G4VI28_SCHMA Loading...

TGc domain-containing protein

AlphaFold DB , UniProt , Accession G4VI28, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 911 aa.

						>G4VI28_SCHMA|G4VI28
MSKQFNFNNIEEAFGNVLYLSNDSPTTIQNHSHYSPALNSLNHSNNQTVYSPSSSLVGQNHTGNGIHQKYTSSTSPPIKYQNSVRFEPGSSSYVGSNGSNNTNVCYASPGSSNSSSVPYYNKQQYDQVTSTTGGLSRSNQPASSSTNQFYKFDQSTANWSSGPIQRVPPKEFAPSPLSMDTLEEKPKPQEIPTTSDMSSTPYQSFDVFRRIDEHAVSISQQQQDNFNQLIWQLIYARNITDDLEKVRVIFLWLCTKDLHKMNFDHVKPDSPEEILMGIRTGKSTYAQIFYTLCRYAGLHCKLLIGYAKGAEYAPGMHFSGRQGQHSWNAVLIDKCWRLIDCHWAARRLIGKRPSPDNVRYGLDMFYFLASPSQLIYTHFPHDPDWQLLRHPVSLKEFENLAPVKSAFFKYNLDLVTHRNSVIVCSDPEVRIAIAFPSDSKNDLSFTFGLSFDNQEGSEEFRGIPLTRFGRQETLIREHTSVFYIRPPRPGAYKLLIYAKQHQPHQNGQKEGLGIVSMIPDDLSSENLFGAVCEYRLVANFGSNRSLPPFPPCQSSSYGPNELAKNYRITAQRVDCTLRAVRGTLEIRFGLGALPGCPLPRLMAKLKCTLVAENALSKSLLQRSINGNTEAVFAIFLPEAGEYGLEVYANDPVKDGNSFFVVWQYIIISDCDSPVRGLPTIPPTYLGPVSRFDSMGLKALSHTDPFIQANTGELCIQFARHPDKPLRIMAQLIHCSHDVSEDCSQQILQQTRDFQIYFVIRFPHPGFFKFQIYALPYTEPGESLPSVYNYLLEATQVNRGRNGHVMCFPQQFAQWKEGCYLHTPMDGILYPSVSNQPTADTVPFRVTIPTAHAVAVVVGEDWTHLSKVNDCWTGQVCLKPYWGIENQLALCAKYNVDDGNYGTLLEYRLAKR
					

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	26.6	Very low	24.7	Very low	250 Å²	250	169.2 Å²	169.2	100%	1.232	84%	0.838	S	S	*	*				0	94.6	0	-70.3	-178.1	-155.4	0	0	108.5
2	S	27.3	Very low	24.6	Very low	114 Å²	114	170.5 Å²	170.5	80%	0.797	84%	0.84	S	S	*	*			trans	-110.9	101.4	178.5	49	0	0	0	0	108.6	Q4	S2-Q4 PolarHBondContact O-N 3.39Å
3	K	25.4	Very low	24.6	Very low	195 Å²	195	163.5 Å²	163.5	85%	0.848	83%	0.826	S	S	*	*			trans	-74.7	106.3	169.5	-80.2	-176.3	174.8	-178.7	0	108.1	F5	K3-F5 PolarHBondContact O-N 2.97Å
4	Q	23.9	Very low	24.7	Very low	188 Å²	188	167.4 Å²	167.4	88%	0.879	84%	0.835	S	S	*	*			trans	-69.6	118.8	166.8	-85.4	173.7	-31.3	0	0	108.8	S2	S2-Q4 PolarHBondContact O-N 3.39Å
5	F	24.8	Very low	24.6	Very low	166 Å²	166	160.6 Å²	160.6	73%	0.728	82%	0.824	S	S	*	*			trans	-87	116	164.3	-84.4	-86.7	0	0	0	108.2	K3 F7	K3-F5 PolarHBondContact O-N 2.97Å; F5-F7 HydrophobicContact CB-CD2 4.46Å; F5-F7 HydrophobicContact CB-CE2 4.22Å
6	N	22.3	Very low	24.4	Very low	133 Å²	133	160.3 Å²	160.3	71%	0.711	83%	0.825	S	S	*	*			trans	-93.6	107.3	-178.8	-145.7	1.3	0	0	0	107.7
7	F	27.4	Very low	24.3	Very low	176 Å²	176	159.2 Å²	159.2	77%	0.772	83%	0.827	S	S	*	*			trans	-106.9	85.7	170.9	-77.9	-80.2	0	0	0	107.9	F5	F5-F7 HydrophobicContact CB-CD2 4.46Å; F5-F7 HydrophobicContact CB-CE2 4.22Å
8	N	21.7	Very low	24	Very low	121 Å²	121	157.6 Å²	157.6	65%	0.647	82%	0.819	S	S	*	*			trans	-95.1	145.8	166.4	-77.5	-16.4	0	0	0	109
9	N	24.7	Very low	23.8	Very low	153 Å²	153	159.4 Å²	159.4	82%	0.818	82%	0.815	S	S	*	*			trans	93.3	76.1	167.3	-52.2	-13.1	0	0	0	116.7
10	I	26.3	Very low	23.7	Very low	174 Å²	174	158.6 Å²	158.6	89%	0.892	81%	0.812	S	S	*	*			trans	-146.1	75.9	132.6	-51.2	-177.6	0	0	0	107.4
11	E	21.5	Very low	23.5	Very low	191 Å²	191	155.2 Å²	155.2	89%	0.893	80%	0.803	S	S	*	*			trans	-100	108.9	155.1	-85.6	-172.6	159.2	0	0	105.9
12	E	23.1	Very low	23.3	Very low	185 Å²	185	149.9 Å²	149.9	86%	0.864	78%	0.779	S	S	*	*			trans	-176.4	142.3	140.2	-106.8	176.4	-178	0	0	111
13	A	24.7	Very low	23.1	Very low	79 Å²	79	151.2 Å²	151.2	65%	0.653	78%	0.777	S	S	*	*			trans	72.5	86.8	162	0	0	0	0	0	117.9
14	F	25.6	Very low	22.9	Very low	219 Å²	219	147 Å²	147	96%	0.961	77%	0.772	S	S	*	*				-145.1	100	126.1	-83.9	-68.1	0	0	0	110
15	G	23.7	Very low	22.9	Very low	65 Å²	65	143.2 Å²	143.2	67%	0.67	76%	0.764	S	S	*	*			trans	-71.9	141.3	170.6	0	0	0	0	0	111.8	V17	G15-V17 PolarHBondContact O-N 2.98Å
16	N	20.9	Very low	22.7	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	76%	0.764	S	S	*	*			trans	-10.6	107.7	157.8	-62.9	-32.3	0	0	0	116
17	V	22.9	Very low	22.6	Very low	143 Å²	143	140.5 Å²	140.5	87%	0.867	77%	0.766	S	S	*	*			trans	-115.2	91.5	151.8	-177.3	0	0	0	0	107.5	G15	G15-V17 PolarHBondContact O-N 2.98Å
18	L	18.7	Very low	22.3	Very low	129 Å²	129	139.4 Å²	139.4	68%	0.675	77%	0.767	S	S	*	*			trans	-75	130.1	157	-80.4	153.9	0	0	0	107.6
19	Y	21.7	Very low	22.1	Very low	193 Å²	193	141 Å²	141	76%	0.757	77%	0.77	S	S	*	*				163	131	113.6	-90.1	-66.1	0	0	0	113.3
20	L	21.3	Very low	21.9	Very low	142 Å²	142	141.1 Å²	141.1	74%	0.743	77%	0.771	S	S	*	*			trans	70.7	105.9	137.4	-64.9	157.2	0	0	0	121.1
21	S	18.9	Very low	21.6	Very low	89 Å²	89	139.8 Å²	139.8	62%	0.622	76%	0.761	S	S	*	*			trans	-33.7	133.2	132	52.2	0	0	0	0	115.2
22	N	21.7	Very low	21.7	Very low	138 Å²	138	136.5 Å²	136.5	74%	0.738	76%	0.759	S	S	*	*				178.1	151.9	109.6	-95.7	-3	0	0	0	112.6
23	D	24	Very low	21.5	Very low	141 Å²	141	134.8 Å²	134.8	75%	0.754	75%	0.751	S	S	*	*			trans	85.8	97.5	154.9	-57.1	-20.8	0	0	0	121
24	S	20.1	Very low	21.5	Very low	106 Å²	106	142.5 Å²	142.5	74%	0.741	76%	0.764	S	S	*	*			trans	-48.3	148.1	133.9	50.2	0	0	0	0	112
25	P	25.3	Very low	21.3	Very low	109 Å²	109	136.9 Å²	136.9	71%	0.708	75%	0.752	S	S	*	*				-153.1	172.3	72.6	37.5	-16	0	0	0	118.2
26	T	21	Very low	21.7	Very low	117 Å²	117	139.9 Å²	139.9	72%	0.718	76%	0.76	S	S	*	*			trans	78.7	96.5	145.4	33.8	0	0	0	0	121.3
27	T	18.7	Very low	21.8	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	75%	0.754	S	S	*	*				16.8	111.7	120.2	-35	0	0	0	0	118
28	I	20.8	Very low	21.7	Very low	153 Å²	153	137 Å²	137	79%	0.785	75%	0.751	S	S	*	*			trans	-118.8	114.8	154.7	-66.1	176.6	0	0	0	107.6
29	Q	17.9	Very low	21.8	Very low	153 Å²	153	137.9 Å²	137.9	72%	0.715	76%	0.756	S	S	*	*			trans	-71.4	134.6	165.1	-71.2	178.4	-21.3	0	0	108.9
30	N	21.5	Very low	21.7	Very low	156 Å²	156	133.3 Å²	133.3	83%	0.834	75%	0.752	S	S	*	*			trans	-138.7	114.3	153.9	-98.1	-28.5	0	0	0	109.5
31	H	19.6	Very low	21.8	Very low	147 Å²	147	133.4 Å²	133.4	68%	0.681	75%	0.753	S	S	*	*			trans	-69.7	139.6	166.5	-80	-92.4	0	0	0	110.1
32	S	23.3	Very low	22	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	76%	0.759	S	S	*	*			trans	-162.6	121.1	135.4	24.6	0	0	0	0	110.6
33	H	20.2	Very low	21.9	Very low	150 Å²	150	138 Å²	138	69%	0.694	76%	0.764	S	S	*	*			trans	-63.6	141.3	172.6	-70.6	-95.4	0	0	0	111.7
34	Y	23	Very low	21.8	Very low	240 Å²	240	136.7 Å²	136.7	94%	0.941	77%	0.766	S	S	*	*			trans	-142.2	126.2	137.8	-101.8	-80.7	0	0	0	110.1
35	S	22.5	Very low	21.8	Very low	101 Å²	101	138.3 Å²	138.3	71%	0.706	77%	0.766	S	S	*	*			trans	-85.4	164.2	-170.9	-48.3	0	0	0	0	112.5
36	P	31.9	Very low	21.8	Very low	128 Å²	128	140.4 Å²	140.4	83%	0.831	77%	0.771	S	S	*	*			trans	-94.3	151.4	-179.2	36.5	-30.4	0	0	0	112.4
37	A	22.5	Very low	21.7	Very low	84 Å²	84	143.5 Å²	143.5	69%	0.694	78%	0.778	S	S	*	*			trans	-146.7	110.4	166	0	0	0	0	0	109.5
38	L	21.4	Very low	21.8	Very low	154 Å²	154	143.8 Å²	143.8	81%	0.806	78%	0.78	S	S	*	*				76.5	100.3	113.3	-80.7	132.8	0	0	0	113.8
39	N	19.5	Very low	21.7	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	78%	0.778	S	S	*	*				67.3	124	83.9	-92.5	-11.2	0	0	0	114.7
40	S	21.1	Very low	22	Very low	96 Å²	96	146 Å²	146	67%	0.671	79%	0.787	S	S	*	*				117.7	143.3	124.3	77.9	0	0	0	0	117.2
41	L	21.9	Very low	21.9	Very low	145 Å²	145	143.5 Å²	143.5	76%	0.759	78%	0.781	S	S	*	*			trans	79.2	118.9	158.1	-60.9	150.5	0	0	0	112.9
42	N	23.2	Very low	22.1	Very low	140 Å²	140	142.4 Å²	142.4	75%	0.749	79%	0.787	S	S	*	*			cis	-170.3	142.1	35.3	-108.9	-29.7	0	0	0	111.3
43	H	20	Very low	21.9	Very low	183 Å²	183	141.8 Å²	141.8	85%	0.847	78%	0.783	S	S	*	*			trans	-64.9	138.6	157.5	-84.1	-84.7	0	0	0	110.6
44	S	23.2	Very low	22	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	79%	0.786	S	S	*	*			trans	-160.7	109.4	143.5	33.2	0	0	0	0	111.4
45	N	20.1	Very low	21.9	Very low	141 Å²	141	133.5 Å²	133.5	75%	0.754	78%	0.777	S	S	*	*			trans	-2	135	146.4	-66.7	-18.2	0	0	0	119.6
46	N	23.9	Very low	22	Very low	152 Å²	152	137.4 Å²	137.4	81%	0.813	79%	0.789	S	S	*	*				164	102	120.2	-82.4	-15.6	0	0	0	108.1
47	Q	18.6	Very low	21.4	Very low	183 Å²	183	137.7 Å²	137.7	86%	0.855	79%	0.788	S	S	*	*				32.5	107	91.7	-76.6	-167.7	5.5	0	0	115.5
48	T	22.5	Very low	21.4	Very low	132 Å²	132	137 Å²	137	81%	0.81	79%	0.789	S	S	*	*				166.7	106.6	128.5	35.1	0	0	0	0	108
49	V	18.3	Very low	21.4	Very low	123 Å²	123	137.4 Å²	137.4	75%	0.745	79%	0.787	S	S	*	*				49.7	108.1	95.1	-175.3	0	0	0	0	113.7
50	Y	23.4	Very low	21.4	Very low	229 Å²	229	135.7 Å²	135.7	90%	0.898	78%	0.778	S	S	*	*			trans	-162.5	122.2	131.9	-99.2	-72.9	0	0	0	110.2
51	S	19.9	Very low	21.6	Very low	103 Å²	103	139 Å²	139	72%	0.72	78%	0.783	S	S	*	*			trans	-79.7	156.1	150.7	-45.3	0	0	0	0	108
52	P	24.1	Very low	21.6	Very low	124 Å²	124	138.4 Å²	138.4	81%	0.805	79%	0.785	S	S	*	*				-148.4	157.5	93.7	33.6	-14.3	0	0	0	116.3
53	S	18.7	Very low	21.7	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	79%	0.789	S	S	*	*			trans	-65.3	147.2	164.5	45	0	0	0	0	115
54	S	22.4	Very low	21.7	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	80%	0.795	S	S	*	*			trans	171.9	110.2	137.7	41.2	0	0	0	0	108.2
55	S	21.1	Very low	21.8	Very low	106 Å²	106	133.9 Å²	133.9	74%	0.741	80%	0.795	S	S	*	*				59.6	100.6	83.6	71.9	0	0	0	0	114
56	L	25.1	Very low	21.8	Very low	183 Å²	183	134.6 Å²	134.6	96%	0.958	80%	0.798	S	S	*	*			trans	-138.2	122.8	154.2	-93.8	167	0	0	0	109.9
57	V	18.7	Very low	21.8	Very low	134 Å²	134	136.4 Å²	136.4	81%	0.812	80%	0.801	S	S	*	*			trans	-106.5	137.7	178.1	166.4	0	0	0	0	107.1
58	G	22.9	Very low	21.9	Very low	70 Å²	70	136.1 Å²	136.1	72%	0.722	80%	0.8	S	S	*	*			trans	-166.8	104.5	161.8	0	0	0	0	0	107.5
59	Q	20.1	Very low	21.8	Very low	162 Å²	162	138.5 Å²	138.5	76%	0.757	80%	0.799	S	S	*	*				67.3	117.3	72.6	-86.2	-157.7	3.1	0	0	116.6
60	N	20.8	Very low	22	Very low	113 Å²	113	142.7 Å²	142.7	60%	0.604	80%	0.803	S	S	*	*			trans	79.8	114.6	144.6	-55.5	-21.8	0	0	0	120.2
61	H	25.2	Very low	21.9	Very low	166 Å²	166	138.9 Å²	138.9	77%	0.769	80%	0.803	S	S	*	*				175.1	118.4	96.8	-96	-66	0	0	0	114
62	T	21.3	Very low	22.1	Very low	132 Å²	132	138.5 Å²	138.5	81%	0.81	80%	0.801	S	S	*	*			trans	19	127.7	136.1	55.1	0	0	0	0	122.5
63	G	25	Very low	22.2	Very low	81 Å²	81	138.2 Å²	138.2	84%	0.835	80%	0.802	S	S	*	*			trans	-164.4	111.5	156.3	0	0	0	0	0	112.8
64	N	21.5	Very low	22.4	Very low	181 Å²	181	139.2 Å²	139.2	97%	0.968	80%	0.803	S	S	*	*			trans	-74.4	143.1	-179.6	-81.1	-32.4	0	0	0	113.1
65	G	24	Very low	22.6	Very low	78 Å²	78	139 Å²	139	80%	0.804	80%	0.802	S	S	*	*			trans	-170.9	99.2	168.1	0	0	0	0	0	112
66	I	20.8	Very low	22.7	Very low	157 Å²	157	139.2 Å²	139.2	81%	0.805	80%	0.801	S	S	*	*			trans	-76.4	123.2	179.2	-65.4	165.4	0	0	0	109.5
67	H	24.2	Very low	22.7	Very low	190 Å²	190	136.5 Å²	136.5	88%	0.88	79%	0.794	S	S	*	*			trans	-154	115	147.5	-104.8	-68.7	0	0	0	110.6
68	Q	19.4	Very low	22.9	Very low	177 Å²	177	136.7 Å²	136.7	83%	0.827	79%	0.789	S	S	*	*			trans	-61.3	131.2	169.2	-69.1	171.8	-31	0	0	110.4
69	K	21.3	Very low	22.9	Very low	181 Å²	181	142.8 Å²	142.8	79%	0.787	80%	0.796	S	S	*	*			trans	-177.4	129.8	136	-103.9	171.3	-173.6	-179.5	0	112.8
70	Y	23.3	Very low	23.3	Very low	211 Å²	211	145.3 Å²	145.3	83%	0.827	80%	0.8	S	S	*	*			trans	60.9	101.9	161.1	-63	-71.8	0	0	0	119.4	S72	Y70-S72 PolarHBondContact O-N 3.45Å
71	T	20.8	Very low	23.5	Very low	149 Å²	149	148.8 Å²	148.8	91%	0.914	81%	0.812	S	S	*	*			trans	-63.4	104	165.8	49.7	0	0	0	0	111.3
72	S	24.2	Very low	23.6	Very low	95 Å²	95	147.9 Å²	147.9	66%	0.664	81%	0.813	S	S	*	*			trans	-102.3	117.1	151.8	54.9	0	0	0	0	107.5	Y70 T74	Y70-S72 PolarHBondContact O-N 3.45Å; S72-T74 PolarHBondContact O-N 3.48Å
73	S	24.9	Very low	23.9	Very low	119 Å²	119	146.8 Å²	146.8	83%	0.832	81%	0.811	S	S	*	*			trans	-61.9	97.9	178.7	54.9	0	0	0	0	109.8
74	T	24	Very low	23.9	Very low	129 Å²	129	149 Å²	149	79%	0.791	81%	0.809	S	S	*	*			trans	-91.8	97.1	169.8	29.8	0	0	0	0	107.9	S72	S72-T74 PolarHBondContact O-N 3.48Å
75	S	25.3	Very low	23.9	Very low	105 Å²	105	150.3 Å²	150.3	73%	0.734	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60.3	137	165	-30.1	0	0	0	0	108.6
76	P	25.1	Very low	23.9	Very low	110 Å²	110	156.1 Å²	156.1	71%	0.714	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-66.5	151.6	-176.6	9.9	-6.9	0	0	0	112.1	I78	P76-I78 PolarHBondContact O-N 3.13Å
77	P	24.2	Very low	23.9	Very low	126 Å²	126	155.9 Å²	155.9	82%	0.818	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.3	-177	25.1	-31.6	0	0	0	110.7	K79	P77-K79 PolarHBondContact O-N 3.48Å; P77-K79 VanDerWaalsContact O-N 3.09Å
78	I	23.6	Very low	24	Very low	138 Å²	138	152.9 Å²	152.9	71%	0.708	80%	0.796	S	S	*	*			trans	-64.6	107.1	171.4	-62.6	173	0	0	0	107.3	P76 Y80	P76-I78 PolarHBondContact O-N 3.13Å; I78-Y80 PolarHBondContact O-N 2.99Å
79	K	22.1	Very low	24.3	Very low	199 Å²	199	148.3 Å²	148.3	87%	0.865	80%	0.796	S	S	*	*			trans	-66	109.1	164.8	-77	-176.4	176.4	-179.5	0	107.7	P77 Q81	P77-K79 PolarHBondContact O-N 3.48Å; P77-K79 VanDerWaalsContact O-N 3.09Å; K79-Q81 PolarHBondContact O-N 3.19Å
80	Y	28.9	Very low	24.3	Very low	214 Å²	214	145.7 Å²	145.7	84%	0.839	80%	0.801	S	S	*	*			trans	-65.7	116.2	172.4	-83.1	-88.2	0	0	0	109.6	I78 N82	I78-Y80 PolarHBondContact O-N 2.99Å; Y80-N82 PolarHBondContact O-N 2.96Å
81	Q	24.4	Very low	24.4	Very low	186 Å²	186	140.8 Å²	140.8	87%	0.869	80%	0.797	S	S	*	*			trans	-70.1	123.4	165.6	-79.9	177.4	-42.9	0	0	108.8	K79	K79-Q81 PolarHBondContact O-N 3.19Å
82	N	26.9	Very low	24.4	Very low	147 Å²	147	138.6 Å²	138.6	79%	0.786	79%	0.788	S	S	*	*			trans	27.2	107.5	157.9	-66.5	-15	0	0	0	117.4	Y80 V84	Y80-N82 PolarHBondContact O-N 2.96Å; N82-V84 PolarHBondContact O-N 2.97Å
83	S	27.2	Very low	24.4	Very low	109 Å²	109	145 Å²	145	76%	0.762	80%	0.799	S	S	*	*			trans	-17.8	118.6	148.2	33.5	0	0	0	0	113.7	R85	S83-R85 PolarHBondContact O-N 3.39Å
84	V	25.1	Very low	24.2	Very low	129 Å²	129	145.9 Å²	145.9	78%	0.782	80%	0.799	S	S	*	*			trans	-59.9	98.3	167.7	178	0	0	0	0	107.6	N82 F86	N82-V84 PolarHBondContact O-N 2.97Å; V84-F86 PolarHBondContact O-N 2.98Å
85	R	22.8	Very low	24	Very low	207 Å²	207	142.7 Å²	142.7	78%	0.781	79%	0.793	S	S	*	*			trans	-65.9	117.6	166.9	-102.7	-174.7	-175	179.8	3.5	107.8	S83 E87	S83-R85 PolarHBondContact O-N 3.39Å; R85-E87 PolarHBondContact O-N 3.14Å; R85-E87 VanDerWaalsContact O-N 3.15Å
86	F	23.3	Very low	23.9	Very low	200 Å²	200	143.9 Å²	143.9	88%	0.877	80%	0.801	S	S	*	*			trans	-70.2	100	161.6	-82	-93.4	0	0	0	108.1	V84	V84-F86 PolarHBondContact O-N 2.98Å
87	E	21.6	Very low	23.7	Very low	153 Å²	153	146.8 Å²	146.8	72%	0.715	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-93.5	128.7	162.5	-72.7	-150.3	167.9	0	0	109.8	R85 G89	R85-E87 PolarHBondContact O-N 3.14Å; R85-E87 VanDerWaalsContact O-N 3.15Å; E87-G89 PolarHBondContact O-N 2.95Å
88	P	26.2	Very low	23.7	Very low	127 Å²	127	144.5 Å²	144.5	83%	0.825	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-69.9	123.4	174.8	-10	24.8	0	0	0	110.1	S90	P88-S90 PolarHBondContact O-N 3.16Å
89	G	26	Very low	23.7	Very low	80 Å²	80	143.3 Å²	143.3	83%	0.825	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-56.4	125.4	-178.8	0	0	0	0	0	113.1	E87	E87-G89 PolarHBondContact O-N 2.95Å
90	S	19.9	Very low	23.8	Very low	127 Å²	127	141.7 Å²	141.7	89%	0.888	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-80.7	120	164.3	34.8	0	0	0	0	108.9	P88	P88-S90 PolarHBondContact O-N 3.16Å
91	S	26.9	Very low	23.4	Very low	107 Å²	107	139 Å²	139	75%	0.748	81%	0.814	S	S	*	*			trans	-134.6	108.1	162.9	-179	0	0	0	0	109
92	S	20	Very low	23.5	Very low	104 Å²	104	136.9 Å²	136.9	73%	0.727	81%	0.814	S	S	*	*			trans	-55.1	129.2	165.2	48.4	0	0	0	0	111.7
93	Y	23.5	Very low	23.3	Very low	228 Å²	228	137.7 Å²	137.7	89%	0.894	82%	0.819	S	S	*	*			trans	-146	136.1	145.6	-107.5	-80.8	0	0	0	110.9
94	V	20.4	Very low	23.2	Very low	138 Å²	138	139.5 Å²	139.5	84%	0.836	83%	0.825	S	S	*	*			trans	-88.5	137.5	-170.2	168	0	0	0	0	110.4
95	G	20.3	Very low	23	Very low	63 Å²	63	139.1 Å²	139.1	65%	0.649	83%	0.826	S	S	*	*			trans	84.5	117.8	142.6	0	0	0	0	0	118.2
96	S	23.5	Very low	22.9	Very low	129 Å²	129	140.1 Å²	140.1	90%	0.902	83%	0.832	S	S	*	*				175.5	142.7	96.8	-72	0	0	0	0	112.1
97	N	20.5	Very low	22.9	Very low	172 Å²	172	135.4 Å²	135.4	92%	0.92	83%	0.829	S	S	*	*			trans	-56.2	147.4	-176.3	-71.4	-34.6	0	0	0	115.3
98	G	24.7	Very low	23	Very low	78 Å²	78	133.5 Å²	133.5	80%	0.804	83%	0.833	S	S	*	*			trans	-172.1	83.2	167.8	0	0	0	0	0	111
99	S	22.4	Very low	23.2	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	83%	0.834	S	S	*	*			trans	-60.4	129.6	173.7	41.8	0	0	0	0	113.1
100	N	25.4	Very low	23.1	Very low	165 Å²	165	133.4 Å²	133.4	88%	0.882	83%	0.832	S	S	*	*			trans	-159.9	126.2	138.1	-101.2	-18.1	0	0	0	111.7
101	N	21.2	Very low	23.4	Very low	158 Å²	158	133.1 Å²	133.1	85%	0.845	83%	0.83	S	S	*	*			trans	-61.2	131.3	172.1	-85.5	-30.1	0	0	0	111.7
102	T	25.9	Very low	23.5	Very low	142 Å²	142	133.5 Å²	133.5	87%	0.871	83%	0.833	S	S	*	*			trans	-161.7	126.8	132.4	24.1	0	0	0	0	110.1
103	N	21.4	Very low	23.7	Very low	164 Å²	164	136.2 Å²	136.2	88%	0.877	84%	0.839	S	S	*	*			trans	-65	124.3	175	-71.2	-39.8	0	0	0	111.8
104	V	25.2	Very low	23.8	Very low	147 Å²	147	130.5 Å²	130.5	89%	0.891	83%	0.832	S	S	*	*			trans	-145.7	136.1	145.9	-176.1	0	0	0	0	109.3
105	C	22	Very low	24.2	Very low	120 Å²	120	129.3 Å²	129.3	81%	0.811	83%	0.83	S	S	*	*			trans	-66.3	149.7	-168	-62.3	0	0	0	0	116.3
106	Y	20.5	Very low	24.4	Very low	229 Å²	229	131.3 Å²	131.3	90%	0.898	83%	0.834	S	S	*	*			trans	-38.4	124.7	174.1	-66.1	-94	0	0	0	117.7
107	A	23.7	Very low	24.6	Very low	100 Å²	100	130.7 Å²	130.7	83%	0.826	82%	0.824	S	S	*	*			trans	-131.9	122.4	143.4	0	0	0	0	0	108
108	S	24.1	Very low	24.8	Very low	113 Å²	113	127.4 Å²	127.4	79%	0.79	81%	0.813	S	S	*	*			trans	-72.7	157.3	-173.9	-67.1	0	0	0	0	113.6
109	P	29.8	Very low	24.7	Very low	129 Å²	129	133.9 Å²	133.9	84%	0.838	81%	0.814	S	S	*	*			trans	-106.3	157.7	-159.9	36.6	-25.8	0	0	0	114.2
110	G	24.5	Very low	24.8	Very low	76 Å²	76	138.6 Å²	138.6	78%	0.784	82%	0.816	S	S	*	*			trans	-166.2	49.3	172.2	0	0	0	0	0	112.3	S112	G110-S112 PolarHBondContact O-N 3.18Å
111	S	25.3	Very low	24.8	Very low	121 Å²	121	138.1 Å²	138.1	85%	0.846	81%	0.814	S	S	*	*			trans	-79.8	109.7	170	-60.3	0	0	0	0	109.5
112	S	29	Very low	25	Very low	116 Å²	116	138.2 Å²	138.2	81%	0.811	81%	0.807	S	S	*	*			trans	-83.2	115.4	165.9	46	0	0	0	0	109.7	G110 S114	G110-S112 PolarHBondContact O-N 3.18Å; S112-S114 PolarHBondContact O-N 3.43Å
113	N	24.3	Very low	25.1	Very low	161 Å²	161	137.9 Å²	137.9	86%	0.861	80%	0.795	S	S	*	*			trans	-34.2	115.5	176.8	-71.9	-27	0	0	0	114.6	S115	N113-S115 PolarHBondContact O-N 2.86Å
114	S	25.5	Very low	25.3	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	79%	0.794	S	S	*	*			trans	-73	118.7	149.1	69.8	0	0	0	0	107.2	S112 S116	S112-S114 PolarHBondContact O-N 3.43Å; S114-S116 VanDerWaalsContact C-N 3.34Å; S114-S116 PolarHBondContact O-N 3.05Å
115	S	28.2	Very low	25.9	Very low	112 Å²	112	135 Å²	135	78%	0.783	77%	0.765	S	S	*	*			trans	-63.4	101	162.4	48.4	0	0	0	0	107.2	N113 V117	N113-S115 PolarHBondContact O-N 2.86Å; S115-V117 PolarHBondContact O-N 2.83Å
116	S	26.1	Very low	26.7	Very low	105 Å²	105	131.5 Å²	131.5	73%	0.734	74%	0.737	S	S	*	*			trans	-63.4	100.5	173.5	43.3	0	0	0	0	109.3	S114	S114-S116 VanDerWaalsContact C-N 3.34Å; S114-S116 PolarHBondContact O-N 3.05Å
117	V	26.9	Very low	27.2	Very low	116 Å²	116	126.4 Å²	126.4	70%	0.703	72%	0.722	S	S	*	*			trans	-61.1	135.3	160.1	-175.6	0	0	0	0	106.7	S115 Y119	S115-V117 PolarHBondContact O-N 2.83Å; V117-Y119 PolarHBondContact O-N 3.34Å
118	P	24.6	Very low	27.8	Very low	104 Å²	104	123.9 Å²	123.9	68%	0.675	70%	0.696	S	S	*	*			trans	-57.8	126.2	-173.7	-19.1	29.5	0	0	0	110	Y120	P118-Y120 VanDerWaalsContact C-N 3.33Å; P118-Y120 PolarHBondContact O-N 3.47Å
119	Y	23.3	Very low	28.1	Very low	213 Å²	213	122.8 Å²	122.8	84%	0.835	69%	0.685	S	S	*	*			trans	-53.9	98.7	167.9	-91	-94.9	0	0	0	108.3	V117 N121	V117-Y119 PolarHBondContact O-N 3.34Å; Y119-N121 PolarHBondContact O-N 3.46Å
120	Y	24.4	Very low	28.5	Very low	211 Å²	211	118.5 Å²	118.5	83%	0.827	66%	0.658	S	S	*	*			trans	-56.7	122.6	163.9	-97.1	-91.2	0	0	0	106.8	P118 K122	P118-Y120 VanDerWaalsContact C-N 3.33Å; P118-Y120 PolarHBondContact O-N 3.47Å; Y120-K122 PolarHBondContact O-N 2.82Å; Y120-K122 VanDerWaalsContact O-N 3.13Å
121	N	24.1	Very low	28.6	Very low	155 Å²	155	119.9 Å²	119.9	83%	0.829	65%	0.651	S	S	*	*			trans	-40.2	121.5	175.8	-97.8	-39	0	0	0	109.8	Y119 Q123	Y119-N121 PolarHBondContact O-N 3.46Å; N121-Q123 VanDerWaalsContact C-N 3.31Å; N121-Q123 PolarHBondContact O-N 2.91Å
122	K	26.7	Very low	28.7	Very low	160 Å²	160	119.5 Å²	119.5	70%	0.696	64%	0.644	S	S	*	*			trans	-57.8	93.7	175.6	-73.1	178.2	175.1	-179.7	0	108.4	Y120 Q124	Y120-K122 PolarHBondContact O-N 2.82Å; Y120-K122 VanDerWaalsContact O-N 3.13Å; K122-Q124 PolarHBondContact O-N 2.85Å
123	Q	27.2	Very low	28.5	Very low	135 Å²	135	117.4 Å²	117.4	63%	0.631	64%	0.641	S	S	*	*			trans	-61.4	119.7	170.2	-68.4	175.8	-18	0	0	107.2	N121 Y125	N121-Q123 VanDerWaalsContact C-N 3.31Å; N121-Q123 PolarHBondContact O-N 2.91Å; Q123-Y125 HydrophobicContact CB-CD2 3.79Å; Q123-Y125 HydrophobicContact CB-CE2 3.66Å; Q123-Y125 HydrophobicContact CG-CE2 4.44Å; Q123-Y125 PolarHBondContact O-N 2.91Å
124	Q	26.3	Very low	28.5	Very low	180 Å²	180	113.4 Å²	113.4	84%	0.841	64%	0.637	S	S	*	*			trans	-72	59.3	-176.6	-72.9	178	-57.2	0	0	111.8	K122	K122-Q124 PolarHBondContact O-N 2.85Å
125	Y	38.2	Very low	28.5	Very low	72 Å²	72	116.6 Å²	116.6	28%	0.282	65%	0.645	S	S	.	*	S	Bend	trans	-87.4	152.6	160.9	-60.4	-65.9	0	0	0	108.5	Q123 Q127 H390 E396	Q123-Y125 HydrophobicContact CB-CD2 3.79Å; Q123-Y125 HydrophobicContact CB-CE2 3.66Å; Q123-Y125 HydrophobicContact CG-CE2 4.44Å; Q123-Y125 PolarHBondContact O-N 2.91Å; Y125-Q127 PolarHBondContact O-N 2.88Å; Y125-H390 HydrophobicContact CD1-CB 3.99Å; Y125-E396 VanDerWaalsContact CZ-OE1 3.22Å; Y125-E396 PolarHBondContact OH-OE1 2.81Å
126	D	37.2	Very low	28.3	Very low	45 Å²	45	117.4 Å²	117.4	24%	0.241	65%	0.65	C	S	.	*			trans	-45.5	107.9	172.4	-73.9	-36.5	0	0	0	108.3	V128 T194 R389	D126-V128 PolarHBondContact O-N 2.83Å; D126-T194 HydrophobicContact CB-CG2 3.68Å; D126-R389 WeakPolarHBondContact OD2-CB 3.48Å
127	Q	32.8	Very low	28.2	Very low	123 Å²	123	123.5 Å²	123.5	58%	0.575	66%	0.657	S	S	*	*			trans	-68.2	108.4	-174.8	-76.2	-174.7	-12.3	0	0	107.7	Y125 T129	Y125-Q127 PolarHBondContact O-N 2.88Å; Q127-T129 PolarHBondContact O-N 3.23Å
128	V	35.5	Very low	28.2	Very low	46 Å²	46	122.9 Å²	122.9	28%	0.279	66%	0.659	S	S	.	*			trans	-81.7	90.1	163.3	-174.2	0	0	0	0	106.5	D126	D126-V128 PolarHBondContact O-N 2.83Å
129	T	30.5	Very low	28.2	Very low	90 Å²	90	125.8 Å²	125.8	55%	0.552	67%	0.668	S	S	*	*			trans	-89.6	127.8	148.9	36.7	0	0	0	0	106.2	Q127 T131	Q127-T129 PolarHBondContact O-N 3.23Å; T129-T131 PolarHBondContact O-N 2.84Å
130	S	38.2	Very low	28.4	Very low	40 Å²	40	124.3 Å²	124.3	28%	0.28	67%	0.669	S	S	.	*			trans	-67.1	7.6	178.1	65.1	0	0	0	0	114.3	T132 N411 D413	S130-T132 PolarHBondContact O-N 2.93Å; S130-N411 PolarHBondContact OG-O 2.84Å; S130-D413 WeakPolarHBondContact CB-OD2 3.46Å; S130-D413 PolarHBondContact N-OD2 3.03Å; S130-D413 VanDerWaalsContact OG-CG 3.24Å; S130-D413 PolarHBondContact OG-OD2 3.33Å
131	T	26.2	Very low	28.5	Very low	104 Å²	104	120.6 Å²	120.6	64%	0.638	67%	0.671	S	S	*	*			trans	-86.8	88.1	-178.9	56.4	0	0	0	0	112.6	T129	T129-T131 PolarHBondContact O-N 2.84Å
132	T	27.1	Very low	28.8	Very low	114 Å²	114	117.7 Å²	117.7	70%	0.699	67%	0.668	S	S	*	*			trans	-85.8	105.9	147.4	43.2	0	0	0	0	108.6	S130	S130-T132 PolarHBondContact O-N 2.93Å
133	G	25.3	Very low	28.9	Very low	72 Å²	72	115.7 Å²	115.7	74%	0.742	67%	0.674	S	S	*	*	S	Bend	trans	120.7	112.9	167.1	0	0	0	0	0	114.1
134	G	24.5	Very low	29.1	Very low	76 Å²	76	114.3 Å²	114.3	78%	0.784	68%	0.679	S	S	*	*			trans	136.4	36.2	161	0	0	0	0	0	118.5
135	L	25	Very low	29.7	Very low	176 Å²	176	110.4 Å²	110.4	92%	0.921	67%	0.672	S	S	*	*			trans	-136.3	99.6	159.5	-78.9	173.3	0	0	0	110.9	R137	L135-R137 PolarHBondContact O-N 2.81Å
136	S	24	Very low	29.8	Very low	128 Å²	128	112.6 Å²	112.6	90%	0.895	69%	0.693	S	S	*	*			trans	-61.1	111.7	166.4	-55.1	0	0	0	0	110.4
137	R	24.9	Very low	30.5	Very low	233 Å²	233	115 Å²	115	88%	0.879	71%	0.706	S	S	*	*			trans	-153.7	104	157.7	-111.4	175.9	-175	-172.5	1.1	111.9	L135	L135-R137 PolarHBondContact O-N 2.81Å
138	S	26.5	Very low	32	Very low	104 Å²	104	116.5 Å²	116.5	73%	0.727	71%	0.713	S	S	*	*			trans	45	103.2	145.9	59.1	0	0	0	0	120.3
139	N	25.1	Very low	34.1	Very low	164 Å²	164	117.1 Å²	117.1	88%	0.877	71%	0.712	S	S	*	*			trans	27.3	93.3	132.3	-66.3	-7.9	0	0	0	118.7
140	Q	26.1	Very low	36.6	Very low	183 Å²	183	113.7 Å²	113.7	86%	0.855	69%	0.689	S	S	*	*			trans	-147.5	140.8	132.6	-76.4	-159.7	-18.7	0	0	109.6	A142	Q140-A142 PolarHBondContact O-N 2.9Å
141	P	27.9	Very low	38.7	Very low	133 Å²	133	116.9 Å²	116.9	86%	0.864	70%	0.698	S	S	*	*			trans	-84.7	101.5	-169.2	32.4	-30.1	0	0	0	110.7
142	A	29.4	Very low	41	Very low	93 Å²	93	117 Å²	117	77%	0.769	69%	0.69	S	S	*	*			trans	-82.3	131.8	161.2	0	0	0	0	0	108.8	Q140 S144	Q140-A142 PolarHBondContact O-N 2.9Å; A142-S144 PolarHBondContact O-N 2.87Å
143	S	28.7	Very low	43.4	Very low	119 Å²	119	117.3 Å²	117.3	83%	0.832	69%	0.687	S	S	*	*			trans	-43.1	115.4	177.8	49.3	0	0	0	0	112.5	S145	S143-S145 PolarHBondContact O-N 3.2Å; S143-S145 VanDerWaalsContact O-N 3.09Å
144	S	32.2	Very low	46	Very low	105 Å²	105	117.3 Å²	117.3	73%	0.734	67%	0.668	S	S	*	*			trans	-68.1	99.3	176.3	53.9	0	0	0	0	110.8	A142 T146	A142-S144 PolarHBondContact O-N 2.87Å; S144-T146 PolarHBondContact O-N 2.8Å
145	S	38.6	Very low	49.1	Very low	98 Å²	98	115.3 Å²	115.3	69%	0.685	64%	0.642	S	S	*	*			trans	-69.4	102.6	152.4	51.4	0	0	0	0	107	S143 N147	S143-S145 PolarHBondContact O-N 3.2Å; S143-S145 VanDerWaalsContact O-N 3.09Å; S145-N147 PolarHBondContact O-N 2.87Å
146	T	39	Very low	52.2	Low	119 Å²	119	109.2 Å²	109.2	73%	0.73	61%	0.612	S	S	*	*			trans	-62.2	94.7	174.5	-43.9	0	0	0	0	108.4	S144 Q148	S144-T146 PolarHBondContact O-N 2.8Å; T146-Q148 VanDerWaalsContact C-N 3.29Å; T146-Q148 PolarHBondContact O-N 3.31Å
147	N	52.6	Low	55.4	Low	95 Å²	95	103.4 Å²	103.4	51%	0.508	57%	0.572	S	S	.	*			trans	-63.9	93.6	170.7	-86.6	-7.6	0	0	0	108.2	S145 F149	S145-N147 PolarHBondContact O-N 2.87Å; N147-F149 PolarHBondContact O-N 3.08Å; N147-F149 VanDerWaalsContact O-N 3.17Å
148	Q	65.5	Low	58.6	Low	154 Å²	154	96.5 Å²	96.5	72%	0.72	55%	0.552	S	S	*	*			trans	-75.4	99.7	173.9	-120.2	-178.3	-6	0	0	107.6	T146	T146-Q148 VanDerWaalsContact C-N 3.29Å; T146-Q148 PolarHBondContact O-N 3.31Å
149	F	79.7	Confident	61.5	Low	60 Å²	60	94.1 Å²	94.1	26%	0.263	53%	0.527	S	S	.	.			trans	-63.9	141.9	169.1	-64.9	-76.8	0	0	0	110.2	N147 K151 T200 P201 Q203	N147-F149 PolarHBondContact O-N 3.08Å; N147-F149 VanDerWaalsContact O-N 3.17Å; F149-K151 WeakPolarHBondContact O-CG 3.31Å; F149-K151 PolarHBondContact O-N 3.28Å; F149-T200 WeakPolarHBondContact CD1-O 3.47Å; F149-T200 VanDerWaalsContact CE1-O 3.31Å; F149-T200 WeakPolarHBondContact CE1-O 3.19Å; F149-P201 CarbonylContact C-O 3.54Å; F149-P201 WeakPolarHBondContact CA-O 2.94Å; F149-Q203 HydrophobicContact CB-CG 3.86Å; F149-Q203 HydrophobicContact CD1-CG 4.01Å; F149-Q203 HydrophobicContact CD2-CG 3.75Å; F149-Q203 HydrophobicContact CE1-CG 4.49Å; F149-Q203 HydrophobicContact CE2-CG 4.27Å; F149-Q203 HydrophobicContact CG-CG 3.6Å
150	Y	82.9	Confident	64.4	Low	17 Å²	17	89.6 Å²	89.6	7%	0.067	51%	0.509	C	S	.	.	B	Isolated β-bridge	trans	-55.4	129.6	168.4	-179.6	-93.3	0	0	0	110.5	Q154 S155 P201 V207 F208 L243 E244	Y150-Q154 HydrophobicContact CE2-CB 4.31Å; Y150-S155 VanDerWaalsContact OH-CA 3.23Å; Y150-S155 WeakPolarHBondContact OH-CA 3.36Å; Y150-P201 WeakPolarHBondContact CB-O 2.81Å; Y150-P201 PolarHBondContact N-O 3.48Å; Y150-V207 HydrophobicContact CD1-CB 4.18Å; Y150-V207 HydrophobicContact CD1-CG2 3.66Å; Y150-V207 HydrophobicContact CE1-CB 4.32Å; Y150-V207 HydrophobicContact CE1-CG2 4.03Å; Y150-F208 HydrophobicContact CD1-CD1 4.45Å; Y150-F208 AromaticContact CD1-CE1 3.74Å; Y150-F208 HydrophobicContact CD1-CE1 3.74Å; Y150-F208 HydrophobicContact CD1-CZ 4.05Å; Y150-F208 HydrophobicContact CE1-CD1 4.02Å; Y150-F208 AromaticContact CE1-CE1 3.65Å; Y150-F208 HydrophobicContact CE1-CE1 3.65Å; Y150-F208 HydrophobicContact CE1-CZ 4.41Å; Y150-L243 HydrophobicContact CD1-CD2 4.48Å; Y150-L243 HydrophobicContact CD2-CD2 4.19Å; Y150-L243 HydrophobicContact CG-CD2 3.9Å; Y150-E244 HydrophobicContact CE2-CG 4.16Å; Y150-E244 VanDerWaalsContact OH-CG 3.32Å; Y150-E244 WeakPolarHBondContact OH-CG 3.11Å; Y150-E244 PolarHBondContact OH-OE1 2.97Å
151	K	80.9	Confident	66.7	Low	107 Å²	107	87.2 Å²	87.2	47%	0.465	51%	0.512	S	S	.	.			trans	-117.4	154.8	-178.9	-58	-177.6	-178.7	177.6	0	111.4	F149 D153 Q154	F149-K151 WeakPolarHBondContact O-CG 3.31Å; F149-K151 PolarHBondContact O-N 3.28Å; K151-D153 WeakPolarHBondContact CB-OD1 3.37Å; K151-D153 PolarHBondContact O-N 3.49Å; K151-Q154 HydrophobicContact CB-CG 4.15Å; K151-Q154 WeakPolarHBondContact O-CB 3.32Å; K151-Q154 PolarHBondContact O-N 2.91Å
152	F	74.3	Confident	69	Low	107 Å²	107	82.9 Å²	82.9	47%	0.469	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-55.4	-34.2	178.8	147.1	-94.2	0	0	0	113.7	Q154	F152-Q154 PolarHBondContact O-N 3.22Å
153	D	77.5	Confident	71.3	Confident	121 Å²	121	85 Å²	85	65%	0.647	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-77	-5.6	179.7	60.2	-37.9	0	0	0	113.7	K151	K151-D153 WeakPolarHBondContact CB-OD1 3.37Å; K151-D153 PolarHBondContact O-N 3.49Å
154	Q	80.7	Confident	73.8	Confident	72 Å²	72	82.2 Å²	82.2	34%	0.336	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-98.4	4.9	179.7	-61.7	174.5	-27.3	0	0	113.1	Y150 K151 F152 T156	Y150-Q154 HydrophobicContact CE2-CB 4.31Å; K151-Q154 HydrophobicContact CB-CG 4.15Å; K151-Q154 WeakPolarHBondContact O-CB 3.32Å; K151-Q154 PolarHBondContact O-N 2.91Å; F152-Q154 PolarHBondContact O-N 3.22Å; Q154-T156 PolarHBondContact O-N 2.96Å
155	S	88.8	Confident	76.5	Confident	33 Å²	33	82 Å²	82	23%	0.231	46%	0.46	C	S	.	.			trans	-58.2	124.6	177.4	-174.8	0	0	0	0	111.2	Y150 A157 W159 E244	Y150-S155 VanDerWaalsContact OH-CA 3.23Å; Y150-S155 WeakPolarHBondContact OH-CA 3.36Å; S155-A157 VanDerWaalsContact C-N 3.3Å; S155-W159 PolarHBondContact OG-NE1 3.08Å; S155-E244 WeakPolarHBondContact CA-OE1 3.24Å; S155-E244 WeakPolarHBondContact CB-OE1 3.43Å; S155-E244 PolarHBondContact OG-OE1 2.85Å
156	T	90.2	Very high	78.7	Confident	48 Å²	48	85.7 Å²	85.7	29%	0.294	46%	0.459	S	S	.	.			trans	-81.1	-16.7	177.7	59.3	0	0	0	0	112.8	Q154 T240 D241 E244	Q154-T156 PolarHBondContact O-N 2.96Å; T156-T240 VanDerWaalsContact CB-OG1 3.25Å; T156-T240 WeakPolarHBondContact CB-OG1 3.44Å; T156-T240 WeakPolarHBondContact CG2-OG1 3.36Å; T156-T240 PolarHBondContact OG1-N 3.39Å; T156-D241 HydrophobicContact CG2-CB 3.63Å; T156-D241 WeakPolarHBondContact OG1-CB 3.4Å; T156-D241 PolarHBondContact OG1-N 2.82Å; T156-E244 PolarHBondContact N-OE2 2.71Å; T156-E244 PolarHBondContact OG1-OE2 3.19Å
157	A	91.8	Very high	81.1	Confident	7 Å²	7	84.6 Å²	84.6	6%	0.058	45%	0.452	C	S	.	.	S	Bend	trans	-67.7	136.3	-178.1	0	0	0	0	0	112.1	S155 W159 I211 R237 I239	S155-A157 VanDerWaalsContact C-N 3.3Å; A157-W159 HydrophobicContact CB-CD2 4.36Å; A157-W159 HydrophobicContact CB-CH2 4.25Å; A157-W159 HydrophobicContact CB-CZ2 3.45Å; A157-W159 VanDerWaalsContact CB-CZ2 3.45Å; A157-W159 PolarHBondContact O-N 3.47Å; A157-W159 PolarHBondContact O-NE1 2.86Å; A157-I211 HydrophobicContact CB-CD1 4.22Å; A157-R237 HydrophobicContact CB-CB 4.45Å; A157-I239 HydrophobicContact CB-CD1 4.46Å; A157-I239 HydrophobicContact CB-CG1 3.83Å
158	N	91.4	Very high	83	Confident	87 Å²	87	81.3 Å²	81.3	47%	0.465	44%	0.435	S	S	.	.			trans	-74.3	105.4	171.7	-176.5	-2.1	0	0	0	110.4	S160 R237	N158-S160 PolarHBondContact ND2-OG 2.86Å; N158-S160 WeakPolarHBondContact OD1-CB 3.13Å; N158-S160 PolarHBondContact OD1-N 3.37Å; N158-S160 PolarHBondContact OD1-OG 2.84Å; N158-R237 WeakPolarHBondContact CB-O 3.43Å; N158-R237 PolarHBondContact N-O 2.87Å; N158-R237 PolarHBondContact O-NH1 2.92Å
159	W	88.6	Confident	84.3	Confident	54 Å²	54	75.3 Å²	75.3	21%	0.205	41%	0.41	C	S	.	.			trans	-96.6	17	176.8	-57.7	109.9	0	0	0	114.1	S155 A157 R210 I211 H214 R237	S155-W159 PolarHBondContact OG-NE1 3.08Å; A157-W159 HydrophobicContact CB-CD2 4.36Å; A157-W159 HydrophobicContact CB-CH2 4.25Å; A157-W159 HydrophobicContact CB-CZ2 3.45Å; A157-W159 VanDerWaalsContact CB-CZ2 3.45Å; A157-W159 PolarHBondContact O-N 3.47Å; A157-W159 PolarHBondContact O-NE1 2.86Å; W159-R210 HydrophobicContact CD2-CB 3.94Å; W159-R210 HydrophobicContact CD2-CG 4.45Å; W159-R210 HydrophobicContact CE3-CB 4.02Å; W159-R210 HydrophobicContact CH2-CB 3.74Å; W159-R210 WeakPolarHBondContact CH2-O 3.4Å; W159-R210 HydrophobicContact CZ2-CB 3.59Å; W159-R210 HydrophobicContact CZ3-CB 3.91Å; W159-R210 WeakPolarHBondContact CZ3-O 3.32Å; W159-I211 HydrophobicContact CH2-CD1 3.93Å; W159-I211 HydrophobicContact CH2-CG1 4.39Å; W159-I211 HydrophobicContact CZ2-CD1 3.53Å; W159-I211 HydrophobicContact CZ2-CG1 3.91Å; W159-H214 HydrophobicContact CH2-CB 3.97Å; W159-H214 HydrophobicContact CZ3-CB 4.05Å; W159-R237 VanDerWaalsContact CE3-NH1 3.27Å; W159-R237 VanDerWaalsContact CZ3-CD 3.48Å
160	S	85	Confident	84.7	Confident	70 Å²	70	82.6 Å²	82.6	49%	0.49	44%	0.442	S	S	.	.			trans	-57.3	148.5	178.7	57.9	0	0	0	0	112.7	N158 G162	N158-S160 PolarHBondContact ND2-OG 2.86Å; N158-S160 WeakPolarHBondContact OD1-CB 3.13Å; N158-S160 PolarHBondContact OD1-N 3.37Å; N158-S160 PolarHBondContact OD1-OG 2.84Å; S160-G162 PolarHBondContact O-N 2.8Å; S160-G162 VanDerWaalsContact O-N 3.12Å
161	S	74.4	Confident	85	Confident	133 Å²	133	89.4 Å²	89.4	93%	0.93	47%	0.474	S	S	*	.	S	Bend	trans	-70.3	-3.8	-173.8	-39.5	0	0	0	0	114.9
162	G	76.6	Confident	85.5	Confident	41 Å²	41	85.8 Å²	85.8	42%	0.423	46%	0.458	S	S	.	.	S	Bend	trans	-71.2	161.8	-178.3	0	0	0	0	0	113.1	S160 I164	S160-G162 PolarHBondContact O-N 2.8Å; S160-G162 VanDerWaalsContact O-N 3.12Å; G162-I164 PolarHBondContact O-N 2.93Å
163	P	77.2	Confident	86.1	Confident	137 Å²	137	84.6 Å²	84.6	89%	0.89	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-62.6	123	174.7	26.7	-32.6	0	0	0	109.8	Q165	P163-Q165 PolarHBondContact O-N 2.83Å
164	I	82.7	Confident	86.6	Confident	62 Å²	62	79.7 Å²	79.7	32%	0.318	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-69.3	131.6	173.8	-62.7	163.9	0	0	0	108.3	G162 R166 A236 R237	G162-I164 PolarHBondContact O-N 2.93Å; I164-R166 PolarHBondContact O-N 2.86Å; I164-A236 HydrophobicContact CG2-CB 3.57Å; I164-R237 HydrophobicContact CD1-CG 4.33Å
165	Q	87.7	Confident	87	Confident	99 Å²	99	80.7 Å²	80.7	46%	0.463	46%	0.458	S	S	.	.			trans	-60.9	107.1	172.7	177.3	173.7	9.4	0	0	109.4	P163 V167 W231	P163-Q165 PolarHBondContact O-N 2.83Å; Q165-V167 WeakPolarHBondContact CG-O 2.96Å; Q165-V167 PolarHBondContact NE2-O 3.49Å; Q165-W231 HydrophobicContact CB-CZ2 4.25Å; Q165-W231 HydrophobicContact CG-CZ2 4.04Å; Q165-W231 PolarHBondContact O-NE1 2.84Å
166	R	85.7	Confident	87.2	Confident	177 Å²	177	81.4 Å²	81.4	67%	0.668	46%	0.462	S	S	*	.			trans	-79.7	-28.8	-176.7	-64.8	-173.6	-177.9	-177.7	-0.8	113.9	I164 Q232	I164-R166 PolarHBondContact O-N 2.86Å; R166-Q232 PolarHBondContact O-NE2 3.43Å; R166-Q232 VanDerWaalsContact O-NE2 3.08Å
167	V	89.7	Confident	87.2	Confident	95 Å²	95	81.3 Å²	81.3	58%	0.576	46%	0.459	S	S	*	.	S	Bend	trans	-104	125.8	-178.6	-178.6	0	0	0	0	108.3	Q165	Q165-V167 WeakPolarHBondContact CG-O 2.96Å; Q165-V167 PolarHBondContact NE2-O 3.49Å
168	P	91.7	Very high	86.7	Confident	26 Å²	26	83.8 Å²	83.8	17%	0.169	48%	0.476	C	S	.	.			trans	-57.6	145	179	20.2	-30.2	0	0	0	111.9	F172 W231	P168-F172 HydrophobicContact CB-CB 3.91Å; P168-F172 HydrophobicContact CB-CD1 3.46Å; P168-F172 VanDerWaalsContact CB-CD1 3.46Å; P168-F172 HydrophobicContact CB-CE1 4.32Å; P168-F172 HydrophobicContact CB-CG 3.97Å; P168-F172 HydrophobicContact CG-CD1 4.33Å; P168-W231 HydrophobicContact CB-CB 3.95Å; P168-W231 HydrophobicContact CB-CD2 3.83Å; P168-W231 HydrophobicContact CB-CE3 4.15Å; P168-W231 HydrophobicContact CB-CG 3.7Å; P168-W231 HydrophobicContact CG-CB 4.32Å; P168-W231 HydrophobicContact CG-CG 4.37Å
169	P	92.1	Very high	85.7	Confident	29 Å²	29	85.6 Å²	85.6	19%	0.188	48%	0.483	C	S	.	.			trans	-53.6	153.8	167.5	-21.1	29.7	0	0	0	111.4	E171 F172 W231	P169-E171 VanDerWaalsContact CB-CD 3.44Å; P169-E171 HydrophobicContact CB-CG 3.99Å; P169-E171 WeakPolarHBondContact CB-OE1 3.02Å; P169-E171 PolarHBondContact O-N 2.84Å; P169-F172 VanDerWaalsContact O-CB 3.28Å; P169-F172 WeakPolarHBondContact O-CB 2.9Å; P169-F172 PolarHBondContact O-N 2.97Å; P169-W231 HydrophobicContact CG-CH2 3.75Å; P169-W231 HydrophobicContact CG-CZ2 4.2Å; P169-W231 HydrophobicContact CG-CZ3 4.16Å
170	K	88.1	Confident	84.4	Confident	213 Å²	213	90 Å²	90	93%	0.926	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-29	-178.6	-70.5	-175.7	179.5	179.8	0	112.4	F172	K170-F172 VanDerWaalsContact C-N 3.29Å
171	E	89.5	Confident	83.2	Confident	159 Å²	159	89.6 Å²	89.6	74%	0.743	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.6	175.9	60.6	-91	-155	0	0	114.1	P169 A173	P169-E171 VanDerWaalsContact CB-CD 3.44Å; P169-E171 HydrophobicContact CB-CG 3.99Å; P169-E171 WeakPolarHBondContact CB-OE1 3.02Å; P169-E171 PolarHBondContact O-N 2.84Å; E171-A173 PolarHBondContact O-N 3.35Å
172	F	91.4	Very high	82.3	Confident	31 Å²	31	89.7 Å²	89.7	14%	0.136	50%	0.495	C	S	.	.			trans	-74.4	98.8	178.6	-179.1	-107.1	0	0	0	110.8	P168 P169 K170 P174 I230 W231 Y235	P168-F172 HydrophobicContact CB-CB 3.91Å; P168-F172 HydrophobicContact CB-CD1 3.46Å; P168-F172 VanDerWaalsContact CB-CD1 3.46Å; P168-F172 HydrophobicContact CB-CE1 4.32Å; P168-F172 HydrophobicContact CB-CG 3.97Å; P168-F172 HydrophobicContact CG-CD1 4.33Å; P169-F172 VanDerWaalsContact O-CB 3.28Å; P169-F172 WeakPolarHBondContact O-CB 2.9Å; P169-F172 PolarHBondContact O-N 2.97Å; K170-F172 VanDerWaalsContact C-N 3.29Å; F172-P174 HydrophobicContact CD1-CG 4.27Å; F172-P174 HydrophobicContact CE1-CB 4.11Å; F172-P174 HydrophobicContact CE1-CG 3.55Å; F172-P174 HydrophobicContact CE2-CB 4.14Å; F172-P174 HydrophobicContact CE2-CG 4.44Å; F172-P174 HydrophobicContact CZ-CB 3.65Å; F172-P174 HydrophobicContact CZ-CG 3.65Å; F172-I230 HydrophobicContact CE1-CG2 4.01Å; F172-I230 HydrophobicContact CZ-CG2 4.03Å; F172-W231 HydrophobicContact CB-CE3 4.37Å; F172-W231 HydrophobicContact CD1-CB 4.27Å; F172-W231 AromaticContact CD1-CE3 3.94Å; F172-W231 HydrophobicContact CD1-CE3 3.94Å; F172-W231 AromaticContact CD2-CE3 3.6Å; F172-W231 HydrophobicContact CD2-CE3 3.6Å; F172-W231 AromaticContact CD2-CZ3 3.84Å; F172-W231 HydrophobicContact CD2-CZ3 3.84Å; F172-W231 HydrophobicContact CE1-CB 3.8Å; F172-W231 HydrophobicContact CE1-CE3 4.09Å; F172-W231 AromaticContact CE2-CE3 3.78Å; F172-W231 HydrophobicContact CE2-CE3 3.78Å; F172-W231 HydrophobicContact CE2-CZ3 4.26Å; F172-W231 AromaticContact CG-CE3 3.69Å; F172-W231 HydrophobicContact CG-CE3 3.69Å; F172-W231 HydrophobicContact CG-CZ3 4.14Å; F172-W231 HydrophobicContact CZ-CB 4.29Å; F172-W231 HydrophobicContact CZ-CE3 4.02Å; F172-Y235 HydrophobicContact CE1-CD2 4.5Å; F172-Y235 AromaticContact CE2-CD1 3.93Å; F172-Y235 HydrophobicContact CE2-CD1 3.93Å; F172-Y235 AromaticContact CE2-CD2 3.5Å; F172-Y235 HydrophobicContact CE2-CD2 3.5Å; F172-Y235 HydrophobicContact CE2-CE1 4.22Å; F172-Y235 AromaticContact CE2-CE2 3.82Å; F172-Y235 HydrophobicContact CE2-CE2 3.82Å; F172-Y235 AromaticContact CE2-CG 3.55Å; F172-Y235 HydrophobicContact CE2-CG 3.55Å; F172-Y235 AromaticContact CZ-CD2 3.31Å; F172-Y235 HydrophobicContact CZ-CD2 3.31Å; F172-Y235 AromaticContact CZ-CE2 3.6Å; F172-Y235 HydrophobicContact CZ-CE2 3.6Å; F172-Y235 AromaticContact CZ-CG 3.84Å; F172-Y235 HydrophobicContact CZ-CG 3.84Å
173	A	88.3	Confident	81.8	Confident	82 Å²	82	90.6 Å²	90.6	68%	0.678	49%	0.488	S	S	*	.			trans	-120.3	83.7	173.8	0	0	0	0	0	109.1	E171 S175	E171-A173 PolarHBondContact O-N 3.35Å; A173-S175 PolarHBondContact O-N 3.32Å
174	P	87	Confident	81.5	Confident	18 Å²	18	91.1 Å²	91.1	12%	0.117	48%	0.479	C	S	.	.			trans	-66.2	129.6	-179	30.3	-34.8	0	0	0	109	F172 N227 I230 Y295	F172-P174 HydrophobicContact CD1-CG 4.27Å; F172-P174 HydrophobicContact CE1-CB 4.11Å; F172-P174 HydrophobicContact CE1-CG 3.55Å; F172-P174 HydrophobicContact CE2-CB 4.14Å; F172-P174 HydrophobicContact CE2-CG 4.44Å; F172-P174 HydrophobicContact CZ-CB 3.65Å; F172-P174 HydrophobicContact CZ-CG 3.65Å; P174-N227 WeakPolarHBondContact CG-OD1 3.25Å; P174-I230 HydrophobicContact CB-CG2 4.37Å; P174-I230 HydrophobicContact CG-CG2 3.94Å; P174-Y295 HydrophobicContact CB-CD1 4.07Å; P174-Y295 HydrophobicContact CG-CD1 4.23Å; P174-Y295 VanDerWaalsContact O-CE1 3.31Å; P174-Y295 WeakPolarHBondContact O-CE1 3.24Å
175	S	89.7	Confident	81.4	Confident	93 Å²	93	91.6 Å²	91.6	65%	0.65	48%	0.479	S	S	*	.			trans	-104.8	140.2	174.7	55.3	0	0	0	0	109.8	A173	A173-S175 PolarHBondContact O-N 3.32Å
176	P	91.6	Very high	81	Confident	49 Å²	49	88.2 Å²	88.2	32%	0.318	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-68.6	137.2	174.5	28.6	-31.7	0	0	0	109.3	S178 R294 Y295	P176-S178 PolarHBondContact O-N 2.99Å; P176-R294 HydrophobicContact CB-CB 4.03Å; P176-Y295 HydrophobicContact CB-CD2 3.96Å; P176-Y295 HydrophobicContact CB-CE1 4.48Å; P176-Y295 HydrophobicContact CB-CE2 3.77Å; P176-Y295 HydrophobicContact CB-CG 4.39Å; P176-Y295 HydrophobicContact CG-CE1 4.41Å; P176-Y295 HydrophobicContact CG-CE2 4.11Å
177	L	90.1	Very high	80.6	Confident	45 Å²	45	84.8 Å²	84.8	24%	0.236	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-48.1	132.9	168.6	-171	67.5	0	0	0	109.8	R294 H299	L177-R294 PolarHBondContact N-O 2.8Å; L177-R294 PolarHBondContact O-NE 3.23Å; L177-R294 PolarHBondContact O-NH2 2.71Å; L177-H299 HydrophobicContact CD2-CB 4.43Å
178	S	81.3	Confident	80	Confident	59 Å²	59	83.8 Å²	83.8	41%	0.413	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-61.9	152.7	-172.7	67.8	0	0	0	0	111.7	P176 D180 T181	P176-S178 PolarHBondContact O-N 2.99Å; S178-D180 PolarHBondContact O-N 2.81Å; S178-T181 PolarHBondContact O-OG1 2.83Å; S178-T181 WeakPolarHBondContact OG-CG2 3.36Å; S178-T181 PolarHBondContact OG-N 2.9Å; S178-T181 PolarHBondContact OG-OG1 3.46Å
179	M	71.7	Confident	79.1	Confident	125 Å²	125	90.5 Å²	90.5	62%	0.616	48%	0.48	S	S	*	.	S	Bend	trans	-71.5	-21.6	173.2	-69.5	-165.1	-164.1	0	0	111.8	L182	M179-L182 WeakPolarHBondContact O-CG 3.38Å
180	D	61.2	Low	78.3	Confident	147 Å²	147	94.6 Å²	94.6	79%	0.786	50%	0.497	S	S	*	.	S	Bend	trans	-82	-16	-175.7	-57	-40	0	0	0	113.6	S178 L182	S178-D180 PolarHBondContact O-N 2.81Å; D180-L182 PolarHBondContact O-N 3.02Å
181	T	59.1	Low	77.8	Confident	62 Å²	62	85 Å²	85	38%	0.38	46%	0.455	S	S	.	.			trans	-75.5	42.2	169.8	44.8	0	0	0	0	111.7	S178 E183 H299	S178-T181 PolarHBondContact O-OG1 2.83Å; S178-T181 WeakPolarHBondContact OG-CG2 3.36Å; S178-T181 PolarHBondContact OG-N 2.9Å; S178-T181 PolarHBondContact OG-OG1 3.46Å; T181-E183 PolarHBondContact O-N 2.95Å; T181-H299 PolarHBondContact O-CE1 3.17Å; T181-H299 PolarHBondContact O-ND1 2.88Å
182	L	55.6	Low	76.8	Confident	135 Å²	135	79.4 Å²	79.4	71%	0.707	43%	0.433	S	S	*	.			trans	-58.2	102.3	172.7	-76.1	157.8	0	0	0	108.4	M179 D180 E184	M179-L182 WeakPolarHBondContact O-CG 3.38Å; D180-L182 PolarHBondContact O-N 3.02Å; L182-E184 PolarHBondContact O-N 3.31Å
183	E	65.6	Low	75.6	Confident	60 Å²	60	80.1 Å²	80.1	28%	0.28	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-61.4	133.3	157	-74.2	-145.5	172.4	0	0	107.7	T181 L331 K334 W336	T181-E183 PolarHBondContact O-N 2.95Å; E183-L331 HydrophobicContact CG-CD2 4.18Å; E183-L331 WeakPolarHBondContact OE2-CD2 3.35Å; E183-K334 IonicContact OE1-NZ 2.76Å; E183-K334 PolarHBondContact OE1-NZ 2.71Å; E183-W336 HydrophobicContact CB-CZ2 4.34Å
184	E	71.7	Confident	74.1	Confident	147 Å²	147	78.4 Å²	78.4	69%	0.687	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-56.5	145.5	178.8	-160.9	176.8	164.4	0	0	109.3	L182	L182-E184 PolarHBondContact O-N 3.31Å
185	K	80.3	Confident	72.5	Confident	72 Å²	72	81.5 Å²	81.5	31%	0.313	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-56.3	141.4	171.1	-66.8	171.9	169.3	-175.4	0	108.5	K187 D382 D384 W385	K185-K187 PolarHBondContact O-N 2.86Å; K185-D382 WeakPolarHBondContact CE-OD2 3.43Å; K185-D382 IonicContact NZ-OD1 2.72Å; K185-D382 PolarHBondContact NZ-OD1 2.81Å; K185-D382 IonicContact NZ-OD2 2.68Å; K185-D382 PolarHBondContact NZ-OD2 3.34Å; K185-D384 HydrophobicContact CD-CB 3.81Å; K185-D384 WeakPolarHBondContact CD-OD2 3.35Å; K185-D384 IonicContact NZ-OD2 2.68Å; K185-D384 PolarHBondContact NZ-OD2 3.14Å; K185-W385 HydrophobicContact CG-CZ2 4.11Å
186	P	79.4	Confident	70.6	Confident	29 Å²	29	80.6 Å²	80.6	19%	0.188	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-63.9	131.4	177.1	27.3	-31.2	0	0	0	108.8	E190 I191 L387	P186-E190 WeakPolarHBondContact CA-OE2 3.37Å; P186-E190 HydrophobicContact CB-CB 4.49Å; P186-I191 HydrophobicContact CB-CG1 4.43Å; P186-L387 HydrophobicContact CG-CD2 3.73Å
187	K	77.8	Confident	68.5	Low	104 Å²	104	79.7 Å²	79.7	45%	0.452	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-66.4	151.3	173.7	-66.8	174.1	-175.1	161.5	0	108.9	K185 Q189 E190 I191	K185-K187 PolarHBondContact O-N 2.86Å; K187-Q189 PolarHBondContact O-N 3.44Å; K187-E190 HydrophobicContact CB-CG 4.2Å; K187-E190 PolarHBondContact N-OE2 2.85Å; K187-E190 WeakPolarHBondContact O-CA 3.41Å; K187-E190 WeakPolarHBondContact O-CB 3.33Å; K187-E190 PolarHBondContact O-N 2.82Å; K187-I191 PolarHBondContact O-N 2.88Å
188	P	76.3	Confident	66.7	Low	74 Å²	74	80.8 Å²	80.8	48%	0.481	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-27.9	-179.5	-29.5	35.3	0	0	0	115
189	Q	73.9	Confident	65.7	Low	168 Å²	168	79.6 Å²	79.6	79%	0.785	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-26.9	177.2	-64.3	175.5	-14.7	0	0	113.6	K187 I191	K187-Q189 PolarHBondContact O-N 3.44Å; Q189-I191 VanDerWaalsContact C-N 3.34Å
190	E	74.3	Confident	65.9	Low	115 Å²	115	76 Å²	76	54%	0.537	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-14.5	178.5	-63.5	164.6	-174.5	0	0	111.8	P186 K187 P192	P186-E190 WeakPolarHBondContact CA-OE2 3.37Å; P186-E190 HydrophobicContact CB-CB 4.49Å; K187-E190 HydrophobicContact CB-CG 4.2Å; K187-E190 PolarHBondContact N-OE2 2.85Å; K187-E190 WeakPolarHBondContact O-CA 3.41Å; K187-E190 WeakPolarHBondContact O-CB 3.33Å; K187-E190 PolarHBondContact O-N 2.82Å; E190-P192 VanDerWaalsContact O-CD 3.25Å; E190-P192 WeakPolarHBondContact O-CD 3.41Å
191	I	78.3	Confident	66.8	Low	12 Å²	12	70.1 Å²	70.1	6%	0.062	38%	0.381	C	S	.	.	S	Bend	trans	-69.4	116.5	172.7	-57.5	175.1	0	0	0	107.9	P186 K187 Q189 M197 L387 L388 R389	P186-I191 HydrophobicContact CB-CG1 4.43Å; K187-I191 PolarHBondContact O-N 2.88Å; Q189-I191 VanDerWaalsContact C-N 3.34Å; I191-M197 HydrophobicContact CG2-CE 4.36Å; I191-L387 VanDerWaalsContact CG2-O 3.31Å; I191-L387 WeakPolarHBondContact CG2-O 3.48Å; I191-L388 WeakPolarHBondContact CD1-O 3.4Å; I191-R389 HydrophobicContact CB-CG 4.31Å; I191-R389 HydrophobicContact CG2-CG 4.39Å; I191-R389 PolarHBondContact O-NH1 2.8Å
192	P	68.9	Low	67.9	Low	41 Å²	41	67.6 Å²	67.6	27%	0.266	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-55	146.4	177	-14.4	22.4	0	0	0	111.1	E190 D196 M197	E190-P192 VanDerWaalsContact O-CD 3.25Å; E190-P192 WeakPolarHBondContact O-CD 3.41Å; P192-D196 HydrophobicContact CB-CB 3.55Å; P192-M197 HydrophobicContact CB-CG 4.02Å; P192-M197 VanDerWaalsContact CD-CE 3.49Å; P192-M197 HydrophobicContact CG-CE 3.86Å; P192-M197 HydrophobicContact CG-CG 4.31Å
193	T	64.7	Low	69	Low	46 Å²	46	68.4 Å²	68.4	28%	0.282	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-67	165.4	-178.5	60.4	0	0	0	0	111.1	S195 D196 M197	T193-S195 PolarHBondContact O-N 3.49Å; T193-S195 VanDerWaalsContact O-N 3.14Å; T193-S195 PolarHBondContact OG1-OG 2.82Å; T193-D196 PolarHBondContact N-OD2 2.86Å; T193-D196 CarbonylContact O-C 3.57Å; T193-D196 WeakPolarHBondContact O-CA 3.28Å; T193-D196 WeakPolarHBondContact O-CB 3.4Å; T193-D196 PolarHBondContact O-N 2.81Å; T193-D196 VanDerWaalsContact OG1-CG 3.27Å; T193-D196 PolarHBondContact OG1-OD2 2.96Å; T193-M197 PolarHBondContact O-N 3.23Å
194	T	57.3	Low	69.8	Low	46 Å²	46	67.7 Å²	67.7	28%	0.282	37%	0.366	S	S	.	.	H	α-helix	trans	-56.5	-30.8	178.8	45	0	0	0	0	113.3	D126 D196 S198	D126-T194 HydrophobicContact CB-CG2 3.68Å; T194-D196 VanDerWaalsContact C-N 3.28Å; T194-D196 PolarHBondContact O-N 3.09Å; T194-S198 PolarHBondContact O-N 3.41Å
195	S	53.3	Low	70.4	Confident	83 Å²	83	63.1 Å²	63.1	58%	0.58	34%	0.344	S	S	*	.	H	α-helix	trans	-67.6	-24.8	172.1	48.6	0	0	0	0	113.9	T193	T193-S195 PolarHBondContact O-N 3.49Å; T193-S195 VanDerWaalsContact O-N 3.14Å; T193-S195 PolarHBondContact OG1-OG 2.82Å
196	D	50.6	Low	70.6	Confident	74 Å²	74	62.4 Å²	62.4	40%	0.396	34%	0.344	S	S	.	.	H	α-helix	trans	-95.3	-33.2	-179.8	-53.4	-37.4	0	0	0	112	P192 T193 T194 S199	P192-D196 HydrophobicContact CB-CB 3.55Å; T193-D196 PolarHBondContact N-OD2 2.86Å; T193-D196 CarbonylContact O-C 3.57Å; T193-D196 WeakPolarHBondContact O-CA 3.28Å; T193-D196 WeakPolarHBondContact O-CB 3.4Å; T193-D196 PolarHBondContact O-N 2.81Å; T193-D196 VanDerWaalsContact OG1-CG 3.27Å; T193-D196 PolarHBondContact OG1-OD2 2.96Å; T194-D196 VanDerWaalsContact C-N 3.28Å; T194-D196 PolarHBondContact O-N 3.09Å; D196-S199 PolarHBondContact O-OG 3.37Å
197	M	47.8	Very low	71	Confident	29 Å²	29	62.4 Å²	62.4	14%	0.143	34%	0.343	C	S	.	.	H	α-helix	trans	-78.3	-17.8	-179.6	-90.9	-77.8	-179.6	0	0	113.8	I191 P192 T193 S199 P371	I191-M197 HydrophobicContact CG2-CE 4.36Å; P192-M197 HydrophobicContact CB-CG 4.02Å; P192-M197 VanDerWaalsContact CD-CE 3.49Å; P192-M197 HydrophobicContact CG-CE 3.86Å; P192-M197 HydrophobicContact CG-CG 4.31Å; T193-M197 PolarHBondContact O-N 3.23Å; M197-S199 PolarHBondContact O-N 3.12Å; M197-P371 HydrophobicContact CE-CG 4.3Å; M197-P371 HydrophobicContact SD-CG 4.01Å
198	S	51.7	Low	71.6	Confident	68 Å²	68	57.5 Å²	57.5	48%	0.476	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-17.6	176.4	70.2	0	0	0	0	112.8	T194 T200	T194-S198 PolarHBondContact O-N 3.41Å; S198-T200 PolarHBondContact O-N 2.75Å
199	S	59.7	Low	72.2	Confident	34 Å²	34	59.6 Å²	59.6	24%	0.238	32%	0.32	C	S	.	.	S	Bend	trans	-88.4	104.6	174.4	57.7	0	0	0	0	110.4	D196 M197	D196-S199 PolarHBondContact O-OG 3.37Å; M197-S199 PolarHBondContact O-N 3.12Å
200	T	75.7	Confident	73	Confident	50 Å²	50	56.4 Å²	56.4	31%	0.307	30%	0.301	S	S	.	.			trans	-49.6	150.9	159	43	0	0	0	0	109.9	F149 S198 Y202	F149-T200 WeakPolarHBondContact CD1-O 3.47Å; F149-T200 VanDerWaalsContact CE1-O 3.31Å; F149-T200 WeakPolarHBondContact CE1-O 3.19Å; S198-T200 PolarHBondContact O-N 2.75Å; T200-Y202 HydrophobicContact CG2-CE1 4.27Å; T200-Y202 HydrophobicContact CG2-CE2 4.07Å; T200-Y202 PolarHBondContact O-N 2.81Å; T200-Y202 PolarHBondContact OG1-O 3.13Å
201	P	81.9	Confident	73.9	Confident	23 Å²	23	51 Å²	51	15%	0.149	28%	0.276	C	S	.	.	S	Bend	trans	-67.4	5.5	177.9	28.5	-33.8	0	0	0	113.3	F149 Y150 L243 L368	F149-P201 CarbonylContact C-O 3.54Å; F149-P201 WeakPolarHBondContact CA-O 2.94Å; Y150-P201 WeakPolarHBondContact CB-O 2.81Å; Y150-P201 PolarHBondContact N-O 3.48Å; P201-L243 HydrophobicContact CB-CD2 4.15Å; P201-L243 HydrophobicContact CG-CD1 4.05Å; P201-L243 HydrophobicContact CG-CD2 3.9Å; P201-L368 HydrophobicContact CG-CD1 4.01Å
202	Y	81.7	Confident	74.6	Confident	10 Å²	10	50.6 Å²	50.6	4%	0.039	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-137.1	158.9	179	52.6	-96.1	0	0	0	110.3	T200 F205 F208 L243 F367 L368	T200-Y202 HydrophobicContact CG2-CE1 4.27Å; T200-Y202 HydrophobicContact CG2-CE2 4.07Å; T200-Y202 PolarHBondContact O-N 2.81Å; T200-Y202 PolarHBondContact OG1-O 3.13Å; Y202-F205 HydrophobicContact CE2-CD1 4.03Å; Y202-F205 AromaticContact CE2-CE1 3.65Å; Y202-F205 HydrophobicContact CE2-CE1 3.65Å; Y202-F205 AromaticContact CE2-CZ 3.97Å; Y202-F205 HydrophobicContact CE2-CZ 3.97Å; Y202-F205 AromaticContact CZ-CE1 3.62Å; Y202-F205 VanDerWaalsContact OH-CE1 3.32Å; Y202-F205 WeakPolarHBondContact OH-CE1 3.34Å; Y202-F205 WeakPolarHBondContact OH-CZ 3.32Å; Y202-F208 AromaticContact CD1-CE2 3.54Å; Y202-F208 HydrophobicContact CD1-CE2 3.54Å; Y202-F208 AromaticContact CD1-CZ 3.65Å; Y202-F208 HydrophobicContact CD1-CZ 3.65Å; Y202-F208 HydrophobicContact CD2-CE2 4.08Å; Y202-F208 AromaticContact CE1-CE2 4Å; Y202-F208 HydrophobicContact CE1-CE2 4Å; Y202-F208 HydrophobicContact CE1-CZ 4.32Å; Y202-F208 AromaticContact CG-CE2 3.59Å; Y202-F208 HydrophobicContact CG-CE2 3.59Å; Y202-F208 AromaticContact CG-CZ 3.96Å; Y202-F208 HydrophobicContact CG-CZ 3.96Å; Y202-L243 HydrophobicContact CD1-CD1 4.49Å; Y202-L243 HydrophobicContact CD1-CD2 4.4Å; Y202-F367 HydrophobicContact CE1-CD1 4.28Å; Y202-F367 AromaticContact CE1-CE1 3.8Å; Y202-F367 HydrophobicContact CE1-CE1 3.8Å; Y202-F367 WeakPolarHBondContact OH-CD1 3.48Å; Y202-L368 HydrophobicContact CE1-CD1 3.86Å
203	Q	78.6	Confident	75.6	Confident	152 Å²	152	53.3 Å²	53.3	71%	0.71	28%	0.283	S	S	*	.	S	Bend	trans	-89.4	-41.3	179.2	-67	-178.7	-9.7	0	0	113.8	F149	F149-Q203 HydrophobicContact CB-CG 3.86Å; F149-Q203 HydrophobicContact CD1-CG 4.01Å; F149-Q203 HydrophobicContact CD2-CG 3.75Å; F149-Q203 HydrophobicContact CE1-CG 4.49Å; F149-Q203 HydrophobicContact CE2-CG 4.27Å; F149-Q203 HydrophobicContact CG-CG 3.6Å
204	S	81.7	Confident	77	Confident	44 Å²	44	51.8 Å²	51.8	31%	0.308	27%	0.272	S	S	.	.			trans	-142.7	153.3	180	171.6	0	0	0	0	108.9	D206 V207	S204-D206 PolarHBondContact O-N 2.77Å; S204-D206 PolarHBondContact OG-N 2.78Å; S204-D206 VanDerWaalsContact OG-N 3.15Å; S204-D206 PolarHBondContact OG-OD2 3.07Å; S204-V207 WeakPolarHBondContact O-CG2 3.35Å; S204-V207 PolarHBondContact O-N 3.39Å
205	F	85.1	Confident	78.7	Confident	51 Å²	51	49.6 Å²	49.6	22%	0.224	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-64.4	-18	171.5	-71	-62.5	0	0	0	113.4	Y202 V207 F208 M364 F367	Y202-F205 HydrophobicContact CE2-CD1 4.03Å; Y202-F205 AromaticContact CE2-CE1 3.65Å; Y202-F205 HydrophobicContact CE2-CE1 3.65Å; Y202-F205 AromaticContact CE2-CZ 3.97Å; Y202-F205 HydrophobicContact CE2-CZ 3.97Å; Y202-F205 AromaticContact CZ-CE1 3.62Å; Y202-F205 VanDerWaalsContact OH-CE1 3.32Å; Y202-F205 WeakPolarHBondContact OH-CE1 3.34Å; Y202-F205 WeakPolarHBondContact OH-CZ 3.32Å; F205-V207 PolarHBondContact O-N 3.43Å; F205-V207 VanDerWaalsContact O-N 3.11Å; F205-F208 HydrophobicContact CD1-CD2 4.15Å; F205-F208 HydrophobicContact CD1-CE2 4.47Å; F205-F208 WeakPolarHBondContact O-CB 3.24Å; F205-F208 PolarHBondContact O-N 2.79Å; F205-M364 HydrophobicContact CD2-CB 4.42Å; F205-M364 HydrophobicContact CD2-CG 4.36Å; F205-M364 HydrophobicContact CE1-CB 4.45Å; F205-M364 HydrophobicContact CE1-SD 4.34Å; F205-M364 HydrophobicContact CE2-CB 3.57Å; F205-M364 HydrophobicContact CE2-CG 3.97Å; F205-M364 HydrophobicContact CZ-CB 3.6Å; F205-M364 HydrophobicContact CZ-CG 4.08Å; F205-M364 HydrophobicContact CZ-SD 4.38Å; F205-F367 AromaticContact CE1-CD1 3.79Å; F205-F367 HydrophobicContact CE1-CD1 3.79Å; F205-F367 HydrophobicContact CE1-CE1 4.29Å; F205-F367 HydrophobicContact CZ-CD1 4.43Å
