å; L831-A834 PolarHBondContact O-N 3.46Å; A834-V836 PolarHBondContact O-N 2.92Å; A834-S837 PolarHBondContact O-N 2.93Å; A834-S837 PolarHBondContact O-OG 3.46Å
835	L	93.9	Very high	95	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-28.5	179.7	-74.4	177.7	0	0	0	112.6	L831 A832 S837 L838 L841 L844 L859 A862 L863 L866	L831-L835 HydrophobicContact CD1-CD2 3.94Å; L831-L835 HydrophobicContact CD1-CG 3.92Å; L831-L835 HydrophobicContact CG-CD1 4.18Å; L831-L835 HydrophobicContact CG-CD2 4.48Å; L831-L835 HydrophobicContact CG-CG 4.08Å; L831-L835 WeakPolarHBondContact O-CG 3.24Å; L831-L835 PolarHBondContact O-N 2.79Å; A832-L835 PolarHBondContact O-N 3.23Å; L835-S837 PolarHBondContact O-N 3.25Å; L835-S837 VanDerWaalsContact O-N 3.08Å; L835-L838 HydrophobicContact CD2-CD1 4.06Å; L835-L838 PolarHBondContact O-N 2.84Å; L835-L841 HydrophobicContact CD2-CD2 3.76Å; L835-L844 HydrophobicContact CD1-CD2 4.02Å; L835-L844 HydrophobicContact CD2-CD2 4.21Å; L835-L859 HydrophobicContact CD1-CD2 4.12Å; L835-A862 HydrophobicContact CB-CB 4.34Å; L835-L863 HydrophobicContact CD1-CD2 4.3Å; L835-L866 HydrophobicContact CD1-CD1 4.46Å; L835-L866 HydrophobicContact CD2-CD1 4.48Å; L835-L866 WeakPolarHBondContact O-CD2 3.38Å
836	V	89.5	Confident	95	Very high	85 Å²	85	41.3 Å²	41.3	52%	0.515	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.7	-178.1	-176.9	0	0	0	0	112.4	A834 H839	A834-V836 PolarHBondContact O-N 2.92Å; V836-H839 PolarHBondContact O-CE1 2.96Å
837	S	88.1	Confident	95	Very high	27 Å²	27	33 Å²	33	19%	0.189	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-16.9	176.6	23.2	0	0	0	0	114.8	P808 A834 L835 H839	P808-S837 VanDerWaalsContact CA-OG 3.28Å; P808-S837 WeakPolarHBondContact CA-OG 3.35Å; P808-S837 WeakPolarHBondContact CB-OG 3.48Å; A834-S837 PolarHBondContact O-N 2.93Å; A834-S837 PolarHBondContact O-OG 3.46Å; L835-S837 PolarHBondContact O-N 3.25Å; L835-S837 VanDerWaalsContact O-N 3.08Å; S837-H839 PolarHBondContact O-N 3.22Å; S837-H839 PolarHBondContact O-ND1 3.38Å; S837-H839 VanDerWaalsContact O-ND1 3.15Å
838	L	94.1	Very high	95	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.			trans	-94.2	61	-168.2	-59.4	-176.7	0	0	0	113.1	L807 L810 L813 L835 S840 L841 L866	L807-L838 HydrophobicContact CD1-CD1 4.44Å; L807-L838 HydrophobicContact CD2-CD1 4.18Å; L807-L838 WeakPolarHBondContact O-CD2 3.37Å; L810-L838 VanDerWaalsContact O-CD2 3.29Å; L810-L838 WeakPolarHBondContact O-CD2 3.45Å; L813-L838 HydrophobicContact CB-CD2 4.49Å; L835-L838 HydrophobicContact CD2-CD1 4.06Å; L835-L838 PolarHBondContact O-N 2.84Å; L838-S840 PolarHBondContact O-N 3.01Å; L838-S840 VanDerWaalsContact O-N 3.1Å; L838-L841 HydrophobicContact CB-CB 4.14Å; L838-L841 HydrophobicContact CD1-CD2 4.47Å; L838-L841 WeakPolarHBondContact O-CB 3.19Å; L838-L841 PolarHBondContact O-N 3.22Å; L838-L841 VanDerWaalsContact O-N 3.09Å; L838-L866 WeakPolarHBondContact O-CD2 3.31Å
839	H	93.2	Very high	95	Very high	110 Å²	110	35.3 Å²	35.3	51%	0.509	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.4	-177	-61.6	78.6	0	0	0	114.3	V836 S837	V836-H839 PolarHBondContact O-CE1 2.96Å; S837-H839 PolarHBondContact O-N 3.22Å; S837-H839 PolarHBondContact O-ND1 3.38Å; S837-H839 VanDerWaalsContact O-ND1 3.15Å
840	S	96.3	Very high	94.9	Very high	22 Å²	22	35.4 Å²	35.4	15%	0.154	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.4	178.3	-61.5	0	0	0	0	114	H811 L813 L838 E842	H811-S840 WeakPolarHBondContact O-CB 3.36Å; H811-S840 PolarHBondContact O-OG 3.06Å; L813-S840 CarbonylContact O-C 3.58Å; L813-S840 VanDerWaalsContact O-C 3.3Å; L838-S840 PolarHBondContact O-N 3.01Å; L838-S840 VanDerWaalsContact O-N 3.1Å; S840-E842 PolarHBondContact O-N 3.27Å
841	L	97.6	Very high	95	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.169	C	C	.	.			trans	-68.5	125.2	-173.6	-164.2	71.3	0	0	0	111.5	L813 L816 L835 L838 L844 L866 K868 L869	L813-L841 WeakPolarHBondContact O-CA 3.5Å; L813-L841 PolarHBondContact O-N 2.96Å; L816-L841 HydrophobicContact CB-CD1 3.88Å; L835-L841 HydrophobicContact CD2-CD2 3.76Å; L838-L841 HydrophobicContact CB-CB 4.14Å; L838-L841 HydrophobicContact CD1-CD2 4.47Å; L838-L841 WeakPolarHBondContact O-CB 3.19Å; L838-L841 PolarHBondContact O-N 3.22Å; L838-L841 VanDerWaalsContact O-N 3.09Å; L841-L844 HydrophobicContact CD2-CB 4.16Å; L841-L844 HydrophobicContact CD2-CD1 4.44Å; L841-L844 HydrophobicContact CD2-CD2 4.43Å; L841-L866 HydrophobicContact CD2-CD1 4.24Å; L841-K868 CarbonylContact O-C 3.57Å; L841-L869 HydrophobicContact CD2-CD1 4.38Å; L841-L869 HydrophobicContact CG-CD1 4.35Å; L841-L869 VanDerWaalsContact O-CA 3.26Å; L841-L869 WeakPolarHBondContact O-CA 3.39Å; L841-L869 PolarHBondContact O-N 2.81Å
842	E	97.6	Very high	95.1	Very high	60 Å²	60	30.5 Å²	30.5	28%	0.28	17%	0.173	S	C	.	.			trans	-110.4	-37.7	-176.7	-74.8	176.8	-166	0	0	111.8	Q814 S840 K868 H870 C871	Q814-E842 HydrophobicContact CB-CB 4.47Å; Q814-E842 WeakPolarHBondContact O-CA 3.38Å; Q814-E842 WeakPolarHBondContact O-CB 3.42Å; Q814-E842 PolarHBondContact O-N 3.06Å; S840-E842 PolarHBondContact O-N 3.27Å; E842-K868 HydrophobicContact CG-CB 4.06Å; E842-H870 PolarHBondContact O-N 3.11Å; E842-C871 PolarHBondContact O-N 3.01Å
843	V	98.1	Very high	95.2	Very high	35 Å²	35	31.6 Å²	31.6	21%	0.212	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.6	-178.1	-176.5	0	0	0	0	110.4	Q814 H815 L816 C871	Q814-V843 PolarHBondContact O-N 3Å; H815-V843 WeakPolarHBondContact CA-O 3.39Å; H815-V843 HydrophobicContact CB-CB 4.35Å; L816-V843 PolarHBondContact N-O 2.99Å; V843-C871 WeakPolarHBondContact CA-O 3.24Å; V843-C871 HydrophobicContact CB-CB 4.4Å; V843-C871 HydrophobicContact CG1-CB 4.15Å; V843-C871 HydrophobicContact CG2-CB 4.07Å
844	L	97.9	Very high	95.3	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	112.6	173.9	-179.7	57.5	0	0	0	110.5	L816 L835 L841 L846 L863 L869 C871 L872 S873	L816-L844 HydrophobicContact CB-CD1 4.15Å; L816-L844 HydrophobicContact CD2-CD1 4Å; L816-L844 HydrophobicContact CG-CD1 4.13Å; L816-L844 WeakPolarHBondContact O-CA 3.22Å; L835-L844 HydrophobicContact CD1-CD2 4.02Å; L835-L844 HydrophobicContact CD2-CD2 4.21Å; L841-L844 HydrophobicContact CD2-CB 4.16Å; L841-L844 HydrophobicContact CD2-CD1 4.44Å; L841-L844 HydrophobicContact CD2-CD2 4.43Å; L844-L846 HydrophobicContact CD1-CD1 4.44Å; L844-L846 HydrophobicContact CD1-CD2 4.08Å; L844-L846 HydrophobicContact CD1-CG 4.03Å; L844-L846 HydrophobicContact CD2-CD1 4.01Å; L844-L846 HydrophobicContact CD2-CG 4.4Å; L844-L846 HydrophobicContact CG-CD1 4.13Å; L844-L846 HydrophobicContact CG-CG 3.97Å; L844-L863 HydrophobicContact CD2-CD2 3.9Å; L844-L869 HydrophobicContact CB-CD1 3.8Å; L844-C871 PolarHBondContact N-O 3.09Å; L844-L872 HydrophobicContact CB-CD1 4.12Å; L844-L872 HydrophobicContact CD2-CD1 4.02Å; L844-L872 HydrophobicContact CG-CD1 4.08Å; L844-L872 WeakPolarHBondContact O-CA 3.36Å; L844-S873 PolarHBondContact O-N 3.25Å
845	N	97.5	Very high	95.5	Very high	21 Å²	21	30.1 Å²	30.1	11%	0.112	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	113.6	174.8	-175.7	11	0	0	0	110.6	L816 D817 V818 E819 S847	L816-N845 PolarHBondContact O-N 3.13Å; D817-N845 HydrophobicContact CB-CB 4.11Å; D817-N845 VanDerWaalsContact CG-ND2 3.26Å; D817-N845 PolarHBondContact OD1-ND2 3.22Å; D817-N845 VanDerWaalsContact OD1-ND2 3.09Å; D817-N845 PolarHBondContact OD2-ND2 3.21Å; V818-N845 PolarHBondContact N-O 2.94Å; E819-N845 PolarHBondContact OE2-ND2 3.37Å; N845-S847 VanDerWaalsContact OD1-CB 3.26Å; N845-S847 WeakPolarHBondContact OD1-CB 3.46Å; N845-S847 PolarHBondContact OD1-N 2.58Å; N845-S847 VanDerWaalsContact OD1-N 3.11Å; N845-S847 PolarHBondContact OD1-OG 3.11Å
846	L	96.9	Very high	95.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.166	C	C	.	.			trans	-120.8	27.4	177.1	-63	175.8	0	0	0	111.8	V818 I823 L831 L844 N849 I851 L859 S873 L874 N877	V818-L846 HydrophobicContact CB-CD2 4.47Å; I823-L846 HydrophobicContact CD1-CD2 3.81Å; L831-L846 HydrophobicContact CD2-CD1 3.85Å; L831-L846 HydrophobicContact CD2-CD2 3.46Å; L831-L846 VanDerWaalsContact CD2-CD2 3.46Å; L831-L846 HydrophobicContact CD2-CG 4.28Å; L844-L846 HydrophobicContact CD1-CD1 4.44Å; L844-L846 HydrophobicContact CD1-CD2 4.08Å; L844-L846 HydrophobicContact CD1-CG 4.03Å; L844-L846 HydrophobicContact CD2-CD1 4.01Å; L844-L846 HydrophobicContact CD2-CG 4.4Å; L844-L846 HydrophobicContact CG-CD1 4.13Å; L844-L846 HydrophobicContact CG-CG 3.97Å; L846-N849 WeakPolarHBondContact CA-ND2 3.39Å; L846-N849 WeakPolarHBondContact O-CB 3.5Å; L846-N849 PolarHBondContact O-ND2 2.97Å; L846-I851 HydrophobicContact CB-CD1 4.13Å; L846-I851 HydrophobicContact CD1-CD1 4.39Å; L846-L859 HydrophobicContact CD1-CD1 3.9Å; L846-L859 HydrophobicContact CD1-CD2 4.33Å; L846-S873 CarbonylContact C-O 3.59Å; L846-S873 WeakPolarHBondContact CA-O 3.41Å; L846-S873 PolarHBondContact N-O 2.86Å; L846-L874 HydrophobicContact CB-CD2 4Å; L846-L874 HydrophobicContact CD1-CD2 4.18Å; L846-N877 PolarHBondContact O-ND2 2.85Å
847	S	95.4	Very high	96	Very high	4 Å²	4	30.9 Å²	30.9	3%	0.028	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	150.8	-178.1	-52.5	0	0	0	0	112.7	E819 N820 N845 N849 S873 Y875	E819-S847 CarbonylContact C-O 3.51Å; E819-S847 WeakPolarHBondContact CA-O 3.31Å; N820-S847 PolarHBondContact N-O 2.73Å; N845-S847 VanDerWaalsContact OD1-CB 3.26Å; N845-S847 WeakPolarHBondContact OD1-CB 3.46Å; N845-S847 PolarHBondContact OD1-N 2.58Å; N845-S847 VanDerWaalsContact OD1-N 3.11Å; N845-S847 PolarHBondContact OD1-OG 3.11Å; S847-N849 VanDerWaalsContact C-N 3.34Å; S847-N849 PolarHBondContact O-N 3.07Å; S847-N849 PolarHBondContact O-ND2 3.36Å; S847-S873 WeakPolarHBondContact OG-CB 3.44Å; S847-S873 PolarHBondContact OG-OG 3.47Å; S847-Y875 CarbonylContact C-O 3.24Å; S847-Y875 WeakPolarHBondContact CA-O 3.5Å
848	E	94	Very high	96.4	Very high	58 Å²	58	33.7 Å²	33.7	27%	0.271	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	33.6	173.7	-65	-169.4	-151.9	0	0	115.4	N820 Y875 S876	N820-E848 WeakPolarHBondContact CA-O 3.39Å; N820-E848 HydrophobicContact CB-CB 3.92Å; E848-Y875 HydrophobicContact CG-CD1 4.41Å; E848-Y875 HydrophobicContact CG-CE1 4.46Å; E848-Y875 PolarHBondContact N-O 2.86Å; E848-S876 VanDerWaalsContact CA-O 3.28Å; E848-S876 WeakPolarHBondContact CA-O 3.42Å; E848-S876 PolarHBondContact N-O 2.88Å