206	D	83.1	Confident	80.5	Confident	58 Å²	58	46.9 Å²	46.9	31%	0.31	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-58.6	-26.1	178.5	-63.3	-48.5	0	0	0	113.2	S204 F208 R209 G511 G513	S204-D206 PolarHBondContact O-N 2.77Å; S204-D206 PolarHBondContact OG-N 2.78Å; S204-D206 VanDerWaalsContact OG-N 3.15Å; S204-D206 PolarHBondContact OG-OD2 3.07Å; D206-F208 PolarHBondContact O-N 3.26Å; D206-R209 WeakPolarHBondContact O-CB 3.37Å; D206-R209 PolarHBondContact O-N 3.23Å; D206-R209 VanDerWaalsContact O-N 3.15Å; D206-G511 WeakPolarHBondContact OD2-CA 3.41Å; D206-G513 PolarHBondContact OD1-N 3.1Å
207	V	88.1	Confident	82.4	Confident	29 Å²	29	46.3 Å²	46.3	18%	0.176	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-62.8	-23.8	175.2	-53.9	0	0	0	0	112.3	Y150 S204 F205	Y150-V207 HydrophobicContact CD1-CB 4.18Å; Y150-V207 HydrophobicContact CD1-CG2 3.66Å; Y150-V207 HydrophobicContact CE1-CB 4.32Å; Y150-V207 HydrophobicContact CE1-CG2 4.03Å; S204-V207 WeakPolarHBondContact O-CG2 3.35Å; S204-V207 PolarHBondContact O-N 3.39Å; F205-V207 PolarHBondContact O-N 3.43Å; F205-V207 VanDerWaalsContact O-N 3.11Å
208	F	90.3	Very high	84.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-94.4	4.9	179	-58.6	-64.5	0	0	0	113.6	Y150 Y202 F205 D206 R210 I211 D212 L243 R247	Y150-F208 HydrophobicContact CD1-CD1 4.45Å; Y150-F208 AromaticContact CD1-CE1 3.74Å; Y150-F208 HydrophobicContact CD1-CE1 3.74Å; Y150-F208 HydrophobicContact CD1-CZ 4.05Å; Y150-F208 HydrophobicContact CE1-CD1 4.02Å; Y150-F208 AromaticContact CE1-CE1 3.65Å; Y150-F208 HydrophobicContact CE1-CE1 3.65Å; Y150-F208 HydrophobicContact CE1-CZ 4.41Å; Y202-F208 AromaticContact CD1-CE2 3.54Å; Y202-F208 HydrophobicContact CD1-CE2 3.54Å; Y202-F208 AromaticContact CD1-CZ 3.65Å; Y202-F208 HydrophobicContact CD1-CZ 3.65Å; Y202-F208 HydrophobicContact CD2-CE2 4.08Å; Y202-F208 AromaticContact CE1-CE2 4Å; Y202-F208 HydrophobicContact CE1-CE2 4Å; Y202-F208 HydrophobicContact CE1-CZ 4.32Å; Y202-F208 AromaticContact CG-CE2 3.59Å; Y202-F208 HydrophobicContact CG-CE2 3.59Å; Y202-F208 AromaticContact CG-CZ 3.96Å; Y202-F208 HydrophobicContact CG-CZ 3.96Å; F205-F208 HydrophobicContact CD1-CD2 4.15Å; F205-F208 HydrophobicContact CD1-CE2 4.47Å; F205-F208 WeakPolarHBondContact O-CB 3.24Å; F205-F208 PolarHBondContact O-N 2.79Å; D206-F208 PolarHBondContact O-N 3.26Å; F208-R210 VanDerWaalsContact C-N 3.33Å; F208-R210 PolarHBondContact O-N 3.06Å; F208-R210 VanDerWaalsContact O-N 3.1Å; F208-I211 HydrophobicContact CB-CB 4.46Å; F208-I211 CarbonylContact O-C 3.49Å; F208-I211 WeakPolarHBondContact O-CA 3.49Å; F208-I211 WeakPolarHBondContact O-CB 3.43Å; F208-I211 PolarHBondContact O-N 3.17Å; F208-D212 PolarHBondContact O-N 2.79Å; F208-L243 HydrophobicContact CE1-CD2 4.14Å; F208-L243 HydrophobicContact CE1-CG 3.94Å; F208-L243 HydrophobicContact CZ-CD1 4.21Å; F208-L243 HydrophobicContact CZ-CD2 3.82Å; F208-L243 HydrophobicContact CZ-CG 3.86Å; F208-R247 HydrophobicContact CB-CG 4.02Å; F208-R247 HydrophobicContact CD1-CB 4.32Å; F208-R247 HydrophobicContact CD1-CG 3.91Å; F208-R247 HydrophobicContact CD2-CG 4.4Å; F208-R247 HydrophobicContact CG-CG 3.85Å
209	R	89	Confident	86.5	Confident	118 Å²	118	42.4 Å²	42.4	45%	0.445	22%	0.216	S	C	.	.	H	α-helix	trans	-45.1	-51.9	-172.7	-174.8	-179.9	67.4	-147.2	-4.7	113.5	D206 I211 D212 E213 I514	D206-R209 WeakPolarHBondContact O-CB 3.37Å; D206-R209 PolarHBondContact O-N 3.23Å; D206-R209 VanDerWaalsContact O-N 3.15Å; R209-I211 PolarHBondContact O-N 3.15Å; R209-D212 PolarHBondContact O-N 3.27Å; R209-E213 PolarHBondContact O-N 3.46Å; R209-I514 HydrophobicContact CB-CD1 4.31Å; R209-I514 HydrophobicContact CG-CD1 3.43Å; R209-I514 VanDerWaalsContact CG-CD1 3.43Å; R209-I514 HydrophobicContact CG-CG1 4.12Å; R209-I514 WeakPolarHBondContact O-CD1 3.49Å
210	R	91	Very high	87.9	Confident	101 Å²	101	48.1 Å²	48.1	38%	0.381	24%	0.239	S	C	.	.	H	α-helix	trans	-66.3	-38	-179.5	-68.8	-174.2	176.6	169.3	0.3	113.4	W159 F208 D212 H214	W159-R210 HydrophobicContact CD2-CB 3.94Å; W159-R210 HydrophobicContact CD2-CG 4.45Å; W159-R210 HydrophobicContact CE3-CB 4.02Å; W159-R210 HydrophobicContact CH2-CB 3.74Å; W159-R210 WeakPolarHBondContact CH2-O 3.4Å; W159-R210 HydrophobicContact CZ2-CB 3.59Å; W159-R210 HydrophobicContact CZ3-CB 3.91Å; W159-R210 WeakPolarHBondContact CZ3-O 3.32Å; F208-R210 VanDerWaalsContact C-N 3.33Å; F208-R210 PolarHBondContact O-N 3.06Å; F208-R210 VanDerWaalsContact O-N 3.1Å; R210-D212 VanDerWaalsContact C-N 3.27Å; R210-H214 WeakPolarHBondContact O-CB 3.16Å; R210-H214 PolarHBondContact O-N 3.27Å
211	I	93.7	Very high	88.6	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-40.9	174	-66.4	-70.6	0	0	0	109.9	A157 W159 F208 R209 H214 A215 I239 E244 R247 V248	A157-I211 HydrophobicContact CB-CD1 4.22Å; W159-I211 HydrophobicContact CH2-CD1 3.93Å; W159-I211 HydrophobicContact CH2-CG1 4.39Å; W159-I211 HydrophobicContact CZ2-CD1 3.53Å; W159-I211 HydrophobicContact CZ2-CG1 3.91Å; F208-I211 HydrophobicContact CB-CB 4.46Å; F208-I211 CarbonylContact O-C 3.49Å; F208-I211 WeakPolarHBondContact O-CA 3.49Å; F208-I211 WeakPolarHBondContact O-CB 3.43Å; F208-I211 PolarHBondContact O-N 3.17Å; R209-I211 PolarHBondContact O-N 3.15Å; I211-H214 WeakPolarHBondContact O-CB 3.26Å; I211-H214 PolarHBondContact O-N 2.61Å; I211-A215 PolarHBondContact O-N 3.16Å; I211-I239 HydrophobicContact CD1-CD1 3.96Å; I211-E244 HydrophobicContact CD1-CB 4.01Å; I211-E244 HydrophobicContact CD1-CG 4.16Å; I211-E244 WeakPolarHBondContact CD1-OE1 3.39Å; I211-E244 HydrophobicContact CG1-CB 4.44Å; I211-E244 HydrophobicContact CG1-CG 4.24Å; I211-E244 WeakPolarHBondContact CG1-OE1 3.39Å; I211-R247 HydrophobicContact CG2-CB 4.09Å; I211-R247 HydrophobicContact CG2-CG 3.73Å; I211-V248 HydrophobicContact CG2-CB 3.88Å; I211-V248 HydrophobicContact CG2-CG2 4.48Å
212	D	92	Very high	89	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-67.5	-45.1	-179	-70.2	-2.2	0	0	0	111.8	F208 R209 R210 H214 A215 V216 R247 L251 I514	F208-D212 PolarHBondContact O-N 2.79Å; R209-D212 PolarHBondContact O-N 3.27Å; R210-D212 VanDerWaalsContact C-N 3.27Å; D212-H214 VanDerWaalsContact C-N 3.26Å; D212-H214 PolarHBondContact O-N 3Å; D212-A215 PolarHBondContact O-N 2.75Å; D212-V216 WeakPolarHBondContact O-CG2 3.47Å; D212-V216 PolarHBondContact O-N 3.3Å; D212-R247 IonicContact OD1-CZ 3.36Å; D212-R247 IonicContact OD1-NE 3.6Å; D212-R247 PolarHBondContact OD1-NE 3.22Å; D212-R247 IonicContact OD1-NH2 2.7Å; D212-R247 PolarHBondContact OD1-NH2 2.92Å; D212-R247 IonicContact OD2-CZ 3.56Å; D212-R247 IonicContact OD2-NE 3.53Å; D212-R247 IonicContact OD2-NH2 3.18Å; D212-R247 PolarHBondContact OD2-NH2 2.86Å; D212-L251 HydrophobicContact CB-CD2 3.47Å; D212-L251 VanDerWaalsContact CB-CD2 3.47Å; D212-L251 WeakPolarHBondContact OD1-CD2 3.39Å; D212-I514 HydrophobicContact CB-CD1 4.12Å
213	E	90.6	Very high	89.6	Confident	98 Å²	98	51.9 Å²	51.9	46%	0.458	25%	0.251	S	S	.	.	H	α-helix	trans	-54.9	-44.1	173.4	-111.9	152.7	-144.6	0	0	110.9	R209 S217 I514	R209-E213 PolarHBondContact O-N 3.46Å; E213-S217 VanDerWaalsContact O-CB 3.23Å; E213-S217 WeakPolarHBondContact O-CB 3.36Å; E213-S217 PolarHBondContact O-N 2.96Å; E213-I514 HydrophobicContact CB-CD1 3.66Å; E213-I514 VanDerWaalsContact CD-CD1 3.45Å; E213-I514 HydrophobicContact CG-CD1 3.26Å; E213-I514 HydrophobicContact CG-CG1 3.87Å; E213-I514 VanDerWaalsContact OE1-CD1 3.29Å; E213-I514 WeakPolarHBondContact OE1-CD1 3.37Å
214	H	93.7	Very high	90.2	Very high	13 Å²	13	50 Å²	50	6%	0.06	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-48.3	179.2	179.1	65.6	0	0	0	112.2	W159 R210 I211 D212 V216 S217 I218 Q232 L233 R237	W159-H214 HydrophobicContact CH2-CB 3.97Å; W159-H214 HydrophobicContact CZ3-CB 4.05Å; R210-H214 WeakPolarHBondContact O-CB 3.16Å; R210-H214 PolarHBondContact O-N 3.27Å; I211-H214 WeakPolarHBondContact O-CB 3.26Å; I211-H214 PolarHBondContact O-N 2.61Å; D212-H214 VanDerWaalsContact C-N 3.26Å; D212-H214 PolarHBondContact O-N 3Å; H214-V216 PolarHBondContact O-N 3.14Å; H214-S217 PolarHBondContact O-N 3.28Å; H214-I218 WeakPolarHBondContact CE1-CD1 3.22Å; H214-I218 VanDerWaalsContact NE2-CD1 3.35Å; H214-I218 WeakPolarHBondContact NE2-CD1 3.48Å; H214-I218 WeakPolarHBondContact O-CG1 3.45Å; H214-I218 PolarHBondContact O-N 3.11Å; H214-Q232 PolarHBondContact CE1-O 3.23Å; H214-Q232 PolarHBondContact NE2-O 3.02Å; H214-L233 PolarHBondContact NE2-O 3.1Å; H214-L233 VanDerWaalsContact NE2-O 3.09Å; H214-R237 PolarHBondContact CE1-NE 2.92Å; H214-R237 VanDerWaalsContact CE1-NE 3.34Å; H214-R237 PolarHBondContact ND1-NE 2.81Å
215	A	93.6	Very high	90.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.1	-46.3	178.2	0	0	0	0	0	112	I211 D212 I218 S219 V248 L251 W252	I211-A215 PolarHBondContact O-N 3.16Å; D212-A215 PolarHBondContact O-N 2.75Å; A215-I218 PolarHBondContact O-N 3.29Å; A215-S219 WeakPolarHBondContact O-CB 3.45Å; A215-S219 PolarHBondContact O-N 2.93Å; A215-V248 HydrophobicContact CB-CG2 3.77Å; A215-L251 HydrophobicContact CB-CB 3.96Å; A215-L251 HydrophobicContact CB-CD2 3.89Å; A215-L251 HydrophobicContact CB-CG 4Å; A215-W252 HydrophobicContact CB-CB 4.29Å
216	V	90.3	Very high	91.2	Very high	27 Å²	27	48.5 Å²	48.5	16%	0.164	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-44.7	179	173	0	0	0	0	110.7	D212 H214 I218 S219 Q220 L251	D212-V216 WeakPolarHBondContact O-CG2 3.47Å; D212-V216 PolarHBondContact O-N 3.3Å; H214-V216 PolarHBondContact O-N 3.14Å; V216-I218 VanDerWaalsContact C-N 3.28Å; V216-I218 PolarHBondContact O-N 2.88Å; V216-S219 PolarHBondContact O-N 3.37Å; V216-S219 VanDerWaalsContact O-N 3.13Å; V216-S219 PolarHBondContact O-OG 2.78Å; V216-Q220 WeakPolarHBondContact O-CG 3.42Å; V216-Q220 PolarHBondContact O-N 2.72Å; V216-L251 HydrophobicContact CG2-CD2 4.24Å; V216-L251 HydrophobicContact CG2-CG 4.47Å
217	S	91.6	Very high	91.7	Very high	61 Å²	61	48.5 Å²	48.5	43%	0.427	24%	0.237	S	C	.	.	H	α-helix	trans	-57.1	-40.8	176.5	178.8	0	0	0	0	112.5	E213 H214 Q221	E213-S217 VanDerWaalsContact O-CB 3.23Å; E213-S217 WeakPolarHBondContact O-CB 3.36Å; E213-S217 PolarHBondContact O-N 2.96Å; H214-S217 PolarHBondContact O-N 3.28Å; S217-Q221 WeakPolarHBondContact O-CG 3.5Å; S217-Q221 PolarHBondContact O-NE2 2.81Å
218	I	93.4	Very high	92.1	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-73.3	-35.3	177.2	-65.4	169.9	0	0	0	111.7	H214 A215 V216 Q220 Q221 Q223 L229 Q232 L233	H214-I218 WeakPolarHBondContact CE1-CD1 3.22Å; H214-I218 VanDerWaalsContact NE2-CD1 3.35Å; H214-I218 WeakPolarHBondContact NE2-CD1 3.48Å; H214-I218 WeakPolarHBondContact O-CG1 3.45Å; H214-I218 PolarHBondContact O-N 3.11Å; A215-I218 PolarHBondContact O-N 3.29Å; V216-I218 VanDerWaalsContact C-N 3.28Å; V216-I218 PolarHBondContact O-N 2.88Å; I218-Q220 PolarHBondContact O-N 2.85Å; I218-Q221 PolarHBondContact O-N 3.35Å; I218-Q223 PolarHBondContact O-NE2 2.93Å; I218-Q223 VanDerWaalsContact O-NE2 3.16Å; I218-L229 HydrophobicContact CG2-CD1 4.07Å; I218-Q232 VanDerWaalsContact CD1-C 3.42Å; I218-Q232 HydrophobicContact CD1-CB 3.9Å; I218-Q232 WeakPolarHBondContact CD1-O 3.19Å; I218-Q232 HydrophobicContact CG1-CB 4.34Å; I218-Q232 HydrophobicContact CG2-CB 4.39Å; I218-L233 HydrophobicContact CB-CD2 4.15Å; I218-L233 HydrophobicContact CD1-CD2 3.85Å; I218-L233 HydrophobicContact CD1-CG 4.33Å; I218-L233 HydrophobicContact CG2-CD2 3.86Å; I218-L233 HydrophobicContact CG2-CG 4.18Å
219	S	90.9	Very high	92.3	Very high	11 Å²	11	48.1 Å²	48.1	8%	0.077	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-30.5	179.2	78.7	0	0	0	0	112.7	A215 V216 Q221 T255 K256	A215-S219 WeakPolarHBondContact O-CB 3.45Å; A215-S219 PolarHBondContact O-N 2.93Å; V216-S219 PolarHBondContact O-N 3.37Å; V216-S219 VanDerWaalsContact O-N 3.13Å; V216-S219 PolarHBondContact O-OG 2.78Å; S219-Q221 VanDerWaalsContact C-N 3.33Å; S219-T255 WeakPolarHBondContact CB-OG1 3.42Å; S219-T255 PolarHBondContact OG-OG1 3.09Å; S219-K256 WeakPolarHBondContact O-CD 3.41Å; S219-K256 PolarHBondContact O-NZ 3.34Å
220	Q	89.5	Confident	92.7	Very high	154 Å²	154	42.5 Å²	42.5	72%	0.72	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-12.9	179	-66.1	174.8	-0.7	0	0	113.5	V216 I218	V216-Q220 WeakPolarHBondContact O-CG 3.42Å; V216-Q220 PolarHBondContact O-N 2.72Å; I218-Q220 PolarHBondContact O-N 2.85Å
221	Q	91.5	Very high	93	Very high	61 Å²	61	39 Å²	39	29%	0.285	20%	0.199	S	C	.	.	S	Bend	trans	-90.2	155.5	179.3	-65.9	168.9	51.1	0	0	110.7	S217 I218 S219 Q223 K256	S217-Q221 WeakPolarHBondContact O-CG 3.5Å; S217-Q221 PolarHBondContact O-NE2 2.81Å; I218-Q221 PolarHBondContact O-N 3.35Å; S219-Q221 VanDerWaalsContact C-N 3.33Å; Q221-Q223 PolarHBondContact O-OE1 2.97Å; Q221-K256 PolarHBondContact O-NZ 3.38Å
222	Q	90.4	Very high	93.1	Very high	100 Å²	100	39.6 Å²	39.6	47%	0.467	20%	0.201	S	C	.	.			trans	-100.2	129.7	167.7	-176.3	56.8	34.2	0	0	108.5	N262	Q222-N262 PolarHBondContact NE2-O 3.08Å
223	Q	93.1	Very high	93.3	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.201	C	C	.	.			trans	-104.9	144.9	177.5	-66	78.3	18.5	0	0	109.6	I218 Q221 L229 F263	I218-Q223 PolarHBondContact O-NE2 2.93Å; I218-Q223 VanDerWaalsContact O-NE2 3.16Å; Q221-Q223 PolarHBondContact O-OE1 2.97Å; Q223-L229 HydrophobicContact CB-CB 4.2Å; Q223-L229 HydrophobicContact CG-CB 4.05Å; Q223-L229 HydrophobicContact CG-CD1 4.24Å; Q223-F263 HydrophobicContact CB-CE1 4.38Å
224	D	92.2	Very high	93.6	Very high	113 Å²	113	34.9 Å²	34.9	60%	0.604	18%	0.179	S	C	*	.	S	Bend	trans	-74.4	-33.5	-177.1	-58.2	-32.4	0	0	0	111.7
225	N	93.1	Very high	93.7	Very high	62 Å²	62	37.9 Å²	37.9	33%	0.332	19%	0.191	S	C	.	.	S	Bend	trans	-156	172.2	179.7	57.1	63.1	0	0	0	111.4	N227 Q228 L229	N225-N227 VanDerWaalsContact C-N 3.34Å; N225-N227 PolarHBondContact O-N 2.9Å; N225-N227 WeakPolarHBondContact OD1-CB 3.38Å; N225-N227 PolarHBondContact OD1-N 3.15Å; N225-N227 VanDerWaalsContact OD1-N 3.15Å; N225-Q228 PolarHBondContact O-N 3.22Å; N225-Q228 PolarHBondContact OD1-N 3.29Å; N225-L229 PolarHBondContact O-N 3.46Å
226	F	94.5	Very high	93.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-36.6	-179.3	179.7	-93.9	0	0	0	112.7	Q228 L229 I230 P271 E272 L275 T291 L292 Y295	F226-Q228 VanDerWaalsContact C-N 3.32Å; F226-Q228 PolarHBondContact O-N 3.5Å; F226-L229 WeakPolarHBondContact O-CB 3.48Å; F226-L229 PolarHBondContact O-N 2.77Å; F226-L229 VanDerWaalsContact O-N 3.11Å; F226-I230 HydrophobicContact CD1-CG2 4.38Å; F226-I230 HydrophobicContact CE1-CB 4.15Å; F226-I230 HydrophobicContact CE1-CG2 4.12Å; F226-I230 HydrophobicContact CZ-CB 4.37Å; F226-I230 PolarHBondContact O-N 2.9Å; F226-P271 HydrophobicContact CB-CB 3.95Å; F226-P271 HydrophobicContact CD1-CB 3.62Å; F226-P271 HydrophobicContact CD1-CG 3.9Å; F226-P271 HydrophobicContact CD2-CB 3.38Å; F226-P271 HydrophobicContact CD2-CG 4.49Å; F226-P271 HydrophobicContact CE1-CB 3.89Å; F226-P271 HydrophobicContact CE1-CG 4.08Å; F226-P271 HydrophobicContact CE2-CB 3.64Å; F226-P271 HydrophobicContact CG-CB 3.36Å; F226-P271 HydrophobicContact CG-CG 4.13Å; F226-P271 HydrophobicContact CZ-CB 3.89Å; F226-P271 HydrophobicContact CZ-CG 4.43Å; F226-E272 HydrophobicContact CB-CG 3.89Å; F226-E272 WeakPolarHBondContact CB-OE1 3.44Å; F226-E272 PolarHBondContact N-OE1 3.16Å; F226-L275 HydrophobicContact CD2-CD1 4.02Å; F226-L275 HydrophobicContact CD2-CD2 4.14Å; F226-L275 HydrophobicContact CE2-CD1 3.95Å; F226-L275 HydrophobicContact CE2-CD2 4.5Å; F226-T291 HydrophobicContact CE2-CG2 4.28Å; F226-T291 HydrophobicContact CZ-CG2 4.26Å; F226-L292 HydrophobicContact CE2-CD2 3.62Å; F226-L292 HydrophobicContact CE2-CG 4.4Å; F226-L292 HydrophobicContact CZ-CD2 4.09Å; F226-Y295 HydrophobicContact CD1-CD1 4.48Å; F226-Y295 AromaticContact CE1-CD1 3.62Å; F226-Y295 HydrophobicContact CE1-CD1 3.62Å; F226-Y295 AromaticContact CE1-CD2 3.75Å; F226-Y295 HydrophobicContact CE1-CD2 3.75Å; F226-Y295 HydrophobicContact CE1-CE1 4.08Å; F226-Y295 HydrophobicContact CE1-CE2 4.22Å; F226-Y295 AromaticContact CE1-CG 3.42Å; F226-Y295 HydrophobicContact CE1-CG 3.42Å; F226-Y295 VanDerWaalsContact CE1-CG 3.42Å; F226-Y295 HydrophobicContact CZ-CD1 4.42Å; F226-Y295 AromaticContact CZ-CD2 3.79Å; F226-Y295 HydrophobicContact CZ-CD2 3.79Å; F226-Y295 HydrophobicContact CZ-CE2 4.46Å; F226-Y295 AromaticContact CZ-CG 3.76Å; F226-Y295 HydrophobicContact CZ-CG 3.76Å
227	N	94	Very high	93.8	Very high	59 Å²	59	39.5 Å²	39.5	32%	0.316	20%	0.198	S	C	.	.	H	α-helix	trans	-61	-41.8	178.9	-74.6	-3.1	0	0	0	111.6	P174 N225 L229 W231	P174-N227 WeakPolarHBondContact CG-OD1 3.25Å; N225-N227 VanDerWaalsContact C-N 3.34Å; N225-N227 PolarHBondContact O-N 2.9Å; N225-N227 WeakPolarHBondContact OD1-CB 3.38Å; N225-N227 PolarHBondContact OD1-N 3.15Å; N225-N227 VanDerWaalsContact OD1-N 3.15Å; N227-L229 VanDerWaalsContact C-N 3.34Å; N227-W231 WeakPolarHBondContact O-CB 3.2Å; N227-W231 PolarHBondContact O-N 3.45Å
228	Q	95.2	Very high	93.9	Very high	21 Å²	21	41.4 Å²	41.4	10%	0.098	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-40.5	174.8	-171.2	-173.7	35.1	0	0	111.5	N225 F226 Q232	N225-Q228 PolarHBondContact O-N 3.22Å; N225-Q228 PolarHBondContact OD1-N 3.29Å; F226-Q228 VanDerWaalsContact C-N 3.32Å; F226-Q228 PolarHBondContact O-N 3.5Å; Q228-Q232 WeakPolarHBondContact O-CB 3.38Å; Q228-Q232 VanDerWaalsContact O-CG 3.26Å; Q228-Q232 WeakPolarHBondContact O-CG 3.44Å; Q228-Q232 PolarHBondContact O-N 3.44Å
229	L	96	Very high	94	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-55.4	177.5	172.2	63.5	0	0	0	112.4	I218 Q223 N225 F226 N227 W231 Q232 L233 W252 M261 L275 L292	I218-L229 HydrophobicContact CG2-CD1 4.07Å; Q223-L229 HydrophobicContact CB-CB 4.2Å; Q223-L229 HydrophobicContact CG-CB 4.05Å; Q223-L229 HydrophobicContact CG-CD1 4.24Å; N225-L229 PolarHBondContact O-N 3.46Å; F226-L229 WeakPolarHBondContact O-CB 3.48Å; F226-L229 PolarHBondContact O-N 2.77Å; F226-L229 VanDerWaalsContact O-N 3.11Å; N227-L229 VanDerWaalsContact C-N 3.34Å; L229-W231 VanDerWaalsContact C-N 3.27Å; L229-W231 PolarHBondContact O-N 2.78Å; L229-Q232 PolarHBondContact O-N 2.97Å; L229-L233 HydrophobicContact CD1-CD1 3.74Å; L229-L233 HydrophobicContact CD1-CG 4.05Å; L229-L233 HydrophobicContact CG-CD1 4Å; L229-L233 WeakPolarHBondContact O-CG 3.41Å; L229-L233 PolarHBondContact O-N 3.48Å; L229-W252 HydrophobicContact CD1-CD2 4.38Å; L229-W252 HydrophobicContact CD1-CH2 4.27Å; L229-W252 HydrophobicContact CD1-CZ2 3.47Å; L229-W252 VanDerWaalsContact CD1-CZ2 3.47Å; L229-W252 HydrophobicContact CD2-CH2 3.54Å; L229-W252 HydrophobicContact CD2-CZ2 3.55Å; L229-W252 HydrophobicContact CD2-CZ3 4.29Å; L229-W252 HydrophobicContact CG-CZ2 4.14Å; L229-M261 HydrophobicContact CD2-CE 4Å; L229-L275 HydrophobicContact CD2-CD2 3.52Å; L229-L292 HydrophobicContact CD2-CD2 4.29Å
230	I	96.6	Very high	94.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.6	-34	-177.5	-162.2	69.8	0	0	0	111.3	F172 P174 F226 L233 I234 Y235 L292 A296	F172-I230 HydrophobicContact CE1-CG2 4.01Å; F172-I230 HydrophobicContact CZ-CG2 4.03Å; P174-I230 HydrophobicContact CB-CG2 4.37Å; P174-I230 HydrophobicContact CG-CG2 3.94Å; F226-I230 HydrophobicContact CD1-CG2 4.38Å; F226-I230 HydrophobicContact CE1-CB 4.15Å; F226-I230 HydrophobicContact CE1-CG2 4.12Å; F226-I230 HydrophobicContact CZ-CB 4.37Å; F226-I230 PolarHBondContact O-N 2.9Å; I230-L233 PolarHBondContact O-N 2.89Å; I230-I234 HydrophobicContact CD1-CG1 4.07Å; I230-I234 HydrophobicContact CG1-CG1 4.48Å; I230-I234 PolarHBondContact O-N 3.28Å; I230-Y235 HydrophobicContact CG1-CE2 4.07Å; I230-L292 HydrophobicContact CD1-CD2 4.11Å; I230-A296 HydrophobicContact CD1-CB 4.37Å
231	W	96.5	Very high	94.4	Very high	28 Å²	28	39 Å²	39	11%	0.106	20%	0.197	C	C	.	.	H	α-helix	trans	-56.9	-54.3	170.8	174.1	-99.3	0	0	0	111.1	Q165 P168 P169 F172 N227 L229 L233 I234 Y235 A236	Q165-W231 HydrophobicContact CB-CZ2 4.25Å; Q165-W231 HydrophobicContact CG-CZ2 4.04Å; Q165-W231 PolarHBondContact O-NE1 2.84Å; P168-W231 HydrophobicContact CB-CB 3.95Å; P168-W231 HydrophobicContact CB-CD2 3.83Å; P168-W231 HydrophobicContact CB-CE3 4.15Å; P168-W231 HydrophobicContact CB-CG 3.7Å; P168-W231 HydrophobicContact CG-CB 4.32Å; P168-W231 HydrophobicContact CG-CG 4.37Å; P169-W231 HydrophobicContact CG-CH2 3.75Å; P169-W231 HydrophobicContact CG-CZ2 4.2Å; P169-W231 HydrophobicContact CG-CZ3 4.16Å; F172-W231 HydrophobicContact CB-CE3 4.37Å; F172-W231 HydrophobicContact CD1-CB 4.27Å; F172-W231 AromaticContact CD1-CE3 3.94Å; F172-W231 HydrophobicContact CD1-CE3 3.94Å; F172-W231 AromaticContact CD2-CE3 3.6Å; F172-W231 HydrophobicContact CD2-CE3 3.6Å; F172-W231 AromaticContact CD2-CZ3 3.84Å; F172-W231 HydrophobicContact CD2-CZ3 3.84Å; F172-W231 HydrophobicContact CE1-CB 3.8Å; F172-W231 HydrophobicContact CE1-CE3 4.09Å; F172-W231 AromaticContact CE2-CE3 3.78Å; F172-W231 HydrophobicContact CE2-CE3 3.78Å; F172-W231 HydrophobicContact CE2-CZ3 4.26Å; F172-W231 AromaticContact CG-CE3 3.69Å; F172-W231 HydrophobicContact CG-CE3 3.69Å; F172-W231 HydrophobicContact CG-CZ3 4.14Å; F172-W231 HydrophobicContact CZ-CB 4.29Å; F172-W231 HydrophobicContact CZ-CE3 4.02Å; N227-W231 WeakPolarHBondContact O-CB 3.2Å; N227-W231 PolarHBondContact O-N 3.45Å; L229-W231 VanDerWaalsContact C-N 3.27Å; L229-W231 PolarHBondContact O-N 2.78Å; W231-L233 VanDerWaalsContact C-N 3.34Å; W231-L233 PolarHBondContact O-N 3.18Å; W231-I234 PolarHBondContact O-N 2.77Å; W231-Y235 HydrophobicContact CE3-CG 4.34Å; W231-Y235 PolarHBondContact O-N 2.79Å; W231-A236 HydrophobicContact CD2-CB 4.47Å; W231-A236 HydrophobicContact CG-CB 4.46Å; W231-A236 HydrophobicContact CZ2-CB 4.37Å; W231-A236 VanDerWaalsContact O-CB 3.3Å; W231-A236 WeakPolarHBondContact O-CB 3.48Å; W231-A236 PolarHBondContact O-N 2.86Å
232	Q	96.2	Very high	94.5	Very high	15 Å²	15	38.8 Å²	38.8	7%	0.07	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-41.8	-179.1	-73.6	174.9	2.6	0	0	112.1	R166 H214 I218 Q228 L229	R166-Q232 PolarHBondContact O-NE2 3.43Å; R166-Q232 VanDerWaalsContact O-NE2 3.08Å; H214-Q232 PolarHBondContact CE1-O 3.23Å; H214-Q232 PolarHBondContact NE2-O 3.02Å; I218-Q232 VanDerWaalsContact CD1-C 3.42Å; I218-Q232 HydrophobicContact CD1-CB 3.9Å; I218-Q232 WeakPolarHBondContact CD1-O 3.19Å; I218-Q232 HydrophobicContact CG1-CB 4.34Å; I218-Q232 HydrophobicContact CG2-CB 4.39Å; Q228-Q232 WeakPolarHBondContact O-CB 3.38Å; Q228-Q232 VanDerWaalsContact O-CG 3.26Å; Q228-Q232 WeakPolarHBondContact O-CG 3.44Å; Q228-Q232 PolarHBondContact O-N 3.44Å; L229-Q232 PolarHBondContact O-N 2.97Å
233	L	96.3	Very high	94.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-46.7	-178.8	-74.6	173.2	0	0	0	112.3	H214 I218 L229 I230 W231 I239 V248 W252 L292	H214-L233 PolarHBondContact NE2-O 3.1Å; H214-L233 VanDerWaalsContact NE2-O 3.09Å; I218-L233 HydrophobicContact CB-CD2 4.15Å; I218-L233 HydrophobicContact CD1-CD2 3.85Å; I218-L233 HydrophobicContact CD1-CG 4.33Å; I218-L233 HydrophobicContact CG2-CD2 3.86Å; I218-L233 HydrophobicContact CG2-CG 4.18Å; L229-L233 HydrophobicContact CD1-CD1 3.74Å; L229-L233 HydrophobicContact CD1-CG 4.05Å; L229-L233 HydrophobicContact CG-CD1 4Å; L229-L233 WeakPolarHBondContact O-CG 3.41Å; L229-L233 PolarHBondContact O-N 3.48Å; I230-L233 PolarHBondContact O-N 2.89Å; W231-L233 VanDerWaalsContact C-N 3.34Å; W231-L233 PolarHBondContact O-N 3.18Å; L233-I239 VanDerWaalsContact O-CD1 3.29Å; L233-I239 WeakPolarHBondContact O-CD1 3.28Å; L233-V248 HydrophobicContact CD2-CG2 4.01Å; L233-W252 HydrophobicContact CD1-CD2 4.05Å; L233-W252 HydrophobicContact CD1-CE3 4.36Å; L233-W252 HydrophobicContact CD1-CG 4.08Å; L233-W252 HydrophobicContact CD2-CB 3.72Å; L233-W252 HydrophobicContact CD2-CD2 4.45Å; L233-W252 HydrophobicContact CD2-CG 3.65Å; L233-W252 HydrophobicContact CG-CG 4.46Å; L233-L292 HydrophobicContact CD1-CD2 4.47Å
234	I	96.5	Very high	94.9	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	-58.6	-165.5	-52.6	-61.6	0	0	0	112.1	I230 W231 N238 I239 K245 V248 I249 A296	I230-I234 HydrophobicContact CD1-CG1 4.07Å; I230-I234 HydrophobicContact CG1-CG1 4.48Å; I230-I234 PolarHBondContact O-N 3.28Å; W231-I234 PolarHBondContact O-N 2.77Å; I234-N238 PolarHBondContact O-N 3.35Å; I234-I239 HydrophobicContact CG2-CB 4.45Å; I234-I239 PolarHBondContact O-N 3.38Å; I234-K245 HydrophobicContact CD1-CB 4.1Å; I234-K245 HydrophobicContact CD1-CG 4.08Å; I234-K245 HydrophobicContact CG2-CD 4.44Å; I234-K245 HydrophobicContact CG2-CG 4.17Å; I234-V248 HydrophobicContact CD1-CG1 3.39Å; I234-I249 HydrophobicContact CD1-CD1 4.27Å; I234-I249 HydrophobicContact CD1-CG1 4.17Å; I234-A296 HydrophobicContact CD1-CB 4.4Å; I234-A296 HydrophobicContact CG1-CB 4.09Å
235	Y	95.2	Very high	95.2	Very high	76 Å²	76	30 Å²	30	30%	0.298	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-82.4	-31.7	-162.6	-62.9	-82.5	0	0	0	113.9	F172 I230 W231 R237 N238 Y295	F172-Y235 HydrophobicContact CE1-CD2 4.5Å; F172-Y235 AromaticContact CE2-CD1 3.93Å; F172-Y235 HydrophobicContact CE2-CD1 3.93Å; F172-Y235 AromaticContact CE2-CD2 3.5Å; F172-Y235 HydrophobicContact CE2-CD2 3.5Å; F172-Y235 HydrophobicContact CE2-CE1 4.22Å; F172-Y235 AromaticContact CE2-CE2 3.82Å; F172-Y235 HydrophobicContact CE2-CE2 3.82Å; F172-Y235 AromaticContact CE2-CG 3.55Å; F172-Y235 HydrophobicContact CE2-CG 3.55Å; F172-Y235 AromaticContact CZ-CD2 3.31Å; F172-Y235 HydrophobicContact CZ-CD2 3.31Å; F172-Y235 AromaticContact CZ-CE2 3.6Å; F172-Y235 HydrophobicContact CZ-CE2 3.6Å; F172-Y235 AromaticContact CZ-CG 3.84Å; F172-Y235 HydrophobicContact CZ-CG 3.84Å; I230-Y235 HydrophobicContact CG1-CE2 4.07Å; W231-Y235 HydrophobicContact CE3-CG 4.34Å; W231-Y235 PolarHBondContact O-N 2.79Å; Y235-R237 PolarHBondContact O-N 2.9Å; Y235-N238 PolarHBondContact O-N 2.95Å; Y235-Y295 PolarHBondContact OH-O 2.97Å
236	A	93.9	Very high	95.4	Very high	21 Å²	21	27 Å²	27	17%	0.174	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-63	-27	179.4	0	0	0	0	0	112.5	I164 W231	I164-A236 HydrophobicContact CG2-CB 3.57Å; W231-A236 HydrophobicContact CD2-CB 4.47Å; W231-A236 HydrophobicContact CG-CB 4.46Å; W231-A236 HydrophobicContact CZ2-CB 4.37Å; W231-A236 VanDerWaalsContact O-CB 3.3Å; W231-A236 WeakPolarHBondContact O-CB 3.48Å; W231-A236 PolarHBondContact O-N 2.86Å
237	R	94.1	Very high	95.4	Very high	39 Å²	39	27 Å²	27	15%	0.147	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-103	1.3	171.7	-71.1	-165.4	178.5	-83.4	10	113.5	A157 N158 W159 I164 H214 Y235 I239	A157-R237 HydrophobicContact CB-CB 4.45Å; N158-R237 WeakPolarHBondContact CB-O 3.43Å; N158-R237 PolarHBondContact N-O 2.87Å; N158-R237 PolarHBondContact O-NH1 2.92Å; W159-R237 VanDerWaalsContact CE3-NH1 3.27Å; W159-R237 VanDerWaalsContact CZ3-CD 3.48Å; I164-R237 HydrophobicContact CD1-CG 4.33Å; H214-R237 PolarHBondContact CE1-NE 2.92Å; H214-R237 VanDerWaalsContact CE1-NE 3.34Å; H214-R237 PolarHBondContact ND1-NE 2.81Å; Y235-R237 PolarHBondContact O-N 2.9Å; R237-I239 VanDerWaalsContact C-N 3.31Å; R237-I239 HydrophobicContact CB-CD1 4.49Å; R237-I239 HydrophobicContact CB-CG1 3.94Å; R237-I239 PolarHBondContact O-N 3.45Å
238	N	93.3	Very high	95.6	Very high	102 Å²	102	24.2 Å²	24.2	55%	0.545	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	47.9	-175	-168.1	56	0	0	0	112.8	I234 Y235 T240	I234-N238 PolarHBondContact O-N 3.35Å; Y235-N238 PolarHBondContact O-N 2.95Å; N238-T240 PolarHBondContact O-N 3.3Å
239	I	95.6	Very high	95.7	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.026	12%	0.118	C	C	.	.			trans	-71.4	108.4	175.8	-49.8	-174.6	0	0	0	108	A157 I211 L233 I234 R237 E244 K245 V248	A157-I239 HydrophobicContact CB-CD1 4.46Å; A157-I239 HydrophobicContact CB-CG1 3.83Å; I211-I239 HydrophobicContact CD1-CD1 3.96Å; L233-I239 VanDerWaalsContact O-CD1 3.29Å; L233-I239 WeakPolarHBondContact O-CD1 3.28Å; I234-I239 HydrophobicContact CG2-CB 4.45Å; I234-I239 PolarHBondContact O-N 3.38Å; R237-I239 VanDerWaalsContact C-N 3.31Å; R237-I239 HydrophobicContact CB-CD1 4.49Å; R237-I239 HydrophobicContact CB-CG1 3.94Å; R237-I239 PolarHBondContact O-N 3.45Å; I239-E244 HydrophobicContact CG2-CB 3.48Å; I239-E244 VanDerWaalsContact CG2-CB 3.48Å; I239-K245 HydrophobicContact CG2-CG 4.01Å; I239-K245 WeakPolarHBondContact O-CE 3.21Å; I239-V248 HydrophobicContact CD1-CG1 4.29Å
240	T	93.9	Very high	95.8	Very high	76 Å²	76	23.2 Å²	23.2	47%	0.466	12%	0.118	S	C	.	.			trans	-105	-24.6	-176.7	60.7	0	0	0	0	113.6	T156 N238 K245	T156-T240 VanDerWaalsContact CB-OG1 3.25Å; T156-T240 WeakPolarHBondContact CB-OG1 3.44Å; T156-T240 WeakPolarHBondContact CG2-OG1 3.36Å; T156-T240 PolarHBondContact OG1-N 3.39Å; N238-T240 PolarHBondContact O-N 3.3Å; T240-K245 VanDerWaalsContact O-CE 3.29Å; T240-K245 WeakPolarHBondContact O-CE 3.41Å; T240-K245 PolarHBondContact O-NZ 2.8Å
241	D	94.2	Very high	95.7	Very high	37 Å²	37	23.5 Å²	23.5	20%	0.198	12%	0.119	C	C	.	.			trans	-68.1	131.4	175.5	178.6	79.8	0	0	0	111.9	T156 L243 E244 K245	T156-D241 HydrophobicContact CG2-CB 3.63Å; T156-D241 WeakPolarHBondContact OG1-CB 3.4Å; T156-D241 PolarHBondContact OG1-N 2.82Å; D241-L243 WeakPolarHBondContact OD2-CA 3.36Å; D241-L243 VanDerWaalsContact OD2-CB 3.26Å; D241-L243 WeakPolarHBondContact OD2-CB 3.43Å; D241-L243 PolarHBondContact OD2-N 3.17Å; D241-E244 HydrophobicContact CB-CB 4.12Å; D241-E244 HydrophobicContact CB-CG 3.98Å; D241-E244 PolarHBondContact O-N 3.22Å; D241-E244 WeakPolarHBondContact OD2-CG 3.28Å; D241-E244 PolarHBondContact OD2-N 3.49Å; D241-K245 VanDerWaalsContact O-CG 3.31Å; D241-K245 WeakPolarHBondContact O-CG 3.22Å; D241-K245 PolarHBondContact O-N 3.09Å
242	D	94.4	Very high	95.6	Very high	57 Å²	57	22.1 Å²	22.1	31%	0.305	11%	0.114	S	C	.	.	H	α-helix	trans	-71.5	-33.6	-173.5	-73.4	-14.3	0	0	0	112.6	K245 V246 L298	D242-K245 PolarHBondContact O-N 3.3Å; D242-K245 IonicContact OD1-NZ 2.88Å; D242-K245 PolarHBondContact OD1-NZ 3.22Å; D242-V246 WeakPolarHBondContact O-CB 3.11Å; D242-V246 VanDerWaalsContact O-CG2 3.23Å; D242-V246 WeakPolarHBondContact O-CG2 3.43Å; D242-V246 PolarHBondContact O-N 3.09Å; D242-L298 HydrophobicContact CB-CD2 3.61Å; D242-L298 WeakPolarHBondContact OD1-CD2 3.41Å
243	L	95.2	Very high	95.5	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.016	11%	0.111	C	C	.	.	H	α-helix	trans	-66.3	-41.8	175.5	176.4	61.1	0	0	0	110.9	Y150 P201 Y202 F208 D241 V246 R247 I332 F367 L368	Y150-L243 HydrophobicContact CD1-CD2 4.48Å; Y150-L243 HydrophobicContact CD2-CD2 4.19Å; Y150-L243 HydrophobicContact CG-CD2 3.9Å; P201-L243 HydrophobicContact CB-CD2 4.15Å; P201-L243 HydrophobicContact CG-CD1 4.05Å; P201-L243 HydrophobicContact CG-CD2 3.9Å; Y202-L243 HydrophobicContact CD1-CD1 4.49Å; Y202-L243 HydrophobicContact CD1-CD2 4.4Å; F208-L243 HydrophobicContact CE1-CD2 4.14Å; F208-L243 HydrophobicContact CE1-CG 3.94Å; F208-L243 HydrophobicContact CZ-CD1 4.21Å; F208-L243 HydrophobicContact CZ-CD2 3.82Å; F208-L243 HydrophobicContact CZ-CG 3.86Å; D241-L243 WeakPolarHBondContact OD2-CA 3.36Å; D241-L243 VanDerWaalsContact OD2-CB 3.26Å; D241-L243 WeakPolarHBondContact OD2-CB 3.43Å; D241-L243 PolarHBondContact OD2-N 3.17Å; L243-V246 PolarHBondContact O-N 3.49Å; L243-R247 VanDerWaalsContact O-CB 3.29Å; L243-R247 WeakPolarHBondContact O-CB 3.19Å; L243-R247 PolarHBondContact O-N 2.71Å; L243-I332 HydrophobicContact CB-CG2 3.98Å; L243-I332 HydrophobicContact CD1-CD1 4.01Å; L243-F367 HydrophobicContact CD1-CZ 4.41Å; L243-L368 HydrophobicContact CD1-CD1 3.59Å
244	E	96	Very high	95.3	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-63.1	-45	173.6	-68.3	-165.8	121.2	0	0	112.4	Y150 S155 T156 I211 I239 D241 V246 R247 V248	Y150-E244 HydrophobicContact CE2-CG 4.16Å; Y150-E244 VanDerWaalsContact OH-CG 3.32Å; Y150-E244 WeakPolarHBondContact OH-CG 3.11Å; Y150-E244 PolarHBondContact OH-OE1 2.97Å; S155-E244 WeakPolarHBondContact CA-OE1 3.24Å; S155-E244 WeakPolarHBondContact CB-OE1 3.43Å; S155-E244 PolarHBondContact OG-OE1 2.85Å; T156-E244 PolarHBondContact N-OE2 2.71Å; T156-E244 PolarHBondContact OG1-OE2 3.19Å; I211-E244 HydrophobicContact CD1-CB 4.01Å; I211-E244 HydrophobicContact CD1-CG 4.16Å; I211-E244 WeakPolarHBondContact CD1-OE1 3.39Å; I211-E244 HydrophobicContact CG1-CB 4.44Å; I211-E244 HydrophobicContact CG1-CG 4.24Å; I211-E244 WeakPolarHBondContact CG1-OE1 3.39Å; I239-E244 HydrophobicContact CG2-CB 3.48Å; I239-E244 VanDerWaalsContact CG2-CB 3.48Å; D241-E244 HydrophobicContact CB-CB 4.12Å; D241-E244 HydrophobicContact CB-CG 3.98Å; D241-E244 PolarHBondContact O-N 3.22Å; D241-E244 WeakPolarHBondContact OD2-CG 3.28Å; D241-E244 PolarHBondContact OD2-N 3.49Å; E244-V246 VanDerWaalsContact C-N 3.34Å; E244-V246 PolarHBondContact O-N 2.75Å; E244-R247 PolarHBondContact O-N 2.76Å; E244-V248 WeakPolarHBondContact O-CG1 3.24Å; E244-V248 PolarHBondContact O-N 2.77Å
245	K	97.5	Very high	94.9	Very high	26 Å²	26	22.4 Å²	22.4	11%	0.113	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-44	175.2	-68.3	175	-163.1	151.3	0	111.4	I234 I239 T240 D241 D242 V248 I249 L298	I234-K245 HydrophobicContact CD1-CB 4.1Å; I234-K245 HydrophobicContact CD1-CG 4.08Å; I234-K245 HydrophobicContact CG2-CD 4.44Å; I234-K245 HydrophobicContact CG2-CG 4.17Å; I239-K245 HydrophobicContact CG2-CG 4.01Å; I239-K245 WeakPolarHBondContact O-CE 3.21Å; T240-K245 VanDerWaalsContact O-CE 3.29Å; T240-K245 WeakPolarHBondContact O-CE 3.41Å; T240-K245 PolarHBondContact O-NZ 2.8Å; D241-K245 VanDerWaalsContact O-CG 3.31Å; D241-K245 WeakPolarHBondContact O-CG 3.22Å; D241-K245 PolarHBondContact O-N 3.09Å; D242-K245 PolarHBondContact O-N 3.3Å; D242-K245 IonicContact OD1-NZ 2.88Å; D242-K245 PolarHBondContact OD1-NZ 3.22Å; K245-V248 VanDerWaalsContact O-CG1 3.28Å; K245-V248 WeakPolarHBondContact O-CG1 3.37Å; K245-I249 WeakPolarHBondContact O-CB 3.34Å; K245-I249 WeakPolarHBondContact O-CD1 3.14Å; K245-I249 WeakPolarHBondContact O-CG1 3.29Å; K245-I249 PolarHBondContact O-N 2.87Å; K245-I249 VanDerWaalsContact O-N 3.11Å; K245-L298 HydrophobicContact CB-CD1 3.78Å; K245-L298 HydrophobicContact CB-CD2 4.27Å; K245-L298 HydrophobicContact CB-CG 4.29Å; K245-L298 HydrophobicContact CD-CD2 4.13Å; K245-L298 HydrophobicContact CD-CG 4.24Å
246	V	97.8	Very high	94.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.3	-44.4	176.8	167.3	0	0	0	0	110.9	D242 L243 E244 F250 F289 L298 V330 I332 I339 F367 L368	D242-V246 WeakPolarHBondContact O-CB 3.11Å; D242-V246 VanDerWaalsContact O-CG2 3.23Å; D242-V246 WeakPolarHBondContact O-CG2 3.43Å; D242-V246 PolarHBondContact O-N 3.09Å; L243-V246 PolarHBondContact O-N 3.49Å; E244-V246 VanDerWaalsContact C-N 3.34Å; E244-V246 PolarHBondContact O-N 2.75Å; V246-F250 WeakPolarHBondContact O-CB 3.31Å; V246-F250 PolarHBondContact O-N 2.83Å; V246-F289 HydrophobicContact CG1-CZ 4.35Å; V246-L298 HydrophobicContact CG2-CD1 3.58Å; V246-L298 HydrophobicContact CG2-CD2 4.15Å; V246-L298 HydrophobicContact CG2-CG 4.46Å; V246-V330 HydrophobicContact CG1-CG1 4.11Å; V246-V330 HydrophobicContact CG2-CB 4.43Å; V246-V330 HydrophobicContact CG2-CG1 4.06Å; V246-V330 HydrophobicContact CG2-CG2 3.59Å; V246-I332 HydrophobicContact CB-CD1 4.14Å; V246-I332 HydrophobicContact CG1-CD1 4.11Å; V246-I332 HydrophobicContact CG2-CD1 4.02Å; V246-I332 HydrophobicContact CG2-CG1 4.22Å; V246-I339 HydrophobicContact CG1-CD1 3.43Å; V246-I339 VanDerWaalsContact CG1-CD1 3.43Å; V246-F367 HydrophobicContact CG1-CE2 3.84Å; V246-F367 HydrophobicContact CG1-CZ 4.34Å; V246-L368 HydrophobicContact CG1-CD2 4.25Å
247	R	95.9	Very high	94.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-49.3	178.6	-179.7	65.3	178.1	-171.6	-4.8	112.2	F208 I211 D212 L243 E244 F250 L251 M364 F367	F208-R247 HydrophobicContact CB-CG 4.02Å; F208-R247 HydrophobicContact CD1-CB 4.32Å; F208-R247 HydrophobicContact CD1-CG 3.91Å; F208-R247 HydrophobicContact CD2-CG 4.4Å; F208-R247 HydrophobicContact CG-CG 3.85Å; I211-R247 HydrophobicContact CG2-CB 4.09Å; I211-R247 HydrophobicContact CG2-CG 3.73Å; D212-R247 IonicContact OD1-CZ 3.36Å; D212-R247 IonicContact OD1-NE 3.6Å; D212-R247 PolarHBondContact OD1-NE 3.22Å; D212-R247 IonicContact OD1-NH2 2.7Å; D212-R247 PolarHBondContact OD1-NH2 2.92Å; D212-R247 IonicContact OD2-CZ 3.56Å; D212-R247 IonicContact OD2-NE 3.53Å; D212-R247 IonicContact OD2-NH2 3.18Å; D212-R247 PolarHBondContact OD2-NH2 2.86Å; L243-R247 VanDerWaalsContact O-CB 3.29Å; L243-R247 WeakPolarHBondContact O-CB 3.19Å; L243-R247 PolarHBondContact O-N 2.71Å; E244-R247 PolarHBondContact O-N 2.76Å; R247-F250 PolarHBondContact O-N 2.79Å; R247-L251 WeakPolarHBondContact O-CB 3.43Å; R247-L251 PolarHBondContact O-N 2.79Å; R247-M364 PolarHBondContact NH1-SD 2.89Å; R247-M364 VanDerWaalsContact NH2-CE 3.3Å; R247-F367 HydrophobicContact CB-CE2 4.39Å; R247-F367 HydrophobicContact CB-CZ 3.94Å; R247-F367 HydrophobicContact CG-CZ 4.4Å
248	V	96.8	Very high	94.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.6	-41.3	-178.2	71.9	0	0	0	0	111.4	I211 A215 L233 I234 I239 E244 K245 W252	I211-V248 HydrophobicContact CG2-CB 3.88Å; I211-V248 HydrophobicContact CG2-CG2 4.48Å; A215-V248 HydrophobicContact CB-CG2 3.77Å; L233-V248 HydrophobicContact CD2-CG2 4.01Å; I234-V248 HydrophobicContact CD1-CG1 3.39Å; I239-V248 HydrophobicContact CD1-CG1 4.29Å; E244-V248 WeakPolarHBondContact O-CG1 3.24Å; E244-V248 PolarHBondContact O-N 2.77Å; K245-V248 VanDerWaalsContact O-CG1 3.28Å; K245-V248 WeakPolarHBondContact O-CG1 3.37Å; V248-W252 WeakPolarHBondContact O-CB 3.44Å; V248-W252 PolarHBondContact O-N 2.78Å
249	I	98.2	Very high	93.8	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.4	-48.7	177.5	-69.2	168.3	0	0	0	110.5	I234 K245 L251 L253 F289 L292 A296 L298	I234-I249 HydrophobicContact CD1-CD1 4.27Å; I234-I249 HydrophobicContact CD1-CG1 4.17Å; K245-I249 WeakPolarHBondContact O-CB 3.34Å; K245-I249 WeakPolarHBondContact O-CD1 3.14Å; K245-I249 WeakPolarHBondContact O-CG1 3.29Å; K245-I249 PolarHBondContact O-N 2.87Å; K245-I249 VanDerWaalsContact O-N 3.11Å; I249-L251 PolarHBondContact O-N 2.84Å; I249-L253 VanDerWaalsContact O-CB 3.28Å; I249-L253 WeakPolarHBondContact O-CB 3.28Å; I249-L253 PolarHBondContact O-N 2.79Å; I249-F289 HydrophobicContact CB-CE2 4.31Å; I249-F289 HydrophobicContact CG2-CD2 3.65Å; I249-F289 HydrophobicContact CG2-CE2 3.67Å; I249-L292 HydrophobicContact CD1-CB 4.28Å; I249-L292 HydrophobicContact CG1-CB 4.4Å; I249-L292 HydrophobicContact CG2-CB 3.6Å; I249-L292 HydrophobicContact CG2-CD1 3.92Å; I249-L292 HydrophobicContact CG2-CG 4.39Å; I249-A296 HydrophobicContact CD1-CB 3.72Å; I249-L298 HydrophobicContact CD1-CD1 4.03Å
250	F	97.3	Very high	93.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-56.4	-52.9	179	171.4	-93.4	0	0	0	110.9	V246 R247 L253 C254 F289 I339 C341 A344 L362 M364 F367	V246-F250 WeakPolarHBondContact O-CB 3.31Å; V246-F250 PolarHBondContact O-N 2.83Å; R247-F250 PolarHBondContact O-N 2.79Å; F250-L253 PolarHBondContact O-N 2.88Å; F250-C254 WeakPolarHBondContact O-CB 3.42Å; F250-C254 PolarHBondContact O-N 3.21Å; F250-C254 PolarHBondContact O-SG 3.43Å; F250-F289 HydrophobicContact CB-CE2 4.06Å; F250-I339 HydrophobicContact CD2-CG2 3.53Å; F250-I339 HydrophobicContact CE2-CG2 3.87Å; F250-C341 WeakPolarHBondContact CD2-SG 3.31Å; F250-A344 HydrophobicContact CE1-CB 4.39Å; F250-A344 HydrophobicContact CE2-CB 3.64Å; F250-A344 HydrophobicContact CZ-CB 3.33Å; F250-L362 HydrophobicContact CE1-CD1 4.12Å; F250-L362 HydrophobicContact CZ-CD1 4.4Å; F250-M364 HydrophobicContact CE1-SD 4.11Å; F250-F367 HydrophobicContact CB-CD2 3.9Å; F250-F367 HydrophobicContact CB-CE2 3.96Å; F250-F367 HydrophobicContact CD1-CB 4.26Å; F250-F367 AromaticContact CD1-CD2 3.54Å; F250-F367 HydrophobicContact CD1-CD2 3.54Å; F250-F367 HydrophobicContact CD1-CE2 4.22Å; F250-F367 HydrophobicContact CD1-CG 4.17Å; F250-F367 AromaticContact CD2-CD2 3.82Å; F250-F367 HydrophobicContact CD2-CD2 3.82Å; F250-F367 HydrophobicContact CE1-CB 3.76Å; F250-F367 AromaticContact CE1-CD2 3.95Å; F250-F367 HydrophobicContact CE1-CD2 3.95Å; F250-F367 HydrophobicContact CE1-CG 4.15Å; F250-F367 HydrophobicContact CE2-CB 4.08Å; F250-F367 HydrophobicContact CE2-CD2 4.2Å; F250-F367 AromaticContact CG-CD2 3.47Å; F250-F367 HydrophobicContact CG-CD2 3.47Å; F250-F367 VanDerWaalsContact CG-CD2 3.47Å; F250-F367 HydrophobicContact CG-CE2 4.05Å; F250-F367 HydrophobicContact CG-CG 4.44Å; F250-F367 HydrophobicContact CZ-CB 3.64Å; F250-F367 HydrophobicContact CZ-CD2 4.25Å; F250-F367 HydrophobicContact CZ-CG 4.39Å
251	L	94.1	Very high	93.1	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-68.8	-41.9	-174.5	-177.6	64.2	0	0	0	111.8	D212 A215 V216 R247 I249 L253 C254 T255 L362 M364	D212-L251 HydrophobicContact CB-CD2 3.47Å; D212-L251 VanDerWaalsContact CB-CD2 3.47Å; D212-L251 WeakPolarHBondContact OD1-CD2 3.39Å; A215-L251 HydrophobicContact CB-CB 3.96Å; A215-L251 HydrophobicContact CB-CD2 3.89Å; A215-L251 HydrophobicContact CB-CG 4Å; V216-L251 HydrophobicContact CG2-CD2 4.24Å; V216-L251 HydrophobicContact CG2-CG 4.47Å; R247-L251 WeakPolarHBondContact O-CB 3.43Å; R247-L251 PolarHBondContact O-N 2.79Å; I249-L251 PolarHBondContact O-N 2.84Å; L251-L253 VanDerWaalsContact C-N 3.31Å; L251-L253 PolarHBondContact O-N 2.83Å; L251-C254 PolarHBondContact O-N 2.92Å; L251-T255 HydrophobicContact CD1-CG2 3.92Å; L251-T255 HydrophobicContact CG-CG2 4.45Å; L251-T255 WeakPolarHBondContact O-CB 3.45Å; L251-T255 WeakPolarHBondContact O-CG2 3.38Å; L251-T255 PolarHBondContact O-N 2.72Å; L251-T255 VanDerWaalsContact O-N 3.09Å; L251-T255 PolarHBondContact O-OG1 2.83Å; L251-L362 HydrophobicContact CD1-CD2 3.12Å; L251-M364 HydrophobicContact CD1-CE 4.39Å
252	W	95.3	Very high	92.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-56.6	-48.3	174.3	173.8	86.9	0	0	0	110.6	A215 L229 L233 V248 C254 T255 K256 L258 M261 L275 L292	A215-W252 HydrophobicContact CB-CB 4.29Å; L229-W252 HydrophobicContact CD1-CD2 4.38Å; L229-W252 HydrophobicContact CD1-CH2 4.27Å; L229-W252 HydrophobicContact CD1-CZ2 3.47Å; L229-W252 VanDerWaalsContact CD1-CZ2 3.47Å; L229-W252 HydrophobicContact CD2-CH2 3.54Å; L229-W252 HydrophobicContact CD2-CZ2 3.55Å; L229-W252 HydrophobicContact CD2-CZ3 4.29Å; L229-W252 HydrophobicContact CG-CZ2 4.14Å; L233-W252 HydrophobicContact CD1-CD2 4.05Å; L233-W252 HydrophobicContact CD1-CE3 4.36Å; L233-W252 HydrophobicContact CD1-CG 4.08Å; L233-W252 HydrophobicContact CD2-CB 3.72Å; L233-W252 HydrophobicContact CD2-CD2 4.45Å; L233-W252 HydrophobicContact CD2-CG 3.65Å; L233-W252 HydrophobicContact CG-CG 4.46Å; V248-W252 WeakPolarHBondContact O-CB 3.44Å; V248-W252 PolarHBondContact O-N 2.78Å; W252-C254 VanDerWaalsContact C-N 3.33Å; W252-C254 PolarHBondContact O-N 2.63Å; W252-T255 PolarHBondContact O-N 2.87Å; W252-T255 PolarHBondContact O-OG1 3.02Å; W252-K256 HydrophobicContact CD2-CB 4.48Å; W252-K256 HydrophobicContact CH2-CG 4.2Å; W252-K256 HydrophobicContact CZ2-CB 4.22Å; W252-K256 HydrophobicContact CZ2-CD 4.14Å; W252-K256 HydrophobicContact CZ2-CG 3.82Å; W252-K256 VanDerWaalsContact O-CB 3.25Å; W252-K256 WeakPolarHBondContact O-CB 3.46Å; W252-K256 PolarHBondContact O-N 2.96Å; W252-L258 HydrophobicContact CH2-CD2 4.29Å; W252-M261 HydrophobicContact CH2-CE 4.11Å; W252-M261 HydrophobicContact CH2-SD 4.16Å; W252-M261 HydrophobicContact CZ2-CE 4.03Å; W252-M261 HydrophobicContact CZ2-SD 4.41Å; W252-L275 HydrophobicContact CH2-CD2 4.02Å; W252-L292 HydrophobicContact CE3-CD1 3.9Å; W252-L292 HydrophobicContact CZ3-CD1 3.63Å
253	L	95	Very high	92.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.3	-38.5	-178.1	-178.1	58.6	0	0	0	112.1	I249 F250 L251 T255 L258 Y285 I288 F289 C341	I249-L253 VanDerWaalsContact O-CB 3.28Å; I249-L253 WeakPolarHBondContact O-CB 3.28Å; I249-L253 PolarHBondContact O-N 2.79Å; F250-L253 PolarHBondContact O-N 2.88Å; L251-L253 VanDerWaalsContact C-N 3.31Å; L251-L253 PolarHBondContact O-N 2.83Å; L253-T255 VanDerWaalsContact C-N 3.29Å; L253-T255 PolarHBondContact O-N 3.39Å; L253-L258 HydrophobicContact CD1-CD1 3.68Å; L253-L258 HydrophobicContact CD1-CD2 4.02Å; L253-L258 HydrophobicContact CD1-CG 4.35Å; L253-Y285 HydrophobicContact CD1-CD1 4.1Å; L253-Y285 HydrophobicContact CD1-CE1 4.27Å; L253-Y285 HydrophobicContact CD2-CD1 4.1Å; L253-Y285 HydrophobicContact CG-CD1 3.82Å; L253-Y285 HydrophobicContact CG-CE1 4.18Å; L253-I288 HydrophobicContact CD1-CB 4.26Å; L253-I288 HydrophobicContact CD1-CG2 3.57Å; L253-I288 HydrophobicContact CD2-CB 4.42Å; L253-I288 HydrophobicContact CD2-CG2 4.2Å; L253-F289 HydrophobicContact CD2-CB 3.74Å; L253-F289 HydrophobicContact CD2-CD2 4.23Å; L253-F289 HydrophobicContact CD2-CG 4.5Å; L253-C341 HydrophobicContact CD2-CB 3.78Å; L253-C341 HydrophobicContact CG-CB 4.31Å
254	C	91.8	Very high	92.7	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-76.3	-15.4	-179.4	-60.9	0	0	0	0	113.9	F250 L251 W252 A345 L362	F250-C254 WeakPolarHBondContact O-CB 3.42Å; F250-C254 PolarHBondContact O-N 3.21Å; F250-C254 PolarHBondContact O-SG 3.43Å; L251-C254 PolarHBondContact O-N 2.92Å; W252-C254 VanDerWaalsContact C-N 3.33Å; W252-C254 PolarHBondContact O-N 2.63Å; C254-A345 HydrophobicContact CB-CB 4.07Å; C254-L362 HydrophobicContact CB-CD1 3.54Å
255	T	88.5	Confident	92.4	Very high	22 Å²	22	34.6 Å²	34.6	14%	0.135	17%	0.167	C	C	.	.	H	α-helix	trans	-111.2	-16.4	-177.5	55.4	0	0	0	0	113.8	S219 L251 W252 L253 I518	S219-T255 WeakPolarHBondContact CB-OG1 3.42Å; S219-T255 PolarHBondContact OG-OG1 3.09Å; L251-T255 HydrophobicContact CD1-CG2 3.92Å; L251-T255 HydrophobicContact CG-CG2 4.45Å; L251-T255 WeakPolarHBondContact O-CB 3.45Å; L251-T255 WeakPolarHBondContact O-CG2 3.38Å; L251-T255 PolarHBondContact O-N 2.72Å; L251-T255 VanDerWaalsContact O-N 3.09Å; L251-T255 PolarHBondContact O-OG1 2.83Å; W252-T255 PolarHBondContact O-N 2.87Å; W252-T255 PolarHBondContact O-OG1 3.02Å; L253-T255 VanDerWaalsContact C-N 3.29Å; L253-T255 PolarHBondContact O-N 3.39Å; T255-I518 HydrophobicContact CG2-CD1 4.11Å
256	K	89.9	Confident	92.1	Very high	13 Å²	13	36 Å²	36	6%	0.057	18%	0.177	C	C	.	.	S	Bend	trans	-72.9	128.6	174.6	-177.4	66.6	175.3	179.8	0	110.8	S219 Q221 W252 L258	S219-K256 WeakPolarHBondContact O-CD 3.41Å; S219-K256 PolarHBondContact O-NZ 3.34Å; Q221-K256 PolarHBondContact O-NZ 3.38Å; W252-K256 HydrophobicContact CD2-CB 4.48Å; W252-K256 HydrophobicContact CH2-CG 4.2Å; W252-K256 HydrophobicContact CZ2-CB 4.22Å; W252-K256 HydrophobicContact CZ2-CD 4.14Å; W252-K256 HydrophobicContact CZ2-CG 3.82Å; W252-K256 VanDerWaalsContact O-CB 3.25Å; W252-K256 WeakPolarHBondContact O-CB 3.46Å; W252-K256 PolarHBondContact O-N 2.96Å; K256-L258 VanDerWaalsContact C-N 3.3Å; K256-L258 HydrophobicContact CB-CD2 4.22Å; K256-L258 HydrophobicContact CG-CD2 3.82Å; K256-L258 HydrophobicContact CG-CG 4.43Å; K256-L258 PolarHBondContact O-N 3.19Å
257	D	87.4	Confident	91.8	Very high	37 Å²	37	43.3 Å²	43.3	20%	0.198	21%	0.209	C	C	.	.			trans	-72.7	86.7	165.8	-172.2	-16.2	0	0	0	109.7	H259 K260 M261 Y360	D257-H259 PolarHBondContact O-N 3.11Å; D257-H259 WeakPolarHBondContact OD1-CB 3.33Å; D257-H259 PolarHBondContact OD1-N 3.27Å; D257-H259 VanDerWaalsContact OD1-N 3.15Å; D257-K260 HydrophobicContact CB-CB 4.46Å; D257-K260 HydrophobicContact CB-CD 4.46Å; D257-K260 PolarHBondContact O-N 3.07Å; D257-K260 PolarHBondContact OD1-N 3.1Å; D257-K260 WeakPolarHBondContact OD2-CD 3.25Å; D257-K260 WeakPolarHBondContact OD2-CE 3.24Å; D257-K260 WeakPolarHBondContact OD2-CG 3.48Å; D257-K260 IonicContact OD2-NZ 3.57Å; D257-K260 PolarHBondContact OD2-NZ 3.11Å; D257-M261 PolarHBondContact O-N 2.93Å; D257-Y360 HydrophobicContact CB-CE2 4.21Å; D257-Y360 VanDerWaalsContact CG-OH 3.3Å; D257-Y360 PolarHBondContact OD1-OH 2.87Å
258	L	89	Confident	91.6	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.1	-178.5	-56.9	167.3	0	0	0	112.7	W252 L253 K256 K260 M261 I278 Y285 I288	W252-L258 HydrophobicContact CH2-CD2 4.29Å; L253-L258 HydrophobicContact CD1-CD1 3.68Å; L253-L258 HydrophobicContact CD1-CD2 4.02Å; L253-L258 HydrophobicContact CD1-CG 4.35Å; K256-L258 VanDerWaalsContact C-N 3.3Å; K256-L258 HydrophobicContact CB-CD2 4.22Å; K256-L258 HydrophobicContact CG-CD2 3.82Å; K256-L258 HydrophobicContact CG-CG 4.43Å; K256-L258 PolarHBondContact O-N 3.19Å; L258-K260 VanDerWaalsContact C-N 3.26Å; L258-K260 PolarHBondContact O-N 3.2Å; L258-M261 HydrophobicContact CD2-SD 4.11Å; L258-M261 WeakPolarHBondContact O-CB 3.24Å; L258-M261 PolarHBondContact O-N 2.87Å; L258-I278 HydrophobicContact CB-CG2 3.55Å; L258-I278 HydrophobicContact CD1-CG1 4.42Å; L258-I278 HydrophobicContact CD1-CG2 4.24Å; L258-I278 HydrophobicContact CG-CG2 4.49Å; L258-Y285 HydrophobicContact CD1-CD1 4.28Å; L258-Y285 HydrophobicContact CD1-CE1 3.69Å; L258-Y285 HydrophobicContact CD1-CE2 4.32Å; L258-I288 HydrophobicContact CD1-CD1 4.06Å
259	H	86.3	Confident	91.2	Very high	95 Å²	95	55.5 Å²	55.5	44%	0.44	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-25	176.3	-70.9	-70.4	0	0	0	112.6	D257 R279	D257-H259 PolarHBondContact O-N 3.11Å; D257-H259 WeakPolarHBondContact OD1-CB 3.33Å; D257-H259 PolarHBondContact OD1-N 3.27Å; D257-H259 VanDerWaalsContact OD1-N 3.15Å; H259-R279 WeakPolarHBondContact O-CD 3.35Å; H259-R279 PolarHBondContact O-NE 3.33Å
260	K	86.8	Confident	91	Very high	149 Å²	149	56.2 Å²	56.2	65%	0.648	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-8	174	-66.1	-178.6	-173.1	166.8	0	113.5	D257 L258	D257-K260 HydrophobicContact CB-CB 4.46Å; D257-K260 HydrophobicContact CB-CD 4.46Å; D257-K260 PolarHBondContact O-N 3.07Å; D257-K260 PolarHBondContact OD1-N 3.1Å; D257-K260 WeakPolarHBondContact OD2-CD 3.25Å; D257-K260 WeakPolarHBondContact OD2-CE 3.24Å; D257-K260 WeakPolarHBondContact OD2-CG 3.48Å; D257-K260 IonicContact OD2-NZ 3.57Å; D257-K260 PolarHBondContact OD2-NZ 3.11Å; L258-K260 VanDerWaalsContact C-N 3.26Å; L258-K260 PolarHBondContact O-N 3.2Å
261	M	87.9	Confident	90.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.29	C	S	.	.			trans	-71.2	131.5	-178.5	-165.3	173.2	-164.5	0	0	111.2	L229 W252 D257 L258 F263 L275 R279	L229-M261 HydrophobicContact CD2-CE 4Å; W252-M261 HydrophobicContact CH2-CE 4.11Å; W252-M261 HydrophobicContact CH2-SD 4.16Å; W252-M261 HydrophobicContact CZ2-CE 4.03Å; W252-M261 HydrophobicContact CZ2-SD 4.41Å; D257-M261 PolarHBondContact O-N 2.93Å; L258-M261 HydrophobicContact CD2-SD 4.11Å; L258-M261 WeakPolarHBondContact O-CB 3.24Å; L258-M261 PolarHBondContact O-N 2.87Å; M261-F263 HydrophobicContact CE-CE1 4Å; M261-F263 HydrophobicContact CE-CE2 3.57Å; M261-F263 HydrophobicContact CE-CZ 3.19Å; M261-F263 HydrophobicContact SD-CE2 4.29Å; M261-F263 HydrophobicContact SD-CZ 4.46Å; M261-L275 HydrophobicContact CE-CD2 3.87Å; M261-L275 HydrophobicContact SD-CB 4.46Å; M261-L275 HydrophobicContact SD-CD2 4.12Å; M261-R279 WeakPolarHBondContact O-CD 3.19Å; M261-R279 PolarHBondContact O-NH1 3.17Å
262	N	90.9	Very high	91	Very high	66 Å²	66	58.2 Å²	58.2	35%	0.353	30%	0.296	S	S	.	.			trans	-142.7	131.9	179.3	-165.7	74.8	0	0	0	110.7	Q222 D264 M276 R279	Q222-N262 PolarHBondContact NE2-O 3.08Å; N262-D264 PolarHBondContact ND2-OD1 3.29Å; N262-M276 WeakPolarHBondContact OD1-CE 3.32Å; N262-R279 PolarHBondContact OD1-NH1 3.27Å
263	F	92.9	Very high	91	Very high	7 Å²	7	61.4 Å²	61.4	3%	0.031	31%	0.311	C	S	.	.			trans	-112.7	146.5	168.1	-64.5	-66.7	0	0	0	108.8	Q223 M261 V266 E272 L275 M276	Q223-F263 HydrophobicContact CB-CE1 4.38Å; M261-F263 HydrophobicContact CE-CE1 4Å; M261-F263 HydrophobicContact CE-CE2 3.57Å; M261-F263 HydrophobicContact CE-CZ 3.19Å; M261-F263 HydrophobicContact SD-CE2 4.29Å; M261-F263 HydrophobicContact SD-CZ 4.46Å; F263-V266 HydrophobicContact CB-CG2 3.8Å; F263-V266 WeakPolarHBondContact O-CG2 3.13Å; F263-E272 HydrophobicContact CB-CB 4.06Å; F263-E272 HydrophobicContact CB-CG 3.98Å; F263-E272 HydrophobicContact CD1-CG 4.18Å; F263-E272 HydrophobicContact CD2-CB 3.58Å; F263-E272 HydrophobicContact CD2-CG 3.61Å; F263-E272 HydrophobicContact CE2-CB 4.18Å; F263-E272 HydrophobicContact CE2-CG 4.01Å; F263-E272 HydrophobicContact CG-CB 3.97Å; F263-E272 HydrophobicContact CG-CG 3.67Å; F263-E272 HydrophobicContact CZ-CG 4.41Å; F263-L275 HydrophobicContact CE2-CB 4.02Å; F263-L275 HydrophobicContact CE2-CD2 4.01Å; F263-L275 HydrophobicContact CZ-CD2 4.23Å; F263-M276 HydrophobicContact CB-SD 3.84Å; F263-M276 HydrophobicContact CD2-CG 4.04Å; F263-M276 HydrophobicContact CD2-SD 4.09Å; F263-M276 HydrophobicContact CG-SD 4.41Å; F263-M276 PolarHBondContact N-SD 3.46Å
264	D	90.9	Very high	91	Very high	121 Å²	121	63.6 Å²	63.6	65%	0.647	32%	0.322	S	S	*	.	S	Bend	trans	-89.3	150	176	-61.7	-36.6	0	0	0	110.3	N262 V266	N262-D264 PolarHBondContact ND2-OD1 3.29Å; D264-V266 VanDerWaalsContact C-N 3.35Å; D264-V266 PolarHBondContact O-N 2.88Å
265	H	89.6	Confident	91.1	Very high	184 Å²	184	63.6 Å²	63.6	85%	0.852	32%	0.322	S	S	*	.	S	Bend	trans	55	40.9	175.3	-52.6	-64.8	0	0	0	115.6	K267	H265-K267 PolarHBondContact O-N 2.8Å
266	V	91.1	Very high	91.4	Very high	54 Å²	54	64.3 Å²	64.3	33%	0.327	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-62.5	127.8	-179.7	-179.2	0	0	0	0	112	F263 D264 E272 E273 M276	F263-V266 HydrophobicContact CB-CG2 3.8Å; F263-V266 WeakPolarHBondContact O-CG2 3.13Å; D264-V266 VanDerWaalsContact C-N 3.35Å; D264-V266 PolarHBondContact O-N 2.88Å; V266-E272 HydrophobicContact CG1-CB 4.07Å; V266-E272 HydrophobicContact CG2-CB 4.08Å; V266-E273 HydrophobicContact CG1-CB 3.58Å; V266-E273 HydrophobicContact CG1-CG 4.32Å; V266-M276 HydrophobicContact CG2-CE 4.49Å; V266-M276 HydrophobicContact CG2-SD 3.6Å; V266-M276 VanDerWaalsContact CG2-SD 3.6Å
267	K	93	Very high	91.6	Very high	155 Å²	155	63.9 Å²	63.9	67%	0.674	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-89.3	148.3	175.2	-61.2	179.5	-176	175.6	0	110.6	H265 S270	H265-K267 PolarHBondContact O-N 2.8Å; K267-S270 VanDerWaalsContact O-CB 3.23Å; K267-S270 WeakPolarHBondContact O-CB 3.41Å; K267-S270 PolarHBondContact O-N 2.85Å; K267-S270 PolarHBondContact O-OG 2.93Å
268	P	91.4	Very high	91.7	Very high	105 Å²	105	63.4 Å²	63.4	68%	0.682	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	142.9	169.4	-24.4	34.4	0	0	0	111.9	S270 E273	P268-S270 PolarHBondContact O-N 2.75Å; P268-S270 VanDerWaalsContact O-N 3.09Å; P268-E273 VanDerWaalsContact CA-OE2 3.31Å; P268-E273 WeakPolarHBondContact CA-OE2 3.43Å
269	D	87.6	Confident	91.7	Very high	151 Å²	151	68.7 Å²	68.7	81%	0.807	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	12.1	-179.3	-56.8	-52.2	0	0	0	114.9	E273	D269-E273 PolarHBondContact N-OE2 3.33Å
270	S	94.4	Very high	91.8	Very high	15 Å²	15	68.9 Å²	68.9	11%	0.105	35%	0.348	C	S	.	.			trans	-76.9	153.8	175.1	66.3	0	0	0	0	112.2	K267 P268 E272 E273 I274	K267-S270 VanDerWaalsContact O-CB 3.23Å; K267-S270 WeakPolarHBondContact O-CB 3.41Å; K267-S270 PolarHBondContact O-N 2.85Å; K267-S270 PolarHBondContact O-OG 2.93Å; P268-S270 PolarHBondContact O-N 2.75Å; P268-S270 VanDerWaalsContact O-N 3.09Å; S270-E272 WeakPolarHBondContact CB-OE2 3.38Å; S270-E272 PolarHBondContact O-N 2.86Å; S270-E273 WeakPolarHBondContact O-CB 3.4Å; S270-E273 PolarHBondContact O-N 3.46Å; S270-E273 PolarHBondContact OG-N 3.22Å; S270-I274 PolarHBondContact O-N 2.71Å; S270-I274 VanDerWaalsContact O-N 3.15Å