849	N	95.3	Very high	96.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-107.7	7.2	-169.4	-88.1	-53.2	0	0	0	116.8	V818 S821 K822 I823 G824 L846 S847 I851 N877	V818-N849 PolarHBondContact O-ND2 3.01Å; V818-N849 PolarHBondContact O-OD1 3.06Å; S821-N849 VanDerWaalsContact CA-OD1 3.31Å; S821-N849 WeakPolarHBondContact CA-OD1 3.46Å; S821-N849 WeakPolarHBondContact CB-OD1 3.5Å; S821-N849 PolarHBondContact N-OD1 2.68Å; K822-N849 PolarHBondContact N-OD1 3.18Å; I823-N849 HydrophobicContact CB-CB 4.04Å; I823-N849 HydrophobicContact CD1-CB 4.16Å; I823-N849 VanDerWaalsContact CD1-CG 3.45Å; I823-N849 WeakPolarHBondContact CD1-ND2 3.34Å; I823-N849 HydrophobicContact CG1-CB 4.23Å; I823-N849 VanDerWaalsContact CG1-OD1 3.29Å; I823-N849 WeakPolarHBondContact CG1-OD1 3.39Å; I823-N849 PolarHBondContact N-O 2.94Å; I823-N849 PolarHBondContact N-OD1 3.36Å; G824-N849 PolarHBondContact N-O 3.41Å; L846-N849 WeakPolarHBondContact CA-ND2 3.39Å; L846-N849 WeakPolarHBondContact O-CB 3.5Å; L846-N849 PolarHBondContact O-ND2 2.97Å; S847-N849 VanDerWaalsContact C-N 3.34Å; S847-N849 PolarHBondContact O-N 3.07Å; S847-N849 PolarHBondContact O-ND2 3.36Å; N849-I851 HydrophobicContact CB-CD1 3.86Å; N849-I851 HydrophobicContact CB-CG1 3.79Å; N849-I851 PolarHBondContact O-N 2.93Å; N849-N877 WeakPolarHBondContact CA-OD1 3.5Å; N849-N877 PolarHBondContact N-OD1 3.4Å; N849-N877 VanDerWaalsContact N-OD1 3.09Å
850	C	94.7	Very high	96.5	Very high	79 Å²	79	28.7 Å²	28.7	53%	0.534	15%	0.149	S	C	.	.			trans	55.6	30.1	-176.4	-55	0	0	0	0	113.9	N877 V878	C850-N877 PolarHBondContact N-OD1 3.02Å; C850-N877 VanDerWaalsContact N-OD1 3.15Å; C850-V878 HydrophobicContact CB-CG2 4.42Å
851	I	97	Very high	96.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.			trans	-76.5	129.2	177.9	-55.3	172	0	0	0	108.7	A828 L846 N849 V856 L859 N877 V878	A828-I851 HydrophobicContact CB-CD1 4.38Å; A828-I851 HydrophobicContact CB-CG1 4.41Å; A828-I851 HydrophobicContact CB-CG2 3.97Å; L846-I851 HydrophobicContact CB-CD1 4.13Å; L846-I851 HydrophobicContact CD1-CD1 4.39Å; N849-I851 HydrophobicContact CB-CD1 3.86Å; N849-I851 HydrophobicContact CB-CG1 3.79Å; N849-I851 PolarHBondContact O-N 2.93Å; I851-V856 HydrophobicContact CG2-CG2 3.99Å; I851-L859 HydrophobicContact CD1-CD1 4.29Å; I851-L859 HydrophobicContact CG2-CD1 4.39Å; I851-N877 HydrophobicContact CB-CB 4.45Å; I851-N877 PolarHBondContact N-OD1 3.43Å; I851-V878 CarbonylContact O-C 3.6Å; I851-V878 WeakPolarHBondContact O-CA 3.49Å; I851-V878 PolarHBondContact O-N 2.97Å
852	G	96.9	Very high	96.2	Very high	8 Å²	8	32.8 Å²	32.8	8%	0.082	17%	0.169	C	C	.	.			trans	-105.6	-167.3	176.3	0	0	0	0	0	112.5	D825 Q854 G855 V856	D825-G852 VanDerWaalsContact OD1-C 3.32Å; D825-G852 VanDerWaalsContact OD1-CA 3.24Å; D825-G852 WeakPolarHBondContact OD1-CA 3.24Å; D825-G852 PolarHBondContact OD1-N 3Å; G852-Q854 PolarHBondContact O-N 3.11Å; G852-G855 PolarHBondContact O-N 3.18Å; G852-V856 WeakPolarHBondContact O-CG2 3.44Å; G852-V856 PolarHBondContact O-N 2.99Å
853	D	97.6	Very high	96	Very high	28 Å²	28	30 Å²	30	15%	0.15	16%	0.156	C	C	.	.	H	α-helix	trans	-64.6	-37.7	-171.1	-58.4	-41.3	0	0	0	113.1	V856 K857 S880 E882 G883	D853-V856 PolarHBondContact O-N 2.96Å; D853-K857 VanDerWaalsContact O-CB 3.31Å; D853-K857 WeakPolarHBondContact O-CB 3.37Å; D853-K857 PolarHBondContact O-N 2.92Å; D853-S880 VanDerWaalsContact CG-OG 3.23Å; D853-S880 PolarHBondContact OD1-N 3.5Å; D853-S880 PolarHBondContact OD1-OG 2.89Å; D853-S880 WeakPolarHBondContact OD2-CB 3.49Å; D853-S880 PolarHBondContact OD2-OG 2.94Å; D853-E882 HydrophobicContact CB-CB 4.15Å; D853-E882 HydrophobicContact CB-CG 4.34Å; D853-G883 VanDerWaalsContact OD1-CA 3.24Å; D853-G883 WeakPolarHBondContact OD1-CA 3.46Å; D853-G883 PolarHBondContact OD1-N 2.89Å
854	Q	97.3	Very high	95.5	Very high	94 Å²	94	32.4 Å²	32.4	44%	0.439	16%	0.164	S	C	.	.	H	α-helix	trans	-68.4	-40.5	178.9	-62.5	-53.6	-47.3	0	0	111.9	D825 G852 K857 K858 E882	D825-Q854 HydrophobicContact CB-CB 4.5Å; G852-Q854 PolarHBondContact O-N 3.11Å; Q854-K857 PolarHBondContact O-N 3.3Å; Q854-K858 WeakPolarHBondContact O-CG 3.11Å; Q854-K858 PolarHBondContact O-N 2.84Å; Q854-E882 PolarHBondContact NE2-OE1 2.76Å
855	G	96.7	Very high	95.2	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-45.1	174.9	0	0	0	0	0	111.7	D825 G852 K857 K858 L859	D825-G855 VanDerWaalsContact CG-N 3.35Å; D825-G855 WeakPolarHBondContact OD1-CA 3.18Å; D825-G855 PolarHBondContact OD1-N 3.21Å; G852-G855 PolarHBondContact O-N 3.18Å; G855-K857 PolarHBondContact O-N 3.01Å; G855-K858 PolarHBondContact O-N 2.99Å; G855-L859 WeakPolarHBondContact O-CG 3.11Å; G855-L859 PolarHBondContact O-N 2.9Å
856	V	96.9	Very high	95	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.4	-42.9	175.7	169.6	0	0	0	0	112	I851 G852 D853 K858 L859 A860 I879 G883 L887	I851-V856 HydrophobicContact CG2-CG2 3.99Å; G852-V856 WeakPolarHBondContact O-CG2 3.44Å; G852-V856 PolarHBondContact O-N 2.99Å; D853-V856 PolarHBondContact O-N 2.96Å; V856-K858 VanDerWaalsContact C-N 3.26Å; V856-K858 PolarHBondContact O-N 2.95Å; V856-L859 PolarHBondContact O-N 2.58Å; V856-A860 VanDerWaalsContact O-CB 3.25Å; V856-A860 WeakPolarHBondContact O-CB 3.26Å; V856-A860 PolarHBondContact O-N 2.67Å; V856-I879 HydrophobicContact CG2-CD1 3.52Å; V856-I879 HydrophobicContact CG2-CG1 3.61Å; V856-I879 HydrophobicContact CG2-CG2 4.28Å; V856-G883 WeakPolarHBondContact CG1-O 3.26Å; V856-L887 HydrophobicContact CG1-CD1 3.66Å; V856-L887 HydrophobicContact CG1-CD2 3.94Å; V856-L887 HydrophobicContact CG1-CG 3.41Å; V856-L887 VanDerWaalsContact CG1-CG 3.41Å
857	K	96.5	Very high	94.8	Very high	101 Å²	101	39.8 Å²	39.8	44%	0.439	21%	0.207	S	C	.	.	H	α-helix	trans	-58.2	-39.9	176.9	-176.7	176.6	-176.8	172.7	0	112	D853 Q854 G855	D853-K857 VanDerWaalsContact O-CB 3.31Å; D853-K857 WeakPolarHBondContact O-CB 3.37Å; D853-K857 PolarHBondContact O-N 2.92Å; Q854-K857 PolarHBondContact O-N 3.3Å; G855-K857 PolarHBondContact O-N 3.01Å
858	K	96.6	Very high	94.8	Very high	86 Å²	86	44.3 Å²	44.3	37%	0.374	23%	0.226	S	C	.	.	H	α-helix	trans	-70.1	-45.4	175.4	-65.9	-74.9	-179.9	145.3	0	111.9	E829 A832 Q854 G855 V856 A860 L861	E829-K858 HydrophobicContact CB-CB 4.34Å; E829-K858 HydrophobicContact CB-CG 4.22Å; E829-K858 HydrophobicContact CG-CD 4.23Å; E829-K858 HydrophobicContact CG-CG 4.25Å; E829-K858 WeakPolarHBondContact OE1-CE 3.32Å; E829-K858 IonicContact OE1-NZ 3.45Å; E829-K858 PolarHBondContact OE1-NZ 3.14Å; A832-K858 HydrophobicContact CB-CB 4.48Å; Q854-K858 WeakPolarHBondContact O-CG 3.11Å; Q854-K858 PolarHBondContact O-N 2.84Å; G855-K858 PolarHBondContact O-N 2.99Å; V856-K858 VanDerWaalsContact C-N 3.26Å; V856-K858 PolarHBondContact O-N 2.95Å; K858-A860 VanDerWaalsContact C-N 3.35Å; K858-A860 PolarHBondContact O-N 3.17Å; K858-L861 PolarHBondContact O-N 3.44Å
859	L	96.4	Very high	95	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-59.1	-44.9	175.6	-73.3	169.3	0	0	0	111.6	A828 L831 A832 L835 L846 I851 G855 V856 L861 A862 L863	A828-L859 HydrophobicContact CB-CD1 3.86Å; A828-L859 HydrophobicContact CB-CG 4.04Å; L831-L859 HydrophobicContact CD2-CD2 4.15Å; L831-L859 HydrophobicContact CG-CD2 4.24Å; A832-L859 HydrophobicContact CB-CD2 4.2Å; L835-L859 HydrophobicContact CD1-CD2 4.12Å; L846-L859 HydrophobicContact CD1-CD1 3.9Å; L846-L859 HydrophobicContact CD1-CD2 4.33Å; I851-L859 HydrophobicContact CD1-CD1 4.29Å; I851-L859 HydrophobicContact CG2-CD1 4.39Å; G855-L859 WeakPolarHBondContact O-CG 3.11Å; G855-L859 PolarHBondContact O-N 2.9Å; V856-L859 PolarHBondContact O-N 2.58Å; L859-L861 PolarHBondContact O-N 3.34Å; L859-L861 VanDerWaalsContact O-N 3.17Å; L859-A862 PolarHBondContact O-N 3.24Å; L859-L863 HydrophobicContact CB-CD1 4.09Å; L859-L863 HydrophobicContact CB-CG 4.49Å; L859-L863 WeakPolarHBondContact O-CB 3.49Å; L859-L863 WeakPolarHBondContact O-CG 3.43Å; L859-L863 PolarHBondContact O-N 3.01Å
860	A	94.2	Very high	95	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-54	-36.4	179.3	0	0	0	0	0	112.7	V856 K858 A862 L887 V890	V856-A860 VanDerWaalsContact O-CB 3.25Å; V856-A860 WeakPolarHBondContact O-CB 3.26Å; V856-A860 PolarHBondContact O-N 2.67Å; K858-A860 VanDerWaalsContact C-N 3.35Å; K858-A860 PolarHBondContact O-N 3.17Å; A860-A862 VanDerWaalsContact C-N 3.34Å; A860-A862 PolarHBondContact O-N 2.88Å; A860-L887 HydrophobicContact CB-CD2 4.5Å; A860-V890 HydrophobicContact CB-CB 4.5Å; A860-V890 HydrophobicContact CB-CG1 4.09Å; A860-V890 HydrophobicContact CB-CG2 3.65Å
861	L	92.3	Very high	95.2	Very high	101 Å²	101	42.8 Å²	42.8	53%	0.529	22%	0.215	S	C	.	.	H	α-helix	trans	-67.2	-32	176.7	-66.7	173.4	0	0	0	113.1	K858 L859 K864	K858-L861 PolarHBondContact O-N 3.44Å; L859-L861 PolarHBondContact O-N 3.34Å; L859-L861 VanDerWaalsContact O-N 3.17Å; L861-K864 WeakPolarHBondContact O-CE 3.47Å; L861-K864 WeakPolarHBondContact O-CG 3.39Å
862	A	93.9	Very high	95.2	Very high	7 Å²	7	42.9 Å²	42.9	6%	0.058	22%	0.215	C	C	.	.	H	α-helix	trans	-89	-37.4	178.5	0	0	0	0	0	112.6	A832 L835 L859 A860 K864 D865	A832-A862 HydrophobicContact CB-CB 4.03Å; A832-A862 VanDerWaalsContact O-CB 3.32Å; A832-A862 WeakPolarHBondContact O-CB 3.35Å; L835-A862 HydrophobicContact CB-CB 4.34Å; L859-A862 PolarHBondContact O-N 3.24Å; A860-A862 VanDerWaalsContact C-N 3.34Å; A860-A862 PolarHBondContact O-N 2.88Å; A862-K864 VanDerWaalsContact C-N 3.27Å; A862-K864 PolarHBondContact O-N 3.47Å; A862-D865 PolarHBondContact O-N 3.45Å
863	L	93.4	Very high	95.2	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-32.2	-175.3	-73.4	170.4	0	0	0	113.5	L835 L844 L859 D865 L866 L869 L872 L887 M894	L835-L863 HydrophobicContact CD1-CD2 4.3Å; L844-L863 HydrophobicContact CD2-CD2 3.9Å; L859-L863 HydrophobicContact CB-CD1 4.09Å; L859-L863 HydrophobicContact CB-CG 4.49Å; L859-L863 WeakPolarHBondContact O-CB 3.49Å; L859-L863 WeakPolarHBondContact O-CG 3.43Å; L859-L863 PolarHBondContact O-N 3.01Å; L863-D865 PolarHBondContact O-N 3.32Å; L863-L866 HydrophobicContact CD2-CD1 4.1Å; L863-L866 PolarHBondContact O-N 2.95Å; L863-L869 HydrophobicContact CD2-CD2 3.61Å; L863-L872 HydrophobicContact CD1-CD2 3.66Å; L863-L872 HydrophobicContact CD2-CD1 4.37Å; L863-L872 HydrophobicContact CD2-CD2 4.29Å; L863-L887 HydrophobicContact CD1-CD2 4.5Å; L863-M894 HydrophobicContact CB-CE 3.9Å; L863-M894 HydrophobicContact CB-SD 4.28Å