271	P	94.8	Very high	91.8	Very high	14 Å²	14	65 Å²	65	9%	0.091	35%	0.35	C	S	.	.	H	α-helix	trans	-53.8	-36.2	170.5	-27	36.6	0	0	0	113	F226 E273 I274 L275 T291 Y295	F226-P271 HydrophobicContact CB-CB 3.95Å; F226-P271 HydrophobicContact CD1-CB 3.62Å; F226-P271 HydrophobicContact CD1-CG 3.9Å; F226-P271 HydrophobicContact CD2-CB 3.38Å; F226-P271 HydrophobicContact CD2-CG 4.49Å; F226-P271 HydrophobicContact CE1-CB 3.89Å; F226-P271 HydrophobicContact CE1-CG 4.08Å; F226-P271 HydrophobicContact CE2-CB 3.64Å; F226-P271 HydrophobicContact CG-CB 3.36Å; F226-P271 HydrophobicContact CG-CG 4.13Å; F226-P271 HydrophobicContact CZ-CB 3.89Å; F226-P271 HydrophobicContact CZ-CG 4.43Å; P271-E273 PolarHBondContact O-N 2.87Å; P271-I274 PolarHBondContact O-N 3.04Å; P271-L275 WeakPolarHBondContact O-CD1 3.19Å; P271-L275 PolarHBondContact O-N 3.04Å; P271-T291 HydrophobicContact CB-CG2 3.89Å; P271-T291 HydrophobicContact CG-CG2 4.35Å; P271-Y295 HydrophobicContact CB-CE2 4.41Å; P271-Y295 HydrophobicContact CG-CD2 4.37Å; P271-Y295 HydrophobicContact CG-CE1 4.32Å; P271-Y295 HydrophobicContact CG-CE2 3.51Å; P271-Y295 VanDerWaalsContact CG-CZ 3.46Å; P271-Y295 VanDerWaalsContact CG-OH 3.31Å; P271-Y295 WeakPolarHBondContact CG-OH 3.43Å
272	E	95.9	Very high	92.1	Very high	32 Å²	32	72.2 Å²	72.2	15%	0.15	38%	0.382	C	S	.	.	H	α-helix	trans	-59.3	-43.4	174.4	-68.6	85	169.8	0	0	112.4	F226 F263 V266 S270 I274 L275 M276	F226-E272 HydrophobicContact CB-CG 3.89Å; F226-E272 WeakPolarHBondContact CB-OE1 3.44Å; F226-E272 PolarHBondContact N-OE1 3.16Å; F263-E272 HydrophobicContact CB-CB 4.06Å; F263-E272 HydrophobicContact CB-CG 3.98Å; F263-E272 HydrophobicContact CD1-CG 4.18Å; F263-E272 HydrophobicContact CD2-CB 3.58Å; F263-E272 HydrophobicContact CD2-CG 3.61Å; F263-E272 HydrophobicContact CE2-CB 4.18Å; F263-E272 HydrophobicContact CE2-CG 4.01Å; F263-E272 HydrophobicContact CG-CB 3.97Å; F263-E272 HydrophobicContact CG-CG 3.67Å; F263-E272 HydrophobicContact CZ-CG 4.41Å; V266-E272 HydrophobicContact CG1-CB 4.07Å; V266-E272 HydrophobicContact CG2-CB 4.08Å; S270-E272 WeakPolarHBondContact CB-OE2 3.38Å; S270-E272 PolarHBondContact O-N 2.86Å; E272-I274 VanDerWaalsContact C-N 3.34Å; E272-L275 PolarHBondContact O-N 2.78Å; E272-M276 WeakPolarHBondContact O-CB 3.16Å; E272-M276 WeakPolarHBondContact O-CG 3.1Å; E272-M276 PolarHBondContact O-N 2.88Å
273	E	95.5	Very high	92.2	Very high	68 Å²	68	69.7 Å²	69.7	32%	0.318	37%	0.369	S	S	.	.	H	α-helix	trans	-63	-43.2	175.6	-170.9	179.2	-152.5	0	0	110.9	V266 P268 D269 S270 P271 L275 M276 G277	V266-E273 HydrophobicContact CG1-CB 3.58Å; V266-E273 HydrophobicContact CG1-CG 4.32Å; P268-E273 VanDerWaalsContact CA-OE2 3.31Å; P268-E273 WeakPolarHBondContact CA-OE2 3.43Å; D269-E273 PolarHBondContact N-OE2 3.33Å; S270-E273 WeakPolarHBondContact O-CB 3.4Å; S270-E273 PolarHBondContact O-N 3.46Å; S270-E273 PolarHBondContact OG-N 3.22Å; P271-E273 PolarHBondContact O-N 2.87Å; E273-L275 PolarHBondContact O-N 3.3Å; E273-M276 PolarHBondContact O-N 3.5Å; E273-G277 WeakPolarHBondContact O-CA 3.27Å; E273-G277 PolarHBondContact O-N 2.99Å
274	I	95	Very high	92.3	Very high	46 Å²	46	71.8 Å²	71.8	24%	0.236	38%	0.383	C	S	.	.	H	α-helix	trans	-61.8	-47.2	178.7	-61.7	170.8	0	0	0	110.4	S270 P271 E272 G277 S283 Q287 I288 T291	S270-I274 PolarHBondContact O-N 2.71Å; S270-I274 VanDerWaalsContact O-N 3.15Å; P271-I274 PolarHBondContact O-N 3.04Å; E272-I274 VanDerWaalsContact C-N 3.34Å; I274-G277 PolarHBondContact O-N 3.48Å; I274-S283 WeakPolarHBondContact O-CB 3.39Å; I274-S283 PolarHBondContact O-OG 3.31Å; I274-Q287 HydrophobicContact CG2-CB 4.36Å; I274-I288 HydrophobicContact CG2-CG1 4.22Å; I274-T291 HydrophobicContact CD1-CG2 4.32Å; I274-T291 WeakPolarHBondContact CD1-OG1 3.48Å
275	L	95	Very high	92.5	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-63.3	-41.2	178.9	-91.9	71.6	0	0	0	112.2	F226 L229 W252 M261 F263 P271 E272 E273 G277 I288	F226-L275 HydrophobicContact CD2-CD1 4.02Å; F226-L275 HydrophobicContact CD2-CD2 4.14Å; F226-L275 HydrophobicContact CE2-CD1 3.95Å; F226-L275 HydrophobicContact CE2-CD2 4.5Å; L229-L275 HydrophobicContact CD2-CD2 3.52Å; W252-L275 HydrophobicContact CH2-CD2 4.02Å; M261-L275 HydrophobicContact CE-CD2 3.87Å; M261-L275 HydrophobicContact SD-CB 4.46Å; M261-L275 HydrophobicContact SD-CD2 4.12Å; F263-L275 HydrophobicContact CE2-CB 4.02Å; F263-L275 HydrophobicContact CE2-CD2 4.01Å; F263-L275 HydrophobicContact CZ-CD2 4.23Å; P271-L275 WeakPolarHBondContact O-CD1 3.19Å; P271-L275 PolarHBondContact O-N 3.04Å; E272-L275 PolarHBondContact O-N 2.78Å; E273-L275 PolarHBondContact O-N 3.3Å; L275-G277 VanDerWaalsContact C-N 3.32Å; L275-I288 HydrophobicContact CD1-CG2 3.93Å; L275-I288 HydrophobicContact CG-CG2 3.88Å
276	M	94.2	Very high	92.9	Very high	37 Å²	37	58.5 Å²	58.5	18%	0.182	32%	0.317	C	S	.	.	H	α-helix	trans	-74.9	-20.8	176.4	-73.2	179.5	59.5	0	0	113.3	N262 F263 V266 E272 E273 I278 R279	N262-M276 WeakPolarHBondContact OD1-CE 3.32Å; F263-M276 HydrophobicContact CB-SD 3.84Å; F263-M276 HydrophobicContact CD2-CG 4.04Å; F263-M276 HydrophobicContact CD2-SD 4.09Å; F263-M276 HydrophobicContact CG-SD 4.41Å; F263-M276 PolarHBondContact N-SD 3.46Å; V266-M276 HydrophobicContact CG2-CE 4.49Å; V266-M276 HydrophobicContact CG2-SD 3.6Å; V266-M276 VanDerWaalsContact CG2-SD 3.6Å; E272-M276 WeakPolarHBondContact O-CB 3.16Å; E272-M276 WeakPolarHBondContact O-CG 3.1Å; E272-M276 PolarHBondContact O-N 2.88Å; E273-M276 PolarHBondContact O-N 3.5Å; M276-I278 PolarHBondContact O-N 2.86Å; M276-I278 VanDerWaalsContact O-N 3.12Å; M276-R279 WeakPolarHBondContact O-CB 3.45Å; M276-R279 PolarHBondContact O-N 3.41Å
277	G	93.5	Very high	93.2	Very high	4 Å²	4	59.1 Å²	59.1	4%	0.041	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-60.1	-23.6	-175.8	0	0	0	0	0	114.2	E273 I274 L275 R279 T280 G281 K282 S283	E273-G277 WeakPolarHBondContact O-CA 3.27Å; E273-G277 PolarHBondContact O-N 2.99Å; I274-G277 PolarHBondContact O-N 3.48Å; L275-G277 VanDerWaalsContact C-N 3.32Å; G277-R279 PolarHBondContact O-N 3.07Å; G277-T280 CarbonylContact O-C 3.48Å; G277-T280 PolarHBondContact O-N 3.05Å; G277-T280 VanDerWaalsContact O-N 3.07Å; G277-T280 PolarHBondContact O-OG1 2.85Å; G277-T280 VanDerWaalsContact O-OG1 3.07Å; G277-G281 PolarHBondContact O-N 2.94Å; G277-K282 PolarHBondContact O-N 3.44Å; G277-S283 WeakPolarHBondContact CA-OG 3.36Å; G277-S283 PolarHBondContact O-N 3.44Å
278	I	89.9	Confident	93.4	Very high	28 Å²	28	51.8 Å²	51.8	14%	0.144	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-60.8	-31.4	175.3	-163.6	70.3	0	0	0	112.4	L258 M276 T280 G281 S283 Y285 I288	L258-I278 HydrophobicContact CB-CG2 3.55Å; L258-I278 HydrophobicContact CD1-CG1 4.42Å; L258-I278 HydrophobicContact CD1-CG2 4.24Å; L258-I278 HydrophobicContact CG-CG2 4.49Å; M276-I278 PolarHBondContact O-N 2.86Å; M276-I278 VanDerWaalsContact O-N 3.12Å; I278-T280 VanDerWaalsContact C-N 3.27Å; I278-T280 PolarHBondContact O-N 3.25Å; I278-G281 PolarHBondContact O-N 2.74Å; I278-S283 VanDerWaalsContact CD1-O 3.29Å; I278-S283 WeakPolarHBondContact CD1-O 3.16Å; I278-Y285 HydrophobicContact CD1-CD2 3.95Å; I278-Y285 HydrophobicContact CD1-CE2 4.1Å; I278-Y285 HydrophobicContact CG1-CE2 4.39Å; I278-I288 HydrophobicContact CB-CD1 4.1Å; I278-I288 HydrophobicContact CG2-CD1 4.41Å
279	R	88.3	Confident	93.7	Very high	112 Å²	112	46.8 Å²	46.8	42%	0.423	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-66.5	-30.3	176.2	-70.6	169	60.3	-173	-5.5	112.8	H259 M261 N262 M276 G277	H259-R279 WeakPolarHBondContact O-CD 3.35Å; H259-R279 PolarHBondContact O-NE 3.33Å; M261-R279 WeakPolarHBondContact O-CD 3.19Å; M261-R279 PolarHBondContact O-NH1 3.17Å; N262-R279 PolarHBondContact OD1-NH1 3.27Å; M276-R279 WeakPolarHBondContact O-CB 3.45Å; M276-R279 PolarHBondContact O-N 3.41Å; G277-R279 PolarHBondContact O-N 3.07Å
280	T	89.2	Confident	94.1	Very high	98 Å²	98	41.8 Å²	41.8	60%	0.601	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-103.6	-0.3	-177.1	59.7	0	0	0	0	112.5	G277 I278 K282	G277-T280 CarbonylContact O-C 3.48Å; G277-T280 PolarHBondContact O-N 3.05Å; G277-T280 VanDerWaalsContact O-N 3.07Å; G277-T280 PolarHBondContact O-OG1 2.85Å; G277-T280 VanDerWaalsContact O-OG1 3.07Å; I278-T280 VanDerWaalsContact C-N 3.27Å; I278-T280 PolarHBondContact O-N 3.25Å; T280-K282 PolarHBondContact O-N 3.17Å; T280-K282 WeakPolarHBondContact OG1-CG 3.44Å
281	G	87.9	Confident	94.3	Very high	67 Å²	67	41.7 Å²	41.7	69%	0.691	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.3	11.7	-173.9	0	0	0	0	0	114.5	G277 I278	G277-G281 PolarHBondContact O-N 2.94Å; I278-G281 PolarHBondContact O-N 2.74Å
282	K	92.2	Very high	94.4	Very high	152 Å²	152	41 Å²	41	66%	0.661	22%	0.216	S	C	*	.	S	Bend	trans	-81.2	-22.1	177	-70.1	-175.9	178.7	-175.9	0	113.4	G277 T280	G277-K282 PolarHBondContact O-N 3.44Å; T280-K282 PolarHBondContact O-N 3.17Å; T280-K282 WeakPolarHBondContact OG1-CG 3.44Å
283	S	93.5	Very high	94.5	Very high	13 Å²	13	39.5 Å²	39.5	9%	0.091	21%	0.209	C	C	.	.			trans	-124.5	156.1	178.5	-58.1	0	0	0	0	111.7	I274 G277 I278 Q287	I274-S283 WeakPolarHBondContact O-CB 3.39Å; I274-S283 PolarHBondContact O-OG 3.31Å; G277-S283 WeakPolarHBondContact CA-OG 3.36Å; G277-S283 PolarHBondContact O-N 3.44Å; I278-S283 VanDerWaalsContact CD1-O 3.29Å; I278-S283 WeakPolarHBondContact CD1-O 3.16Å; S283-Q287 VanDerWaalsContact CA-OE1 3.29Å
284	T	94.7	Very high	94.4	Very high	51 Å²	51	38 Å²	38	31%	0.313	20%	0.2	S	C	.	.			trans	-113.1	159.4	174.9	58.9	0	0	0	0	110.5	A286 Q287 I288 S326	T284-A286 PolarHBondContact O-N 3.08Å; T284-Q287 PolarHBondContact O-N 2.91Å; T284-Q287 VanDerWaalsContact O-N 3.1Å; T284-Q287 WeakPolarHBondContact OG1-CG 3.43Å; T284-Q287 PolarHBondContact OG1-N 3.45Å; T284-Q287 PolarHBondContact OG1-OE1 3.4Å; T284-I288 WeakPolarHBondContact O-CG1 3.23Å; T284-I288 PolarHBondContact O-N 3Å; T284-S326 PolarHBondContact OG1-OG 3.18Å
285	Y	95.8	Very high	94.5	Very high	25 Å²	25	37.9 Å²	37.9	10%	0.098	20%	0.197	C	C	.	.	H	α-helix	trans	-51.6	-39.7	170.4	-86	-96.4	0	0	0	111.8	L253 L258 I278 Q287 I288 F289 C341 H342 A345	L253-Y285 HydrophobicContact CD1-CD1 4.1Å; L253-Y285 HydrophobicContact CD1-CE1 4.27Å; L253-Y285 HydrophobicContact CD2-CD1 4.1Å; L253-Y285 HydrophobicContact CG-CD1 3.82Å; L253-Y285 HydrophobicContact CG-CE1 4.18Å; L258-Y285 HydrophobicContact CD1-CD1 4.28Å; L258-Y285 HydrophobicContact CD1-CE1 3.69Å; L258-Y285 HydrophobicContact CD1-CE2 4.32Å; I278-Y285 HydrophobicContact CD1-CD2 3.95Å; I278-Y285 HydrophobicContact CD1-CE2 4.1Å; I278-Y285 HydrophobicContact CG1-CE2 4.39Å; Y285-Q287 PolarHBondContact O-N 3.08Å; Y285-I288 PolarHBondContact O-N 3.25Å; Y285-F289 WeakPolarHBondContact O-CB 3.23Å; Y285-F289 PolarHBondContact O-N 3.5Å; Y285-C341 HydrophobicContact CD1-CB 4.04Å; Y285-H342 HydrophobicContact CD2-CB 4.12Å; Y285-H342 HydrophobicContact CG-CB 4.11Å; Y285-A345 HydrophobicContact CE1-CB 4Å
286	A	97.6	Very high	94.5	Very high	2 Å²	2	38 Å²	38	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-66.9	-35.4	-179.7	0	0	0	0	0	113.5	T284 Y290 L302 S326 N328	T284-A286 PolarHBondContact O-N 3.08Å; A286-Y290 WeakPolarHBondContact O-CB 3.26Å; A286-Y290 PolarHBondContact O-N 3.08Å; A286-L302 HydrophobicContact CB-CD1 3.46Å; A286-L302 VanDerWaalsContact CB-CD1 3.46Å; A286-S326 WeakPolarHBondContact CB-O 3.34Å; A286-N328 WeakPolarHBondContact CA-OD1 3.26Å; A286-N328 WeakPolarHBondContact CB-OD1 3.37Å; A286-N328 PolarHBondContact O-ND2 3.34Å; A286-N328 PolarHBondContact O-OD1 2.82Å
287	Q	97.2	Very high	94.5	Very high	67 Å²	67	38.1 Å²	38.1	31%	0.313	21%	0.209	S	C	.	.	H	α-helix	trans	-69	-41.4	173	-76.2	163.4	-52.9	0	0	111.5	I274 S283 T284 Y285 Y290 T291 L302	I274-Q287 HydrophobicContact CG2-CB 4.36Å; S283-Q287 VanDerWaalsContact CA-OE1 3.29Å; T284-Q287 PolarHBondContact O-N 2.91Å; T284-Q287 VanDerWaalsContact O-N 3.1Å; T284-Q287 WeakPolarHBondContact OG1-CG 3.43Å; T284-Q287 PolarHBondContact OG1-N 3.45Å; T284-Q287 PolarHBondContact OG1-OE1 3.4Å; Y285-Q287 PolarHBondContact O-N 3.08Å; Q287-Y290 PolarHBondContact O-N 2.97Å; Q287-T291 PolarHBondContact O-N 3.35Å; Q287-T291 PolarHBondContact O-OG1 3.33Å; Q287-T291 VanDerWaalsContact O-OG1 3.08Å; Q287-L302 HydrophobicContact CG-CD1 4.45Å; Q287-L302 HydrophobicContact CG-CD2 3.81Å
288	I	97.3	Very high	94.6	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-47.1	177.6	-64.5	171.7	0	0	0	110.6	L253 L258 I274 L275 I278 T284 Y285 Y290 T291 L292	L253-I288 HydrophobicContact CD1-CB 4.26Å; L253-I288 HydrophobicContact CD1-CG2 3.57Å; L253-I288 HydrophobicContact CD2-CB 4.42Å; L253-I288 HydrophobicContact CD2-CG2 4.2Å; L258-I288 HydrophobicContact CD1-CD1 4.06Å; I274-I288 HydrophobicContact CG2-CG1 4.22Å; L275-I288 HydrophobicContact CD1-CG2 3.93Å; L275-I288 HydrophobicContact CG-CG2 3.88Å; I278-I288 HydrophobicContact CB-CD1 4.1Å; I278-I288 HydrophobicContact CG2-CD1 4.41Å; T284-I288 WeakPolarHBondContact O-CG1 3.23Å; T284-I288 PolarHBondContact O-N 3Å; Y285-I288 PolarHBondContact O-N 3.25Å; I288-Y290 PolarHBondContact O-N 3.15Å; I288-T291 PolarHBondContact O-N 2.88Å; I288-L292 HydrophobicContact CG2-CD1 3.88Å; I288-L292 WeakPolarHBondContact O-CG 3.34Å; I288-L292 PolarHBondContact O-N 2.99Å
289	F	98.1	Very high	94.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-47	176.3	-174.5	-96.3	0	0	0	111.4	V246 I249 F250 L253 Y285 T291 L292 C293 N328 I339 C341	V246-F289 HydrophobicContact CG1-CZ 4.35Å; I249-F289 HydrophobicContact CB-CE2 4.31Å; I249-F289 HydrophobicContact CG2-CD2 3.65Å; I249-F289 HydrophobicContact CG2-CE2 3.67Å; F250-F289 HydrophobicContact CB-CE2 4.06Å; L253-F289 HydrophobicContact CD2-CB 3.74Å; L253-F289 HydrophobicContact CD2-CD2 4.23Å; L253-F289 HydrophobicContact CD2-CG 4.5Å; Y285-F289 WeakPolarHBondContact O-CB 3.23Å; Y285-F289 PolarHBondContact O-N 3.5Å; F289-T291 PolarHBondContact O-N 3.34Å; F289-L292 PolarHBondContact O-N 3.01Å; F289-C293 WeakPolarHBondContact CE1-SG 3.43Å; F289-C293 VanDerWaalsContact CZ-SG 3.55Å; F289-C293 WeakPolarHBondContact O-CB 3.23Å; F289-C293 PolarHBondContact O-N 2.93Å; F289-C293 PolarHBondContact O-SG 3.12Å; F289-C293 VanDerWaalsContact O-SG 3.41Å; F289-N328 HydrophobicContact CD1-CB 3.77Å; F289-N328 WeakPolarHBondContact CD1-OD1 3.19Å; F289-N328 HydrophobicContact CE1-CB 4.08Å; F289-I339 HydrophobicContact CE1-CD1 4.06Å; F289-I339 HydrophobicContact CE1-CG2 4.4Å; F289-I339 HydrophobicContact CE2-CD1 4.48Å; F289-I339 HydrophobicContact CE2-CG2 4.42Å; F289-I339 HydrophobicContact CZ-CD1 3.59Å; F289-I339 HydrophobicContact CZ-CG2 4.18Å; F289-C341 WeakPolarHBondContact CD2-SG 3.37Å
290	Y	97.2	Very high	95.1	Very high	47 Å²	47	34.4 Å²	34.4	18%	0.184	20%	0.196	C	C	.	.	H	α-helix	trans	-55.9	-46.7	175.2	172.6	-98.9	0	0	0	112.5	A286 Q287 I288 C293 R294 C300 L302	A286-Y290 WeakPolarHBondContact O-CB 3.26Å; A286-Y290 PolarHBondContact O-N 3.08Å; Q287-Y290 PolarHBondContact O-N 2.97Å; I288-Y290 PolarHBondContact O-N 3.15Å; Y290-C293 PolarHBondContact O-N 2.88Å; Y290-R294 VanDerWaalsContact CE1-CD 3.49Å; Y290-R294 HydrophobicContact CE1-CG 4.49Å; Y290-R294 HydrophobicContact CE2-CG 4.34Å; Y290-R294 WeakPolarHBondContact O-CG 3.5Å; Y290-R294 PolarHBondContact O-N 2.84Å; Y290-R294 WeakPolarHBondContact OH-CD 3.36Å; Y290-R294 PolarHBondContact OH-NH1 2.76Å; Y290-C300 HydrophobicContact CD2-CB 4.19Å; Y290-C300 WeakPolarHBondContact CD2-O 3.47Å; Y290-C300 WeakPolarHBondContact CE2-O 3.23Å; Y290-L302 HydrophobicContact CD2-CB 4.24Å; Y290-L302 HydrophobicContact CG-CB 4.37Å
291	T	96.7	Very high	95.3	Very high	12 Å²	12	33.5 Å²	33.5	7%	0.074	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-49.4	177	-63.7	0	0	0	0	111.3	F226 P271 I274 Q287 I288 F289 C293 R294 Y295	F226-T291 HydrophobicContact CE2-CG2 4.28Å; F226-T291 HydrophobicContact CZ-CG2 4.26Å; P271-T291 HydrophobicContact CB-CG2 3.89Å; P271-T291 HydrophobicContact CG-CG2 4.35Å; I274-T291 HydrophobicContact CD1-CG2 4.32Å; I274-T291 WeakPolarHBondContact CD1-OG1 3.48Å; Q287-T291 PolarHBondContact O-N 3.35Å; Q287-T291 PolarHBondContact O-OG1 3.33Å; Q287-T291 VanDerWaalsContact O-OG1 3.08Å; I288-T291 PolarHBondContact O-N 2.88Å; F289-T291 PolarHBondContact O-N 3.34Å; T291-C293 VanDerWaalsContact C-N 3.35Å; T291-C293 PolarHBondContact O-N 2.96Å; T291-R294 PolarHBondContact O-N 3.36Å; T291-Y295 HydrophobicContact CG2-CD2 4.05Å; T291-Y295 HydrophobicContact CG2-CE2 4.13Å; T291-Y295 WeakPolarHBondContact O-CD2 3.4Å; T291-Y295 PolarHBondContact O-N 2.89Å; T291-Y295 VanDerWaalsContact O-N 3.15Å
292	L	97.8	Very high	95.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.3	-44.5	178.2	-71.1	163.5	0	0	0	111.9	F226 L229 I230 L233 I249 W252 I288 F289 R294 Y295 A296	F226-L292 HydrophobicContact CE2-CD2 3.62Å; F226-L292 HydrophobicContact CE2-CG 4.4Å; F226-L292 HydrophobicContact CZ-CD2 4.09Å; L229-L292 HydrophobicContact CD2-CD2 4.29Å; I230-L292 HydrophobicContact CD1-CD2 4.11Å; L233-L292 HydrophobicContact CD1-CD2 4.47Å; I249-L292 HydrophobicContact CD1-CB 4.28Å; I249-L292 HydrophobicContact CG1-CB 4.4Å; I249-L292 HydrophobicContact CG2-CB 3.6Å; I249-L292 HydrophobicContact CG2-CD1 3.92Å; I249-L292 HydrophobicContact CG2-CG 4.39Å; W252-L292 HydrophobicContact CE3-CD1 3.9Å; W252-L292 HydrophobicContact CZ3-CD1 3.63Å; I288-L292 HydrophobicContact CG2-CD1 3.88Å; I288-L292 WeakPolarHBondContact O-CG 3.34Å; I288-L292 PolarHBondContact O-N 2.99Å; F289-L292 PolarHBondContact O-N 3.01Å; L292-R294 PolarHBondContact O-N 2.81Å; L292-Y295 PolarHBondContact O-N 3.44Å; L292-A296 WeakPolarHBondContact O-CB 3.44Å; L292-A296 PolarHBondContact O-N 3.35Å
293	C	97.3	Very high	95.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.7	-46.4	176.6	-77.8	0	0	0	0	112.2	F289 Y290 T291 Y295 A296 G297 L298 C300	F289-C293 WeakPolarHBondContact CE1-SG 3.43Å; F289-C293 VanDerWaalsContact CZ-SG 3.55Å; F289-C293 WeakPolarHBondContact O-CB 3.23Å; F289-C293 PolarHBondContact O-N 2.93Å; F289-C293 PolarHBondContact O-SG 3.12Å; F289-C293 VanDerWaalsContact O-SG 3.41Å; Y290-C293 PolarHBondContact O-N 2.88Å; T291-C293 VanDerWaalsContact C-N 3.35Å; T291-C293 PolarHBondContact O-N 2.96Å; C293-Y295 VanDerWaalsContact C-N 3.34Å; C293-Y295 PolarHBondContact O-N 2.82Å; C293-A296 CarbonylContact O-C 3.5Å; C293-A296 WeakPolarHBondContact O-CA 3.22Å; C293-A296 PolarHBondContact O-N 3.49Å; C293-G297 PolarHBondContact O-N 2.91Å; C293-L298 HydrophobicContact CB-CB 3.93Å; C293-L298 HydrophobicContact CB-CD1 4.26Å; C293-L298 WeakPolarHBondContact O-CB 3.31Å; C293-L298 PolarHBondContact O-N 2.8Å; C293-C300 HydrophobicContact CB-CB 3.5Å; C293-C300 VanDerWaalsContact CB-CB 3.5Å
294	R	95.1	Very high	96.1	Very high	37 Å²	37	29.6 Å²	29.6	14%	0.14	15%	0.152	C	C	.	.	H	α-helix	trans	-62.2	-41.7	-179.5	-76.1	-173.8	65.2	-167.7	-3.1	112.7	P176 L177 Y290 T291 L292 A296 G297	P176-R294 HydrophobicContact CB-CB 4.03Å; L177-R294 PolarHBondContact N-O 2.8Å; L177-R294 PolarHBondContact O-NE 3.23Å; L177-R294 PolarHBondContact O-NH2 2.71Å; Y290-R294 VanDerWaalsContact CE1-CD 3.49Å; Y290-R294 HydrophobicContact CE1-CG 4.49Å; Y290-R294 HydrophobicContact CE2-CG 4.34Å; Y290-R294 WeakPolarHBondContact O-CG 3.5Å; Y290-R294 PolarHBondContact O-N 2.84Å; Y290-R294 WeakPolarHBondContact OH-CD 3.36Å; Y290-R294 PolarHBondContact OH-NH1 2.76Å; T291-R294 PolarHBondContact O-N 3.36Å; L292-R294 PolarHBondContact O-N 2.81Å; R294-A296 PolarHBondContact O-N 3.49Å; R294-G297 PolarHBondContact O-N 2.95Å
295	Y	95.8	Very high	96.2	Very high	43 Å²	43	27.1 Å²	27.1	17%	0.169	14%	0.137	C	C	.	.	H	α-helix	trans	-74.6	-14.5	176.2	-81.4	-92.8	0	0	0	113.4	P174 P176 F226 Y235 P271 T291 L292 C293	P174-Y295 HydrophobicContact CB-CD1 4.07Å; P174-Y295 HydrophobicContact CG-CD1 4.23Å; P174-Y295 VanDerWaalsContact O-CE1 3.31Å; P174-Y295 WeakPolarHBondContact O-CE1 3.24Å; P176-Y295 HydrophobicContact CB-CD2 3.96Å; P176-Y295 HydrophobicContact CB-CE1 4.48Å; P176-Y295 HydrophobicContact CB-CE2 3.77Å; P176-Y295 HydrophobicContact CB-CG 4.39Å; P176-Y295 HydrophobicContact CG-CE1 4.41Å; P176-Y295 HydrophobicContact CG-CE2 4.11Å; F226-Y295 HydrophobicContact CD1-CD1 4.48Å; F226-Y295 AromaticContact CE1-CD1 3.62Å; F226-Y295 HydrophobicContact CE1-CD1 3.62Å; F226-Y295 AromaticContact CE1-CD2 3.75Å; F226-Y295 HydrophobicContact CE1-CD2 3.75Å; F226-Y295 HydrophobicContact CE1-CE1 4.08Å; F226-Y295 HydrophobicContact CE1-CE2 4.22Å; F226-Y295 AromaticContact CE1-CG 3.42Å; F226-Y295 HydrophobicContact CE1-CG 3.42Å; F226-Y295 VanDerWaalsContact CE1-CG 3.42Å; F226-Y295 HydrophobicContact CZ-CD1 4.42Å; F226-Y295 AromaticContact CZ-CD2 3.79Å; F226-Y295 HydrophobicContact CZ-CD2 3.79Å; F226-Y295 HydrophobicContact CZ-CE2 4.46Å; F226-Y295 AromaticContact CZ-CG 3.76Å; F226-Y295 HydrophobicContact CZ-CG 3.76Å; Y235-Y295 PolarHBondContact OH-O 2.97Å; P271-Y295 HydrophobicContact CB-CE2 4.41Å; P271-Y295 HydrophobicContact CG-CD2 4.37Å; P271-Y295 HydrophobicContact CG-CE1 4.32Å; P271-Y295 HydrophobicContact CG-CE2 3.51Å; P271-Y295 VanDerWaalsContact CG-CZ 3.46Å; P271-Y295 VanDerWaalsContact CG-OH 3.31Å; P271-Y295 WeakPolarHBondContact CG-OH 3.43Å; T291-Y295 HydrophobicContact CG2-CD2 4.05Å; T291-Y295 HydrophobicContact CG2-CE2 4.13Å; T291-Y295 WeakPolarHBondContact O-CD2 3.4Å; T291-Y295 PolarHBondContact O-N 2.89Å; T291-Y295 VanDerWaalsContact O-N 3.15Å; L292-Y295 PolarHBondContact O-N 3.44Å; C293-Y295 VanDerWaalsContact C-N 3.34Å; C293-Y295 PolarHBondContact O-N 2.82Å
296	A	95.9	Very high	96.3	Very high	3 Å²	3	27.4 Å²	27.4	3%	0.025	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	2.7	169.3	0	0	0	0	0	113.4	I230 I234 I249 L292 C293 R294 L298	I230-A296 HydrophobicContact CD1-CB 4.37Å; I234-A296 HydrophobicContact CD1-CB 4.4Å; I234-A296 HydrophobicContact CG1-CB 4.09Å; I249-A296 HydrophobicContact CD1-CB 3.72Å; L292-A296 WeakPolarHBondContact O-CB 3.44Å; L292-A296 PolarHBondContact O-N 3.35Å; C293-A296 CarbonylContact O-C 3.5Å; C293-A296 WeakPolarHBondContact O-CA 3.22Å; C293-A296 PolarHBondContact O-N 3.49Å; R294-A296 PolarHBondContact O-N 3.49Å; A296-L298 HydrophobicContact CB-CD1 4.26Å; A296-L298 HydrophobicContact CB-CG 4.39Å
297	G	93.9	Very high	96.2	Very high	39 Å²	39	27.4 Å²	27.4	40%	0.402	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	18.7	-177.9	0	0	0	0	0	114.7	C293 R294	C293-G297 PolarHBondContact O-N 2.91Å; R294-G297 PolarHBondContact O-N 2.95Å
298	L	94.8	Very high	96.1	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	12%	0.124	C	C	.	.			trans	-93.6	134.2	179.6	-65.4	167.1	0	0	0	111.4	D242 K245 V246 I249 C293 A296 C300 V330	D242-L298 HydrophobicContact CB-CD2 3.61Å; D242-L298 WeakPolarHBondContact OD1-CD2 3.41Å; K245-L298 HydrophobicContact CB-CD1 3.78Å; K245-L298 HydrophobicContact CB-CD2 4.27Å; K245-L298 HydrophobicContact CB-CG 4.29Å; K245-L298 HydrophobicContact CD-CD2 4.13Å; K245-L298 HydrophobicContact CD-CG 4.24Å; V246-L298 HydrophobicContact CG2-CD1 3.58Å; V246-L298 HydrophobicContact CG2-CD2 4.15Å; V246-L298 HydrophobicContact CG2-CG 4.46Å; I249-L298 HydrophobicContact CD1-CD1 4.03Å; C293-L298 HydrophobicContact CB-CB 3.93Å; C293-L298 HydrophobicContact CB-CD1 4.26Å; C293-L298 WeakPolarHBondContact O-CB 3.31Å; C293-L298 PolarHBondContact O-N 2.8Å; A296-L298 HydrophobicContact CB-CD1 4.26Å; A296-L298 HydrophobicContact CB-CG 4.39Å; L298-C300 PolarHBondContact O-N 3.47Å; L298-V330 HydrophobicContact CB-CG2 4.45Å
299	H	93.6	Very high	95.8	Very high	51 Å²	51	25 Å²	25	24%	0.236	13%	0.131	C	C	.	.			trans	-70.2	112.3	167.1	-68.6	-91.4	0	0	0	109.4	L177 T181 V330 L331 W336	L177-H299 HydrophobicContact CD2-CB 4.43Å; T181-H299 PolarHBondContact O-CE1 3.17Å; T181-H299 PolarHBondContact O-ND1 2.88Å; H299-V330 WeakPolarHBondContact O-CA 3.43Å; H299-V330 WeakPolarHBondContact O-CG2 3.27Å; H299-L331 HydrophobicContact CB-CB 3.84Å; H299-L331 HydrophobicContact CB-CD2 4.2Å; H299-L331 PolarHBondContact O-N 2.76Å; H299-W336 HydrophobicContact CB-CH2 4.2Å
300	C	95	Very high	95.2	Very high	15 Å²	15	30 Å²	30	10%	0.101	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.8	179.9	-177.6	0	0	0	0	109.1	Y290 C293 L298 A329	Y290-C300 HydrophobicContact CD2-CB 4.19Å; Y290-C300 WeakPolarHBondContact CD2-O 3.47Å; Y290-C300 WeakPolarHBondContact CE2-O 3.23Å; C293-C300 HydrophobicContact CB-CB 3.5Å; C293-C300 VanDerWaalsContact CB-CB 3.5Å; L298-C300 PolarHBondContact O-N 3.47Å; C300-A329 CarbonylContact C-O 3.49Å; C300-A329 WeakPolarHBondContact CA-O 3.44Å
301	K	94.4	Very high	94.7	Very high	79 Å²	79	32.9 Å²	32.9	34%	0.343	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127	175.8	-177.3	71.3	177	-177.6	0	108.7	L303 N328 A329 W336 W385	K301-L303 HydrophobicContact CB-CD2 4.36Å; K301-L303 HydrophobicContact CG-CD2 3.53Å; K301-L303 HydrophobicContact CG-CG 4.36Å; K301-N328 WeakPolarHBondContact O-CA 3.25Å; K301-N328 PolarHBondContact O-ND2 2.85Å; K301-A329 HydrophobicContact CB-CB 4.34Å; K301-A329 PolarHBondContact N-O 2.94Å; K301-A329 PolarHBondContact O-N 2.74Å; K301-W336 HydrophobicContact CB-CH2 4.46Å; K301-W336 HydrophobicContact CB-CZ3 4.18Å; K301-W385 HydrophobicContact CB-CH2 3.84Å; K301-W385 HydrophobicContact CB-CZ2 4.16Å; K301-W385 HydrophobicContact CB-CZ3 4.14Å; K301-W385 HydrophobicContact CD-CH2 4.34Å; K301-W385 HydrophobicContact CD-CZ2 3.83Å; K301-W385 HydrophobicContact CG-CD2 4.31Å; K301-W385 HydrophobicContact CG-CE3 4.48Å; K301-W385 HydrophobicContact CG-CH2 3.8Å; K301-W385 HydrophobicContact CG-CZ2 3.58Å; K301-W385 HydrophobicContact CG-CZ3 4.24Å
302	L	95.9	Very high	94.5	Very high	50 Å²	50	33.1 Å²	33.1	26%	0.262	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	120.7	165	179.7	63.2	0	0	0	109	A286 Q287 Y290	A286-L302 HydrophobicContact CB-CD1 3.46Å; A286-L302 VanDerWaalsContact CB-CD1 3.46Å; Q287-L302 HydrophobicContact CG-CD1 4.45Å; Q287-L302 HydrophobicContact CG-CD2 3.81Å; Y290-L302 HydrophobicContact CD2-CB 4.24Å; Y290-L302 HydrophobicContact CG-CB 4.37Å
303	L	96.9	Very high	94.3	Very high	5 Å²	5	34 Å²	34	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	142	178.5	-58.1	-178.1	0	0	0	109.8	K301 S326 W327 A329 L338 W385	K301-L303 HydrophobicContact CB-CD2 4.36Å; K301-L303 HydrophobicContact CG-CD2 3.53Å; K301-L303 HydrophobicContact CG-CG 4.36Å; L303-S326 WeakPolarHBondContact O-CA 3.36Å; L303-S326 WeakPolarHBondContact O-CB 3.39Å; L303-W327 HydrophobicContact CB-CD2 4.04Å; L303-W327 HydrophobicContact CB-CG 4.28Å; L303-W327 HydrophobicContact CB-CZ2 4.22Å; L303-W327 HydrophobicContact CD1-CZ2 4.5Å; L303-W327 PolarHBondContact N-O 3.27Å; L303-W327 PolarHBondContact O-N 3.37Å; L303-W327 VanDerWaalsContact O-N 3.14Å; L303-A329 HydrophobicContact CD1-CB 3.91Å; L303-A329 HydrophobicContact CG-CB 4.48Å; L303-L338 HydrophobicContact CD1-CD2 3.96Å; L303-W385 HydrophobicContact CD1-CB 4.1Å; L303-W385 HydrophobicContact CD1-CE3 4.45Å; L303-W385 HydrophobicContact CD1-CG 4.49Å; L303-W385 HydrophobicContact CD2-CB 3.71Å; L303-W385 HydrophobicContact CD2-CD2 3.49Å; L303-W385 VanDerWaalsContact CD2-CD2 3.49Å; L303-W385 HydrophobicContact CD2-CE3 3.93Å; L303-W385 HydrophobicContact CD2-CG 3.36Å
304	I	96.8	Very high	94.1	Very high	94 Å²	94	34.1 Å²	34.1	48%	0.482	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	135.7	178.3	-54.4	174.5	0	0	0	107.5	H381	I304-H381 PolarHBondContact O-CD2 2.93Å; I304-H381 PolarHBondContact O-N 2.84Å
305	G	97.5	Very high	94	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.9	-159.2	-176.6	0	0	0	0	0	112.9	Q324 H325 F379	G305-Q324 WeakPolarHBondContact O-CA 3.43Å; G305-H325 PolarHBondContact N-O 3.12Å; G305-H325 PolarHBondContact O-N 2.84Å; G305-F379 CarbonylContact C-O 3.5Å; G305-F379 WeakPolarHBondContact CA-O 3.39Å
306	Y	97.4	Very high	93.8	Very high	30 Å²	30	33.9 Å²	33.9	12%	0.118	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	146.6	171.8	-62.3	-60.5	0	0	0	111	F318 G323 Q324 F379 H381 L394	Y306-F318 HydrophobicContact CD1-CB 3.78Å; Y306-F318 AromaticContact CD1-CD1 3.71Å; Y306-F318 HydrophobicContact CD1-CD1 3.71Å; Y306-F318 AromaticContact CD1-CG 3.96Å; Y306-F318 HydrophobicContact CD1-CG 3.96Å; Y306-F318 HydrophobicContact CD2-CB 3.69Å; Y306-F318 HydrophobicContact CD2-CG 4.1Å; Y306-F318 HydrophobicContact CE1-CB 3.9Å; Y306-F318 HydrophobicContact CE1-CD1 4.47Å; Y306-F318 HydrophobicContact CE2-CB 3.8Å; Y306-F318 HydrophobicContact CG-CB 3.67Å; Y306-F318 AromaticContact CG-CD1 3.79Å; Y306-F318 HydrophobicContact CG-CD1 3.79Å; Y306-F318 HydrophobicContact CG-CD2 4.42Å; Y306-F318 AromaticContact CG-CG 3.7Å; Y306-F318 HydrophobicContact CG-CG 3.7Å; Y306-G323 CarbonylContact C-O 3.56Å; Y306-G323 VanDerWaalsContact CA-O 3.26Å; Y306-G323 WeakPolarHBondContact CA-O 3.38Å; Y306-Q324 HydrophobicContact CD1-CG 4.49Å; Y306-Q324 HydrophobicContact CE1-CG 4.27Å; Y306-F379 HydrophobicContact CD2-CD1 4.25Å; Y306-F379 PolarHBondContact N-O 2.85Å; Y306-F379 PolarHBondContact O-N 2.83Å; Y306-H381 AromaticContact CE2-CE1 3.84Å; Y306-H381 AromaticContact CZ-CE1 3.91Å; Y306-L394 HydrophobicContact CD2-CD1 3.93Å; Y306-L394 HydrophobicContact CE2-CD1 4.32Å; Y306-L394 HydrophobicContact CE2-CD2 4.36Å
307	A	96.4	Very high	93.7	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	145.5	169.2	0	0	0	0	0	112.4	G309 G323 H325 W343 T377	A307-G309 PolarHBondContact O-N 2.91Å; A307-G323 PolarHBondContact N-O 2.89Å; A307-H325 HydrophobicContact CB-CB 3.55Å; A307-W343 HydrophobicContact CB-CH2 4.1Å; A307-W343 HydrophobicContact CB-CZ2 3.65Å; A307-T377 CarbonylContact C-O 3.49Å; A307-T377 WeakPolarHBondContact CA-O 3.5Å
308	K	95.3	Very high	93.7	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.013	22%	0.215	C	C	.	.			trans	-79.1	68.5	174.5	-64.8	-178	-174.1	162.6	0	110.6	Y312 F318 W343 Y376 T377 F397 L400 P402	K308-Y312 HydrophobicContact CB-CD1 3.82Å; K308-Y312 HydrophobicContact CB-CD2 4.23Å; K308-Y312 HydrophobicContact CB-CE1 4.31Å; K308-Y312 HydrophobicContact CB-CG 3.76Å; K308-Y312 HydrophobicContact CD-CD1 4.05Å; K308-Y312 HydrophobicContact CD-CD2 4.48Å; K308-Y312 HydrophobicContact CD-CE1 3.65Å; K308-Y312 HydrophobicContact CD-CE2 4.12Å; K308-Y312 HydrophobicContact CD-CG 4.44Å; K308-Y312 HydrophobicContact CG-CD1 3.9Å; K308-Y312 HydrophobicContact CG-CD2 3.8Å; K308-Y312 HydrophobicContact CG-CE1 3.94Å; K308-Y312 HydrophobicContact CG-CE2 3.84Å; K308-Y312 HydrophobicContact CG-CG 3.82Å; K308-F318 HydrophobicContact CG-CE2 4.28Å; K308-F318 HydrophobicContact CG-CZ 3.92Å; K308-W343 WeakPolarHBondContact O-CH2 3.44Å; K308-Y376 WeakPolarHBondContact CD-O 3.46Å; K308-Y376 PolarHBondContact NZ-O 3.3Å; K308-Y376 VanDerWaalsContact NZ-O 3.13Å; K308-T377 PolarHBondContact N-O 3.25Å; K308-F397 HydrophobicContact CD-CE2 4.47Å; K308-F397 HydrophobicContact CD-CZ 4.3Å; K308-F397 VanDerWaalsContact CE-O 3.26Å; K308-F397 WeakPolarHBondContact CE-O 3.18Å; K308-F397 HydrophobicContact CG-CE1 4.4Å; K308-F397 HydrophobicContact CG-CE2 4.45Å; K308-F397 HydrophobicContact CG-CZ 3.85Å; K308-F397 PolarHBondContact NZ-O 3.17Å; K308-L400 PolarHBondContact NZ-O 3.05Å; K308-P402 HydrophobicContact CD-CB 4.18Å
309	G	90.6	Very high	93.4	Very high	14 Å²	14	42.1 Å²	42.1	14%	0.144	24%	0.241	C	C	.	.			trans	-72.7	-159.4	-177.9	0	0	0	0	0	114.5	A307 E311 Y312	A307-G309 PolarHBondContact O-N 2.91Å; G309-E311 VanDerWaalsContact C-N 3.29Å; G309-E311 PolarHBondContact O-N 2.83Å; G309-Y312 PolarHBondContact O-N 3.08Å
310	A	85.8	Confident	93.2	Very high	105 Å²	105	42.1 Å²	42.1	87%	0.868	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-29.6	-178.1	0	0	0	0	0	112.8	Y312	A310-Y312 VanDerWaalsContact C-N 3.34Å
311	E	86.4	Confident	92.9	Very high	106 Å²	106	51.8 Å²	51.8	50%	0.495	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-5.9	178.2	68.7	-84.9	-166.1	0	0	114.1	G309	G309-E311 VanDerWaalsContact C-N 3.29Å; G309-E311 PolarHBondContact O-N 2.83Å
312	Y	92.7	Very high	92.7	Very high	17 Å²	17	52.6 Å²	52.6	7%	0.067	30%	0.295	C	S	.	.			trans	-78.6	131.8	178.7	178.9	-91.7	0	0	0	111	K308 G309 A310 M316 F318 E398 P402	K308-Y312 HydrophobicContact CB-CD1 3.82Å; K308-Y312 HydrophobicContact CB-CD2 4.23Å; K308-Y312 HydrophobicContact CB-CE1 4.31Å; K308-Y312 HydrophobicContact CB-CG 3.76Å; K308-Y312 HydrophobicContact CD-CD1 4.05Å; K308-Y312 HydrophobicContact CD-CD2 4.48Å; K308-Y312 HydrophobicContact CD-CE1 3.65Å; K308-Y312 HydrophobicContact CD-CE2 4.12Å; K308-Y312 HydrophobicContact CD-CG 4.44Å; K308-Y312 HydrophobicContact CG-CD1 3.9Å; K308-Y312 HydrophobicContact CG-CD2 3.8Å; K308-Y312 HydrophobicContact CG-CE1 3.94Å; K308-Y312 HydrophobicContact CG-CE2 3.84Å; K308-Y312 HydrophobicContact CG-CG 3.82Å; G309-Y312 PolarHBondContact O-N 3.08Å; A310-Y312 VanDerWaalsContact C-N 3.34Å; Y312-M316 HydrophobicContact CD2-CB 4.11Å; Y312-M316 HydrophobicContact CE2-CB 3.96Å; Y312-F318 HydrophobicContact CD2-CE1 4.19Å; Y312-F318 AromaticContact CD2-CE2 3.98Å; Y312-F318 HydrophobicContact CD2-CE2 3.98Å; Y312-F318 AromaticContact CD2-CZ 3.46Å; Y312-F318 HydrophobicContact CD2-CZ 3.46Å; Y312-F318 VanDerWaalsContact CD2-CZ 3.46Å; Y312-F318 AromaticContact CE2-CE2 3.77Å; Y312-F318 HydrophobicContact CE2-CE2 3.77Å; Y312-F318 AromaticContact CE2-CZ 3.77Å; Y312-F318 HydrophobicContact CE2-CZ 3.77Å; Y312-F318 HydrophobicContact CG-CZ 4.48Å; Y312-E398 PolarHBondContact OH-O 2.82Å; Y312-P402 HydrophobicContact CD1-CB 4.16Å; Y312-P402 HydrophobicContact CD1-CG 4.42Å; Y312-P402 HydrophobicContact CE1-CB 3.88Å; Y312-P402 HydrophobicContact CE1-CG 3.9Å
313	A	92.3	Very high	92.5	Very high	19 Å²	19	50.5 Å²	50.5	16%	0.157	29%	0.285	C	S	.	.			trans	-115.9	145.1	168.7	0	0	0	0	0	110	G315 M316	A313-G315 PolarHBondContact O-N 2.76Å; A313-M316 HydrophobicContact CB-CG 4.07Å; A313-M316 HydrophobicContact CB-SD 3.67Å; A313-M316 PolarHBondContact N-SD 3.27Å; A313-M316 VanDerWaalsContact O-CB 3.29Å; A313-M316 WeakPolarHBondContact O-CB 3.24Å; A313-M316 VanDerWaalsContact O-CG 3.31Å; A313-M316 WeakPolarHBondContact O-CG 3.48Å; A313-M316 PolarHBondContact O-N 3.49Å
314	P	94.2	Very high	92.4	Very high	3 Å²	3	55 Å²	55	2%	0.019	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	128.4	177	-22.3	28.7	0	0	0	112.5	P402 E533 R535	P314-P402 HydrophobicContact CG-CG 3.97Å; P314-E533 WeakPolarHBondContact CD-OE1 3.49Å; P314-E533 HydrophobicContact CG-CB 4.18Å; P314-E533 HydrophobicContact CG-CG 3.76Å; P314-R535 HydrophobicContact CB-CB 3.72Å; P314-R535 HydrophobicContact CG-CB 4.47Å; P314-R535 VanDerWaalsContact O-CD 3.29Å; P314-R535 WeakPolarHBondContact O-CD 3.32Å
315	G	91.6	Very high	92.4	Very high	29 Å²	29	51.6 Å²	51.6	30%	0.299	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	2	-176.6	0	0	0	0	0	115.3	A313 S420	A313-G315 PolarHBondContact O-N 2.76Å; G315-S420 PolarHBondContact N-OG 2.85Å
316	M	92.8	Very high	92.4	Very high	46 Å²	46	52.4 Å²	52.4	23%	0.227	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-69.6	140.9	170.1	-77.7	179.3	52.9	0	0	111.7	Y312 A313 Q322	Y312-M316 HydrophobicContact CD2-CB 4.11Å; Y312-M316 HydrophobicContact CE2-CB 3.96Å; A313-M316 HydrophobicContact CB-CG 4.07Å; A313-M316 HydrophobicContact CB-SD 3.67Å; A313-M316 PolarHBondContact N-SD 3.27Å; A313-M316 VanDerWaalsContact O-CB 3.29Å; A313-M316 WeakPolarHBondContact O-CB 3.24Å; A313-M316 VanDerWaalsContact O-CG 3.31Å; A313-M316 WeakPolarHBondContact O-CG 3.48Å; A313-M316 PolarHBondContact O-N 3.49Å; M316-Q322 HydrophobicContact CE-CG 4.4Å
317	H	94.3	Very high	92.4	Very high	119 Å²	119	51.1 Å²	51.1	55%	0.551	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-99.6	140.3	170.5	-64.1	-78	0	0	0	110	E398	H317-E398 WeakPolarHBondContact CA-OE1 3.39Å; H317-E398 IonicContact CE1-OE2 3.2Å; H317-E398 IonicContact CG-OE2 3.69Å; H317-E398 IonicContact ND1-OE1 2.87Å; H317-E398 IonicContact ND1-OE2 3.97Å; H317-E398 PolarHBondContact ND1-OE2 3.34Å
318	F	93.7	Very high	92.5	Very high	16 Å²	16	51 Å²	51	7%	0.07	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-84.3	128.5	178.1	-68.5	-81.5	0	0	0	110.3	Y306 K308 Y312 F397 E398	Y306-F318 HydrophobicContact CD1-CB 3.78Å; Y306-F318 AromaticContact CD1-CD1 3.71Å; Y306-F318 HydrophobicContact CD1-CD1 3.71Å; Y306-F318 AromaticContact CD1-CG 3.96Å; Y306-F318 HydrophobicContact CD1-CG 3.96Å; Y306-F318 HydrophobicContact CD2-CB 3.69Å; Y306-F318 HydrophobicContact CD2-CG 4.1Å; Y306-F318 HydrophobicContact CE1-CB 3.9Å; Y306-F318 HydrophobicContact CE1-CD1 4.47Å; Y306-F318 HydrophobicContact CE2-CB 3.8Å; Y306-F318 HydrophobicContact CG-CB 3.67Å; Y306-F318 AromaticContact CG-CD1 3.79Å; Y306-F318 HydrophobicContact CG-CD1 3.79Å; Y306-F318 HydrophobicContact CG-CD2 4.42Å; Y306-F318 AromaticContact CG-CG 3.7Å; Y306-F318 HydrophobicContact CG-CG 3.7Å; K308-F318 HydrophobicContact CG-CE2 4.28Å; K308-F318 HydrophobicContact CG-CZ 3.92Å; Y312-F318 HydrophobicContact CD2-CE1 4.19Å; Y312-F318 AromaticContact CD2-CE2 3.98Å; Y312-F318 HydrophobicContact CD2-CE2 3.98Å; Y312-F318 AromaticContact CD2-CZ 3.46Å; Y312-F318 HydrophobicContact CD2-CZ 3.46Å; Y312-F318 VanDerWaalsContact CD2-CZ 3.46Å; Y312-F318 AromaticContact CE2-CE2 3.77Å; Y312-F318 HydrophobicContact CE2-CE2 3.77Å; Y312-F318 AromaticContact CE2-CZ 3.77Å; Y312-F318 HydrophobicContact CE2-CZ 3.77Å; Y312-F318 HydrophobicContact CG-CZ 4.48Å; F318-F397 HydrophobicContact CD2-CD1 4.2Å; F318-F397 AromaticContact CD2-CE1 3.83Å; F318-F397 HydrophobicContact CD2-CE1 3.83Å; F318-F397 AromaticContact CE2-CD1 3.97Å; F318-F397 HydrophobicContact CE2-CD1 3.97Å; F318-F397 AromaticContact CE2-CE1 3.3Å; F318-F397 HydrophobicContact CE2-CE1 3.3Å; F318-F397 HydrophobicContact CE2-CZ 4.19Å; F318-F397 AromaticContact CZ-CE1 3.97Å; F318-F397 HydrophobicContact CZ-CE1 3.97Å; F318-E398 HydrophobicContact CD2-CG 3.86Å; F318-E398 HydrophobicContact CE2-CG 4.4Å; F318-E398 PolarHBondContact N-OE1 3.35Å
319	S	88.5	Confident	92.6	Very high	81 Å²	81	50.9 Å²	50.9	57%	0.566	29%	0.286	S	S	*	.			trans	-148.3	141.8	171.8	63.1	0	0	0	0	111	R321 Q322	S319-R321 PolarHBondContact O-N 3.39Å; S319-Q322 PolarHBondContact O-N 2.92Å
320	G	89	Confident	92.8	Very high	51 Å²	51	50.2 Å²	50.2	53%	0.526	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	-126.5	178.3	0	0	0	0	0	113.3	Q324	G320-Q324 PolarHBondContact O-NE2 2.87Å
321	R	89.2	Confident	93.1	Very high	218 Å²	218	45.8 Å²	45.8	82%	0.823	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-14.3	-175.3	-66.1	-171.3	179.9	-169.2	-0.5	114.5	S319 G323 Q324	S319-R321 PolarHBondContact O-N 3.39Å; R321-G323 PolarHBondContact O-N 2.78Å; R321-Q324 WeakPolarHBondContact O-CB 3.5Å; R321-Q324 PolarHBondContact O-N 3.01Å; R321-Q324 VanDerWaalsContact O-N 3.17Å
322	Q	89.6	Confident	93.3	Very high	96 Å²	96	40.9 Å²	40.9	45%	0.449	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	128.3	-175.7	-173.7	171.5	22	0	0	110.1	M316 S319 Q324	M316-Q322 HydrophobicContact CE-CG 4.4Å; S319-Q322 PolarHBondContact O-N 2.92Å; Q322-Q324 PolarHBondContact O-N 3.38Å
323	G	91.6	Very high	93	Very high	5 Å²	5	45.4 Å²	45.4	5%	0.052	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	11.4	-176.7	0	0	0	0	0	114.9	Y306 A307 R321 H325	Y306-G323 CarbonylContact C-O 3.56Å; Y306-G323 VanDerWaalsContact CA-O 3.26Å; Y306-G323 WeakPolarHBondContact CA-O 3.38Å; A307-G323 PolarHBondContact N-O 2.89Å; R321-G323 PolarHBondContact O-N 2.78Å; G323-H325 PolarHBondContact O-N 2.85Å
324	Q	94.9	Very high	92.6	Very high	99 Å²	99	51.9 Å²	51.9	46%	0.463	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	132.1	172.7	-81.5	-173	-17.1	0	0	110.6	G305 Y306 G320 R321 Q322	G305-Q324 WeakPolarHBondContact O-CA 3.43Å; Y306-Q324 HydrophobicContact CD1-CG 4.49Å; Y306-Q324 HydrophobicContact CE1-CG 4.27Å; G320-Q324 PolarHBondContact O-NE2 2.87Å; R321-Q324 WeakPolarHBondContact O-CB 3.5Å; R321-Q324 PolarHBondContact O-N 3.01Å; R321-Q324 VanDerWaalsContact O-N 3.17Å; Q322-Q324 PolarHBondContact O-N 3.38Å
325	H	96.3	Very high	92.3	Very high	23 Å²	23	53.6 Å²	53.6	11%	0.106	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	158.6	-178.8	-171.7	43.2	0	0	0	111	G305 A307 G323 D340 H342 W343 H378	G305-H325 PolarHBondContact N-O 3.12Å; G305-H325 PolarHBondContact O-N 2.84Å; A307-H325 HydrophobicContact CB-CB 3.55Å; G323-H325 PolarHBondContact O-N 2.85Å; H325-D340 IonicContact CD2-OD2 2.76Å; H325-D340 IonicContact CE1-OD2 2.76Å; H325-D340 IonicContact NE2-OD1 3.08Å; H325-D340 IonicContact NE2-OD2 3.27Å; H325-D340 PolarHBondContact NE2-OD2 3.48Å; H325-H342 AromaticContact CE1-ND1 3.49Å; H325-H342 PolarHBondContact CE1-ND1 3.04Å; H325-H342 AromaticContact ND1-ND1 3.96Å; H325-W343 AromaticContact CD2-NE1 3.97Å; H325-W343 AromaticContact CE1-CD1 3.88Å; H325-W343 AromaticContact CE1-NE1 3.75Å; H325-W343 AromaticContact NE2-CD1 3.66Å; H325-W343 AromaticContact NE2-NE1 3.49Å; H325-W343 PolarHBondContact NE2-NE1 2.88Å; H325-H378 AromaticContact CD2-CD2 3.69Å; H325-H378 AromaticContact CD2-NE2 3.57Å; H325-H378 AromaticContact NE2-NE2 3.7Å
326	S	97.3	Very high	92.4	Very high	17 Å²	17	53.2 Å²	53.2	12%	0.119	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140.4	176.9	58.7	0	0	0	0	111.3	T284 A286 L303	T284-S326 PolarHBondContact OG1-OG 3.18Å; A286-S326 WeakPolarHBondContact CB-O 3.34Å; L303-S326 WeakPolarHBondContact O-CA 3.36Å; L303-S326 WeakPolarHBondContact O-CB 3.39Å
327	W	98.3	Very high	92.4	Very high	4 Å²	4	53 Å²	53	2%	0.015	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	-170.1	179.1	68.4	98.8	0	0	0	109	L303 I339 D340 H378 P380	L303-W327 HydrophobicContact CB-CD2 4.04Å; L303-W327 HydrophobicContact CB-CG 4.28Å; L303-W327 HydrophobicContact CB-CZ2 4.22Å; L303-W327 HydrophobicContact CD1-CZ2 4.5Å; L303-W327 PolarHBondContact N-O 3.27Å; L303-W327 PolarHBondContact O-N 3.37Å; L303-W327 VanDerWaalsContact O-N 3.14Å; W327-I339 WeakPolarHBondContact CB-O 3.23Å; W327-D340 HydrophobicContact CB-CB 4.01Å; W327-H378 AromaticContact CD2-CD2 3.9Å; W327-H378 AromaticContact CE3-CD2 3.82Å; W327-H378 HydrophobicContact CH2-CB 4.17Å; W327-H378 HydrophobicContact CZ2-CB 4.06Å; W327-P380 HydrophobicContact CH2-CB 4.04Å; W327-P380 HydrophobicContact CZ2-CB 3.7Å; W327-P380 HydrophobicContact CZ2-CG 4.2Å
328	N	98.2	Very high	92.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.7	-174.4	-58.4	99.1	0	0	0	113.4	A286 F289 K301 I339	A286-N328 WeakPolarHBondContact CA-OD1 3.26Å; A286-N328 WeakPolarHBondContact CB-OD1 3.37Å; A286-N328 PolarHBondContact O-ND2 3.34Å; A286-N328 PolarHBondContact O-OD1 2.82Å; F289-N328 HydrophobicContact CD1-CB 3.77Å; F289-N328 WeakPolarHBondContact CD1-OD1 3.19Å; F289-N328 HydrophobicContact CE1-CB 4.08Å; K301-N328 WeakPolarHBondContact O-CA 3.25Å; K301-N328 PolarHBondContact O-ND2 2.85Å; N328-I339 PolarHBondContact N-O 2.7Å; N328-I339 PolarHBondContact O-N 2.87Å
329	A	96.5	Very high	92.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	137	156.1	0	0	0	0	0	108.6	C300 K301 L303 W336 R337 L338 W385	C300-A329 CarbonylContact C-O 3.49Å; C300-A329 WeakPolarHBondContact CA-O 3.44Å; K301-A329 HydrophobicContact CB-CB 4.34Å; K301-A329 PolarHBondContact N-O 2.94Å; K301-A329 PolarHBondContact O-N 2.74Å; L303-A329 HydrophobicContact CD1-CB 3.91Å; L303-A329 HydrophobicContact CG-CB 4.48Å; A329-W336 HydrophobicContact CB-CE3 3.82Å; A329-W336 HydrophobicContact CB-CZ3 4.37Å; A329-W336 WeakPolarHBondContact O-CZ3 3.25Å; A329-R337 CarbonylContact C-O 3.59Å; A329-R337 VanDerWaalsContact CA-O 3.23Å; A329-R337 WeakPolarHBondContact CA-O 3.27Å; A329-L338 HydrophobicContact CB-CD2 4.02Å; A329-W385 HydrophobicContact CB-CE3 3.81Å; A329-W385 HydrophobicContact CB-CZ3 3.69Å
330	V	95.2	Very high	93.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.2	177	67.2	0	0	0	0	109.9	V246 L298 H299 I332 W336 R337 I339 L368	V246-V330 HydrophobicContact CG1-CG1 4.11Å; V246-V330 HydrophobicContact CG2-CB 4.43Å; V246-V330 HydrophobicContact CG2-CG1 4.06Å; V246-V330 HydrophobicContact CG2-CG2 3.59Å; L298-V330 HydrophobicContact CB-CG2 4.45Å; H299-V330 WeakPolarHBondContact O-CA 3.43Å; H299-V330 WeakPolarHBondContact O-CG2 3.27Å; V330-I332 HydrophobicContact CG1-CD1 4.04Å; V330-I332 HydrophobicContact CG1-CG1 4.19Å; V330-W336 CarbonylContact O-C 3.56Å; V330-W336 WeakPolarHBondContact O-CA 3.42Å; V330-R337 HydrophobicContact CG1-CB 4.37Å; V330-R337 PolarHBondContact N-O 3.46Å; V330-R337 PolarHBondContact O-N 2.79Å; V330-I339 HydrophobicContact CG1-CD1 3.55Å; V330-I339 HydrophobicContact CG1-CG1 4.29Å; V330-L368 HydrophobicContact CG1-CD2 4.3Å
331	L	92.8	Very high	93.5	Very high	12 Å²	12	40.7 Å²	40.7	6%	0.063	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	122.3	177.5	-170.3	80	0	0	0	109.7	E183 H299 W336	E183-L331 HydrophobicContact CG-CD2 4.18Å; E183-L331 WeakPolarHBondContact OE2-CD2 3.35Å; H299-L331 HydrophobicContact CB-CB 3.84Å; H299-L331 HydrophobicContact CB-CD2 4.2Å; H299-L331 PolarHBondContact O-N 2.76Å; L331-W336 HydrophobicContact CB-CD2 4.29Å; L331-W336 HydrophobicContact CB-CE3 4.15Å; L331-W336 HydrophobicContact CB-CH2 4.28Å; L331-W336 HydrophobicContact CB-CZ2 4.42Å; L331-W336 HydrophobicContact CB-CZ3 4.14Å; L331-W336 HydrophobicContact CD1-CD2 3.99Å; L331-W336 HydrophobicContact CD1-CG 4.05Å; L331-W336 HydrophobicContact CD1-CZ2 4.41Å
332	I	90.9	Very high	93.7	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.015	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	127.3	174.6	-56.9	172.7	0	0	0	106.5	L243 V246 V330 K334 C335 L368	L243-I332 HydrophobicContact CB-CG2 3.98Å; L243-I332 HydrophobicContact CD1-CD1 4.01Å; V246-I332 HydrophobicContact CB-CD1 4.14Å; V246-I332 HydrophobicContact CG1-CD1 4.11Å; V246-I332 HydrophobicContact CG2-CD1 4.02Å; V246-I332 HydrophobicContact CG2-CG1 4.22Å; V330-I332 HydrophobicContact CG1-CD1 4.04Å; V330-I332 HydrophobicContact CG1-CG1 4.19Å; I332-K334 VanDerWaalsContact C-N 3.3Å; I332-K334 PolarHBondContact O-N 2.74Å; I332-C335 PolarHBondContact N-O 3.23Å; I332-C335 WeakPolarHBondContact O-CA 3.18Å; I332-C335 WeakPolarHBondContact O-CB 3.5Å; I332-C335 PolarHBondContact O-N 2.75Å; I332-L368 HydrophobicContact CD1-CD1 4.16Å; I332-L368 HydrophobicContact CD1-CD2 3.74Å
333	D	85.2	Confident	93.8	Very high	113 Å²	113	32.6 Å²	32.6	60%	0.604	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	48.5	-178.9	-58.1	-36	0	0	0	113.4	C335	D333-C335 PolarHBondContact O-N 3.19Å; D333-C335 PolarHBondContact O-SG 2.83Å; D333-C335 VanDerWaalsContact O-SG 3.38Å
334	K	84.2	Confident	93.8	Very high	155 Å²	155	32.3 Å²	32.3	67%	0.674	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	15.5	-177.1	-58.5	-53.7	-168.7	-174.5	0	115.1	E183 I332	E183-K334 IonicContact OE1-NZ 2.76Å; E183-K334 PolarHBondContact OE1-NZ 2.71Å; I332-K334 VanDerWaalsContact C-N 3.3Å; I332-K334 PolarHBondContact O-N 2.74Å
335	C	88.2	Confident	93.5	Very high	38 Å²	38	28.2 Å²	28.2	26%	0.257	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.2	177.8	-59.8	0	0	0	0	111.1	I332 D333 R337	I332-C335 PolarHBondContact N-O 3.23Å; I332-C335 WeakPolarHBondContact O-CA 3.18Å; I332-C335 WeakPolarHBondContact O-CB 3.5Å; I332-C335 PolarHBondContact O-N 2.75Å; D333-C335 PolarHBondContact O-N 3.19Å; D333-C335 PolarHBondContact O-SG 2.83Å; D333-C335 VanDerWaalsContact O-SG 3.38Å; C335-R337 VanDerWaalsContact CB-CZ 3.47Å
336	W	93	Very high	92.2	Very high	21 Å²	21	32.7 Å²	32.7	8%	0.08	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.4	172.3	-70.8	99	0	0	0	111	E183 H299 K301 A329 V330 L331 W385 L387	E183-W336 HydrophobicContact CB-CZ2 4.34Å; H299-W336 HydrophobicContact CB-CH2 4.2Å; K301-W336 HydrophobicContact CB-CH2 4.46Å; K301-W336 HydrophobicContact CB-CZ3 4.18Å; A329-W336 HydrophobicContact CB-CE3 3.82Å; A329-W336 HydrophobicContact CB-CZ3 4.37Å; A329-W336 WeakPolarHBondContact O-CZ3 3.25Å; V330-W336 CarbonylContact O-C 3.56Å; V330-W336 WeakPolarHBondContact O-CA 3.42Å; L331-W336 HydrophobicContact CB-CD2 4.29Å; L331-W336 HydrophobicContact CB-CE3 4.15Å; L331-W336 HydrophobicContact CB-CH2 4.28Å; L331-W336 HydrophobicContact CB-CZ2 4.42Å; L331-W336 HydrophobicContact CB-CZ3 4.14Å; L331-W336 HydrophobicContact CD1-CD2 3.99Å; L331-W336 HydrophobicContact CD1-CG 4.05Å; L331-W336 HydrophobicContact CD1-CZ2 4.41Å; W336-W385 HydrophobicContact CD2-CH2 4.08Å; W336-W385 AromaticContact CD2-CZ3 3.76Å; W336-W385 HydrophobicContact CD2-CZ3 3.76Å; W336-W385 AromaticContact CE2-CH2 3.94Å; W336-W385 HydrophobicContact CE3-CH2 4.25Å; W336-W385 AromaticContact CE3-CZ3 3.88Å; W336-W385 HydrophobicContact CE3-CZ3 3.88Å; W336-W385 HydrophobicContact CG-CZ3 4.14Å; W336-W385 HydrophobicContact CH2-CH2 4.18Å; W336-W385 AromaticContact CZ2-CH2 3.99Å; W336-W385 HydrophobicContact CZ2-CH2 3.99Å; W336-W385 HydrophobicContact CZ3-CH2 4.3Å; W336-W385 HydrophobicContact CZ3-CZ3 4.31Å; W336-L387 HydrophobicContact CB-CD1 3.83Å; W336-L387 HydrophobicContact CB-CD2 4.2Å
337	R	93.9	Very high	90.4	Very high	42 Å²	42	38.8 Å²	38.8	16%	0.158	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140.6	-179	-60.8	-72.2	-178.1	-103.7	-2.6	110.1	A329 V330 C335 L368	A329-R337 CarbonylContact C-O 3.59Å; A329-R337 VanDerWaalsContact CA-O 3.23Å; A329-R337 WeakPolarHBondContact CA-O 3.27Å; V330-R337 HydrophobicContact CG1-CB 4.37Å; V330-R337 PolarHBondContact N-O 3.46Å; V330-R337 PolarHBondContact O-N 2.79Å; C335-R337 VanDerWaalsContact CB-CZ 3.47Å; R337-L368 HydrophobicContact CB-CB 4.44Å; R337-L368 HydrophobicContact CB-CD2 3.63Å; R337-L368 HydrophobicContact CG-CD2 4.21Å
338	L	97	Very high	88.3	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	138.4	-175.3	-58.3	173.3	0	0	0	111.4	L303 A329 L368 A369 P371 L374 L387	L303-L338 HydrophobicContact CD1-CD2 3.96Å; A329-L338 HydrophobicContact CB-CD2 4.02Å; L338-L368 CarbonylContact O-C 3.56Å; L338-L368 WeakPolarHBondContact O-CA 3.38Å; L338-L368 PolarHBondContact O-N 3.21Å; L338-A369 PolarHBondContact O-N 3.24Å; L338-P371 HydrophobicContact CD1-CB 4.15Å; L338-P371 HydrophobicContact CD1-CG 4.12Å; L338-L374 HydrophobicContact CB-CD2 3.69Å; L338-L374 HydrophobicContact CD1-CB 4.36Å; L338-L374 HydrophobicContact CD1-CD2 3.72Å; L338-L374 HydrophobicContact CG-CD2 4.28Å; L338-L387 HydrophobicContact CD1-CD1 4.46Å; L338-L387 HydrophobicContact CD2-CD1 3.75Å; L338-L387 HydrophobicContact CD2-CG 4.42Å; L338-L387 HydrophobicContact CG-CD1 3.93Å
339	I	98.2	Very high	85.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	135.7	180	-64	179.2	0	0	0	109.5	V246 F250 F289 W327 N328 V330 Y366 L368	V246-I339 HydrophobicContact CG1-CD1 3.43Å; V246-I339 VanDerWaalsContact CG1-CD1 3.43Å; F250-I339 HydrophobicContact CD2-CG2 3.53Å; F250-I339 HydrophobicContact CE2-CG2 3.87Å; F289-I339 HydrophobicContact CE1-CD1 4.06Å; F289-I339 HydrophobicContact CE1-CG2 4.4Å; F289-I339 HydrophobicContact CE2-CD1 4.48Å; F289-I339 HydrophobicContact CE2-CG2 4.42Å; F289-I339 HydrophobicContact CZ-CD1 3.59Å; F289-I339 HydrophobicContact CZ-CG2 4.18Å; W327-I339 WeakPolarHBondContact CB-O 3.23Å; N328-I339 PolarHBondContact N-O 2.7Å; N328-I339 PolarHBondContact O-N 2.87Å; V330-I339 HydrophobicContact CG1-CD1 3.55Å; V330-I339 HydrophobicContact CG1-CG1 4.29Å; I339-Y366 WeakPolarHBondContact CA-O 3.38Å; I339-L368 HydrophobicContact CD1-CD2 3.74Å; I339-L368 HydrophobicContact CG1-CD2 3.89Å
340	D	97.3	Very high	83.2	Confident	2 Å²	2	48 Å²	48	1%	0.011	23%	0.226	C	C	.	.			trans	-128.2	99.8	167	-175.4	-7.1	0	0	0	111.4	H325 W327 H342 W343 A344 Y366 H378	H325-D340 IonicContact CD2-OD2 2.76Å; H325-D340 IonicContact CE1-OD2 2.76Å; H325-D340 IonicContact NE2-OD1 3.08Å; H325-D340 IonicContact NE2-OD2 3.27Å; H325-D340 PolarHBondContact NE2-OD2 3.48Å; W327-D340 HydrophobicContact CB-CB 4.01Å; D340-H342 VanDerWaalsContact C-N 3.32Å; D340-H342 PolarHBondContact O-N 2.77Å; D340-H342 WeakPolarHBondContact OD1-CA 3.39Å; D340-H342 VanDerWaalsContact OD1-CB 3.3Å; D340-H342 WeakPolarHBondContact OD1-CB 3.45Å; D340-H342 PolarHBondContact OD1-N 2.99Å; D340-W343 HydrophobicContact CB-CB 4.49Å; D340-W343 PolarHBondContact OD1-N 2.84Å; D340-W343 VanDerWaalsContact OD1-N 3.12Å; D340-W343 WeakPolarHBondContact OD2-CB 3.49Å; D340-W343 VanDerWaalsContact OD2-CG 3.23Å; D340-A344 VanDerWaalsContact O-CB 3.25Å; D340-A344 WeakPolarHBondContact O-CB 3.35Å; D340-A344 PolarHBondContact O-N 2.84Å; D340-A344 VanDerWaalsContact O-N 3.1Å; D340-Y366 HydrophobicContact CB-CD1 4.34Å; D340-Y366 PolarHBondContact N-O 2.77Å; D340-Y366 VanDerWaalsContact O-CB 3.3Å; D340-Y366 WeakPolarHBondContact O-CB 3.41Å; D340-H378 IonicContact OD2-CD2 2.78Å; D340-H378 IonicContact OD2-CE1 3.88Å; D340-H378 IonicContact OD2-NE2 3.72Å; D340-H378 PolarHBondContact OD2-NE2 3.36Å
341	C	96.2	Very high	80.8	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.007	27%	0.266	C	S	.	.	H	α-helix	trans	-69.7	-26.5	176.7	-64	0	0	0	0	113.4	F250 L253 Y285 F289 A345	F250-C341 WeakPolarHBondContact CD2-SG 3.31Å; L253-C341 HydrophobicContact CD2-CB 3.78Å; L253-C341 HydrophobicContact CG-CB 4.31Å; Y285-C341 HydrophobicContact CD1-CB 4.04Å; F289-C341 WeakPolarHBondContact CD2-SG 3.37Å; C341-A345 VanDerWaalsContact O-CB 3.23Å; C341-A345 WeakPolarHBondContact O-CB 3.48Å; C341-A345 PolarHBondContact O-N 3.34Å; C341-A345 VanDerWaalsContact O-N 3.09Å
342	H	93.1	Very high	78.4	Confident	94 Å²	94	66 Å²	66	44%	0.435	30%	0.298	S	S	.	.	H	α-helix	trans	-68.7	-50.1	179.1	-175.3	-165.3	0	0	0	110.1	Y285 H325 D340 A344 A345	Y285-H342 HydrophobicContact CD2-CB 4.12Å; Y285-H342 HydrophobicContact CG-CB 4.11Å; H325-H342 AromaticContact CE1-ND1 3.49Å; H325-H342 PolarHBondContact CE1-ND1 3.04Å; H325-H342 AromaticContact ND1-ND1 3.96Å; D340-H342 VanDerWaalsContact C-N 3.32Å; D340-H342 PolarHBondContact O-N 2.77Å; D340-H342 WeakPolarHBondContact OD1-CA 3.39Å; D340-H342 VanDerWaalsContact OD1-CB 3.3Å; D340-H342 WeakPolarHBondContact OD1-CB 3.45Å; D340-H342 PolarHBondContact OD1-N 2.99Å; H342-A344 VanDerWaalsContact C-N 3.34Å; H342-A345 PolarHBondContact O-N 3.06Å
343	W	92.2	Very high	76	Confident	50 Å²	50	71.5 Å²	71.5	19%	0.189	34%	0.335	C	S	.	.	H	α-helix	trans	-75.3	-24.7	-179.5	-74.7	29.2	0	0	0	112.7	A307 K308 H325 D340 Y366 T377 H378	A307-W343 HydrophobicContact CB-CH2 4.1Å; A307-W343 HydrophobicContact CB-CZ2 3.65Å; K308-W343 WeakPolarHBondContact O-CH2 3.44Å; H325-W343 AromaticContact CD2-NE1 3.97Å; H325-W343 AromaticContact CE1-CD1 3.88Å; H325-W343 AromaticContact CE1-NE1 3.75Å; H325-W343 AromaticContact NE2-CD1 3.66Å; H325-W343 AromaticContact NE2-NE1 3.49Å; H325-W343 PolarHBondContact NE2-NE1 2.88Å; D340-W343 HydrophobicContact CB-CB 4.49Å; D340-W343 PolarHBondContact OD1-N 2.84Å; D340-W343 VanDerWaalsContact OD1-N 3.12Å; D340-W343 WeakPolarHBondContact OD2-CB 3.49Å; D340-W343 VanDerWaalsContact OD2-CG 3.23Å; W343-Y366 VanDerWaalsContact C-CD2 3.47Å; W343-Y366 HydrophobicContact CB-CD1 4Å; W343-Y366 HydrophobicContact CB-CD2 3.82Å; W343-Y366 HydrophobicContact CB-CE1 3.95Å; W343-Y366 HydrophobicContact CB-CE2 3.74Å; W343-Y366 HydrophobicContact CB-CG 3.96Å; W343-Y366 HydrophobicContact CD2-CE1 4.3Å; W343-Y366 HydrophobicContact CE3-CD1 4.43Å; W343-Y366 AromaticContact CE3-CE1 3.48Å; W343-Y366 HydrophobicContact CE3-CE1 3.48Å; W343-Y366 VanDerWaalsContact CE3-CE1 3.48Å; W343-Y366 AromaticContact CE3-CZ 3.55Å; W343-Y366 HydrophobicContact CZ3-CE1 4.3Å; W343-Y366 WeakPolarHBondContact O-CD2 3.4Å; W343-Y366 WeakPolarHBondContact O-CE2 3.46Å; W343-T377 HydrophobicContact CZ3-CG2 4.1Å; W343-H378 AromaticContact CD2-CE1 3.81Å; W343-H378 AromaticContact CD2-NE2 3.97Å; W343-H378 AromaticContact CE3-CE1 3.42Å; W343-H378 VanDerWaalsContact CE3-CE1 3.42Å; W343-H378 AromaticContact CH2-CE1 3.89Å; W343-H378 AromaticContact CZ3-CE1 3.46Å; W343-H378 VanDerWaalsContact CZ3-CE1 3.46Å; W343-H378 WeakPolarHBondContact CZ3-CE1 3.23Å
344	A	91.7	Very high	74	Confident	0 Å²	0	68 Å²	68	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65	-42.7	169.2	0	0	0	0	0	112.9	F250 D340 H342 R346 L362 D363	F250-A344 HydrophobicContact CE1-CB 4.39Å; F250-A344 HydrophobicContact CE2-CB 3.64Å; F250-A344 HydrophobicContact CZ-CB 3.33Å; D340-A344 VanDerWaalsContact O-CB 3.25Å; D340-A344 WeakPolarHBondContact O-CB 3.35Å; D340-A344 PolarHBondContact O-N 2.84Å; D340-A344 VanDerWaalsContact O-N 3.1Å; H342-A344 VanDerWaalsContact C-N 3.34Å; A344-R346 PolarHBondContact O-N 2.9Å; A344-L362 HydrophobicContact CB-CD1 4.16Å; A344-D363 PolarHBondContact O-N 3.24Å
345	A	87.6	Confident	72.4	Confident	12 Å²	12	65.7 Å²	65.7	10%	0.099	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	83.5	-177.1	0	0	0	0	0	111.2	C254 Y285 C341 H342 R347	C254-A345 HydrophobicContact CB-CB 4.07Å; Y285-A345 HydrophobicContact CE1-CB 4Å; C341-A345 VanDerWaalsContact O-CB 3.23Å; C341-A345 WeakPolarHBondContact O-CB 3.48Å; C341-A345 PolarHBondContact O-N 3.34Å; C341-A345 VanDerWaalsContact O-N 3.09Å; H342-A345 PolarHBondContact O-N 3.06Å; A345-R347 PolarHBondContact O-N 2.86Å
346	R	69.2	Low	70.6	Confident	118 Å²	118	71 Å²	71	45%	0.445	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	119.6	177	-61.9	-171.9	175.7	-167.5	0.8	110.3	A344 L348 Y360 G361 D363 S405	A344-R346 PolarHBondContact O-N 2.9Å; R346-L348 PolarHBondContact O-N 2.59Å; R346-Y360 CarbonylContact O-C 3.52Å; R346-Y360 VanDerWaalsContact O-CA 3.24Å; R346-Y360 WeakPolarHBondContact O-CA 3.28Å; R346-G361 WeakPolarHBondContact CA-O 3.25Å; R346-G361 VanDerWaalsContact CB-O 3.31Å; R346-G361 WeakPolarHBondContact CB-O 3.12Å; R346-G361 PolarHBondContact N-O 2.79Å; R346-G361 PolarHBondContact O-N 2.9Å; R346-D363 HydrophobicContact CG-CB 4.48Å; R346-D363 IonicContact CZ-OD2 3.69Å; R346-D363 IonicContact NE-OD2 2.75Å; R346-D363 PolarHBondContact NE-OD2 2.78Å; R346-D363 IonicContact NH2-OD2 3.65Å; R346-D363 PolarHBondContact NH2-OD2 2.72Å; R346-S405 PolarHBondContact NH2-OG 2.93Å
347	R	60.1	Low	68.3	Low	145 Å²	145	72.8 Å²	72.8	55%	0.547	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	100.3	166.2	-167.5	179.8	179.9	-174.5	1.2	109.6	A345 V358	A345-R347 PolarHBondContact O-N 2.86Å; R347-V358 HydrophobicContact CG-CG1 3.5Å; R347-V358 VanDerWaalsContact CG-CG1 3.5Å
348	L	54.4	Low	65.9	Low	69 Å²	69	72.2 Å²	72.2	36%	0.361	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	118.3	170.1	-59.8	170.2	0	0	0	108.8	R346 V358 R359	R346-L348 PolarHBondContact O-N 2.59Å; L348-V358 CarbonylContact O-C 3.57Å; L348-V358 WeakPolarHBondContact O-CA 3.41Å; L348-R359 CarbonylContact C-O 3.36Å; L348-R359 VanDerWaalsContact CA-O 3.27Å; L348-R359 WeakPolarHBondContact CA-O 3.45Å; L348-R359 HydrophobicContact CB-CB 4.46Å; L348-R359 VanDerWaalsContact CB-O 3.26Å; L348-R359 WeakPolarHBondContact CB-O 3.32Å; L348-R359 PolarHBondContact N-O 2.93Å; L348-R359 PolarHBondContact O-N 3.38Å
349	I	46	Very low	63.6	Low	103 Å²	103	76.7 Å²	76.7	53%	0.528	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	119.5	170.6	-58.1	170.6	0	0	0	106.4	P353	I349-P353 HydrophobicContact CG2-CB 4.06Å
350	G	41.5	Very low	61.3	Low	24 Å²	24	78.4 Å²	78.4	25%	0.247	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-60.3	169.8	177.2	0	0	0	0	0	112.9	R352 N357	G350-R352 CarbonylContact O-C 3.5Å; G350-R352 PolarHBondContact O-N 3.26Å; G350-N357 PolarHBondContact N-O 2.71Å
351	K	43.2	Very low	59.8	Low	193 Å²	193	78.7 Å²	78.7	84%	0.839	39%	0.385	S	S	*	.	S	Bend	trans	-52.1	-21.8	-174.8	-66.7	-178	-178	176.2	0	115.3
352	R	43.7	Very low	59.2	Low	197 Å²	197	80.1 Å²	80.1	74%	0.743	39%	0.392	S	S	*	.	S	Bend	trans	-113.3	119.3	167.7	-65.3	179.4	-173.7	-179.3	1.8	108.2	G350 S354 N357	G350-R352 CarbonylContact O-C 3.5Å; G350-R352 PolarHBondContact O-N 3.26Å; R352-S354 VanDerWaalsContact C-N 3.29Å; R352-S354 PolarHBondContact O-N 2.91Å; R352-N357 VanDerWaalsContact O-CB 3.29Å; R352-N357 WeakPolarHBondContact O-CB 3.3Å; R352-N357 PolarHBondContact O-ND2 3.23Å
353	P	39.3	Very low	58.9	Low	120 Å²	120	76.5 Å²	76.5	78%	0.779	38%	0.376	S	S	*	.			trans	-66.6	93.1	171.1	20.5	-20.9	0	0	0	108.8	I349	I349-P353 HydrophobicContact CG2-CB 4.06Å
354	S	44.4	Very low	58.8	Low	39 Å²	39	75.4 Å²	75.4	27%	0.273	37%	0.373	S	S	.	.			trans	-124.4	152.4	163.9	67.5	0	0	0	0	108.3	R352 D356 N357	R352-S354 VanDerWaalsContact C-N 3.29Å; R352-S354 PolarHBondContact O-N 2.91Å; S354-D356 PolarHBondContact O-N 3.04Å; S354-D356 VanDerWaalsContact O-N 3.13Å; S354-N357 PolarHBondContact O-N 3.39Å; S354-N357 WeakPolarHBondContact OG-CB 3.46Å; S354-N357 PolarHBondContact OG-N 2.7Å; S354-N357 PolarHBondContact OG-ND2 2.92Å; S354-N357 VanDerWaalsContact OG-ND2 3.1Å
355	P	49.7	Very low	58.8	Low	107 Å²	107	76.9 Å²	76.9	70%	0.695	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-54.1	-29.8	174.2	-23.6	32.7	0	0	0	113.1	N357	P355-N357 VanDerWaalsContact C-N 3.35Å
356	D	50.7	Low	59.1	Low	149 Å²	149	76.9 Å²	76.9	80%	0.797	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-79.1	-13.1	179.1	-58	-38.1	0	0	0	113.9	S354	S354-D356 PolarHBondContact O-N 3.04Å; S354-D356 VanDerWaalsContact O-N 3.13Å
357	N	44.2	Very low	60.3	Low	59 Å²	59	71.4 Å²	71.4	32%	0.316	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-102.3	14.6	-178.6	-75.9	-18.4	0	0	0	113.6	G350 R352 S354 P355 R359	G350-N357 PolarHBondContact N-O 2.71Å; R352-N357 VanDerWaalsContact O-CB 3.29Å; R352-N357 WeakPolarHBondContact O-CB 3.3Å; R352-N357 PolarHBondContact O-ND2 3.23Å; S354-N357 PolarHBondContact O-N 3.39Å; S354-N357 WeakPolarHBondContact OG-CB 3.46Å; S354-N357 PolarHBondContact OG-N 2.7Å; S354-N357 PolarHBondContact OG-ND2 2.92Å; S354-N357 VanDerWaalsContact OG-ND2 3.1Å; P355-N357 VanDerWaalsContact C-N 3.35Å; N357-R359 PolarHBondContact O-N 2.81Å
358	V	43.5	Very low	62	Low	29 Å²	29	65 Å²	65	18%	0.176	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	110.7	173	-178.5	0	0	0	0	108.6	R347 L348 Y360	R347-V358 HydrophobicContact CG-CG1 3.5Å; R347-V358 VanDerWaalsContact CG-CG1 3.5Å; L348-V358 CarbonylContact O-C 3.57Å; L348-V358 WeakPolarHBondContact O-CA 3.41Å; V358-Y360 HydrophobicContact CG1-CE2 4.42Å
359	R	48.8	Very low	63.9	Low	99 Å²	99	62 Å²	62	37%	0.374	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	148	170.3	-65.3	-168.4	-179.1	156.6	5.6	109.6	L348 N357 P519 D521	L348-R359 CarbonylContact C-O 3.36Å; L348-R359 VanDerWaalsContact CA-O 3.27Å; L348-R359 WeakPolarHBondContact CA-O 3.45Å; L348-R359 HydrophobicContact CB-CB 4.46Å; L348-R359 VanDerWaalsContact CB-O 3.26Å; L348-R359 WeakPolarHBondContact CB-O 3.32Å; L348-R359 PolarHBondContact N-O 2.93Å; L348-R359 PolarHBondContact O-N 3.38Å; N357-R359 PolarHBondContact O-N 2.81Å; R359-P519 VanDerWaalsContact CD-O 3.23Å; R359-P519 WeakPolarHBondContact CD-O 3.49Å; R359-P519 PolarHBondContact NH1-O 3.5Å; R359-D521 IonicContact CZ-OD1 2.73Å; R359-D521 IonicContact NH1-OD1 3.45Å; R359-D521 PolarHBondContact NH1-OD1 2.6Å; R359-D521 IonicContact NH2-OD1 3.33Å
360	Y	50.9	Low	66.1	Low	36 Å²	36	58 Å²	58	14%	0.141	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116.3	177	-66.2	-89.5	0	0	0	108.6	D257 R346 V358 I518	D257-Y360 HydrophobicContact CB-CE2 4.21Å; D257-Y360 VanDerWaalsContact CG-OH 3.3Å; D257-Y360 PolarHBondContact OD1-OH 2.87Å; R346-Y360 CarbonylContact O-C 3.52Å; R346-Y360 VanDerWaalsContact O-CA 3.24Å; R346-Y360 WeakPolarHBondContact O-CA 3.28Å; V358-Y360 HydrophobicContact CG1-CE2 4.42Å; Y360-I518 WeakPolarHBondContact O-CG2 3.22Å
361	G	65.7	Low	68.6	Low	9 Å²	9	57.1 Å²	57.1	9%	0.093	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	149.2	164.9	0	0	0	0	0	109.4	R346	R346-G361 WeakPolarHBondContact CA-O 3.25Å; R346-G361 VanDerWaalsContact CB-O 3.31Å; R346-G361 WeakPolarHBondContact CB-O 3.12Å; R346-G361 PolarHBondContact N-O 2.79Å; R346-G361 PolarHBondContact O-N 2.9Å
362	L	82.8	Confident	71	Confident	30 Å²	30	48.8 Å²	48.8	16%	0.157	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.9	-179.3	-176.1	57.2	0	0	0	110.7	F250 L251 C254 A344 M364 I518	F250-L362 HydrophobicContact CE1-CD1 4.12Å; F250-L362 HydrophobicContact CZ-CD1 4.4Å; L251-L362 HydrophobicContact CD1-CD2 3.12Å; C254-L362 HydrophobicContact CB-CD1 3.54Å; A344-L362 HydrophobicContact CB-CD1 4.16Å; L362-M364 HydrophobicContact CD2-CE 3.19Å; L362-M364 HydrophobicContact CD2-SD 3.96Å; L362-M364 HydrophobicContact CG-CE 3.84Å; L362-M364 HydrophobicContact CG-SD 4.07Å; L362-I518 HydrophobicContact CB-CD1 4.42Å
363	D	87.7	Confident	73.4	Confident	19 Å²	19	41.8 Å²	41.8	10%	0.102	23%	0.231	C	C	.	.			trans	-102	96.8	176.5	-165.2	-13.9	0	0	0	111	A344 R346 F365 Y366 S405	A344-D363 PolarHBondContact O-N 3.24Å; R346-D363 HydrophobicContact CG-CB 4.48Å; R346-D363 IonicContact CZ-OD2 3.69Å; R346-D363 IonicContact NE-OD2 2.75Å; R346-D363 PolarHBondContact NE-OD2 2.78Å; R346-D363 IonicContact NH2-OD2 3.65Å; R346-D363 PolarHBondContact NH2-OD2 2.72Å; D363-F365 PolarHBondContact O-N 2.92Å; D363-F365 VanDerWaalsContact O-N 3.15Å; D363-F365 VanDerWaalsContact OD1-CB 3.28Å; D363-F365 WeakPolarHBondContact OD1-CB 3.44Å; D363-F365 PolarHBondContact OD1-N 3.49Å; D363-Y366 HydrophobicContact CB-CD2 3.94Å; D363-Y366 HydrophobicContact CB-CE2 4.03Å; D363-Y366 PolarHBondContact O-N 2.85Å; D363-Y366 WeakPolarHBondContact OD2-CE2 3.16Å; D363-S405 VanDerWaalsContact OD2-CB 3.23Å; D363-S405 WeakPolarHBondContact OD2-CB 3.28Å; D363-S405 PolarHBondContact OD2-OG 2.76Å
364	M	89.7	Confident	76	Confident	26 Å²	26	36.2 Å²	36.2	13%	0.128	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-67.3	-10.1	-177.5	-68.1	-62.9	-174	0	0	114.2	F205 R247 F250 L251 L362 Y366 F367 V515	F205-M364 HydrophobicContact CD2-CB 4.42Å; F205-M364 HydrophobicContact CD2-CG 4.36Å; F205-M364 HydrophobicContact CE1-CB 4.45Å; F205-M364 HydrophobicContact CE1-SD 4.34Å; F205-M364 HydrophobicContact CE2-CB 3.57Å; F205-M364 HydrophobicContact CE2-CG 3.97Å; F205-M364 HydrophobicContact CZ-CB 3.6Å; F205-M364 HydrophobicContact CZ-CG 4.08Å; F205-M364 HydrophobicContact CZ-SD 4.38Å; R247-M364 PolarHBondContact NH1-SD 2.89Å; R247-M364 VanDerWaalsContact NH2-CE 3.3Å; F250-M364 HydrophobicContact CE1-SD 4.11Å; L251-M364 HydrophobicContact CD1-CE 4.39Å; L362-M364 HydrophobicContact CD2-CE 3.19Å; L362-M364 HydrophobicContact CD2-SD 3.96Å; L362-M364 HydrophobicContact CG-CE 3.84Å; L362-M364 HydrophobicContact CG-SD 4.07Å; M364-Y366 PolarHBondContact O-N 2.74Å; M364-F367 PolarHBondContact O-N 2.84Å; M364-F367 VanDerWaalsContact O-N 3.12Å; M364-V515 HydrophobicContact CE-CG2 3.83Å
365	F	91	Very high	78.5	Confident	31 Å²	31	34.9 Å²	34.9	14%	0.136	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-57	-34	173.5	170.7	-97.6	0	0	0	112.1	D363 F367 A369 Q373 L374 F408	D363-F365 PolarHBondContact O-N 2.92Å; D363-F365 VanDerWaalsContact O-N 3.15Å; D363-F365 VanDerWaalsContact OD1-CB 3.28Å; D363-F365 WeakPolarHBondContact OD1-CB 3.44Å; D363-F365 PolarHBondContact OD1-N 3.49Å; F365-F367 VanDerWaalsContact C-N 3.28Å; F365-F367 PolarHBondContact O-N 2.83Å; F365-A369 WeakPolarHBondContact O-CB 3.45Å; F365-Q373 HydrophobicContact CE2-CB 4.09Å; F365-Q373 HydrophobicContact CZ-CB 4.05Å; F365-L374 HydrophobicContact CE1-CD1 4.25Å; F365-F408 HydrophobicContact CD2-CB 3.98Å; F365-F408 HydrophobicContact CD2-CD2 4.3Å; F365-F408 HydrophobicContact CE1-CD2 4.34Å; F365-F408 HydrophobicContact CE2-CB 3.53Å; F365-F408 AromaticContact CE2-CD2 3.32Å; F365-F408 HydrophobicContact CE2-CD2 3.32Å; F365-F408 HydrophobicContact CE2-CE2 4.22Å; F365-F408 AromaticContact CE2-CG 3.68Å; F365-F408 HydrophobicContact CE2-CG 3.68Å; F365-F408 HydrophobicContact CZ-CB 4.43Å; F365-F408 AromaticContact CZ-CD2 3.34Å; F365-F408 HydrophobicContact CZ-CD2 3.34Å; F365-F408 AromaticContact CZ-CE2 3.83Å; F365-F408 HydrophobicContact CZ-CE2 3.83Å; F365-F408 HydrophobicContact CZ-CG 4.15Å
366	Y	94.8	Very high	80.7	Confident	13 Å²	13	30.7 Å²	30.7	5%	0.051	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-85.5	4	-178.4	-56	-72.9	0	0	0	113.9	I339 D340 W343 D363 M364 L374	I339-Y366 WeakPolarHBondContact CA-O 3.38Å; D340-Y366 HydrophobicContact CB-CD1 4.34Å; D340-Y366 PolarHBondContact N-O 2.77Å; D340-Y366 VanDerWaalsContact O-CB 3.3Å; D340-Y366 WeakPolarHBondContact O-CB 3.41Å; W343-Y366 VanDerWaalsContact C-CD2 3.47Å; W343-Y366 HydrophobicContact CB-CD1 4Å; W343-Y366 HydrophobicContact CB-CD2 3.82Å; W343-Y366 HydrophobicContact CB-CE1 3.95Å; W343-Y366 HydrophobicContact CB-CE2 3.74Å; W343-Y366 HydrophobicContact CB-CG 3.96Å; W343-Y366 HydrophobicContact CD2-CE1 4.3Å; W343-Y366 HydrophobicContact CE3-CD1 4.43Å; W343-Y366 AromaticContact CE3-CE1 3.48Å; W343-Y366 HydrophobicContact CE3-CE1 3.48Å; W343-Y366 VanDerWaalsContact CE3-CE1 3.48Å; W343-Y366 AromaticContact CE3-CZ 3.55Å; W343-Y366 HydrophobicContact CZ3-CE1 4.3Å; W343-Y366 WeakPolarHBondContact O-CD2 3.4Å; W343-Y366 WeakPolarHBondContact O-CE2 3.46Å; D363-Y366 HydrophobicContact CB-CD2 3.94Å; D363-Y366 HydrophobicContact CB-CE2 4.03Å; D363-Y366 PolarHBondContact O-N 2.85Å; D363-Y366 WeakPolarHBondContact OD2-CE2 3.16Å; M364-Y366 PolarHBondContact O-N 2.74Å; Y366-L374 HydrophobicContact CD1-CD1 4.04Å; Y366-L374 HydrophobicContact CE1-CD1 4.3Å
367	F	95.4	Very high	82.8	Confident	3 Å²	3	23.9 Å²	23.9	1%	0.013	12%	0.119	C	C	.	.	S	Bend	trans	-93.1	114.8	169.6	-179	-107.5	0	0	0	109.7	Y202 F205 L243 V246 R247 F250 M364 F365 A369	Y202-F367 HydrophobicContact CE1-CD1 4.28Å; Y202-F367 AromaticContact CE1-CE1 3.8Å; Y202-F367 HydrophobicContact CE1-CE1 3.8Å; Y202-F367 WeakPolarHBondContact OH-CD1 3.48Å; F205-F367 AromaticContact CE1-CD1 3.79Å; F205-F367 HydrophobicContact CE1-CD1 3.79Å; F205-F367 HydrophobicContact CE1-CE1 4.29Å; F205-F367 HydrophobicContact CZ-CD1 4.43Å; L243-F367 HydrophobicContact CD1-CZ 4.41Å; V246-F367 HydrophobicContact CG1-CE2 3.84Å; V246-F367 HydrophobicContact CG1-CZ 4.34Å; R247-F367 HydrophobicContact CB-CE2 4.39Å; R247-F367 HydrophobicContact CB-CZ 3.94Å; R247-F367 HydrophobicContact CG-CZ 4.4Å; F250-F367 HydrophobicContact CB-CD2 3.9Å; F250-F367 HydrophobicContact CB-CE2 3.96Å; F250-F367 HydrophobicContact CD1-CB 4.26Å; F250-F367 AromaticContact CD1-CD2 3.54Å; F250-F367 HydrophobicContact CD1-CD2 3.54Å; F250-F367 HydrophobicContact CD1-CE2 4.22Å; F250-F367 HydrophobicContact CD1-CG 4.17Å; F250-F367 AromaticContact CD2-CD2 3.82Å; F250-F367 HydrophobicContact CD2-CD2 3.82Å; F250-F367 HydrophobicContact CE1-CB 3.76Å; F250-F367 AromaticContact CE1-CD2 3.95Å; F250-F367 HydrophobicContact CE1-CD2 3.95Å; F250-F367 HydrophobicContact CE1-CG 4.15Å; F250-F367 HydrophobicContact CE2-CB 4.08Å; F250-F367 HydrophobicContact CE2-CD2 4.2Å; F250-F367 AromaticContact CG-CD2 3.47Å; F250-F367 HydrophobicContact CG-CD2 3.47Å; F250-F367 VanDerWaalsContact CG-CD2 3.47Å; F250-F367 HydrophobicContact CG-CE2 4.05Å; F250-F367 HydrophobicContact CG-CG 4.44Å; F250-F367 HydrophobicContact CZ-CB 3.64Å; F250-F367 HydrophobicContact CZ-CD2 4.25Å; F250-F367 HydrophobicContact CZ-CG 4.39Å; M364-F367 PolarHBondContact O-N 2.84Å; M364-F367 VanDerWaalsContact O-N 3.12Å; F365-F367 VanDerWaalsContact C-N 3.28Å; F365-F367 PolarHBondContact O-N 2.83Å; F367-A369 VanDerWaalsContact C-N 3.26Å; F367-A369 PolarHBondContact O-N 2.73Å
368	L	94.9	Very high	85.3	Confident	11 Å²	11	21.2 Å²	21.2	6%	0.058	10%	0.104	C	C	.	.	S	Bend	trans	52.5	45.2	-175.8	-48	-174.8	0	0	0	112.2	P201 Y202 L243 V246 V330 I332 R337 L338 I339 S370	P201-L368 HydrophobicContact CG-CD1 4.01Å; Y202-L368 HydrophobicContact CE1-CD1 3.86Å; L243-L368 HydrophobicContact CD1-CD1 3.59Å; V246-L368 HydrophobicContact CG1-CD2 4.25Å; V330-L368 HydrophobicContact CG1-CD2 4.3Å; I332-L368 HydrophobicContact CD1-CD1 4.16Å; I332-L368 HydrophobicContact CD1-CD2 3.74Å; R337-L368 HydrophobicContact CB-CB 4.44Å; R337-L368 HydrophobicContact CB-CD2 3.63Å; R337-L368 HydrophobicContact CG-CD2 4.21Å; L338-L368 CarbonylContact O-C 3.56Å; L338-L368 WeakPolarHBondContact O-CA 3.38Å; L338-L368 PolarHBondContact O-N 3.21Å; I339-L368 HydrophobicContact CD1-CD2 3.74Å; I339-L368 HydrophobicContact CG1-CD2 3.89Å; L368-S370 PolarHBondContact O-N 3.18Å
369	A	93.3	Very high	87.9	Confident	5 Å²	5	20.6 Å²	20.6	4%	0.041	10%	0.1	C	C	.	.	B	Isolated β-bridge	trans	-58.7	136.8	-176.8	0	0	0	0	0	111.1	L338 F365 F367 L374	L338-A369 PolarHBondContact O-N 3.24Å; F365-A369 WeakPolarHBondContact O-CB 3.45Å; F367-A369 VanDerWaalsContact C-N 3.26Å; F367-A369 PolarHBondContact O-N 2.73Å; A369-L374 HydrophobicContact CB-CB 4.17Å; A369-L374 HydrophobicContact CB-CD1 3.89Å; A369-L374 HydrophobicContact CB-CD2 4.27Å; A369-L374 HydrophobicContact CB-CG 4.33Å
370	S	92.9	Very high	90.2	Very high	18 Å²	18	16.1 Å²	16.1	13%	0.126	8%	0.083	C	C	.	.			trans	-60.5	128.6	175.4	173.5	0	0	0	0	110.2	L368 S372 Q373 L374	L368-S370 PolarHBondContact O-N 3.18Å; S370-S372 VanDerWaalsContact C-N 3.26Å; S370-S372 PolarHBondContact O-N 3.32Å; S370-S372 PolarHBondContact OG-OG 2.7Å; S370-S372 VanDerWaalsContact OG-OG 3.13Å; S370-Q373 PolarHBondContact O-N 2.82Å; S370-L374 PolarHBondContact O-N 3.19Å
371	P	94.9	Very high	92.4	Very high	7 Å²	7	18.7 Å²	18.7	5%	0.045	10%	0.096	C	C	.	.	H	α-helix	trans	-52	-42.5	177.7	-30.9	37.4	0	0	0	113.9	M197 L338 Q373 L374 I375 Q386 L387 L388	M197-P371 HydrophobicContact CE-CG 4.3Å; M197-P371 HydrophobicContact SD-CG 4.01Å; L338-P371 HydrophobicContact CD1-CB 4.15Å; L338-P371 HydrophobicContact CD1-CG 4.12Å; P371-Q373 PolarHBondContact O-N 3.43Å; P371-L374 PolarHBondContact O-N 3.19Å; P371-I375 WeakPolarHBondContact O-CB 3.16Å; P371-I375 PolarHBondContact O-N 2.95Å; P371-I375 VanDerWaalsContact O-N 3.08Å; P371-Q386 WeakPolarHBondContact CB-O 3.41Å; P371-L387 HydrophobicContact CB-CB 3.98Å; P371-L387 WeakPolarHBondContact CB-O 3.38Å; P371-L387 HydrophobicContact CG-CB 3.81Å; P371-L387 HydrophobicContact CG-CD1 4.48Å; P371-L388 HydrophobicContact CB-CD2 3.97Å
372	S	92	Very high	93.7	Very high	18 Å²	18	20.8 Å²	20.8	13%	0.126	11%	0.105	C	C	.	.	H	α-helix	trans	-71.2	-17.1	-179	62.7	0	0	0	0	113.9	S370 I375	S370-S372 VanDerWaalsContact C-N 3.26Å; S370-S372 PolarHBondContact O-N 3.32Å; S370-S372 PolarHBondContact OG-OG 2.7Å; S370-S372 VanDerWaalsContact OG-OG 3.13Å; S372-I375 WeakPolarHBondContact O-CG2 3.42Å
373	Q	93.9	Very high	94.3	Very high	49 Å²	49	22.3 Å²	22.3	23%	0.229	12%	0.117	C	C	.	.	H	α-helix	trans	-94.2	-45.3	173.7	-62.2	-179.1	-16.2	0	0	110.9	F365 S370 P371 I375 Y376 F408	F365-Q373 HydrophobicContact CE2-CB 4.09Å; F365-Q373 HydrophobicContact CZ-CB 4.05Å; S370-Q373 PolarHBondContact O-N 2.82Å; P371-Q373 PolarHBondContact O-N 3.43Å; Q373-I375 VanDerWaalsContact C-N 3.28Å; Q373-I375 PolarHBondContact O-N 3.39Å; Q373-Y376 PolarHBondContact O-N 3.4Å; Q373-F408 HydrophobicContact CB-CD1 3.86Å; Q373-F408 HydrophobicContact CB-CD2 4.04Å; Q373-F408 HydrophobicContact CB-CE1 3.76Å; Q373-F408 HydrophobicContact CB-CE2 3.9Å; Q373-F408 HydrophobicContact CB-CG 4Å; Q373-F408 HydrophobicContact CB-CZ 3.76Å; Q373-F408 HydrophobicContact CG-CD1 3.56Å; Q373-F408 HydrophobicContact CG-CE1 3.69Å; Q373-F408 HydrophobicContact CG-CG 4.03Å; Q373-F408 HydrophobicContact CG-CZ 4.24Å; Q373-F408 WeakPolarHBondContact O-CE2 3.26Å; Q373-F408 WeakPolarHBondContact O-CZ 3.46Å
374	L	95.9	Very high	94.5	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-64.1	-33.5	-177.4	-162.6	71.1	0	0	0	111.9	L338 F365 Y366 A369 S370 P371 Y376 T377 H378	L338-L374 HydrophobicContact CB-CD2 3.69Å; L338-L374 HydrophobicContact CD1-CB 4.36Å; L338-L374 HydrophobicContact CD1-CD2 3.72Å; L338-L374 HydrophobicContact CG-CD2 4.28Å; F365-L374 HydrophobicContact CE1-CD1 4.25Å; Y366-L374 HydrophobicContact CD1-CD1 4.04Å; Y366-L374 HydrophobicContact CE1-CD1 4.3Å; A369-L374 HydrophobicContact CB-CB 4.17Å; A369-L374 HydrophobicContact CB-CD1 3.89Å; A369-L374 HydrophobicContact CB-CD2 4.27Å; A369-L374 HydrophobicContact CB-CG 4.33Å; S370-L374 PolarHBondContact O-N 3.19Å; P371-L374 PolarHBondContact O-N 3.19Å; L374-Y376 PolarHBondContact O-N 3.42Å; L374-T377 PolarHBondContact O-N 3.1Å; L374-T377 PolarHBondContact O-OG1 2.82Å; L374-T377 VanDerWaalsContact O-OG1 3.07Å; L374-H378 WeakPolarHBondContact CD1-ND1 3.49Å; L374-H378 HydrophobicContact CD2-CB 4.29Å; L374-H378 HydrophobicContact CG-CB 3.98Å; L374-H378 PolarHBondContact O-N 2.69Å
375	I	95.8	Very high	94.8	Very high	11 Å²	11	24.6 Å²	24.6	6%	0.056	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.8	178.1	-166	57.6	0	0	0	113.8	P371 S372 Q373 T377 H378 F379 Q386 L388 V392 F397	P371-I375 WeakPolarHBondContact O-CB 3.16Å; P371-I375 PolarHBondContact O-N 2.95Å; P371-I375 VanDerWaalsContact O-N 3.08Å; S372-I375 WeakPolarHBondContact O-CG2 3.42Å; Q373-I375 VanDerWaalsContact C-N 3.28Å; Q373-I375 PolarHBondContact O-N 3.39Å; I375-T377 PolarHBondContact O-N 3.25Å; I375-H378 WeakPolarHBondContact CD1-O 3.43Å; I375-F379 HydrophobicContact CD1-CD2 4.42Å; I375-Q386 HydrophobicContact CD1-CB 4.38Å; I375-Q386 HydrophobicContact CD1-CG 3.86Å; I375-L388 HydrophobicContact CB-CD1 4.16Å; I375-L388 HydrophobicContact CG1-CD1 3.92Å; I375-L388 HydrophobicContact CG2-CD1 4.18Å; I375-V392 HydrophobicContact CG1-CB 4.18Å; I375-V392 HydrophobicContact CG1-CG2 4.04Å; I375-F397 WeakPolarHBondContact O-CD2 3.5Å; I375-F397 VanDerWaalsContact O-CE2 3.24Å; I375-F397 WeakPolarHBondContact O-CE2 3.36Å
376	Y	95.5	Very high	95	Very high	19 Å²	19	23.2 Å²	23.2	8%	0.075	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.2	174.2	-83.4	-97.8	0	0	0	113.1	K308 Q373 L374 L400 V403 F408 L414 R418	K308-Y376 WeakPolarHBondContact CD-O 3.46Å; K308-Y376 PolarHBondContact NZ-O 3.3Å; K308-Y376 VanDerWaalsContact NZ-O 3.13Å; Q373-Y376 PolarHBondContact O-N 3.4Å; L374-Y376 PolarHBondContact O-N 3.42Å; Y376-L400 HydrophobicContact CD1-CB 4.22Å; Y376-L400 HydrophobicContact CD1-CD1 4.17Å; Y376-L400 HydrophobicContact CE1-CB 4.44Å; Y376-L400 HydrophobicContact CE1-CD1 4.3Å; Y376-L400 HydrophobicContact CE1-CD2 4.11Å; Y376-L400 HydrophobicContact CG-CD1 4.43Å; Y376-V403 HydrophobicContact CD1-CG1 4.24Å; Y376-V403 HydrophobicContact CD1-CG2 4.12Å; Y376-V403 HydrophobicContact CG-CG2 3.96Å; Y376-F408 HydrophobicContact CD2-CE1 4.42Å; Y376-F408 AromaticContact CD2-CZ 3.76Å; Y376-F408 HydrophobicContact CD2-CZ 3.76Å; Y376-F408 HydrophobicContact CE2-CZ 4.33Å; Y376-F408 HydrophobicContact CG-CZ 4.08Å; Y376-L414 HydrophobicContact CE1-CD1 4.42Å; Y376-R418 PolarHBondContact OH-NE 3.16Å; Y376-R418 PolarHBondContact OH-NH2 2.8Å
377	T	95.7	Very high	94.9	Very high	6 Å²	6	22.9 Å²	22.9	4%	0.037	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-25.7	-173.3	53.8	0	0	0	0	113.6	A307 K308 W343 L374 I375 V403	A307-T377 CarbonylContact C-O 3.49Å; A307-T377 WeakPolarHBondContact CA-O 3.5Å; K308-T377 PolarHBondContact N-O 3.25Å; W343-T377 HydrophobicContact CZ3-CG2 4.1Å; L374-T377 PolarHBondContact O-N 3.1Å; L374-T377 PolarHBondContact O-OG1 2.82Å; L374-T377 VanDerWaalsContact O-OG1 3.07Å; I375-T377 PolarHBondContact O-N 3.25Å; T377-V403 VanDerWaalsContact CG2-O 3.28Å; T377-V403 WeakPolarHBondContact CG2-O 3.4Å
378	H	97.3	Very high	94.8	Very high	3 Å²	3	23.7 Å²	23.7	1%	0.014	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.6	-176.9	-63.9	68.1	0	0	0	111.2	H325 W327 D340 W343 L374 I375	H325-H378 AromaticContact CD2-CD2 3.69Å; H325-H378 AromaticContact CD2-NE2 3.57Å; H325-H378 AromaticContact NE2-NE2 3.7Å; W327-H378 AromaticContact CD2-CD2 3.9Å; W327-H378 AromaticContact CE3-CD2 3.82Å; W327-H378 HydrophobicContact CH2-CB 4.17Å; W327-H378 HydrophobicContact CZ2-CB 4.06Å; D340-H378 IonicContact OD2-CD2 2.78Å; D340-H378 IonicContact OD2-CE1 3.88Å; D340-H378 IonicContact OD2-NE2 3.72Å; D340-H378 PolarHBondContact OD2-NE2 3.36Å; W343-H378 AromaticContact CD2-CE1 3.81Å; W343-H378 AromaticContact CD2-NE2 3.97Å; W343-H378 AromaticContact CE3-CE1 3.42Å; W343-H378 VanDerWaalsContact CE3-CE1 3.42Å; W343-H378 AromaticContact CH2-CE1 3.89Å; W343-H378 AromaticContact CZ3-CE1 3.46Å; W343-H378 VanDerWaalsContact CZ3-CE1 3.46Å; W343-H378 WeakPolarHBondContact CZ3-CE1 3.23Å; L374-H378 WeakPolarHBondContact CD1-ND1 3.49Å; L374-H378 HydrophobicContact CD2-CB 4.29Å; L374-H378 HydrophobicContact CG-CB 3.98Å; L374-H378 PolarHBondContact O-N 2.69Å; I375-H378 WeakPolarHBondContact CD1-O 3.43Å
379	F	97.7	Very high	94.5	Very high	17 Å²	17	26.9 Å²	26.9	8%	0.075	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	102.5	178.5	-177.7	-91.5	0	0	0	110.4	G305 Y306 I375 V392 L394 F397	G305-F379 CarbonylContact C-O 3.5Å; G305-F379 WeakPolarHBondContact CA-O 3.39Å; Y306-F379 HydrophobicContact CD2-CD1 4.25Å; Y306-F379 PolarHBondContact N-O 2.85Å; Y306-F379 PolarHBondContact O-N 2.83Å; I375-F379 HydrophobicContact CD1-CD2 4.42Å; F379-V392 WeakPolarHBondContact CE2-O 3.28Å; F379-L394 HydrophobicContact CD1-CD1 3.79Å; F379-L394 HydrophobicContact CE1-CB 3.97Å; F379-L394 HydrophobicContact CE1-CD1 3.84Å; F379-L394 HydrophobicContact CE1-CG 4.42Å; F379-L394 HydrophobicContact CE2-CB 4.28Å; F379-L394 HydrophobicContact CG-CD1 4.21Å; F379-L394 HydrophobicContact CZ-CB 3.73Å; F379-L394 HydrophobicContact CZ-CD1 4.3Å; F379-F397 HydrophobicContact CB-CD1 3.55Å; F379-F397 HydrophobicContact CB-CD2 3.89Å; F379-F397 HydrophobicContact CB-CE1 3.49Å; F379-F397 VanDerWaalsContact CB-CE1 3.49Å; F379-F397 HydrophobicContact CB-CE2 3.87Å; F379-F397 HydrophobicContact CB-CG 3.72Å; F379-F397 HydrophobicContact CB-CZ 3.66Å; F379-F397 HydrophobicContact CD2-CB 3.66Å; F379-F397 HydrophobicContact CD2-CD1 4.15Å; F379-F397 HydrophobicContact CD2-CD2 4.33Å; F379-F397 AromaticContact CD2-CG 3.8Å; F379-F397 HydrophobicContact CD2-CG 3.8Å; F379-F397 HydrophobicContact CE2-CB 4.26Å; F379-F397 HydrophobicContact CG-CB 4.32Å; F379-F397 AromaticContact CG-CD1 3.94Å; F379-F397 HydrophobicContact CG-CD1 3.94Å; F379-F397 HydrophobicContact CG-CE1 4.33Å; F379-F397 HydrophobicContact CG-CG 4.02Å
380	P	97.4	Very high	94.4	Very high	4 Å²	4	31.2 Å²	31.2	3%	0.026	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	144.1	177.6	26.2	-30.4	0	0	0	111	W327 D382 W385 Q386	W327-P380 HydrophobicContact CH2-CB 4.04Å; W327-P380 HydrophobicContact CZ2-CB 3.7Å; W327-P380 HydrophobicContact CZ2-CG 4.2Å; P380-D382 PolarHBondContact O-N 2.97Å; P380-W385 HydrophobicContact CB-CB 4.07Å; P380-W385 HydrophobicContact CG-CB 4.22Å; P380-Q386 HydrophobicContact CG-CB 4.41Å; P380-Q386 HydrophobicContact CG-CG 3.57Å
381	H	95.7	Very high	94.4	Very high	90 Å²	90	33 Å²	33	42%	0.417	17%	0.168	S	C	.	.	S	Bend	trans	-63.2	-31.1	175	-70.3	-32	0	0	0	113	I304 Y306 P383	I304-H381 PolarHBondContact O-CD2 2.93Å; I304-H381 PolarHBondContact O-N 2.84Å; Y306-H381 AromaticContact CE2-CE1 3.84Å; Y306-H381 AromaticContact CZ-CE1 3.91Å; H381-P383 WeakPolarHBondContact O-CD 3.41Å
382	D	94.4	Very high	94.5	Very high	54 Å²	54	33.5 Å²	33.5	29%	0.289	17%	0.171	S	C	.	.	S	Bend	trans	-96.3	109.2	174.5	177.1	-2.8	0	0	0	108.7	K185 P380 D384 W385	K185-D382 WeakPolarHBondContact CE-OD2 3.43Å; K185-D382 IonicContact NZ-OD1 2.72Å; K185-D382 PolarHBondContact NZ-OD1 2.81Å; K185-D382 IonicContact NZ-OD2 2.68Å; K185-D382 PolarHBondContact NZ-OD2 3.34Å; P380-D382 PolarHBondContact O-N 2.97Å; D382-D384 PolarHBondContact O-N 2.78Å; D382-D384 VanDerWaalsContact O-N 3.14Å; D382-D384 PolarHBondContact OD1-N 3.31Å; D382-W385 VanDerWaalsContact CG-CD1 3.48Å; D382-W385 PolarHBondContact O-N 3.48Å; D382-W385 VanDerWaalsContact O-N 3.09Å; D382-W385 PolarHBondContact OD2-NE1 3.48Å
383	P	94.3	Very high	94.7	Very high	61 Å²	61	35.1 Å²	35.1	40%	0.396	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-59.8	-25.3	-172.4	-25.7	35.4	0	0	0	114.6	H381 W385 Q386 P391	H381-P383 WeakPolarHBondContact O-CD 3.41Å; P383-W385 PolarHBondContact O-N 2.92Å; P383-Q386 VanDerWaalsContact O-CB 3.28Å; P383-Q386 WeakPolarHBondContact O-CB 3.37Å; P383-Q386 VanDerWaalsContact O-CG 3.27Å; P383-Q386 WeakPolarHBondContact O-CG 3.23Å; P383-Q386 PolarHBondContact O-N 3.17Å; P383-P391 HydrophobicContact CB-CB 4.25Å
384	D	92.5	Very high	94.8	Very high	79 Å²	79	35.4 Å²	35.4	42%	0.422	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-63.8	-29.6	179.2	-61.3	-25.6	0	0	0	111.5	K185 D382 Q386 L387	K185-D384 HydrophobicContact CD-CB 3.81Å; K185-D384 WeakPolarHBondContact CD-OD2 3.35Å; K185-D384 IonicContact NZ-OD2 2.68Å; K185-D384 PolarHBondContact NZ-OD2 3.14Å; D382-D384 PolarHBondContact O-N 2.78Å; D382-D384 VanDerWaalsContact O-N 3.14Å; D382-D384 PolarHBondContact OD1-N 3.31Å; D384-Q386 PolarHBondContact O-N 3.48Å; D384-L387 PolarHBondContact O-N 3Å
385	W	94.8	Very high	94.8	Very high	14 Å²	14	42.3 Å²	42.3	5%	0.053	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-80	2.7	177.7	-68.2	105.7	0	0	0	114	K185 K301 L303 A329 W336 P380 D382 P383 L387	K185-W385 HydrophobicContact CG-CZ2 4.11Å; K301-W385 HydrophobicContact CB-CH2 3.84Å; K301-W385 HydrophobicContact CB-CZ2 4.16Å; K301-W385 HydrophobicContact CB-CZ3 4.14Å; K301-W385 HydrophobicContact CD-CH2 4.34Å; K301-W385 HydrophobicContact CD-CZ2 3.83Å; K301-W385 HydrophobicContact CG-CD2 4.31Å; K301-W385 HydrophobicContact CG-CE3 4.48Å; K301-W385 HydrophobicContact CG-CH2 3.8Å; K301-W385 HydrophobicContact CG-CZ2 3.58Å; K301-W385 HydrophobicContact CG-CZ3 4.24Å; L303-W385 HydrophobicContact CD1-CB 4.1Å; L303-W385 HydrophobicContact CD1-CE3 4.45Å; L303-W385 HydrophobicContact CD1-CG 4.49Å; L303-W385 HydrophobicContact CD2-CB 3.71Å; L303-W385 HydrophobicContact CD2-CD2 3.49Å; L303-W385 VanDerWaalsContact CD2-CD2 3.49Å; L303-W385 HydrophobicContact CD2-CE3 3.93Å; L303-W385 HydrophobicContact CD2-CG 3.36Å; A329-W385 HydrophobicContact CB-CE3 3.81Å; A329-W385 HydrophobicContact CB-CZ3 3.69Å; W336-W385 HydrophobicContact CD2-CH2 4.08Å; W336-W385 AromaticContact CD2-CZ3 3.76Å; W336-W385 HydrophobicContact CD2-CZ3 3.76Å; W336-W385 AromaticContact CE2-CH2 3.94Å; W336-W385 HydrophobicContact CE3-CH2 4.25Å; W336-W385 AromaticContact CE3-CZ3 3.88Å; W336-W385 HydrophobicContact CE3-CZ3 3.88Å; W336-W385 HydrophobicContact CG-CZ3 4.14Å; W336-W385 HydrophobicContact CH2-CH2 4.18Å; W336-W385 AromaticContact CZ2-CH2 3.99Å; W336-W385 HydrophobicContact CZ2-CH2 3.99Å; W336-W385 HydrophobicContact CZ3-CH2 4.3Å; W336-W385 HydrophobicContact CZ3-CZ3 4.31Å; P380-W385 HydrophobicContact CB-CB 4.07Å; P380-W385 HydrophobicContact CG-CB 4.22Å; D382-W385 VanDerWaalsContact CG-CD1 3.48Å; D382-W385 PolarHBondContact O-N 3.48Å; D382-W385 VanDerWaalsContact O-N 3.09Å; D382-W385 PolarHBondContact OD2-NE1 3.48Å; P383-W385 PolarHBondContact O-N 2.92Å; W385-L387 HydrophobicContact CE3-CD2 4.39Å; W385-L387 PolarHBondContact O-N 3.49Å
386	Q	95.6	Very high	94.9	Very high	3 Å²	3	44 Å²	44	1%	0.014	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-65.7	-23.6	163.2	-64	-176.3	23.7	0	0	111.1	P371 I375 P380 P383 D384 L388 P391 V392	P371-Q386 WeakPolarHBondContact CB-O 3.41Å; I375-Q386 HydrophobicContact CD1-CB 4.38Å; I375-Q386 HydrophobicContact CD1-CG 3.86Å; P380-Q386 HydrophobicContact CG-CB 4.41Å; P380-Q386 HydrophobicContact CG-CG 3.57Å; P383-Q386 VanDerWaalsContact O-CB 3.28Å; P383-Q386 WeakPolarHBondContact O-CB 3.37Å; P383-Q386 VanDerWaalsContact O-CG 3.27Å; P383-Q386 WeakPolarHBondContact O-CG 3.23Å; P383-Q386 PolarHBondContact O-N 3.17Å; D384-Q386 PolarHBondContact O-N 3.48Å; Q386-L388 HydrophobicContact CB-CB 4.43Å; Q386-L388 HydrophobicContact CB-CD1 4.24Å; Q386-L388 HydrophobicContact CB-CG 4.12Å; Q386-L388 PolarHBondContact O-N 3.31Å; Q386-P391 VanDerWaalsContact OE1-CA 3.25Å; Q386-V392 PolarHBondContact NE2-O 2.87Å; Q386-V392 PolarHBondContact OE1-O 2.8Å
387	L	93.2	Very high	94.9	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.026	22%	0.219	C	C	.	.			trans	53.3	39.7	-176.1	-53.9	-180	0	0	0	111.9	P186 I191 W336 L338 P371 D384 W385	P186-L387 HydrophobicContact CG-CD2 3.73Å; I191-L387 VanDerWaalsContact CG2-O 3.31Å; I191-L387 WeakPolarHBondContact CG2-O 3.48Å; W336-L387 HydrophobicContact CB-CD1 3.83Å; W336-L387 HydrophobicContact CB-CD2 4.2Å; L338-L387 HydrophobicContact CD1-CD1 4.46Å; L338-L387 HydrophobicContact CD2-CD1 3.75Å; L338-L387 HydrophobicContact CD2-CG 4.42Å; L338-L387 HydrophobicContact CG-CD1 3.93Å; P371-L387 HydrophobicContact CB-CB 3.98Å; P371-L387 WeakPolarHBondContact CB-O 3.38Å; P371-L387 HydrophobicContact CG-CB 3.81Å; P371-L387 HydrophobicContact CG-CD1 4.48Å; D384-L387 PolarHBondContact O-N 3Å; W385-L387 HydrophobicContact CE3-CD2 4.39Å; W385-L387 PolarHBondContact O-N 3.49Å
388	L	92.5	Very high	94.9	Very high	21 Å²	21	43.5 Å²	43.5	11%	0.11	22%	0.22	C	C	.	.			trans	-114.4	143.8	174.7	-61.6	177.8	0	0	0	109.6	I191 P371 I375 Q386 H390 V392	I191-L388 WeakPolarHBondContact CD1-O 3.4Å; P371-L388 HydrophobicContact CB-CD2 3.97Å; I375-L388 HydrophobicContact CB-CD1 4.16Å; I375-L388 HydrophobicContact CG1-CD1 3.92Å; I375-L388 HydrophobicContact CG2-CD1 4.18Å; Q386-L388 HydrophobicContact CB-CB 4.43Å; Q386-L388 HydrophobicContact CB-CD1 4.24Å; Q386-L388 HydrophobicContact CB-CG 4.12Å; Q386-L388 PolarHBondContact O-N 3.31Å; L388-H390 PolarHBondContact O-N 3.08Å; L388-V392 HydrophobicContact CD1-CG2 4.03Å
389	R	88.7	Confident	94.9	Very high	78 Å²	78	46.1 Å²	46.1	29%	0.294	23%	0.234	S	C	.	.	S	Bend	trans	-63.7	-34.4	174.3	-58.4	-178.8	78.7	103.9	-5.8	111.3	D126 I191	D126-R389 WeakPolarHBondContact OD2-CB 3.48Å; I191-R389 HydrophobicContact CB-CG 4.31Å; I191-R389 HydrophobicContact CG2-CG 4.39Å; I191-R389 PolarHBondContact O-NH1 2.8Å
390	H	91.1	Very high	94.8	Very high	96 Å²	96	45.9 Å²	45.9	44%	0.444	23%	0.234	S	C	.	.	S	Bend	trans	-120.1	92.6	174.3	-60.1	-62.1	0	0	0	109.6	Y125 L388 V392	Y125-H390 HydrophobicContact CD1-CB 3.99Å; L388-H390 PolarHBondContact O-N 3.08Å; H390-V392 PolarHBondContact O-N 2.94Å
391	P	94.2	Very high	94.7	Very high	55 Å²	55	45.7 Å²	45.7	36%	0.357	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-57.1	137.2	177.5	-26.4	35.4	0	0	0	112.2	P383 Q386	P383-P391 HydrophobicContact CB-CB 4.25Å; Q386-P391 VanDerWaalsContact OE1-CA 3.25Å
392	V	95.5	Very high	94.6	Very high	18 Å²	18	41.7 Å²	41.7	11%	0.109	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-78.6	137.8	174.6	-180	0	0	0	0	108.6	I375 F379 Q386 L388 H390 E396 F397	I375-V392 HydrophobicContact CG1-CB 4.18Å; I375-V392 HydrophobicContact CG1-CG2 4.04Å; F379-V392 WeakPolarHBondContact CE2-O 3.28Å; Q386-V392 PolarHBondContact NE2-O 2.87Å; Q386-V392 PolarHBondContact OE1-O 2.8Å; L388-V392 HydrophobicContact CD1-CG2 4.03Å; H390-V392 PolarHBondContact O-N 2.94Å; V392-E396 HydrophobicContact CG1-CB 3.45Å; V392-E396 VanDerWaalsContact CG1-CB 3.45Å; V392-F397 HydrophobicContact CG1-CB 4.35Å
393	S	97.4	Very high	94.6	Very high	52 Å²	52	39.1 Å²	39.1	36%	0.364	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-75.6	159.6	173.5	66.9	0	0	0	0	112	K395 E396 F397	S393-K395 PolarHBondContact O-N 3.1Å; S393-E396 WeakPolarHBondContact CB-OE2 3.37Å; S393-E396 PolarHBondContact N-OE2 2.81Å; S393-E396 PolarHBondContact O-N 2.82Å; S393-E396 VanDerWaalsContact O-N 3.09Å; S393-E396 VanDerWaalsContact OG-CD 3.22Å; S393-E396 VanDerWaalsContact OG-CG 3.26Å; S393-E396 WeakPolarHBondContact OG-CG 3.46Å; S393-E396 PolarHBondContact OG-N 3.08Å; S393-E396 PolarHBondContact OG-OE2 2.78Å; S393-F397 PolarHBondContact O-N 2.74Å
394	L	96.3	Very high	94.5	Very high	55 Å²	55	39.9 Å²	39.9	29%	0.288	20%	0.198	S	C	.	.	H	α-helix	trans	-55.6	-41.6	176.5	178.2	60.2	0	0	0	112	Y306 F379 E396 F397 E398	Y306-L394 HydrophobicContact CD2-CD1 3.93Å; Y306-L394 HydrophobicContact CE2-CD1 4.32Å; Y306-L394 HydrophobicContact CE2-CD2 4.36Å; F379-L394 HydrophobicContact CD1-CD1 3.79Å; F379-L394 HydrophobicContact CE1-CB 3.97Å; F379-L394 HydrophobicContact CE1-CD1 3.84Å; F379-L394 HydrophobicContact CE1-CG 4.42Å; F379-L394 HydrophobicContact CE2-CB 4.28Å; F379-L394 HydrophobicContact CG-CD1 4.21Å; F379-L394 HydrophobicContact CZ-CB 3.73Å; F379-L394 HydrophobicContact CZ-CD1 4.3Å; L394-E396 VanDerWaalsContact C-N 3.33Å; L394-E396 PolarHBondContact O-N 2.92Å; L394-F397 HydrophobicContact CD1-CD1 4.13Å; L394-F397 WeakPolarHBondContact O-CB 3.49Å; L394-F397 PolarHBondContact O-N 2.9Å; L394-E398 HydrophobicContact CD1-CG 4.31Å; L394-E398 VanDerWaalsContact O-CG 3.29Å; L394-E398 WeakPolarHBondContact O-CG 3.47Å; L394-E398 PolarHBondContact O-N 2.89Å
395	K	95.9	Very high	94.4	Very high	148 Å²	148	36.3 Å²	36.3	64%	0.643	18%	0.179	S	C	*	.	H	α-helix	trans	-62.4	-40.3	178.2	-176.7	178	-178.7	179.5	0	112.1	S393 N399	S393-K395 PolarHBondContact O-N 3.1Å; K395-N399 WeakPolarHBondContact O-CB 3.48Å; K395-N399 PolarHBondContact O-N 3.09Å; K395-N399 VanDerWaalsContact O-N 3.11Å; K395-N399 PolarHBondContact O-ND2 2.88Å
396	E	96.5	Very high	94.2	Very high	47 Å²	47	36.3 Å²	36.3	22%	0.22	18%	0.182	C	C	.	.	H	α-helix	trans	-69	-43.2	176.5	-72.3	163.7	142.8	0	0	111	Y125 V392 S393 L394 E398 N399 L400	Y125-E396 VanDerWaalsContact CZ-OE1 3.22Å; Y125-E396 PolarHBondContact OH-OE1 2.81Å; V392-E396 HydrophobicContact CG1-CB 3.45Å; V392-E396 VanDerWaalsContact CG1-CB 3.45Å; S393-E396 WeakPolarHBondContact CB-OE2 3.37Å; S393-E396 PolarHBondContact N-OE2 2.81Å; S393-E396 PolarHBondContact O-N 2.82Å; S393-E396 VanDerWaalsContact O-N 3.09Å; S393-E396 VanDerWaalsContact OG-CD 3.22Å; S393-E396 VanDerWaalsContact OG-CG 3.26Å; S393-E396 WeakPolarHBondContact OG-CG 3.46Å; S393-E396 PolarHBondContact OG-N 3.08Å; S393-E396 PolarHBondContact OG-OE2 2.78Å; L394-E396 VanDerWaalsContact C-N 3.33Å; L394-E396 PolarHBondContact O-N 2.92Å; E396-E398 VanDerWaalsContact C-N 3.35Å; E396-E398 PolarHBondContact O-N 2.98Å; E396-N399 PolarHBondContact O-N 2.95Å; E396-N399 VanDerWaalsContact O-N 3.09Å; E396-L400 WeakPolarHBondContact O-CG 3.39Å; E396-L400 PolarHBondContact O-N 3.03Å
397	F	97	Very high	94.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-54.6	-48.6	173.7	169.3	-106.9	0	0	0	112.1	K308 F318 I375 F379 V392 S393 L394 N399 L400	K308-F397 HydrophobicContact CD-CE2 4.47Å; K308-F397 HydrophobicContact CD-CZ 4.3Å; K308-F397 VanDerWaalsContact CE-O 3.26Å; K308-F397 WeakPolarHBondContact CE-O 3.18Å; K308-F397 HydrophobicContact CG-CE1 4.4Å; K308-F397 HydrophobicContact CG-CE2 4.45Å; K308-F397 HydrophobicContact CG-CZ 3.85Å; K308-F397 PolarHBondContact NZ-O 3.17Å; F318-F397 HydrophobicContact CD2-CD1 4.2Å; F318-F397 AromaticContact CD2-CE1 3.83Å; F318-F397 HydrophobicContact CD2-CE1 3.83Å; F318-F397 AromaticContact CE2-CD1 3.97Å; F318-F397 HydrophobicContact CE2-CD1 3.97Å; F318-F397 AromaticContact CE2-CE1 3.3Å; F318-F397 HydrophobicContact CE2-CE1 3.3Å; F318-F397 HydrophobicContact CE2-CZ 4.19Å; F318-F397 AromaticContact CZ-CE1 3.97Å; F318-F397 HydrophobicContact CZ-CE1 3.97Å; I375-F397 WeakPolarHBondContact O-CD2 3.5Å; I375-F397 VanDerWaalsContact O-CE2 3.24Å; I375-F397 WeakPolarHBondContact O-CE2 3.36Å; F379-F397 HydrophobicContact CB-CD1 3.55Å; F379-F397 HydrophobicContact CB-CD2 3.89Å; F379-F397 HydrophobicContact CB-CE1 3.49Å; F379-F397 VanDerWaalsContact CB-CE1 3.49Å; F379-F397 HydrophobicContact CB-CE2 3.87Å; F379-F397 HydrophobicContact CB-CG 3.72Å; F379-F397 HydrophobicContact CB-CZ 3.66Å; F379-F397 HydrophobicContact CD2-CB 3.66Å; F379-F397 HydrophobicContact CD2-CD1 4.15Å; F379-F397 HydrophobicContact CD2-CD2 4.33Å; F379-F397 AromaticContact CD2-CG 3.8Å; F379-F397 HydrophobicContact CD2-CG 3.8Å; F379-F397 HydrophobicContact CE2-CB 4.26Å; F379-F397 HydrophobicContact CG-CB 4.32Å; F379-F397 AromaticContact CG-CD1 3.94Å; F379-F397 HydrophobicContact CG-CD1 3.94Å; F379-F397 HydrophobicContact CG-CE1 4.33Å; F379-F397 HydrophobicContact CG-CG 4.02Å; V392-F397 HydrophobicContact CG1-CB 4.35Å; S393-F397 PolarHBondContact O-N 2.74Å; L394-F397 HydrophobicContact CD1-CD1 4.13Å; L394-F397 WeakPolarHBondContact O-CB 3.49Å; L394-F397 PolarHBondContact O-N 2.9Å; F397-N399 VanDerWaalsContact C-N 3.28Å; F397-N399 PolarHBondContact O-N 2.83Å; F397-L400 PolarHBondContact O-N 3.33Å
398	E	96	Very high	94	Very high	14 Å²	14	37 Å²	37	7%	0.065	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-38	175.8	-72.1	171.4	160.3	0	0	112.3	Y312 H317 F318 L394 E396	Y312-E398 PolarHBondContact OH-O 2.82Å; H317-E398 WeakPolarHBondContact CA-OE1 3.39Å; H317-E398 IonicContact CE1-OE2 3.2Å; H317-E398 IonicContact CG-OE2 3.69Å; H317-E398 IonicContact ND1-OE1 2.87Å; H317-E398 IonicContact ND1-OE2 3.97Å; H317-E398 PolarHBondContact ND1-OE2 3.34Å; F318-E398 HydrophobicContact CD2-CG 3.86Å; F318-E398 HydrophobicContact CE2-CG 4.4Å; F318-E398 PolarHBondContact N-OE1 3.35Å; L394-E398 HydrophobicContact CD1-CG 4.31Å; L394-E398 VanDerWaalsContact O-CG 3.29Å; L394-E398 WeakPolarHBondContact O-CG 3.47Å; L394-E398 PolarHBondContact O-N 2.89Å; E396-E398 VanDerWaalsContact C-N 3.35Å; E396-E398 PolarHBondContact O-N 2.98Å
399	N	96.3	Very high	93.7	Very high	57 Å²	57	42.7 Å²	42.7	31%	0.305	21%	0.209	S	C	.	.	H	α-helix	trans	-72.7	-27	178.5	-73.4	-33.8	0	0	0	113.1	K395 E396 F397 N419 S420	K395-N399 WeakPolarHBondContact O-CB 3.48Å; K395-N399 PolarHBondContact O-N 3.09Å; K395-N399 VanDerWaalsContact O-N 3.11Å; K395-N399 PolarHBondContact O-ND2 2.88Å; E396-N399 PolarHBondContact O-N 2.95Å; E396-N399 VanDerWaalsContact O-N 3.09Å; F397-N399 VanDerWaalsContact C-N 3.28Å; F397-N399 PolarHBondContact O-N 2.83Å; N399-N419 CarbonylContact O-C 3.52Å; N399-N419 WeakPolarHBondContact O-CA 3.5Å; N399-N419 WeakPolarHBondContact O-CB 3.24Å; N399-S420 PolarHBondContact O-N 3.04Å; N399-S420 PolarHBondContact O-OG 2.83Å
400	L	95.8	Very high	93.7	Very high	13 Å²	13	40.5 Å²	40.5	7%	0.068	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-61.4	136.9	-179.6	-70.3	175.9	0	0	0	112.1	K308 Y376 E396 F397 R418 S420	K308-L400 PolarHBondContact NZ-O 3.05Å; Y376-L400 HydrophobicContact CD1-CB 4.22Å; Y376-L400 HydrophobicContact CD1-CD1 4.17Å; Y376-L400 HydrophobicContact CE1-CB 4.44Å; Y376-L400 HydrophobicContact CE1-CD1 4.3Å; Y376-L400 HydrophobicContact CE1-CD2 4.11Å; Y376-L400 HydrophobicContact CG-CD1 4.43Å; E396-L400 WeakPolarHBondContact O-CG 3.39Å; E396-L400 PolarHBondContact O-N 3.03Å; F397-L400 PolarHBondContact O-N 3.33Å; L400-R418 HydrophobicContact CD2-CG 3.83Å; L400-S420 WeakPolarHBondContact O-CB 3.28Å
401	A	95.3	Very high	93.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-53.6	127.1	171.4	0	0	0	0	0	110.2	V403 L414 R418 Y534	A401-V403 PolarHBondContact O-N 2.8Å; A401-L414 HydrophobicContact CB-CD1 3.8Å; A401-R418 PolarHBondContact N-O 2.81Å; A401-Y534 HydrophobicContact CB-CD1 4.31Å; A401-Y534 HydrophobicContact CB-CE1 3.69Å
402	P	93.7	Very high	93.7	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.032	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-62.8	125.3	170.7	27.2	-35.6	0	0	0	109.2	K308 Y312 P314 C532 E533	K308-P402 HydrophobicContact CD-CB 4.18Å; Y312-P402 HydrophobicContact CD1-CB 4.16Å; Y312-P402 HydrophobicContact CD1-CG 4.42Å; Y312-P402 HydrophobicContact CE1-CB 3.88Å; Y312-P402 HydrophobicContact CE1-CG 3.9Å; P314-P402 HydrophobicContact CG-CG 3.97Å; P402-C532 VanDerWaalsContact O-CA 3.29Å; P402-C532 WeakPolarHBondContact O-CA 3.08Å; P402-E533 VanDerWaalsContact CD-O 3.3Å; P402-E533 WeakPolarHBondContact CD-O 3.18Å; P402-E533 HydrophobicContact CG-CB 3.93Å; P402-E533 WeakPolarHBondContact CG-O 3.37Å; P402-E533 PolarHBondContact O-N 2.91Å; P402-E533 VanDerWaalsContact O-N 3.09Å
403	V	95.1	Very high	93.7	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-114.6	159.6	172.2	-56.7	0	0	0	0	109.3	Y376 T377 A401 F407 F408 L414 V531 C532	Y376-V403 HydrophobicContact CD1-CG1 4.24Å; Y376-V403 HydrophobicContact CD1-CG2 4.12Å; Y376-V403 HydrophobicContact CG-CG2 3.96Å; T377-V403 VanDerWaalsContact CG2-O 3.28Å; T377-V403 WeakPolarHBondContact CG2-O 3.4Å; A401-V403 PolarHBondContact O-N 2.8Å; V403-F407 HydrophobicContact CB-CB 3.95Å; V403-F407 HydrophobicContact CB-CD1 4.12Å; V403-F407 HydrophobicContact CB-CD2 4.44Å; V403-F407 HydrophobicContact CB-CG 3.92Å; V403-F407 HydrophobicContact CG1-CD1 4.05Å; V403-F407 HydrophobicContact CG1-CD2 4.14Å; V403-F407 HydrophobicContact CG1-CE1 4.3Å; V403-F407 HydrophobicContact CG1-CE2 4.41Å; V403-F407 HydrophobicContact CG1-CG 3.98Å; V403-F407 HydrophobicContact CG1-CZ 4.49Å; V403-F407 HydrophobicContact CG2-CD1 4.43Å; V403-F408 HydrophobicContact CG2-CD2 4.36Å; V403-F408 HydrophobicContact CG2-CE2 3.39Å; V403-F408 HydrophobicContact CG2-CZ 3.55Å; V403-L414 HydrophobicContact CG1-CD1 4.5Å; V403-V531 CarbonylContact C-O 3.5Å; V403-V531 VanDerWaalsContact CA-O 3.24Å; V403-V531 WeakPolarHBondContact CA-O 3.41Å; V403-C532 HydrophobicContact CG1-CB 4.06Å
404	K	91.6	Very high	93.6	Very high	76 Å²	76	37 Å²	37	33%	0.33	18%	0.178	S	C	.	.			trans	-110.5	163.9	173.7	-56.6	-60.7	-178.6	-175.5	0	109.6	A406 F407 A530 V531	K404-A406 PolarHBondContact O-N 2.96Å; K404-F407 WeakPolarHBondContact O-CB 3.41Å; K404-F407 PolarHBondContact O-N 2.95Å; K404-A530 VanDerWaalsContact CB-O 3.29Å; K404-A530 WeakPolarHBondContact CB-O 3.29Å; K404-A530 HydrophobicContact CG-CB 4.34Å; K404-V531 PolarHBondContact N-O 3.31Å
405	S	90.2	Very high	93.6	Very high	5 Å²	5	38.4 Å²	38.4	4%	0.035	19%	0.188	C	C	.	.	H	α-helix	trans	-51	-34.2	178.3	53.7	0	0	0	0	113.9	R346 D363 F407 F408 K409	R346-S405 PolarHBondContact NH2-OG 2.93Å; D363-S405 VanDerWaalsContact OD2-CB 3.23Å; D363-S405 WeakPolarHBondContact OD2-CB 3.28Å; D363-S405 PolarHBondContact OD2-OG 2.76Å; S405-F407 PolarHBondContact O-N 3.2Å; S405-F408 PolarHBondContact O-N 2.66Å; S405-K409 WeakPolarHBondContact O-CB 3.45Å; S405-K409 PolarHBondContact O-N 3.42Å
406	A	90	Very high	93.6	Very high	13 Å²	13	34.1 Å²	34.1	11%	0.107	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-31.8	175.4	0	0	0	0	0	113.4	K404 F408 K409 Y410 V531	K404-A406 PolarHBondContact O-N 2.96Å; A406-F408 PolarHBondContact O-N 3.01Å; A406-K409 PolarHBondContact O-N 2.85Å; A406-Y410 HydrophobicContact CB-CD2 4.36Å; A406-Y410 HydrophobicContact CB-CE2 4.04Å; A406-Y410 WeakPolarHBondContact O-CB 3.36Å; A406-Y410 WeakPolarHBondContact O-CD2 3.39Å; A406-Y410 VanDerWaalsContact O-CG 3.31Å; A406-Y410 PolarHBondContact O-N 3.43Å; A406-V531 HydrophobicContact CB-CG1 3.93Å
407	F	94	Very high	93.6	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-58.5	-48.6	175.8	-175.7	-92.1	0	0	0	111.5	V403 K404 S405 N411 L412 L414 I433 V531 C532	V403-F407 HydrophobicContact CB-CB 3.95Å; V403-F407 HydrophobicContact CB-CD1 4.12Å; V403-F407 HydrophobicContact CB-CD2 4.44Å; V403-F407 HydrophobicContact CB-CG 3.92Å; V403-F407 HydrophobicContact CG1-CD1 4.05Å; V403-F407 HydrophobicContact CG1-CD2 4.14Å; V403-F407 HydrophobicContact CG1-CE1 4.3Å; V403-F407 HydrophobicContact CG1-CE2 4.41Å; V403-F407 HydrophobicContact CG1-CG 3.98Å; V403-F407 HydrophobicContact CG1-CZ 4.49Å; V403-F407 HydrophobicContact CG2-CD1 4.43Å; K404-F407 WeakPolarHBondContact O-CB 3.41Å; K404-F407 PolarHBondContact O-N 2.95Å; S405-F407 PolarHBondContact O-N 3.2Å; F407-N411 PolarHBondContact O-N 3.42Å; F407-L412 HydrophobicContact CD1-CB 4.4Å; F407-L412 HydrophobicContact CD2-CB 3.69Å; F407-L412 HydrophobicContact CD2-CD1 4Å; F407-L412 HydrophobicContact CD2-CG 4.4Å; F407-L412 HydrophobicContact CE1-CB 4.29Å; F407-L412 WeakPolarHBondContact CE1-O 3.48Å; F407-L412 HydrophobicContact CE2-CB 3.53Å; F407-L412 HydrophobicContact CE2-CD1 4.44Å; F407-L412 HydrophobicContact CG-CB 4.1Å; F407-L412 VanDerWaalsContact CZ-C 3.48Å; F407-L412 HydrophobicContact CZ-CB 3.86Å; F407-L412 WeakPolarHBondContact CZ-O 3.5Å; F407-L412 WeakPolarHBondContact O-CB 3.37Å; F407-L412 WeakPolarHBondContact O-CG 3.4Å; F407-L412 PolarHBondContact O-N 2.72Å; F407-L414 HydrophobicContact CD2-CD2 4.5Å; F407-L414 HydrophobicContact CE2-CD2 3.41Å; F407-L414 VanDerWaalsContact CE2-CD2 3.41Å; F407-L414 HydrophobicContact CE2-CG 4.09Å; F407-L414 HydrophobicContact CZ-CD2 3.55Å; F407-L414 HydrophobicContact CZ-CG 3.68Å; F407-I433 HydrophobicContact CE2-CG2 4.36Å; F407-V531 HydrophobicContact CB-CB 4.15Å; F407-V531 WeakPolarHBondContact CB-O 3.27Å; F407-V531 HydrophobicContact CD2-CB 4.2Å; F407-C532 HydrophobicContact CD2-CB 4.37Å
408	F	91.5	Very high	93.5	Very high	18 Å²	18	39.4 Å²	39.4	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-77.7	-35.8	178.6	-58.8	-64.2	0	0	0	112.3	F365 Q373 Y376 V403 S405 A406 Y410 N411	F365-F408 HydrophobicContact CD2-CB 3.98Å; F365-F408 HydrophobicContact CD2-CD2 4.3Å; F365-F408 HydrophobicContact CE1-CD2 4.34Å; F365-F408 HydrophobicContact CE2-CB 3.53Å; F365-F408 AromaticContact CE2-CD2 3.32Å; F365-F408 HydrophobicContact CE2-CD2 3.32Å; F365-F408 HydrophobicContact CE2-CE2 4.22Å; F365-F408 AromaticContact CE2-CG 3.68Å; F365-F408 HydrophobicContact CE2-CG 3.68Å; F365-F408 HydrophobicContact CZ-CB 4.43Å; F365-F408 AromaticContact CZ-CD2 3.34Å; F365-F408 HydrophobicContact CZ-CD2 3.34Å; F365-F408 AromaticContact CZ-CE2 3.83Å; F365-F408 HydrophobicContact CZ-CE2 3.83Å; F365-F408 HydrophobicContact CZ-CG 4.15Å; Q373-F408 HydrophobicContact CB-CD1 3.86Å; Q373-F408 HydrophobicContact CB-CD2 4.04Å; Q373-F408 HydrophobicContact CB-CE1 3.76Å; Q373-F408 HydrophobicContact CB-CE2 3.9Å; Q373-F408 HydrophobicContact CB-CG 4Å; Q373-F408 HydrophobicContact CB-CZ 3.76Å; Q373-F408 HydrophobicContact CG-CD1 3.56Å; Q373-F408 HydrophobicContact CG-CE1 3.69Å; Q373-F408 HydrophobicContact CG-CG 4.03Å; Q373-F408 HydrophobicContact CG-CZ 4.24Å; Q373-F408 WeakPolarHBondContact O-CE2 3.26Å; Q373-F408 WeakPolarHBondContact O-CZ 3.46Å; Y376-F408 HydrophobicContact CD2-CE1 4.42Å; Y376-F408 AromaticContact CD2-CZ 3.76Å; Y376-F408 HydrophobicContact CD2-CZ 3.76Å; Y376-F408 HydrophobicContact CE2-CZ 4.33Å; Y376-F408 HydrophobicContact CG-CZ 4.08Å; V403-F408 HydrophobicContact CG2-CD2 4.36Å; V403-F408 HydrophobicContact CG2-CE2 3.39Å; V403-F408 HydrophobicContact CG2-CZ 3.55Å; S405-F408 PolarHBondContact O-N 2.66Å; A406-F408 PolarHBondContact O-N 3.01Å; F408-Y410 PolarHBondContact O-N 2.85Å; F408-N411 PolarHBondContact O-N 3.07Å; F408-N411 PolarHBondContact O-OD1 2.76Å
409	K	86.2	Confident	93.5	Very high	141 Å²	141	42.9 Å²	42.9	61%	0.613	21%	0.213	S	C	*	.	H	α-helix	trans	-54.5	-38.7	173.6	-178.7	-178	175.7	177.9	0	111.8	S405 A406	S405-K409 WeakPolarHBondContact O-CB 3.45Å; S405-K409 PolarHBondContact O-N 3.42Å; A406-K409 PolarHBondContact O-N 2.85Å
410	Y	88.5	Confident	93.4	Very high	32 Å²	32	40.2 Å²	40.2	13%	0.125	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	7.1	179.1	-57.3	-38.7	0	0	0	113.6	A406 F408 L412 L443 A498 Q500 V531	A406-Y410 HydrophobicContact CB-CD2 4.36Å; A406-Y410 HydrophobicContact CB-CE2 4.04Å; A406-Y410 WeakPolarHBondContact O-CB 3.36Å; A406-Y410 WeakPolarHBondContact O-CD2 3.39Å; A406-Y410 VanDerWaalsContact O-CG 3.31Å; A406-Y410 PolarHBondContact O-N 3.43Å; F408-Y410 PolarHBondContact O-N 2.85Å; Y410-L412 VanDerWaalsContact C-N 3.28Å; Y410-L412 PolarHBondContact O-N 3.3Å; Y410-L443 HydrophobicContact CD1-CD2 4.09Å; Y410-L443 HydrophobicContact CD2-CD2 4.43Å; Y410-L443 HydrophobicContact CG-CD2 4.02Å; Y410-A498 HydrophobicContact CD2-CB 3.87Å; Y410-A498 HydrophobicContact CE2-CB 4.04Å; Y410-Q500 HydrophobicContact CD1-CB 4.16Å; Y410-Q500 HydrophobicContact CE1-CB 3.58Å; Y410-Q500 VanDerWaalsContact CE1-OE1 3.31Å; Y410-V531 HydrophobicContact CD2-CG1 4.25Å
411	N	90.3	Very high	93.5	Very high	81 Å²	81	42 Å²	42	43%	0.433	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	47.4	-177.8	-64.1	-34.1	0	0	0	112.5	S130 F407 F408 P436	S130-N411 PolarHBondContact OG-O 2.84Å; F407-N411 PolarHBondContact O-N 3.42Å; F408-N411 PolarHBondContact O-N 3.07Å; F408-N411 PolarHBondContact O-OD1 2.76Å; N411-P436 HydrophobicContact CB-CG 3.5Å; N411-P436 VanDerWaalsContact CB-CG 3.5Å; N411-P436 WeakPolarHBondContact O-CD 3.37Å
412	L	94.7	Very high	93.6	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	21%	0.213	C	C	.	.			trans	-82.3	153.9	177.9	-54.7	-176.3	0	0	0	110.9	F407 Y410 I433 A434 F435 L443 F445 A498 V531	F407-L412 HydrophobicContact CD1-CB 4.4Å; F407-L412 HydrophobicContact CD2-CB 3.69Å; F407-L412 HydrophobicContact CD2-CD1 4Å; F407-L412 HydrophobicContact CD2-CG 4.4Å; F407-L412 HydrophobicContact CE1-CB 4.29Å; F407-L412 WeakPolarHBondContact CE1-O 3.48Å; F407-L412 HydrophobicContact CE2-CB 3.53Å; F407-L412 HydrophobicContact CE2-CD1 4.44Å; F407-L412 HydrophobicContact CG-CB 4.1Å; F407-L412 VanDerWaalsContact CZ-C 3.48Å; F407-L412 HydrophobicContact CZ-CB 3.86Å; F407-L412 WeakPolarHBondContact CZ-O 3.5Å; F407-L412 WeakPolarHBondContact O-CB 3.37Å; F407-L412 WeakPolarHBondContact O-CG 3.4Å; F407-L412 PolarHBondContact O-N 2.72Å; Y410-L412 VanDerWaalsContact C-N 3.28Å; Y410-L412 PolarHBondContact O-N 3.3Å; L412-I433 HydrophobicContact CB-CG2 3.99Å; L412-I433 HydrophobicContact CD1-CG2 4.19Å; L412-I433 HydrophobicContact CG-CG2 4.47Å; L412-A434 VanDerWaalsContact CA-O 3.29Å; L412-A434 WeakPolarHBondContact CA-O 3.48Å; L412-F435 HydrophobicContact CD2-CB 3.8Å; L412-L443 HydrophobicContact CD2-CD1 4.27Å; L412-F445 HydrophobicContact CD1-CE1 4.17Å; L412-F445 HydrophobicContact CD2-CE1 4.21Å; L412-F445 HydrophobicContact CD2-CZ 4.03Å; L412-A498 HydrophobicContact CD1-CB 4.36Å; L412-V531 HydrophobicContact CD1-CB 3.96Å; L412-V531 HydrophobicContact CD1-CG1 3.87Å; L412-V531 HydrophobicContact CD1-CG2 4.02Å
413	D	94.9	Very high	93.8	Very high	36 Å²	36	46.9 Å²	46.9	19%	0.193	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.6	175.3	-80.2	-33.2	0	0	0	111.9	S130 V415 I433 A434	S130-D413 WeakPolarHBondContact CB-OD2 3.46Å; S130-D413 PolarHBondContact N-OD2 3.03Å; S130-D413 VanDerWaalsContact OG-CG 3.24Å; S130-D413 PolarHBondContact OG-OD2 3.33Å; D413-V415 PolarHBondContact O-N 2.78Å; D413-I433 CarbonylContact O-C 3.57Å; D413-I433 WeakPolarHBondContact O-CA 3.35Å; D413-A434 HydrophobicContact CB-CB 4.16Å; D413-A434 PolarHBondContact N-O 3.04Å; D413-A434 PolarHBondContact O-N 2.98Å
414	L	96.2	Very high	93.8	Very high	30 Å²	30	47.4 Å²	47.4	16%	0.157	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	105.8	175.9	-56.8	-176.1	0	0	0	109.6	Y376 A401 V403 F407 I433 Y534	Y376-L414 HydrophobicContact CE1-CD1 4.42Å; A401-L414 HydrophobicContact CB-CD1 3.8Å; V403-L414 HydrophobicContact CG1-CD1 4.5Å; F407-L414 HydrophobicContact CD2-CD2 4.5Å; F407-L414 HydrophobicContact CE2-CD2 3.41Å; F407-L414 VanDerWaalsContact CE2-CD2 3.41Å; F407-L414 HydrophobicContact CE2-CG 4.09Å; F407-L414 HydrophobicContact CZ-CD2 3.55Å; F407-L414 HydrophobicContact CZ-CG 3.68Å; L414-I433 HydrophobicContact CD2-CD1 3.57Å; L414-Y534 WeakPolarHBondContact CD2-OH 3.46Å
415	V	95.4	Very high	94	Very high	84 Å²	84	47.3 Å²	47.3	51%	0.509	25%	0.252	S	S	.	.	S	Bend	trans	-85.4	-51.4	-172.9	-178.8	0	0	0	0	111.9	D413 A432 A434	D413-V415 PolarHBondContact O-N 2.78Å; V415-A432 HydrophobicContact CB-CB 4.16Å; V415-A432 WeakPolarHBondContact CB-O 3.45Å; V415-A432 PolarHBondContact N-O 3.33Å; V415-A432 VanDerWaalsContact N-O 3.17Å; V415-A434 HydrophobicContact CG2-CB 3.43Å; V415-A434 VanDerWaalsContact CG2-CB 3.43Å
416	T	96.6	Very high	94.3	Very high	57 Å²	57	51.4 Å²	51.4	35%	0.35	27%	0.273	S	S	.	.	S	Bend	trans	-93.6	-37.2	-171.2	48.8	0	0	0	0	113.9	I431 A432	T416-I431 WeakPolarHBondContact OG1-CA 3.13Å; T416-A432 HydrophobicContact CG2-CB 3.72Å; T416-A432 PolarHBondContact OG1-N 2.67Å