864	K	89.3	Confident	95.2	Very high	86 Å²	86	42.1 Å²	42.1	37%	0.374	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-23.2	176.5	63.6	169.9	-168.7	178.5	0	113.4	L861 A862 H893	L861-K864 WeakPolarHBondContact O-CE 3.47Å; L861-K864 WeakPolarHBondContact O-CG 3.39Å; A862-K864 VanDerWaalsContact C-N 3.27Å; A862-K864 PolarHBondContact O-N 3.47Å; K864-H893 HydrophobicContact CB-CB 4.2Å
865	D	90	Very high	95.1	Very high	97 Å²	97	40.7 Å²	40.7	52%	0.519	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	2.2	-175.6	-61	-34.1	0	0	0	111.8	A862 L863 P867	A862-D865 PolarHBondContact O-N 3.45Å; L863-D865 PolarHBondContact O-N 3.32Å; D865-P867 VanDerWaalsContact O-CD 3.29Å; D865-P867 WeakPolarHBondContact O-CD 3.47Å
866	L	93.4	Very high	95	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.047	22%	0.217	C	C	.	.			trans	-90.4	105.8	176.6	-64.6	177.6	0	0	0	111	L835 L838 L841 L863 K868 L869	L835-L866 HydrophobicContact CD1-CD1 4.46Å; L835-L866 HydrophobicContact CD2-CD1 4.48Å; L835-L866 WeakPolarHBondContact O-CD2 3.38Å; L838-L866 WeakPolarHBondContact O-CD2 3.31Å; L841-L866 HydrophobicContact CD2-CD1 4.24Å; L863-L866 HydrophobicContact CD2-CD1 4.1Å; L863-L866 PolarHBondContact O-N 2.95Å; L866-K868 VanDerWaalsContact C-N 3.35Å; L866-K868 PolarHBondContact O-N 2.73Å; L866-L869 HydrophobicContact CB-CB 3.9Å; L866-L869 HydrophobicContact CD1-CB 4.43Å; L866-L869 HydrophobicContact CD1-CD2 4Å
867	P	92.9	Very high	95	Very high	71 Å²	71	43.1 Å²	43.1	46%	0.461	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-19.8	-167.7	30.3	-36.1	0	0	0	113.9	D865 S896	D865-P867 VanDerWaalsContact O-CD 3.29Å; D865-P867 WeakPolarHBondContact O-CD 3.47Å; P867-S896 VanDerWaalsContact O-CB 3.24Å; P867-S896 WeakPolarHBondContact O-CB 3.24Å; P867-S896 PolarHBondContact O-OG 2.89Å
868	K	96.1	Very high	95	Very high	99 Å²	99	40.8 Å²	40.8	43%	0.43	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-5.9	-176.3	-64.6	-168	-171.5	173	0	114.4	L841 E842 L866 H870	L841-K868 CarbonylContact O-C 3.57Å; E842-K868 HydrophobicContact CG-CB 4.06Å; L866-K868 VanDerWaalsContact C-N 3.35Å; L866-K868 PolarHBondContact O-N 2.73Å; K868-H870 PolarHBondContact O-N 2.96Å
869	L	96.9	Very high	95	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	20%	0.195	C	C	.	.			trans	-66	109.9	-174.6	-174.3	73.4	0	0	0	109.9	L841 L844 L863 L866 M894 S896 L897	L841-L869 HydrophobicContact CD2-CD1 4.38Å; L841-L869 HydrophobicContact CG-CD1 4.35Å; L841-L869 VanDerWaalsContact O-CA 3.26Å; L841-L869 WeakPolarHBondContact O-CA 3.39Å; L841-L869 PolarHBondContact O-N 2.81Å; L844-L869 HydrophobicContact CB-CD1 3.8Å; L863-L869 HydrophobicContact CD2-CD2 3.61Å; L866-L869 HydrophobicContact CB-CB 3.9Å; L866-L869 HydrophobicContact CD1-CB 4.43Å; L866-L869 HydrophobicContact CD1-CD2 4Å; L869-M894 HydrophobicContact CD2-CE 3.9Å; L869-S896 CarbonylContact O-C 3.6Å; L869-S896 VanDerWaalsContact O-C 3.23Å; L869-L897 WeakPolarHBondContact O-CA 3.25Å; L869-L897 PolarHBondContact O-N 3.45Å
870	H	97.1	Very high	95	Very high	64 Å²	64	38.3 Å²	38.3	30%	0.296	21%	0.206	S	C	.	.			trans	-109.5	-23.3	-179.2	72.2	73.2	0	0	0	112.5	E842 K868 S896 T898 D899	E842-H870 PolarHBondContact O-N 3.11Å; K868-H870 PolarHBondContact O-N 2.96Å; H870-S896 WeakPolarHBondContact CA-O 3.32Å; H870-S896 WeakPolarHBondContact CB-O 3.44Å; H870-T898 HydrophobicContact CB-CG2 4.39Å; H870-T898 PolarHBondContact O-N 2.86Å; H870-T898 PolarHBondContact O-OG1 3.15Å; H870-D899 PolarHBondContact O-N 3.37Å
871	C	97.8	Very high	95.2	Very high	39 Å²	39	39.7 Å²	39.7	26%	0.264	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	122.2	178.1	-173.6	0	0	0	0	111.2	E842 V843 L844 D899	E842-C871 PolarHBondContact O-N 3.01Å; V843-C871 WeakPolarHBondContact CA-O 3.24Å; V843-C871 HydrophobicContact CB-CB 4.4Å; V843-C871 HydrophobicContact CG1-CB 4.15Å; V843-C871 HydrophobicContact CG2-CB 4.07Å; L844-C871 PolarHBondContact N-O 3.09Å; C871-D899 WeakPolarHBondContact CA-O 3.5Å
872	L	97.6	Very high	95.4	Very high	1 Å²	1	39 Å²	39	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	123.4	173.8	176.2	61.1	0	0	0	110.1	L844 L863 L874 M894 L897 D899 L900 D901	L844-L872 HydrophobicContact CB-CD1 4.12Å; L844-L872 HydrophobicContact CD2-CD1 4.02Å; L844-L872 HydrophobicContact CG-CD1 4.08Å; L844-L872 WeakPolarHBondContact O-CA 3.36Å; L863-L872 HydrophobicContact CD1-CD2 3.66Å; L863-L872 HydrophobicContact CD2-CD1 4.37Å; L863-L872 HydrophobicContact CD2-CD2 4.29Å; L872-L874 HydrophobicContact CD1-CG 4.43Å; L872-L874 HydrophobicContact CD2-CD1 4.27Å; L872-L874 HydrophobicContact CG-CG 4.38Å; L872-M894 HydrophobicContact CD2-CE 4.3Å; L872-L897 HydrophobicContact CB-CD1 3.88Å; L872-D899 PolarHBondContact N-O 3Å; L872-L900 HydrophobicContact CB-CD1 4.11Å; L872-L900 HydrophobicContact CD2-CD1 3.93Å; L872-L900 HydrophobicContact CG-CD1 3.98Å; L872-L900 WeakPolarHBondContact O-CA 3.33Å; L872-D901 PolarHBondContact O-N 2.83Å
873	S	97.4	Very high	95.5	Very high	19 Å²	19	38.7 Å²	38.7	13%	0.133	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	123	171.1	-169.9	0	0	0	0	111.7	L844 L846 S847	L844-S873 PolarHBondContact O-N 3.25Å; L846-S873 CarbonylContact C-O 3.59Å; L846-S873 WeakPolarHBondContact CA-O 3.41Å; L846-S873 PolarHBondContact N-O 2.86Å; S847-S873 WeakPolarHBondContact OG-CB 3.44Å; S847-S873 PolarHBondContact OG-OG 3.47Å
874	L	96.8	Very high	95.7	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	21%	0.205	C	C	.	.			trans	-120.6	24.2	170.4	-69.1	168.7	0	0	0	110.6	L846 L872 N877 I879 L887 D901 I902 N905	L846-L874 HydrophobicContact CB-CD2 4Å; L846-L874 HydrophobicContact CD1-CD2 4.18Å; L872-L874 HydrophobicContact CD1-CG 4.43Å; L872-L874 HydrophobicContact CD2-CD1 4.27Å; L872-L874 HydrophobicContact CG-CG 4.38Å; L874-N877 PolarHBondContact O-ND2 3.01Å; L874-I879 HydrophobicContact CB-CD1 3.98Å; L874-I879 HydrophobicContact CD1-CD1 4.15Å; L874-I879 HydrophobicContact CG-CD1 4.49Å; L874-L887 HydrophobicContact CD1-CD1 3.75Å; L874-L887 HydrophobicContact CD1-CD2 4.33Å; L874-D901 CarbonylContact C-O 3.59Å; L874-D901 WeakPolarHBondContact CA-O 3.42Å; L874-D901 PolarHBondContact N-O 3.11Å; L874-I902 HydrophobicContact CB-CG1 4.35Å; L874-N905 PolarHBondContact O-ND2 2.74Å
875	Y	95.6	Very high	96	Very high	63 Å²	63	40.4 Å²	40.4	25%	0.247	21%	0.214	C	C	.	.			trans	-51.6	137	178.2	172.7	-88.7	0	0	0	112	S847 E848 N877 D901 K903 Y904	S847-Y875 CarbonylContact C-O 3.24Å; S847-Y875 WeakPolarHBondContact CA-O 3.5Å; E848-Y875 HydrophobicContact CG-CD1 4.41Å; E848-Y875 HydrophobicContact CG-CE1 4.46Å; E848-Y875 PolarHBondContact N-O 2.86Å; Y875-N877 PolarHBondContact O-N 3.46Å; Y875-N877 PolarHBondContact O-ND2 2.85Å; Y875-D901 PolarHBondContact N-O 3.44Å; Y875-K903 HydrophobicContact CD2-CB 3.86Å; Y875-K903 HydrophobicContact CE2-CB 4.16Å; Y875-Y904 HydrophobicContact CD2-CD2 4.11Å; Y875-Y904 AromaticContact CE2-CD2 3.23Å; Y875-Y904 HydrophobicContact CE2-CD2 3.23Å; Y875-Y904 AromaticContact CE2-CE2 3.74Å; Y875-Y904 HydrophobicContact CE2-CE2 3.74Å; Y875-Y904 HydrophobicContact CE2-CG 4.24Å; Y875-Y904 AromaticContact CZ-CD2 3.59Å; Y875-Y904 WeakPolarHBondContact OH-CD2 3.16Å
876	S	94.8	Very high	96.4	Very high	44 Å²	44	37 Å²	37	31%	0.308	20%	0.197	S	C	.	.	S	Bend	trans	54.7	55.7	173.4	-167.3	0	0	0	0	113.9	E848 K903 Y904	E848-S876 VanDerWaalsContact CA-O 3.28Å; E848-S876 WeakPolarHBondContact CA-O 3.42Å; E848-S876 PolarHBondContact N-O 2.88Å; S876-K903 PolarHBondContact N-O 3.5Å; S876-Y904 WeakPolarHBondContact CA-O 3.19Å
877	N	97	Very high	96.5	Very high	8 Å²	8	36.7 Å²	36.7	4%	0.043	20%	0.196	C	C	.	.			trans	-113.2	-164.7	172.2	-82.5	-69.9	0	0	0	110.4	L846 N849 C850 I851 L874 Y875 I879 N905	L846-N877 PolarHBondContact O-ND2 2.85Å; N849-N877 WeakPolarHBondContact CA-OD1 3.5Å; N849-N877 PolarHBondContact N-OD1 3.4Å; N849-N877 VanDerWaalsContact N-OD1 3.09Å; C850-N877 PolarHBondContact N-OD1 3.02Å; C850-N877 VanDerWaalsContact N-OD1 3.15Å; I851-N877 HydrophobicContact CB-CB 4.45Å; I851-N877 PolarHBondContact N-OD1 3.43Å; L874-N877 PolarHBondContact O-ND2 3.01Å; Y875-N877 PolarHBondContact O-N 3.46Å; Y875-N877 PolarHBondContact O-ND2 2.85Å; N877-I879 HydrophobicContact CB-CD1 4.12Å; N877-I879 HydrophobicContact CB-CG1 3.99Å; N877-N905 WeakPolarHBondContact CA-OD1 3.44Å; N877-N905 WeakPolarHBondContact CB-OD1 3.42Å; N877-N905 PolarHBondContact N-OD1 3.01Å; N877-N905 PolarHBondContact O-OD1 2.88Å
878	V	96	Very high	96.6	Very high	52 Å²	52	33.6 Å²	33.6	32%	0.315	18%	0.176	S	C	.	.			trans	-112.8	32.5	-176.1	-161	0	0	0	0	110.4	C850 I851 N905 K906	C850-V878 HydrophobicContact CB-CG2 4.42Å; I851-V878 CarbonylContact O-C 3.6Å; I851-V878 WeakPolarHBondContact O-CA 3.49Å; I851-V878 PolarHBondContact O-N 2.97Å; V878-N905 PolarHBondContact N-OD1 3.25Å; V878-K906 HydrophobicContact CG1-CD 3.72Å
879	I	96.6	Very high	96.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.183	C	C	.	.			trans	-78.3	123.9	-174.2	-51.9	171.7	0	0	0	109.7	V856 L874 N877 I902 N905 K906 M907	V856-I879 HydrophobicContact CG2-CD1 3.52Å; V856-I879 HydrophobicContact CG2-CG1 3.61Å; V856-I879 HydrophobicContact CG2-CG2 4.28Å; L874-I879 HydrophobicContact CB-CD1 3.98Å; L874-I879 HydrophobicContact CD1-CD1 4.15Å; L874-I879 HydrophobicContact CG-CD1 4.49Å; N877-I879 HydrophobicContact CB-CD1 4.12Å; N877-I879 HydrophobicContact CB-CG1 3.99Å; I879-I902 HydrophobicContact CD1-CD1 3.72Å; I879-I902 HydrophobicContact CD1-CG1 3.95Å; I879-I902 HydrophobicContact CG2-CD1 4.25Å; I879-N905 HydrophobicContact CB-CB 4.1Å; I879-N905 VanDerWaalsContact CB-OD1 3.31Å; I879-N905 WeakPolarHBondContact CB-OD1 3.28Å; I879-N905 WeakPolarHBondContact CG1-OD1 3.33Å; I879-N905 PolarHBondContact N-OD1 3.08Å; I879-N905 VanDerWaalsContact N-OD1 3.11Å; I879-K906 CarbonylContact O-C 3.51Å; I879-K906 VanDerWaalsContact O-C 3.24Å; I879-K906 VanDerWaalsContact O-CA 3.29Å; I879-K906 WeakPolarHBondContact O-CA 3.43Å; I879-K906 PolarHBondContact O-N 3.05Å; I879-M907 PolarHBondContact O-N 3.36Å; I879-M907 VanDerWaalsContact O-N 3.11Å