417	H	96.4	Very high	94.6	Very high	52 Å²	52	51.6 Å²	51.6	24%	0.241	27%	0.273	C	S	.	.			trans	-137.2	103.7	-168.6	-63.7	96.4	0	0	0	109.3	I422 R430 Y534	H417-I422 HydrophobicContact CB-CD1 3.81Å; H417-I422 HydrophobicContact CB-CG1 4.1Å; H417-R430 PolarHBondContact CE1-O 2.65Å; H417-Y534 HydrophobicContact CB-CE1 3.94Å; H417-Y534 WeakPolarHBondContact O-CE1 3.34Å; H417-Y534 PolarHBondContact O-OH 3.11Å
418	R	94.4	Very high	94.8	Very high	107 Å²	107	54.3 Å²	54.3	40%	0.404	29%	0.286	S	S	.	.			trans	-84.1	-21.9	174.5	-168.8	172.3	179.2	168.7	-2.6	112.5	Y376 L400 A401	Y376-R418 PolarHBondContact OH-NE 3.16Å; Y376-R418 PolarHBondContact OH-NH2 2.8Å; L400-R418 HydrophobicContact CD2-CG 3.83Å; A401-R418 PolarHBondContact N-O 2.81Å
419	N	96.1	Very high	95	Very high	86 Å²	86	54 Å²	54	46%	0.46	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-90	145.6	-177.3	-66.4	-4.1	0	0	0	111.7	N399 V421 Y534	N399-N419 CarbonylContact O-C 3.52Å; N399-N419 WeakPolarHBondContact O-CA 3.5Å; N399-N419 WeakPolarHBondContact O-CB 3.24Å; N419-V421 PolarHBondContact O-N 2.77Å; N419-Y534 WeakPolarHBondContact O-CD1 3.2Å; N419-Y534 VanDerWaalsContact O-CE1 3.29Å; N419-Y534 WeakPolarHBondContact O-CE1 3.43Å
420	S	95.6	Very high	95.6	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.007	27%	0.274	C	S	.	.	S	Bend	trans	-69.1	-30.1	-174.4	68.2	0	0	0	0	113.3	G315 N399 L400 Y534 R535	G315-S420 PolarHBondContact N-OG 2.85Å; N399-S420 PolarHBondContact O-N 3.04Å; N399-S420 PolarHBondContact O-OG 2.83Å; L400-S420 WeakPolarHBondContact O-CB 3.28Å; S420-Y534 CarbonylContact O-C 3.5Å; S420-Y534 WeakPolarHBondContact O-CA 3.48Å; S420-R535 PolarHBondContact O-N 2.89Å
421	V	97.7	Very high	96.1	Very high	52 Å²	52	50.3 Å²	50.3	32%	0.315	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119.7	176.6	-175.3	0	0	0	0	109.7	N419 V423 R535 V537	N419-V421 PolarHBondContact O-N 2.77Å; V421-V423 HydrophobicContact CG1-CG2 4.21Å; V421-R535 CarbonylContact C-O 3.49Å; V421-R535 WeakPolarHBondContact CA-O 3.35Å; V421-R535 HydrophobicContact CG2-CB 4.38Å; V421-V537 HydrophobicContact CG1-CG2 3.92Å
422	I	97.5	Very high	96.4	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.041	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	110.1	174.9	-57.6	174.3	0	0	0	107.5	H417 V429 I431 Y534 R535 L536 V537	H417-I422 HydrophobicContact CB-CD1 3.81Å; H417-I422 HydrophobicContact CB-CG1 4.1Å; I422-V429 HydrophobicContact CG2-CG2 4.07Å; I422-I431 HydrophobicContact CD1-CG1 3.9Å; I422-Y534 HydrophobicContact CD1-CD1 3.57Å; I422-Y534 HydrophobicContact CD1-CD2 4.41Å; I422-Y534 HydrophobicContact CD1-CE1 4.05Å; I422-Y534 HydrophobicContact CD1-CG 3.76Å; I422-Y534 HydrophobicContact CG1-CD1 3.87Å; I422-Y534 HydrophobicContact CG1-CE1 4.47Å; I422-Y534 HydrophobicContact CG1-CG 4.4Å; I422-R535 PolarHBondContact N-O 3.29Å; I422-L536 HydrophobicContact CB-CD1 3.89Å; I422-L536 HydrophobicContact CG2-CD1 3.76Å; I422-L536 CarbonylContact O-C 3.51Å; I422-L536 WeakPolarHBondContact O-CA 3.45Å; I422-V537 PolarHBondContact O-N 2.88Å
423	V	97.3	Very high	96.6	Very high	99 Å²	99	46.4 Å²	46.4	60%	0.6	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	115.5	172.7	-175.5	0	0	0	0	108.1	V421 V537 N539	V421-V423 HydrophobicContact CG1-CG2 4.21Å; V423-V537 WeakPolarHBondContact CA-O 3.25Å; V423-V537 HydrophobicContact CG2-CB 4.31Å; V423-N539 HydrophobicContact CG1-CB 4.32Å
424	C	94.5	Very high	96.6	Very high	11 Å²	11	45.7 Å²	45.7	7%	0.074	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129	-179.5	61.8	0	0	0	0	111.7	V429 L536 V537 N539	C424-V429 HydrophobicContact CB-CB 4.34Å; C424-L536 HydrophobicContact CB-CD1 4.27Å; C424-L536 VanDerWaalsContact SG-CD1 3.58Å; C424-V537 PolarHBondContact N-O 2.73Å; C424-N539 PolarHBondContact O-N 3.49Å
425	S	95.5	Very high	96.5	Very high	74 Å²	74	45.3 Å²	45.3	52%	0.517	24%	0.243	S	C	.	.	S	Bend	trans	-92.8	-12.8	170.4	51.4	0	0	0	0	112.8	F540 R544	S425-F540 WeakPolarHBondContact O-CB 2.88Å; S425-R544 PolarHBondContact O-NH1 2.96Å
426	D	96.6	Very high	96.2	Very high	91 Å²	91	43.1 Å²	43.1	49%	0.487	23%	0.231	S	C	.	.	S	Bend	trans	-95.8	146.3	176.1	-70.1	-43.3	0	0	0	111.4	E428 R544	D426-E428 PolarHBondContact O-N 2.83Å; D426-R544 IonicContact OD1-NH2 3.81Å; D426-R544 PolarHBondContact OD1-NH2 3.36Å
427	P	96.6	Very high	95.7	Very high	17 Å²	17	43.8 Å²	43.8	11%	0.11	24%	0.238	C	C	.	.	S	Bend	trans	-74.5	-5	-176.2	33.5	-38.4	0	0	0	113.4	R485 F540 R544 L546	P427-R485 WeakPolarHBondContact O-CA 3.38Å; P427-F540 HydrophobicContact CB-CE1 4.35Å; P427-F540 HydrophobicContact CB-CE2 4.33Å; P427-F540 HydrophobicContact CB-CZ 4.2Å; P427-R544 WeakPolarHBondContact CB-O 3.37Å; P427-R544 WeakPolarHBondContact CG-O 3.17Å; P427-L546 HydrophobicContact CB-CD1 4.31Å; P427-L546 HydrophobicContact CB-CG 4.03Å; P427-L546 HydrophobicContact CG-CD1 4.07Å; P427-L546 HydrophobicContact CG-CG 4.03Å
428	E	97.6	Very high	94.6	Very high	61 Å²	61	47.8 Å²	47.8	29%	0.285	26%	0.261	S	S	.	.	S	Bend	trans	-129.8	131.7	168.8	-172.6	177.3	98.9	0	0	109.1	D426 I484 R485 L546	D426-E428 PolarHBondContact O-N 2.83Å; E428-I484 CarbonylContact C-O 3.53Å; E428-I484 VanDerWaalsContact CA-O 3.3Å; E428-I484 WeakPolarHBondContact CA-O 3.33Å; E428-R485 HydrophobicContact CB-CG 4.11Å; E428-R485 HydrophobicContact CG-CG 3.95Å; E428-R485 IonicContact OE2-CZ 3.72Å; E428-R485 VanDerWaalsContact OE2-CZ 3.24Å; E428-R485 IonicContact OE2-NE 3.41Å; E428-R485 PolarHBondContact OE2-NE 3.36Å; E428-R485 IonicContact OE2-NH2 3.64Å; E428-R485 PolarHBondContact OE2-NH2 3.2Å; E428-L546 HydrophobicContact CB-CD1 4.1Å
429	V	97.4	Very high	92.9	Very high	11 Å²	11	44.7 Å²	44.7	7%	0.067	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	138.5	174.6	60.7	0	0	0	0	110	I422 C424 I431 Y483 I484 L536	I422-V429 HydrophobicContact CG2-CG2 4.07Å; C424-V429 HydrophobicContact CB-CB 4.34Å; V429-I431 HydrophobicContact CB-CD1 4.45Å; V429-I431 HydrophobicContact CG1-CD1 3.81Å; V429-I431 HydrophobicContact CG2-CD1 3.97Å; V429-I431 HydrophobicContact CG2-CG1 4.39Å; V429-Y483 CarbonylContact O-C 3.53Å; V429-Y483 VanDerWaalsContact O-CA 3.3Å; V429-Y483 WeakPolarHBondContact O-CA 3.49Å; V429-I484 HydrophobicContact CG1-CB 3.66Å; V429-I484 HydrophobicContact CG1-CG1 4.32Å; V429-I484 PolarHBondContact N-O 3.28Å; V429-I484 PolarHBondContact O-N 3.18Å; V429-L536 HydrophobicContact CB-CD1 4.34Å; V429-L536 HydrophobicContact CG1-CD1 3.8Å; V429-L536 HydrophobicContact CG1-CD2 3.73Å; V429-L536 HydrophobicContact CG1-CG 4.44Å; V429-L536 HydrophobicContact CG2-CD1 4.34Å
430	R	97.7	Very high	90.6	Very high	97 Å²	97	49.9 Å²	49.9	37%	0.366	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	118.5	176.3	-174.3	-178.1	-178.3	-85.7	4.4	110.2	H417 V481 F482 Y483	H417-R430 PolarHBondContact CE1-O 2.65Å; R430-V481 HydrophobicContact CG-CG1 3.59Å; R430-F482 CarbonylContact C-O 3.51Å; R430-F482 WeakPolarHBondContact CA-O 3.31Å; R430-Y483 HydrophobicContact CB-CD1 4.27Å; R430-Y483 HydrophobicContact CB-CE1 4.31Å; R430-Y483 HydrophobicContact CG-CD1 4.17Å; R430-Y483 HydrophobicContact CG-CE1 3.82Å
431	I	98.4	Very high	88.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131	174	-55.4	94.3	0	0	0	108.5	T416 I422 V429 V481 F482 I484 L494 I496 Y534	T416-I431 WeakPolarHBondContact OG1-CA 3.13Å; I422-I431 HydrophobicContact CD1-CG1 3.9Å; V429-I431 HydrophobicContact CB-CD1 4.45Å; V429-I431 HydrophobicContact CG1-CD1 3.81Å; V429-I431 HydrophobicContact CG2-CD1 3.97Å; V429-I431 HydrophobicContact CG2-CG1 4.39Å; I431-V481 CarbonylContact O-C 3.52Å; I431-V481 WeakPolarHBondContact O-CA 3.35Å; I431-F482 HydrophobicContact CB-CB 4.39Å; I431-F482 PolarHBondContact N-O 2.79Å; I431-F482 PolarHBondContact O-N 2.84Å; I431-I484 HydrophobicContact CD1-CG1 3.98Å; I431-L494 HydrophobicContact CD1-CD2 3.77Å; I431-L494 HydrophobicContact CG1-CD2 4.25Å; I431-I496 HydrophobicContact CG2-CD1 4.28Å; I431-Y534 HydrophobicContact CG2-CE2 4.05Å
432	A	97.9	Very high	87.7	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.008	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.4	179.7	0	0	0	0	0	111.9	V415 T416 T479 S480 V481	V415-A432 HydrophobicContact CB-CB 4.16Å; V415-A432 WeakPolarHBondContact CB-O 3.45Å; V415-A432 PolarHBondContact N-O 3.33Å; V415-A432 VanDerWaalsContact N-O 3.17Å; T416-A432 HydrophobicContact CG2-CB 3.72Å; T416-A432 PolarHBondContact OG1-N 2.67Å; A432-T479 HydrophobicContact CB-CG2 3.7Å; A432-S480 WeakPolarHBondContact CA-O 3.31Å; A432-V481 HydrophobicContact CB-CG2 4.29Å
433	I	97.5	Very high	87.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	118	178.2	-52.8	-63	0	0	0	107.8	F407 L412 D413 L414 T479 S480 F482 I496	F407-I433 HydrophobicContact CE2-CG2 4.36Å; L412-I433 HydrophobicContact CB-CG2 3.99Å; L412-I433 HydrophobicContact CD1-CG2 4.19Å; L412-I433 HydrophobicContact CG-CG2 4.47Å; D413-I433 CarbonylContact O-C 3.57Å; D413-I433 WeakPolarHBondContact O-CA 3.35Å; L414-I433 HydrophobicContact CD2-CD1 3.57Å; I433-T479 CarbonylContact O-C 3.48Å; I433-T479 WeakPolarHBondContact O-CA 3.26Å; I433-S480 PolarHBondContact N-O 2.85Å; I433-S480 PolarHBondContact O-N 3.17Å; I433-F482 HydrophobicContact CG1-CE2 4.01Å; I433-I496 HydrophobicContact CD1-CD1 4.28Å; I433-I496 HydrophobicContact CG1-CD1 4.05Å
434	A	95.8	Very high	87	Confident	20 Å²	20	49.8 Å²	49.8	17%	0.165	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	153.7	176.6	0	0	0	0	0	110.7	L412 D413 V415 H478	L412-A434 VanDerWaalsContact CA-O 3.29Å; L412-A434 WeakPolarHBondContact CA-O 3.48Å; D413-A434 HydrophobicContact CB-CB 4.16Å; D413-A434 PolarHBondContact N-O 3.04Å; D413-A434 PolarHBondContact O-N 2.98Å; V415-A434 HydrophobicContact CG2-CB 3.43Å; V415-A434 VanDerWaalsContact CG2-CB 3.43Å; A434-H478 WeakPolarHBondContact CA-O 3.48Å
435	F	93.9	Very high	87	Confident	23 Å²	23	49.5 Å²	49.5	10%	0.101	27%	0.268	C	S	.	.			trans	-136.4	163.7	173.8	55.4	-99.7	0	0	0	109.7	L412 L443 F445 T473 H478 T479	L412-F435 HydrophobicContact CD2-CB 3.8Å; F435-L443 HydrophobicContact CB-CD1 3.91Å; F435-L443 HydrophobicContact CG-CD1 4.39Å; F435-F445 HydrophobicContact CB-CZ 4.46Å; F435-F445 AromaticContact CD1-CE2 3.84Å; F435-F445 HydrophobicContact CD1-CE2 3.84Å; F435-F445 AromaticContact CD1-CZ 3.89Å; F435-F445 HydrophobicContact CD1-CZ 3.89Å; F435-F445 HydrophobicContact CE1-CE2 4.13Å; F435-F445 HydrophobicContact CG-CZ 4.48Å; F435-T473 HydrophobicContact CE1-CG2 3.87Å; F435-T473 HydrophobicContact CZ-CG2 3.72Å; F435-H478 WeakPolarHBondContact CD1-O 3.3Å; F435-H478 HydrophobicContact CD2-CB 4.03Å; F435-H478 HydrophobicContact CE2-CB 3.82Å; F435-H478 WeakPolarHBondContact CG-O 3.09Å; F435-H478 HydrophobicContact CZ-CB 4.33Å; F435-H478 PolarHBondContact N-O 2.85Å; F435-H478 WeakPolarHBondContact O-CB 3.4Å; F435-T479 VanDerWaalsContact CE1-C 3.46Å; F435-T479 VanDerWaalsContact CE1-N 3.29Å
436	P	89.8	Confident	87	Confident	38 Å²	38	48 Å²	48	25%	0.247	26%	0.255	C	S	.	.			trans	-65.1	144.5	-174.7	-22.1	33.9	0	0	0	113.4	N411 D438 S439	N411-P436 HydrophobicContact CB-CG 3.5Å; N411-P436 VanDerWaalsContact CB-CG 3.5Å; N411-P436 WeakPolarHBondContact O-CD 3.37Å; P436-D438 VanDerWaalsContact C-N 3.34Å; P436-S439 WeakPolarHBondContact O-CB 3.24Å; P436-S439 PolarHBondContact O-N 2.94Å; P436-S439 PolarHBondContact O-OG 3.31Å
437	S	84.8	Confident	87.1	Confident	71 Å²	71	44.1 Å²	44.1	50%	0.497	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-36.9	175.3	57.1	0	0	0	0	113.2	S439 H478	S437-S439 PolarHBondContact O-N 2.96Å; S437-S439 VanDerWaalsContact O-N 3.16Å; S437-H478 WeakPolarHBondContact CB-NE2 3.39Å
438	D	75	Confident	87.1	Confident	135 Å²	135	44.2 Å²	44.2	72%	0.722	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	19.5	-177.1	-64.5	-6.8	0	0	0	112	P436 K440	P436-D438 VanDerWaalsContact C-N 3.34Å; D438-K440 PolarHBondContact O-N 3.5Å
439	S	57.5	Low	87.1	Confident	43 Å²	43	41.4 Å²	41.4	30%	0.301	23%	0.225	S	C	.	.			trans	-61.4	89.2	179.4	69.3	0	0	0	0	109.2	P436 S437 N441	P436-S439 WeakPolarHBondContact O-CB 3.24Å; P436-S439 PolarHBondContact O-N 2.94Å; P436-S439 PolarHBondContact O-OG 3.31Å; S437-S439 PolarHBondContact O-N 2.96Å; S437-S439 VanDerWaalsContact O-N 3.16Å; S439-N441 WeakPolarHBondContact CB-O 3.46Å; S439-N441 PolarHBondContact O-N 3.04Å
440	K	47.6	Very low	87.2	Confident	194 Å²	194	41.9 Å²	41.9	84%	0.843	23%	0.229	S	C	*	.			trans	-55.5	12.3	152.3	-69.8	178.7	174.1	178	0	111.9	D438	D438-K440 PolarHBondContact O-N 3.5Å
441	N	55.4	Low	87.2	Confident	61 Å²	61	37.9 Å²	37.9	33%	0.326	21%	0.214	S	C	.	.	S	Bend	trans	-137	97.5	-158.8	-71.3	-22.4	0	0	0	106.1	S439 L443 Q500	S439-N441 WeakPolarHBondContact CB-O 3.46Å; S439-N441 PolarHBondContact O-N 3.04Å; N441-L443 PolarHBondContact O-N 3.39Å; N441-Q500 HydrophobicContact CB-CG 3.9Å; N441-Q500 PolarHBondContact ND2-NE2 3.24Å; N441-Q500 PolarHBondContact OD1-NE2 2.97Å
442	D	77.1	Confident	87	Confident	51 Å²	51	39.3 Å²	39.3	27%	0.273	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	94.3	176.4	176.7	46.1	0	0	0	108.5	H501 K564	D442-H501 HydrophobicContact CB-CB 3.88Å; D442-H501 VanDerWaalsContact O-CB 3.26Å; D442-H501 WeakPolarHBondContact O-CB 3.43Å; D442-H501 PolarHBondContact O-N 2.79Å; D442-H501 IonicContact OD2-CD2 3Å; D442-H501 IonicContact OD2-CG 3.62Å; D442-K564 IonicContact OD1-NZ 2.63Å; D442-K564 PolarHBondContact OD1-NZ 2.68Å; D442-K564 IonicContact OD2-NZ 3.19Å; D442-K564 PolarHBondContact OD2-NZ 3.24Å
443	L	89.2	Confident	86.7	Confident	22 Å²	22	42.4 Å²	42.4	12%	0.115	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	125	-178.2	-72.4	172.4	0	0	0	110.4	Y410 L412 F435 N441 F445 K499 Q500	Y410-L443 HydrophobicContact CD1-CD2 4.09Å; Y410-L443 HydrophobicContact CD2-CD2 4.43Å; Y410-L443 HydrophobicContact CG-CD2 4.02Å; L412-L443 HydrophobicContact CD2-CD1 4.27Å; F435-L443 HydrophobicContact CB-CD1 3.91Å; F435-L443 HydrophobicContact CG-CD1 4.39Å; N441-L443 PolarHBondContact O-N 3.39Å; L443-F445 HydrophobicContact CB-CE2 3.83Å; L443-F445 HydrophobicContact CB-CZ 4.25Å; L443-F445 HydrophobicContact CD1-CZ 4.33Å; L443-K499 CarbonylContact C-O 3.48Å; L443-K499 VanDerWaalsContact CA-O 3.28Å; L443-K499 WeakPolarHBondContact CA-O 3.34Å; L443-Q500 HydrophobicContact CD2-CB 3.81Å; L443-Q500 HydrophobicContact CD2-CG 4.33Å
444	S	91	Very high	86.3	Confident	24 Å²	24	52.3 Å²	52.3	17%	0.168	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	143.3	169.7	-67.1	0	0	0	0	109.5	A498 K499 F528 E561	S444-A498 CarbonylContact O-C 3.58Å; S444-A498 VanDerWaalsContact O-CA 3.31Å; S444-A498 WeakPolarHBondContact O-CA 2.99Å; S444-K499 PolarHBondContact N-O 3.3Å; S444-K499 PolarHBondContact O-N 2.97Å; S444-F528 WeakPolarHBondContact O-CE1 3.45Å; S444-E561 PolarHBondContact OG-OE1 3.23Å
445	F	94.5	Very high	86	Confident	5 Å²	5	59.1 Å²	59.1	2%	0.022	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	148.3	178.3	-66.7	-92.5	0	0	0	111.5	L412 F435 L443 Q471 S480 F482 Y497 A498 S556	L412-F445 HydrophobicContact CD1-CE1 4.17Å; L412-F445 HydrophobicContact CD2-CE1 4.21Å; L412-F445 HydrophobicContact CD2-CZ 4.03Å; F435-F445 HydrophobicContact CB-CZ 4.46Å; F435-F445 AromaticContact CD1-CE2 3.84Å; F435-F445 HydrophobicContact CD1-CE2 3.84Å; F435-F445 AromaticContact CD1-CZ 3.89Å; F435-F445 HydrophobicContact CD1-CZ 3.89Å; F435-F445 HydrophobicContact CE1-CE2 4.13Å; F435-F445 HydrophobicContact CG-CZ 4.48Å; L443-F445 HydrophobicContact CB-CE2 3.83Å; L443-F445 HydrophobicContact CB-CZ 4.25Å; L443-F445 HydrophobicContact CD1-CZ 4.33Å; F445-Q471 HydrophobicContact CB-CG 4.17Å; F445-Q471 PolarHBondContact O-OE1 2.84Å; F445-S480 WeakPolarHBondContact CB-OG 3.46Å; F445-S480 WeakPolarHBondContact CD2-OG 3.36Å; F445-S480 VanDerWaalsContact CG-OG 3.27Å; F445-S480 WeakPolarHBondContact CG-OG 3.47Å; F445-F482 HydrophobicContact CB-CZ 4.04Å; F445-F482 HydrophobicContact CD1-CZ 4.33Å; F445-Y497 WeakPolarHBondContact CA-O 3.4Å; F445-A498 HydrophobicContact CD1-CB 3.85Å; F445-A498 HydrophobicContact CE1-CB 3.76Å; F445-S556 PolarHBondContact O-OG 3.25Å
446	T	95.5	Very high	85.9	Confident	42 Å²	42	59.4 Å²	59.4	26%	0.258	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	174.6	169.8	-168.7	0	0	0	0	109.9	Y497 F528	T446-Y497 HydrophobicContact CG2-CD2 4.18Å; T446-Y497 HydrophobicContact CG2-CG 4.26Å; T446-Y497 PolarHBondContact N-O 3.1Å; T446-Y497 PolarHBondContact O-N 3.47Å; T446-F528 HydrophobicContact CG2-CB 4.16Å; T446-F528 HydrophobicContact CG2-CD1 3.52Å; T446-F528 HydrophobicContact CG2-CD2 4.09Å; T446-F528 HydrophobicContact CG2-CE1 3.8Å; T446-F528 HydrophobicContact CG2-CE2 4.36Å; T446-F528 HydrophobicContact CG2-CG 3.66Å; T446-F528 HydrophobicContact CG2-CZ 4.21Å
447	F	98	Very high	86.2	Confident	10 Å²	10	59.3 Å²	59.3	4%	0.044	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	153.3	178.4	68.5	-81.8	0	0	0	111.8	L449 G469 Q471 F482 I484 L494 L495	F447-L449 HydrophobicContact CD2-CB 4.46Å; F447-L449 HydrophobicContact CE2-CB 4.45Å; F447-G469 VanDerWaalsContact CZ-CA 3.4Å; F447-Q471 HydrophobicContact CD1-CB 4.23Å; F447-Q471 HydrophobicContact CE1-CB 4.34Å; F447-F482 HydrophobicContact CB-CD1 3.97Å; F447-F482 HydrophobicContact CB-CE1 4Å; F447-F482 AromaticContact CD1-CD1 3.79Å; F447-F482 HydrophobicContact CD1-CD1 3.79Å; F447-F482 HydrophobicContact CD1-CE1 4.15Å; F447-F482 HydrophobicContact CG-CD1 4.11Å; F447-F482 HydrophobicContact CG-CE1 4.48Å; F447-I484 HydrophobicContact CD2-CD1 4.11Å; F447-I484 HydrophobicContact CE2-CD1 4Å; F447-L494 HydrophobicContact CB-CD1 3.99Å; F447-L494 HydrophobicContact CD2-CD1 3.93Å; F447-L494 HydrophobicContact CG-CD1 4.27Å; F447-L495 CarbonylContact C-O 3.58Å; F447-L495 WeakPolarHBondContact CA-O 3.38Å
448	G	97.4	Very high	86.8	Confident	19 Å²	19	62.4 Å²	62.4	20%	0.196	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	147.6	165	0	0	0	0	0	109.9	L495	G448-L495 PolarHBondContact N-O 3.15Å; G448-L495 PolarHBondContact O-N 3.42Å
449	L	98.1	Very high	87.8	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.016	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	125.7	177.1	-172	66.7	0	0	0	109.4	F447 L465 I484 K493 L494	F447-L449 HydrophobicContact CD2-CB 4.46Å; F447-L449 HydrophobicContact CE2-CB 4.45Å; L449-L465 HydrophobicContact CB-CB 4.09Å; L449-L465 HydrophobicContact CD2-CB 4.11Å; L449-L465 WeakPolarHBondContact CD2-O 3.35Å; L449-L465 HydrophobicContact CG-CB 4.11Å; L449-L465 WeakPolarHBondContact O-CB 3.39Å; L449-I484 HydrophobicContact CD1-CG2 4.21Å; L449-I484 HydrophobicContact CD2-CG2 3.78Å; L449-K493 WeakPolarHBondContact CA-O 3.43Å; L449-L494 HydrophobicContact CD1-CB 4.26Å; L449-L494 HydrophobicContact CD1-CD1 4.44Å
450	S	98	Very high	89.7	Confident	21 Å²	21	61 Å²	61	15%	0.147	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	158.4	176.9	60	0	0	0	0	111.6	G456 S457 Y492 K493	S450-G456 WeakPolarHBondContact CB-O 3.39Å; S450-S457 WeakPolarHBondContact CA-O 3.22Å; S450-Y492 CarbonylContact O-C 3.35Å; S450-Y492 VanDerWaalsContact O-CA 3.23Å; S450-Y492 WeakPolarHBondContact O-CA 3.27Å; S450-K493 PolarHBondContact N-O 2.97Å; S450-K493 PolarHBondContact O-N 2.88Å
451	F	97.8	Very high	92	Very high	12 Å²	12	62.3 Å²	62.3	5%	0.053	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	136.5	167.8	-75.3	-73.5	0	0	0	109.9	N453 S457 E459 F460 L465 P487 R488 Y492	F451-N453 PolarHBondContact O-N 3.07Å; F451-S457 WeakPolarHBondContact CD2-O 3.34Å; F451-S457 PolarHBondContact N-O 3.37Å; F451-E459 WeakPolarHBondContact CE2-O 3.5Å; F451-F460 HydrophobicContact CE2-CB 4.15Å; F451-F460 HydrophobicContact CE2-CD2 4.39Å; F451-F460 HydrophobicContact CZ-CB 4.08Å; F451-F460 AromaticContact CZ-CD2 3.81Å; F451-F460 HydrophobicContact CZ-CD2 3.81Å; F451-F460 HydrophobicContact CZ-CG 4.31Å; F451-L465 HydrophobicContact CD2-CD1 3.76Å; F451-L465 HydrophobicContact CE2-CD1 3.83Å; F451-L465 HydrophobicContact CE2-CD2 4.14Å; F451-L465 HydrophobicContact CE2-CG 4.32Å; F451-L465 HydrophobicContact CG-CD1 4.3Å; F451-L465 HydrophobicContact CZ-CD1 4.44Å; F451-L465 HydrophobicContact CZ-CD2 4.22Å; F451-P487 HydrophobicContact CZ-CG 4.4Å; F451-R488 HydrophobicContact CE1-CG 4.4Å; F451-Y492 HydrophobicContact CD1-CD1 4.04Å; F451-Y492 AromaticContact CD1-CE1 3.52Å; F451-Y492 HydrophobicContact CD1-CE1 3.52Å; F451-Y492 AromaticContact CD1-CZ 3.97Å; F451-Y492 HydrophobicContact CE1-CD1 4.25Å; F451-Y492 AromaticContact CE1-CE1 3.3Å; F451-Y492 HydrophobicContact CE1-CE1 3.3Å; F451-Y492 AromaticContact CE1-CZ 3.55Å; F451-Y492 WeakPolarHBondContact CE1-OH 3.47Å; F451-Y492 HydrophobicContact CG-CE1 4.36Å; F451-Y492 AromaticContact CZ-CE1 3.97Å; F451-Y492 HydrophobicContact CZ-CE1 3.97Å
452	D	95.9	Very high	93.9	Very high	31 Å²	31	62.1 Å²	62.1	17%	0.166	33%	0.326	C	S	.	.	S	Bend	trans	-86.9	71.1	174.8	-170.2	9	0	0	0	110.3	A491 K493 R535	D452-A491 HydrophobicContact CB-CB 3.76Å; D452-A491 PolarHBondContact N-O 2.89Å; D452-K493 HydrophobicContact CB-CG 3.95Å; D452-K493 WeakPolarHBondContact OD1-CE 3.48Å; D452-K493 IonicContact OD1-NZ 3.46Å; D452-R535 IonicContact OD1-NH1 3.91Å; D452-R535 WeakPolarHBondContact OD2-CD 3.33Å; D452-R535 WeakPolarHBondContact OD2-CG 3.41Å; D452-R535 IonicContact OD2-CZ 3.47Å; D452-R535 IonicContact OD2-NE 3.91Å; D452-R535 PolarHBondContact OD2-NE 2.79Å; D452-R535 VanDerWaalsContact OD2-NE 3.16Å; D452-R535 IonicContact OD2-NH1 3.58Å; D452-R535 PolarHBondContact OD2-NH1 2.92Å; D452-R535 IonicContact OD2-NH2 2.75Å; D452-R535 PolarHBondContact OD2-NH2 3.28Å
453	N	91.8	Very high	94.8	Very high	66 Å²	66	62.3 Å²	62.3	35%	0.353	33%	0.326	S	S	.	.	S	Bend	trans	-138.2	177.7	175.6	66.3	3.3	0	0	0	109.8	F451 E455 G456	F451-N453 PolarHBondContact O-N 3.07Å; N453-E455 PolarHBondContact O-N 3.32Å; N453-E455 PolarHBondContact OD1-N 3.16Å; N453-G456 PolarHBondContact O-N 2.95Å; N453-G456 PolarHBondContact OD1-N 3.24Å
454	Q	87.5	Confident	95.2	Very high	207 Å²	207	64.4 Å²	64.4	97%	0.967	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-31.2	-179.5	-68.7	-177.4	-8.3	0	0	113.2
455	E	89.1	Confident	95.6	Very high	163 Å²	163	63.3 Å²	63.3	76%	0.762	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-27.3	179.5	-65.8	174.5	175.3	0	0	112.6	N453 S457	N453-E455 PolarHBondContact O-N 3.32Å; N453-E455 PolarHBondContact OD1-N 3.16Å; E455-S457 PolarHBondContact O-N 3.25Å
456	G	92	Very high	95.7	Very high	30 Å²	30	65.5 Å²	65.5	31%	0.309	35%	0.347	S	S	.	.			trans	60	26.4	-179.4	0	0	0	0	0	113.8	S450 N453 E458	S450-G456 WeakPolarHBondContact CB-O 3.39Å; N453-G456 PolarHBondContact O-N 2.95Å; N453-G456 PolarHBondContact OD1-N 3.24Å; G456-E458 PolarHBondContact O-N 3.41Å
457	S	96.1	Very high	95.8	Very high	35 Å²	35	66.2 Å²	66.2	25%	0.245	35%	0.345	C	S	.	.			trans	-57.1	136	-172	175.3	0	0	0	0	112	S450 F451 E455 E459 L465	S450-S457 WeakPolarHBondContact CA-O 3.22Å; F451-S457 WeakPolarHBondContact CD2-O 3.34Å; F451-S457 PolarHBondContact N-O 3.37Å; E455-S457 PolarHBondContact O-N 3.25Å; S457-E459 PolarHBondContact OG-N 3.08Å; S457-E459 PolarHBondContact OG-O 3.23Å; S457-L465 WeakPolarHBondContact O-CD1 3.49Å
458	E	97.3	Very high	95.8	Very high	137 Å²	137	66.1 Å²	66.1	64%	0.64	35%	0.345	S	S	*	.			trans	-97.7	10.4	178.1	-62.1	-174.7	167.8	0	0	112.1	G456 P464 L465	G456-E458 PolarHBondContact O-N 3.41Å; E458-P464 CarbonylContact O-C 3.59Å; E458-P464 WeakPolarHBondContact O-CA 3.42Å; E458-L465 WeakPolarHBondContact O-CB 3.28Å; E458-L465 PolarHBondContact O-N 3.32Å
459	E	97.3	Very high	95.9	Very high	113 Å²	113	65.3 Å²	65.3	53%	0.528	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.8	-178.8	61	167.6	-147.8	0	0	113.3	F451 S457 I463	F451-E459 WeakPolarHBondContact CE2-O 3.5Å; S457-E459 PolarHBondContact OG-N 3.08Å; S457-E459 PolarHBondContact OG-O 3.23Å; E459-I463 CarbonylContact C-O 3.58Å; E459-I463 WeakPolarHBondContact CA-O 3.4Å
460	F	96.4	Very high	95.9	Very high	36 Å²	36	65.7 Å²	65.7	16%	0.158	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	114.3	172.4	178.8	-107.6	0	0	0	109.6	F451 G462 I463 L465 F468 P487 R488	F451-F460 HydrophobicContact CE2-CB 4.15Å; F451-F460 HydrophobicContact CE2-CD2 4.39Å; F451-F460 HydrophobicContact CZ-CB 4.08Å; F451-F460 AromaticContact CZ-CD2 3.81Å; F451-F460 HydrophobicContact CZ-CD2 3.81Å; F451-F460 HydrophobicContact CZ-CG 4.31Å; F460-G462 VanDerWaalsContact C-N 3.28Å; F460-G462 PolarHBondContact O-N 3.18Å; F460-I463 PolarHBondContact N-O 2.82Å; F460-I463 WeakPolarHBondContact O-CB 3.37Å; F460-I463 PolarHBondContact O-N 2.92Å; F460-L465 HydrophobicContact CB-CD2 3.95Å; F460-F468 HydrophobicContact CD1-CZ 4.26Å; F460-P487 HydrophobicContact CB-CB 4.35Å; F460-P487 HydrophobicContact CB-CG 4.02Å; F460-P487 HydrophobicContact CD1-CB 3.45Å; F460-P487 VanDerWaalsContact CD1-CB 3.45Å; F460-P487 HydrophobicContact CD1-CG 4.04Å; F460-P487 HydrophobicContact CD2-CG 4.47Å; F460-P487 HydrophobicContact CE1-CB 3.74Å; F460-P487 HydrophobicContact CG-CB 3.86Å; F460-P487 HydrophobicContact CG-CG 3.92Å; F460-P487 HydrophobicContact CZ-CB 4.39Å; F460-R488 HydrophobicContact CE2-CG 4.33Å
461	R	95.7	Very high	95.8	Very high	220 Å²	220	65 Å²	65	83%	0.83	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	42.4	-178.7	-56.9	-179.5	177.8	-179.9	-0.2	112.7	I463	R461-I463 PolarHBondContact O-N 3.4Å
462	G	96.2	Very high	95.7	Very high	57 Å²	57	64.8 Å²	64.8	59%	0.588	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	6.1	-178.7	0	0	0	0	0	115.1	F460	F460-G462 VanDerWaalsContact C-N 3.28Å; F460-G462 PolarHBondContact O-N 3.18Å
463	I	96.8	Very high	95.5	Very high	56 Å²	56	65.3 Å²	65.3	29%	0.287	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.6	174.3	-56.6	176.7	0	0	0	108.3	E459 F460 R461 L465 R467 F468	E459-I463 CarbonylContact C-O 3.58Å; E459-I463 WeakPolarHBondContact CA-O 3.4Å; F460-I463 PolarHBondContact N-O 2.82Å; F460-I463 WeakPolarHBondContact O-CB 3.37Å; F460-I463 PolarHBondContact O-N 2.92Å; R461-I463 PolarHBondContact O-N 3.4Å; I463-L465 PolarHBondContact O-N 2.84Å; I463-R467 HydrophobicContact CG2-CB 3.76Å; I463-R467 HydrophobicContact CG2-CG 3.96Å; I463-F468 HydrophobicContact CB-CE2 4.18Å; I463-F468 HydrophobicContact CG2-CE2 3.79Å; I463-F468 HydrophobicContact CG2-CZ 4.48Å
464	P	97.8	Very high	95.5	Very high	66 Å²	66	63.8 Å²	63.8	43%	0.429	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	135.2	173.6	-26	34.6	0	0	0	111.6	E458 T466 R467	E458-P464 CarbonylContact O-C 3.59Å; E458-P464 WeakPolarHBondContact O-CA 3.42Å; P464-T466 PolarHBondContact O-N 3.05Å; P464-R467 WeakPolarHBondContact O-CB 3.33Å; P464-R467 PolarHBondContact O-N 3.48Å
465	L	98.3	Very high	95.4	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-62.8	-23.9	-179.3	-78.4	179.8	0	0	0	112.5	L449 F451 S457 E458 F460 I463 R467 F468 P487 Y492	L449-L465 HydrophobicContact CB-CB 4.09Å; L449-L465 HydrophobicContact CD2-CB 4.11Å; L449-L465 WeakPolarHBondContact CD2-O 3.35Å; L449-L465 HydrophobicContact CG-CB 4.11Å; L449-L465 WeakPolarHBondContact O-CB 3.39Å; F451-L465 HydrophobicContact CD2-CD1 3.76Å; F451-L465 HydrophobicContact CE2-CD1 3.83Å; F451-L465 HydrophobicContact CE2-CD2 4.14Å; F451-L465 HydrophobicContact CE2-CG 4.32Å; F451-L465 HydrophobicContact CG-CD1 4.3Å; F451-L465 HydrophobicContact CZ-CD1 4.44Å; F451-L465 HydrophobicContact CZ-CD2 4.22Å; S457-L465 WeakPolarHBondContact O-CD1 3.49Å; E458-L465 WeakPolarHBondContact O-CB 3.28Å; E458-L465 PolarHBondContact O-N 3.32Å; F460-L465 HydrophobicContact CB-CD2 3.95Å; I463-L465 PolarHBondContact O-N 2.84Å; L465-R467 PolarHBondContact O-N 2.87Å; L465-F468 HydrophobicContact CD2-CD2 4.21Å; L465-F468 WeakPolarHBondContact O-CA 3.2Å; L465-F468 WeakPolarHBondContact O-CB 3.18Å; L465-F468 PolarHBondContact O-N 2.8Å; L465-P487 HydrophobicContact CD2-CG 3.64Å; L465-Y492 HydrophobicContact CD1-CD1 4.4Å; L465-Y492 HydrophobicContact CD1-CE1 4.44Å; L465-Y492 HydrophobicContact CD2-CE1 4.3Å
466	T	97.5	Very high	95.3	Very high	51 Å²	51	61.7 Å²	61.7	31%	0.313	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-57.2	-27.9	170.3	51	0	0	0	0	112.8	P464 F468 G469 S555	P464-T466 PolarHBondContact O-N 3.05Å; T466-F468 PolarHBondContact O-N 2.79Å; T466-G469 PolarHBondContact O-N 3.29Å; T466-S555 PolarHBondContact O-OG 2.87Å
467	R	97.5	Very high	95.3	Very high	58 Å²	58	66.1 Å²	66.1	22%	0.219	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-66.4	-17.4	172.6	-69.9	-70.1	-50.8	-64.4	-10.2	114.1	I463 P464 L465 G469 P548 F549	I463-R467 HydrophobicContact CG2-CB 3.76Å; I463-R467 HydrophobicContact CG2-CG 3.96Å; P464-R467 WeakPolarHBondContact O-CB 3.33Å; P464-R467 PolarHBondContact O-N 3.48Å; L465-R467 PolarHBondContact O-N 2.87Å; R467-G469 VanDerWaalsContact C-N 3.33Å; R467-P548 HydrophobicContact CB-CB 4.03Å; R467-P548 WeakPolarHBondContact O-CA 3.34Å; R467-P548 VanDerWaalsContact O-CB 3.26Å; R467-P548 WeakPolarHBondContact O-CB 3.48Å; R467-F549 PolarHBondContact NE-O 2.82Å; R467-F549 PolarHBondContact NH2-O 3.16Å; R467-F549 PolarHBondContact O-N 3.44Å
468	F	98.2	Very high	95.1	Very high	8 Å²	8	67.6 Å²	67.6	4%	0.035	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-93.9	4.8	175	-67.9	-88.6	0	0	0	112.1	F460 I463 L465 T466 I484 R485 P487 P548	F460-F468 HydrophobicContact CD1-CZ 4.26Å; I463-F468 HydrophobicContact CB-CE2 4.18Å; I463-F468 HydrophobicContact CG2-CE2 3.79Å; I463-F468 HydrophobicContact CG2-CZ 4.48Å; L465-F468 HydrophobicContact CD2-CD2 4.21Å; L465-F468 WeakPolarHBondContact O-CA 3.2Å; L465-F468 WeakPolarHBondContact O-CB 3.18Å; L465-F468 PolarHBondContact O-N 2.8Å; T466-F468 PolarHBondContact O-N 2.79Å; F468-I484 CarbonylContact O-C 3.54Å; F468-R485 WeakPolarHBondContact CB-O 3.41Å; F468-R485 VanDerWaalsContact CD1-O 3.31Å; F468-R485 WeakPolarHBondContact CD1-O 3.4Å; F468-R485 PolarHBondContact O-N 3.28Å; F468-P487 HydrophobicContact CD1-CB 3.89Å; F468-P487 HydrophobicContact CD1-CG 4.37Å; F468-P487 HydrophobicContact CD2-CG 4.45Å; F468-P487 HydrophobicContact CE1-CB 3.58Å; F468-P487 HydrophobicContact CE1-CG 4.43Å; F468-P487 HydrophobicContact CE2-CB 4.24Å; F468-P487 HydrophobicContact CE2-CG 4.48Å; F468-P487 HydrophobicContact CG-CB 4.35Å; F468-P487 HydrophobicContact CG-CG 4.38Å; F468-P487 HydrophobicContact CZ-CB 3.76Å; F468-P487 HydrophobicContact CZ-CG 4.47Å; F468-P548 HydrophobicContact CD1-CB 3.94Å; F468-P548 HydrophobicContact CD2-CB 4.27Å; F468-P548 HydrophobicContact CE1-CB 3.76Å; F468-P548 HydrophobicContact CE1-CG 4.06Å; F468-P548 HydrophobicContact CE2-CB 4.14Å; F468-P548 HydrophobicContact CG-CB 4.2Å; F468-P548 HydrophobicContact CZ-CB 3.87Å; F468-P548 HydrophobicContact CZ-CG 3.98Å
469	G	98.2	Very high	95	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	159.6	168.3	0	0	0	0	0	111.6	F447 T466 R467 Y483 F549	F447-G469 VanDerWaalsContact CZ-CA 3.4Å; T466-G469 PolarHBondContact O-N 3.29Å; R467-G469 VanDerWaalsContact C-N 3.33Å; G469-Y483 CarbonylContact C-O 3.46Å; G469-Y483 WeakPolarHBondContact CA-O 3.3Å; G469-F549 VanDerWaalsContact C-CD2 3.46Å; G469-F549 WeakPolarHBondContact O-CD2 3.29Å
470	R	97.6	Very high	94.9	Very high	12 Å²	12	56.3 Å²	56.3	5%	0.045	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.5	162.3	68.4	175.4	-174.9	112.2	-1.5	110.2	E472 F482 Y483 F549 S555 Y557 T576	R470-E472 IonicContact CZ-OE2 2.93Å; R470-E472 IonicContact NH1-OE2 2.71Å; R470-E472 PolarHBondContact NH1-OE2 2.99Å; R470-E472 IonicContact NH2-OE2 3.8Å; R470-F482 CarbonylContact O-C 3.58Å; R470-F482 WeakPolarHBondContact O-CA 3.37Å; R470-Y483 HydrophobicContact CG-CD2 3.91Å; R470-Y483 HydrophobicContact CG-CG 4.32Å; R470-Y483 PolarHBondContact N-O 3.36Å; R470-Y483 PolarHBondContact O-N 3.33Å; R470-F549 HydrophobicContact CB-CD1 4.46Å; R470-F549 HydrophobicContact CB-CD2 4.01Å; R470-F549 HydrophobicContact CB-CE2 4.15Å; R470-F549 HydrophobicContact CB-CG 4.17Å; R470-F549 HydrophobicContact CB-CZ 4.42Å; R470-F549 HydrophobicContact CG-CD1 4.09Å; R470-F549 HydrophobicContact CG-CD2 4.12Å; R470-F549 HydrophobicContact CG-CE1 3.76Å; R470-F549 HydrophobicContact CG-CE2 3.82Å; R470-F549 HydrophobicContact CG-CG 4.25Å; R470-F549 HydrophobicContact CG-CZ 3.63Å; R470-S555 CarbonylContact C-O 3.5Å; R470-S555 VanDerWaalsContact CA-O 3.3Å; R470-S555 WeakPolarHBondContact CA-O 3.49Å; R470-Y557 HydrophobicContact CB-CD2 3.8Å; R470-Y557 HydrophobicContact CB-CE2 3.64Å; R470-T576 PolarHBondContact NH1-OG1 3.28Å; R470-T576 VanDerWaalsContact NH1-OG1 3.09Å; R470-T576 PolarHBondContact NH2-OG1 2.82Å; R470-T576 VanDerWaalsContact NH2-OG1 3.1Å
471	Q	97.5	Very high	95	Very high	5 Å²	5	54.6 Å²	54.6	2%	0.023	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	139.3	175.3	-179.3	-83.3	-38.8	0	0	109	F445 F447 T473 S480 V481 F482 S555 S556 Y557	F445-Q471 HydrophobicContact CB-CG 4.17Å; F445-Q471 PolarHBondContact O-OE1 2.84Å; F447-Q471 HydrophobicContact CD1-CB 4.23Å; F447-Q471 HydrophobicContact CE1-CB 4.34Å; Q471-T473 PolarHBondContact NE2-OG1 2.84Å; Q471-S480 PolarHBondContact NE2-OG 3.45Å; Q471-V481 CarbonylContact C-O 3.58Å; Q471-V481 VanDerWaalsContact CA-O 3.25Å; Q471-V481 WeakPolarHBondContact CA-O 3.41Å; Q471-F482 HydrophobicContact CB-CD1 3.88Å; Q471-F482 HydrophobicContact CB-CE1 3.95Å; Q471-F482 HydrophobicContact CG-CD1 3.82Å; Q471-F482 HydrophobicContact CG-CE1 3.48Å; Q471-F482 VanDerWaalsContact CG-CE1 3.48Å; Q471-F482 HydrophobicContact CG-CG 4.49Å; Q471-F482 HydrophobicContact CG-CZ 3.89Å; Q471-S555 PolarHBondContact N-O 2.92Å; Q471-S556 CarbonylContact O-C 3.53Å; Q471-S556 WeakPolarHBondContact O-CA 3.31Å; Q471-S556 VanDerWaalsContact OE1-CB 3.29Å; Q471-S556 PolarHBondContact OE1-OG 3.06Å; Q471-Y557 PolarHBondContact O-N 3.44Å
472	E	95.2	Very high	95.1	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.037	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	149.4	169.3	72.2	-170.1	175.8	0	0	110	R470 L474 V481 Y483 C575 T576	R470-E472 IonicContact CZ-OE2 2.93Å; R470-E472 IonicContact NH1-OE2 2.71Å; R470-E472 PolarHBondContact NH1-OE2 2.99Å; R470-E472 IonicContact NH2-OE2 3.8Å; E472-L474 HydrophobicContact CG-CD2 4.13Å; E472-V481 HydrophobicContact CG-CB 4.25Å; E472-V481 PolarHBondContact N-O 3.19Å; E472-V481 PolarHBondContact O-N 2.86Å; E472-Y483 HydrophobicContact CG-CE2 3.98Å; E472-Y483 WeakPolarHBondContact OE1-CE2 3.28Å; E472-Y483 VanDerWaalsContact OE1-CZ 3.3Å; E472-Y483 PolarHBondContact OE1-OH 2.72Å; E472-C575 HydrophobicContact CB-CB 3.91Å; E472-C575 WeakPolarHBondContact OE2-CB 3.44Å; E472-T576 PolarHBondContact OE2-OG1 2.72Å; E472-T576 VanDerWaalsContact OE2-OG1 3.08Å
473	T	92.7	Very high	95.2	Very high	42 Å²	42	42.8 Å²	42.8	26%	0.258	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	114.1	177.9	-59.4	0	0	0	0	109.5	F435 Q471 I475	F435-T473 HydrophobicContact CE1-CG2 3.87Å; F435-T473 HydrophobicContact CZ-CG2 3.72Å; Q471-T473 PolarHBondContact NE2-OG1 2.84Å; T473-I475 HydrophobicContact CG2-CG1 4.36Å; T473-I475 PolarHBondContact O-N 2.86Å
474	L	91.8	Very high	95.3	Very high	34 Å²	34	40.1 Å²	40.1	18%	0.178	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	88.5	175.3	-56.4	-174.4	0	0	0	109.1	E472 R476 E477 H478 T479 V481	E472-L474 HydrophobicContact CG-CD2 4.13Å; L474-R476 VanDerWaalsContact C-N 3.31Å; L474-R476 PolarHBondContact O-N 2.84Å; L474-E477 HydrophobicContact CB-CB 4.02Å; L474-E477 HydrophobicContact CB-CG 4.41Å; L474-E477 WeakPolarHBondContact CD1-OE2 3.43Å; L474-E477 CarbonylContact O-C 3.54Å; L474-E477 PolarHBondContact O-N 2.94Å; L474-H478 PolarHBondContact O-N 2.75Å; L474-T479 PolarHBondContact N-O 3.38Å; L474-T479 PolarHBondContact O-N 2.72Å; L474-V481 HydrophobicContact CD1-CG2 3.64Å; L474-V481 HydrophobicContact CG-CG2 3.87Å
475	I	84.7	Confident	95.3	Very high	107 Å²	107	37.4 Å²	37.4	55%	0.549	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-57.3	-41.7	-171.9	-63	168.2	0	0	0	112.1	T473 E477 H478	T473-I475 HydrophobicContact CG2-CG1 4.36Å; T473-I475 PolarHBondContact O-N 2.86Å; I475-E477 VanDerWaalsContact C-N 3.27Å; I475-E477 PolarHBondContact O-N 2.99Å; I475-H478 PolarHBondContact O-N 3.18Å; I475-H478 PolarHBondContact O-ND1 3Å
476	R	87.6	Confident	95.3	Very high	219 Å²	219	37.4 Å²	37.4	83%	0.826	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-67.9	-27.3	179.8	-65.9	179.5	-178.2	-102.5	0.9	113.3	L474	L474-R476 VanDerWaalsContact C-N 3.31Å; L474-R476 PolarHBondContact O-N 2.84Å
477	E	91	Very high	95.3	Very high	124 Å²	124	35.5 Å²	35.5	58%	0.579	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-98.6	-0.6	-179.2	-63.5	177.9	-155.2	0	0	112.1	L474 I475 T479	L474-E477 HydrophobicContact CB-CB 4.02Å; L474-E477 HydrophobicContact CB-CG 4.41Å; L474-E477 WeakPolarHBondContact CD1-OE2 3.43Å; L474-E477 CarbonylContact O-C 3.54Å; L474-E477 PolarHBondContact O-N 2.94Å; I475-E477 VanDerWaalsContact C-N 3.27Å; I475-E477 PolarHBondContact O-N 2.99Å; E477-T479 PolarHBondContact O-N 2.87Å; E477-T479 PolarHBondContact O-OG1 3.13Å
478	H	92.1	Very high	95.2	Very high	66 Å²	66	37.4 Å²	37.4	31%	0.306	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	45.1	-174.6	-55	-72.4	0	0	0	112.9	A434 F435 S437 L474 I475	A434-H478 WeakPolarHBondContact CA-O 3.48Å; F435-H478 WeakPolarHBondContact CD1-O 3.3Å; F435-H478 HydrophobicContact CD2-CB 4.03Å; F435-H478 HydrophobicContact CE2-CB 3.82Å; F435-H478 WeakPolarHBondContact CG-O 3.09Å; F435-H478 HydrophobicContact CZ-CB 4.33Å; F435-H478 PolarHBondContact N-O 2.85Å; F435-H478 WeakPolarHBondContact O-CB 3.4Å; S437-H478 WeakPolarHBondContact CB-NE2 3.39Å; L474-H478 PolarHBondContact O-N 2.75Å; I475-H478 PolarHBondContact O-N 3.18Å; I475-H478 PolarHBondContact O-ND1 3Å
479	T	94.9	Very high	95.1	Very high	13 Å²	13	38.8 Å²	38.8	8%	0.08	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	133.1	-171.4	-64.2	0	0	0	0	111.2	A432 I433 F435 L474 E477 V481	A432-T479 HydrophobicContact CB-CG2 3.7Å; I433-T479 CarbonylContact O-C 3.48Å; I433-T479 WeakPolarHBondContact O-CA 3.26Å; F435-T479 VanDerWaalsContact CE1-C 3.46Å; F435-T479 VanDerWaalsContact CE1-N 3.29Å; L474-T479 PolarHBondContact N-O 3.38Å; L474-T479 PolarHBondContact O-N 2.72Å; E477-T479 PolarHBondContact O-N 2.87Å; E477-T479 PolarHBondContact O-OG1 3.13Å; T479-V481 HydrophobicContact CG2-CG2 3.86Å
480	S	96	Very high	95	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.4	168.5	-172.9	0	0	0	0	109.5	A432 I433 F445 Q471	A432-S480 WeakPolarHBondContact CA-O 3.31Å; I433-S480 PolarHBondContact N-O 2.85Å; I433-S480 PolarHBondContact O-N 3.17Å; F445-S480 WeakPolarHBondContact CB-OG 3.46Å; F445-S480 WeakPolarHBondContact CD2-OG 3.36Å; F445-S480 VanDerWaalsContact CG-OG 3.27Å; F445-S480 WeakPolarHBondContact CG-OG 3.47Å; Q471-S480 PolarHBondContact NE2-OG 3.45Å
481	V	98	Very high	95	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133	-172.4	-173.6	0	0	0	0	110.1	R430 I431 A432 Q471 E472 L474 T479 Y483	R430-V481 HydrophobicContact CG-CG1 3.59Å; I431-V481 CarbonylContact O-C 3.52Å; I431-V481 WeakPolarHBondContact O-CA 3.35Å; A432-V481 HydrophobicContact CB-CG2 4.29Å; Q471-V481 CarbonylContact C-O 3.58Å; Q471-V481 VanDerWaalsContact CA-O 3.25Å; Q471-V481 WeakPolarHBondContact CA-O 3.41Å; E472-V481 HydrophobicContact CG-CB 4.25Å; E472-V481 PolarHBondContact N-O 3.19Å; E472-V481 PolarHBondContact O-N 2.86Å; L474-V481 HydrophobicContact CD1-CG2 3.64Å; L474-V481 HydrophobicContact CG-CG2 3.87Å; T479-V481 HydrophobicContact CG2-CG2 3.86Å; V481-Y483 HydrophobicContact CB-CE2 4.14Å; V481-Y483 HydrophobicContact CG1-CD2 4.16Å; V481-Y483 HydrophobicContact CG1-CE1 4.31Å; V481-Y483 HydrophobicContact CG1-CE2 3.49Å; V481-Y483 VanDerWaalsContact CG1-CE2 3.49Å
482	F	98.5	Very high	95.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.6	-179.6	-55.2	-98.7	0	0	0	109	R430 I431 I433 F445 F447 R470 Q471 I496	R430-F482 CarbonylContact C-O 3.51Å; R430-F482 WeakPolarHBondContact CA-O 3.31Å; I431-F482 HydrophobicContact CB-CB 4.39Å; I431-F482 PolarHBondContact N-O 2.79Å; I431-F482 PolarHBondContact O-N 2.84Å; I433-F482 HydrophobicContact CG1-CE2 4.01Å; F445-F482 HydrophobicContact CB-CZ 4.04Å; F445-F482 HydrophobicContact CD1-CZ 4.33Å; F447-F482 HydrophobicContact CB-CD1 3.97Å; F447-F482 HydrophobicContact CB-CE1 4Å; F447-F482 AromaticContact CD1-CD1 3.79Å; F447-F482 HydrophobicContact CD1-CD1 3.79Å; F447-F482 HydrophobicContact CD1-CE1 4.15Å; F447-F482 HydrophobicContact CG-CD1 4.11Å; F447-F482 HydrophobicContact CG-CE1 4.48Å; R470-F482 CarbonylContact O-C 3.58Å; R470-F482 WeakPolarHBondContact O-CA 3.37Å; Q471-F482 HydrophobicContact CB-CD1 3.88Å; Q471-F482 HydrophobicContact CB-CE1 3.95Å; Q471-F482 HydrophobicContact CG-CD1 3.82Å; Q471-F482 HydrophobicContact CG-CE1 3.48Å; Q471-F482 VanDerWaalsContact CG-CE1 3.48Å; Q471-F482 HydrophobicContact CG-CG 4.49Å; Q471-F482 HydrophobicContact CG-CZ 3.89Å; F482-I496 HydrophobicContact CD2-CD1 3.9Å; F482-I496 HydrophobicContact CE1-CG1 4.33Å; F482-I496 HydrophobicContact CE1-CG2 4.01Å; F482-I496 HydrophobicContact CE2-CD1 3.89Å; F482-I496 HydrophobicContact CE2-CG1 4.41Å; F482-I496 HydrophobicContact CE2-CG2 3.91Å; F482-I496 HydrophobicContact CG-CD1 4.3Å; F482-I496 HydrophobicContact CZ-CB 4.46Å; F482-I496 HydrophobicContact CZ-CD1 4.25Å; F482-I496 HydrophobicContact CZ-CG1 4.28Å; F482-I496 HydrophobicContact CZ-CG2 3.42Å; F482-I496 VanDerWaalsContact CZ-CG2 3.42Å
483	Y	98.5	Very high	95.2	Very high	28 Å²	28	42.8 Å²	42.8	11%	0.11	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	120.4	174	-56.3	-98.7	0	0	0	107.9	V429 R430 G469 R470 E472 V481 F549	V429-Y483 CarbonylContact O-C 3.53Å; V429-Y483 VanDerWaalsContact O-CA 3.3Å; V429-Y483 WeakPolarHBondContact O-CA 3.49Å; R430-Y483 HydrophobicContact CB-CD1 4.27Å; R430-Y483 HydrophobicContact CB-CE1 4.31Å; R430-Y483 HydrophobicContact CG-CD1 4.17Å; R430-Y483 HydrophobicContact CG-CE1 3.82Å; G469-Y483 CarbonylContact C-O 3.46Å; G469-Y483 WeakPolarHBondContact CA-O 3.3Å; R470-Y483 HydrophobicContact CG-CD2 3.91Å; R470-Y483 HydrophobicContact CG-CG 4.32Å; R470-Y483 PolarHBondContact N-O 3.36Å; R470-Y483 PolarHBondContact O-N 3.33Å; E472-Y483 HydrophobicContact CG-CE2 3.98Å; E472-Y483 WeakPolarHBondContact OE1-CE2 3.28Å; E472-Y483 VanDerWaalsContact OE1-CZ 3.3Å; E472-Y483 PolarHBondContact OE1-OH 2.72Å; V481-Y483 HydrophobicContact CB-CE2 4.14Å; V481-Y483 HydrophobicContact CG1-CD2 4.16Å; V481-Y483 HydrophobicContact CG1-CE1 4.31Å; V481-Y483 HydrophobicContact CG1-CE2 3.49Å; V481-Y483 VanDerWaalsContact CG1-CE2 3.49Å; Y483-F549 WeakPolarHBondContact O-CE2 3.34Å
484	I	98.6	Very high	95.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.1	-178.3	-49.9	-61.4	0	0	0	109.2	E428 V429 I431 F447 L449 F468 P486 L494 L536	E428-I484 CarbonylContact C-O 3.53Å; E428-I484 VanDerWaalsContact CA-O 3.3Å; E428-I484 WeakPolarHBondContact CA-O 3.33Å; V429-I484 HydrophobicContact CG1-CB 3.66Å; V429-I484 HydrophobicContact CG1-CG1 4.32Å; V429-I484 PolarHBondContact N-O 3.28Å; V429-I484 PolarHBondContact O-N 3.18Å; I431-I484 HydrophobicContact CD1-CG1 3.98Å; F447-I484 HydrophobicContact CD2-CD1 4.11Å; F447-I484 HydrophobicContact CE2-CD1 4Å; L449-I484 HydrophobicContact CD1-CG2 4.21Å; L449-I484 HydrophobicContact CD2-CG2 3.78Å; F468-I484 CarbonylContact O-C 3.54Å; I484-P486 WeakPolarHBondContact O-CD 3.3Å; I484-L494 HydrophobicContact CD1-CD1 3.9Å; I484-L494 HydrophobicContact CG1-CD1 4.27Å; I484-L494 HydrophobicContact CG1-CD2 4.15Å; I484-L536 HydrophobicContact CB-CD2 4.3Å; I484-L536 HydrophobicContact CG2-CD2 3.84Å
485	R	97.7	Very high	95.7	Very high	10 Å²	10	41.1 Å²	41.1	4%	0.038	20%	0.195	C	C	.	.			trans	-116.3	82.5	179.7	-67.6	177.1	175.6	175.8	2.2	110.6	P427 E428 F468 P487 L546 P547 F549 E641	P427-R485 WeakPolarHBondContact O-CA 3.38Å; E428-R485 HydrophobicContact CB-CG 4.11Å; E428-R485 HydrophobicContact CG-CG 3.95Å; E428-R485 IonicContact OE2-CZ 3.72Å; E428-R485 VanDerWaalsContact OE2-CZ 3.24Å; E428-R485 IonicContact OE2-NE 3.41Å; E428-R485 PolarHBondContact OE2-NE 3.36Å; E428-R485 IonicContact OE2-NH2 3.64Å; E428-R485 PolarHBondContact OE2-NH2 3.2Å; F468-R485 WeakPolarHBondContact CB-O 3.41Å; F468-R485 VanDerWaalsContact CD1-O 3.31Å; F468-R485 WeakPolarHBondContact CD1-O 3.4Å; F468-R485 PolarHBondContact O-N 3.28Å; R485-P487 WeakPolarHBondContact O-CD 3.17Å; R485-P487 VanDerWaalsContact O-N 3.12Å; R485-L546 HydrophobicContact CB-CB 4.46Å; R485-L546 HydrophobicContact CG-CB 4.29Å; R485-L546 HydrophobicContact CG-CD1 4.25Å; R485-P547 PolarHBondContact NH1-O 2.96Å; R485-F549 HydrophobicContact CG-CE2 3.9Å; R485-F549 HydrophobicContact CG-CZ 3.94Å; R485-F549 VanDerWaalsContact NH2-CE1 3.25Å; R485-E641 IonicContact CZ-OE1 3.97Å; R485-E641 IonicContact CZ-OE2 3.8Å; R485-E641 IonicContact NH1-OE1 3.78Å; R485-E641 IonicContact NH1-OE2 2.79Å; R485-E641 PolarHBondContact NH1-OE2 2.81Å; R485-E641 IonicContact NH2-OE1 3.68Å; R485-E641 PolarHBondContact NH2-OE1 3.26Å; R485-E641 IonicContact NH2-OE2 3.68Å; R485-E641 PolarHBondContact NH2-OE2 3.49Å
486	P	98	Very high	96.3	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.169	C	C	.	.			trans	-52.5	122.7	-178.2	-26.9	36	0	0	0	111.4	I484 R488 Y492 L536 A538 F540	I484-P486 WeakPolarHBondContact O-CD 3.3Å; P486-R488 PolarHBondContact O-N 2.89Å; P486-Y492 HydrophobicContact CB-CD2 4.14Å; P486-Y492 HydrophobicContact CB-CE2 3.62Å; P486-Y492 HydrophobicContact CG-CE2 4.49Å; P486-L536 HydrophobicContact CG-CD2 3.65Å; P486-A538 HydrophobicContact CB-CB 3.66Å; P486-A538 HydrophobicContact CG-CB 3.84Å; P486-F540 HydrophobicContact CB-CE1 4.42Å; P486-F540 HydrophobicContact CB-CZ 4.05Å; P486-F540 HydrophobicContact CG-CE1 4.45Å
487	P	96.7	Very high	96.7	Very high	10 Å²	10	28.8 Å²	28.8	7%	0.065	14%	0.142	C	C	.	.	S	Bend	trans	-64.6	-16.1	-173.7	19.9	-31.8	0	0	0	113.9	F451 F460 L465 F468 R485 Y492 S545	F451-P487 HydrophobicContact CZ-CG 4.4Å; F460-P487 HydrophobicContact CB-CB 4.35Å; F460-P487 HydrophobicContact CB-CG 4.02Å; F460-P487 HydrophobicContact CD1-CB 3.45Å; F460-P487 VanDerWaalsContact CD1-CB 3.45Å; F460-P487 HydrophobicContact CD1-CG 4.04Å; F460-P487 HydrophobicContact CD2-CG 4.47Å; F460-P487 HydrophobicContact CE1-CB 3.74Å; F460-P487 HydrophobicContact CG-CB 3.86Å; F460-P487 HydrophobicContact CG-CG 3.92Å; F460-P487 HydrophobicContact CZ-CB 4.39Å; L465-P487 HydrophobicContact CD2-CG 3.64Å; F468-P487 HydrophobicContact CD1-CB 3.89Å; F468-P487 HydrophobicContact CD1-CG 4.37Å; F468-P487 HydrophobicContact CD2-CG 4.45Å; F468-P487 HydrophobicContact CE1-CB 3.58Å; F468-P487 HydrophobicContact CE1-CG 4.43Å; F468-P487 HydrophobicContact CE2-CB 4.24Å; F468-P487 HydrophobicContact CE2-CG 4.48Å; F468-P487 HydrophobicContact CG-CB 4.35Å; F468-P487 HydrophobicContact CG-CG 4.38Å; F468-P487 HydrophobicContact CZ-CB 3.76Å; F468-P487 HydrophobicContact CZ-CG 4.47Å; R485-P487 WeakPolarHBondContact O-CD 3.17Å; R485-P487 VanDerWaalsContact O-N 3.12Å; P487-Y492 WeakPolarHBondContact CD-OH 3.29Å; P487-Y492 HydrophobicContact CG-CE1 4.22Å; P487-S545 WeakPolarHBondContact O-CB 3.32Å; P487-S545 PolarHBondContact O-OG 3.34Å; P487-S545 VanDerWaalsContact O-OG 3.04Å
488	R	96.2	Very high	96.9	Very high	99 Å²	99	22.9 Å²	22.9	37%	0.374	11%	0.114	S	C	.	.	S	Bend	trans	-156.8	166.8	174.4	60.4	175	-177	86.3	-5.1	109.3	F451 F460 P486 Y492 S545	F451-R488 HydrophobicContact CE1-CG 4.4Å; F460-R488 HydrophobicContact CE2-CG 4.33Å; P486-R488 PolarHBondContact O-N 2.89Å; R488-Y492 WeakPolarHBondContact CG-OH 3.15Å; R488-Y492 PolarHBondContact N-OH 2.81Å; R488-Y492 PolarHBondContact O-OH 2.82Å; R488-S545 WeakPolarHBondContact CA-OG 3.43Å
489	P	96.6	Very high	96.7	Very high	37 Å²	37	20.4 Å²	20.4	24%	0.24	10%	0.103	C	C	.	.	S	Bend	trans	-61.6	146.9	169.2	-21.2	35.4	0	0	0	110.9	A538 F540	P489-A538 WeakPolarHBondContact CA-O 3.42Å; P489-F540 WeakPolarHBondContact CB-O 3.44Å; P489-F540 HydrophobicContact CG-CD2 4.14Å; P489-F540 HydrophobicContact CG-CE2 4.27Å; P489-F540 WeakPolarHBondContact CG-O 3.02Å
490	G	96.1	Very high	96.2	Very high	25 Å²	25	22.2 Å²	22.2	26%	0.258	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	143.4	-175.4	-176	0	0	0	0	0	113.6	A538	G490-A538 PolarHBondContact N-O 3.07Å; G490-A538 VanDerWaalsContact N-O 3.08Å; G490-A538 WeakPolarHBondContact O-CB 3.41Å; G490-A538 PolarHBondContact O-N 2.59Å
491	A	97.4	Very high	95.3	Very high	22 Å²	22	24.9 Å²	24.9	18%	0.182	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	143.7	178.6	0	0	0	0	0	111.5	D452 L536	D452-A491 HydrophobicContact CB-CB 3.76Å; D452-A491 PolarHBondContact N-O 2.89Å; A491-L536 CarbonylContact C-O 3.59Å; A491-L536 VanDerWaalsContact CA-O 3.28Å; A491-L536 WeakPolarHBondContact CA-O 3.35Å
492	Y	98.1	Very high	93.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.3	-177	-62.1	-97.2	0	0	0	110.2	S450 F451 L465 P486 P487 R488 R535 L536 A538	S450-Y492 CarbonylContact O-C 3.35Å; S450-Y492 VanDerWaalsContact O-CA 3.23Å; S450-Y492 WeakPolarHBondContact O-CA 3.27Å; F451-Y492 HydrophobicContact CD1-CD1 4.04Å; F451-Y492 AromaticContact CD1-CE1 3.52Å; F451-Y492 HydrophobicContact CD1-CE1 3.52Å; F451-Y492 AromaticContact CD1-CZ 3.97Å; F451-Y492 HydrophobicContact CE1-CD1 4.25Å; F451-Y492 AromaticContact CE1-CE1 3.3Å; F451-Y492 HydrophobicContact CE1-CE1 3.3Å; F451-Y492 AromaticContact CE1-CZ 3.55Å; F451-Y492 WeakPolarHBondContact CE1-OH 3.47Å; F451-Y492 HydrophobicContact CG-CE1 4.36Å; F451-Y492 AromaticContact CZ-CE1 3.97Å; F451-Y492 HydrophobicContact CZ-CE1 3.97Å; L465-Y492 HydrophobicContact CD1-CD1 4.4Å; L465-Y492 HydrophobicContact CD1-CE1 4.44Å; L465-Y492 HydrophobicContact CD2-CE1 4.3Å; P486-Y492 HydrophobicContact CB-CD2 4.14Å; P486-Y492 HydrophobicContact CB-CE2 3.62Å; P486-Y492 HydrophobicContact CG-CE2 4.49Å; P487-Y492 WeakPolarHBondContact CD-OH 3.29Å; P487-Y492 HydrophobicContact CG-CE1 4.22Å; R488-Y492 WeakPolarHBondContact CG-OH 3.15Å; R488-Y492 PolarHBondContact N-OH 2.81Å; R488-Y492 PolarHBondContact O-OH 2.82Å; Y492-R535 CarbonylContact O-C 3.38Å; Y492-R535 WeakPolarHBondContact O-CA 3.42Å; Y492-L536 PolarHBondContact N-O 3.39Å; Y492-L536 PolarHBondContact O-N 3.22Å; Y492-A538 HydrophobicContact CE2-CB 4.25Å
493	K	97.6	Very high	91.6	Very high	63 Å²	63	34.2 Å²	34.2	27%	0.274	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.2	169.3	-63.4	-178.4	-178.2	179.9	0	109	L449 S450 D452	L449-K493 WeakPolarHBondContact CA-O 3.43Å; S450-K493 PolarHBondContact N-O 2.97Å; S450-K493 PolarHBondContact O-N 2.88Å; D452-K493 HydrophobicContact CB-CG 3.95Å; D452-K493 WeakPolarHBondContact OD1-CE 3.48Å; D452-K493 IonicContact OD1-NZ 3.46Å
494	L	98.1	Very high	88.9	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	117.3	173.7	171.8	66	0	0	0	108.3	I431 F447 L449 I484 I496 E533 Y534	I431-L494 HydrophobicContact CD1-CD2 3.77Å; I431-L494 HydrophobicContact CG1-CD2 4.25Å; F447-L494 HydrophobicContact CB-CD1 3.99Å; F447-L494 HydrophobicContact CD2-CD1 3.93Å; F447-L494 HydrophobicContact CG-CD1 4.27Å; L449-L494 HydrophobicContact CD1-CB 4.26Å; L449-L494 HydrophobicContact CD1-CD1 4.44Å; I484-L494 HydrophobicContact CD1-CD1 3.9Å; I484-L494 HydrophobicContact CG1-CD1 4.27Å; I484-L494 HydrophobicContact CG1-CD2 4.15Å; L494-I496 HydrophobicContact CG-CG1 4.33Å; L494-E533 CarbonylContact O-C 3.47Å; L494-E533 VanDerWaalsContact O-CA 3.3Å; L494-E533 WeakPolarHBondContact O-CA 3.29Å; L494-Y534 HydrophobicContact CD2-CD2 4.29Å; L494-Y534 PolarHBondContact N-O 3.32Å; L494-Y534 PolarHBondContact O-N 3.43Å
495	L	97.5	Very high	86	Confident	40 Å²	40	47.2 Å²	47.2	21%	0.209	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.6	177	-174.4	54.7	0	0	0	109.1	F447 G448 Y497 A530 E533	F447-L495 CarbonylContact C-O 3.58Å; F447-L495 WeakPolarHBondContact CA-O 3.38Å; G448-L495 PolarHBondContact N-O 3.15Å; G448-L495 PolarHBondContact O-N 3.42Å; L495-Y497 HydrophobicContact CB-CE2 4.04Å; L495-Y497 HydrophobicContact CD2-CE1 4.15Å; L495-Y497 HydrophobicContact CD2-CE2 4.07Å; L495-Y497 WeakPolarHBondContact CD2-OH 3.23Å; L495-Y497 HydrophobicContact CG-CD2 4.43Å; L495-Y497 HydrophobicContact CG-CE1 4.29Å; L495-Y497 HydrophobicContact CG-CE2 3.69Å; L495-Y497 WeakPolarHBondContact O-CD2 3.18Å; L495-Y497 WeakPolarHBondContact O-CE2 3.49Å; L495-A530 HydrophobicContact CD1-CB 4.04Å; L495-A530 HydrophobicContact CG-CB 4.45Å; L495-E533 HydrophobicContact CB-CG 4.49Å; L495-E533 HydrophobicContact CD1-CB 3.79Å; L495-E533 HydrophobicContact CD1-CG 3.99Å
496	I	97.9	Very high	82.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.9	179.5	-62	176.4	0	0	0	109	I431 I433 F482 L494 V531 C532 Y534	I431-I496 HydrophobicContact CG2-CD1 4.28Å; I433-I496 HydrophobicContact CD1-CD1 4.28Å; I433-I496 HydrophobicContact CG1-CD1 4.05Å; F482-I496 HydrophobicContact CD2-CD1 3.9Å; F482-I496 HydrophobicContact CE1-CG1 4.33Å; F482-I496 HydrophobicContact CE1-CG2 4.01Å; F482-I496 HydrophobicContact CE2-CD1 3.89Å; F482-I496 HydrophobicContact CE2-CG1 4.41Å; F482-I496 HydrophobicContact CE2-CG2 3.91Å; F482-I496 HydrophobicContact CG-CD1 4.3Å; F482-I496 HydrophobicContact CZ-CB 4.46Å; F482-I496 HydrophobicContact CZ-CD1 4.25Å; F482-I496 HydrophobicContact CZ-CG1 4.28Å; F482-I496 HydrophobicContact CZ-CG2 3.42Å; F482-I496 VanDerWaalsContact CZ-CG2 3.42Å; L494-I496 HydrophobicContact CG-CG1 4.33Å; I496-V531 HydrophobicContact CB-CG2 4.14Å; I496-V531 HydrophobicContact CG2-CG2 3.69Å; I496-V531 VanDerWaalsContact O-CG2 3.31Å; I496-V531 WeakPolarHBondContact O-CG2 3.49Å; I496-V531 PolarHBondContact O-N 3.02Å; I496-C532 PolarHBondContact N-O 3.09Å; I496-C532 PolarHBondContact O-N 3.09Å; I496-Y534 HydrophobicContact CD1-CD2 4.48Å; I496-Y534 HydrophobicContact CD1-CE2 4.15Å
497	Y	96.3	Very high	80	Confident	67 Å²	67	58.1 Å²	58.1	26%	0.263	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.8	177.5	-53.2	-105.7	0	0	0	111.1	F445 T446 L495 F528 G529 A530	F445-Y497 WeakPolarHBondContact CA-O 3.4Å; T446-Y497 HydrophobicContact CG2-CD2 4.18Å; T446-Y497 HydrophobicContact CG2-CG 4.26Å; T446-Y497 PolarHBondContact N-O 3.1Å; T446-Y497 PolarHBondContact O-N 3.47Å; L495-Y497 HydrophobicContact CB-CE2 4.04Å; L495-Y497 HydrophobicContact CD2-CE1 4.15Å; L495-Y497 HydrophobicContact CD2-CE2 4.07Å; L495-Y497 WeakPolarHBondContact CD2-OH 3.23Å; L495-Y497 HydrophobicContact CG-CD2 4.43Å; L495-Y497 HydrophobicContact CG-CE1 4.29Å; L495-Y497 HydrophobicContact CG-CE2 3.69Å; L495-Y497 WeakPolarHBondContact O-CD2 3.18Å; L495-Y497 WeakPolarHBondContact O-CE2 3.49Å; Y497-F528 HydrophobicContact CD1-CB 4.44Å; Y497-F528 HydrophobicContact CG-CB 4.44Å; Y497-G529 CarbonylContact C-O 3.42Å; Y497-G529 WeakPolarHBondContact CA-O 3.3Å; Y497-G529 WeakPolarHBondContact CB-O 3.45Å; Y497-A530 HydrophobicContact CD1-CB 3.93Å; Y497-A530 HydrophobicContact CE1-CB 3.92Å
498	A	93.5	Very high	76.8	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	155.1	171.7	0	0	0	0	0	110.7	Y410 L412 S444 F445 G529 V531	Y410-A498 HydrophobicContact CD2-CB 3.87Å; Y410-A498 HydrophobicContact CE2-CB 4.04Å; L412-A498 HydrophobicContact CD1-CB 4.36Å; S444-A498 CarbonylContact O-C 3.58Å; S444-A498 VanDerWaalsContact O-CA 3.31Å; S444-A498 WeakPolarHBondContact O-CA 2.99Å; F445-A498 HydrophobicContact CD1-CB 3.85Å; F445-A498 HydrophobicContact CE1-CB 3.76Å; A498-G529 PolarHBondContact N-O 3.32Å; A498-G529 PolarHBondContact O-N 2.98Å; A498-V531 HydrophobicContact CB-CG1 3.67Å; A498-V531 HydrophobicContact CB-CG2 4.42Å