880	S	96.5	Very high	96.5	Very high	36 Å²	36	32.8 Å²	32.8	25%	0.252	19%	0.187	S	C	.	.			trans	-98.7	-166	175.8	88.1	0	0	0	0	111.2	D853 E882 G883 A884	D853-S880 VanDerWaalsContact CG-OG 3.23Å; D853-S880 PolarHBondContact OD1-N 3.5Å; D853-S880 PolarHBondContact OD1-OG 2.89Å; D853-S880 WeakPolarHBondContact OD2-CB 3.49Å; D853-S880 PolarHBondContact OD2-OG 2.94Å; S880-E882 VanDerWaalsContact C-N 3.28Å; S880-E882 PolarHBondContact O-N 3.48Å; S880-E882 PolarHBondContact OG-N 2.68Å; S880-G883 PolarHBondContact O-N 3.36Å; S880-A884 WeakPolarHBondContact O-CB 3.27Å; S880-A884 PolarHBondContact O-N 2.94Å
881	D	97.3	Very high	96.3	Very high	32 Å²	32	30 Å²	30	17%	0.171	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-34.8	176.9	-62	-39.2	0	0	0	112.6	A884 E885 T908 I910 G911	D881-A884 PolarHBondContact O-N 3.24Å; D881-E885 WeakPolarHBondContact O-CB 3.43Å; D881-E885 PolarHBondContact O-N 2.76Å; D881-T908 VanDerWaalsContact CG-OG1 3.24Å; D881-T908 PolarHBondContact OD1-N 3.48Å; D881-T908 PolarHBondContact OD1-OG1 3.3Å; D881-T908 PolarHBondContact OD2-OG1 2.84Å; D881-I910 HydrophobicContact CB-CB 4.33Å; D881-I910 HydrophobicContact CB-CG2 4.34Å; D881-G911 VanDerWaalsContact OD1-CA 3.29Å; D881-G911 WeakPolarHBondContact OD1-CA 3.22Å; D881-G911 PolarHBondContact OD1-N 2.9Å
882	E	97.1	Very high	96.2	Very high	87 Å²	87	30.3 Å²	30.3	41%	0.407	18%	0.176	S	C	.	.	H	α-helix	trans	-65.6	-44.3	179.2	-175.2	-175.7	164.8	0	0	111.9	D853 Q854 S880 E885 S886	D853-E882 HydrophobicContact CB-CB 4.15Å; D853-E882 HydrophobicContact CB-CG 4.34Å; Q854-E882 PolarHBondContact NE2-OE1 2.76Å; S880-E882 VanDerWaalsContact C-N 3.28Å; S880-E882 PolarHBondContact O-N 3.48Å; S880-E882 PolarHBondContact OG-N 2.68Å; E882-E885 PolarHBondContact O-N 3.28Å; E882-S886 PolarHBondContact O-N 3.01Å; E882-S886 PolarHBondContact O-OG 2.82Å
883	G	96.1	Very high	95.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-70.1	-36.5	176.1	0	0	0	0	0	112.1	D853 V856 S880 S886 L887	D853-G883 VanDerWaalsContact OD1-CA 3.24Å; D853-G883 WeakPolarHBondContact OD1-CA 3.46Å; D853-G883 PolarHBondContact OD1-N 2.89Å; V856-G883 WeakPolarHBondContact CG1-O 3.26Å; S880-G883 PolarHBondContact O-N 3.36Å; G883-S886 WeakPolarHBondContact O-CB 3.41Å; G883-S886 PolarHBondContact O-N 2.98Å; G883-L887 PolarHBondContact O-N 3.24Å
884	A	96.7	Very high	95.7	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-41.1	173.3	0	0	0	0	0	111.8	S880 D881 L887 A888 M907 L915	S880-A884 WeakPolarHBondContact O-CB 3.27Å; S880-A884 PolarHBondContact O-N 2.94Å; D881-A884 PolarHBondContact O-N 3.24Å; A884-L887 PolarHBondContact O-N 2.7Å; A884-A888 VanDerWaalsContact O-CB 3.31Å; A884-A888 WeakPolarHBondContact O-CB 3.44Å; A884-A888 PolarHBondContact O-N 3.3Å; A884-M907 HydrophobicContact CB-CB 4.3Å; A884-M907 HydrophobicContact CB-CE 4.11Å; A884-M907 HydrophobicContact CB-SD 4.2Å; A884-L915 HydrophobicContact CB-CD1 4.06Å; A884-L915 HydrophobicContact CB-CG 4.3Å
885	E	96.8	Very high	95.2	Very high	123 Å²	123	39 Å²	39	58%	0.575	23%	0.226	S	C	*	.	H	α-helix	trans	-64.5	-40.8	174.1	-173.5	175.7	-166.1	0	0	111.8	D881 E882 L887 A888 A889	D881-E885 WeakPolarHBondContact O-CB 3.43Å; D881-E885 PolarHBondContact O-N 2.76Å; E882-E885 PolarHBondContact O-N 3.28Å; E885-L887 VanDerWaalsContact C-N 3.35Å; E885-L887 PolarHBondContact O-N 3Å; E885-A888 WeakPolarHBondContact O-CB 2.94Å; E885-A888 PolarHBondContact O-N 3.17Å; E885-A889 PolarHBondContact O-N 2.95Å
886	S	96.8	Very high	95.1	Very high	24 Å²	24	37.5 Å²	37.5	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-60.6	-42.2	175.4	-62.2	0	0	0	0	112.1	E882 G883	E882-S886 PolarHBondContact O-N 3.01Å; E882-S886 PolarHBondContact O-OG 2.82Å; G883-S886 WeakPolarHBondContact O-CB 3.41Å; G883-S886 PolarHBondContact O-N 2.98Å
887	L	96	Very high	95.2	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-67.5	-43.5	173	-75.4	167.6	0	0	0	111.9	V856 A860 L863 L874 G883 A884 E885 A889 V890 L891 I902 L915	V856-L887 HydrophobicContact CG1-CD1 3.66Å; V856-L887 HydrophobicContact CG1-CD2 3.94Å; V856-L887 HydrophobicContact CG1-CG 3.41Å; V856-L887 VanDerWaalsContact CG1-CG 3.41Å; A860-L887 HydrophobicContact CB-CD2 4.5Å; L863-L887 HydrophobicContact CD1-CD2 4.5Å; L874-L887 HydrophobicContact CD1-CD1 3.75Å; L874-L887 HydrophobicContact CD1-CD2 4.33Å; G883-L887 PolarHBondContact O-N 3.24Å; A884-L887 PolarHBondContact O-N 2.7Å; E885-L887 VanDerWaalsContact C-N 3.35Å; E885-L887 PolarHBondContact O-N 3Å; L887-A889 PolarHBondContact O-N 3.45Å; L887-V890 WeakPolarHBondContact O-CG2 3.11Å; L887-V890 PolarHBondContact O-N 2.99Å; L887-V890 VanDerWaalsContact O-N 3.11Å; L887-L891 WeakPolarHBondContact O-CB 3.4Å; L887-L891 PolarHBondContact O-N 3.4Å; L887-I902 HydrophobicContact CD1-CD1 3.44Å; L887-I902 VanDerWaalsContact CD1-CD1 3.44Å; L887-L915 HydrophobicContact CB-CD2 4.21Å
888	A	95.5	Very high	95.2	Very high	5 Å²	5	36.2 Å²	36.2	4%	0.041	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-35.9	178.2	0	0	0	0	0	111.8	A884 E885 V890 P892 S914 L915 S918	A884-A888 VanDerWaalsContact O-CB 3.31Å; A884-A888 WeakPolarHBondContact O-CB 3.44Å; A884-A888 PolarHBondContact O-N 3.3Å; E885-A888 WeakPolarHBondContact O-CB 2.94Å; E885-A888 PolarHBondContact O-N 3.17Å; A888-V890 VanDerWaalsContact C-N 3.33Å; A888-V890 PolarHBondContact O-N 2.93Å; A888-P892 WeakPolarHBondContact O-CD 3.42Å; A888-S914 WeakPolarHBondContact CB-OG 3.49Å; A888-L915 HydrophobicContact CB-CD2 4.1Å; A888-S918 VanDerWaalsContact O-CB 3.27Å; A888-S918 WeakPolarHBondContact O-CB 3.38Å; A888-S918 PolarHBondContact O-OG 3.38Å
889	A	95.4	Very high	95.3	Very high	69 Å²	69	35.9 Å²	35.9	57%	0.57	21%	0.211	S	C	*	.	H	α-helix	trans	-64.7	-34	177.3	0	0	0	0	0	113.3	E885 L887	E885-A889 PolarHBondContact O-N 2.95Å; L887-A889 PolarHBondContact O-N 3.45Å
890	V	95.2	Very high	95.3	Very high	17 Å²	17	36 Å²	36	10%	0.103	21%	0.211	C	C	.	.	H	α-helix	trans	-98.4	-19.4	-177	-59.7	0	0	0	0	114.1	A860 L887 A888 P892 H893 M894	A860-V890 HydrophobicContact CB-CB 4.5Å; A860-V890 HydrophobicContact CB-CG1 4.09Å; A860-V890 HydrophobicContact CB-CG2 3.65Å; L887-V890 WeakPolarHBondContact O-CG2 3.11Å; L887-V890 PolarHBondContact O-N 2.99Å; L887-V890 VanDerWaalsContact O-N 3.11Å; A888-V890 VanDerWaalsContact C-N 3.33Å; A888-V890 PolarHBondContact O-N 2.93Å; V890-P892 VanDerWaalsContact C-N 3.31Å; V890-H893 WeakPolarHBondContact O-CA 3.32Å; V890-H893 WeakPolarHBondContact O-CB 3.46Å; V890-H893 PolarHBondContact O-N 3.48Å; V890-M894 PolarHBondContact O-N 2.78Å
891	L	94.1	Very high	95.3	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-50	-41.4	-176.9	-164	68.9	0	0	0	114	L887 H893 M894 L897 L900 C922	L887-L891 WeakPolarHBondContact O-CB 3.4Å; L887-L891 PolarHBondContact O-N 3.4Å; L891-H893 PolarHBondContact O-N 3.3Å; L891-M894 HydrophobicContact CD1-SD 4.46Å; L891-M894 PolarHBondContact O-N 3.28Å; L891-L897 HydrophobicContact CD1-CD2 3.57Å; L891-L900 HydrophobicContact CD1-CD2 3.72Å; L891-C922 VanDerWaalsContact CG-SG 3.56Å
892	P	94.1	Very high	95.2	Very high	46 Å²	46	33.8 Å²	33.8	30%	0.299	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-67.8	-20	178.2	-20.5	35.4	0	0	0	113.9	A888 V890 S918 K921	A888-P892 WeakPolarHBondContact O-CD 3.42Å; V890-P892 VanDerWaalsContact C-N 3.31Å; P892-S918 WeakPolarHBondContact CD-OG 3.03Å; P892-S918 WeakPolarHBondContact CG-OG 3.43Å; P892-K921 HydrophobicContact CB-CB 4.1Å; P892-K921 HydrophobicContact CG-CB 4.03Å; P892-K921 HydrophobicContact CG-CD 4.4Å
893	H	92.8	Very high	95	Very high	128 Å²	128	30.8 Å²	30.8	59%	0.593	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-88.8	-13.7	178.4	-60.2	-66.7	0	0	0	112.8	K864 V890 L891 A895	K864-H893 HydrophobicContact CB-CB 4.2Å; V890-H893 WeakPolarHBondContact O-CA 3.32Å; V890-H893 WeakPolarHBondContact O-CB 3.46Å; V890-H893 PolarHBondContact O-N 3.48Å; L891-H893 PolarHBondContact O-N 3.3Å; H893-A895 VanDerWaalsContact C-N 3.29Å; H893-A895 PolarHBondContact O-N 2.91Å
894	M	93.3	Very high	94.8	Very high	12 Å²	12	36.5 Å²	36.5	6%	0.059	21%	0.205	C	C	.	.			trans	-79	77.2	176.3	-62.5	-177.7	68.6	0	0	110.5	L863 L869 L872 V890 L891 S896 L897	L863-M894 HydrophobicContact CB-CE 3.9Å; L863-M894 HydrophobicContact CB-SD 4.28Å; L869-M894 HydrophobicContact CD2-CE 3.9Å; L872-M894 HydrophobicContact CD2-CE 4.3Å; V890-M894 PolarHBondContact O-N 2.78Å; L891-M894 HydrophobicContact CD1-SD 4.46Å; L891-M894 PolarHBondContact O-N 3.28Å; M894-S896 PolarHBondContact O-N 2.59Å; M894-L897 HydrophobicContact CB-CB 3.97Å; M894-L897 HydrophobicContact CB-CD2 4.48Å; M894-L897 HydrophobicContact CE-CB 4.39Å; M894-L897 HydrophobicContact CE-CD1 4.02Å; M894-L897 HydrophobicContact CE-CD2 3.85Å; M894-L897 HydrophobicContact CE-CG 4.32Å; M894-L897 PolarHBondContact O-N 3.21Å; M894-L897 HydrophobicContact SD-CD2 4.05Å
895	A	85.9	Confident	94.8	Very high	66 Å²	66	36.9 Å²	36.9	55%	0.545	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-14.2	-164.7	0	0	0	0	0	116	H893 K924	H893-A895 VanDerWaalsContact C-N 3.29Å; H893-A895 PolarHBondContact O-N 2.91Å; A895-K924 WeakPolarHBondContact O-CD 3.4Å; A895-K924 WeakPolarHBondContact O-CE 3.48Å; A895-K924 PolarHBondContact O-NZ 2.94Å
896	S	93.9	Very high	94.7	Very high	31 Å²	31	36.8 Å²	36.8	22%	0.217	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-5.1	-178.6	-67.4	0	0	0	0	114.1	P867 L869 H870 M894 T898	P867-S896 VanDerWaalsContact O-CB 3.24Å; P867-S896 WeakPolarHBondContact O-CB 3.24Å; P867-S896 PolarHBondContact O-OG 2.89Å; L869-S896 CarbonylContact O-C 3.6Å; L869-S896 VanDerWaalsContact O-C 3.23Å; H870-S896 WeakPolarHBondContact CA-O 3.32Å; H870-S896 WeakPolarHBondContact CB-O 3.44Å; M894-S896 PolarHBondContact O-N 2.59Å; S896-T898 PolarHBondContact O-N 3.38Å