499	K	87.7	Confident	74	Confident	13 Å²	13	67.1 Å²	67.1	6%	0.057	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	139.9	174.8	173.5	-173.7	168.2	178.1	0	108.2	L443 S444 N526 F528	L443-K499 CarbonylContact C-O 3.48Å; L443-K499 VanDerWaalsContact CA-O 3.28Å; L443-K499 WeakPolarHBondContact CA-O 3.34Å; S444-K499 PolarHBondContact N-O 3.3Å; S444-K499 PolarHBondContact O-N 2.97Å; K499-N526 WeakPolarHBondContact CD-O 3.45Å; K499-N526 VanDerWaalsContact CE-O 3.31Å; K499-N526 WeakPolarHBondContact CE-O 3.4Å; K499-N526 WeakPolarHBondContact CE-OD1 3.45Å; K499-N526 PolarHBondContact NZ-O 2.8Å; K499-N526 PolarHBondContact NZ-OD1 3.44Å; K499-F528 HydrophobicContact CB-CD1 3.75Å; K499-F528 HydrophobicContact CB-CE1 3.9Å; K499-F528 HydrophobicContact CB-CG 4.15Å; K499-F528 HydrophobicContact CB-CZ 4.38Å
500	Q	84.8	Confident	71	Confident	51 Å²	51	72.5 Å²	72.5	24%	0.238	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.4	171.2	-179.3	180	-4.9	0	0	109.8	Y410 N441 L443	Y410-Q500 HydrophobicContact CD1-CB 4.16Å; Y410-Q500 HydrophobicContact CE1-CB 3.58Å; Y410-Q500 VanDerWaalsContact CE1-OE1 3.31Å; N441-Q500 HydrophobicContact CB-CG 3.9Å; N441-Q500 PolarHBondContact ND2-NE2 3.24Å; N441-Q500 PolarHBondContact OD1-NE2 2.97Å; L443-Q500 HydrophobicContact CD2-CB 3.81Å; L443-Q500 HydrophobicContact CD2-CG 4.33Å
501	H	77.2	Confident	68.2	Low	56 Å²	56	73.1 Å²	73.1	26%	0.259	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	124.6	174.2	-169.6	88.4	0	0	0	109.3	D442 E561	D442-H501 HydrophobicContact CB-CB 3.88Å; D442-H501 VanDerWaalsContact O-CB 3.26Å; D442-H501 WeakPolarHBondContact O-CB 3.43Å; D442-H501 PolarHBondContact O-N 2.79Å; D442-H501 IonicContact OD2-CD2 3Å; D442-H501 IonicContact OD2-CG 3.62Å; H501-E561 IonicContact ND1-OE2 4Å
502	Q	63.9	Low	65.6	Low	110 Å²	110	76.9 Å²	76.9	51%	0.514	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-76.8	138.5	173	-71.4	177.8	17.8	0	0	109	H504 E525	Q502-H504 PolarHBondContact O-N 2.91Å; Q502-E525 PolarHBondContact NE2-OE1 3.1Å; Q502-E525 PolarHBondContact NE2-OE2 2.89Å
503	P	55.3	Low	62.7	Low	86 Å²	86	77.8 Å²	77.8	56%	0.558	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-57.7	131.1	166.9	24.7	-30.5	0	0	0	108	Q505	P503-Q505 PolarHBondContact O-N 3.45Å
504	H	42.8	Very low	60.2	Low	180 Å²	180	75.9 Å²	75.9	83%	0.833	40%	0.403	S	S	*	.			trans	-61.1	78.4	176.2	-128	-60.2	0	0	0	109.4	Q502	Q502-H504 PolarHBondContact O-N 2.91Å
505	Q	35.7	Very low	57.7	Low	122 Å²	122	77.4 Å²	77.4	57%	0.57	41%	0.413	S	S	*	.			trans	-91.6	123.2	168.8	-71	-150.8	17.8	0	0	108.3	P503 G507	P503-Q505 PolarHBondContact O-N 3.45Å; Q505-G507 PolarHBondContact O-N 2.82Å
506	N	31.6	Very low	55.2	Low	156 Å²	156	78.1 Å²	78.1	83%	0.834	42%	0.421	S	S	*	.	S	Bend	trans	-57.8	106.5	171.5	-75.9	-24.9	0	0	0	109.6	Q508	N506-Q508 PolarHBondContact O-N 2.95Å; N506-Q508 VanDerWaalsContact O-N 3.07Å
507	G	38.3	Very low	52.2	Low	83 Å²	83	85.6 Å²	85.6	86%	0.856	46%	0.458	S	S	*	.	S	Bend	trans	72.7	2.8	150	0	0	0	0	0	119.5	Q505	Q505-G507 PolarHBondContact O-N 2.82Å
508	Q	30	Very low	49.8	Very low	135 Å²	135	84 Å²	84	63%	0.631	45%	0.454	S	S	*	.			trans	-115.5	99.9	171.8	-68.6	-170.2	0.5	0	0	110.4	N506 E510	N506-Q508 PolarHBondContact O-N 2.95Å; N506-Q508 VanDerWaalsContact O-N 3.07Å; Q508-E510 HydrophobicContact CB-CG 4.36Å; Q508-E510 PolarHBondContact O-N 2.91Å
509	K	37.1	Very low	47.1	Very low	162 Å²	162	87.4 Å²	87.4	70%	0.704	48%	0.475	S	S	*	.			trans	-67.8	80.4	166.2	-71.6	-175	176.3	-173.7	0	108.4
510	E	33.3	Very low	44.8	Very low	151 Å²	151	90.5 Å²	90.5	71%	0.706	49%	0.493	S	S	*	.			trans	-75.1	121.8	171.8	-68.7	-172.6	150.8	0	0	109.6	Q508	Q508-E510 HydrophobicContact CB-CG 4.36Å; Q508-E510 PolarHBondContact O-N 2.91Å
511	G	38.6	Very low	42.4	Very low	38 Å²	38	91.3 Å²	91.3	39%	0.392	50%	0.499	S	S	.	.	S	Bend	trans	103.7	7.6	157.8	0	0	0	0	0	119.5	D206	D206-G511 WeakPolarHBondContact OD2-CA 3.41Å
512	L	42.5	Very low	40.5	Very low	100 Å²	100	97 Å²	97	52%	0.524	53%	0.53	S	S	.	.			trans	-128.8	74.3	169.7	-72.4	167.4	0	0	0	109.8	I514	L512-I514 PolarHBondContact O-N 3.43Å
513	G	37.8	Very low	39.5	Very low	19 Å²	19	94.8 Å²	94.8	20%	0.196	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	133.4	172.2	0	0	0	0	0	112.2	D206 V515	D206-G513 PolarHBondContact OD1-N 3.1Å; G513-V515 PolarHBondContact O-N 3.28Å
514	I	44.7	Very low	39.1	Very low	23 Å²	23	93.2 Å²	93.2	12%	0.118	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	-25.9	172	-57.4	146.6	0	0	0	118.7	R209 D212 E213 L512 S516 M517	R209-I514 HydrophobicContact CB-CD1 4.31Å; R209-I514 HydrophobicContact CG-CD1 3.43Å; R209-I514 VanDerWaalsContact CG-CD1 3.43Å; R209-I514 HydrophobicContact CG-CG1 4.12Å; R209-I514 WeakPolarHBondContact O-CD1 3.49Å; D212-I514 HydrophobicContact CB-CD1 4.12Å; E213-I514 HydrophobicContact CB-CD1 3.66Å; E213-I514 VanDerWaalsContact CD-CD1 3.45Å; E213-I514 HydrophobicContact CG-CD1 3.26Å; E213-I514 HydrophobicContact CG-CG1 3.87Å; E213-I514 VanDerWaalsContact OE1-CD1 3.29Å; E213-I514 WeakPolarHBondContact OE1-CD1 3.37Å; L512-I514 PolarHBondContact O-N 3.43Å; I514-S516 PolarHBondContact O-N 3.47Å; I514-M517 HydrophobicContact CG2-CB 4.47Å; I514-M517 WeakPolarHBondContact O-CB 3.42Å; I514-M517 PolarHBondContact O-N 3.24Å
515	V	45.2	Very low	39.4	Very low	34 Å²	34	89.3 Å²	89.3	21%	0.206	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-24.3	168.1	-177.6	0	0	0	0	110.4	M364 G513	M364-V515 HydrophobicContact CE-CG2 3.83Å; G513-V515 PolarHBondContact O-N 3.28Å
516	S	44	Very low	40.5	Very low	55 Å²	55	88.8 Å²	88.8	39%	0.385	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-13	171.2	71.9	0	0	0	0	116.4	I514	I514-S516 PolarHBondContact O-N 3.47Å
517	M	36.5	Very low	42.5	Very low	157 Å²	157	87.4 Å²	87.4	77%	0.773	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-20.3	174	-66.7	-71.1	-139.5	0	0	112.3	I514 P519	I514-M517 HydrophobicContact CG2-CB 4.47Å; I514-M517 WeakPolarHBondContact O-CB 3.42Å; I514-M517 PolarHBondContact O-N 3.24Å; M517-P519 VanDerWaalsContact O-CD 3.31Å; M517-P519 WeakPolarHBondContact O-CD 3.43Å
518	I	45.4	Very low	44.7	Very low	34 Å²	34	86.9 Å²	86.9	17%	0.174	47%	0.467	C	S	.	.	S	Bend	trans	-65.8	119.8	158.5	-60.8	-179.6	0	0	0	104.8	T255 Y360 L362 D520	T255-I518 HydrophobicContact CG2-CD1 4.11Å; Y360-I518 WeakPolarHBondContact O-CG2 3.22Å; L362-I518 HydrophobicContact CB-CD1 4.42Å; I518-D520 PolarHBondContact O-N 3.26Å
519	P	36.1	Very low	47.4	Very low	70 Å²	70	81.6 Å²	81.6	46%	0.455	45%	0.449	S	S	.	.			trans	-69.3	88.1	-178.7	-10.8	25.4	0	0	0	108.7	R359 M517 D521	R359-P519 VanDerWaalsContact CD-O 3.23Å; R359-P519 WeakPolarHBondContact CD-O 3.49Å; R359-P519 PolarHBondContact NH1-O 3.5Å; M517-P519 VanDerWaalsContact O-CD 3.31Å; M517-P519 WeakPolarHBondContact O-CD 3.43Å; P519-D521 VanDerWaalsContact C-N 3.34Å; P519-D521 PolarHBondContact O-N 2.98Å
520	D	40.1	Very low	50.1	Low	79 Å²	79	75.2 Å²	75.2	42%	0.422	43%	0.426	S	S	.	.			trans	-53.2	109.7	152.4	-109.9	-33.7	0	0	0	104.4	I518 L522 S524	I518-D520 PolarHBondContact O-N 3.26Å; D520-L522 PolarHBondContact O-N 2.87Å; D520-S524 VanDerWaalsContact CG-OG 3.31Å; D520-S524 PolarHBondContact OD1-OG 2.73Å
521	D	34.8	Very low	53	Low	68 Å²	68	68 Å²	68	36%	0.364	39%	0.393	S	S	.	.			trans	-65	90.1	-178.6	-163.1	41.7	0	0	0	108.5	R359 P519 S523	R359-D521 IonicContact CZ-OD1 2.73Å; R359-D521 IonicContact NH1-OD1 3.45Å; R359-D521 PolarHBondContact NH1-OD1 2.6Å; R359-D521 IonicContact NH2-OD1 3.33Å; P519-D521 VanDerWaalsContact C-N 3.34Å; P519-D521 PolarHBondContact O-N 2.98Å; D521-S523 PolarHBondContact O-N 2.85Å; D521-S523 PolarHBondContact O-OG 2.88Å
522	L	37.4	Very low	55.8	Low	176 Å²	176	66.3 Å²	66.3	92%	0.921	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	33.8	20.2	152.9	-100.6	131.7	0	0	0	119.3	D520	D520-L522 PolarHBondContact O-N 2.87Å
523	S	42	Very low	58.4	Low	63 Å²	63	63.1 Å²	63.1	44%	0.441	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-168.3	-9.4	-172.4	57.8	0	0	0	0	115.8	D521 E525 N526	D521-S523 PolarHBondContact O-N 2.85Å; D521-S523 PolarHBondContact O-OG 2.88Å; S523-E525 PolarHBondContact O-N 3.35Å; S523-N526 PolarHBondContact O-N 2.83Å
524	S	47.7	Very low	61.2	Low	52 Å²	52	62.2 Å²	62.2	36%	0.364	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-67.7	-32.6	178.6	51.1	0	0	0	0	113.1	D520 N526 L527	D520-S524 VanDerWaalsContact CG-OG 3.31Å; D520-S524 PolarHBondContact OD1-OG 2.73Å; S524-N526 PolarHBondContact O-N 2.91Å; S524-L527 PolarHBondContact O-N 3.25Å
525	E	49.7	Very low	63.8	Low	98 Å²	98	65 Å²	65	46%	0.458	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-69	-20.6	-179.1	-62.3	-158.5	144	0	0	113.7	Q502 S523	Q502-E525 PolarHBondContact NE2-OE1 3.1Å; Q502-E525 PolarHBondContact NE2-OE2 2.89Å; S523-E525 PolarHBondContact O-N 3.35Å
526	N	57.8	Low	66.3	Low	111 Å²	111	63.5 Å²	63.5	59%	0.594	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-97.3	1.3	177.9	-95.3	-29.4	0	0	0	114.2	K499 S523 S524	K499-N526 WeakPolarHBondContact CD-O 3.45Å; K499-N526 VanDerWaalsContact CE-O 3.31Å; K499-N526 WeakPolarHBondContact CE-O 3.4Å; K499-N526 WeakPolarHBondContact CE-OD1 3.45Å; K499-N526 PolarHBondContact NZ-O 2.8Å; K499-N526 PolarHBondContact NZ-OD1 3.44Å; S523-N526 PolarHBondContact O-N 2.83Å; S524-N526 PolarHBondContact O-N 2.91Å
527	L	73.1	Confident	68.8	Low	127 Å²	127	62.9 Å²	62.9	67%	0.665	34%	0.341	S	S	*	.	S	Bend	trans	-95.6	145.8	-175.2	-149.2	74.6	0	0	0	111.5	S524 G529	S524-L527 PolarHBondContact O-N 3.25Å; L527-G529 PolarHBondContact O-N 3.09Å
528	F	85.9	Confident	71.8	Confident	73 Å²	73	55.6 Å²	55.6	32%	0.32	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-69.1	123.7	171.2	-80.6	-85.3	0	0	0	110.6	S444 T446 Y497 K499	S444-F528 WeakPolarHBondContact O-CE1 3.45Å; T446-F528 HydrophobicContact CG2-CB 4.16Å; T446-F528 HydrophobicContact CG2-CD1 3.52Å; T446-F528 HydrophobicContact CG2-CD2 4.09Å; T446-F528 HydrophobicContact CG2-CE1 3.8Å; T446-F528 HydrophobicContact CG2-CE2 4.36Å; T446-F528 HydrophobicContact CG2-CG 3.66Å; T446-F528 HydrophobicContact CG2-CZ 4.21Å; Y497-F528 HydrophobicContact CD1-CB 4.44Å; Y497-F528 HydrophobicContact CG-CB 4.44Å; K499-F528 HydrophobicContact CB-CD1 3.75Å; K499-F528 HydrophobicContact CB-CE1 3.9Å; K499-F528 HydrophobicContact CB-CG 4.15Å; K499-F528 HydrophobicContact CB-CZ 4.38Å
529	G	86.7	Confident	74.2	Confident	24 Å²	24	59.4 Å²	59.4	25%	0.247	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.5	172.3	0	0	0	0	0	110.8	Y497 A498 L527 V531	Y497-G529 CarbonylContact C-O 3.42Å; Y497-G529 WeakPolarHBondContact CA-O 3.3Å; Y497-G529 WeakPolarHBondContact CB-O 3.45Å; A498-G529 PolarHBondContact N-O 3.32Å; A498-G529 PolarHBondContact O-N 2.98Å; L527-G529 PolarHBondContact O-N 3.09Å; G529-V531 PolarHBondContact O-N 3.42Å
530	A	92	Very high	77	Confident	28 Å²	28	56.8 Å²	56.8	23%	0.231	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	133.9	171.8	0	0	0	0	0	109.6	K404 L495 Y497	K404-A530 VanDerWaalsContact CB-O 3.29Å; K404-A530 WeakPolarHBondContact CB-O 3.29Å; K404-A530 HydrophobicContact CG-CB 4.34Å; L495-A530 HydrophobicContact CD1-CB 4.04Å; L495-A530 HydrophobicContact CG-CB 4.45Å; Y497-A530 HydrophobicContact CD1-CB 3.93Å; Y497-A530 HydrophobicContact CE1-CB 3.92Å
531	V	95.7	Very high	79.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-42.5	-179.6	-65.9	0	0	0	0	112.4	V403 K404 A406 F407 Y410 L412 I496 A498 G529	V403-V531 CarbonylContact C-O 3.5Å; V403-V531 VanDerWaalsContact CA-O 3.24Å; V403-V531 WeakPolarHBondContact CA-O 3.41Å; K404-V531 PolarHBondContact N-O 3.31Å; A406-V531 HydrophobicContact CB-CG1 3.93Å; F407-V531 HydrophobicContact CB-CB 4.15Å; F407-V531 WeakPolarHBondContact CB-O 3.27Å; F407-V531 HydrophobicContact CD2-CB 4.2Å; Y410-V531 HydrophobicContact CD2-CG1 4.25Å; L412-V531 HydrophobicContact CD1-CB 3.96Å; L412-V531 HydrophobicContact CD1-CG1 3.87Å; L412-V531 HydrophobicContact CD1-CG2 4.02Å; I496-V531 HydrophobicContact CB-CG2 4.14Å; I496-V531 HydrophobicContact CG2-CG2 3.69Å; I496-V531 VanDerWaalsContact O-CG2 3.31Å; I496-V531 WeakPolarHBondContact O-CG2 3.49Å; I496-V531 PolarHBondContact O-N 3.02Å; A498-V531 HydrophobicContact CB-CG1 3.67Å; A498-V531 HydrophobicContact CB-CG2 4.42Å; G529-V531 PolarHBondContact O-N 3.42Å
532	C	96.4	Very high	82.1	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	157.4	176.6	63.1	0	0	0	0	112.4	P402 V403 F407 I496	P402-C532 VanDerWaalsContact O-CA 3.29Å; P402-C532 WeakPolarHBondContact O-CA 3.08Å; V403-C532 HydrophobicContact CG1-CB 4.06Å; F407-C532 HydrophobicContact CD2-CB 4.37Å; I496-C532 PolarHBondContact N-O 3.09Å; I496-C532 PolarHBondContact O-N 3.09Å
533	E	96.9	Very high	84.6	Confident	33 Å²	33	55.3 Å²	55.3	15%	0.154	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.3	-177.7	-166.6	-173.3	162.8	0	0	111.2	P314 P402 L494 L495	P314-E533 WeakPolarHBondContact CD-OE1 3.49Å; P314-E533 HydrophobicContact CG-CB 4.18Å; P314-E533 HydrophobicContact CG-CG 3.76Å; P402-E533 VanDerWaalsContact CD-O 3.3Å; P402-E533 WeakPolarHBondContact CD-O 3.18Å; P402-E533 HydrophobicContact CG-CB 3.93Å; P402-E533 WeakPolarHBondContact CG-O 3.37Å; P402-E533 PolarHBondContact O-N 2.91Å; P402-E533 VanDerWaalsContact O-N 3.09Å; L494-E533 CarbonylContact O-C 3.47Å; L494-E533 VanDerWaalsContact O-CA 3.3Å; L494-E533 WeakPolarHBondContact O-CA 3.29Å; L495-E533 HydrophobicContact CB-CG 4.49Å; L495-E533 HydrophobicContact CD1-CB 3.79Å; L495-E533 HydrophobicContact CD1-CG 3.99Å
534	Y	98.1	Very high	87.1	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.5	175.3	-63.8	-83.4	0	0	0	111.4	A401 L414 H417 N419 S420 I422 I431 L494 I496	A401-Y534 HydrophobicContact CB-CD1 4.31Å; A401-Y534 HydrophobicContact CB-CE1 3.69Å; L414-Y534 WeakPolarHBondContact CD2-OH 3.46Å; H417-Y534 HydrophobicContact CB-CE1 3.94Å; H417-Y534 WeakPolarHBondContact O-CE1 3.34Å; H417-Y534 PolarHBondContact O-OH 3.11Å; N419-Y534 WeakPolarHBondContact O-CD1 3.2Å; N419-Y534 VanDerWaalsContact O-CE1 3.29Å; N419-Y534 WeakPolarHBondContact O-CE1 3.43Å; S420-Y534 CarbonylContact O-C 3.5Å; S420-Y534 WeakPolarHBondContact O-CA 3.48Å; I422-Y534 HydrophobicContact CD1-CD1 3.57Å; I422-Y534 HydrophobicContact CD1-CD2 4.41Å; I422-Y534 HydrophobicContact CD1-CE1 4.05Å; I422-Y534 HydrophobicContact CD1-CG 3.76Å; I422-Y534 HydrophobicContact CG1-CD1 3.87Å; I422-Y534 HydrophobicContact CG1-CE1 4.47Å; I422-Y534 HydrophobicContact CG1-CG 4.4Å; I431-Y534 HydrophobicContact CG2-CE2 4.05Å; L494-Y534 HydrophobicContact CD2-CD2 4.29Å; L494-Y534 PolarHBondContact N-O 3.32Å; L494-Y534 PolarHBondContact O-N 3.43Å; I496-Y534 HydrophobicContact CD1-CD2 4.48Å; I496-Y534 HydrophobicContact CD1-CE2 4.15Å
535	R	97.8	Very high	89.4	Confident	82 Å²	82	57.1 Å²	57.1	31%	0.309	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	108.9	160.8	173.1	178	-175.9	116.7	13.8	108.3	P314 S420 V421 I422 D452 Y492 V537	P314-R535 HydrophobicContact CB-CB 3.72Å; P314-R535 HydrophobicContact CG-CB 4.47Å; P314-R535 VanDerWaalsContact O-CD 3.29Å; P314-R535 WeakPolarHBondContact O-CD 3.32Å; S420-R535 PolarHBondContact O-N 2.89Å; V421-R535 CarbonylContact C-O 3.49Å; V421-R535 WeakPolarHBondContact CA-O 3.35Å; V421-R535 HydrophobicContact CG2-CB 4.38Å; I422-R535 PolarHBondContact N-O 3.29Å; D452-R535 IonicContact OD1-NH1 3.91Å; D452-R535 WeakPolarHBondContact OD2-CD 3.33Å; D452-R535 WeakPolarHBondContact OD2-CG 3.41Å; D452-R535 IonicContact OD2-CZ 3.47Å; D452-R535 IonicContact OD2-NE 3.91Å; D452-R535 PolarHBondContact OD2-NE 2.79Å; D452-R535 VanDerWaalsContact OD2-NE 3.16Å; D452-R535 IonicContact OD2-NH1 3.58Å; D452-R535 PolarHBondContact OD2-NH1 2.92Å; D452-R535 IonicContact OD2-NH2 2.75Å; D452-R535 PolarHBondContact OD2-NH2 3.28Å; Y492-R535 CarbonylContact O-C 3.38Å; Y492-R535 WeakPolarHBondContact O-CA 3.42Å; R535-V537 HydrophobicContact CG-CG2 4.21Å
536	L	98	Very high	91.6	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	123.3	175.4	-179	67.1	0	0	0	109.5	I422 C424 V429 I484 P486 A491 Y492	I422-L536 HydrophobicContact CB-CD1 3.89Å; I422-L536 HydrophobicContact CG2-CD1 3.76Å; I422-L536 CarbonylContact O-C 3.51Å; I422-L536 WeakPolarHBondContact O-CA 3.45Å; C424-L536 HydrophobicContact CB-CD1 4.27Å; C424-L536 VanDerWaalsContact SG-CD1 3.58Å; V429-L536 HydrophobicContact CB-CD1 4.34Å; V429-L536 HydrophobicContact CG1-CD1 3.8Å; V429-L536 HydrophobicContact CG1-CD2 3.73Å; V429-L536 HydrophobicContact CG1-CG 4.44Å; V429-L536 HydrophobicContact CG2-CD1 4.34Å; I484-L536 HydrophobicContact CB-CD2 4.3Å; I484-L536 HydrophobicContact CG2-CD2 3.84Å; P486-L536 HydrophobicContact CG-CD2 3.65Å; A491-L536 CarbonylContact C-O 3.59Å; A491-L536 VanDerWaalsContact CA-O 3.28Å; A491-L536 WeakPolarHBondContact CA-O 3.35Å; Y492-L536 PolarHBondContact N-O 3.39Å; Y492-L536 PolarHBondContact O-N 3.22Å
537	V	98	Very high	93.4	Very high	42 Å²	42	52.7 Å²	52.7	26%	0.255	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	100	176.7	-177.1	0	0	0	0	108.8	V421 I422 V423 C424 R535 N539	V421-V537 HydrophobicContact CG1-CG2 3.92Å; I422-V537 PolarHBondContact O-N 2.88Å; V423-V537 WeakPolarHBondContact CA-O 3.25Å; V423-V537 HydrophobicContact CG2-CB 4.31Å; C424-V537 PolarHBondContact N-O 2.73Å; R535-V537 HydrophobicContact CG-CG2 4.21Å; V537-N539 PolarHBondContact O-N 3.36Å
538	A	97.5	Very high	94.5	Very high	4 Å²	4	47.2 Å²	47.2	3%	0.033	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	103.3	178.1	0	0	0	0	0	110.9	P486 P489 G490 Y492 F540	P486-A538 HydrophobicContact CB-CB 3.66Å; P486-A538 HydrophobicContact CG-CB 3.84Å; P489-A538 WeakPolarHBondContact CA-O 3.42Å; G490-A538 PolarHBondContact N-O 3.07Å; G490-A538 VanDerWaalsContact N-O 3.08Å; G490-A538 WeakPolarHBondContact O-CB 3.41Å; G490-A538 PolarHBondContact O-N 2.59Å; Y492-A538 HydrophobicContact CE2-CB 4.25Å; A538-F540 HydrophobicContact CB-CD1 4.26Å; A538-F540 HydrophobicContact CB-CE1 3.6Å; A538-F540 HydrophobicContact CB-CZ 4.02Å
539	N	96.6	Very high	95.1	Very high	114 Å²	114	43.9 Å²	43.9	61%	0.61	25%	0.253	S	S	*	.			trans	-112.7	66.8	-176.6	-170.9	25.6	0	0	0	111.5	V423 C424 V537	V423-N539 HydrophobicContact CG1-CB 4.32Å; C424-N539 PolarHBondContact O-N 3.49Å; V537-N539 PolarHBondContact O-N 3.36Å
540	F	95.2	Very high	95.6	Very high	16 Å²	16	43 Å²	43	7%	0.07	24%	0.242	C	C	.	.	S	Bend	trans	-134.5	168.5	174.1	50.6	-101.1	0	0	0	110.5	S425 P427 P486 P489 A538 R544	S425-F540 WeakPolarHBondContact O-CB 2.88Å; P427-F540 HydrophobicContact CB-CE1 4.35Å; P427-F540 HydrophobicContact CB-CE2 4.33Å; P427-F540 HydrophobicContact CB-CZ 4.2Å; P486-F540 HydrophobicContact CB-CE1 4.42Å; P486-F540 HydrophobicContact CB-CZ 4.05Å; P486-F540 HydrophobicContact CG-CE1 4.45Å; P489-F540 WeakPolarHBondContact CB-O 3.44Å; P489-F540 HydrophobicContact CG-CD2 4.14Å; P489-F540 HydrophobicContact CG-CE2 4.27Å; P489-F540 WeakPolarHBondContact CG-O 3.02Å; A538-F540 HydrophobicContact CB-CD1 4.26Å; A538-F540 HydrophobicContact CB-CE1 3.6Å; A538-F540 HydrophobicContact CB-CZ 4.02Å; F540-R544 HydrophobicContact CD2-CB 4.18Å
541	G	92.2	Very high	95.9	Very high	46 Å²	46	43.8 Å²	43.8	47%	0.474	25%	0.245	S	C	.	.			trans	-70.8	143.5	175.9	0	0	0	0	0	112	N543 R544	G541-N543 PolarHBondContact O-N 3.13Å; G541-R544 WeakPolarHBondContact O-CB 3.39Å; G541-R544 PolarHBondContact O-N 3.27Å
542	S	89.5	Confident	95.9	Very high	81 Å²	81	44.5 Å²	44.5	57%	0.566	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-54.5	-26.3	-177.1	49.7	0	0	0	0	115.1	R544	S542-R544 VanDerWaalsContact C-N 3.26Å; S542-R544 PolarHBondContact O-N 3.5Å
543	N	91	Very high	95.8	Very high	164 Å²	164	51.3 Å²	51.3	88%	0.877	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-77.7	-5.8	178.3	-62.4	-19	0	0	0	114	G541	G541-N543 PolarHBondContact O-N 3.13Å
544	R	93.9	Very high	95.6	Very high	118 Å²	118	52.2 Å²	52.2	45%	0.445	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-93.9	-6	178.1	-68	-174.2	66.5	-144.1	0.2	113.6	S425 D426 P427 F540 G541 S542 L546	S425-R544 PolarHBondContact O-NH1 2.96Å; D426-R544 IonicContact OD1-NH2 3.81Å; D426-R544 PolarHBondContact OD1-NH2 3.36Å; P427-R544 WeakPolarHBondContact CB-O 3.37Å; P427-R544 WeakPolarHBondContact CG-O 3.17Å; F540-R544 HydrophobicContact CD2-CB 4.18Å; G541-R544 WeakPolarHBondContact O-CB 3.39Å; G541-R544 PolarHBondContact O-N 3.27Å; S542-R544 VanDerWaalsContact C-N 3.26Å; S542-R544 PolarHBondContact O-N 3.5Å; R544-L546 PolarHBondContact O-N 3.18Å
545	S	94.7	Very high	95.5	Very high	36 Å²	36	53.4 Å²	53.4	25%	0.252	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-59.1	130.4	179.9	-72.8	0	0	0	0	111.7	P487 R488	P487-S545 WeakPolarHBondContact O-CB 3.32Å; P487-S545 PolarHBondContact O-OG 3.34Å; P487-S545 VanDerWaalsContact O-OG 3.04Å; R488-S545 WeakPolarHBondContact CA-OG 3.43Å
546	L	96.1	Very high	95.3	Very high	62 Å²	62	51.1 Å²	51.1	33%	0.325	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-84.5	153.5	177	-65.7	175.9	0	0	0	111	P427 E428 R485 R544	P427-L546 HydrophobicContact CB-CD1 4.31Å; P427-L546 HydrophobicContact CB-CG 4.03Å; P427-L546 HydrophobicContact CG-CD1 4.07Å; P427-L546 HydrophobicContact CG-CG 4.03Å; E428-L546 HydrophobicContact CB-CD1 4.1Å; R485-L546 HydrophobicContact CB-CB 4.46Å; R485-L546 HydrophobicContact CG-CB 4.29Å; R485-L546 HydrophobicContact CG-CD1 4.25Å; R544-L546 PolarHBondContact O-N 3.18Å
547	P	96	Very high	95.2	Very high	53 Å²	53	51.4 Å²	51.4	34%	0.344	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-63.6	157.1	172.1	28.4	-35	0	0	0	111.3	R485 T608	R485-P547 PolarHBondContact NH1-O 2.96Å; P547-T608 HydrophobicContact CB-CG2 4.2Å
548	P	97.5	Very high	95	Very high	13 Å²	13	49.7 Å²	49.7	8%	0.084	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-60.1	153.8	171.7	25.9	-32.3	0	0	0	110.6	R467 F468 T608	R467-P548 HydrophobicContact CB-CB 4.03Å; R467-P548 WeakPolarHBondContact O-CA 3.34Å; R467-P548 VanDerWaalsContact O-CB 3.26Å; R467-P548 WeakPolarHBondContact O-CB 3.48Å; F468-P548 HydrophobicContact CD1-CB 3.94Å; F468-P548 HydrophobicContact CD2-CB 4.27Å; F468-P548 HydrophobicContact CE1-CB 3.76Å; F468-P548 HydrophobicContact CE1-CG 4.06Å; F468-P548 HydrophobicContact CE2-CB 4.14Å; F468-P548 HydrophobicContact CG-CB 4.2Å; F468-P548 HydrophobicContact CZ-CB 3.87Å; F468-P548 HydrophobicContact CZ-CG 3.98Å; P548-T608 HydrophobicContact CG-CG2 3.8Å; P548-T608 PolarHBondContact O-OG1 3.17Å
549	F	98.1	Very high	94.8	Very high	3 Å²	3	52.3 Å²	52.3	1%	0.013	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-58.9	157.4	174.9	-70.9	-74.4	0	0	0	111.1	R467 G469 R470 Y483 R485 T608 I665	R467-F549 PolarHBondContact NE-O 2.82Å; R467-F549 PolarHBondContact NH2-O 3.16Å; R467-F549 PolarHBondContact O-N 3.44Å; G469-F549 VanDerWaalsContact C-CD2 3.46Å; G469-F549 WeakPolarHBondContact O-CD2 3.29Å; R470-F549 HydrophobicContact CB-CD1 4.46Å; R470-F549 HydrophobicContact CB-CD2 4.01Å; R470-F549 HydrophobicContact CB-CE2 4.15Å; R470-F549 HydrophobicContact CB-CG 4.17Å; R470-F549 HydrophobicContact CB-CZ 4.42Å; R470-F549 HydrophobicContact CG-CD1 4.09Å; R470-F549 HydrophobicContact CG-CD2 4.12Å; R470-F549 HydrophobicContact CG-CE1 3.76Å; R470-F549 HydrophobicContact CG-CE2 3.82Å; R470-F549 HydrophobicContact CG-CG 4.25Å; R470-F549 HydrophobicContact CG-CZ 3.63Å; Y483-F549 WeakPolarHBondContact O-CE2 3.34Å; R485-F549 HydrophobicContact CG-CE2 3.9Å; R485-F549 HydrophobicContact CG-CZ 3.94Å; R485-F549 VanDerWaalsContact NH2-CE1 3.25Å; F549-T608 PolarHBondContact O-OG1 3.24Å; F549-I665 HydrophobicContact CD1-CD1 3.72Å; F549-I665 HydrophobicContact CE1-CD1 4.09Å
550	P	97.5	Very high	94.5	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.026	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-46.9	140.9	179.2	-30.1	36	0	0	0	112.7	C552 Y557 E641 Y642 G643	P550-C552 PolarHBondContact O-N 2.64Å; P550-Y557 PolarHBondContact O-OH 3.03Å; P550-E641 HydrophobicContact CG-CB 4.38Å; P550-Y642 VanDerWaalsContact CG-C 3.47Å; P550-G643 VanDerWaalsContact CG-N 3.33Å
551	P	96.6	Very high	94	Very high	46 Å²	46	52.3 Å²	52.3	30%	0.299	30%	0.304	S	S	.	.			trans	-75.2	61.4	-174.3	31	-35.5	0	0	0	112.6	K606	P551-K606 HydrophobicContact CG-CB 4.17Å
552	C	96.7	Very high	93.8	Very high	14 Å²	14	53.3 Å²	53.3	10%	0.095	30%	0.297	C	S	.	.			trans	-75.4	162	171.7	-67.8	0	0	0	0	111.7	P550 S554 G643 E645	P550-C552 PolarHBondContact O-N 2.64Å; C552-S554 PolarHBondContact O-N 3.34Å; C552-G643 VanDerWaalsContact SG-CA 3.59Å; C552-E645 WeakPolarHBondContact CA-OE1 3.39Å; C552-E645 HydrophobicContact CB-CG 4.23Å
553	Q	93.7	Very high	93.9	Very high	144 Å²	144	49.7 Å²	49.7	67%	0.673	27%	0.273	S	S	*	.	S	Bend	trans	-60.1	-35.2	-178.4	-171.8	-179.8	27.8	0	0	112.3	E645 V660	Q553-E645 PolarHBondContact N-OE1 3.15Å; Q553-V660 VanDerWaalsContact OE1-CB 3.32Å
554	S	93.4	Very high	93.6	Very high	52 Å²	52	48.1 Å²	48.1	36%	0.364	26%	0.258	S	S	.	.			trans	-126	155.8	176.3	-178.6	0	0	0	0	111.7	C552 S556 Q663	C552-S554 PolarHBondContact O-N 3.34Å; S554-S556 VanDerWaalsContact C-N 3.25Å; S554-S556 PolarHBondContact OG-N 3.06Å; S554-Q663 PolarHBondContact O-NE2 3.36Å
555	S	95.6	Very high	93.3	Very high	26 Å²	26	47.5 Å²	47.5	18%	0.182	26%	0.264	C	S	.	.	S	Bend	trans	-80	-6	168.4	-53	0	0	0	0	112.9	T466 R470 Q471 Y557	T466-S555 PolarHBondContact O-OG 2.87Å; R470-S555 CarbonylContact C-O 3.5Å; R470-S555 VanDerWaalsContact CA-O 3.3Å; R470-S555 WeakPolarHBondContact CA-O 3.49Å; Q471-S555 PolarHBondContact N-O 2.92Å; S555-Y557 WeakPolarHBondContact O-CD2 3.35Å
556	S	94.7	Very high	93.2	Very high	33 Å²	33	46.4 Å²	46.4	23%	0.231	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.6	174.6	-61.7	0	0	0	0	111.3	F445 Q471 S554 Q663	F445-S556 PolarHBondContact O-OG 3.25Å; Q471-S556 CarbonylContact O-C 3.53Å; Q471-S556 WeakPolarHBondContact O-CA 3.31Å; Q471-S556 VanDerWaalsContact OE1-CB 3.29Å; Q471-S556 PolarHBondContact OE1-OG 3.06Å; S554-S556 VanDerWaalsContact C-N 3.25Å; S554-S556 PolarHBondContact OG-N 3.06Å; S556-Q663 PolarHBondContact O-NE2 3.4Å
557	Y	95.7	Very high	92.9	Very high	9 Å²	9	46.2 Å²	46.2	4%	0.035	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	143.6	179.2	-71.4	-103.8	0	0	0	110.2	R470 Q471 P550 S555 C575 Q663 Y664 I665	R470-Y557 HydrophobicContact CB-CD2 3.8Å; R470-Y557 HydrophobicContact CB-CE2 3.64Å; Q471-Y557 PolarHBondContact O-N 3.44Å; P550-Y557 PolarHBondContact O-OH 3.03Å; S555-Y557 WeakPolarHBondContact O-CD2 3.35Å; Y557-C575 VanDerWaalsContact C-SG 3.6Å; Y557-C575 PolarHBondContact O-SG 2.98Å; Y557-C575 VanDerWaalsContact O-SG 3.36Å; Y557-Q663 HydrophobicContact CD1-CB 4.17Å; Y557-Y664 VanDerWaalsContact CD1-C 3.41Å; Y557-Y664 WeakPolarHBondContact CE1-O 3.23Å; Y557-I665 HydrophobicContact CD1-CB 4.04Å; Y557-I665 HydrophobicContact CE1-CB 3.86Å
558	G	93.9	Very high	92.7	Very high	5 Å²	5	44.4 Å²	44.4	5%	0.052	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	112.6	-168.3	-167.9	0	0	0	0	0	112.8	C575 W662 Q663	G558-C575 WeakPolarHBondContact CA-SG 3.47Å; G558-W662 VanDerWaalsContact C-CD1 3.48Å; G558-W662 WeakPolarHBondContact O-CA 3.48Å; G558-Q663 PolarHBondContact N-O 2.88Å; G558-Q663 PolarHBondContact O-N 3.35Å
559	P	92.9	Very high	92.5	Very high	60 Å²	60	48.3 Å²	48.3	39%	0.39	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	142.5	173.8	29	-32.1	0	0	0	110.7	A563 V661 W662	P559-A563 HydrophobicContact CB-CB 3.91Å; P559-V661 WeakPolarHBondContact CA-O 3.26Å; P559-W662 HydrophobicContact CB-CD2 3.86Å; P559-W662 HydrophobicContact CB-CE3 3.77Å; P559-W662 HydrophobicContact CB-CH2 4Å; P559-W662 HydrophobicContact CB-CZ2 4.1Å; P559-W662 HydrophobicContact CB-CZ3 3.84Å; P559-W662 HydrophobicContact CG-CH2 4.11Å; P559-W662 HydrophobicContact CG-CZ2 4Å; P559-W662 HydrophobicContact CG-CZ3 4.45Å
560	N	90.2	Very high	92.3	Very high	62 Å²	62	48.9 Å²	48.9	33%	0.332	27%	0.266	S	S	.	.			trans	-98	179.9	169.5	74.6	15.6	0	0	0	111.8	L562 A563 V660 V661	N560-L562 PolarHBondContact O-N 2.54Å; N560-L562 VanDerWaalsContact O-N 3.15Å; N560-L562 WeakPolarHBondContact OD1-CB 3.35Å; N560-L562 PolarHBondContact OD1-N 2.69Å; N560-A563 VanDerWaalsContact O-CB 3.32Å; N560-A563 WeakPolarHBondContact O-CB 3.29Å; N560-A563 PolarHBondContact O-N 2.82Å; N560-A563 VanDerWaalsContact O-N 3.07Å; N560-A563 PolarHBondContact OD1-N 3.05Å; N560-V660 PolarHBondContact ND2-O 3.15Å; N560-V661 PolarHBondContact N-O 3.26Å; N560-V661 WeakPolarHBondContact OD1-CA 3.46Å; N560-V661 PolarHBondContact OD1-O 3.28Å
561	E	83.6	Confident	92.2	Very high	68 Å²	68	54.7 Å²	54.7	32%	0.318	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.8	-177.3	-58.6	-177.4	-178.7	0	0	113.2	S444 H501	S444-E561 PolarHBondContact OG-OE1 3.23Å; H501-E561 IonicContact ND1-OE2 4Å
562	L	89.3	Confident	92	Very high	66 Å²	66	58.3 Å²	58.3	35%	0.346	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-22	-179.8	-64.6	178	0	0	0	113.2	N560 K564 N565 Y566 F659 V661	N560-L562 PolarHBondContact O-N 2.54Å; N560-L562 VanDerWaalsContact O-N 3.15Å; N560-L562 WeakPolarHBondContact OD1-CB 3.35Å; N560-L562 PolarHBondContact OD1-N 2.69Å; L562-K564 PolarHBondContact O-N 2.92Å; L562-K564 VanDerWaalsContact O-N 3.16Å; L562-N565 WeakPolarHBondContact O-CB 3.48Å; L562-N565 PolarHBondContact O-N 2.71Å; L562-Y566 HydrophobicContact CB-CE2 4.29Å; L562-Y566 VanDerWaalsContact O-CD2 3.29Å; L562-Y566 WeakPolarHBondContact O-CD2 3.45Å; L562-F659 HydrophobicContact CD1-CB 3.87Å; L562-F659 HydrophobicContact CD1-CG 4.38Å; L562-V661 HydrophobicContact CB-CG1 4.22Å
563	A	90.2	Very high	91.7	Very high	6 Å²	6	61 Å²	61	5%	0.05	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-55	-39.1	-176.2	0	0	0	0	0	112.7	P559 N560 N565 Y566 I568 V661	P559-A563 HydrophobicContact CB-CB 3.91Å; N560-A563 VanDerWaalsContact O-CB 3.32Å; N560-A563 WeakPolarHBondContact O-CB 3.29Å; N560-A563 PolarHBondContact O-N 2.82Å; N560-A563 VanDerWaalsContact O-N 3.07Å; N560-A563 PolarHBondContact OD1-N 3.05Å; A563-N565 PolarHBondContact O-N 2.92Å; A563-Y566 PolarHBondContact O-N 3.23Å; A563-I568 HydrophobicContact CB-CD1 4.49Å; A563-V661 HydrophobicContact CB-CB 4.23Å; A563-V661 WeakPolarHBondContact CB-O 3.27Å
564	K	85.8	Confident	91.6	Very high	130 Å²	130	58.8 Å²	58.8	57%	0.565	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-63.3	-30.8	179.2	-62.3	177.5	-172.4	170.3	0	112.4	D442 L562 Y566	D442-K564 IonicContact OD1-NZ 2.63Å; D442-K564 PolarHBondContact OD1-NZ 2.68Å; D442-K564 IonicContact OD2-NZ 3.19Å; D442-K564 PolarHBondContact OD2-NZ 3.24Å; L562-K564 PolarHBondContact O-N 2.92Å; L562-K564 VanDerWaalsContact O-N 3.16Å; K564-Y566 VanDerWaalsContact C-N 3.28Å; K564-Y566 PolarHBondContact O-N 3.01Å
565	N	88	Confident	91.6	Very high	105 Å²	105	56.6 Å²	56.6	56%	0.561	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-73	-22.4	-178.4	-61.4	-21.9	0	0	0	112.8	L562 A563	L562-N565 WeakPolarHBondContact O-CB 3.48Å; L562-N565 PolarHBondContact O-N 2.71Å; A563-N565 PolarHBondContact O-N 2.92Å
566	Y	91.7	Very high	91.6	Very high	14 Å²	14	57.7 Å²	57.7	6%	0.055	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-97.5	1	-176.5	-69.8	-73.9	0	0	0	114.2	L562 A563 K564 I568 P599 A648 D650 D654 F659 V661	L562-Y566 HydrophobicContact CB-CE2 4.29Å; L562-Y566 VanDerWaalsContact O-CD2 3.29Å; L562-Y566 WeakPolarHBondContact O-CD2 3.45Å; A563-Y566 PolarHBondContact O-N 3.23Å; K564-Y566 VanDerWaalsContact C-N 3.28Å; K564-Y566 PolarHBondContact O-N 3.01Å; Y566-I568 VanDerWaalsContact C-N 3.26Å; Y566-I568 WeakPolarHBondContact O-CG2 3.46Å; Y566-I568 PolarHBondContact O-N 3.07Å; Y566-P599 HydrophobicContact CD1-CB 4.39Å; Y566-P599 VanDerWaalsContact O-CG 3.29Å; Y566-P599 WeakPolarHBondContact O-CG 3.4Å; Y566-A648 HydrophobicContact CD1-CB 3.78Å; Y566-A648 HydrophobicContact CD2-CB 3.71Å; Y566-A648 HydrophobicContact CE1-CB 4.25Å; Y566-A648 HydrophobicContact CE2-CB 4.16Å; Y566-A648 HydrophobicContact CG-CB 3.49Å; Y566-A648 VanDerWaalsContact CG-CB 3.49Å; Y566-D650 HydrophobicContact CE1-CB 4.21Å; Y566-D654 WeakPolarHBondContact CE1-OD2 3.47Å; Y566-D654 PolarHBondContact OH-OD2 3.12Å; Y566-F659 WeakPolarHBondContact OH-CD2 3.47Å; Y566-V661 HydrophobicContact CD2-CG1 3.51Å; Y566-V661 HydrophobicContact CE2-CG1 3.87Å; Y566-V661 HydrophobicContact CG-CG1 4.44Å
567	R	89.4	Confident	91.7	Very high	57 Å²	57	56.6 Å²	56.6	22%	0.215	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	39	176.3	-54.7	167.5	-76.6	154.2	-3.6	112.8	G591 P597	R567-G591 PolarHBondContact NH1-O 2.85Å; R567-G591 PolarHBondContact O-N 3.26Å; R567-P597 PolarHBondContact NH2-O 2.9Å
568	I	92.9	Very high	91.8	Very high	16 Å²	16	64.5 Å²	64.5	8%	0.082	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.5	179.9	62.4	177.8	0	0	0	111	A563 Y566 G589 L590 P599 L601 V661 W662	A563-I568 HydrophobicContact CB-CD1 4.49Å; Y566-I568 VanDerWaalsContact C-N 3.26Å; Y566-I568 WeakPolarHBondContact O-CG2 3.46Å; Y566-I568 PolarHBondContact O-N 3.07Å; I568-G589 WeakPolarHBondContact CA-O 3.36Å; I568-L590 HydrophobicContact CG2-CD2 3.87Å; I568-P599 HydrophobicContact CG2-CG 4.03Å; I568-L601 HydrophobicContact CG2-CD2 4.18Å; I568-V661 HydrophobicContact CD1-CB 3.99Å; I568-V661 HydrophobicContact CD1-CG2 3.55Å; I568-W662 HydrophobicContact CD1-CE3 4.49Å
569	T	93.1	Very high	92	Very high	94 Å²	94	64.3 Å²	64.3	58%	0.577	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.6	174.1	55.5	0	0	0	0	109.7	F588 G589	T569-F588 CarbonylContact O-C 3.54Å; T569-F588 WeakPolarHBondContact O-CA 3.31Å; T569-G589 PolarHBondContact N-O 3.28Å; T569-G589 PolarHBondContact O-N 2.93Å
570	A	94.1	Very high	92.1	Very high	16 Å²	16	66.5 Å²	66.5	13%	0.132	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	135.5	176.6	0	0	0	0	0	110.8	R572 F588 W662 Y664	A570-R572 VanDerWaalsContact C-N 3.33Å; A570-F588 HydrophobicContact CB-CD1 3.94Å; A570-F588 HydrophobicContact CB-CE1 3.64Å; A570-F588 HydrophobicContact CB-CZ 4.38Å; A570-W662 HydrophobicContact CB-CE3 4.3Å; A570-W662 HydrophobicContact CB-CH2 3.36Å; A570-W662 HydrophobicContact CB-CZ2 3.57Å; A570-W662 HydrophobicContact CB-CZ3 3.75Å; A570-Y664 WeakPolarHBondContact CB-OH 3.11Å
571	Q	94	Very high	92.4	Very high	126 Å²	126	70.6 Å²	70.6	59%	0.589	34%	0.341	S	S	*	.	S	Bend	trans	-68.9	-35	171.4	-171.6	-174.6	11.4	0	0	111.6	R587	Q571-R587 HydrophobicContact CB-CB 4.21Å; Q571-R587 PolarHBondContact N-O 2.8Å; Q571-R587 VanDerWaalsContact OE1-CG 3.31Å
572	R	93.1	Very high	93	Very high	122 Å²	122	67.3 Å²	67.3	46%	0.46	33%	0.326	S	S	.	.			trans	-105	107.3	176.9	-63.6	-74	-173.3	145.8	2.2	108.3	A570 L577 Y664	A570-R572 VanDerWaalsContact C-N 3.33Å; R572-L577 HydrophobicContact CB-CD1 4.4Å; R572-L577 HydrophobicContact CB-CD2 4.2Å; R572-Y664 WeakPolarHBondContact O-CE1 3.44Å; R572-Y664 PolarHBondContact O-OH 3.47Å
573	V	89.9	Confident	93.3	Very high	71 Å²	71	65.7 Å²	65.7	43%	0.43	32%	0.318	S	S	.	.			trans	-87.8	-19.8	-179.8	-64.5	0	0	0	0	113.2
574	D	91.9	Very high	93.6	Very high	96 Å²	96	66.3 Å²	66.3	51%	0.513	32%	0.321	S	S	.	.			trans	-67.5	134.8	179.1	-57.2	-37.4	0	0	0	110.5	L577 Y664	D574-L577 HydrophobicContact CB-CD2 4.22Å; D574-L577 WeakPolarHBondContact O-CD2 3.41Å; D574-Y664 VanDerWaalsContact O-CD1 3.27Å; D574-Y664 WeakPolarHBondContact O-CD1 3.33Å; D574-Y664 VanDerWaalsContact O-CE1 3.29Å; D574-Y664 WeakPolarHBondContact O-CE1 3.3Å
575	C	93.2	Very high	94.1	Very high	7 Å²	7	62.8 Å²	62.8	5%	0.047	31%	0.306	C	S	.	.	S	Bend	trans	-76.6	-30.7	-176.4	-62.9	0	0	0	0	112.4	E472 Y557 G558 Y664 I665	E472-C575 HydrophobicContact CB-CB 3.91Å; E472-C575 WeakPolarHBondContact OE2-CB 3.44Å; Y557-C575 VanDerWaalsContact C-SG 3.6Å; Y557-C575 PolarHBondContact O-SG 2.98Å; Y557-C575 VanDerWaalsContact O-SG 3.36Å; G558-C575 WeakPolarHBondContact CA-SG 3.47Å; C575-Y664 WeakPolarHBondContact O-CA 3.3Å; C575-I665 PolarHBondContact O-N 3.05Å
576	T	95.6	Very high	94.6	Very high	49 Å²	49	57.8 Å²	57.8	30%	0.301	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.7	178.3	-56.8	0	0	0	0	110	R470 E472 I665 I667	R470-T576 PolarHBondContact NH1-OG1 3.28Å; R470-T576 VanDerWaalsContact NH1-OG1 3.09Å; R470-T576 PolarHBondContact NH2-OG1 2.82Å; R470-T576 VanDerWaalsContact NH2-OG1 3.1Å; E472-T576 PolarHBondContact OE2-OG1 2.72Å; E472-T576 VanDerWaalsContact OE2-OG1 3.08Å; T576-I665 CarbonylContact C-O 3.58Å; T576-I665 WeakPolarHBondContact CA-O 3.47Å; T576-I665 HydrophobicContact CG2-CG2 3.81Å; T576-I665 VanDerWaalsContact OG1-CG2 3.24Å; T576-I665 WeakPolarHBondContact OG1-CG2 3.24Å; T576-I667 HydrophobicContact CG2-CD1 3.72Å; T576-I667 HydrophobicContact CG2-CG1 4.44Å
577	L	97.2	Very high	94.8	Very high	9 Å²	9	60.4 Å²	60.4	5%	0.047	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	145.2	-177.3	-57.2	179.5	0	0	0	110.5	R572 D574 L584 I586 Y664 I665 I666 I667	R572-L577 HydrophobicContact CB-CD1 4.4Å; R572-L577 HydrophobicContact CB-CD2 4.2Å; D574-L577 HydrophobicContact CB-CD2 4.22Å; D574-L577 WeakPolarHBondContact O-CD2 3.41Å; L577-L584 HydrophobicContact CB-CD2 3.85Å; L577-L584 HydrophobicContact CD1-CD2 3.97Å; L577-I586 HydrophobicContact CD1-CD1 3.59Å; L577-I586 HydrophobicContact CD1-CG1 4.09Å; L577-Y664 HydrophobicContact CD1-CD1 3.54Å; L577-Y664 HydrophobicContact CD1-CE1 3.98Å; L577-Y664 HydrophobicContact CD1-CG 4.01Å; L577-Y664 HydrophobicContact CG-CD1 3.95Å; L577-I665 PolarHBondContact N-O 2.87Å; L577-I666 CarbonylContact O-C 3.53Å; L577-I666 VanDerWaalsContact O-CA 3.31Å; L577-I666 WeakPolarHBondContact O-CA 3.27Å; L577-I667 PolarHBondContact O-N 3.38Å
578	R	97.8	Very high	95.2	Very high	176 Å²	176	57.7 Å²	57.7	66%	0.664	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.4	173.3	177.7	173	-92.9	-149.7	-5.8	110	I667	R578-I667 WeakPolarHBondContact CA-O 3.26Å
579	A	97.8	Very high	95.3	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.008	29%	0.287	C	S	.	.			trans	-75.5	141.3	169.8	0	0	0	0	0	110.2	T583 L584 L636 I666 I667	A579-T583 CarbonylContact C-O 3.56Å; A579-T583 VanDerWaalsContact CA-O 3.28Å; A579-T583 WeakPolarHBondContact CA-O 3.44Å; A579-T583 WeakPolarHBondContact CB-O 3.48Å; A579-L584 HydrophobicContact CB-CB 4.15Å; A579-L636 HydrophobicContact CB-CD1 3.83Å; A579-I666 HydrophobicContact CB-CG2 4.05Å; A579-I667 PolarHBondContact N-O 3.14Å
580	V	96.4	Very high	95.4	Very high	105 Å²	105	54.2 Å²	54.2	64%	0.636	26%	0.263	S	S	*	.	B	Isolated β-bridge	trans	-102.5	120.1	177.3	178.2	0	0	0	0	107.6	G582 T583	V580-G582 VanDerWaalsContact C-N 3.29Å; V580-G582 PolarHBondContact O-N 2.98Å; V580-T583 PolarHBondContact N-O 3.46Å; V580-T583 PolarHBondContact O-N 3.13Å; V580-T583 PolarHBondContact O-OG1 3.21Å
581	R	94.8	Very high	95	Very high	148 Å²	148	54.9 Å²	54.9	56%	0.558	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	44.3	-175.8	-60.2	-176	63.9	-153.7	-1.8	113	T583 C670 S672 P673	R581-T583 PolarHBondContact O-N 2.84Å; R581-T583 VanDerWaalsContact O-N 3.12Å; R581-C670 VanDerWaalsContact CA-SG 3.52Å; R581-S672 WeakPolarHBondContact O-CA 3.43Å; R581-P673 VanDerWaalsContact O-CD 3.27Å; R581-P673 WeakPolarHBondContact O-CD 3.38Å
582	G	96.2	Very high	94.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	4.8	-176.9	0	0	0	0	0	115.5	V580 L636 S668 C670	V580-G582 VanDerWaalsContact C-N 3.29Å; V580-G582 PolarHBondContact O-N 2.98Å; G582-L636 WeakPolarHBondContact O-CB 3.31Å; G582-L636 PolarHBondContact O-N 2.51Å; G582-S668 WeakPolarHBondContact CA-OG 3.12Å; G582-S668 PolarHBondContact N-OG 2.92Å; G582-C670 WeakPolarHBondContact CA-O 3.42Å
583	T	96.7	Very high	93.5	Very high	31 Å²	31	51.2 Å²	51.2	19%	0.19	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.8	-179.6	68	0	0	0	0	113	A579 V580 R581 I634 F635	A579-T583 CarbonylContact C-O 3.56Å; A579-T583 VanDerWaalsContact CA-O 3.28Å; A579-T583 WeakPolarHBondContact CA-O 3.44Å; A579-T583 WeakPolarHBondContact CB-O 3.48Å; V580-T583 PolarHBondContact N-O 3.46Å; V580-T583 PolarHBondContact O-N 3.13Å; V580-T583 PolarHBondContact O-OG1 3.21Å; R581-T583 PolarHBondContact O-N 2.84Å; R581-T583 VanDerWaalsContact O-N 3.12Å; T583-I634 VanDerWaalsContact CA-O 3.23Å; T583-I634 WeakPolarHBondContact CA-O 3.06Å; T583-F635 HydrophobicContact CG2-CD1 3.77Å; T583-F635 HydrophobicContact CG2-CE1 4.15Å
584	L	97.1	Very high	93	Very high	19 Å²	19	54 Å²	54	10%	0.099	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	141.1	177	-179.2	64.4	0	0	0	109.8	L577 A579 I586 I634 I666	L577-L584 HydrophobicContact CB-CD2 3.85Å; L577-L584 HydrophobicContact CD1-CD2 3.97Å; A579-L584 HydrophobicContact CB-CB 4.15Å; L584-I586 HydrophobicContact CD2-CD1 3.94Å; L584-I586 HydrophobicContact CD2-CG1 4.07Å; L584-I586 HydrophobicContact CG-CD1 4.47Å; L584-I586 HydrophobicContact CG-CG1 4.07Å; L584-I634 HydrophobicContact CB-CB 4.43Å; L584-I634 PolarHBondContact N-O 2.68Å; L584-I634 VanDerWaalsContact N-O 3.12Å; L584-I634 WeakPolarHBondContact O-CB 3.29Å; L584-I634 PolarHBondContact O-N 3.24Å; L584-I666 HydrophobicContact CD2-CB 4.48Å; L584-I666 HydrophobicContact CD2-CD1 3.92Å; L584-I666 HydrophobicContact CD2-CG1 3.84Å; L584-I666 HydrophobicContact CD2-CG2 3.85Å
585	E	96.3	Very high	92.3	Very high	56 Å²	56	53.7 Å²	53.7	26%	0.262	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.7	171	-170.6	174.1	90.7	0	0	110.3	R587 R622 V631 F632	E585-R587 HydrophobicContact CG-CG 4.4Å; E585-R587 IonicContact OE1-CZ 3.98Å; E585-R587 IonicContact OE1-NE 2.69Å; E585-R587 PolarHBondContact OE1-NE 2.84Å; E585-R587 IonicContact OE1-NH2 2.99Å; E585-R587 PolarHBondContact OE1-NH2 2.91Å; E585-R622 IonicContact OE2-CZ 2.88Å; E585-R622 IonicContact OE2-NH1 3.84Å; E585-R622 IonicContact OE2-NH2 3.77Å; E585-R622 PolarHBondContact OE2-NH2 3.37Å; E585-V631 HydrophobicContact CG-CG1 3.48Å; E585-V631 VanDerWaalsContact CG-CG1 3.48Å; E585-F632 WeakPolarHBondContact CA-O 3.41Å
586	I	97.2	Very high	91.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.6	178.1	-54.5	178.3	0	0	0	108.5	L577 L584 F588 V631 F632 I634 L644 Y664	L577-I586 HydrophobicContact CD1-CD1 3.59Å; L577-I586 HydrophobicContact CD1-CG1 4.09Å; L584-I586 HydrophobicContact CD2-CD1 3.94Å; L584-I586 HydrophobicContact CD2-CG1 4.07Å; L584-I586 HydrophobicContact CG-CD1 4.47Å; L584-I586 HydrophobicContact CG-CG1 4.07Å; I586-F588 HydrophobicContact CG2-CD2 4.33Å; I586-F588 HydrophobicContact CG2-CE2 3.68Å; I586-F588 HydrophobicContact CG2-CZ 4.27Å; I586-V631 WeakPolarHBondContact O-CA 3.45Å; I586-F632 PolarHBondContact N-O 3.23Å; I586-F632 PolarHBondContact O-N 3.29Å; I586-I634 HydrophobicContact CD1-CD1 4.13Å; I586-L644 HydrophobicContact CD1-CD2 3.46Å; I586-L644 VanDerWaalsContact CD1-CD2 3.46Å; I586-Y664 HydrophobicContact CD1-CD2 4.31Å; I586-Y664 HydrophobicContact CG2-CE2 4.34Å
587	R	97.1	Very high	91.2	Very high	70 Å²	70	56.1 Å²	56.1	26%	0.264	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	144.4	-175.7	-47.5	-163.6	-178.9	-169.4	-8.5	112.1	Q571 E585 E629 A630 V631	Q571-R587 HydrophobicContact CB-CB 4.21Å; Q571-R587 PolarHBondContact N-O 2.8Å; Q571-R587 VanDerWaalsContact OE1-CG 3.31Å; E585-R587 HydrophobicContact CG-CG 4.4Å; E585-R587 IonicContact OE1-CZ 3.98Å; E585-R587 IonicContact OE1-NE 2.69Å; E585-R587 PolarHBondContact OE1-NE 2.84Å; E585-R587 IonicContact OE1-NH2 2.99Å; E585-R587 PolarHBondContact OE1-NH2 2.91Å; R587-E629 WeakPolarHBondContact CB-OE1 3.4Å; R587-E629 WeakPolarHBondContact CD-OE1 3.18Å; R587-E629 IonicContact NH1-OE1 3.46Å; R587-A630 CarbonylContact C-O 3.49Å; R587-A630 WeakPolarHBondContact CA-O 3.34Å; R587-V631 HydrophobicContact CB-CG2 4.41Å; R587-V631 HydrophobicContact CG-CG1 4.12Å; R587-V631 HydrophobicContact CG-CG2 4.01Å
588	F	97	Very high	90.8	Very high	0 Å²	0	58 Å²	58	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	124.7	178.2	-70.6	-91.5	0	0	0	110.9	T569 A570 I586 L590 L601 E629 A630 F632 V646 W662 Y664	T569-F588 CarbonylContact O-C 3.54Å; T569-F588 WeakPolarHBondContact O-CA 3.31Å; A570-F588 HydrophobicContact CB-CD1 3.94Å; A570-F588 HydrophobicContact CB-CE1 3.64Å; A570-F588 HydrophobicContact CB-CZ 4.38Å; I586-F588 HydrophobicContact CG2-CD2 4.33Å; I586-F588 HydrophobicContact CG2-CE2 3.68Å; I586-F588 HydrophobicContact CG2-CZ 4.27Å; F588-L590 HydrophobicContact CB-CD2 4.49Å; F588-L601 HydrophobicContact CB-CD1 3.65Å; F588-L601 HydrophobicContact CD1-CD1 4.37Å; F588-L601 HydrophobicContact CD2-CD1 4.13Å; F588-L601 HydrophobicContact CG-CD1 3.81Å; F588-E629 CarbonylContact O-C 3.57Å; F588-E629 VanDerWaalsContact O-CA 3.28Å; F588-E629 WeakPolarHBondContact O-CA 3.41Å; F588-A630 HydrophobicContact CB-CB 4.5Å; F588-A630 PolarHBondContact N-O 3.35Å; F588-A630 PolarHBondContact O-N 3.01Å; F588-F632 AromaticContact CD2-CD2 3.93Å; F588-F632 HydrophobicContact CD2-CD2 3.93Å; F588-F632 AromaticContact CD2-CE2 3.73Å; F588-F632 HydrophobicContact CD2-CE2 3.73Å; F588-F632 AromaticContact CE2-CD2 3.89Å; F588-F632 HydrophobicContact CE2-CD2 3.89Å; F588-F632 AromaticContact CE2-CE2 3.82Å; F588-F632 HydrophobicContact CE2-CE2 3.82Å; F588-V646 HydrophobicContact CE2-CG1 4.14Å; F588-V646 HydrophobicContact CE2-CG2 3.98Å; F588-V646 HydrophobicContact CZ-CB 4.33Å; F588-V646 HydrophobicContact CZ-CG1 4.08Å; F588-V646 HydrophobicContact CZ-CG2 3.86Å; F588-W662 HydrophobicContact CE1-CD2 4.08Å; F588-W662 AromaticContact CE1-CE3 3.83Å; F588-W662 HydrophobicContact CE1-CE3 3.83Å; F588-W662 HydrophobicContact CE1-CG 4.44Å; F588-W662 HydrophobicContact CE1-CZ3 4.34Å; F588-W662 HydrophobicContact CZ-CG 4.49Å; F588-Y664 AromaticContact CZ-CE2 3.91Å; F588-Y664 HydrophobicContact CZ-CE2 3.91Å
589	G	95.5	Very high	90.6	Very high	24 Å²	24	49.9 Å²	49.9	25%	0.247	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	137.8	166.1	0	0	0	0	0	110.5	I568 T569	I568-G589 WeakPolarHBondContact CA-O 3.36Å; T569-G589 PolarHBondContact N-O 3.28Å; T569-G589 PolarHBondContact O-N 2.93Å
590	L	93.9	Very high	90.3	Very high	13 Å²	13	55.4 Å²	55.4	7%	0.068	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	108.8	180	-50	-177.8	0	0	0	108.3	I568 F588 A592 L598 P599 L601 T628 A630	I568-L590 HydrophobicContact CG2-CD2 3.87Å; F588-L590 HydrophobicContact CB-CD2 4.49Å; L590-A592 PolarHBondContact O-N 3.49Å; L590-L598 HydrophobicContact CB-CD2 4.17Å; L590-P599 HydrophobicContact CB-CG 4.13Å; L590-P599 HydrophobicContact CD2-CG 4.09Å; L590-L601 HydrophobicContact CD2-CD1 3.79Å; L590-L601 HydrophobicContact CD2-CG 3.95Å; L590-T628 WeakPolarHBondContact CB-O 3.45Å; L590-T628 PolarHBondContact N-O 3.47Å; L590-A630 HydrophobicContact CD1-CB 4.23Å; L590-A630 HydrophobicContact CD2-CB 4.39Å
591	G	86.6	Confident	90.3	Very high	30 Å²	30	50.8 Å²	50.8	31%	0.309	30%	0.303	S	S	.	.			trans	-69.8	124	-176.1	0	0	0	0	0	112.8	R567	R567-G591 PolarHBondContact NH1-O 2.85Å; R567-G591 PolarHBondContact O-N 3.26Å
592	A	79.1	Confident	90.2	Very high	75 Å²	75	46 Å²	46	62%	0.62	29%	0.288	S	S	*	.			trans	-85.7	133.7	172.6	0	0	0	0	0	111	L590 L598	L590-A592 PolarHBondContact O-N 3.49Å; A592-L598 HydrophobicContact CB-CD2 4.07Å
593	L	76.9	Confident	90.2	Very high	96 Å²	96	46.7 Å²	46.7	50%	0.503	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-119.7	143.9	164.6	-76.8	169.7	0	0	0	108.2	G595 C596	L593-G595 PolarHBondContact O-N 2.79Å; L593-C596 HydrophobicContact CB-CB 4.08Å; L593-C596 PolarHBondContact O-N 2.87Å; L593-C596 VanDerWaalsContact O-N 3.08Å
594	P	77.8	Confident	90.2	Very high	130 Å²	130	49.2 Å²	49.2	84%	0.844	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	126.5	175.7	-23.3	32.8	0	0	0	111.1	C596	P594-C596 VanDerWaalsContact C-N 3.26Å; P594-C596 PolarHBondContact O-N 2.86Å
595	G	79	Confident	90.2	Very high	89 Å²	89	48.8 Å²	48.8	92%	0.918	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-3	178.6	0	0	0	0	0	115.9	L593	L593-G595 PolarHBondContact O-N 2.79Å
596	C	79.4	Confident	90.3	Very high	60 Å²	60	47.6 Å²	47.6	41%	0.405	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-106.2	130.8	176.1	-62.4	0	0	0	0	110.8	L593 P594	L593-C596 HydrophobicContact CB-CB 4.08Å; L593-C596 PolarHBondContact O-N 2.87Å; L593-C596 VanDerWaalsContact O-N 3.08Å; P594-C596 VanDerWaalsContact C-N 3.26Å; P594-C596 PolarHBondContact O-N 2.86Å
597	P	85.2	Confident	90.3	Very high	46 Å²	46	48.3 Å²	48.3	30%	0.299	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-61	154.6	173.9	30.4	-37.7	0	0	0	110.7	R567 P651 V652	R567-P597 PolarHBondContact NH2-O 2.9Å; P597-P651 HydrophobicContact CB-CG 3.9Å; P597-P651 HydrophobicContact CG-CG 4.05Å; P597-V652 HydrophobicContact CG-CB 4.18Å; P597-V652 HydrophobicContact CG-CG2 3.72Å
598	L	89.9	Confident	90.2	Very high	49 Å²	49	47.3 Å²	47.3	26%	0.257	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-68.1	140.4	170.6	-70.7	171.3	0	0	0	109.6	L590 A592 N627 T628	L590-L598 HydrophobicContact CB-CD2 4.17Å; A592-L598 HydrophobicContact CB-CD2 4.07Å; L598-N627 HydrophobicContact CD1-CB 4.4Å; L598-N627 WeakPolarHBondContact CD1-O 3.29Å; L598-T628 HydrophobicContact CD1-CG2 4.37Å
599	P	92.5	Very high	90.1	Very high	5 Å²	5	53.7 Å²	53.7	3%	0.032	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-61.9	148.4	172.3	31.7	-40.1	0	0	0	110.2	Y566 I568 L590 N649	Y566-P599 HydrophobicContact CD1-CB 4.39Å; Y566-P599 VanDerWaalsContact O-CG 3.29Å; Y566-P599 WeakPolarHBondContact O-CG 3.4Å; I568-P599 HydrophobicContact CG2-CG 4.03Å; L590-P599 HydrophobicContact CB-CG 4.13Å; L590-P599 HydrophobicContact CD2-CG 4.09Å; P599-N649 CarbonylContact C-O 3.59Å; P599-N649 WeakPolarHBondContact CA-O 3.31Å
600	R	92.2	Very high	90	Very high	118 Å²	118	53.1 Å²	53.1	45%	0.445	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	135.9	169.7	-68.8	172.2	56.8	-164.5	-4	109.1	A648 N649 F658	R600-A648 CarbonylContact O-C 3.52Å; R600-A648 VanDerWaalsContact O-CA 3.3Å; R600-A648 WeakPolarHBondContact O-CA 3.37Å; R600-N649 PolarHBondContact N-O 3.03Å; R600-N649 PolarHBondContact O-N 3.23Å; R600-F658 HydrophobicContact CB-CE1 4.09Å; R600-F658 HydrophobicContact CB-CZ 4.09Å
601	L	94.9	Very high	90	Very high	8 Å²	8	55.9 Å²	55.9	4%	0.042	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	156.1	172.1	-62.7	-170.3	0	0	0	111.8	I568 F588 L590 Q621 A630 F632 V646 Y647 A648	I568-L601 HydrophobicContact CG2-CD2 4.18Å; F588-L601 HydrophobicContact CB-CD1 3.65Å; F588-L601 HydrophobicContact CD1-CD1 4.37Å; F588-L601 HydrophobicContact CD2-CD1 4.13Å; F588-L601 HydrophobicContact CG-CD1 3.81Å; L590-L601 HydrophobicContact CD2-CD1 3.79Å; L590-L601 HydrophobicContact CD2-CG 3.95Å; L601-Q621 PolarHBondContact O-NE2 3.09Å; L601-A630 HydrophobicContact CB-CB 4.33Å; L601-A630 HydrophobicContact CD1-CB 3.92Å; L601-A630 HydrophobicContact CG-CB 4.38Å; L601-F632 HydrophobicContact CB-CE2 4.48Å; L601-F632 HydrophobicContact CB-CZ 3.91Å; L601-F632 HydrophobicContact CD1-CE2 4.36Å; L601-V646 HydrophobicContact CD1-CG1 4.31Å; L601-V646 HydrophobicContact CD2-CG1 4.5Å; L601-Y647 CarbonylContact C-O 3.47Å; L601-Y647 VanDerWaalsContact CA-O 3.26Å; L601-Y647 WeakPolarHBondContact CA-O 2.99Å; L601-Y647 WeakPolarHBondContact CD2-O 3.34Å; L601-A648 HydrophobicContact CD2-CB 3.53Å
602	M	94.4	Very high	90.2	Very high	48 Å²	48	59.5 Å²	59.5	24%	0.236	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	161.2	161.7	65.7	173.7	-66.3	0	0	109.1	K604 V646 Y647 F658	M602-K604 HydrophobicContact CE-CD 4.44Å; M602-K604 VanDerWaalsContact CE-CE 3.48Å; M602-K604 HydrophobicContact CE-CG 4.24Å; M602-V646 WeakPolarHBondContact O-CA 3.47Å; M602-Y647 HydrophobicContact CG-CD2 4.15Å; M602-Y647 HydrophobicContact CG-CG 4.06Å; M602-Y647 PolarHBondContact N-O 3.32Å; M602-Y647 PolarHBondContact O-N 3.07Å; M602-Y647 HydrophobicContact SD-CG 4.43Å; M602-F658 HydrophobicContact CB-CD1 4.37Å; M602-F658 HydrophobicContact CB-CE1 4.27Å; M602-F658 HydrophobicContact CG-CB 4.4Å; M602-F658 HydrophobicContact CG-CD1 3.55Å; M602-F658 HydrophobicContact CG-CE1 3.94Å; M602-F658 HydrophobicContact CG-CG 4.01Å; M602-F658 HydrophobicContact SD-CB 3.79Å; M602-F658 HydrophobicContact SD-CD1 3.77Å; M602-F658 HydrophobicContact SD-CD2 3.99Å; M602-F658 HydrophobicContact SD-CE1 4.32Å; M602-F658 HydrophobicContact SD-CG 3.57Å; M602-F658 VanDerWaalsContact SD-CG 3.57Å
603	A	96.2	Very high	90.7	Very high	14 Å²	14	62.6 Å²	62.6	12%	0.116	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	154.4	175.5	0	0	0	0	0	112.6	L619 F632 L644 E645 V646	A603-L619 HydrophobicContact CB-CD1 3.82Å; A603-L619 HydrophobicContact CB-CD2 4.47Å; A603-F632 HydrophobicContact CB-CD1 3.68Å; A603-F632 HydrophobicContact CB-CD2 4.39Å; A603-F632 HydrophobicContact CB-CE1 3.45Å; A603-F632 VanDerWaalsContact CB-CE1 3.45Å; A603-F632 HydrophobicContact CB-CE2 4.22Å; A603-F632 HydrophobicContact CB-CG 4.13Å; A603-F632 HydrophobicContact CB-CZ 3.74Å; A603-L644 HydrophobicContact CB-CD1 3.93Å; A603-E645 CarbonylContact C-O 3.55Å; A603-E645 WeakPolarHBondContact CA-O 3.29Å; A603-E645 WeakPolarHBondContact CB-O 3.42Å; A603-V646 HydrophobicContact CB-CG2 4.35Å
604	K	96.3	Very high	91.4	Very high	84 Å²	84	60.9 Å²	60.9	37%	0.365	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.6	177.7	-65	-174	-178.8	178.6	0	110.4	M602 E645 Y647	M602-K604 HydrophobicContact CE-CD 4.44Å; M602-K604 VanDerWaalsContact CE-CE 3.48Å; M602-K604 HydrophobicContact CE-CG 4.24Å; K604-E645 PolarHBondContact N-O 3.25Å; K604-E645 PolarHBondContact O-N 3.23Å; K604-Y647 HydrophobicContact CB-CE2 4.19Å; K604-Y647 HydrophobicContact CD-CE2 4.07Å; K604-Y647 HydrophobicContact CG-CE2 4.02Å
605	L	97.5	Very high	92.2	Very high	9 Å²	9	55.2 Å²	55.2	5%	0.047	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	143	170	-74.6	167.1	0	0	0	110.5	L615 L619 I634 L636 G643 L644 I666	L605-L615 HydrophobicContact CB-CB 4.36Å; L605-L615 HydrophobicContact CB-CD1 4.24Å; L605-L619 HydrophobicContact CD1-CB 4Å; L605-L619 HydrophobicContact CD1-CD1 4.4Å; L605-L619 HydrophobicContact CG-CB 4.47Å; L605-L619 HydrophobicContact CG-CD1 4.07Å; L605-I634 HydrophobicContact CD1-CG2 3.89Å; L605-I634 HydrophobicContact CD2-CD1 4.47Å; L605-I634 HydrophobicContact CD2-CG2 4.24Å; L605-L636 HydrophobicContact CD1-CD2 4.44Å; L605-G643 CarbonylContact C-O 3.54Å; L605-G643 WeakPolarHBondContact CA-O 3.26Å; L605-L644 HydrophobicContact CD2-CB 4.33Å; L605-L644 HydrophobicContact CD2-CD1 3.8Å; L605-L644 HydrophobicContact CG-CD1 4.13Å; L605-I666 HydrophobicContact CD2-CD1 4.19Å
606	K	97.4	Very high	92.7	Very high	31 Å²	31	55.2 Å²	55.2	14%	0.135	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.4	176.4	-62.9	-62.4	-173.2	-178.1	0	108.6	P551 E612 Y642 G643	P551-K606 HydrophobicContact CG-CB 4.17Å; K606-E612 IonicContact NZ-OE1 2.72Å; K606-E612 PolarHBondContact NZ-OE1 2.93Å; K606-E612 IonicContact NZ-OE2 2.75Å; K606-E612 PolarHBondContact NZ-OE2 2.81Å; K606-E612 VanDerWaalsContact NZ-OE2 3.08Å; K606-Y642 CarbonylContact O-C 3.5Å; K606-Y642 VanDerWaalsContact O-CA 3.27Å; K606-Y642 WeakPolarHBondContact O-CA 3.26Å; K606-G643 PolarHBondContact N-O 3.12Å; K606-G643 PolarHBondContact O-N 3.07Å
607	C	97.5	Very high	93.4	Very high	16 Å²	16	55 Å²	55	11%	0.108	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147	174.1	-172.9	0	0	0	0	108.9	L609 V610 L615 E641 Y642	C607-L609 PolarHBondContact SG-N 3.17Å; C607-V610 HydrophobicContact CB-CB 3.87Å; C607-V610 HydrophobicContact CB-CG2 4.45Å; C607-L615 HydrophobicContact CB-CD1 4.04Å; C607-E641 PolarHBondContact SG-O 3.43Å; C607-E641 VanDerWaalsContact SG-O 3.34Å; C607-Y642 HydrophobicContact CB-CD1 3.68Å; C607-Y642 HydrophobicContact CB-CE1 3.77Å
608	T	96.1	Very high	93.9	Very high	49 Å²	49	53.2 Å²	53.2	30%	0.301	29%	0.293	S	S	.	.	S	Bend	trans	-74	-37	175.2	-64.1	0	0	0	0	111.5	P547 P548 F549	P547-T608 HydrophobicContact CB-CG2 4.2Å; P548-T608 HydrophobicContact CG-CG2 3.8Å; P548-T608 PolarHBondContact O-OG1 3.17Å; F549-T608 PolarHBondContact O-OG1 3.24Å
609	L	94	Very high	94.2	Very high	133 Å²	133	52.5 Å²	52.5	70%	0.696	29%	0.29	S	S	*	.	S	Bend	trans	-99	-21.1	-171.7	-58.7	179.3	0	0	0	113.3	C607	C607-L609 PolarHBondContact SG-N 3.17Å
610	V	94.3	Very high	94.3	Very high	13 Å²	13	52.8 Å²	52.8	8%	0.079	29%	0.291	C	S	.	.	S	Bend	trans	-107.2	127.2	179.6	-176.9	0	0	0	0	110	C607 A614 L615 P637 E638 Y642	C607-V610 HydrophobicContact CB-CB 3.87Å; C607-V610 HydrophobicContact CB-CG2 4.45Å; V610-A614 HydrophobicContact CG1-CB 3.91Å; V610-L615 HydrophobicContact CB-CD2 4.15Å; V610-L615 HydrophobicContact CG1-CD2 3.65Å; V610-L615 HydrophobicContact CG1-CG 4.07Å; V610-P637 HydrophobicContact CG1-CG 4.14Å; V610-E638 HydrophobicContact CG2-CB 4.48Å; V610-Y642 HydrophobicContact CG2-CE1 4.45Å
611	A	92.7	Very high	94.4	Very high	71 Å²	71	51 Å²	51	59%	0.587	29%	0.288	S	S	*	.			trans	-63.8	143	179.6	0	0	0	0	0	112.2	N613 A614 L615	A611-N613 VanDerWaalsContact C-N 3.27Å; A611-N613 PolarHBondContact O-N 2.99Å; A611-A614 WeakPolarHBondContact O-CB 3.09Å; A611-A614 PolarHBondContact O-N 3.49Å; A611-L615 PolarHBondContact O-N 3.46Å
612	E	91.3	Very high	94.3	Very high	106 Å²	106	51.1 Å²	51.1	50%	0.495	29%	0.288	S	S	.	.	H	α-helix	trans	-55.3	-39	-175.7	-178.6	164.2	-167.8	0	0	113.4	K606 A614 L615 S616	K606-E612 IonicContact NZ-OE1 2.72Å; K606-E612 PolarHBondContact NZ-OE1 2.93Å; K606-E612 IonicContact NZ-OE2 2.75Å; K606-E612 PolarHBondContact NZ-OE2 2.81Å; K606-E612 VanDerWaalsContact NZ-OE2 3.08Å; E612-A614 PolarHBondContact O-N 3.12Å; E612-L615 WeakPolarHBondContact O-CB 3.48Å; E612-L615 PolarHBondContact O-N 3.23Å; E612-S616 PolarHBondContact O-N 3.4Å
613	N	90.3	Very high	94.1	Very high	140 Å²	140	51.3 Å²	51.3	75%	0.749	29%	0.294	S	S	*	.	H	α-helix	trans	-62	-32.9	178.4	-62.5	-7.7	0	0	0	112.4	A611 L615 S616	A611-N613 VanDerWaalsContact C-N 3.27Å; A611-N613 PolarHBondContact O-N 2.99Å; N613-L615 VanDerWaalsContact C-N 3.26Å; N613-L615 PolarHBondContact O-N 2.85Å; N613-S616 WeakPolarHBondContact O-CB 3.5Å; N613-S616 PolarHBondContact O-N 3.49Å; N613-S616 PolarHBondContact O-OG 2.7Å
614	A	90.7	Very high	93.8	Very high	60 Å²	60	51.5 Å²	51.5	50%	0.496	29%	0.293	S	S	.	.	H	α-helix	trans	-73.7	-18.8	177	0	0	0	0	0	112.5	V610 A611 E612	V610-A614 HydrophobicContact CG1-CB 3.91Å; A611-A614 WeakPolarHBondContact O-CB 3.09Å; A611-A614 PolarHBondContact O-N 3.49Å; E612-A614 PolarHBondContact O-N 3.12Å
615	L	94.9	Very high	93.3	Very high	10 Å²	10	52.3 Å²	52.3	5%	0.052	30%	0.301	C	S	.	.	H	α-helix	trans	-87.1	-10.7	177	-57.3	175.8	0	0	0	113.3	L605 C607 V610 A611 E612 N613 K617 S618 P637 Y642	L605-L615 HydrophobicContact CB-CB 4.36Å; L605-L615 HydrophobicContact CB-CD1 4.24Å; C607-L615 HydrophobicContact CB-CD1 4.04Å; V610-L615 HydrophobicContact CB-CD2 4.15Å; V610-L615 HydrophobicContact CG1-CD2 3.65Å; V610-L615 HydrophobicContact CG1-CG 4.07Å; A611-L615 PolarHBondContact O-N 3.46Å; E612-L615 WeakPolarHBondContact O-CB 3.48Å; E612-L615 PolarHBondContact O-N 3.23Å; N613-L615 VanDerWaalsContact C-N 3.26Å; N613-L615 PolarHBondContact O-N 2.85Å; L615-K617 PolarHBondContact O-N 3.05Å; L615-S618 WeakPolarHBondContact O-CB 3.33Å; L615-S618 PolarHBondContact O-N 3.39Å; L615-S618 VanDerWaalsContact O-N 3.07Å; L615-P637 HydrophobicContact CD2-CG 3.96Å; L615-Y642 HydrophobicContact CD2-CD1 4.21Å; L615-Y642 HydrophobicContact CD2-CE1 3.79Å
616	S	89.9	Confident	92.6	Very high	90 Å²	90	55.1 Å²	55.1	63%	0.629	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.9	-175.6	60.4	0	0	0	0	114.4	E612 N613	E612-S616 PolarHBondContact O-N 3.4Å; N613-S616 WeakPolarHBondContact O-CB 3.5Å; N613-S616 PolarHBondContact O-N 3.49Å; N613-S616 PolarHBondContact O-OG 2.7Å
617	K	93.3	Very high	92	Very high	55 Å²	55	58.6 Å²	58.6	24%	0.239	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	26.4	-179.4	-61.8	-172	173.4	-169.6	0	113.3	L615 L677 H736 D737	L615-K617 PolarHBondContact O-N 3.05Å; K617-L677 HydrophobicContact CB-CB 4.47Å; K617-L677 WeakPolarHBondContact CD-O 3.5Å; K617-L677 WeakPolarHBondContact CG-O 3.4Å; K617-L677 WeakPolarHBondContact O-CB 3.44Å; K617-L677 PolarHBondContact O-N 3.06Å; K617-H736 PolarHBondContact NZ-O 2.97Å; K617-D737 VanDerWaalsContact CE-OD2 3.24Å; K617-D737 WeakPolarHBondContact CE-OD2 3.38Å; K617-D737 IonicContact NZ-OD2 3.7Å; K617-D737 PolarHBondContact NZ-OD2 3.29Å
618	S	96.4	Very high	91.7	Very high	8 Å²	8	60.8 Å²	60.8	6%	0.056	37%	0.365	C	S	.	.	S	Bend	trans	-113.6	-2.2	-176.8	-69.9	0	0	0	0	114.3	L615 I634 F635	L615-S618 WeakPolarHBondContact O-CB 3.33Å; L615-S618 PolarHBondContact O-N 3.39Å; L615-S618 VanDerWaalsContact O-N 3.07Å; S618-I634 CarbonylContact O-C 3.54Å; S618-I634 WeakPolarHBondContact O-CA 3.31Å; S618-F635 WeakPolarHBondContact CA-O 3.29Å; S618-F635 WeakPolarHBondContact CB-O 3.29Å; S618-F635 PolarHBondContact O-N 3.43Å; S618-F635 PolarHBondContact OG-O 2.99Å; S618-F635 VanDerWaalsContact OG-O 3.04Å
619	L	95.8	Very high	91.6	Very high	34 Å²	34	60 Å²	60	18%	0.178	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	121.6	-179	-176.2	152	0	0	0	110.6	A603 L605 Q621 F632 A633 I634 L644	A603-L619 HydrophobicContact CB-CD1 3.82Å; A603-L619 HydrophobicContact CB-CD2 4.47Å; L605-L619 HydrophobicContact CD1-CB 4Å; L605-L619 HydrophobicContact CD1-CD1 4.4Å; L605-L619 HydrophobicContact CG-CB 4.47Å; L605-L619 HydrophobicContact CG-CD1 4.07Å; L619-Q621 HydrophobicContact CD2-CB 4.37Å; L619-F632 HydrophobicContact CD2-CD1 3.96Å; L619-A633 WeakPolarHBondContact CA-O 3.46Å; L619-I634 HydrophobicContact CD1-CG1 4.29Å; L619-I634 HydrophobicContact CG-CG1 4.41Å; L619-L644 HydrophobicContact CD1-CD1 3.47Å; L619-L644 VanDerWaalsContact CD1-CD1 3.47Å
620	L	95.2	Very high	91.6	Very high	11 Å²	11	53.8 Å²	53.8	6%	0.058	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.7	172.6	175.5	67	0	0	0	109.1	F632 A633 F635 L677 I680 L685 F705 L790	L620-F632 WeakPolarHBondContact O-CA 3.49Å; L620-A633 HydrophobicContact CB-CB 4.31Å; L620-A633 PolarHBondContact N-O 3.13Å; L620-A633 PolarHBondContact O-N 3.38Å; L620-F635 HydrophobicContact CB-CE2 4.33Å; L620-L677 HydrophobicContact CB-CD1 3.71Å; L620-L677 HydrophobicContact CB-CD2 4.01Å; L620-L677 VanDerWaalsContact N-CD1 3.34Å; L620-I680 HydrophobicContact CD1-CD1 3.95Å; L620-L685 HydrophobicContact CD1-CD1 4.1Å; L620-F705 HydrophobicContact CD2-CB 4.11Å; L620-F705 HydrophobicContact CD2-CD1 4.39Å; L620-F705 HydrophobicContact CD2-CD2 3.38Å; L620-F705 HydrophobicContact CD2-CE2 3.88Å; L620-F705 HydrophobicContact CD2-CG 3.68Å; L620-L790 HydrophobicContact CD1-CD2 3.9Å; L620-L790 HydrophobicContact CD2-CD2 3.65Å; L620-L790 HydrophobicContact CG-CD2 4.39Å
621	Q	94	Very high	91.7	Very high	80 Å²	80	53.1 Å²	53.1	37%	0.374	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	136.1	171.5	176.4	-178.9	-23.3	0	0	110.2	L601 L619 V631 F632	L601-Q621 PolarHBondContact O-NE2 3.09Å; L619-Q621 HydrophobicContact CD2-CB 4.37Å; Q621-V631 WeakPolarHBondContact CA-O 3.36Å; Q621-F632 HydrophobicContact CB-CD1 4Å; Q621-F632 HydrophobicContact CB-CE1 3.99Å; Q621-F632 HydrophobicContact CG-CD1 4.1Å; Q621-F632 HydrophobicContact CG-CE1 3.69Å
622	R	92.1	Very high	91.9	Very high	12 Å²	12	49.8 Å²	49.8	5%	0.045	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	161.4	171	65.9	-167.9	-170.6	-83.3	4	111.5	E585 I624 V631 D703	E585-R622 IonicContact OE2-CZ 2.88Å; E585-R622 IonicContact OE2-NH1 3.84Å; E585-R622 IonicContact OE2-NH2 3.77Å; E585-R622 PolarHBondContact OE2-NH2 3.37Å; R622-I624 HydrophobicContact CG-CG2 4.48Å; R622-V631 HydrophobicContact CG-CB 4.06Å; R622-V631 PolarHBondContact N-O 3.46Å; R622-V631 PolarHBondContact O-N 3.08Å; R622-D703 WeakPolarHBondContact CD-OD1 3.43Å; R622-D703 IonicContact CZ-OD1 3.28Å; R622-D703 IonicContact CZ-OD2 3.68Å; R622-D703 IonicContact NE-OD1 3.71Å; R622-D703 PolarHBondContact NE-OD1 3.45Å; R622-D703 IonicContact NE-OD2 2.7Å; R622-D703 PolarHBondContact NE-OD2 2.87Å; R622-D703 IonicContact NH2-OD1 2.65Å; R622-D703 IonicContact NH2-OD2 3.84Å; R622-D703 PolarHBondContact NH2-OD2 3.15Å
623	S	89.5	Confident	92.1	Very high	52 Å²	52	44.9 Å²	44.9	36%	0.364	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.4	173	-58.1	0	0	0	0	109.4	N627 E629	S623-N627 VanDerWaalsContact CB-OD1 3.24Å; S623-N627 WeakPolarHBondContact CB-OD1 3.4Å; S623-E629 CarbonylContact C-O 3.53Å; S623-E629 VanDerWaalsContact CA-O 3.28Å; S623-E629 WeakPolarHBondContact CA-O 3.39Å
624	I	89.8	Confident	92.5	Very high	18 Å²	18	38.2 Å²	38.2	9%	0.092	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	177.7	179	66.6	174.4	0	0	0	110.1	R622 G626 N627 T628 E629 V631	R622-I624 HydrophobicContact CG-CG2 4.48Å; I624-G626 VanDerWaalsContact C-N 3.33Å; I624-G626 PolarHBondContact O-N 2.76Å; I624-N627 PolarHBondContact O-N 3.35Å; I624-N627 VanDerWaalsContact O-N 3.1Å; I624-T628 PolarHBondContact O-N 3.46Å; I624-E629 HydrophobicContact CD1-CG 4.36Å; I624-E629 HydrophobicContact CG1-CB 3.85Å; I624-E629 HydrophobicContact CG1-CG 4.05Å; I624-E629 PolarHBondContact N-O 2.97Å; I624-E629 PolarHBondContact O-N 2.82Å; I624-V631 HydrophobicContact CD1-CG2 3.76Å; I624-V631 HydrophobicContact CG1-CG2 3.98Å
625	N	87.6	Confident	92.8	Very high	101 Å²	101	35.5 Å²	35.5	54%	0.54	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	45.8	175.4	-64.1	-32.1	0	0	0	113.5	T628 E629	N625-T628 PolarHBondContact O-N 2.82Å; N625-T628 PolarHBondContact O-OG1 2.89Å; N625-E629 PolarHBondContact ND2-OE2 3.48Å
626	G	81.9	Confident	92.9	Very high	68 Å²	68	35 Å²	35	70%	0.701	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.3	36.5	-179.4	0	0	0	0	0	113.7	I624 T628	I624-G626 VanDerWaalsContact C-N 3.33Å; I624-G626 PolarHBondContact O-N 2.76Å; G626-T628 PolarHBondContact O-N 3.26Å
627	N	85.1	Confident	93.2	Very high	103 Å²	103	31.6 Å²	31.6	55%	0.551	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.2	9.8	-176.3	-59.6	-43	0	0	0	115.6	L598 S623 I624 E629	L598-N627 HydrophobicContact CD1-CB 4.4Å; L598-N627 WeakPolarHBondContact CD1-O 3.29Å; S623-N627 VanDerWaalsContact CB-OD1 3.24Å; S623-N627 WeakPolarHBondContact CB-OD1 3.4Å; I624-N627 PolarHBondContact O-N 3.35Å; I624-N627 VanDerWaalsContact O-N 3.1Å; N627-E629 VanDerWaalsContact C-N 3.3Å
628	T	91	Very high	93.2	Very high	62 Å²	62	34.1 Å²	34.1	38%	0.38	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-7.6	177.3	63.6	0	0	0	0	113.3	L590 L598 I624 N625 G626	L590-T628 WeakPolarHBondContact CB-O 3.45Å; L590-T628 PolarHBondContact N-O 3.47Å; L598-T628 HydrophobicContact CD1-CG2 4.37Å; I624-T628 PolarHBondContact O-N 3.46Å; N625-T628 PolarHBondContact O-N 2.82Å; N625-T628 PolarHBondContact O-OG1 2.89Å; G626-T628 PolarHBondContact O-N 3.26Å
629	E	93.9	Very high	93.2	Very high	33 Å²	33	36.5 Å²	36.5	15%	0.154	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	130.7	177.5	-174.4	177.4	179.6	0	0	110.4	R587 F588 S623 I624 N625 N627 V631	R587-E629 WeakPolarHBondContact CB-OE1 3.4Å; R587-E629 WeakPolarHBondContact CD-OE1 3.18Å; R587-E629 IonicContact NH1-OE1 3.46Å; F588-E629 CarbonylContact O-C 3.57Å; F588-E629 VanDerWaalsContact O-CA 3.28Å; F588-E629 WeakPolarHBondContact O-CA 3.41Å; S623-E629 CarbonylContact C-O 3.53Å; S623-E629 VanDerWaalsContact CA-O 3.28Å; S623-E629 WeakPolarHBondContact CA-O 3.39Å; I624-E629 HydrophobicContact CD1-CG 4.36Å; I624-E629 HydrophobicContact CG1-CB 3.85Å; I624-E629 HydrophobicContact CG1-CG 4.05Å; I624-E629 PolarHBondContact N-O 2.97Å; I624-E629 PolarHBondContact O-N 2.82Å; N625-E629 PolarHBondContact ND2-OE2 3.48Å; N627-E629 VanDerWaalsContact C-N 3.3Å; E629-V631 HydrophobicContact CG-CG2 4.31Å
630	A	94.8	Very high	93.2	Very high	2 Å²	2	36.1 Å²	36.1	2%	0.017	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	132.6	174.2	0	0	0	0	0	110.1	R587 F588 L590 L601	R587-A630 CarbonylContact C-O 3.49Å; R587-A630 WeakPolarHBondContact CA-O 3.34Å; F588-A630 HydrophobicContact CB-CB 4.5Å; F588-A630 PolarHBondContact N-O 3.35Å; F588-A630 PolarHBondContact O-N 3.01Å; L590-A630 HydrophobicContact CD1-CB 4.23Å; L590-A630 HydrophobicContact CD2-CB 4.39Å; L601-A630 HydrophobicContact CB-CB 4.33Å; L601-A630 HydrophobicContact CD1-CB 3.92Å; L601-A630 HydrophobicContact CG-CB 4.38Å
631	V	96.1	Very high	93.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.1	-176.7	-175.7	0	0	0	0	110.2	E585 I586 R587 Q621 R622 I624 E629	E585-V631 HydrophobicContact CG-CG1 3.48Å; E585-V631 VanDerWaalsContact CG-CG1 3.48Å; I586-V631 WeakPolarHBondContact O-CA 3.45Å; R587-V631 HydrophobicContact CB-CG2 4.41Å; R587-V631 HydrophobicContact CG-CG1 4.12Å; R587-V631 HydrophobicContact CG-CG2 4.01Å; Q621-V631 WeakPolarHBondContact CA-O 3.36Å; R622-V631 HydrophobicContact CG-CB 4.06Å; R622-V631 PolarHBondContact N-O 3.46Å; R622-V631 PolarHBondContact O-N 3.08Å; I624-V631 HydrophobicContact CD1-CG2 3.76Å; I624-V631 HydrophobicContact CG1-CG2 3.98Å; E629-V631 HydrophobicContact CG-CG2 4.31Å
632	F	96.4	Very high	93.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	110.3	173.2	-58	-70.6	0	0	0	109.2	E585 I586 F588 L601 A603 L619 L620 Q621 V646	E585-F632 WeakPolarHBondContact CA-O 3.41Å; I586-F632 PolarHBondContact N-O 3.23Å; I586-F632 PolarHBondContact O-N 3.29Å; F588-F632 AromaticContact CD2-CD2 3.93Å; F588-F632 HydrophobicContact CD2-CD2 3.93Å; F588-F632 AromaticContact CD2-CE2 3.73Å; F588-F632 HydrophobicContact CD2-CE2 3.73Å; F588-F632 AromaticContact CE2-CD2 3.89Å; F588-F632 HydrophobicContact CE2-CD2 3.89Å; F588-F632 AromaticContact CE2-CE2 3.82Å; F588-F632 HydrophobicContact CE2-CE2 3.82Å; L601-F632 HydrophobicContact CB-CE2 4.48Å; L601-F632 HydrophobicContact CB-CZ 3.91Å; L601-F632 HydrophobicContact CD1-CE2 4.36Å; A603-F632 HydrophobicContact CB-CD1 3.68Å; A603-F632 HydrophobicContact CB-CD2 4.39Å; A603-F632 HydrophobicContact CB-CE1 3.45Å; A603-F632 VanDerWaalsContact CB-CE1 3.45Å; A603-F632 HydrophobicContact CB-CE2 4.22Å; A603-F632 HydrophobicContact CB-CG 4.13Å; A603-F632 HydrophobicContact CB-CZ 3.74Å; L619-F632 HydrophobicContact CD2-CD1 3.96Å; L620-F632 WeakPolarHBondContact O-CA 3.49Å; Q621-F632 HydrophobicContact CB-CD1 4Å; Q621-F632 HydrophobicContact CB-CE1 3.99Å; Q621-F632 HydrophobicContact CG-CD1 4.1Å; Q621-F632 HydrophobicContact CG-CE1 3.69Å; F632-V646 HydrophobicContact CE2-CG1 4.01Å; F632-V646 HydrophobicContact CE2-CG2 4.5Å; F632-V646 HydrophobicContact CZ-CG1 4.31Å
633	A	96.3	Very high	93.8	Very high	3 Å²	3	33.8 Å²	33.8	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.5	170.3	0	0	0	0	0	109.4	L619 L620 F635 F705	L619-A633 WeakPolarHBondContact CA-O 3.46Å; L620-A633 HydrophobicContact CB-CB 4.31Å; L620-A633 PolarHBondContact N-O 3.13Å; L620-A633 PolarHBondContact O-N 3.38Å; A633-F635 HydrophobicContact CB-CE2 3.84Å; A633-F635 HydrophobicContact CB-CZ 4.06Å; A633-F705 HydrophobicContact CB-CE1 4.43Å
634	I	97.4	Very high	94.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.9	-170.3	-64.9	162.5	0	0	0	108.9	T583 L584 I586 L605 S618 L619 L636 L644 I666	T583-I634 VanDerWaalsContact CA-O 3.23Å; T583-I634 WeakPolarHBondContact CA-O 3.06Å; L584-I634 HydrophobicContact CB-CB 4.43Å; L584-I634 PolarHBondContact N-O 2.68Å; L584-I634 VanDerWaalsContact N-O 3.12Å; L584-I634 WeakPolarHBondContact O-CB 3.29Å; L584-I634 PolarHBondContact O-N 3.24Å; I586-I634 HydrophobicContact CD1-CD1 4.13Å; L605-I634 HydrophobicContact CD1-CG2 3.89Å; L605-I634 HydrophobicContact CD2-CD1 4.47Å; L605-I634 HydrophobicContact CD2-CG2 4.24Å; S618-I634 CarbonylContact O-C 3.54Å; S618-I634 WeakPolarHBondContact O-CA 3.31Å; L619-I634 HydrophobicContact CD1-CG1 4.29Å; L619-I634 HydrophobicContact CG-CG1 4.41Å; I634-L636 HydrophobicContact CG2-CD2 3.53Å; I634-L636 HydrophobicContact CG2-CG 3.89Å; I634-L644 HydrophobicContact CD1-CD1 4.12Å; I634-L644 HydrophobicContact CD1-CD2 3.92Å; I634-I666 HydrophobicContact CD1-CD1 3.6Å
635	F	97.2	Very high	94.6	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.018	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	94.4	-178.1	-55.4	-88.5	0	0	0	108.6	T583 S618 L620 A633 L677 F705 F766 E792	T583-F635 HydrophobicContact CG2-CD1 3.77Å; T583-F635 HydrophobicContact CG2-CE1 4.15Å; S618-F635 WeakPolarHBondContact CA-O 3.29Å; S618-F635 WeakPolarHBondContact CB-O 3.29Å; S618-F635 PolarHBondContact O-N 3.43Å; S618-F635 PolarHBondContact OG-O 2.99Å; S618-F635 VanDerWaalsContact OG-O 3.04Å; L620-F635 HydrophobicContact CB-CE2 4.33Å; A633-F635 HydrophobicContact CB-CE2 3.84Å; A633-F635 HydrophobicContact CB-CZ 4.06Å; F635-L677 HydrophobicContact CD2-CD1 3.7Å; F635-L677 HydrophobicContact CD2-CD2 4.24Å; F635-L677 HydrophobicContact CD2-CG 4.04Å; F635-L677 HydrophobicContact CE2-CD1 4.08Å; F635-L677 HydrophobicContact CE2-CD2 4.06Å; F635-L677 HydrophobicContact CE2-CG 4.36Å; F635-F705 HydrophobicContact CE1-CZ 4.31Å; F635-F705 HydrophobicContact CE2-CZ 4.48Å; F635-F705 HydrophobicContact CZ-CE1 4.17Å; F635-F705 HydrophobicContact CZ-CE2 4.27Å; F635-F705 AromaticContact CZ-CZ 3.56Å; F635-F705 HydrophobicContact CZ-CZ 3.56Å; F635-F766 HydrophobicContact CD1-CZ 4Å; F635-F766 HydrophobicContact CD2-CZ 4.2Å; F635-F766 HydrophobicContact CE1-CE1 4.24Å; F635-F766 HydrophobicContact CE1-CZ 4.09Å; F635-F766 HydrophobicContact CE2-CE1 4.4Å; F635-F766 HydrophobicContact CE2-CZ 4.26Å; F635-F766 HydrophobicContact CG-CZ 4.07Å; F635-F766 HydrophobicContact CZ-CE1 4.14Å; F635-F766 HydrophobicContact CZ-CZ 4.22Å; F635-E792 VanDerWaalsContact CE1-CD 3.49Å; F635-E792 HydrophobicContact CE1-CG 4.38Å; F635-E792 WeakPolarHBondContact CE1-OE2 3.35Å
636	L	97.2	Very high	95.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	17%	0.166	C	C	.	.			trans	-76.9	132.8	-170.2	-62.2	174.8	0	0	0	111.1	A579 G582 L605 I634 E638 Y642 I666 S672	A579-L636 HydrophobicContact CB-CD1 3.83Å; G582-L636 WeakPolarHBondContact O-CB 3.31Å; G582-L636 PolarHBondContact O-N 2.51Å; L605-L636 HydrophobicContact CD1-CD2 4.44Å; I634-L636 HydrophobicContact CG2-CD2 3.53Å; I634-L636 HydrophobicContact CG2-CG 3.89Å; L636-E638 VanDerWaalsContact C-N 3.35Å; L636-E638 PolarHBondContact O-N 2.85Å; L636-Y642 HydrophobicContact CB-CE2 4.09Å; L636-Y642 HydrophobicContact CD1-CD2 3.72Å; L636-Y642 HydrophobicContact CD1-CE2 3.85Å; L636-Y642 HydrophobicContact CD1-CG 4.5Å; L636-Y642 HydrophobicContact CD2-CD1 3.83Å; L636-Y642 HydrophobicContact CD2-CD2 3.63Å; L636-Y642 HydrophobicContact CD2-CE1 4.04Å; L636-Y642 HydrophobicContact CD2-CE2 3.83Å; L636-Y642 HydrophobicContact CD2-CG 3.63Å; L636-Y642 HydrophobicContact CG-CD2 4.18Å; L636-Y642 HydrophobicContact CG-CE2 4.13Å; L636-I666 HydrophobicContact CD1-CG2 3.96Å; L636-S672 PolarHBondContact O-N 2.81Å; L636-S672 PolarHBondContact O-OG 3Å
637	P	95.1	Very high	95.8	Very high	18 Å²	18	24.1 Å²	24.1	12%	0.117	14%	0.138	C	C	.	.	S	Bend	trans	-75.2	-25.3	-175	29.9	-34.7	0	0	0	113.2	V610 L615 Y642 D671 R675	V610-P637 HydrophobicContact CG1-CG 4.14Å; L615-P637 HydrophobicContact CD2-CG 3.96Å; P637-Y642 HydrophobicContact CG-CE1 4.47Å; P637-D671 WeakPolarHBondContact O-CB 3.42Å; P637-R675 PolarHBondContact O-NH1 3.14Å
638	E	94.8	Very high	96.4	Very high	108 Å²	108	19.2 Å²	19.2	51%	0.505	11%	0.112	S	C	.	.	S	Bend	trans	-144.9	164	-175	-64.8	-178.5	-160.6	0	0	110.2	V610 L636 Y642	V610-E638 HydrophobicContact CG2-CB 4.48Å; L636-E638 VanDerWaalsContact C-N 3.35Å; L636-E638 PolarHBondContact O-N 2.85Å; E638-Y642 PolarHBondContact N-OH 3Å; E638-Y642 PolarHBondContact O-OH 3.49Å
639	A	96.2	Very high	96.5	Very high	58 Å²	58	16.2 Å²	16.2	48%	0.479	9%	0.094	S	C	.	.	S	Bend	trans	-67.1	145.4	165.5	0	0	0	0	0	110	D669	A639-D669 WeakPolarHBondContact CB-O 3.36Å
640	G	96.4	Very high	96.4	Very high	26 Å²	26	16 Å²	16	27%	0.268	9%	0.094	S	C	.	.	E	Extended strand (participates in β ladder)	trans	146.5	-157.4	177	0	0	0	0	0	113.8	S668	G640-S668 PolarHBondContact N-O 3.06Å; G640-S668 PolarHBondContact O-N 2.68Å
641	E	97.6	Very high	96.1	Very high	52 Å²	52	18.2 Å²	18.2	24%	0.243	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133.5	-177.8	-61.9	-179.2	175.7	0	0	110.8	R485 P550 C607 I666 I667	R485-E641 IonicContact CZ-OE1 3.97Å; R485-E641 IonicContact CZ-OE2 3.8Å; R485-E641 IonicContact NH1-OE1 3.78Å; R485-E641 IonicContact NH1-OE2 2.79Å; R485-E641 PolarHBondContact NH1-OE2 2.81Å; R485-E641 IonicContact NH2-OE1 3.68Å; R485-E641 PolarHBondContact NH2-OE1 3.26Å; R485-E641 IonicContact NH2-OE2 3.68Å; R485-E641 PolarHBondContact NH2-OE2 3.49Å; P550-E641 HydrophobicContact CG-CB 4.38Å; C607-E641 PolarHBondContact SG-O 3.43Å; C607-E641 VanDerWaalsContact SG-O 3.34Å; E641-I666 CarbonylContact C-O 3.52Å; E641-I666 WeakPolarHBondContact CA-O 3.28Å; E641-I667 HydrophobicContact CG-CG1 4.46Å
642	Y	98.2	Very high	95.8	Very high	1 Å²	1	24 Å²	24	0%	0.004	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.6	-177.1	-62.2	-95.1	0	0	0	109.8	P550 K606 C607 V610 L615 L636 P637 E638 I665 I666	P550-Y642 VanDerWaalsContact CG-C 3.47Å; K606-Y642 CarbonylContact O-C 3.5Å; K606-Y642 VanDerWaalsContact O-CA 3.27Å; K606-Y642 WeakPolarHBondContact O-CA 3.26Å; C607-Y642 HydrophobicContact CB-CD1 3.68Å; C607-Y642 HydrophobicContact CB-CE1 3.77Å; V610-Y642 HydrophobicContact CG2-CE1 4.45Å; L615-Y642 HydrophobicContact CD2-CD1 4.21Å; L615-Y642 HydrophobicContact CD2-CE1 3.79Å; L636-Y642 HydrophobicContact CB-CE2 4.09Å; L636-Y642 HydrophobicContact CD1-CD2 3.72Å; L636-Y642 HydrophobicContact CD1-CE2 3.85Å; L636-Y642 HydrophobicContact CD1-CG 4.5Å; L636-Y642 HydrophobicContact CD2-CD1 3.83Å; L636-Y642 HydrophobicContact CD2-CD2 3.63Å; L636-Y642 HydrophobicContact CD2-CE1 4.04Å; L636-Y642 HydrophobicContact CD2-CE2 3.83Å; L636-Y642 HydrophobicContact CD2-CG 3.63Å; L636-Y642 HydrophobicContact CG-CD2 4.18Å; L636-Y642 HydrophobicContact CG-CE2 4.13Å; P637-Y642 HydrophobicContact CG-CE1 4.47Å; E638-Y642 PolarHBondContact N-OH 3Å; E638-Y642 PolarHBondContact O-OH 3.49Å; Y642-I665 CarbonylContact O-C 3.55Å; Y642-I665 WeakPolarHBondContact O-CA 3.4Å; Y642-I666 PolarHBondContact N-O 3.47Å; Y642-I666 PolarHBondContact O-N 3.1Å
643	G	97.9	Very high	95.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	133.7	168.2	0	0	0	0	0	108.7	P550 C552 L605 K606 Y664	P550-G643 VanDerWaalsContact CG-N 3.33Å; C552-G643 VanDerWaalsContact SG-CA 3.59Å; L605-G643 CarbonylContact C-O 3.54Å; L605-G643 WeakPolarHBondContact CA-O 3.26Å; K606-G643 PolarHBondContact N-O 3.12Å; K606-G643 PolarHBondContact O-N 3.07Å; G643-Y664 CarbonylContact C-O 3.57Å; G643-Y664 WeakPolarHBondContact CA-O 3.29Å
644	L	98.1	Very high	95.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117.9	169.2	-178.7	75	0	0	0	108.8	I586 A603 L605 L619 I634 V646 Q663 Y664 I666	I586-L644 HydrophobicContact CD1-CD2 3.46Å; I586-L644 VanDerWaalsContact CD1-CD2 3.46Å; A603-L644 HydrophobicContact CB-CD1 3.93Å; L605-L644 HydrophobicContact CD2-CB 4.33Å; L605-L644 HydrophobicContact CD2-CD1 3.8Å; L605-L644 HydrophobicContact CG-CD1 4.13Å; L619-L644 HydrophobicContact CD1-CD1 3.47Å; L619-L644 VanDerWaalsContact CD1-CD1 3.47Å; I634-L644 HydrophobicContact CD1-CD1 4.12Å; I634-L644 HydrophobicContact CD1-CD2 3.92Å; L644-V646 HydrophobicContact CD2-CG2 4.17Å; L644-V646 HydrophobicContact CG-CG2 4.28Å; L644-Q663 CarbonylContact O-C 3.52Å; L644-Q663 VanDerWaalsContact O-CA 3.22Å; L644-Q663 WeakPolarHBondContact O-CA 3.43Å; L644-Y664 HydrophobicContact CD2-CD2 4.07Å; L644-Y664 PolarHBondContact N-O 3.35Å; L644-Y664 PolarHBondContact O-N 3.18Å; L644-I666 HydrophobicContact CB-CD1 3.85Å; L644-I666 HydrophobicContact CD2-CD1 4.41Å
645	E	98	Very high	94.9	Very high	5 Å²	5	34.1 Å²	34.1	2%	0.023	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.3	171.1	-63.6	173.9	154.6	0	0	109.1	C552 Q553 A603 K604 Y647 Q663	C552-E645 WeakPolarHBondContact CA-OE1 3.39Å; C552-E645 HydrophobicContact CB-CG 4.23Å; Q553-E645 PolarHBondContact N-OE1 3.15Å; A603-E645 CarbonylContact C-O 3.55Å; A603-E645 WeakPolarHBondContact CA-O 3.29Å; A603-E645 WeakPolarHBondContact CB-O 3.42Å; K604-E645 PolarHBondContact N-O 3.25Å; K604-E645 PolarHBondContact O-N 3.23Å; E645-Y647 HydrophobicContact CB-CD2 4.28Å; E645-Y647 HydrophobicContact CB-CE2 3.48Å; E645-Y647 VanDerWaalsContact CB-CE2 3.48Å; E645-Y647 PolarHBondContact OE2-OH 3.31Å; E645-Q663 HydrophobicContact CG-CG 4.49Å
646	V	97.7	Very high	94.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	130.1	174	-174.6	0	0	0	0	108.1	F588 L601 M602 A603 F632 L644 V660 V661 W662 Y664	F588-V646 HydrophobicContact CE2-CG1 4.14Å; F588-V646 HydrophobicContact CE2-CG2 3.98Å; F588-V646 HydrophobicContact CZ-CB 4.33Å; F588-V646 HydrophobicContact CZ-CG1 4.08Å; F588-V646 HydrophobicContact CZ-CG2 3.86Å; L601-V646 HydrophobicContact CD1-CG1 4.31Å; L601-V646 HydrophobicContact CD2-CG1 4.5Å; M602-V646 WeakPolarHBondContact O-CA 3.47Å; A603-V646 HydrophobicContact CB-CG2 4.35Å; F632-V646 HydrophobicContact CE2-CG1 4.01Å; F632-V646 HydrophobicContact CE2-CG2 4.5Å; F632-V646 HydrophobicContact CZ-CG1 4.31Å; L644-V646 HydrophobicContact CD2-CG2 4.17Å; L644-V646 HydrophobicContact CG-CG2 4.28Å; V646-V660 WeakPolarHBondContact O-CA 3.26Å; V646-V661 HydrophobicContact CG1-CG2 4.3Å; V646-V661 VanDerWaalsContact O-CG2 3.31Å; V646-V661 WeakPolarHBondContact O-CG2 3.17Å; V646-V661 PolarHBondContact O-N 3.11Å; V646-W662 HydrophobicContact CB-CB 3.93Å; V646-W662 HydrophobicContact CG2-CB 4.32Å; V646-W662 PolarHBondContact N-O 3.44Å; V646-W662 PolarHBondContact O-N 3.34Å; V646-Y664 HydrophobicContact CG2-CE2 4.41Å
647	Y	97.3	Very high	94.5	Very high	31 Å²	31	42.8 Å²	42.8	12%	0.122	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148	-179.2	-53.2	-118.6	0	0	0	110.1	L601 M602 K604 E645 F658 F659 V660	L601-Y647 CarbonylContact C-O 3.47Å; L601-Y647 VanDerWaalsContact CA-O 3.26Å; L601-Y647 WeakPolarHBondContact CA-O 2.99Å; L601-Y647 WeakPolarHBondContact CD2-O 3.34Å; M602-Y647 HydrophobicContact CG-CD2 4.15Å; M602-Y647 HydrophobicContact CG-CG 4.06Å; M602-Y647 PolarHBondContact N-O 3.32Å; M602-Y647 PolarHBondContact O-N 3.07Å; M602-Y647 HydrophobicContact SD-CG 4.43Å; K604-Y647 HydrophobicContact CB-CE2 4.19Å; K604-Y647 HydrophobicContact CD-CE2 4.07Å; K604-Y647 HydrophobicContact CG-CE2 4.02Å; E645-Y647 HydrophobicContact CB-CD2 4.28Å; E645-Y647 HydrophobicContact CB-CE2 3.48Å; E645-Y647 VanDerWaalsContact CB-CE2 3.48Å; E645-Y647 PolarHBondContact OE2-OH 3.31Å; Y647-F658 HydrophobicContact CD1-CB 4.39Å; Y647-F659 CarbonylContact C-O 3.32Å; Y647-F659 WeakPolarHBondContact CA-O 3.28Å; Y647-F659 WeakPolarHBondContact CB-O 3.07Å; Y647-V660 HydrophobicContact CD1-CB 4.35Å; Y647-V660 HydrophobicContact CD1-CG2 3.48Å; Y647-V660 VanDerWaalsContact CD1-CG2 3.48Å; Y647-V660 HydrophobicContact CD2-CG2 4.32Å; Y647-V660 HydrophobicContact CE1-CB 4.41Å; Y647-V660 HydrophobicContact CE1-CG2 3.15Å; Y647-V660 HydrophobicContact CE2-CG2 4.02Å; Y647-V660 HydrophobicContact CG-CG2 4.05Å; Y647-V660 VanDerWaalsContact CZ-CG2 3.42Å
648	A	96.2	Very high	94.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	158.8	174.9	0	0	0	0	0	111.9	Y566 R600 L601 F658 F659 V661	Y566-A648 HydrophobicContact CD1-CB 3.78Å; Y566-A648 HydrophobicContact CD2-CB 3.71Å; Y566-A648 HydrophobicContact CE1-CB 4.25Å; Y566-A648 HydrophobicContact CE2-CB 4.16Å; Y566-A648 HydrophobicContact CG-CB 3.49Å; Y566-A648 VanDerWaalsContact CG-CB 3.49Å; R600-A648 CarbonylContact O-C 3.52Å; R600-A648 VanDerWaalsContact O-CA 3.3Å; R600-A648 WeakPolarHBondContact O-CA 3.37Å; L601-A648 HydrophobicContact CD2-CB 3.53Å; A648-F658 WeakPolarHBondContact O-CA 3.4Å; A648-F659 PolarHBondContact N-O 3.41Å; A648-F659 PolarHBondContact O-N 2.82Å; A648-V661 HydrophobicContact CB-CB 4.41Å; A648-V661 HydrophobicContact CB-CG1 3.67Å; A648-V661 HydrophobicContact CB-CG2 3.87Å
649	N	94	Very high	94.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	138.9	176.2	162.7	-83.8	0	0	0	108.7	P599 R600 P651 D654 G655 S657 F658	P599-N649 CarbonylContact C-O 3.59Å; P599-N649 WeakPolarHBondContact CA-O 3.31Å; R600-N649 PolarHBondContact N-O 3.03Å; R600-N649 PolarHBondContact O-N 3.23Å; N649-P651 WeakPolarHBondContact OD1-CA 3.45Å; N649-D654 WeakPolarHBondContact ND2-CB 3.24Å; N649-G655 PolarHBondContact ND2-O 3.37Å; N649-G655 PolarHBondContact OD1-O 2.99Å; N649-S657 WeakPolarHBondContact CB-O 3.42Å; N649-S657 PolarHBondContact ND2-N 2.92Å; N649-S657 PolarHBondContact ND2-O 3.06Å; N649-F658 HydrophobicContact CB-CD1 3.58Å; N649-F658 HydrophobicContact CB-CD2 4.11Å; N649-F658 HydrophobicContact CB-CE1 3.55Å; N649-F658 HydrophobicContact CB-CE2 4.06Å; N649-F658 HydrophobicContact CB-CG 3.88Å; N649-F658 HydrophobicContact CB-CZ 3.79Å
650	D	91.2	Very high	94.6	Very high	29 Å²	29	40.9 Å²	40.9	16%	0.155	23%	0.227	C	C	.	.			trans	-93.7	116.8	161.7	179.8	-42.3	0	0	0	107.5	Y566 V652 K653 D654	Y566-D650 HydrophobicContact CE1-CB 4.21Å; D650-V652 PolarHBondContact O-N 3.42Å; D650-V652 VanDerWaalsContact O-N 3.17Å; D650-V652 PolarHBondContact OD1-N 3.07Å; D650-K653 HydrophobicContact CB-CB 3.96Å; D650-K653 PolarHBondContact O-N 3.07Å; D650-K653 PolarHBondContact OD1-N 3.28Å; D650-K653 VanDerWaalsContact OD1-N 3.07Å; D650-D654 PolarHBondContact N-OD2 3.45Å; D650-D654 WeakPolarHBondContact O-CA 3.48Å; D650-D654 WeakPolarHBondContact O-CB 3.12Å; D650-D654 PolarHBondContact O-N 3.4Å
651	P	88.3	Confident	94.6	Very high	48 Å²	48	39.6 Å²	39.6	31%	0.312	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.4	-171.8	24.8	-34	0	0	0	113.4	P597 N649	P597-P651 HydrophobicContact CB-CG 3.9Å; P597-P651 HydrophobicContact CG-CG 4.05Å; N649-P651 WeakPolarHBondContact OD1-CA 3.45Å
652	V	89.8	Confident	94.5	Very high	120 Å²	120	38.1 Å²	38.1	73%	0.727	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-43	179.2	171.7	0	0	0	0	110.5	P597 D650	P597-V652 HydrophobicContact CG-CB 4.18Å; P597-V652 HydrophobicContact CG-CG2 3.72Å; D650-V652 PolarHBondContact O-N 3.42Å; D650-V652 VanDerWaalsContact O-N 3.17Å; D650-V652 PolarHBondContact OD1-N 3.07Å
653	K	89.5	Confident	94.5	Very high	155 Å²	155	38.4 Å²	38.4	67%	0.674	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-43.6	-176.4	-178.5	-169.5	170.2	-171	0	113.3	D650	D650-K653 HydrophobicContact CB-CB 3.96Å; D650-K653 PolarHBondContact O-N 3.07Å; D650-K653 PolarHBondContact OD1-N 3.28Å; D650-K653 VanDerWaalsContact OD1-N 3.07Å
654	D	91.2	Very high	94.5	Very high	27 Å²	27	38.4 Å²	38.4	14%	0.144	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-7.5	-168.6	-56.7	-33.7	0	0	0	112.8	Y566 N649 D650 N656 S657 F659	Y566-D654 WeakPolarHBondContact CE1-OD2 3.47Å; Y566-D654 PolarHBondContact OH-OD2 3.12Å; N649-D654 WeakPolarHBondContact ND2-CB 3.24Å; D650-D654 PolarHBondContact N-OD2 3.45Å; D650-D654 WeakPolarHBondContact O-CA 3.48Å; D650-D654 WeakPolarHBondContact O-CB 3.12Å; D650-D654 PolarHBondContact O-N 3.4Å; D654-N656 PolarHBondContact O-N 3.09Å; D654-N656 VanDerWaalsContact O-N 3.14Å; D654-S657 WeakPolarHBondContact O-CB 3.39Å; D654-S657 PolarHBondContact O-N 3.24Å; D654-S657 PolarHBondContact O-OG 2.65Å; D654-F659 HydrophobicContact CB-CE2 4.13Å
655	G	91.1	Very high	94.5	Very high	34 Å²	34	38.5 Å²	38.5	35%	0.351	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	-113.2	-177.6	0	0	0	0	0	111.5	N649	N649-G655 PolarHBondContact ND2-O 3.37Å; N649-G655 PolarHBondContact OD1-O 2.99Å
656	N	90.8	Very high	94.5	Very high	118 Å²	118	38.3 Å²	38.3	63%	0.631	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.4	5.5	177.7	-71.5	-39.4	0	0	0	114	D654 F658	D654-N656 PolarHBondContact O-N 3.09Å; D654-N656 VanDerWaalsContact O-N 3.14Å; N656-F658 WeakPolarHBondContact O-CD2 3.43Å
657	S	95.1	Very high	94.5	Very high	69 Å²	69	40.9 Å²	40.9	48%	0.483	22%	0.221	S	C	.	.			trans	-85.3	122.3	-177	-56.3	0	0	0	0	111	N649 D654	N649-S657 WeakPolarHBondContact CB-O 3.42Å; N649-S657 PolarHBondContact ND2-N 2.92Å; N649-S657 PolarHBondContact ND2-O 3.06Å; D654-S657 WeakPolarHBondContact O-CB 3.39Å; D654-S657 PolarHBondContact O-N 3.24Å; D654-S657 PolarHBondContact O-OG 2.65Å
658	F	95.8	Very high	94.5	Very high	52 Å²	52	39.7 Å²	39.7	23%	0.228	22%	0.217	C	C	.	.			trans	-104.6	139.2	176.9	-78.9	-97	0	0	0	110.7	R600 M602 Y647 A648 N649 N656	R600-F658 HydrophobicContact CB-CE1 4.09Å; R600-F658 HydrophobicContact CB-CZ 4.09Å; M602-F658 HydrophobicContact CB-CD1 4.37Å; M602-F658 HydrophobicContact CB-CE1 4.27Å; M602-F658 HydrophobicContact CG-CB 4.4Å; M602-F658 HydrophobicContact CG-CD1 3.55Å; M602-F658 HydrophobicContact CG-CE1 3.94Å; M602-F658 HydrophobicContact CG-CG 4.01Å; M602-F658 HydrophobicContact SD-CB 3.79Å; M602-F658 HydrophobicContact SD-CD1 3.77Å; M602-F658 HydrophobicContact SD-CD2 3.99Å; M602-F658 HydrophobicContact SD-CE1 4.32Å; M602-F658 HydrophobicContact SD-CG 3.57Å; M602-F658 VanDerWaalsContact SD-CG 3.57Å; Y647-F658 HydrophobicContact CD1-CB 4.39Å; A648-F658 WeakPolarHBondContact O-CA 3.4Å; N649-F658 HydrophobicContact CB-CD1 3.58Å; N649-F658 HydrophobicContact CB-CD2 4.11Å; N649-F658 HydrophobicContact CB-CE1 3.55Å; N649-F658 HydrophobicContact CB-CE2 4.06Å; N649-F658 HydrophobicContact CB-CG 3.88Å; N649-F658 HydrophobicContact CB-CZ 3.79Å; N656-F658 WeakPolarHBondContact O-CD2 3.43Å
659	F	96.3	Very high	94.6	Very high	84 Å²	84	44.8 Å²	44.8	37%	0.368	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.1	179.6	-57.8	-86.1	0	0	0	109.7	L562 Y566 Y647 A648 D654 V661	L562-F659 HydrophobicContact CD1-CB 3.87Å; L562-F659 HydrophobicContact CD1-CG 4.38Å; Y566-F659 WeakPolarHBondContact OH-CD2 3.47Å; Y647-F659 CarbonylContact C-O 3.32Å; Y647-F659 WeakPolarHBondContact CA-O 3.28Å; Y647-F659 WeakPolarHBondContact CB-O 3.07Å; A648-F659 PolarHBondContact N-O 3.41Å; A648-F659 PolarHBondContact O-N 2.82Å; D654-F659 HydrophobicContact CB-CE2 4.13Å; F659-V661 PolarHBondContact O-N 3.06Å
660	V	96.6	Very high	94.7	Very high	7 Å²	7	46.8 Å²	46.8	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	135.1	171.9	176.8	0	0	0	0	108.2	Q553 N560 V646 Y647 Q663	Q553-V660 VanDerWaalsContact OE1-CB 3.32Å; N560-V660 PolarHBondContact ND2-O 3.15Å; V646-V660 WeakPolarHBondContact O-CA 3.26Å; Y647-V660 HydrophobicContact CD1-CB 4.35Å; Y647-V660 HydrophobicContact CD1-CG2 3.48Å; Y647-V660 VanDerWaalsContact CD1-CG2 3.48Å; Y647-V660 HydrophobicContact CD2-CG2 4.32Å; Y647-V660 HydrophobicContact CE1-CB 4.41Å; Y647-V660 HydrophobicContact CE1-CG2 3.15Å; Y647-V660 HydrophobicContact CE2-CG2 4.02Å; Y647-V660 HydrophobicContact CG-CG2 4.05Å; Y647-V660 VanDerWaalsContact CZ-CG2 3.42Å; V660-Q663 HydrophobicContact CG1-CG 4Å
661	V	95.9	Very high	94.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	-23.9	178.2	-71.1	0	0	0	0	112.3	P559 N560 L562 A563 Y566 I568 V646 A648 F659	P559-V661 WeakPolarHBondContact CA-O 3.26Å; N560-V661 PolarHBondContact N-O 3.26Å; N560-V661 WeakPolarHBondContact OD1-CA 3.46Å; N560-V661 PolarHBondContact OD1-O 3.28Å; L562-V661 HydrophobicContact CB-CG1 4.22Å; A563-V661 HydrophobicContact CB-CB 4.23Å; A563-V661 WeakPolarHBondContact CB-O 3.27Å; Y566-V661 HydrophobicContact CD2-CG1 3.51Å; Y566-V661 HydrophobicContact CE2-CG1 3.87Å; Y566-V661 HydrophobicContact CG-CG1 4.44Å; I568-V661 HydrophobicContact CD1-CB 3.99Å; I568-V661 HydrophobicContact CD1-CG2 3.55Å; V646-V661 HydrophobicContact CG1-CG2 4.3Å; V646-V661 VanDerWaalsContact O-CG2 3.31Å; V646-V661 WeakPolarHBondContact O-CG2 3.17Å; V646-V661 PolarHBondContact O-N 3.11Å; A648-V661 HydrophobicContact CB-CB 4.41Å; A648-V661 HydrophobicContact CB-CG1 3.67Å; A648-V661 HydrophobicContact CB-CG2 3.87Å; F659-V661 PolarHBondContact O-N 3.06Å
662	W	96.2	Very high	95.2	Very high	21 Å²	21	46.7 Å²	46.7	8%	0.08	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	147.3	-178.4	-144.1	-65.4	0	0	0	110.9	G558 P559 I568 A570 F588 V646 Y664	G558-W662 VanDerWaalsContact C-CD1 3.48Å; G558-W662 WeakPolarHBondContact O-CA 3.48Å; P559-W662 HydrophobicContact CB-CD2 3.86Å; P559-W662 HydrophobicContact CB-CE3 3.77Å; P559-W662 HydrophobicContact CB-CH2 4Å; P559-W662 HydrophobicContact CB-CZ2 4.1Å; P559-W662 HydrophobicContact CB-CZ3 3.84Å; P559-W662 HydrophobicContact CG-CH2 4.11Å; P559-W662 HydrophobicContact CG-CZ2 4Å; P559-W662 HydrophobicContact CG-CZ3 4.45Å; I568-W662 HydrophobicContact CD1-CE3 4.49Å; A570-W662 HydrophobicContact CB-CE3 4.3Å; A570-W662 HydrophobicContact CB-CH2 3.36Å; A570-W662 HydrophobicContact CB-CZ2 3.57Å; A570-W662 HydrophobicContact CB-CZ3 3.75Å; F588-W662 HydrophobicContact CE1-CD2 4.08Å; F588-W662 AromaticContact CE1-CE3 3.83Å; F588-W662 HydrophobicContact CE1-CE3 3.83Å; F588-W662 HydrophobicContact CE1-CG 4.44Å; F588-W662 HydrophobicContact CE1-CZ3 4.34Å; F588-W662 HydrophobicContact CZ-CG 4.49Å; V646-W662 HydrophobicContact CB-CB 3.93Å; V646-W662 HydrophobicContact CG2-CB 4.32Å; V646-W662 PolarHBondContact N-O 3.44Å; V646-W662 PolarHBondContact O-N 3.34Å; W662-Y664 AromaticContact CD1-CD2 3.89Å; W662-Y664 AromaticContact CD1-CE2 3.31Å; W662-Y664 AromaticContact CD1-CZ 3.4Å; W662-Y664 AromaticContact CE2-CZ 3.91Å; W662-Y664 AromaticContact CG-CE2 3.96Å; W662-Y664 HydrophobicContact CG-CE2 3.96Å; W662-Y664 AromaticContact NE1-CE1 3.6Å; W662-Y664 AromaticContact NE1-CE2 3.69Å; W662-Y664 AromaticContact NE1-CZ 3.21Å; W662-Y664 PolarHBondContact NE1-OH 2.93Å; W662-Y664 VanDerWaalsContact NE1-OH 3.17Å
663	Q	97.4	Very high	95.3	Very high	7 Å²	7	43.6 Å²	43.6	3%	0.033	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	141.2	169.6	-55.6	-170.3	154.5	0	0	111.7	S554 S556 Y557 G558 L644 E645 V660	S554-Q663 PolarHBondContact O-NE2 3.36Å; S556-Q663 PolarHBondContact O-NE2 3.4Å; Y557-Q663 HydrophobicContact CD1-CB 4.17Å; G558-Q663 PolarHBondContact N-O 2.88Å; G558-Q663 PolarHBondContact O-N 3.35Å; L644-Q663 CarbonylContact O-C 3.52Å; L644-Q663 VanDerWaalsContact O-CA 3.22Å; L644-Q663 WeakPolarHBondContact O-CA 3.43Å; E645-Q663 HydrophobicContact CG-CG 4.49Å; V660-Q663 HydrophobicContact CG1-CG 4Å
664	Y	98	Very high	95.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	153.3	171.1	-61.3	-91.2	0	0	0	111.2	Y557 A570 R572 D574 C575 L577 I586 F588 G643 L644 V646 W662	Y557-Y664 VanDerWaalsContact CD1-C 3.41Å; Y557-Y664 WeakPolarHBondContact CE1-O 3.23Å; A570-Y664 WeakPolarHBondContact CB-OH 3.11Å; R572-Y664 WeakPolarHBondContact O-CE1 3.44Å; R572-Y664 PolarHBondContact O-OH 3.47Å; D574-Y664 VanDerWaalsContact O-CD1 3.27Å; D574-Y664 WeakPolarHBondContact O-CD1 3.33Å; D574-Y664 VanDerWaalsContact O-CE1 3.29Å; D574-Y664 WeakPolarHBondContact O-CE1 3.3Å; C575-Y664 WeakPolarHBondContact O-CA 3.3Å; L577-Y664 HydrophobicContact CD1-CD1 3.54Å; L577-Y664 HydrophobicContact CD1-CE1 3.98Å; L577-Y664 HydrophobicContact CD1-CG 4.01Å; L577-Y664 HydrophobicContact CG-CD1 3.95Å; I586-Y664 HydrophobicContact CD1-CD2 4.31Å; I586-Y664 HydrophobicContact CG2-CE2 4.34Å; F588-Y664 AromaticContact CZ-CE2 3.91Å; F588-Y664 HydrophobicContact CZ-CE2 3.91Å; G643-Y664 CarbonylContact C-O 3.57Å; G643-Y664 WeakPolarHBondContact CA-O 3.29Å; L644-Y664 HydrophobicContact CD2-CD2 4.07Å; L644-Y664 PolarHBondContact N-O 3.35Å; L644-Y664 PolarHBondContact O-N 3.18Å; V646-Y664 HydrophobicContact CG2-CE2 4.41Å; W662-Y664 AromaticContact CD1-CD2 3.89Å; W662-Y664 AromaticContact CD1-CE2 3.31Å; W662-Y664 AromaticContact CD1-CZ 3.4Å; W662-Y664 AromaticContact CE2-CZ 3.91Å; W662-Y664 AromaticContact CG-CE2 3.96Å; W662-Y664 HydrophobicContact CG-CE2 3.96Å; W662-Y664 AromaticContact NE1-CE1 3.6Å; W662-Y664 AromaticContact NE1-CE2 3.69Å; W662-Y664 AromaticContact NE1-CZ 3.21Å; W662-Y664 PolarHBondContact NE1-OH 2.93Å; W662-Y664 VanDerWaalsContact NE1-OH 3.17Å
665	I	97.8	Very high	95.5	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.6	160.7	-168.2	164.8	0	0	0	108.4	F549 Y557 C575 T576 L577 Y642	F549-I665 HydrophobicContact CD1-CD1 3.72Å; F549-I665 HydrophobicContact CE1-CD1 4.09Å; Y557-I665 HydrophobicContact CD1-CB 4.04Å; Y557-I665 HydrophobicContact CE1-CB 3.86Å; C575-I665 PolarHBondContact O-N 3.05Å; T576-I665 CarbonylContact C-O 3.58Å; T576-I665 WeakPolarHBondContact CA-O 3.47Å; T576-I665 HydrophobicContact CG2-CG2 3.81Å; T576-I665 VanDerWaalsContact OG1-CG2 3.24Å; T576-I665 WeakPolarHBondContact OG1-CG2 3.24Å; L577-I665 PolarHBondContact N-O 2.87Å; Y642-I665 CarbonylContact O-C 3.55Å; Y642-I665 WeakPolarHBondContact O-CA 3.4Å
666	I	98.3	Very high	95.6	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.8	-179.1	-57.9	167.3	0	0	0	107.6	L577 A579 L584 L605 I634 L636 E641 Y642 L644	L577-I666 CarbonylContact O-C 3.53Å; L577-I666 VanDerWaalsContact O-CA 3.31Å; L577-I666 WeakPolarHBondContact O-CA 3.27Å; A579-I666 HydrophobicContact CB-CG2 4.05Å; L584-I666 HydrophobicContact CD2-CB 4.48Å; L584-I666 HydrophobicContact CD2-CD1 3.92Å; L584-I666 HydrophobicContact CD2-CG1 3.84Å; L584-I666 HydrophobicContact CD2-CG2 3.85Å; L605-I666 HydrophobicContact CD2-CD1 4.19Å; I634-I666 HydrophobicContact CD1-CD1 3.6Å; L636-I666 HydrophobicContact CD1-CG2 3.96Å; E641-I666 CarbonylContact C-O 3.52Å; E641-I666 WeakPolarHBondContact CA-O 3.28Å; Y642-I666 PolarHBondContact N-O 3.47Å; Y642-I666 PolarHBondContact O-N 3.1Å; L644-I666 HydrophobicContact CB-CD1 3.85Å; L644-I666 HydrophobicContact CD2-CD1 4.41Å
667	I	97.9	Very high	95.9	Very high	54 Å²	54	33.7 Å²	33.7	28%	0.277	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.5	179	-55.6	173.2	0	0	0	108.4	T576 L577 R578 A579 E641	T576-I667 HydrophobicContact CG2-CD1 3.72Å; T576-I667 HydrophobicContact CG2-CG1 4.44Å; L577-I667 PolarHBondContact O-N 3.38Å; R578-I667 WeakPolarHBondContact CA-O 3.26Å; A579-I667 PolarHBondContact N-O 3.14Å; E641-I667 HydrophobicContact CG-CG1 4.46Å
668	S	98	Very high	95.9	Very high	6 Å²	6	30.9 Å²	30.9	4%	0.042	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.4	172	-154.8	0	0	0	0	112.5	G582 G640 C670	G582-S668 WeakPolarHBondContact CA-OG 3.12Å; G582-S668 PolarHBondContact N-OG 2.92Å; G640-S668 PolarHBondContact N-O 3.06Å; G640-S668 PolarHBondContact O-N 2.68Å; S668-C670 PolarHBondContact OG-O 2.85Å
669	D	97.2	Very high	95.7	Very high	107 Å²	107	32.9 Å²	32.9	57%	0.572	17%	0.174	S	C	*	.	S	Bend	trans	-91.7	-12.7	178.3	57.9	-11.7	0	0	0	113.2	A639	A639-D669 WeakPolarHBondContact CB-O 3.36Å
670	C	96.9	Very high	95.4	Very high	42 Å²	42	30.8 Å²	30.8	28%	0.284	17%	0.166	S	C	.	.	S	Bend	trans	-153.5	167.7	-178.7	55	0	0	0	0	111.2	R581 G582 S668	R581-C670 VanDerWaalsContact CA-SG 3.52Å; G582-C670 WeakPolarHBondContact CA-O 3.42Å; S668-C670 PolarHBondContact OG-O 2.85Å
671	D	94.7	Very high	94.9	Very high	74 Å²	74	34 Å²	34	40%	0.396	19%	0.187	S	C	.	.			trans	-79.1	161	172	57.3	-41.9	0	0	0	112.6	P637 R675	P637-D671 WeakPolarHBondContact O-CB 3.42Å; D671-R675 IonicContact OD2-CZ 2.91Å; D671-R675 IonicContact OD2-NH1 3.69Å; D671-R675 PolarHBondContact OD2-NH1 3.31Å; D671-R675 IonicContact OD2-NH2 2.7Å
672	S	95.2	Very high	94.1	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.014	22%	0.223	C	C	.	.			trans	-70.6	141.7	176.9	65.9	0	0	0	0	111.5	R581 L636 V674 R675	R581-S672 WeakPolarHBondContact O-CA 3.43Å; L636-S672 PolarHBondContact O-N 2.81Å; L636-S672 PolarHBondContact O-OG 3Å; S672-V674 WeakPolarHBondContact CB-O 3.46Å; S672-V674 PolarHBondContact O-N 3.09Å; S672-V674 PolarHBondContact OG-O 3.35Å; S672-R675 VanDerWaalsContact OG-CG 3.31Å; S672-R675 WeakPolarHBondContact OG-CG 3.28Å
673	P	92.5	Very high	93.3	Very high	55 Å²	55	45.5 Å²	45.5	36%	0.357	26%	0.262	S	S	.	.	S	Bend	trans	-65.2	-24.7	-178.1	26.2	-35.3	0	0	0	113.4	R581 T794	R581-P673 VanDerWaalsContact O-CD 3.27Å; R581-P673 WeakPolarHBondContact O-CD 3.38Å; P673-T794 HydrophobicContact CG-CG2 4.02Å
674	V	93.3	Very high	93	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.036	27%	0.269	C	S	.	.	S	Bend	trans	-125.6	138.8	176	179.4	0	0	0	0	108	S672 P764 F766 E792 A793 T794	S672-V674 WeakPolarHBondContact CB-O 3.46Å; S672-V674 PolarHBondContact O-N 3.09Å; S672-V674 PolarHBondContact OG-O 3.35Å; V674-P764 HydrophobicContact CG2-CB 4.28Å; V674-F766 HydrophobicContact CG1-CD2 3.81Å; V674-F766 HydrophobicContact CG1-CE1 4.37Å; V674-F766 HydrophobicContact CG1-CE2 3.64Å; V674-F766 HydrophobicContact CG1-CG 4.27Å; V674-F766 HydrophobicContact CG1-CZ 3.93Å; V674-E792 HydrophobicContact CB-CG 4.12Å; V674-E792 HydrophobicContact CG1-CG 4.3Å; V674-E792 HydrophobicContact CG2-CG 4.25Å; V674-A793 WeakPolarHBondContact CG2-O 3.23Å; V674-T794 HydrophobicContact CG2-CG2 3.89Å
675	R	91.8	Very high	92.8	Very high	107 Å²	107	48.7 Å²	48.7	40%	0.404	28%	0.276	S	S	.	.			trans	-139.4	164	-175.3	-69.8	-165.5	-60	-131.2	-12.8	112.2	P637 D671 S672 H736	P637-R675 PolarHBondContact O-NH1 3.14Å; D671-R675 IonicContact OD2-CZ 2.91Å; D671-R675 IonicContact OD2-NH1 3.69Å; D671-R675 PolarHBondContact OD2-NH1 3.31Å; D671-R675 IonicContact OD2-NH2 2.7Å; S672-R675 VanDerWaalsContact OG-CG 3.31Å; S672-R675 WeakPolarHBondContact OG-CG 3.28Å; R675-H736 PolarHBondContact O-CE1 2.66Å; R675-H736 VanDerWaalsContact O-CE1 3.29Å
676	G	92.7	Very high	92.6	Very high	6 Å²	6	48.7 Å²	48.7	6%	0.062	28%	0.277	C	S	.	.			trans	78.7	67.4	177.2	0	0	0	0	0	110.9	S735 H736 F766	G676-S735 CarbonylContact O-C 3.57Å; G676-S735 WeakPolarHBondContact O-CA 3.39Å; G676-H736 WeakPolarHBondContact CA-NE2 3.44Å; G676-H736 PolarHBondContact O-N 3.36Å; G676-F766 WeakPolarHBondContact O-CD2 3.48Å
677	L	95.7	Very high	92.3	Very high	7 Å²	7	52.1 Å²	52.1	4%	0.037	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-53	138.2	169.2	-77.8	165.6	0	0	0	110.3	K617 L620 F635 F766 L790	K617-L677 HydrophobicContact CB-CB 4.47Å; K617-L677 WeakPolarHBondContact CD-O 3.5Å; K617-L677 WeakPolarHBondContact CG-O 3.4Å; K617-L677 WeakPolarHBondContact O-CB 3.44Å; K617-L677 PolarHBondContact O-N 3.06Å; L620-L677 HydrophobicContact CB-CD1 3.71Å; L620-L677 HydrophobicContact CB-CD2 4.01Å; L620-L677 VanDerWaalsContact N-CD1 3.34Å; F635-L677 HydrophobicContact CD2-CD1 3.7Å; F635-L677 HydrophobicContact CD2-CD2 4.24Å; F635-L677 HydrophobicContact CD2-CG 4.04Å; F635-L677 HydrophobicContact CE2-CD1 4.08Å; F635-L677 HydrophobicContact CE2-CD2 4.06Å; F635-L677 HydrophobicContact CE2-CG 4.36Å; L677-F766 HydrophobicContact CD2-CD1 3.91Å; L677-F766 HydrophobicContact CD2-CD2 4.29Å; L677-F766 HydrophobicContact CD2-CE1 3.48Å; L677-F766 VanDerWaalsContact CD2-CE1 3.48Å; L677-F766 HydrophobicContact CD2-CE2 3.89Å; L677-F766 HydrophobicContact CD2-CG 4.29Å; L677-F766 HydrophobicContact CD2-CZ 3.47Å; L677-F766 VanDerWaalsContact CD2-CZ 3.47Å; L677-F766 HydrophobicContact CG-CE1 4.38Å; L677-F766 HydrophobicContact CG-CE2 3.98Å; L677-F766 HydrophobicContact CG-CZ 3.86Å; L677-L790 HydrophobicContact CD2-CD2 3.89Å
678	P	95.4	Very high	92	Very high	9 Å²	9	52.1 Å²	52.1	6%	0.058	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-66.1	153	170.5	29.9	-37.2	0	0	0	110.7	I680 C734 D737 L790	P678-I680 HydrophobicContact CB-CG1 4.42Å; P678-I680 HydrophobicContact CG-CD1 3.85Å; P678-I680 HydrophobicContact CG-CG1 3.96Å; P678-I680 PolarHBondContact O-N 3.21Å; P678-C734 HydrophobicContact CB-CB 4.04Å; P678-C734 WeakPolarHBondContact CB-O 3.5Å; P678-C734 HydrophobicContact CG-CB 4.39Å; P678-C734 VanDerWaalsContact CG-SG 3.58Å; P678-D737 WeakPolarHBondContact CA-OD1 3.34Å; P678-L790 HydrophobicContact CG-CD1 3.71Å; P678-L790 HydrophobicContact CG-CD2 4.42Å
679	T	92.1	Very high	91.3	Very high	94 Å²	94	57.1 Å²	57.1	58%	0.577	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-67.5	118.5	163.9	-54.7	0	0	0	0	108.4	D737	T679-D737 WeakPolarHBondContact CB-OD1 3.49Å; T679-D737 PolarHBondContact N-OD1 3.33Å; T679-D737 PolarHBondContact OG1-OD1 3.27Å; T679-D737 PolarHBondContact OG1-OD2 3.31Å
680	I	89.7	Confident	90.9	Very high	40 Å²	40	56.5 Å²	56.5	21%	0.205	33%	0.326	C	S	.	.			trans	-118.9	125.9	-177.6	-69	166.9	0	0	0	109.1	L620 P678 Y684 L685 L790	L620-I680 HydrophobicContact CD1-CD1 3.95Å; P678-I680 HydrophobicContact CB-CG1 4.42Å; P678-I680 HydrophobicContact CG-CD1 3.85Å; P678-I680 HydrophobicContact CG-CG1 3.96Å; P678-I680 PolarHBondContact O-N 3.21Å; I680-Y684 HydrophobicContact CG2-CD1 3.59Å; I680-Y684 HydrophobicContact CG2-CG 3.96Å; I680-L685 HydrophobicContact CD1-CD1 4.26Å; I680-L685 HydrophobicContact CD1-CD2 4.4Å; I680-L685 HydrophobicContact CG2-CG 4.1Å; I680-L790 HydrophobicContact CD1-CB 4.42Å; I680-L790 HydrophobicContact CD1-CD1 4.25Å; I680-L790 HydrophobicContact CD1-CD2 3.57Å; I680-L790 HydrophobicContact CD1-CG 4.28Å
681	P	86.5	Confident	90.7	Very high	74 Å²	74	54.8 Å²	54.8	48%	0.481	31%	0.314	S	S	.	.			trans	-60.7	152.5	174.2	-22	32.5	0	0	0	112.5	T683 Y684	P681-T683 PolarHBondContact O-N 3.29Å; P681-Y684 WeakPolarHBondContact O-CB 3.43Å; P681-Y684 PolarHBondContact O-N 3.42Å
682	P	78.2	Confident	90.4	Very high	117 Å²	117	56.8 Å²	56.8	76%	0.76	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	142.6	170.5	-24.1	34.1	0	0	0	111.2	Y684	P682-Y684 PolarHBondContact O-N 3.33Å
683	T	80.7	Confident	90.3	Very high	147 Å²	147	60.1 Å²	60.1	90%	0.902	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	12.6	179.3	68.9	0	0	0	0	116.1	P681	P681-T683 PolarHBondContact O-N 3.29Å
684	Y	90.5	Very high	90.2	Very high	45 Å²	45	57.8 Å²	57.8	18%	0.176	33%	0.332	C	S	.	.			trans	-68.8	-36.6	-179.8	172.2	-94	0	0	0	113	I680 P681 P682 K768 Q770 N788	I680-Y684 HydrophobicContact CG2-CD1 3.59Å; I680-Y684 HydrophobicContact CG2-CG 3.96Å; P681-Y684 WeakPolarHBondContact O-CB 3.43Å; P681-Y684 PolarHBondContact O-N 3.42Å; P682-Y684 PolarHBondContact O-N 3.33Å; Y684-K768 HydrophobicContact CE1-CG 4.5Å; Y684-Q770 PolarHBondContact OH-NE2 3.46Å; Y684-N788 HydrophobicContact CD1-CB 4.32Å; Y684-N788 HydrophobicContact CE1-CB 3.88Å; Y684-N788 WeakPolarHBondContact O-CB 3.13Å; Y684-N788 PolarHBondContact O-ND2 2.91Å; Y684-N788 VanDerWaalsContact O-ND2 3.08Å
685	L	94.3	Very high	90.2	Very high	28 Å²	28	58.2 Å²	58.2	15%	0.147	34%	0.338	C	S	.	.	S	Bend	trans	-83	139.2	-177.2	-65.9	179.8	0	0	0	111.6	L620 I680 P704 L790	L620-L685 HydrophobicContact CD1-CD1 4.1Å; I680-L685 HydrophobicContact CD1-CD1 4.26Å; I680-L685 HydrophobicContact CD1-CD2 4.4Å; I680-L685 HydrophobicContact CG2-CG 4.1Å; L685-P704 HydrophobicContact CB-CB 3.91Å; L685-P704 HydrophobicContact CB-CG 3.87Å; L685-L790 HydrophobicContact CD1-CB 4.4Å; L685-L790 HydrophobicContact CD2-CB 3.81Å
686	G	93.7	Very high	90.4	Very high	3 Å²	3	53.5 Å²	53.5	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	101.3	-165.3	178.6	0	0	0	0	0	113.8	P704 Y787 N788	G686-P704 VanDerWaalsContact N-CB 3.28Å; G686-Y787 WeakPolarHBondContact O-CA 3.31Å; G686-N788 PolarHBondContact N-O 3.47Å; G686-N788 PolarHBondContact O-N 3.32Å; G686-N788 VanDerWaalsContact O-N 3.08Å
687	P	92.4	Very high	90.5	Very high	72 Å²	72	59.8 Å²	59.8	47%	0.468	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	137.3	177.2	29	-33	0	0	0	110.9	F691 Y787	P687-F691 HydrophobicContact CB-CB 3.72Å; P687-F691 HydrophobicContact CB-CD1 3.51Å; P687-F691 HydrophobicContact CB-CD2 4.49Å; P687-F691 HydrophobicContact CB-CE1 4.27Å; P687-F691 HydrophobicContact CB-CG 3.64Å; P687-Y787 HydrophobicContact CB-CD2 3.77Å; P687-Y787 HydrophobicContact CB-CE2 3.77Å; P687-Y787 HydrophobicContact CG-CE2 4.11Å
688	V	91.1	Very high	90.5	Very high	53 Å²	53	60 Å²	60	32%	0.321	35%	0.349	S	S	.	.			trans	-91.5	162.8	173	-170.8	0	0	0	0	109.1	R690 F691 V786	V688-R690 PolarHBondContact O-N 3.44Å; V688-F691 WeakPolarHBondContact O-CB 3.31Å; V688-F691 PolarHBondContact O-N 3Å; V688-V786 PolarHBondContact N-O 2.81Å
689	S	83.5	Confident	90.5	Very high	111 Å²	111	63.1 Å²	63.1	78%	0.776	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-26.9	-172.2	58.4	0	0	0	0	116.7
690	R	87.2	Confident	90.7	Very high	94 Å²	94	60.8 Å²	60.8	36%	0.355	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-3	177.1	-60.5	-169.6	87.4	-167	2.2	114.6	V688 S693 M694 E778	V688-R690 PolarHBondContact O-N 3.44Å; R690-S693 WeakPolarHBondContact CA-OG 2.99Å; R690-S693 PolarHBondContact O-N 3.45Å; R690-S693 PolarHBondContact O-OG 3.14Å; R690-S693 VanDerWaalsContact O-OG 3.08Å; R690-M694 HydrophobicContact CB-CE 3.7Å; R690-M694 HydrophobicContact CB-CG 4.43Å; R690-M694 HydrophobicContact CG-CE 4.46Å; R690-M694 WeakPolarHBondContact O-CB 3.24Å; R690-M694 VanDerWaalsContact O-CG 3.23Å; R690-M694 WeakPolarHBondContact O-CG 3.48Å; R690-M694 PolarHBondContact O-N 2.82Å; R690-E778 IonicContact CZ-OE1 3.16Å; R690-E778 IonicContact CZ-OE2 3.93Å; R690-E778 IonicContact NH1-OE2 3.78Å; R690-E778 PolarHBondContact NH1-OE2 3.04Å; R690-E778 IonicContact NH2-OE1 2.76Å; R690-E778 PolarHBondContact NH2-OE1 3.25Å; R690-E778 IonicContact NH2-OE2 2.82Å; R690-E778 PolarHBondContact NH2-OE2 3.23Å
691	F	92.9	Very high	91	Very high	7 Å²	7	61.5 Å²	61.5	3%	0.031	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-57.6	-173.4	179.9	-106.7	0	0	0	113.2	P687 V688 M694 L696 F717 V786 Y787	P687-F691 HydrophobicContact CB-CB 3.72Å; P687-F691 HydrophobicContact CB-CD1 3.51Å; P687-F691 HydrophobicContact CB-CD2 4.49Å; P687-F691 HydrophobicContact CB-CE1 4.27Å; P687-F691 HydrophobicContact CB-CG 3.64Å; V688-F691 WeakPolarHBondContact O-CB 3.31Å; V688-F691 PolarHBondContact O-N 3Å; F691-M694 PolarHBondContact O-N 2.87Å; F691-L696 HydrophobicContact CD2-CB 3.92Å; F691-L696 HydrophobicContact CD2-CD1 4.29Å; F691-L696 WeakPolarHBondContact CE1-O 3.16Å; F691-L696 HydrophobicContact CE2-CB 3.46Å; F691-L696 VanDerWaalsContact CE2-CB 3.46Å; F691-L696 HydrophobicContact CE2-CD1 4.21Å; F691-L696 HydrophobicContact CE2-CG 4.49Å; F691-L696 HydrophobicContact CZ-CB 3.84Å; F691-L696 PolarHBondContact O-N 3.28Å; F691-F717 AromaticContact CE2-CD1 3.8Å; F691-F717 HydrophobicContact CE2-CD1 3.8Å; F691-F717 AromaticContact CE2-CE1 3.48Å; F691-F717 HydrophobicContact CE2-CE1 3.48Å; F691-F717 VanDerWaalsContact CE2-CE1 3.48Å; F691-F717 AromaticContact CZ-CD1 3.74Å; F691-F717 HydrophobicContact CZ-CD1 3.74Å; F691-F717 AromaticContact CZ-CE1 3.5Å; F691-F717 HydrophobicContact CZ-CE1 3.5Å; F691-V786 WeakPolarHBondContact CB-O 3.38Å; F691-V786 HydrophobicContact CD2-CB 4.29Å; F691-V786 WeakPolarHBondContact CD2-O 3.47Å; F691-Y787 HydrophobicContact CD1-CD2 4.37Å; F691-Y787 AromaticContact CD2-CD2 3.75Å; F691-Y787 HydrophobicContact CD2-CD2 3.75Å; F691-Y787 HydrophobicContact CD2-CG 4.46Å; F691-Y787 HydrophobicContact CE1-CD2 4.18Å; F691-Y787 HydrophobicContact CE1-CE2 4.33Å; F691-Y787 AromaticContact CE2-CD2 3.54Å; F691-Y787 HydrophobicContact CE2-CD2 3.54Å; F691-Y787 HydrophobicContact CE2-CE2 4.39Å; F691-Y787 HydrophobicContact CE2-CG 4.32Å; F691-Y787 HydrophobicContact CG-CD2 4.17Å; F691-Y787 AromaticContact CZ-CD2 3.77Å; F691-Y787 HydrophobicContact CZ-CD2 3.77Å; F691-Y787 HydrophobicContact CZ-CE2 4.17Å
692	D	89.9	Confident	91.3	Very high	116 Å²	116	62.9 Å²	62.9	62%	0.62	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-37.3	-178.4	-61.4	-55.6	0	0	0	111.7	M694 G695	D692-M694 VanDerWaalsContact C-N 3.26Å; D692-M694 PolarHBondContact O-N 3.37Å; D692-G695 WeakPolarHBondContact O-CA 3.11Å; D692-G695 PolarHBondContact O-N 2.87Å