897	L	96.6	Very high	94.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.197	C	C	.	.			trans	-66.4	123.7	-175.4	-166.4	72.3	0	0	0	111.2	L869 L872 L891 M894 L900 K924 V925	L869-L897 WeakPolarHBondContact O-CA 3.25Å; L869-L897 PolarHBondContact O-N 3.45Å; L872-L897 HydrophobicContact CB-CD1 3.88Å; L891-L897 HydrophobicContact CD1-CD2 3.57Å; M894-L897 HydrophobicContact CB-CB 3.97Å; M894-L897 HydrophobicContact CB-CD2 4.48Å; M894-L897 HydrophobicContact CE-CB 4.39Å; M894-L897 HydrophobicContact CE-CD1 4.02Å; M894-L897 HydrophobicContact CE-CD2 3.85Å; M894-L897 HydrophobicContact CE-CG 4.32Å; M894-L897 PolarHBondContact O-N 3.21Å; M894-L897 HydrophobicContact SD-CD2 4.05Å; L897-L900 HydrophobicContact CD2-CB 4.18Å; L897-L900 HydrophobicContact CD2-CD2 4.46Å; L897-K924 CarbonylContact O-C 3.55Å; L897-V925 HydrophobicContact CB-CG2 4.48Å; L897-V925 WeakPolarHBondContact O-CA 3.27Å; L897-V925 WeakPolarHBondContact O-CG2 3.49Å; L897-V925 PolarHBondContact O-N 3.44Å
898	T	96.8	Very high	94.6	Very high	25 Å²	25	37.6 Å²	37.6	15%	0.153	21%	0.209	C	C	.	.			trans	-110.4	-34.2	175.8	58.6	0	0	0	0	112.1	H870 S896 K926 T927	H870-T898 HydrophobicContact CB-CG2 4.39Å; H870-T898 PolarHBondContact O-N 2.86Å; H870-T898 PolarHBondContact O-OG1 3.15Å; S896-T898 PolarHBondContact O-N 3.38Å; T898-K926 PolarHBondContact O-N 3.22Å; T898-T927 PolarHBondContact O-N 3.15Å
899	D	97.1	Very high	94.5	Very high	44 Å²	44	40.1 Å²	40.1	24%	0.235	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	120.1	-171.8	-62.2	-90.2	0	0	0	110.2	H870 C871 L872 T927	H870-D899 PolarHBondContact O-N 3.37Å; C871-D899 WeakPolarHBondContact CA-O 3.5Å; L872-D899 PolarHBondContact N-O 3Å; D899-T927 WeakPolarHBondContact OD1-CG2 3.38Å; D899-T927 PolarHBondContact OD1-OG1 3.29Å
900	L	96.9	Very high	94.5	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	119.1	174.9	177.9	55.6	0	0	0	110	L872 L891 L897 T927 L928 R929	L872-L900 HydrophobicContact CB-CD1 4.11Å; L872-L900 HydrophobicContact CD2-CD1 3.93Å; L872-L900 HydrophobicContact CG-CD1 3.98Å; L872-L900 WeakPolarHBondContact O-CA 3.33Å; L891-L900 HydrophobicContact CD1-CD2 3.72Å; L897-L900 HydrophobicContact CD2-CB 4.18Å; L897-L900 HydrophobicContact CD2-CD2 4.46Å; L900-T927 PolarHBondContact N-O 3.03Å; L900-L928 HydrophobicContact CB-CD1 3.88Å; L900-L928 HydrophobicContact CD2-CD1 3.73Å; L900-L928 HydrophobicContact CG-CD1 3.73Å; L900-L928 WeakPolarHBondContact O-CA 3.31Å; L900-R929 PolarHBondContact O-N 3.38Å
901	D	96.6	Very high	94.5	Very high	23 Å²	23	41.4 Å²	41.4	12%	0.123	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	120.7	170.9	-161.8	-22.6	0	0	0	110.7	L872 L874 Y875 K903 R929	L872-D901 PolarHBondContact O-N 2.83Å; L874-D901 CarbonylContact C-O 3.59Å; L874-D901 WeakPolarHBondContact CA-O 3.42Å; L874-D901 PolarHBondContact N-O 3.11Å; Y875-D901 PolarHBondContact N-O 3.44Å; D901-K903 VanDerWaalsContact CG-CE 3.41Å; D901-K903 WeakPolarHBondContact OD1-CB 3.31Å; D901-K903 WeakPolarHBondContact OD1-CE 3.29Å; D901-K903 WeakPolarHBondContact OD1-CG 3.21Å; D901-K903 PolarHBondContact OD1-N 3.21Å; D901-K903 WeakPolarHBondContact OD2-CE 3.36Å; D901-K903 IonicContact OD2-NZ 3.51Å; D901-K903 PolarHBondContact OD2-NZ 3.15Å; D901-R929 HydrophobicContact CB-CB 4.43Å; D901-R929 WeakPolarHBondContact OD2-CD 3.36Å
902	I	95.1	Very high	94.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.216	C	C	.	.			trans	-133.6	24.1	175	-160.3	161.8	0	0	0	110.9	L874 I879 L887 N905 M907 L915 R929 M930	L874-I902 HydrophobicContact CB-CG1 4.35Å; I879-I902 HydrophobicContact CD1-CD1 3.72Å; I879-I902 HydrophobicContact CD1-CG1 3.95Å; I879-I902 HydrophobicContact CG2-CD1 4.25Å; L887-I902 HydrophobicContact CD1-CD1 3.44Å; L887-I902 VanDerWaalsContact CD1-CD1 3.44Å; I902-N905 HydrophobicContact CG1-CB 4.47Å; I902-N905 WeakPolarHBondContact CG1-ND2 3.44Å; I902-N905 PolarHBondContact O-ND2 2.86Å; I902-M907 HydrophobicContact CB-CE 4.28Å; I902-M907 HydrophobicContact CD1-CE 3.58Å; I902-M907 HydrophobicContact CG1-CE 3.58Å; I902-M907 HydrophobicContact CG2-CE 3.74Å; I902-L915 HydrophobicContact CG2-CD1 4.21Å; I902-R929 CarbonylContact C-O 3.51Å; I902-R929 WeakPolarHBondContact CG2-O 3.35Å; I902-R929 PolarHBondContact N-O 3.11Å; I902-M930 HydrophobicContact CG2-CB 3.75Å
903	K	93.8	Very high	94.6	Very high	24 Å²	24	43.6 Å²	43.6	10%	0.104	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	159	176.4	-71.5	176.3	-70.6	-179.3	0	111.9	Y875 S876 D901 N905 R929 W931 Q953	Y875-K903 HydrophobicContact CD2-CB 3.86Å; Y875-K903 HydrophobicContact CE2-CB 4.16Å; S876-K903 PolarHBondContact N-O 3.5Å; D901-K903 VanDerWaalsContact CG-CE 3.41Å; D901-K903 WeakPolarHBondContact OD1-CB 3.31Å; D901-K903 WeakPolarHBondContact OD1-CE 3.29Å; D901-K903 WeakPolarHBondContact OD1-CG 3.21Å; D901-K903 PolarHBondContact OD1-N 3.21Å; D901-K903 WeakPolarHBondContact OD2-CE 3.36Å; D901-K903 IonicContact OD2-NZ 3.51Å; D901-K903 PolarHBondContact OD2-NZ 3.15Å; K903-N905 PolarHBondContact O-N 3.24Å; K903-N905 PolarHBondContact O-ND2 3.26Å; K903-R929 HydrophobicContact CD-CB 3.82Å; K903-R929 HydrophobicContact CG-CB 3.72Å; K903-R929 PolarHBondContact N-O 3.49Å; K903-W931 CarbonylContact C-O 3.54Å; K903-W931 WeakPolarHBondContact CA-O 3.43Å; K903-W931 WeakPolarHBondContact CB-O 3.42Å; K903-W931 HydrophobicContact CG-CB 4.44Å; K903-Q953 PolarHBondContact NZ-OXT 3.41Å
904	Y	92.5	Very high	94.8	Very high	119 Å²	119	39.1 Å²	39.1	47%	0.467	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	35.3	176.6	-64.6	-84.3	0	0	0	114.7	Y875 S876 W931	Y875-Y904 HydrophobicContact CD2-CD2 4.11Å; Y875-Y904 AromaticContact CE2-CD2 3.23Å; Y875-Y904 HydrophobicContact CE2-CD2 3.23Å; Y875-Y904 AromaticContact CE2-CE2 3.74Å; Y875-Y904 HydrophobicContact CE2-CE2 3.74Å; Y875-Y904 HydrophobicContact CE2-CG 4.24Å; Y875-Y904 AromaticContact CZ-CD2 3.59Å; Y875-Y904 WeakPolarHBondContact OH-CD2 3.16Å; S876-Y904 WeakPolarHBondContact CA-O 3.19Å; Y904-W931 PolarHBondContact N-O 2.79Å
905	N	95.4	Very high	94.9	Very high	9 Å²	9	38.6 Å²	38.6	5%	0.048	20%	0.204	C	C	.	.	S	Bend	trans	-94.8	-166.1	168.8	-82.5	-77.4	0	0	0	111.4	L874 N877 V878 I879 I902 K903 M907 N932	L874-N905 PolarHBondContact O-ND2 2.74Å; N877-N905 WeakPolarHBondContact CA-OD1 3.44Å; N877-N905 WeakPolarHBondContact CB-OD1 3.42Å; N877-N905 PolarHBondContact N-OD1 3.01Å; N877-N905 PolarHBondContact O-OD1 2.88Å; V878-N905 PolarHBondContact N-OD1 3.25Å; I879-N905 HydrophobicContact CB-CB 4.1Å; I879-N905 VanDerWaalsContact CB-OD1 3.31Å; I879-N905 WeakPolarHBondContact CB-OD1 3.28Å; I879-N905 WeakPolarHBondContact CG1-OD1 3.33Å; I879-N905 PolarHBondContact N-OD1 3.08Å; I879-N905 VanDerWaalsContact N-OD1 3.11Å; I902-N905 HydrophobicContact CG1-CB 4.47Å; I902-N905 WeakPolarHBondContact CG1-ND2 3.44Å; I902-N905 PolarHBondContact O-ND2 2.86Å; K903-N905 PolarHBondContact O-N 3.24Å; K903-N905 PolarHBondContact O-ND2 3.26Å; N905-M907 HydrophobicContact CB-CE 4.28Å; N905-N932 VanDerWaalsContact O-CB 3.29Å; N905-N932 WeakPolarHBondContact O-CB 3.46Å; N905-N932 VanDerWaalsContact O-CG 3.29Å; N905-N932 PolarHBondContact O-OD1 2.9Å
906	K	94.5	Very high	95.3	Very high	121 Å²	121	35.7 Å²	35.7	53%	0.526	18%	0.181	S	C	.	.			trans	-113.2	19.1	-177.2	-62.2	-171.1	177.7	176.3	0	113.8	V878 I879	V878-K906 HydrophobicContact CG1-CD 3.72Å; I879-K906 CarbonylContact O-C 3.51Å; I879-K906 VanDerWaalsContact O-C 3.24Å; I879-K906 VanDerWaalsContact O-CA 3.29Å; I879-K906 WeakPolarHBondContact O-CA 3.43Å; I879-K906 PolarHBondContact O-N 3.05Å
907	M	95.3	Very high	95.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.			trans	-76.8	143	177.3	69.8	-178.9	76.8	0	0	111.5	I879 A884 I902 N905 L915 N932 C934 I935	I879-M907 PolarHBondContact O-N 3.36Å; I879-M907 VanDerWaalsContact O-N 3.11Å; A884-M907 HydrophobicContact CB-CB 4.3Å; A884-M907 HydrophobicContact CB-CE 4.11Å; A884-M907 HydrophobicContact CB-SD 4.2Å; I902-M907 HydrophobicContact CB-CE 4.28Å; I902-M907 HydrophobicContact CD1-CE 3.58Å; I902-M907 HydrophobicContact CG1-CE 3.58Å; I902-M907 HydrophobicContact CG2-CE 3.74Å; N905-M907 HydrophobicContact CB-CE 4.28Å; M907-L915 HydrophobicContact CE-CD1 3.95Å; M907-L915 HydrophobicContact SD-CD1 3.79Å; M907-N932 WeakPolarHBondContact CG-ND2 3.3Å; M907-N932 PolarHBondContact O-ND2 3.42Å; M907-N932 PolarHBondContact O-OD1 3.08Å; M907-C934 WeakPolarHBondContact O-CB 3.41Å; M907-I935 HydrophobicContact CG-CD1 4.12Å; M907-I935 HydrophobicContact CG-CG1 4.38Å; M907-I935 WeakPolarHBondContact O-CG1 3.21Å; M907-I935 HydrophobicContact SD-CD1 4.42Å
908	T	95.4	Very high	95.2	Very high	44 Å²	44	37.3 Å²	37.3	27%	0.27	20%	0.195	S	C	.	.			trans	-92.9	-163.9	176.4	74.6	0	0	0	0	110.8	D881 I910 A912	D881-T908 VanDerWaalsContact CG-OG1 3.24Å; D881-T908 PolarHBondContact OD1-N 3.48Å; D881-T908 PolarHBondContact OD1-OG1 3.3Å; D881-T908 PolarHBondContact OD2-OG1 2.84Å; T908-I910 PolarHBondContact O-N 3.3Å; T908-I910 PolarHBondContact OG1-N 2.89Å; T908-A912 WeakPolarHBondContact O-CB 3.31Å; T908-A912 PolarHBondContact O-N 2.72Å
909	D	94.4	Very high	95.1	Very high	59 Å²	59	36.1 Å²	36.1	32%	0.316	19%	0.188	S	C	.	.	H	α-helix	trans	-61.4	-28	172.5	60.5	-38.8	0	0	0	113.2	Q913 V939	D909-Q913 VanDerWaalsContact O-CB 3.31Å; D909-Q913 WeakPolarHBondContact O-CB 3.46Å; D909-Q913 WeakPolarHBondContact O-CG 3.45Å; D909-Q913 PolarHBondContact O-N 3.11Å; D909-V939 HydrophobicContact CB-CB 4.35Å; D909-V939 HydrophobicContact CB-CG1 3.87Å; D909-V939 HydrophobicContact CB-CG2 4.06Å
910	I	95.6	Very high	94.8	Very high	111 Å²	111	41.6 Å²	41.6	57%	0.569	21%	0.205	S	C	*	.	H	α-helix	trans	-64.6	-54.8	179.5	-60	173.8	0	0	0	110.6	D881 T908 A912 Q913 S914	D881-I910 HydrophobicContact CB-CB 4.33Å; D881-I910 HydrophobicContact CB-CG2 4.34Å; T908-I910 PolarHBondContact O-N 3.3Å; T908-I910 PolarHBondContact OG1-N 2.89Å; I910-A912 VanDerWaalsContact C-N 3.35Å; I910-A912 PolarHBondContact O-N 2.85Å; I910-Q913 PolarHBondContact O-N 3.1Å; I910-S914 PolarHBondContact O-N 3.43Å
911	G	95.2	Very high	94.6	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-39.5	178.7	0	0	0	0	0	112.4	D881 Q913 S914 L915	D881-G911 VanDerWaalsContact OD1-CA 3.29Å; D881-G911 WeakPolarHBondContact OD1-CA 3.22Å; D881-G911 PolarHBondContact OD1-N 2.9Å; G911-Q913 PolarHBondContact O-N 2.76Å; G911-S914 PolarHBondContact O-N 2.91Å; G911-L915 PolarHBondContact O-N 3.41Å
912	A	94.9	Very high	94.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-42	176.2	0	0	0	0	0	112.3	T908 I910 G916 M930 I935 L943	T908-A912 WeakPolarHBondContact O-CB 3.31Å; T908-A912 PolarHBondContact O-N 2.72Å; I910-A912 VanDerWaalsContact C-N 3.35Å; I910-A912 PolarHBondContact O-N 2.85Å; A912-G916 PolarHBondContact O-N 3.27Å; A912-M930 HydrophobicContact CB-SD 4.03Å; A912-I935 HydrophobicContact CB-CD1 3.86Å; A912-I935 HydrophobicContact CB-CG1 4.12Å; A912-I935 HydrophobicContact CB-CG2 4.36Å; A912-L943 HydrophobicContact CB-CD1 3.81Å
913	Q	95.1	Very high	93.9	Very high	97 Å²	97	54.4 Å²	54.4	45%	0.453	28%	0.276	S	S	.	.	H	α-helix	trans	-66	-39.2	175.1	-74.9	173.1	41.7	0	0	111.9	D909 I910 G911 G916 A917 L943	D909-Q913 VanDerWaalsContact O-CB 3.31Å; D909-Q913 WeakPolarHBondContact O-CB 3.46Å; D909-Q913 WeakPolarHBondContact O-CG 3.45Å; D909-Q913 PolarHBondContact O-N 3.11Å; I910-Q913 PolarHBondContact O-N 3.1Å; G911-Q913 PolarHBondContact O-N 2.76Å; Q913-G916 PolarHBondContact O-N 3.48Å; Q913-A917 WeakPolarHBondContact O-CB 3.35Å; Q913-A917 PolarHBondContact O-N 2.88Å; Q913-L943 HydrophobicContact CG-CD2 4.44Å
914	S	96.2	Very high	93.8	Very high	34 Å²	34	58.5 Å²	58.5	24%	0.238	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-48.8	176.6	-170.9	0	0	0	0	111.8	A888 I910 G911 G916 A917 S918	A888-S914 WeakPolarHBondContact CB-OG 3.49Å; I910-S914 PolarHBondContact O-N 3.43Å; G911-S914 PolarHBondContact O-N 2.91Å; S914-G916 PolarHBondContact O-N 3.01Å; S914-A917 PolarHBondContact O-N 3.46Å; S914-S918 PolarHBondContact O-N 2.57Å
915	L	95.4	Very high	94	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-44.6	174.8	-73.8	170.4	0	0	0	111.9	A884 L887 A888 I902 M907 G911 A917 S918 L919 L928 M930	A884-L915 HydrophobicContact CB-CD1 4.06Å; A884-L915 HydrophobicContact CB-CG 4.3Å; L887-L915 HydrophobicContact CB-CD2 4.21Å; A888-L915 HydrophobicContact CB-CD2 4.1Å; I902-L915 HydrophobicContact CG2-CD1 4.21Å; M907-L915 HydrophobicContact CE-CD1 3.95Å; M907-L915 HydrophobicContact SD-CD1 3.79Å; G911-L915 PolarHBondContact O-N 3.41Å; L915-A917 PolarHBondContact O-N 3.42Å; L915-S918 PolarHBondContact O-N 2.86Å; L915-L919 WeakPolarHBondContact O-CB 3.29Å; L915-L919 PolarHBondContact O-N 3.33Å; L915-L928 HydrophobicContact CB-CD2 4.39Å; L915-M930 HydrophobicContact CB-CE 4.13Å
916	G	94	Very high	93.9	Very high	5 Å²	5	59.8 Å²	59.8	5%	0.052	30%	0.302	C	S	.	.	H	α-helix	trans	-63	-37.2	177.4	0	0	0	0	0	113.5	A912 Q913 S914	A912-G916 PolarHBondContact O-N 3.27Å; Q913-G916 PolarHBondContact O-N 3.48Å; S914-G916 PolarHBondContact O-N 3.01Å
917	A	94.3	Very high	94	Very high	53 Å²	53	55 Å²	55	44%	0.438	28%	0.282	S	S	.	.	H	α-helix	trans	-69	-41.6	175.6	0	0	0	0	0	111.8	Q913 S914 L915 R920	Q913-A917 WeakPolarHBondContact O-CB 3.35Å; Q913-A917 PolarHBondContact O-N 2.88Å; S914-A917 PolarHBondContact O-N 3.46Å; L915-A917 PolarHBondContact O-N 3.42Å; A917-R920 PolarHBondContact O-N 3.5Å
918	S	95.3	Very high	94	Very high	12 Å²	12	55 Å²	55	8%	0.084	28%	0.282	C	S	.	.	H	α-helix	trans	-68	-37	177.3	-172.1	0	0	0	0	112.8	A888 P892 S914 L915 R920 K921 C922	A888-S918 VanDerWaalsContact O-CB 3.27Å; A888-S918 WeakPolarHBondContact O-CB 3.38Å; A888-S918 PolarHBondContact O-OG 3.38Å; P892-S918 WeakPolarHBondContact CD-OG 3.03Å; P892-S918 WeakPolarHBondContact CG-OG 3.43Å; S914-S918 PolarHBondContact O-N 2.57Å; L915-S918 PolarHBondContact O-N 2.86Å; S918-R920 PolarHBondContact O-N 2.84Å; S918-R920 VanDerWaalsContact O-N 3.08Å; S918-K921 WeakPolarHBondContact O-CB 3.39Å; S918-K921 PolarHBondContact O-N 3.36Å; S918-C922 PolarHBondContact O-SG 3Å
919	L	94.4	Very high	94	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-54.6	-31.3	177.7	-177	63.8	0	0	0	112.7	L915 K921 C922 V925 L928 D947 R949 I950	L915-L919 WeakPolarHBondContact O-CB 3.29Å; L915-L919 PolarHBondContact O-N 3.33Å; L919-K921 PolarHBondContact O-N 3.01Å; L919-C922 HydrophobicContact CD1-CB 4.42Å; L919-C922 WeakPolarHBondContact O-CB 3.33Å; L919-C922 PolarHBondContact O-N 3.25Å; L919-V925 HydrophobicContact CD1-CB 3.73Å; L919-V925 HydrophobicContact CD1-CG1 3.46Å; L919-V925 VanDerWaalsContact CD1-CG1 3.46Å; L919-V925 HydrophobicContact CD1-CG2 4.42Å; L919-L928 HydrophobicContact CB-CD2 4.4Å; L919-L928 HydrophobicContact CD1-CD2 4.34Å; L919-L928 HydrophobicContact CD2-CB 4.26Å; L919-L928 HydrophobicContact CD2-CD2 3.88Å; L919-L928 HydrophobicContact CG-CD2 4.42Å; L919-D947 HydrophobicContact CD2-CB 4.23Å; L919-D947 WeakPolarHBondContact CD2-OD2 3.38Å; L919-R949 HydrophobicContact CD2-CB 4.28Å; L919-R949 PolarHBondContact O-NH2 3.34Å; L919-I950 HydrophobicContact CD2-CD1 4.18Å; L919-I950 HydrophobicContact CD2-CG1 3.71Å
920	R	90.9	Very high	93.9	Very high	160 Å²	160	52.8 Å²	52.8	60%	0.604	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-26.5	175.5	-61.5	-179.3	-175.6	175.6	2.7	113.6	A917 S918 Q946	A917-R920 PolarHBondContact O-N 3.5Å; S918-R920 PolarHBondContact O-N 2.84Å; S918-R920 VanDerWaalsContact O-N 3.08Å; R920-Q946 VanDerWaalsContact NH2-OE1 3.14Å
921	K	92.2	Very high	93.7	Very high	166 Å²	166	49.2 Å²	49.2	72%	0.722	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-7	176.6	-59.2	179.3	-177.1	176.3	0	112.6	P892 S918 L919	P892-K921 HydrophobicContact CB-CB 4.1Å; P892-K921 HydrophobicContact CG-CB 4.03Å; P892-K921 HydrophobicContact CG-CD 4.4Å; S918-K921 WeakPolarHBondContact O-CB 3.39Å; S918-K921 PolarHBondContact O-N 3.36Å; L919-K921 PolarHBondContact O-N 3.01Å
922	C	92.3	Very high	93.4	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.061	24%	0.244	C	C	.	.			trans	-97.2	112.2	-176.7	-56.2	0	0	0	0	109.5	L891 S918 L919 V925 R949	L891-C922 VanDerWaalsContact CG-SG 3.56Å; S918-C922 PolarHBondContact O-SG 3Å; L919-C922 HydrophobicContact CD1-CB 4.42Å; L919-C922 WeakPolarHBondContact O-CB 3.33Å; L919-C922 PolarHBondContact O-N 3.25Å; C922-V925 HydrophobicContact CB-CB 4.16Å; C922-V925 HydrophobicContact CB-CG2 3.76Å; C922-R949 PolarHBondContact O-NH1 3.01Å
923	S	85.8	Confident	93.2	Very high	119 Å²	119	57.6 Å²	57.6	83%	0.832	28%	0.283	S	S	*	.	S	Bend	trans	-84.5	-25.4	-176.4	56.6	0	0	0	0	114.1
924	K	92.1	Very high	93.1	Very high	109 Å²	109	56.2 Å²	56.2	47%	0.474	28%	0.283	S	S	.	.	S	Bend	trans	-99.6	-19.9	-176	-62.3	-153.9	-162.6	154.9	0	115.3	A895 L897 K926	A895-K924 WeakPolarHBondContact O-CD 3.4Å; A895-K924 WeakPolarHBondContact O-CE 3.48Å; A895-K924 PolarHBondContact O-NZ 2.94Å; L897-K924 CarbonylContact O-C 3.55Å; K924-K926 PolarHBondContact O-N 3.46Å
925	V	95	Very high	92.9	Very high	7 Å²	7	54.7 Å²	54.7	4%	0.042	27%	0.273	C	S	.	.			trans	-62.5	124.2	177.5	179.8	0	0	0	0	108.5	L897 L919 C922 R949	L897-V925 HydrophobicContact CB-CG2 4.48Å; L897-V925 WeakPolarHBondContact O-CA 3.27Å; L897-V925 WeakPolarHBondContact O-CG2 3.49Å; L897-V925 PolarHBondContact O-N 3.44Å; L919-V925 HydrophobicContact CD1-CB 3.73Å; L919-V925 HydrophobicContact CD1-CG1 3.46Å; L919-V925 VanDerWaalsContact CD1-CG1 3.46Å; L919-V925 HydrophobicContact CD1-CG2 4.42Å; C922-V925 HydrophobicContact CB-CB 4.16Å; C922-V925 HydrophobicContact CB-CG2 3.76Å; V925-R949 WeakPolarHBondContact O-CD 3.45Å; V925-R949 PolarHBondContact O-NH1 3.48Å
926	K	94.8	Very high	92.8	Very high	148 Å²	148	57.8 Å²	57.8	64%	0.643	29%	0.292	S	S	*	.			trans	-104.6	-38.1	179.7	-64.7	-178.9	-177.7	173.9	0	111.6	T898 K924 R949	T898-K926 PolarHBondContact O-N 3.22Å; K924-K926 PolarHBondContact O-N 3.46Å; K926-R949 VanDerWaalsContact O-CB 3.32Å; K926-R949 WeakPolarHBondContact O-CB 3.19Å; K926-R949 WeakPolarHBondContact O-CG 3.2Å
927	T	95.1	Very high	92.6	Very high	20 Å²	20	64.1 Å²	64.1	12%	0.123	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	131.2	-179.8	77.5	0	0	0	0	111.3	T898 D899 L900 R929 L951	T898-T927 PolarHBondContact O-N 3.15Å; D899-T927 WeakPolarHBondContact OD1-CG2 3.38Å; D899-T927 PolarHBondContact OD1-OG1 3.29Å; L900-T927 PolarHBondContact N-O 3.03Å; T927-R929 PolarHBondContact OG1-NH1 3.45Å; T927-L951 HydrophobicContact CG2-CD1 3.82Å
928	L	96.1	Very high	92.5	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	110.1	170.4	177.5	54.1	0	0	0	108.8	L900 L915 L919 M930 R949 I950 L951	L900-L928 HydrophobicContact CB-CD1 3.88Å; L900-L928 HydrophobicContact CD2-CD1 3.73Å; L900-L928 HydrophobicContact CG-CD1 3.73Å; L900-L928 WeakPolarHBondContact O-CA 3.31Å; L915-L928 HydrophobicContact CB-CD2 4.39Å; L919-L928 HydrophobicContact CB-CD2 4.4Å; L919-L928 HydrophobicContact CD1-CD2 4.34Å; L919-L928 HydrophobicContact CD2-CB 4.26Å; L919-L928 HydrophobicContact CD2-CD2 3.88Å; L919-L928 HydrophobicContact CG-CD2 4.42Å; L928-M930 HydrophobicContact CD1-CE 4.37Å; L928-M930 HydrophobicContact CD2-CE 3.14Å; L928-M930 HydrophobicContact CG-CE 3.47Å; L928-M930 VanDerWaalsContact CG-CE 3.47Å; L928-R949 PolarHBondContact N-O 3.41Å; L928-I950 CarbonylContact O-C 3.58Å; L928-I950 VanDerWaalsContact O-CA 3.31Å; L928-I950 WeakPolarHBondContact O-CA 3.31Å; L928-L951 PolarHBondContact O-N 3.44Å
929	R	95.3	Very high	92.3	Very high	57 Å²	57	65.2 Å²	65.2	22%	0.215	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	110.8	177.2	-55.3	179.3	176.3	80.1	3.7	108.3	L900 D901 I902 K903 T927 L951 Q953	L900-R929 PolarHBondContact O-N 3.38Å; D901-R929 HydrophobicContact CB-CB 4.43Å; D901-R929 WeakPolarHBondContact OD2-CD 3.36Å; I902-R929 CarbonylContact C-O 3.51Å; I902-R929 WeakPolarHBondContact CG2-O 3.35Å; I902-R929 PolarHBondContact N-O 3.11Å; K903-R929 HydrophobicContact CD-CB 3.82Å; K903-R929 HydrophobicContact CG-CB 3.72Å; K903-R929 PolarHBondContact N-O 3.49Å; T927-R929 PolarHBondContact OG1-NH1 3.45Å; R929-L951 HydrophobicContact CG-CB 4.3Å; R929-Q953 WeakPolarHBondContact CD-OXT 3.37Å; R929-Q953 PolarHBondContact NE-O 2.77Å; R929-Q953 PolarHBondContact NE-OXT 3.04Å
930	M	92.9	Very high	92.3	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.327	C	S	.	.			trans	-126.4	3.2	-173.8	67.2	174.5	71.2	0	0	114.4	I902 A912 L915 L928 N932 I935 F940 I950	I902-M930 HydrophobicContact CG2-CB 3.75Å; A912-M930 HydrophobicContact CB-SD 4.03Å; L915-M930 HydrophobicContact CB-CE 4.13Å; L928-M930 HydrophobicContact CD1-CE 4.37Å; L928-M930 HydrophobicContact CD2-CE 3.14Å; L928-M930 HydrophobicContact CG-CE 3.47Å; L928-M930 VanDerWaalsContact CG-CE 3.47Å; M930-N932 PolarHBondContact O-N 3.46Å; M930-I935 WeakPolarHBondContact O-CD1 3.48Å; M930-F940 HydrophobicContact CG-CD2 4.31Å; M930-F940 HydrophobicContact CG-CE2 3.97Å; M930-I950 HydrophobicContact CE-CD1 3.83Å; M930-I950 HydrophobicContact CE-CG1 3.99Å; M930-I950 HydrophobicContact CE-CG2 4.05Å; M930-I950 HydrophobicContact CG-CG2 4.17Å; M930-I950 HydrophobicContact SD-CG2 4.25Å
931	W	91.1	Very high	92.3	Very high	36 Å²	36	59.7 Å²	59.7	14%	0.136	31%	0.308	C	S	.	.			trans	-64.3	132.1	-172.6	176.4	-128.8	0	0	0	113.2	K903 Y904 I935 F940 W952	K903-W931 CarbonylContact C-O 3.54Å; K903-W931 WeakPolarHBondContact CA-O 3.43Å; K903-W931 WeakPolarHBondContact CB-O 3.42Å; K903-W931 HydrophobicContact CG-CB 4.44Å; Y904-W931 PolarHBondContact N-O 2.79Å; W931-I935 HydrophobicContact CE3-CB 4.06Å; W931-I935 HydrophobicContact CE3-CG2 4.47Å; W931-I935 WeakPolarHBondContact CH2-O 3.42Å; W931-I935 HydrophobicContact CZ3-CB 3.62Å; W931-I935 HydrophobicContact CZ3-CG2 4.07Å; W931-I935 WeakPolarHBondContact CZ3-O 3.39Å; W931-F940 HydrophobicContact CB-CD2 4.41Å; W931-F940 HydrophobicContact CB-CE2 3.95Å; W931-F940 HydrophobicContact CB-CZ 4.26Å; W931-F940 HydrophobicContact CE3-CB 4.21Å; W931-F940 HydrophobicContact CE3-CD2 4.03Å; W931-F940 HydrophobicContact CE3-CG 4.06Å; W931-F940 HydrophobicContact CZ3-CB 4.28Å; W931-W952 HydrophobicContact CB-CE3 4.2Å; W931-W952 AromaticContact CD1-CD2 3.78Å; W931-W952 AromaticContact CD1-CE2 3.66Å; W931-W952 AromaticContact CD1-CE3 3.66Å; W931-W952 AromaticContact CD1-CH2 3.46Å; W931-W952 VanDerWaalsContact CD1-CH2 3.46Å; W931-W952 AromaticContact CD1-CZ2 3.52Å; W931-W952 AromaticContact CD1-CZ3 3.5Å; W931-W952 VanDerWaalsContact CD1-CZ3 3.5Å; W931-W952 AromaticContact CD2-CE3 3.98Å; W931-W952 HydrophobicContact CD2-CE3 3.98Å; W931-W952 AromaticContact CD2-CH2 3.83Å; W931-W952 HydrophobicContact CD2-CH2 3.83Å; W931-W952 AromaticContact CD2-CZ3 3.42Å; W931-W952 HydrophobicContact CD2-CZ3 3.42Å; W931-W952 VanDerWaalsContact CD2-CZ3 3.42Å; W931-W952 AromaticContact CE2-CH2 3.24Å; W931-W952 AromaticContact CE2-CZ3 3.37Å; W931-W952 HydrophobicContact CE3-CZ3 4.04Å; W931-W952 HydrophobicContact CG-CD2 4.15Å; W931-W952 AromaticContact CG-CE3 3.66Å; W931-W952 HydrophobicContact CG-CE3 3.66Å; W931-W952 HydrophobicContact CG-CH2 4Å; W931-W952 HydrophobicContact CG-CZ2 4.4Å; W931-W952 AromaticContact CG-CZ3 3.58Å; W931-W952 HydrophobicContact CG-CZ3 3.58Å; W931-W952 AromaticContact CZ2-CH2 3.74Å; W931-W952 HydrophobicContact CZ2-CH2 3.74Å; W931-W952 AromaticContact CZ2-CZ3 3.99Å; W931-W952 HydrophobicContact CZ2-CZ3 3.99Å; W931-W952 AromaticContact NE1-CE2 3.91Å; W931-W952 AromaticContact NE1-CH2 2.96Å; W931-W952 AromaticContact NE1-CZ2 3.25Å; W931-W952 AromaticContact NE1-CZ3 3.38Å
932	N	89.4	Confident	92.4	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	30%	0.304	C	S	.	.			trans	-153.9	166.4	171.2	76.5	71.6	0	0	0	110.7	N905 M907 M930 C934 I935	N905-N932 VanDerWaalsContact O-CB 3.29Å; N905-N932 WeakPolarHBondContact O-CB 3.46Å; N905-N932 VanDerWaalsContact O-CG 3.29Å; N905-N932 PolarHBondContact O-OD1 2.9Å; M907-N932 WeakPolarHBondContact CG-ND2 3.3Å; M907-N932 PolarHBondContact O-ND2 3.42Å; M907-N932 PolarHBondContact O-OD1 3.08Å; M930-N932 PolarHBondContact O-N 3.46Å; N932-C934 PolarHBondContact O-N 3.18Å; N932-C934 VanDerWaalsContact O-N 3.17Å; N932-C934 WeakPolarHBondContact OD1-CA 3.35Å; N932-C934 WeakPolarHBondContact OD1-CB 3.43Å; N932-C934 PolarHBondContact OD1-N 2.82Å; N932-I935 VanDerWaalsContact ND2-CD1 3.28Å; N932-I935 WeakPolarHBondContact ND2-CD1 3.29Å; N932-I935 WeakPolarHBondContact ND2-CG1 3.28Å; N932-I935 PolarHBondContact O-N 3.3Å; N932-I935 PolarHBondContact OD1-N 2.61Å
933	Q	90.7	Very high	92.4	Very high	177 Å²	177	60 Å²	60	83%	0.827	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.8	-173.2	-64	179.8	0.8	0	0	115.2
934	C	92.1	Very high	92.8	Very high	67 Å²	67	57.9 Å²	57.9	45%	0.453	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-15.6	-179.1	-59.6	0	0	0	0	113.3	M907 N932 P936	M907-C934 WeakPolarHBondContact O-CB 3.41Å; N932-C934 PolarHBondContact O-N 3.18Å; N932-C934 VanDerWaalsContact O-N 3.17Å; N932-C934 WeakPolarHBondContact OD1-CA 3.35Å; N932-C934 WeakPolarHBondContact OD1-CB 3.43Å; N932-C934 PolarHBondContact OD1-N 2.82Å; C934-P936 WeakPolarHBondContact O-CD 3.2Å
935	I	92.4	Very high	92.8	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.015	29%	0.293	C	S	.	.	S	Bend	trans	-82.2	125.4	174.2	-59.7	167.5	0	0	0	108.1	M907 A912 M930 W931 N932 Y937 V939 F940	M907-I935 HydrophobicContact CG-CD1 4.12Å; M907-I935 HydrophobicContact CG-CG1 4.38Å; M907-I935 WeakPolarHBondContact O-CG1 3.21Å; M907-I935 HydrophobicContact SD-CD1 4.42Å; A912-I935 HydrophobicContact CB-CD1 3.86Å; A912-I935 HydrophobicContact CB-CG1 4.12Å; A912-I935 HydrophobicContact CB-CG2 4.36Å; M930-I935 WeakPolarHBondContact O-CD1 3.48Å; W931-I935 HydrophobicContact CE3-CB 4.06Å; W931-I935 HydrophobicContact CE3-CG2 4.47Å; W931-I935 WeakPolarHBondContact CH2-O 3.42Å; W931-I935 HydrophobicContact CZ3-CB 3.62Å; W931-I935 HydrophobicContact CZ3-CG2 4.07Å; W931-I935 WeakPolarHBondContact CZ3-O 3.39Å; N932-I935 VanDerWaalsContact ND2-CD1 3.28Å; N932-I935 WeakPolarHBondContact ND2-CD1 3.29Å; N932-I935 WeakPolarHBondContact ND2-CG1 3.28Å; N932-I935 PolarHBondContact O-N 3.3Å; N932-I935 PolarHBondContact OD1-N 2.61Å; I935-Y937 PolarHBondContact O-N 2.75Å; I935-V939 HydrophobicContact CG2-CB 4.48Å; I935-F940 HydrophobicContact CG2-CB 3.94Å
936	P	93.5	Very high	92.7	Very high	64 Å²	64	64.4 Å²	64.4	42%	0.416	31%	0.312	S	S	.	.			trans	-61.2	131.2	172	-22.4	33.6	0	0	0	110.6	C934 G938 V939 F940	C934-P936 WeakPolarHBondContact O-CD 3.2Å; P936-G938 PolarHBondContact O-N 3.31Å; P936-G938 VanDerWaalsContact O-N 3.14Å; P936-V939 HydrophobicContact CB-CB 4.39Å; P936-V939 HydrophobicContact CB-CG2 4.01Å; P936-V939 HydrophobicContact CG-CG2 4.19Å; P936-V939 WeakPolarHBondContact O-CA 3.15Å; P936-V939 WeakPolarHBondContact O-CB 3.31Å; P936-V939 PolarHBondContact O-N 2.94Å; P936-F940 PolarHBondContact O-N 3.26Å; P936-F940 VanDerWaalsContact O-N 3.13Å
937	Y	90.3	Very high	92.6	Very high	139 Å²	139	58.2 Å²	58.2	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-52.7	-40.8	-176.8	-179.9	-99.2	0	0	0	113.2	I935 V939 F940 E941 W952	I935-Y937 PolarHBondContact O-N 2.75Å; Y937-V939 VanDerWaalsContact C-N 3.29Å; Y937-V939 PolarHBondContact O-N 3.36Å; Y937-F940 PolarHBondContact O-N 3.49Å; Y937-E941 HydrophobicContact CD1-CG 4.18Å; Y937-E941 HydrophobicContact CE1-CG 3.59Å; Y937-E941 HydrophobicContact CE2-CG 4.06Å; Y937-E941 PolarHBondContact O-N 2.92Å; Y937-W952 HydrophobicContact CD2-CH2 4.24Å; Y937-W952 AromaticContact CD2-CZ3 3.96Å; Y937-W952 HydrophobicContact CD2-CZ3 3.96Å; Y937-W952 HydrophobicContact CE2-CH2 4.26Å; Y937-W952 AromaticContact CE2-CZ3 3.95Å; Y937-W952 HydrophobicContact CE2-CZ3 3.95Å
938	G	91.6	Very high	92.5	Very high	54 Å²	54	62.2 Å²	62.2	56%	0.557	32%	0.315	S	S	*	.	H	α-helix	trans	-63.6	-32	177.3	0	0	0	0	0	113.9	P936 R942	P936-G938 PolarHBondContact O-N 3.31Å; P936-G938 VanDerWaalsContact O-N 3.14Å; G938-R942 WeakPolarHBondContact O-CB 3.42Å; G938-R942 PolarHBondContact O-N 2.89Å; G938-R942 VanDerWaalsContact O-N 3.13Å
939	V	91.5	Very high	92.5	Very high	33 Å²	33	64.7 Å²	64.7	20%	0.2	32%	0.324	C	S	.	.	H	α-helix	trans	-70.9	-46.5	174.4	174.8	0	0	0	0	110.1	D909 I935 P936 Y937 E941 R942 L943	D909-V939 HydrophobicContact CB-CB 4.35Å; D909-V939 HydrophobicContact CB-CG1 3.87Å; D909-V939 HydrophobicContact CB-CG2 4.06Å; I935-V939 HydrophobicContact CG2-CB 4.48Å; P936-V939 HydrophobicContact CB-CB 4.39Å; P936-V939 HydrophobicContact CB-CG2 4.01Å; P936-V939 HydrophobicContact CG-CG2 4.19Å; P936-V939 WeakPolarHBondContact O-CA 3.15Å; P936-V939 WeakPolarHBondContact O-CB 3.31Å; P936-V939 PolarHBondContact O-N 2.94Å; Y937-V939 VanDerWaalsContact C-N 3.29Å; Y937-V939 PolarHBondContact O-N 3.36Å; V939-E941 PolarHBondContact O-N 3.26Å; V939-R942 PolarHBondContact O-N 3.17Å; V939-L943 HydrophobicContact CG1-CD1 4.05Å; V939-L943 HydrophobicContact CG1-CG 4.42Å; V939-L943 WeakPolarHBondContact O-CG 3.39Å; V939-L943 PolarHBondContact O-N 3.13Å
940	F	92.7	Very high	92.4	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59	-48.5	178.3	-180	-92	0	0	0	111.9	M930 W931 I935 P936 Y937 R942 L943 K944 I950 W952	M930-F940 HydrophobicContact CG-CD2 4.31Å; M930-F940 HydrophobicContact CG-CE2 3.97Å; W931-F940 HydrophobicContact CB-CD2 4.41Å; W931-F940 HydrophobicContact CB-CE2 3.95Å; W931-F940 HydrophobicContact CB-CZ 4.26Å; W931-F940 HydrophobicContact CE3-CB 4.21Å; W931-F940 HydrophobicContact CE3-CD2 4.03Å; W931-F940 HydrophobicContact CE3-CG 4.06Å; W931-F940 HydrophobicContact CZ3-CB 4.28Å; I935-F940 HydrophobicContact CG2-CB 3.94Å; P936-F940 PolarHBondContact O-N 3.26Å; P936-F940 VanDerWaalsContact O-N 3.13Å; Y937-F940 PolarHBondContact O-N 3.49Å; F940-R942 VanDerWaalsContact C-N 3.32Å; F940-R942 PolarHBondContact O-N 3.14Å; F940-L943 PolarHBondContact O-N 3.21Å; F940-K944 HydrophobicContact CE1-CD 4.11Å; F940-K944 WeakPolarHBondContact O-CB 3.48Å; F940-K944 PolarHBondContact O-N 3.04Å; F940-I950 HydrophobicContact CE2-CG2 3.81Å; F940-I950 HydrophobicContact CZ-CG2 4.06Å; F940-W952 AromaticContact CD1-CE3 3.91Å; F940-W952 HydrophobicContact CD1-CE3 3.91Å; F940-W952 HydrophobicContact CD1-CZ3 4.23Å; F940-W952 HydrophobicContact CE1-CB 4.31Å; F940-W952 AromaticContact CE1-CE3 3.58Å; F940-W952 HydrophobicContact CE1-CE3 3.58Å; F940-W952 HydrophobicContact CE1-CZ3 4.35Å; F940-W952 HydrophobicContact CZ-CB 4.36Å; F940-W952 HydrophobicContact CZ-CE3 4.14Å
941	E	92.1	Very high	92.2	Very high	45 Å²	45	64.6 Å²	64.6	21%	0.21	33%	0.328	C	S	.	.	H	α-helix	trans	-61.2	-40.1	177.3	-81.8	-65.7	126.4	0	0	111.9	Y937 V939 K944 Q945	Y937-E941 HydrophobicContact CD1-CG 4.18Å; Y937-E941 HydrophobicContact CE1-CG 3.59Å; Y937-E941 HydrophobicContact CE2-CG 4.06Å; Y937-E941 PolarHBondContact O-N 2.92Å; V939-E941 PolarHBondContact O-N 3.26Å; E941-K944 PolarHBondContact O-N 3.39Å; E941-K944 IonicContact OE1-NZ 2.68Å; E941-Q945 VanDerWaalsContact O-CG 3.31Å; E941-Q945 WeakPolarHBondContact O-CG 3.49Å; E941-Q945 PolarHBondContact O-N 3.25Å
942	R	93.8	Very high	91.5	Very high	168 Å²	168	67.8 Å²	67.8	63%	0.634	34%	0.34	S	S	*	.	H	α-helix	trans	-62.3	-44.5	174.4	-177	179.6	179.4	175.8	0.9	112	G938 V939 F940 Q945 Q946	G938-R942 WeakPolarHBondContact O-CB 3.42Å; G938-R942 PolarHBondContact O-N 2.89Å; G938-R942 VanDerWaalsContact O-N 3.13Å; V939-R942 PolarHBondContact O-N 3.17Å; F940-R942 VanDerWaalsContact C-N 3.32Å; F940-R942 PolarHBondContact O-N 3.14Å; R942-Q945 PolarHBondContact O-N 3.33Å; R942-Q946 VanDerWaalsContact O-CG 3.32Å; R942-Q946 WeakPolarHBondContact O-CG 3.09Å; R942-Q946 PolarHBondContact O-N 2.92Å
943	L	93.1	Very high	89.9	Confident	13 Å²	13	76.4 Å²	76.4	7%	0.068	38%	0.38	C	S	.	.	H	α-helix	trans	-63.4	-42.4	177.9	-72.7	172.4	0	0	0	111.3	A912 Q913 V939 F940 Q945 Q946 D947 I950	A912-L943 HydrophobicContact CB-CD1 3.81Å; Q913-L943 HydrophobicContact CG-CD2 4.44Å; V939-L943 HydrophobicContact CG1-CD1 4.05Å; V939-L943 HydrophobicContact CG1-CG 4.42Å; V939-L943 WeakPolarHBondContact O-CG 3.39Å; V939-L943 PolarHBondContact O-N 3.13Å; F940-L943 PolarHBondContact O-N 3.21Å; L943-Q945 VanDerWaalsContact C-N 3.35Å; L943-Q945 PolarHBondContact O-N 3.1Å; L943-Q946 WeakPolarHBondContact O-CB 3.01Å; L943-Q946 PolarHBondContact O-N 3.47Å; L943-Q946 VanDerWaalsContact O-N 3.1Å; L943-D947 PolarHBondContact O-N 3.2Å; L943-I950 HydrophobicContact CB-CD1 3.96Å
944	K	93.4	Very high	89.9	Confident	74 Å²	74	71.4 Å²	71.4	32%	0.322	36%	0.358	S	S	.	.	H	α-helix	trans	-64	-35.4	175.2	175.4	176.5	169.2	-157.7	0	113.6	F940 E941 Q946 D947 I950	F940-K944 HydrophobicContact CE1-CD 4.11Å; F940-K944 WeakPolarHBondContact O-CB 3.48Å; F940-K944 PolarHBondContact O-N 3.04Å; E941-K944 PolarHBondContact O-N 3.39Å; E941-K944 IonicContact OE1-NZ 2.68Å; K944-Q946 VanDerWaalsContact C-N 3.32Å; K944-D947 CarbonylContact O-C 3.25Å; K944-D947 VanDerWaalsContact O-C 3.25Å; K944-D947 VanDerWaalsContact O-O 3.07Å; K944-I950 HydrophobicContact CB-CB 4.47Å; K944-I950 HydrophobicContact CB-CG2 4.49Å; K944-I950 WeakPolarHBondContact CG-O 3.35Å
945	Q	92.5	Very high	89.8	Confident	158 Å²	158	71.6 Å²	71.6	74%	0.738	35%	0.353	S	S	*	.	H	α-helix	trans	-68.5	-32.6	171.7	-73.5	174.3	6.4	0	0	112.2	E941 R942 L943	E941-Q945 VanDerWaalsContact O-CG 3.31Å; E941-Q945 WeakPolarHBondContact O-CG 3.49Å; E941-Q945 PolarHBondContact O-N 3.25Å; R942-Q945 PolarHBondContact O-N 3.33Å; L943-Q945 VanDerWaalsContact C-N 3.35Å; L943-Q945 PolarHBondContact O-N 3.1Å
946	Q	92.9	Very high	89.6	Confident	95 Å²	95	75.4 Å²	75.4	44%	0.444	37%	0.371	S	S	.	.	H	α-helix	trans	-75.9	-31.7	176.9	-72.3	177.9	3.9	0	0	113	R920 R942 L943 K944	R920-Q946 VanDerWaalsContact NH2-OE1 3.14Å; R942-Q946 VanDerWaalsContact O-CG 3.32Å; R942-Q946 WeakPolarHBondContact O-CG 3.09Å; R942-Q946 PolarHBondContact O-N 2.92Å; L943-Q946 WeakPolarHBondContact O-CB 3.01Å; L943-Q946 PolarHBondContact O-N 3.47Å; L943-Q946 VanDerWaalsContact O-N 3.1Å; K944-Q946 VanDerWaalsContact C-N 3.32Å
947	D	93.1	Very high	89.4	Confident	19 Å²	19	76.1 Å²	76.1	10%	0.102	37%	0.369	C	S	.	.			trans	-143.2	109.4	176.7	-162.8	-39.5	0	0	0	110.3	L919 L943 K944 R949 I950	L919-D947 HydrophobicContact CD2-CB 4.23Å; L919-D947 WeakPolarHBondContact CD2-OD2 3.38Å; L943-D947 PolarHBondContact O-N 3.2Å; K944-D947 CarbonylContact O-C 3.25Å; K944-D947 VanDerWaalsContact O-C 3.25Å; K944-D947 VanDerWaalsContact O-O 3.07Å; D947-R949 PolarHBondContact O-N 3.34Å; D947-R949 VanDerWaalsContact O-N 3.08Å; D947-R949 VanDerWaalsContact OD1-CB 3.22Å; D947-R949 WeakPolarHBondContact OD1-CB 3.32Å; D947-R949 VanDerWaalsContact OD1-CG 3.3Å; D947-R949 WeakPolarHBondContact OD1-CG 3.44Å; D947-R949 IonicContact OD1-CZ 2.67Å; D947-R949 PolarHBondContact OD1-N 3.13Å; D947-R949 VanDerWaalsContact OD1-N 3.11Å; D947-R949 IonicContact OD1-NE 3.84Å; D947-R949 PolarHBondContact OD1-NE 2.94Å; D947-R949 IonicContact OD1-NH2 2.87Å; D947-R949 IonicContact OD2-CZ 3.34Å; D947-R949 IonicContact OD2-NE 3.33Å; D947-R949 PolarHBondContact OD2-NE 3.43Å; D947-R949 IonicContact OD2-NH2 3.6Å; D947-R949 PolarHBondContact OD2-NH2 3.3Å; D947-I950 HydrophobicContact CB-CD1 4.23Å; D947-I950 HydrophobicContact CB-CG1 4.36Å; D947-I950 PolarHBondContact O-N 3.49Å; D947-I950 VanDerWaalsContact O-N 3.1Å
948	S	92.4	Very high	89.4	Confident	103 Å²	103	72.2 Å²	72.2	72%	0.72	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-11.3	-175.7	57.9	0	0	0	0	114	I950	S948-I950 PolarHBondContact O-N 3.37Å
949	R	95.3	Very high	89.2	Confident	52 Å²	52	73.4 Å²	73.4	20%	0.196	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.7	175	-59.3	177.5	-75.1	176.6	-2.8	112.8	L919 C922 V925 K926 L928 D947 L951	L919-R949 HydrophobicContact CD2-CB 4.28Å; L919-R949 PolarHBondContact O-NH2 3.34Å; C922-R949 PolarHBondContact O-NH1 3.01Å; V925-R949 WeakPolarHBondContact O-CD 3.45Å; V925-R949 PolarHBondContact O-NH1 3.48Å; K926-R949 VanDerWaalsContact O-CB 3.32Å; K926-R949 WeakPolarHBondContact O-CB 3.19Å; K926-R949 WeakPolarHBondContact O-CG 3.2Å; L928-R949 PolarHBondContact N-O 3.41Å; D947-R949 PolarHBondContact O-N 3.34Å; D947-R949 VanDerWaalsContact O-N 3.08Å; D947-R949 VanDerWaalsContact OD1-CB 3.22Å; D947-R949 WeakPolarHBondContact OD1-CB 3.32Å; D947-R949 VanDerWaalsContact OD1-CG 3.3Å; D947-R949 WeakPolarHBondContact OD1-CG 3.44Å; D947-R949 IonicContact OD1-CZ 2.67Å; D947-R949 PolarHBondContact OD1-N 3.13Å; D947-R949 VanDerWaalsContact OD1-N 3.11Å; D947-R949 IonicContact OD1-NE 3.84Å; D947-R949 PolarHBondContact OD1-NE 2.94Å; D947-R949 IonicContact OD1-NH2 2.87Å; D947-R949 IonicContact OD2-CZ 3.34Å; D947-R949 IonicContact OD2-NE 3.33Å; D947-R949 PolarHBondContact OD2-NE 3.43Å; D947-R949 IonicContact OD2-NH2 3.6Å; D947-R949 PolarHBondContact OD2-NH2 3.3Å; R949-L951 PolarHBondContact O-N 2.92Å
950	I	93.9	Very high	89	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	114.5	175.9	-60.1	176.2	0	0	0	108.9	L919 L928 M930 F940 L943 K944 D947 S948	L919-I950 HydrophobicContact CD2-CD1 4.18Å; L919-I950 HydrophobicContact CD2-CG1 3.71Å; L928-I950 CarbonylContact O-C 3.58Å; L928-I950 VanDerWaalsContact O-CA 3.31Å; L928-I950 WeakPolarHBondContact O-CA 3.31Å; M930-I950 HydrophobicContact CE-CD1 3.83Å; M930-I950 HydrophobicContact CE-CG1 3.99Å; M930-I950 HydrophobicContact CE-CG2 4.05Å; M930-I950 HydrophobicContact CG-CG2 4.17Å; M930-I950 HydrophobicContact SD-CG2 4.25Å; F940-I950 HydrophobicContact CE2-CG2 3.81Å; F940-I950 HydrophobicContact CZ-CG2 4.06Å; L943-I950 HydrophobicContact CB-CD1 3.96Å; K944-I950 HydrophobicContact CB-CB 4.47Å; K944-I950 HydrophobicContact CB-CG2 4.49Å; K944-I950 WeakPolarHBondContact CG-O 3.35Å; D947-I950 HydrophobicContact CB-CD1 4.23Å; D947-I950 HydrophobicContact CB-CG1 4.36Å; D947-I950 PolarHBondContact O-N 3.49Å; D947-I950 VanDerWaalsContact O-N 3.1Å; S948-I950 PolarHBondContact O-N 3.37Å
951	L	89.3	Confident	88.8	Confident	55 Å²	55	82.2 Å²	82.2	29%	0.288	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	151.3	-172.3	-60.5	-177.9	0	0	0	112.8	T927 L928 R929 R949	T927-L951 HydrophobicContact CG2-CD1 3.82Å; L928-L951 PolarHBondContact O-N 3.44Å; R929-L951 HydrophobicContact CG-CB 4.3Å; R949-L951 PolarHBondContact O-N 2.92Å
952	W	75.8	Confident	88.5	Confident	102 Å²	102	85.3 Å²	85.3	39%	0.386	40%	0.397	S	S	.	.			trans	-87	-39.3	173.4	-177.6	-82.4	0	0	0	112.6	W931 Y937 F940	W931-W952 HydrophobicContact CB-CE3 4.2Å; W931-W952 AromaticContact CD1-CD2 3.78Å; W931-W952 AromaticContact CD1-CE2 3.66Å; W931-W952 AromaticContact CD1-CE3 3.66Å; W931-W952 AromaticContact CD1-CH2 3.46Å; W931-W952 VanDerWaalsContact CD1-CH2 3.46Å; W931-W952 AromaticContact CD1-CZ2 3.52Å; W931-W952 AromaticContact CD1-CZ3 3.5Å; W931-W952 VanDerWaalsContact CD1-CZ3 3.5Å; W931-W952 AromaticContact CD2-CE3 3.98Å; W931-W952 HydrophobicContact CD2-CE3 3.98Å; W931-W952 AromaticContact CD2-CH2 3.83Å; W931-W952 HydrophobicContact CD2-CH2 3.83Å; W931-W952 AromaticContact CD2-CZ3 3.42Å; W931-W952 HydrophobicContact CD2-CZ3 3.42Å; W931-W952 VanDerWaalsContact CD2-CZ3 3.42Å; W931-W952 AromaticContact CE2-CH2 3.24Å; W931-W952 AromaticContact CE2-CZ3 3.37Å; W931-W952 HydrophobicContact CE3-CZ3 4.04Å; W931-W952 HydrophobicContact CG-CD2 4.15Å; W931-W952 AromaticContact CG-CE3 3.66Å; W931-W952 HydrophobicContact CG-CE3 3.66Å; W931-W952 HydrophobicContact CG-CH2 4Å; W931-W952 HydrophobicContact CG-CZ2 4.4Å; W931-W952 AromaticContact CG-CZ3 3.58Å; W931-W952 HydrophobicContact CG-CZ3 3.58Å; W931-W952 AromaticContact CZ2-CH2 3.74Å; W931-W952 HydrophobicContact CZ2-CH2 3.74Å; W931-W952 AromaticContact CZ2-CZ3 3.99Å; W931-W952 HydrophobicContact CZ2-CZ3 3.99Å; W931-W952 AromaticContact NE1-CE2 3.91Å; W931-W952 AromaticContact NE1-CH2 2.96Å; W931-W952 AromaticContact NE1-CZ2 3.25Å; W931-W952 AromaticContact NE1-CZ3 3.38Å; Y937-W952 HydrophobicContact CD2-CH2 4.24Å; Y937-W952 AromaticContact CD2-CZ3 3.96Å; Y937-W952 HydrophobicContact CD2-CZ3 3.96Å; Y937-W952 HydrophobicContact CE2-CH2 4.26Å; Y937-W952 AromaticContact CE2-CZ3 3.95Å; Y937-W952 HydrophobicContact CE2-CZ3 3.95Å; F940-W952 AromaticContact CD1-CE3 3.91Å; F940-W952 HydrophobicContact CD1-CE3 3.91Å; F940-W952 HydrophobicContact CD1-CZ3 4.23Å; F940-W952 HydrophobicContact CE1-CB 4.31Å; F940-W952 AromaticContact CE1-CE3 3.58Å; F940-W952 HydrophobicContact CE1-CE3 3.58Å; F940-W952 HydrophobicContact CE1-CZ3 4.35Å; F940-W952 HydrophobicContact CZ-CB 4.36Å; F940-W952 HydrophobicContact CZ-CE3 4.14Å
953	Q	56.5	Low	88	Confident	183 Å²	183	77.7 Å²	77.7	86%	0.855	38%	0.375	S	S	*	.			trans	-97	0	-178.2	-73	-174.8	-10.3	0	0	112.2	K903 R929	K903-Q953 PolarHBondContact NZ-OXT 3.41Å; R929-Q953 WeakPolarHBondContact CD-OXT 3.37Å; R929-Q953 PolarHBondContact NE-O 2.77Å; R929-Q953 PolarHBondContact NE-OXT 3.04Å

Retrieved 953 of 953 residues in 2263.4 ms (Link to these results)

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