693	S	91.6	Very high	92.1	Very high	72 Å²	72	58.8 Å²	58.8	50%	0.503	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-28.3	179.8	63.8	0	0	0	0	112.6	R690 G695 K723	R690-S693 WeakPolarHBondContact CA-OG 2.99Å; R690-S693 PolarHBondContact O-N 3.45Å; R690-S693 PolarHBondContact O-OG 3.14Å; R690-S693 VanDerWaalsContact O-OG 3.08Å; S693-G695 PolarHBondContact O-N 3.2Å; S693-K723 PolarHBondContact O-NZ 2.91Å
694	M	92.2	Very high	92.8	Very high	5 Å²	5	52 Å²	52	3%	0.025	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-6.5	169.4	-73	-164.1	-159.7	0	0	113.8	R690 F691 D692 L725 A773 P784 V786	R690-M694 HydrophobicContact CB-CE 3.7Å; R690-M694 HydrophobicContact CB-CG 4.43Å; R690-M694 HydrophobicContact CG-CE 4.46Å; R690-M694 WeakPolarHBondContact O-CB 3.24Å; R690-M694 VanDerWaalsContact O-CG 3.23Å; R690-M694 WeakPolarHBondContact O-CG 3.48Å; R690-M694 PolarHBondContact O-N 2.82Å; F691-M694 PolarHBondContact O-N 2.87Å; D692-M694 VanDerWaalsContact C-N 3.26Å; D692-M694 PolarHBondContact O-N 3.37Å; M694-L725 HydrophobicContact CB-CD1 4.11Å; M694-L725 HydrophobicContact CB-CD2 4.28Å; M694-L725 HydrophobicContact CG-CD2 4.47Å; M694-L725 WeakPolarHBondContact O-CD1 3.3Å; M694-L725 HydrophobicContact SD-CD2 4.47Å; M694-A773 VanDerWaalsContact CE-O 3.25Å; M694-A773 WeakPolarHBondContact CE-O 3.35Å; M694-A773 HydrophobicContact SD-CB 3.65Å; M694-P784 HydrophobicContact CE-CG 3.96Å; M694-V786 HydrophobicContact CE-CG1 3.6Å; M694-V786 HydrophobicContact SD-CG1 3.49Å; M694-V786 WeakPolarHBondContact SD-CG1 3.32Å
695	G	93.3	Very high	93.1	Very high	15 Å²	15	50.4 Å²	50.4	16%	0.155	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	28	-179.8	0	0	0	0	0	113.1	D692 S693 R719 H720	D692-G695 WeakPolarHBondContact O-CA 3.11Å; D692-G695 PolarHBondContact O-N 2.87Å; S693-G695 PolarHBondContact O-N 3.2Å; G695-R719 CarbonylContact O-C 3.5Å; G695-R719 WeakPolarHBondContact O-CA 3.45Å; G695-H720 PolarHBondContact O-N 2.76Å
696	L	95.4	Very high	93.2	Very high	8 Å²	8	49.5 Å²	49.5	4%	0.042	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	148.6	171.4	-66.1	172.5	0	0	0	110.1	F691 A718 R719 L725 I727 I755 A773 V786	F691-L696 HydrophobicContact CD2-CB 3.92Å; F691-L696 HydrophobicContact CD2-CD1 4.29Å; F691-L696 WeakPolarHBondContact CE1-O 3.16Å; F691-L696 HydrophobicContact CE2-CB 3.46Å; F691-L696 VanDerWaalsContact CE2-CB 3.46Å; F691-L696 HydrophobicContact CE2-CD1 4.21Å; F691-L696 HydrophobicContact CE2-CG 4.49Å; F691-L696 HydrophobicContact CZ-CB 3.84Å; F691-L696 PolarHBondContact O-N 3.28Å; L696-A718 WeakPolarHBondContact CA-O 3.42Å; L696-R719 HydrophobicContact CD2-CB 4.11Å; L696-L725 HydrophobicContact CD1-CD1 4.06Å; L696-L725 HydrophobicContact CD2-CD1 3.83Å; L696-L725 HydrophobicContact CG-CD1 3.79Å; L696-I727 HydrophobicContact CD2-CD1 4.21Å; L696-I755 HydrophobicContact CD2-CD1 3.82Å; L696-A773 HydrophobicContact CD1-CB 4.22Å; L696-V786 HydrophobicContact CD1-CG2 3.97Å
697	K	94.9	Very high	93.2	Very high	139 Å²	139	54.7 Å²	54.7	60%	0.604	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.6	129.5	171.8	-179.6	178.3	179.5	179.4	0	110.2	L699 F717 A718	K697-L699 PolarHBondContact O-N 2.98Å; K697-F717 CarbonylContact O-C 3.57Å; K697-F717 VanDerWaalsContact O-CA 3.28Å; K697-F717 WeakPolarHBondContact O-CA 3.3Å; K697-A718 HydrophobicContact CB-CB 4.35Å; K697-A718 PolarHBondContact N-O 2.73Å; K697-A718 PolarHBondContact O-N 3Å
698	A	95.1	Very high	93.3	Very high	12 Å²	12	51.3 Å²	51.3	10%	0.099	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.9	175.2	0	0	0	0	0	109.7	T702 F717 Y787	A698-T702 HydrophobicContact CB-CG2 4.48Å; A698-F717 HydrophobicContact CB-CD1 4.18Å; A698-F717 HydrophobicContact CB-CE1 3.73Å; A698-F717 HydrophobicContact CB-CZ 4.25Å; A698-Y787 HydrophobicContact CB-CE2 4.34Å
699	L	95.7	Very high	93.2	Very high	74 Å²	74	53.6 Å²	53.6	39%	0.387	29%	0.294	S	S	.	.	S	Bend	trans	-102.5	-48.5	-179.2	-65.3	179.1	0	0	0	112.2	K697 Q716 A718 Q754	K697-L699 PolarHBondContact O-N 2.98Å; L699-Q716 HydrophobicContact CB-CB 4.18Å; L699-Q716 PolarHBondContact N-O 3.33Å; L699-A718 HydrophobicContact CD1-CB 3.91Å; L699-A718 HydrophobicContact CD2-CB 3.94Å; L699-A718 HydrophobicContact CG-CB 3.97Å; L699-Q754 HydrophobicContact CD1-CG 4Å
700	S	96	Very high	93.5	Very high	45 Å²	45	52.7 Å²	52.7	32%	0.315	28%	0.284	S	S	.	.	S	Bend	trans	-84.7	-40.2	-172.8	61.2	0	0	0	0	113.6	I715 Q716	S700-I715 WeakPolarHBondContact OG-CA 3.35Å; S700-Q716 PolarHBondContact N-O 3.25Å; S700-Q716 PolarHBondContact OG-N 2.97Å
701	H	95.5	Very high	93.7	Very high	54 Å²	54	48.2 Å²	48.2	25%	0.25	27%	0.267	C	S	.	.			trans	-139.7	99.8	-169.4	-62.4	99.7	0	0	0	109.7	I706 C714 Y789	H701-I706 HydrophobicContact CB-CD1 3.52Å; H701-I706 HydrophobicContact CB-CG1 4.05Å; H701-I706 VanDerWaalsContact CG-CD1 3.46Å; H701-C714 PolarHBondContact CE1-O 3.49Å; H701-Y789 HydrophobicContact CB-CE1 4.07Å; H701-Y789 WeakPolarHBondContact O-CE1 3.42Å; H701-Y789 PolarHBondContact O-OH 3.23Å
702	T	93.3	Very high	93.7	Very high	103 Å²	103	51.5 Å²	51.5	63%	0.632	28%	0.282	S	S	*	.			trans	-86.5	-23.8	176.7	52.1	0	0	0	0	112.9	A698 Y787	A698-T702 HydrophobicContact CB-CG2 4.48Å; T702-Y787 PolarHBondContact O-OH 2.96Å
703	D	94.8	Very high	94	Very high	31 Å²	31	46.9 Å²	46.9	17%	0.166	26%	0.257	C	S	.	.	S	Bend	trans	-75.4	123.1	168.3	-170.6	-22	0	0	0	108.9	R622 F705	R622-D703 WeakPolarHBondContact CD-OD1 3.43Å; R622-D703 IonicContact CZ-OD1 3.28Å; R622-D703 IonicContact CZ-OD2 3.68Å; R622-D703 IonicContact NE-OD1 3.71Å; R622-D703 PolarHBondContact NE-OD1 3.45Å; R622-D703 IonicContact NE-OD2 2.7Å; R622-D703 PolarHBondContact NE-OD2 2.87Å; R622-D703 IonicContact NH2-OD1 2.65Å; R622-D703 IonicContact NH2-OD2 3.84Å; R622-D703 PolarHBondContact NH2-OD2 3.15Å; D703-F705 PolarHBondContact O-N 2.92Å; D703-F705 PolarHBondContact OD1-N 3.06Å
704	P	95.3	Very high	94.3	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.039	25%	0.248	C	C	.	.	S	Bend	trans	-72.2	-6.3	-179.8	30.4	-36.8	0	0	0	114.1	L685 G686 Y787 Y789 L790	L685-P704 HydrophobicContact CB-CB 3.91Å; L685-P704 HydrophobicContact CB-CG 3.87Å; G686-P704 VanDerWaalsContact N-CB 3.28Å; P704-Y787 HydrophobicContact CB-CE1 4.28Å; P704-Y789 VanDerWaalsContact CA-CD1 3.47Å; P704-Y789 HydrophobicContact CB-CD1 4.39Å; P704-Y789 CarbonylContact O-C 3.58Å; P704-Y789 WeakPolarHBondContact O-CA 3.41Å; P704-Y789 WeakPolarHBondContact O-CB 3.44Å; P704-Y789 WeakPolarHBondContact O-CD1 3.31Å; P704-L790 PolarHBondContact O-N 3.07Å
705	F	96.2	Very high	94.6	Very high	11 Å²	11	45.4 Å²	45.4	5%	0.048	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.5	168	178.9	-108	0	0	0	110.6	L620 A633 F635 D703 Q707 F766 L790 E792	L620-F705 HydrophobicContact CD2-CB 4.11Å; L620-F705 HydrophobicContact CD2-CD1 4.39Å; L620-F705 HydrophobicContact CD2-CD2 3.38Å; L620-F705 HydrophobicContact CD2-CE2 3.88Å; L620-F705 HydrophobicContact CD2-CG 3.68Å; A633-F705 HydrophobicContact CB-CE1 4.43Å; F635-F705 HydrophobicContact CE1-CZ 4.31Å; F635-F705 HydrophobicContact CE2-CZ 4.48Å; F635-F705 HydrophobicContact CZ-CE1 4.17Å; F635-F705 HydrophobicContact CZ-CE2 4.27Å; F635-F705 AromaticContact CZ-CZ 3.56Å; F635-F705 HydrophobicContact CZ-CZ 3.56Å; D703-F705 PolarHBondContact O-N 2.92Å; D703-F705 PolarHBondContact OD1-N 3.06Å; F705-Q707 HydrophobicContact CE1-CG 3.66Å; F705-Q707 HydrophobicContact CZ-CG 4.04Å; F705-F766 HydrophobicContact CE2-CE1 4.29Å; F705-L790 VanDerWaalsContact CA-O 3.3Å; F705-L790 WeakPolarHBondContact CA-O 3.45Å; F705-L790 HydrophobicContact CD2-CB 4.18Å; F705-L790 HydrophobicContact CD2-CD2 4.07Å; F705-L790 HydrophobicContact CD2-CG 4.12Å; F705-L790 VanDerWaalsContact CD2-O 3.32Å; F705-L790 WeakPolarHBondContact CD2-O 3.45Å; F705-L790 HydrophobicContact CE2-CD2 4.3Å; F705-L790 HydrophobicContact CE2-CG 4.41Å; F705-E792 HydrophobicContact CE2-CB 3.86Å; F705-E792 HydrophobicContact CZ-CB 3.68Å
706	I	96.6	Very high	94.8	Very high	9 Å²	9	47.6 Å²	47.6	5%	0.046	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	128.8	-178.6	-53.8	171	0	0	0	109.9	H701 L713 I715 Y789 L790 L791 E792	H701-I706 HydrophobicContact CB-CD1 3.52Å; H701-I706 HydrophobicContact CB-CG1 4.05Å; H701-I706 VanDerWaalsContact CG-CD1 3.46Å; I706-L713 HydrophobicContact CB-CD2 4.4Å; I706-L713 HydrophobicContact CD1-CD2 4.18Å; I706-L713 HydrophobicContact CG2-CD1 3.98Å; I706-L713 HydrophobicContact CG2-CD2 3.87Å; I706-I715 HydrophobicContact CD1-CD1 3.72Å; I706-I715 HydrophobicContact CD1-CG1 4.13Å; I706-Y789 HydrophobicContact CD1-CD1 3.56Å; I706-Y789 HydrophobicContact CD1-CE1 3.76Å; I706-Y789 HydrophobicContact CD1-CG 4.33Å; I706-Y789 HydrophobicContact CG1-CD1 3.98Å; I706-Y789 HydrophobicContact CG1-CE1 4.35Å; I706-L790 PolarHBondContact N-O 3.3Å; I706-L791 HydrophobicContact CB-CD2 3.82Å; I706-L791 HydrophobicContact CD1-CD2 3.8Å; I706-L791 HydrophobicContact CG1-CD2 4.11Å; I706-L791 CarbonylContact O-C 3.5Å; I706-L791 WeakPolarHBondContact O-CA 3.27Å; I706-E792 PolarHBondContact O-N 3.28Å
707	Q	94	Very high	94.9	Very high	111 Å²	111	47.4 Å²	47.4	52%	0.519	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	108.8	169.6	-56.8	-169.6	-61.4	0	0	109.9	F705 E792	F705-Q707 HydrophobicContact CE1-CG 3.66Å; F705-Q707 HydrophobicContact CZ-CG 4.04Å; Q707-E792 WeakPolarHBondContact CG-OE2 3.43Å; Q707-E792 PolarHBondContact NE2-OE2 3.19Å
708	A	94.2	Very high	95	Very high	2 Å²	2	42 Å²	42	2%	0.017	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	100.8	177.3	0	0	0	0	0	110.8	L713 F761 E792 A793 T794	A708-L713 HydrophobicContact CB-CB 4.36Å; A708-L713 HydrophobicContact CB-CD2 4.42Å; A708-F761 HydrophobicContact CB-CD2 4.05Å; A708-F761 HydrophobicContact CB-CE2 3.25Å; A708-F761 HydrophobicContact CB-CZ 3.57Å; A708-E792 PolarHBondContact N-O 2.94Å; A708-A793 WeakPolarHBondContact O-CA 3.28Å; A708-T794 PolarHBondContact O-N 3.26Å; A708-T794 VanDerWaalsContact O-N 3.11Å
709	N	89.9	Confident	94.9	Very high	101 Å²	101	44.7 Å²	44.7	54%	0.54	24%	0.241	S	C	.	.			trans	-102.6	1.4	-173.7	63.6	-1.4	0	0	0	114.8	Q795	N709-Q795 VanDerWaalsContact O-CG 3.23Å; N709-Q795 WeakPolarHBondContact O-CG 3.23Å; N709-Q795 PolarHBondContact O-NE2 3.09Å; N709-Q795 VanDerWaalsContact O-NE2 3.09Å; N709-Q795 PolarHBondContact O-OE1 2.9Å
710	T	90.1	Very high	94.8	Very high	92 Å²	92	45.1 Å²	45.1	56%	0.564	24%	0.241	S	C	*	.	S	Bend	trans	-110.7	-4.1	-175.6	44.7	0	0	0	0	114.1	E712	T710-E712 PolarHBondContact O-N 3.1Å; T710-E712 PolarHBondContact OG1-O 3.22Å
711	G	90.4	Very high	94.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	78.4	-14.7	-173.3	0	0	0	0	0	114.6	F761 N797	G711-F761 WeakPolarHBondContact O-CD2 3.45Å; G711-F761 PolarHBondContact O-N 3.47Å; G711-N797 WeakPolarHBondContact O-CB 3.29Å
712	E	93.2	Very high	94.3	Very high	76 Å²	76	49.7 Å²	49.7	36%	0.355	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138	172	-170.4	172.8	100.5	0	0	110.7	T710 V758 I759 R760 N797	T710-E712 PolarHBondContact O-N 3.1Å; T710-E712 PolarHBondContact OG1-O 3.22Å; E712-V758 HydrophobicContact CG-CG1 3.87Å; E712-I759 CarbonylContact C-O 3.6Å; E712-I759 VanDerWaalsContact CA-O 3.23Å; E712-I759 WeakPolarHBondContact CA-O 3.42Å; E712-I759 WeakPolarHBondContact CG-O 3.16Å; E712-R760 HydrophobicContact CG-CG 4.11Å; E712-R760 WeakPolarHBondContact OE2-CG 3.48Å; E712-R760 IonicContact OE2-CZ 2.75Å; E712-R760 IonicContact OE2-NE 2.81Å; E712-R760 PolarHBondContact OE2-NE 3.44Å; E712-R760 IonicContact OE2-NH2 3.28Å; E712-N797 PolarHBondContact OE2-ND2 2.96Å
713	L	96.8	Very high	94.1	Very high	18 Å²	18	49.1 Å²	49.1	9%	0.094	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135	-178.3	175.3	67	0	0	0	110.2	I706 A708 I715 V758 I759 F761 L791	I706-L713 HydrophobicContact CB-CD2 4.4Å; I706-L713 HydrophobicContact CD1-CD2 4.18Å; I706-L713 HydrophobicContact CG2-CD1 3.98Å; I706-L713 HydrophobicContact CG2-CD2 3.87Å; A708-L713 HydrophobicContact CB-CB 4.36Å; A708-L713 HydrophobicContact CB-CD2 4.42Å; L713-I715 HydrophobicContact CD2-CD1 3.89Å; L713-I715 HydrophobicContact CD2-CG1 3.93Å; L713-I715 HydrophobicContact CG-CD1 4.49Å; L713-I715 HydrophobicContact CG-CG1 4Å; L713-V758 CarbonylContact O-C 3.57Å; L713-V758 WeakPolarHBondContact O-CA 3.45Å; L713-I759 HydrophobicContact CB-CB 4.48Å; L713-I759 PolarHBondContact N-O 2.86Å; L713-I759 PolarHBondContact O-N 2.97Å; L713-F761 HydrophobicContact CB-CE2 3.81Å; L713-F761 HydrophobicContact CB-CZ 4.13Å; L713-F761 HydrophobicContact CD2-CZ 4.24Å; L713-L791 HydrophobicContact CD2-CD1 4.2Å; L713-L791 HydrophobicContact CD2-CD2 3.97Å
714	C	97.4	Very high	93.9	Very high	46 Å²	46	50.6 Å²	50.6	31%	0.311	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.7	170.9	-173.8	0	0	0	0	110.3	H701 F757	H701-C714 PolarHBondContact CE1-O 3.49Å; C714-F757 CarbonylContact C-O 3.56Å; C714-F757 WeakPolarHBondContact CA-O 3.32Å
715	I	98.3	Very high	93.8	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.2	174.6	-54.6	177.8	0	0	0	108.9	S700 I706 L713 F717 F757 I759 F769 Y789 L791	S700-I715 WeakPolarHBondContact OG-CA 3.35Å; I706-I715 HydrophobicContact CD1-CD1 3.72Å; I706-I715 HydrophobicContact CD1-CG1 4.13Å; L713-I715 HydrophobicContact CD2-CD1 3.89Å; L713-I715 HydrophobicContact CD2-CG1 3.93Å; L713-I715 HydrophobicContact CG-CD1 4.49Å; L713-I715 HydrophobicContact CG-CG1 4Å; I715-F717 HydrophobicContact CG2-CD2 4.17Å; I715-F717 HydrophobicContact CG2-CE2 3.56Å; I715-F717 HydrophobicContact CG2-CZ 4.44Å; I715-F757 HydrophobicContact CB-CB 4.43Å; I715-F757 PolarHBondContact N-O 2.87Å; I715-F757 PolarHBondContact O-N 3.41Å; I715-I759 HydrophobicContact CD1-CD1 3.9Å; I715-I759 HydrophobicContact CG1-CD1 4.46Å; I715-F769 HydrophobicContact CD1-CD1 3.6Å; I715-F769 HydrophobicContact CD1-CE1 3.7Å; I715-Y789 HydrophobicContact CD1-CD2 4.43Å; I715-Y789 HydrophobicContact CG2-CE2 4.15Å; I715-L791 HydrophobicContact CD1-CD2 4.25Å
716	Q	98	Very high	93.6	Very high	61 Å²	61	53.6 Å²	53.6	29%	0.285	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.2	-173.3	-59.4	179	4.4	0	0	111.9	L699 S700 I755 Y756	L699-Q716 HydrophobicContact CB-CB 4.18Å; L699-Q716 PolarHBondContact N-O 3.33Å; S700-Q716 PolarHBondContact N-O 3.25Å; S700-Q716 PolarHBondContact OG-N 2.97Å; Q716-I755 VanDerWaalsContact CA-O 3.31Å; Q716-I755 WeakPolarHBondContact CA-O 3.42Å; Q716-Y756 HydrophobicContact CG-CD1 3.72Å; Q716-Y756 HydrophobicContact CG-CE1 3.98Å
717	F	97.4	Very high	93.4	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.8	174.4	-74.9	-96.5	0	0	0	110.6	F691 K697 A698 I715 Q754 I755 F757 I771 Y787 Y789	F691-F717 AromaticContact CE2-CD1 3.8Å; F691-F717 HydrophobicContact CE2-CD1 3.8Å; F691-F717 AromaticContact CE2-CE1 3.48Å; F691-F717 HydrophobicContact CE2-CE1 3.48Å; F691-F717 VanDerWaalsContact CE2-CE1 3.48Å; F691-F717 AromaticContact CZ-CD1 3.74Å; F691-F717 HydrophobicContact CZ-CD1 3.74Å; F691-F717 AromaticContact CZ-CE1 3.5Å; F691-F717 HydrophobicContact CZ-CE1 3.5Å; K697-F717 CarbonylContact O-C 3.57Å; K697-F717 VanDerWaalsContact O-CA 3.28Å; K697-F717 WeakPolarHBondContact O-CA 3.3Å; A698-F717 HydrophobicContact CB-CD1 4.18Å; A698-F717 HydrophobicContact CB-CE1 3.73Å; A698-F717 HydrophobicContact CB-CZ 4.25Å; I715-F717 HydrophobicContact CG2-CD2 4.17Å; I715-F717 HydrophobicContact CG2-CE2 3.56Å; I715-F717 HydrophobicContact CG2-CZ 4.44Å; F717-Q754 CarbonylContact O-C 3.45Å; F717-Q754 VanDerWaalsContact O-CA 3.25Å; F717-Q754 WeakPolarHBondContact O-CA 3.46Å; F717-I755 HydrophobicContact CB-CB 4.38Å; F717-I755 HydrophobicContact CB-CD1 4.37Å; F717-I755 PolarHBondContact N-O 2.88Å; F717-I755 PolarHBondContact O-N 2.84Å; F717-F757 HydrophobicContact CD2-CD2 4.11Å; F717-F757 AromaticContact CD2-CE2 3.93Å; F717-F757 HydrophobicContact CD2-CE2 3.93Å; F717-F757 HydrophobicContact CE2-CD2 4.42Å; F717-F757 HydrophobicContact CE2-CE2 4.34Å; F717-I771 HydrophobicContact CD2-CD1 4.05Å; F717-I771 HydrophobicContact CE1-CD1 4.38Å; F717-I771 HydrophobicContact CE2-CD1 3.25Å; F717-I771 HydrophobicContact CZ-CD1 3.47Å; F717-I771 VanDerWaalsContact CZ-CD1 3.47Å; F717-Y787 AromaticContact CE1-CD2 3.99Å; F717-Y787 HydrophobicContact CE1-CD2 3.99Å; F717-Y787 HydrophobicContact CE1-CE2 4.39Å; F717-Y787 HydrophobicContact CE1-CG 4.27Å; F717-Y787 HydrophobicContact CZ-CD1 4.41Å; F717-Y787 HydrophobicContact CZ-CD2 4.25Å; F717-Y787 HydrophobicContact CZ-CG 4.12Å; F717-Y789 HydrophobicContact CE2-CE2 4.04Å; F717-Y789 AromaticContact CZ-CE2 3.69Å; F717-Y789 HydrophobicContact CZ-CE2 3.69Å; F717-Y789 AromaticContact CZ-CZ 3.95Å; F717-Y789 VanDerWaalsContact CZ-OH 3.28Å; F717-Y789 WeakPolarHBondContact CZ-OH 3.38Å
718	A	96.2	Very high	93.4	Very high	27 Å²	27	52.7 Å²	52.7	22%	0.223	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	145	162.2	0	0	0	0	0	109.2	L696 K697 L699	L696-A718 WeakPolarHBondContact CA-O 3.42Å; K697-A718 HydrophobicContact CB-CB 4.35Å; K697-A718 PolarHBondContact N-O 2.73Å; K697-A718 PolarHBondContact O-N 3Å; L699-A718 HydrophobicContact CD1-CB 3.91Å; L699-A718 HydrophobicContact CD2-CB 3.94Å; L699-A718 HydrophobicContact CG-CB 3.97Å
719	R	93.8	Very high	93.6	Very high	67 Å²	67	53.3 Å²	53.3	25%	0.253	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	145	168.1	60.8	169	-173	133.6	-0.1	110.4	G695 L696 F753 I755	G695-R719 CarbonylContact O-C 3.5Å; G695-R719 WeakPolarHBondContact O-CA 3.45Å; L696-R719 HydrophobicContact CD2-CB 4.11Å; R719-F753 HydrophobicContact CG-CB 4.32Å; R719-F753 VanDerWaalsContact CG-O 3.22Å; R719-F753 WeakPolarHBondContact CG-O 3.12Å; R719-F753 PolarHBondContact N-O 2.82Å; R719-I755 HydrophobicContact CB-CD1 4.09Å; R719-I755 HydrophobicContact CG-CD1 4.39Å; R719-I755 HydrophobicContact CG-CG1 4.45Å
720	H	94.2	Very high	93.9	Very high	83 Å²	83	52 Å²	52	38%	0.384	27%	0.272	S	S	.	.			trans	-69.9	132.2	175	-165.9	-79.9	0	0	0	110.6	G695 D722 K723	G695-H720 PolarHBondContact O-N 2.76Å; H720-D722 VanDerWaalsContact C-N 3.31Å; H720-D722 IonicContact CE1-OD2 3.97Å; H720-D722 PolarHBondContact CE1-OD2 2.91Å; H720-D722 VanDerWaalsContact CE1-OD2 3.27Å; H720-D722 PolarHBondContact ND1-N 2.75Å; H720-D722 VanDerWaalsContact ND1-N 3.17Å; H720-D722 IonicContact ND1-OD2 3.77Å; H720-D722 PolarHBondContact O-N 3.33Å; H720-K723 HydrophobicContact CB-CB 4.2Å; H720-K723 HydrophobicContact CB-CD 4.33Å; H720-K723 HydrophobicContact CB-CG 4.3Å; H720-K723 PolarHBondContact O-N 3.11Å
721	P	89.5	Confident	94.3	Very high	66 Å²	66	47.7 Å²	47.7	43%	0.429	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-39.5	-177.2	22	-33.2	0	0	0	113	K723 F753	P721-K723 VanDerWaalsContact C-N 3.32Å; P721-K723 PolarHBondContact O-N 2.98Å; P721-F753 HydrophobicContact CB-CD1 3.75Å; P721-F753 HydrophobicContact CB-CE1 3.52Å; P721-F753 HydrophobicContact CB-CG 4.38Å; P721-F753 HydrophobicContact CB-CZ 3.96Å
722	D	90.4	Very high	94.7	Very high	130 Å²	130	49.1 Å²	49.1	70%	0.695	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	5.6	-176.6	-50.9	-47.3	0	0	0	114.8	H720 P724	H720-D722 VanDerWaalsContact C-N 3.31Å; H720-D722 IonicContact CE1-OD2 3.97Å; H720-D722 PolarHBondContact CE1-OD2 2.91Å; H720-D722 VanDerWaalsContact CE1-OD2 3.27Å; H720-D722 PolarHBondContact ND1-N 2.75Å; H720-D722 VanDerWaalsContact ND1-N 3.17Å; H720-D722 IonicContact ND1-OD2 3.77Å; H720-D722 PolarHBondContact O-N 3.33Å; D722-P724 WeakPolarHBondContact O-CD 3.25Å
723	K	90.6	Very high	94.9	Very high	91 Å²	91	46.4 Å²	46.4	40%	0.396	24%	0.239	S	C	.	.			trans	-121.2	80.3	178	-64.7	-175.6	176.8	-178.4	0	109.6	S693 H720 P721 L725	S693-K723 PolarHBondContact O-NZ 2.91Å; H720-K723 HydrophobicContact CB-CB 4.2Å; H720-K723 HydrophobicContact CB-CD 4.33Å; H720-K723 HydrophobicContact CB-CG 4.3Å; H720-K723 PolarHBondContact O-N 3.11Å; P721-K723 VanDerWaalsContact C-N 3.32Å; P721-K723 PolarHBondContact O-N 2.98Å; K723-L725 PolarHBondContact O-N 2.73Å
724	P	89.5	Confident	94.9	Very high	62 Å²	62	45.7 Å²	45.7	40%	0.403	24%	0.236	S	C	.	.			trans	-68.4	128.5	178.3	30	-35.3	0	0	0	110.1	D722 Y776	D722-P724 WeakPolarHBondContact O-CD 3.25Å; P724-Y776 HydrophobicContact CB-CD2 3.84Å; P724-Y776 HydrophobicContact CB-CE2 4.48Å; P724-Y776 PolarHBondContact O-N 3.23Å; P724-Y776 VanDerWaalsContact O-N 3.1Å
725	L	92.2	Very high	94.8	Very high	15 Å²	15	44 Å²	44	8%	0.079	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.1	-177.2	-58	174.6	0	0	0	111.4	M694 L696 K723 I727 A773 P775 Y776	M694-L725 HydrophobicContact CB-CD1 4.11Å; M694-L725 HydrophobicContact CB-CD2 4.28Å; M694-L725 HydrophobicContact CG-CD2 4.47Å; M694-L725 WeakPolarHBondContact O-CD1 3.3Å; M694-L725 HydrophobicContact SD-CD2 4.47Å; L696-L725 HydrophobicContact CD1-CD1 4.06Å; L696-L725 HydrophobicContact CD2-CD1 3.83Å; L696-L725 HydrophobicContact CG-CD1 3.79Å; K723-L725 PolarHBondContact O-N 2.73Å; L725-I727 HydrophobicContact CB-CD1 4.08Å; L725-I727 HydrophobicContact CB-CG1 3.78Å; L725-I727 HydrophobicContact CD1-CD1 4.27Å; L725-A773 HydrophobicContact CD1-CB 4.31Å; L725-P775 HydrophobicContact CD2-CB 4.24Å; L725-P775 HydrophobicContact CD2-CG 3.9Å; L725-Y776 VanDerWaalsContact O-CE2 3.23Å; L725-Y776 WeakPolarHBondContact O-CE2 3.45Å
726	R	92.1	Very high	94.5	Very high	65 Å²	65	49 Å²	49	25%	0.245	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	124.8	157.2	-68.4	178.6	-75.3	160.9	-2.9	107.5	A773 L774 Y776 E778 G780 L783	R726-A773 CarbonylContact O-C 3.53Å; R726-A773 WeakPolarHBondContact O-CA 3.49Å; R726-L774 PolarHBondContact N-O 2.81Å; R726-L774 VanDerWaalsContact NH2-CD2 3.25Å; R726-L774 PolarHBondContact O-N 3.15Å; R726-Y776 HydrophobicContact CG-CD1 3.62Å; R726-Y776 HydrophobicContact CG-CD2 4.15Å; R726-Y776 HydrophobicContact CG-CE1 3.27Å; R726-Y776 HydrophobicContact CG-CE2 3.88Å; R726-Y776 HydrophobicContact CG-CG 4.05Å; R726-Y776 VanDerWaalsContact CG-CZ 3.41Å; R726-E778 PolarHBondContact NH2-O 3.5Å; R726-G780 PolarHBondContact NH1-O 3.22Å; R726-G780 PolarHBondContact NH2-O 2.92Å; R726-L783 HydrophobicContact CB-CD2 4.28Å; R726-L783 WeakPolarHBondContact O-CD2 3.49Å
727	I	93.9	Very high	94.2	Very high	15 Å²	15	49.6 Å²	49.6	8%	0.077	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134.8	-175.4	-58.5	-180	0	0	0	109.7	L696 L725 Q748 I755 F757 I771 Y772 A773	L696-I727 HydrophobicContact CD2-CD1 4.21Å; L725-I727 HydrophobicContact CB-CD1 4.08Å; L725-I727 HydrophobicContact CB-CG1 3.78Å; L725-I727 HydrophobicContact CD1-CD1 4.27Å; I727-Q748 PolarHBondContact O-NE2 2.93Å; I727-Q748 PolarHBondContact O-OE1 3.18Å; I727-I755 HydrophobicContact CD1-CD1 3.27Å; I727-I755 HydrophobicContact CD1-CG1 4.28Å; I727-F757 HydrophobicContact CG2-CZ 4.01Å; I727-I771 HydrophobicContact CG2-CG2 4.16Å; I727-Y772 WeakPolarHBondContact CA-O 3.39Å; I727-A773 HydrophobicContact CG1-CB 4.04Å
728	M	93.9	Very high	94.1	Very high	85 Å²	85	53.1 Å²	53.1	42%	0.419	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.7	171.7	-63.1	-155.5	-67.2	0	0	110.1	Y772 L783	M728-Y772 PolarHBondContact N-O 3.37Å; M728-Y772 PolarHBondContact O-N 3.4Å; M728-L783 HydrophobicContact CB-CD2 4.13Å; M728-L783 HydrophobicContact CE-CD1 3.92Å; M728-L783 HydrophobicContact CE-CD2 4.16Å; M728-L783 HydrophobicContact CE-CG 4.49Å; M728-L783 HydrophobicContact CG-CD2 3.78Å
729	A	97	Very high	94	Very high	15 Å²	15	56.5 Å²	56.5	12%	0.124	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.3	172.3	0	0	0	0	0	111.1	I746 F757 F769 Q770 I771	A729-I746 HydrophobicContact CB-CD1 4.17Å; A729-F757 HydrophobicContact CB-CD1 3.9Å; A729-F757 HydrophobicContact CB-CE1 3.51Å; A729-F757 HydrophobicContact CB-CZ 4.27Å; A729-F769 HydrophobicContact CB-CE2 3.58Å; A729-F769 HydrophobicContact CB-CZ 3.91Å; A729-Q770 CarbonylContact C-O 3.55Å; A729-Q770 WeakPolarHBondContact CA-O 3.46Å; A729-I771 HydrophobicContact CB-CG1 4.46Å
730	Q	97.7	Very high	94.1	Very high	75 Å²	75	57.7 Å²	57.7	35%	0.35	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	142.1	175.5	-70.1	-175.5	-31.5	0	0	109.9	S743 F769 Q770 Y772	Q730-S743 WeakPolarHBondContact CA-OG 3.42Å; Q730-F769 WeakPolarHBondContact O-CA 3.29Å; Q730-Q770 PolarHBondContact N-O 3.32Å; Q730-Q770 PolarHBondContact O-N 2.98Å; Q730-Y772 HydrophobicContact CB-CE2 4.25Å; Q730-Y772 HydrophobicContact CG-CE2 4.07Å; Q730-Y772 PolarHBondContact OE1-OH 3.11Å
731	L	98.2	Very high	94.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	118.5	173	-175.9	72.3	0	0	0	108.2	C742 S743 Q745 I746 I759 F767 K768 F769 L791	L731-C742 HydrophobicContact CB-CB 4.46Å; L731-C742 HydrophobicContact CD2-CB 3.9Å; L731-C742 HydrophobicContact CG-CB 4.17Å; L731-C742 CarbonylContact O-C 3.54Å; L731-C742 WeakPolarHBondContact O-CA 3.49Å; L731-C742 PolarHBondContact O-N 3.18Å; L731-S743 PolarHBondContact N-OG 3.2Å; L731-S743 VanDerWaalsContact N-OG 3.16Å; L731-S743 PolarHBondContact O-N 2.73Å; L731-Q745 HydrophobicContact CD2-CB 4.09Å; L731-I746 HydrophobicContact CB-CD1 3.57Å; L731-I746 HydrophobicContact CB-CG1 3.8Å; L731-I759 HydrophobicContact CD1-CG2 4.18Å; L731-I759 HydrophobicContact CD2-CG2 3.72Å; L731-F767 HydrophobicContact CD1-CB 3.74Å; L731-F767 HydrophobicContact CD1-CD1 4.19Å; L731-F767 HydrophobicContact CD1-CG 4.31Å; L731-F767 HydrophobicContact CD2-CD1 4.23Å; L731-F767 HydrophobicContact CG-CB 4.43Å; L731-F767 HydrophobicContact CG-CD1 4.01Å; L731-K768 WeakPolarHBondContact CA-O 3.23Å; L731-F769 HydrophobicContact CD1-CB 4.07Å; L731-F769 HydrophobicContact CD1-CD2 4.37Å; L731-L791 HydrophobicContact CD1-CD1 4Å
732	I	98	Very high	94.6	Very high	30 Å²	30	56.1 Å²	56.1	15%	0.154	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	115.6	-178.1	-57	176.2	0	0	0	108.4	C734 E740 F767 K768 Q770	I732-C734 PolarHBondContact O-N 3.5Å; I732-E740 CarbonylContact C-O 3.57Å; I732-E740 VanDerWaalsContact CA-O 3.31Å; I732-E740 WeakPolarHBondContact CA-O 3.47Å; I732-F767 CarbonylContact O-C 3.46Å; I732-F767 VanDerWaalsContact O-CA 3.23Å; I732-F767 WeakPolarHBondContact O-CA 3.48Å; I732-K768 HydrophobicContact CB-CB 4.38Å; I732-K768 PolarHBondContact N-O 3.43Å; I732-K768 PolarHBondContact O-N 2.89Å; I732-Q770 VanDerWaalsContact CD1-OE1 3.29Å
733	H	97.3	Very high	94.9	Very high	19 Å²	19	51.2 Å²	51.2	9%	0.088	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	128.9	166.7	171.3	-121.8	0	0	0	109.3	S735 V738 E740 H763 F766 F767	H733-S735 PolarHBondContact CD2-OG 2.97Å; H733-S735 VanDerWaalsContact NE2-CB 3.32Å; H733-S735 WeakPolarHBondContact NE2-CB 3.43Å; H733-S735 PolarHBondContact NE2-OG 2.96Å; H733-V738 VanDerWaalsContact O-O 3.13Å; H733-E740 HydrophobicContact CB-CB 4.19Å; H733-E740 PolarHBondContact N-O 3.32Å; H733-E740 IonicContact ND1-OE2 3.4Å; H733-E740 PolarHBondContact O-N 3.47Å; H733-E740 VanDerWaalsContact O-N 3.15Å; H733-H763 AromaticContact CD2-CE1 3.46Å; H733-H763 PolarHBondContact CD2-CE1 3.29Å; H733-H763 VanDerWaalsContact CD2-CE1 3.46Å; H733-H763 AromaticContact CE1-CE1 3.58Å; H733-H763 AromaticContact CG-CE1 3.43Å; H733-H763 VanDerWaalsContact CG-CE1 3.43Å; H733-H763 AromaticContact ND1-CE1 3.5Å; H733-H763 PolarHBondContact ND1-CE1 2.96Å; H733-H763 AromaticContact NE2-CE1 3.58Å; H733-F766 PolarHBondContact CD2-O 2.68Å; H733-F766 VanDerWaalsContact CD2-O 3.28Å; H733-F767 HydrophobicContact CB-CD1 3.77Å; H733-F767 HydrophobicContact CB-CE1 3.55Å; H733-F767 HydrophobicContact CB-CZ 4.21Å; H733-F767 AromaticContact CD2-CZ 3.9Å
734	C	96.9	Very high	95	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.02	28%	0.277	C	S	.	.			trans	-134.8	10.9	-166	66.8	0	0	0	0	115.6	P678 I732 H736 D737 V738 F766 K768	P678-C734 HydrophobicContact CB-CB 4.04Å; P678-C734 WeakPolarHBondContact CB-O 3.5Å; P678-C734 HydrophobicContact CG-CB 4.39Å; P678-C734 VanDerWaalsContact CG-SG 3.58Å; I732-C734 PolarHBondContact O-N 3.5Å; C734-H736 PolarHBondContact O-N 3Å; C734-D737 PolarHBondContact O-N 3.13Å; C734-D737 VanDerWaalsContact O-N 3.1Å; C734-V738 WeakPolarHBondContact CA-O 3.38Å; C734-F766 PolarHBondContact N-O 3.41Å; C734-F766 PolarHBondContact SG-O 3.28Å; C734-K768 HydrophobicContact CB-CD 4.18Å; C734-K768 HydrophobicContact CB-CG 4.2Å
735	S	95.5	Very high	95.3	Very high	10 Å²	10	50 Å²	50	7%	0.07	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-58.4	134.5	179.6	-49.1	0	0	0	0	110.9	G676 H733 D737 V738 G765 F766	G676-S735 CarbonylContact O-C 3.57Å; G676-S735 WeakPolarHBondContact O-CA 3.39Å; H733-S735 PolarHBondContact CD2-OG 2.97Å; H733-S735 VanDerWaalsContact NE2-CB 3.32Å; H733-S735 WeakPolarHBondContact NE2-CB 3.43Å; H733-S735 PolarHBondContact NE2-OG 2.96Å; S735-D737 PolarHBondContact O-N 2.92Å; S735-V738 VanDerWaalsContact O-CB 3.29Å; S735-V738 WeakPolarHBondContact O-CB 3.42Å; S735-V738 WeakPolarHBondContact O-CG2 3.48Å; S735-V738 PolarHBondContact O-N 3.36Å; S735-G765 VanDerWaalsContact OG-CA 3.27Å; S735-G765 WeakPolarHBondContact OG-CA 3.4Å; S735-F766 PolarHBondContact OG-N 3.31Å
736	H	92	Very high	95.6	Very high	107 Å²	107	49.6 Å²	49.6	50%	0.495	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	56.2	24.2	-177	-56.1	87.5	0	0	0	114.8	K617 R675 G676 C734 V738	K617-H736 PolarHBondContact NZ-O 2.97Å; R675-H736 PolarHBondContact O-CE1 2.66Å; R675-H736 VanDerWaalsContact O-CE1 3.29Å; G676-H736 WeakPolarHBondContact CA-NE2 3.44Å; G676-H736 PolarHBondContact O-N 3.36Å; C734-H736 PolarHBondContact O-N 3Å; H736-V738 PolarHBondContact O-N 2.97Å
737	D	92.4	Very high	95.8	Very high	72 Å²	72	46.5 Å²	46.5	39%	0.385	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	65.6	17.2	-172.2	-58.2	-51.6	0	0	0	114.5	K617 P678 T679 C734 S735	K617-D737 VanDerWaalsContact CE-OD2 3.24Å; K617-D737 WeakPolarHBondContact CE-OD2 3.38Å; K617-D737 IonicContact NZ-OD2 3.7Å; K617-D737 PolarHBondContact NZ-OD2 3.29Å; P678-D737 WeakPolarHBondContact CA-OD1 3.34Å; T679-D737 WeakPolarHBondContact CB-OD1 3.49Å; T679-D737 PolarHBondContact N-OD1 3.33Å; T679-D737 PolarHBondContact OG1-OD1 3.27Å; T679-D737 PolarHBondContact OG1-OD2 3.31Å; C734-D737 PolarHBondContact O-N 3.13Å; C734-D737 VanDerWaalsContact O-N 3.1Å; S735-D737 PolarHBondContact O-N 2.92Å
738	V	94.1	Very high	96	Very high	78 Å²	78	46.1 Å²	46.1	47%	0.473	25%	0.247	S	C	.	.			trans	-61.2	150.4	160.7	177.4	0	0	0	0	108.1	H733 C734 S735 H736	H733-V738 VanDerWaalsContact O-O 3.13Å; C734-V738 WeakPolarHBondContact CA-O 3.38Å; S735-V738 VanDerWaalsContact O-CB 3.29Å; S735-V738 WeakPolarHBondContact O-CB 3.42Å; S735-V738 WeakPolarHBondContact O-CG2 3.48Å; S735-V738 PolarHBondContact O-N 3.36Å; H736-V738 PolarHBondContact O-N 2.97Å
739	S	95.1	Very high	96.2	Very high	99 Å²	99	42.2 Å²	42.2	69%	0.692	23%	0.228	S	C	*	.			trans	-130.4	111.1	174.6	-176.4	0	0	0	0	109
740	E	96.6	Very high	96.1	Very high	91 Å²	91	42 Å²	42	43%	0.425	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.4	175.8	173	-171.9	176.5	0	0	108.8	I732 H733 C742 H763	I732-E740 CarbonylContact C-O 3.57Å; I732-E740 VanDerWaalsContact CA-O 3.31Å; I732-E740 WeakPolarHBondContact CA-O 3.47Å; H733-E740 HydrophobicContact CB-CB 4.19Å; H733-E740 PolarHBondContact N-O 3.32Å; H733-E740 IonicContact ND1-OE2 3.4Å; H733-E740 PolarHBondContact O-N 3.47Å; H733-E740 VanDerWaalsContact O-N 3.15Å; E740-C742 PolarHBondContact O-N 2.78Å; E740-H763 IonicContact OE2-NE2 2.85Å
741	D	97	Very high	95.8	Very high	108 Å²	108	41.8 Å²	41.8	58%	0.578	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	115.7	177.3	-170.4	-23.2	0	0	0	109.8	S743	D741-S743 WeakPolarHBondContact OD1-CB 3.47Å; D741-S743 PolarHBondContact OD1-N 3.28Å; D741-S743 PolarHBondContact OD1-OG 3.06Å
742	C	96.2	Very high	95.4	Very high	8 Å²	8	47.2 Å²	47.2	5%	0.054	25%	0.25	C	C	.	.			trans	-112.3	22.4	177.7	-55.5	0	0	0	0	111.7	L731 E740 Q744 Q745	L731-C742 HydrophobicContact CB-CB 4.46Å; L731-C742 HydrophobicContact CD2-CB 3.9Å; L731-C742 HydrophobicContact CG-CB 4.17Å; L731-C742 CarbonylContact O-C 3.54Å; L731-C742 WeakPolarHBondContact O-CA 3.49Å; L731-C742 PolarHBondContact O-N 3.18Å; E740-C742 PolarHBondContact O-N 2.78Å; C742-Q744 PolarHBondContact O-N 3.23Å; C742-Q745 HydrophobicContact CB-CG 4.27Å; C742-Q745 WeakPolarHBondContact O-CB 3.31Å; C742-Q745 WeakPolarHBondContact O-CG 3.39Å; C742-Q745 PolarHBondContact O-N 3.46Å
743	S	96.4	Very high	95.1	Very high	27 Å²	27	51.1 Å²	51.1	19%	0.189	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-62.8	-20.5	-172.2	-57.8	0	0	0	0	113.8	Q730 L731 D741 Q745 I746	Q730-S743 WeakPolarHBondContact CA-OG 3.42Å; L731-S743 PolarHBondContact N-OG 3.2Å; L731-S743 VanDerWaalsContact N-OG 3.16Å; L731-S743 PolarHBondContact O-N 2.73Å; D741-S743 WeakPolarHBondContact OD1-CB 3.47Å; D741-S743 PolarHBondContact OD1-N 3.28Å; D741-S743 PolarHBondContact OD1-OG 3.06Å; S743-Q745 PolarHBondContact O-N 3.24Å; S743-Q745 VanDerWaalsContact O-N 3.12Å; S743-I746 PolarHBondContact O-N 2.93Å; S743-I746 VanDerWaalsContact O-N 3.08Å
744	Q	93.9	Very high	95.1	Very high	105 Å²	105	53.1 Å²	53.1	49%	0.491	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-64.2	-10.6	170.4	-57.1	-61.5	-11	0	0	113.6	C742 F807	C742-Q744 PolarHBondContact O-N 3.23Å; Q744-F807 PolarHBondContact O-N 3Å
745	Q	95.8	Very high	95.1	Very high	23 Å²	23	53.1 Å²	53.1	11%	0.107	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-94.7	6.7	175.6	-53.5	-65.1	-14.8	0	0	113.3	L731 C742 S743 I759 R760 M805 F807	L731-Q745 HydrophobicContact CD2-CB 4.09Å; C742-Q745 HydrophobicContact CB-CG 4.27Å; C742-Q745 WeakPolarHBondContact O-CB 3.31Å; C742-Q745 WeakPolarHBondContact O-CG 3.39Å; C742-Q745 PolarHBondContact O-N 3.46Å; S743-Q745 PolarHBondContact O-N 3.24Å; S743-Q745 VanDerWaalsContact O-N 3.12Å; Q745-I759 WeakPolarHBondContact O-CA 3.42Å; Q745-R760 WeakPolarHBondContact CB-O 3.41Å; Q745-R760 PolarHBondContact O-N 2.95Å; Q745-M805 PolarHBondContact OE1-O 3.24Å; Q745-F807 WeakPolarHBondContact O-CD2 3.41Å; Q745-F807 VanDerWaalsContact O-CE2 3.24Å; Q745-F807 WeakPolarHBondContact O-CE2 3.39Å
746	I	97.4	Very high	95.2	Very high	7 Å²	7	54.4 Å²	54.4	4%	0.036	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.8	173.1	-55.7	162.4	0	0	0	108.8	A729 L731 S743 F757 V758 I759 F769 Q810	A729-I746 HydrophobicContact CB-CD1 4.17Å; L731-I746 HydrophobicContact CB-CD1 3.57Å; L731-I746 HydrophobicContact CB-CG1 3.8Å; S743-I746 PolarHBondContact O-N 2.93Å; S743-I746 VanDerWaalsContact O-N 3.08Å; I746-F757 HydrophobicContact CG2-CB 4.47Å; I746-F757 HydrophobicContact CG2-CD1 4.02Å; I746-V758 CarbonylContact C-O 3.54Å; I746-V758 WeakPolarHBondContact CA-O 3.2Å; I746-I759 HydrophobicContact CG1-CG1 4.46Å; I746-F769 HydrophobicContact CD1-CD2 4.06Å; I746-F769 HydrophobicContact CD1-CE2 3.82Å; I746-F769 HydrophobicContact CG1-CE2 4.25Å; I746-F769 HydrophobicContact CG2-CE2 4.41Å; I746-Q810 PolarHBondContact O-NE2 3.43Å
747	L	97.4	Very high	95.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	114.2	158.8	179	68.1	0	0	0	109.1	F757 V758 F807 Q810 W814 L820 M824	L747-F757 WeakPolarHBondContact O-CA 3.21Å; L747-V758 HydrophobicContact CB-CB 4.29Å; L747-V758 PolarHBondContact N-O 3.08Å; L747-V758 PolarHBondContact O-N 2.81Å; L747-F807 HydrophobicContact CB-CB 4.12Å; L747-F807 HydrophobicContact CB-CD1 3.62Å; L747-F807 HydrophobicContact CB-CD2 3.77Å; L747-F807 HydrophobicContact CB-CE1 3.91Å; L747-F807 HydrophobicContact CB-CE2 4.02Å; L747-F807 HydrophobicContact CB-CG 3.56Å; L747-F807 HydrophobicContact CB-CZ 4.09Å; L747-F807 HydrophobicContact CD2-CD1 4.02Å; L747-F807 HydrophobicContact CD2-CE1 4.16Å; L747-F807 HydrophobicContact CG-CD1 4.33Å; L747-Q810 HydrophobicContact CD1-CG 4.27Å; L747-W814 HydrophobicContact CD1-CZ2 4.3Å; L747-L820 HydrophobicContact CD1-CD2 4.42Å; L747-L820 HydrophobicContact CD2-CB 4.36Å; L747-L820 HydrophobicContact CD2-CD2 4.22Å; L747-M824 HydrophobicContact CD2-CE 3.17Å; L747-M824 HydrophobicContact CD2-SD 3.76Å
748	Q	97.7	Very high	95.7	Very high	7 Å²	7	46.4 Å²	46.4	3%	0.033	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	122.9	173	177.2	-179	-31.3	0	0	108.7	I727 I755 F757 Q810 W814	I727-Q748 PolarHBondContact O-NE2 2.93Å; I727-Q748 PolarHBondContact O-OE1 3.18Å; Q748-I755 HydrophobicContact CG-CG2 4.45Å; Q748-F757 HydrophobicContact CB-CD1 4Å; Q748-F757 HydrophobicContact CB-CE1 3.98Å; Q748-F757 HydrophobicContact CG-CD1 4.04Å; Q748-F757 HydrophobicContact CG-CE1 3.59Å; Q748-F757 HydrophobicContact CG-CZ 4.36Å; Q748-Q810 PolarHBondContact O-OE1 2.84Å; Q748-W814 PolarHBondContact O-NE1 3.35Å
749	Q	96.9	Very high	95.9	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.014	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.3	178.7	58.7	-172.9	-10.2	0	0	111	Y756 W814 C818 Y819 L820	Q749-Y756 PolarHBondContact N-O 2.72Å; Q749-Y756 PolarHBondContact O-N 2.75Å; Q749-W814 HydrophobicContact CB-CZ2 4.27Å; Q749-C818 WeakPolarHBondContact CA-O 3.41Å; Q749-C818 WeakPolarHBondContact CB-O 3.19Å; Q749-Y819 HydrophobicContact CB-CD2 4.14Å; Q749-Y819 HydrophobicContact CG-CD2 3.77Å; Q749-Y819 HydrophobicContact CG-CE2 3.91Å; Q749-Y819 HydrophobicContact CG-CG 4.48Å; Q749-L820 PolarHBondContact OE1-O 2.68Å
750	T	94.8	Very high	95.9	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.055	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	137.8	-173.7	-62.8	0	0	0	0	110	Q754 I755 G817 C818	T750-Q754 CarbonylContact C-O 3.47Å; T750-Q754 VanDerWaalsContact CA-O 3.24Å; T750-Q754 WeakPolarHBondContact CA-O 3.21Å; T750-Q754 WeakPolarHBondContact CG2-O 3.18Å; T750-I755 HydrophobicContact CG2-CG1 4.47Å; T750-G817 CarbonylContact O-C 3.55Å; T750-G817 VanDerWaalsContact O-C 3.32Å; T750-C818 PolarHBondContact N-O 3.18Å; T750-C818 CarbonylContact O-C 3.43Å
751	R	92.5	Very high	95.8	Very high	71 Å²	71	34.4 Å²	34.4	27%	0.268	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	138.6	176.6	-173.5	-175	171.3	140.3	16.1	109.5	F753 Q754 Y756 Y819 H821 D869	R751-F753 VanDerWaalsContact C-N 3.31Å; R751-F753 PolarHBondContact O-N 3.01Å; R751-Q754 PolarHBondContact N-O 3.3Å; R751-Q754 WeakPolarHBondContact O-CA 3.18Å; R751-Q754 WeakPolarHBondContact O-CB 3.45Å; R751-Q754 PolarHBondContact O-N 2.75Å; R751-Q754 VanDerWaalsContact O-O 3.13Å; R751-Y756 HydrophobicContact CB-CE2 4.24Å; R751-Y819 HydrophobicContact CB-CD2 3.73Å; R751-Y819 HydrophobicContact CB-CE2 4.37Å; R751-Y819 HydrophobicContact CB-CG 4.3Å; R751-H821 PolarHBondContact NH1-CE1 2.99Å; R751-D869 IonicContact CZ-OD2 3.24Å; R751-D869 IonicContact NH1-OD2 3.26Å; R751-D869 IonicContact NH2-OD2 3.19Å; R751-D869 PolarHBondContact NH2-OD2 3.08Å
752	D	90.1	Very high	95.6	Very high	115 Å²	115	30.3 Å²	30.3	62%	0.615	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	46.7	173.3	-55	-37.6	0	0	0	113.6	Q754	D752-Q754 PolarHBondContact O-N 3.46Å; D752-Q754 VanDerWaalsContact O-N 3.16Å
753	F	92	Very high	95.4	Very high	111 Å²	111	32.4 Å²	32.4	49%	0.487	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	21.3	-176.6	-46.7	-73.9	0	0	0	115.2	R719 P721 R751	R719-F753 HydrophobicContact CG-CB 4.32Å; R719-F753 VanDerWaalsContact CG-O 3.22Å; R719-F753 WeakPolarHBondContact CG-O 3.12Å; R719-F753 PolarHBondContact N-O 2.82Å; P721-F753 HydrophobicContact CB-CD1 3.75Å; P721-F753 HydrophobicContact CB-CE1 3.52Å; P721-F753 HydrophobicContact CB-CG 4.38Å; P721-F753 HydrophobicContact CB-CZ 3.96Å; R751-F753 VanDerWaalsContact C-N 3.31Å; R751-F753 PolarHBondContact O-N 3.01Å
754	Q	95.9	Very high	95.3	Very high	61 Å²	61	34.1 Å²	34.1	29%	0.285	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.5	171	-60	-175	27.9	0	0	110.8	L699 F717 T750 R751 D752 Y756	L699-Q754 HydrophobicContact CD1-CG 4Å; F717-Q754 CarbonylContact O-C 3.45Å; F717-Q754 VanDerWaalsContact O-CA 3.25Å; F717-Q754 WeakPolarHBondContact O-CA 3.46Å; T750-Q754 CarbonylContact C-O 3.47Å; T750-Q754 VanDerWaalsContact CA-O 3.24Å; T750-Q754 WeakPolarHBondContact CA-O 3.21Å; T750-Q754 WeakPolarHBondContact CG2-O 3.18Å; R751-Q754 PolarHBondContact N-O 3.3Å; R751-Q754 WeakPolarHBondContact O-CA 3.18Å; R751-Q754 WeakPolarHBondContact O-CB 3.45Å; R751-Q754 PolarHBondContact O-N 2.75Å; R751-Q754 VanDerWaalsContact O-O 3.13Å; D752-Q754 PolarHBondContact O-N 3.46Å; D752-Q754 VanDerWaalsContact O-N 3.16Å; Q754-Y756 HydrophobicContact CB-CE2 3.75Å; Q754-Y756 PolarHBondContact OE1-OH 3.41Å
755	I	96.8	Very high	95.4	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.015	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.2	177.1	-54.3	150.7	0	0	0	106.9	L696 Q716 F717 R719 I727 Q748 T750 F757	L696-I755 HydrophobicContact CD2-CD1 3.82Å; Q716-I755 VanDerWaalsContact CA-O 3.31Å; Q716-I755 WeakPolarHBondContact CA-O 3.42Å; F717-I755 HydrophobicContact CB-CB 4.38Å; F717-I755 HydrophobicContact CB-CD1 4.37Å; F717-I755 PolarHBondContact N-O 2.88Å; F717-I755 PolarHBondContact O-N 2.84Å; R719-I755 HydrophobicContact CB-CD1 4.09Å; R719-I755 HydrophobicContact CG-CD1 4.39Å; R719-I755 HydrophobicContact CG-CG1 4.45Å; I727-I755 HydrophobicContact CD1-CD1 3.27Å; I727-I755 HydrophobicContact CD1-CG1 4.28Å; Q748-I755 HydrophobicContact CG-CG2 4.45Å; T750-I755 HydrophobicContact CG2-CG1 4.47Å; I755-F757 HydrophobicContact CB-CE2 4.47Å; I755-F757 HydrophobicContact CG2-CD2 4.17Å; I755-F757 HydrophobicContact CG2-CE1 4.32Å; I755-F757 HydrophobicContact CG2-CE2 3.58Å; I755-F757 HydrophobicContact CG2-CZ 3.68Å
756	Y	97.9	Very high	95.4	Very high	37 Å²	37	28.1 Å²	28.1	15%	0.145	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	125	178.5	-56.9	-102.9	0	0	0	108	Q716 Q749 R751 Q754 Y819	Q716-Y756 HydrophobicContact CG-CD1 3.72Å; Q716-Y756 HydrophobicContact CG-CE1 3.98Å; Q749-Y756 PolarHBondContact N-O 2.72Å; Q749-Y756 PolarHBondContact O-N 2.75Å; R751-Y756 HydrophobicContact CB-CE2 4.24Å; Q754-Y756 HydrophobicContact CB-CE2 3.75Å; Q754-Y756 PolarHBondContact OE1-OH 3.41Å; Y756-Y819 HydrophobicContact CD2-CD2 4.36Å; Y756-Y819 AromaticContact CD2-CE2 3.91Å; Y756-Y819 HydrophobicContact CD2-CE2 3.91Å; Y756-Y819 HydrophobicContact CE2-CE2 4.15Å; Y756-Y819 HydrophobicContact CG-CE2 4.22Å
757	F	98	Very high	95.5	Very high	1 Å²	1	27.8 Å²	27.8	0%	0.004	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	106.1	167.9	-61.2	-80.7	0	0	0	107.7	C714 I715 F717 I727 A729 I746 L747 Q748 I755 F769 I771	C714-F757 CarbonylContact C-O 3.56Å; C714-F757 WeakPolarHBondContact CA-O 3.32Å; I715-F757 HydrophobicContact CB-CB 4.43Å; I715-F757 PolarHBondContact N-O 2.87Å; I715-F757 PolarHBondContact O-N 3.41Å; F717-F757 HydrophobicContact CD2-CD2 4.11Å; F717-F757 AromaticContact CD2-CE2 3.93Å; F717-F757 HydrophobicContact CD2-CE2 3.93Å; F717-F757 HydrophobicContact CE2-CD2 4.42Å; F717-F757 HydrophobicContact CE2-CE2 4.34Å; I727-F757 HydrophobicContact CG2-CZ 4.01Å; A729-F757 HydrophobicContact CB-CD1 3.9Å; A729-F757 HydrophobicContact CB-CE1 3.51Å; A729-F757 HydrophobicContact CB-CZ 4.27Å; I746-F757 HydrophobicContact CG2-CB 4.47Å; I746-F757 HydrophobicContact CG2-CD1 4.02Å; L747-F757 WeakPolarHBondContact O-CA 3.21Å; Q748-F757 HydrophobicContact CB-CD1 4Å; Q748-F757 HydrophobicContact CB-CE1 3.98Å; Q748-F757 HydrophobicContact CG-CD1 4.04Å; Q748-F757 HydrophobicContact CG-CE1 3.59Å; Q748-F757 HydrophobicContact CG-CZ 4.36Å; I755-F757 HydrophobicContact CB-CE2 4.47Å; I755-F757 HydrophobicContact CG2-CD2 4.17Å; I755-F757 HydrophobicContact CG2-CE1 4.32Å; I755-F757 HydrophobicContact CG2-CE2 3.58Å; I755-F757 HydrophobicContact CG2-CZ 3.68Å; F757-F769 HydrophobicContact CB-CE1 4.39Å; F757-F769 HydrophobicContact CB-CE2 4.42Å; F757-F769 HydrophobicContact CB-CZ 3.69Å; F757-F769 HydrophobicContact CD1-CE2 4.36Å; F757-F769 AromaticContact CD1-CZ 3.81Å; F757-F769 HydrophobicContact CD1-CZ 3.81Å; F757-F769 HydrophobicContact CD2-CE1 4.4Å; F757-F769 AromaticContact CD2-CZ 3.95Å; F757-F769 HydrophobicContact CD2-CZ 3.95Å; F757-F769 HydrophobicContact CE1-CZ 4.38Å; F757-F769 HydrophobicContact CG-CE1 4.36Å; F757-F769 HydrophobicContact CG-CE2 4.43Å; F757-F769 AromaticContact CG-CZ 3.55Å; F757-F769 HydrophobicContact CG-CZ 3.55Å; F757-I771 HydrophobicContact CD2-CD1 4.38Å; F757-I771 HydrophobicContact CE2-CD1 3.88Å; F757-I771 HydrophobicContact CE2-CG1 4.33Å; F757-I771 HydrophobicContact CZ-CD1 4.37Å; F757-I771 HydrophobicContact CZ-CG1 4.34Å; F757-I771 HydrophobicContact CZ-CG2 4.29Å
758	V	97.4	Very high	95.5	Very high	10 Å²	10	29.8 Å²	29.8	6%	0.061	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.9	172.3	-166.8	0	0	0	0	107.3	E712 L713 I746 L747 F807	E712-V758 HydrophobicContact CG-CG1 3.87Å; L713-V758 CarbonylContact O-C 3.57Å; L713-V758 WeakPolarHBondContact O-CA 3.45Å; I746-V758 CarbonylContact C-O 3.54Å; I746-V758 WeakPolarHBondContact CA-O 3.2Å; L747-V758 HydrophobicContact CB-CB 4.29Å; L747-V758 PolarHBondContact N-O 3.08Å; L747-V758 PolarHBondContact O-N 2.81Å; V758-F807 HydrophobicContact CB-CZ 3.98Å; V758-F807 HydrophobicContact CG1-CE1 4.41Å; V758-F807 HydrophobicContact CG1-CZ 3.7Å; V758-F807 VanDerWaalsContact O-CE2 3.25Å; V758-F807 WeakPolarHBondContact O-CE2 3.38Å
759	I	97.7	Very high	95.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.8	-171.9	-57.1	175.6	0	0	0	108.4	E712 L713 I715 L731 Q745 I746 F761 F769 L791	E712-I759 CarbonylContact C-O 3.6Å; E712-I759 VanDerWaalsContact CA-O 3.23Å; E712-I759 WeakPolarHBondContact CA-O 3.42Å; E712-I759 WeakPolarHBondContact CG-O 3.16Å; L713-I759 HydrophobicContact CB-CB 4.48Å; L713-I759 PolarHBondContact N-O 2.86Å; L713-I759 PolarHBondContact O-N 2.97Å; I715-I759 HydrophobicContact CD1-CD1 3.9Å; I715-I759 HydrophobicContact CG1-CD1 4.46Å; L731-I759 HydrophobicContact CD1-CG2 4.18Å; L731-I759 HydrophobicContact CD2-CG2 3.72Å; Q745-I759 WeakPolarHBondContact O-CA 3.42Å; I746-I759 HydrophobicContact CG1-CG1 4.46Å; I759-F761 HydrophobicContact CG2-CD1 4.47Å; I759-F761 HydrophobicContact CG2-CE1 3.98Å; I759-F761 HydrophobicContact CG2-CE2 4.37Å; I759-F761 HydrophobicContact CG2-CZ 3.92Å; I759-F769 HydrophobicContact CD1-CD1 4.07Å; I759-F769 HydrophobicContact CD1-CD2 3.72Å; I759-F769 HydrophobicContact CD1-CE1 4.19Å; I759-F769 HydrophobicContact CD1-CE2 3.83Å; I759-F769 HydrophobicContact CD1-CG 3.85Å; I759-F769 HydrophobicContact CD1-CZ 4.09Å; I759-F769 HydrophobicContact CG1-CE2 4.49Å; I759-L791 HydrophobicContact CD1-CD1 3.89Å
760	R	95.7	Very high	95.6	Very high	17 Å²	17	30.4 Å²	30.4	6%	0.064	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.8	171.2	-69.6	176.8	176	176.3	-3	110	E712 Q745 N797 M805 F807 D825	E712-R760 HydrophobicContact CG-CG 4.11Å; E712-R760 WeakPolarHBondContact OE2-CG 3.48Å; E712-R760 IonicContact OE2-CZ 2.75Å; E712-R760 IonicContact OE2-NE 2.81Å; E712-R760 PolarHBondContact OE2-NE 3.44Å; E712-R760 IonicContact OE2-NH2 3.28Å; Q745-R760 WeakPolarHBondContact CB-O 3.41Å; Q745-R760 PolarHBondContact O-N 2.95Å; R760-N797 HydrophobicContact CB-CB 4.08Å; R760-N797 HydrophobicContact CG-CB 4.19Å; R760-N797 WeakPolarHBondContact CG-ND2 3.5Å; R760-N797 PolarHBondContact NE-ND2 3.04Å; R760-M805 WeakPolarHBondContact CD-O 3.36Å; R760-M805 PolarHBondContact NH1-O 2.88Å; R760-M805 VanDerWaalsContact NH1-O 3.09Å; R760-F807 HydrophobicContact CB-CE2 4.22Å; R760-F807 HydrophobicContact CG-CE2 3.63Å; R760-F807 HydrophobicContact CG-CZ 3.61Å; R760-F807 VanDerWaalsContact NE-CZ 3.33Å; R760-D825 IonicContact CZ-OD1 2.74Å; R760-D825 VanDerWaalsContact CZ-OD1 3.28Å; R760-D825 IonicContact NH1-OD1 2.71Å; R760-D825 PolarHBondContact NH1-OD1 2.86Å; R760-D825 IonicContact NH2-OD1 3.15Å; R760-D825 PolarHBondContact NH2-OD1 2.54Å
761	F	95.2	Very high	95.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.146	C	C	.	.			trans	-95.8	123.1	179.7	-60.5	-78.1	0	0	0	110.6	A708 G711 L713 I759 H763 F767 L791 A793 V796 N797	A708-F761 HydrophobicContact CB-CD2 4.05Å; A708-F761 HydrophobicContact CB-CE2 3.25Å; A708-F761 HydrophobicContact CB-CZ 3.57Å; G711-F761 WeakPolarHBondContact O-CD2 3.45Å; G711-F761 PolarHBondContact O-N 3.47Å; L713-F761 HydrophobicContact CB-CE2 3.81Å; L713-F761 HydrophobicContact CB-CZ 4.13Å; L713-F761 HydrophobicContact CD2-CZ 4.24Å; I759-F761 HydrophobicContact CG2-CD1 4.47Å; I759-F761 HydrophobicContact CG2-CE1 3.98Å; I759-F761 HydrophobicContact CG2-CE2 4.37Å; I759-F761 HydrophobicContact CG2-CZ 3.92Å; F761-H763 VanDerWaalsContact C-N 3.35Å; F761-F767 HydrophobicContact CD1-CD1 4.47Å; F761-F767 AromaticContact CD1-CD2 3.73Å; F761-F767 HydrophobicContact CD1-CD2 3.73Å; F761-F767 HydrophobicContact CD1-CE1 4.48Å; F761-F767 AromaticContact CD1-CE2 3.79Å; F761-F767 HydrophobicContact CD1-CE2 3.79Å; F761-F767 HydrophobicContact CD1-CG 4.12Å; F761-F767 HydrophobicContact CD1-CZ 4.17Å; F761-F767 HydrophobicContact CE1-CD2 4.02Å; F761-F767 HydrophobicContact CE1-CG 4.23Å; F761-L791 HydrophobicContact CE1-CB 4.1Å; F761-L791 HydrophobicContact CE1-CD1 3.87Å; F761-L791 HydrophobicContact CZ-CB 4.24Å; F761-L791 HydrophobicContact CZ-CD1 3.88Å; F761-A793 HydrophobicContact CB-CB 3.73Å; F761-A793 HydrophobicContact CD1-CB 3.39Å; F761-A793 HydrophobicContact CD2-CB 3.86Å; F761-A793 HydrophobicContact CE1-CB 3.9Å; F761-A793 HydrophobicContact CE2-CB 4.36Å; F761-A793 HydrophobicContact CG-CB 3.35Å; F761-A793 HydrophobicContact CZ-CB 4.35Å; F761-V796 WeakPolarHBondContact O-CG1 3.39Å; F761-N797 PolarHBondContact O-N 3.38Å; F761-N797 VanDerWaalsContact O-N 3.11Å
762	P	92.5	Very high	95.8	Very high	21 Å²	21	28.7 Å²	28.7	14%	0.136	14%	0.141	C	C	.	.	S	Bend	trans	-74.5	-25.1	-178.6	29.2	-34.8	0	0	0	113.3	F767 V796 V804	P762-F767 HydrophobicContact CG-CE1 4.08Å; P762-F767 HydrophobicContact CG-CZ 4.22Å; P762-V796 WeakPolarHBondContact O-CG1 3.37Å; P762-V804 HydrophobicContact CB-CG1 3.8Å; P762-V804 HydrophobicContact CB-CG2 4.18Å; P762-V804 VanDerWaalsContact O-CG2 3.24Å; P762-V804 WeakPolarHBondContact O-CG2 3.34Å
763	H	90.9	Very high	96	Very high	53 Å²	53	23.2 Å²	23.2	25%	0.245	11%	0.112	C	C	.	.	S	Bend	trans	-160	166.4	175	49	73.5	0	0	0	109.3	H733 E740 F761 F767	H733-H763 AromaticContact CD2-CE1 3.46Å; H733-H763 PolarHBondContact CD2-CE1 3.29Å; H733-H763 VanDerWaalsContact CD2-CE1 3.46Å; H733-H763 AromaticContact CE1-CE1 3.58Å; H733-H763 AromaticContact CG-CE1 3.43Å; H733-H763 VanDerWaalsContact CG-CE1 3.43Å; H733-H763 AromaticContact ND1-CE1 3.5Å; H733-H763 PolarHBondContact ND1-CE1 2.96Å; H733-H763 AromaticContact NE2-CE1 3.58Å; E740-H763 IonicContact OE2-NE2 2.85Å; F761-H763 VanDerWaalsContact C-N 3.35Å; H763-F767 AromaticContact CE1-CZ 3.82Å; H763-F767 WeakPolarHBondContact O-CZ 3.48Å
764	P	94	Very high	96.1	Very high	62 Å²	62	18.4 Å²	18.4	40%	0.403	9%	0.091	S	C	.	.	S	Bend	trans	-64.7	150.2	173.1	-18.2	34.5	0	0	0	110.8	V674 A793 V796	V674-P764 HydrophobicContact CG2-CB 4.28Å; P764-A793 CarbonylContact C-O 3.55Å; P764-A793 WeakPolarHBondContact CA-O 3.2Å; P764-A793 WeakPolarHBondContact CB-O 3.37Å; P764-V796 VanDerWaalsContact CD-CG2 3.45Å; P764-V796 HydrophobicContact CG-CG2 3.93Å
765	G	96.1	Very high	96	Very high	3 Å²	3	16.5 Å²	16.5	3%	0.031	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.4	179.6	-175.9	0	0	0	0	0	113.8	S735 A793	S735-G765 VanDerWaalsContact OG-CA 3.27Å; S735-G765 WeakPolarHBondContact OG-CA 3.4Å; G765-A793 PolarHBondContact N-O 3.32Å; G765-A793 PolarHBondContact O-N 2.9Å
766	F	97.6	Very high	95.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	138	168.2	-67.9	-70.9	0	0	0	110.7	F635 V674 G676 L677 F705 H733 C734 S735 L790 L791 E792	F635-F766 HydrophobicContact CD1-CZ 4Å; F635-F766 HydrophobicContact CD2-CZ 4.2Å; F635-F766 HydrophobicContact CE1-CE1 4.24Å; F635-F766 HydrophobicContact CE1-CZ 4.09Å; F635-F766 HydrophobicContact CE2-CE1 4.4Å; F635-F766 HydrophobicContact CE2-CZ 4.26Å; F635-F766 HydrophobicContact CG-CZ 4.07Å; F635-F766 HydrophobicContact CZ-CE1 4.14Å; F635-F766 HydrophobicContact CZ-CZ 4.22Å; V674-F766 HydrophobicContact CG1-CD2 3.81Å; V674-F766 HydrophobicContact CG1-CE1 4.37Å; V674-F766 HydrophobicContact CG1-CE2 3.64Å; V674-F766 HydrophobicContact CG1-CG 4.27Å; V674-F766 HydrophobicContact CG1-CZ 3.93Å; G676-F766 WeakPolarHBondContact O-CD2 3.48Å; L677-F766 HydrophobicContact CD2-CD1 3.91Å; L677-F766 HydrophobicContact CD2-CD2 4.29Å; L677-F766 HydrophobicContact CD2-CE1 3.48Å; L677-F766 VanDerWaalsContact CD2-CE1 3.48Å; L677-F766 HydrophobicContact CD2-CE2 3.89Å; L677-F766 HydrophobicContact CD2-CG 4.29Å; L677-F766 HydrophobicContact CD2-CZ 3.47Å; L677-F766 VanDerWaalsContact CD2-CZ 3.47Å; L677-F766 HydrophobicContact CG-CE1 4.38Å; L677-F766 HydrophobicContact CG-CE2 3.98Å; L677-F766 HydrophobicContact CG-CZ 3.86Å; F705-F766 HydrophobicContact CE2-CE1 4.29Å; H733-F766 PolarHBondContact CD2-O 2.68Å; H733-F766 VanDerWaalsContact CD2-O 3.28Å; C734-F766 PolarHBondContact N-O 3.41Å; C734-F766 PolarHBondContact SG-O 3.28Å; S735-F766 PolarHBondContact OG-N 3.31Å; F766-L790 HydrophobicContact CB-CD1 4.14Å; F766-L790 HydrophobicContact CD1-CD1 4.5Å; F766-L790 HydrophobicContact CD1-CD2 4.38Å; F766-L790 HydrophobicContact CD1-CG 4.43Å; F766-L791 CarbonylContact C-O 3.56Å; F766-L791 VanDerWaalsContact CA-O 3.27Å; F766-L791 WeakPolarHBondContact CA-O 3.4Å; F766-E792 HydrophobicContact CD1-CB 4.12Å; F766-E792 HydrophobicContact CD1-CG 4.43Å; F766-E792 HydrophobicContact CE1-CB 3.87Å; F766-E792 HydrophobicContact CE1-CG 3.9Å
767	F	98	Very high	95.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132	179.2	-62.1	-104.7	0	0	0	110.8	L731 I732 H733 F761 P762 H763 L790 L791 A793	L731-F767 HydrophobicContact CD1-CB 3.74Å; L731-F767 HydrophobicContact CD1-CD1 4.19Å; L731-F767 HydrophobicContact CD1-CG 4.31Å; L731-F767 HydrophobicContact CD2-CD1 4.23Å; L731-F767 HydrophobicContact CG-CB 4.43Å; L731-F767 HydrophobicContact CG-CD1 4.01Å; I732-F767 CarbonylContact O-C 3.46Å; I732-F767 VanDerWaalsContact O-CA 3.23Å; I732-F767 WeakPolarHBondContact O-CA 3.48Å; H733-F767 HydrophobicContact CB-CD1 3.77Å; H733-F767 HydrophobicContact CB-CE1 3.55Å; H733-F767 HydrophobicContact CB-CZ 4.21Å; H733-F767 AromaticContact CD2-CZ 3.9Å; F761-F767 HydrophobicContact CD1-CD1 4.47Å; F761-F767 AromaticContact CD1-CD2 3.73Å; F761-F767 HydrophobicContact CD1-CD2 3.73Å; F761-F767 HydrophobicContact CD1-CE1 4.48Å; F761-F767 AromaticContact CD1-CE2 3.79Å; F761-F767 HydrophobicContact CD1-CE2 3.79Å; F761-F767 HydrophobicContact CD1-CG 4.12Å; F761-F767 HydrophobicContact CD1-CZ 4.17Å; F761-F767 HydrophobicContact CE1-CD2 4.02Å; F761-F767 HydrophobicContact CE1-CG 4.23Å; P762-F767 HydrophobicContact CG-CE1 4.08Å; P762-F767 HydrophobicContact CG-CZ 4.22Å; H763-F767 AromaticContact CE1-CZ 3.82Å; H763-F767 WeakPolarHBondContact O-CZ 3.48Å; F767-L790 CarbonylContact O-C 3.5Å; F767-L790 WeakPolarHBondContact O-CA 3.46Å; F767-L791 HydrophobicContact CB-CB 4.26Å; F767-L791 PolarHBondContact N-O 3.16Å; F767-L791 PolarHBondContact O-N 3.49Å; F767-A793 HydrophobicContact CD2-CB 4.12Å; F767-A793 HydrophobicContact CE2-CB 3.84Å
768	K	97.8	Very high	94.8	Very high	42 Å²	42	28.6 Å²	28.6	18%	0.183	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	120.7	166.3	-72.3	168.3	-175.2	178	0	107.6	Y684 L731 I732 C734 Q770 Y789	Y684-K768 HydrophobicContact CE1-CG 4.5Å; L731-K768 WeakPolarHBondContact CA-O 3.23Å; I732-K768 HydrophobicContact CB-CB 4.38Å; I732-K768 PolarHBondContact N-O 3.43Å; I732-K768 PolarHBondContact O-N 2.89Å; C734-K768 HydrophobicContact CB-CD 4.18Å; C734-K768 HydrophobicContact CB-CG 4.2Å; K768-Q770 HydrophobicContact CB-CG 4.42Å; K768-Y789 WeakPolarHBondContact CA-O 3.45Å
769	F	98.3	Very high	94.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	111.6	172.3	173.5	-113.9	0	0	0	109	I715 A729 Q730 L731 I746 F757 I759 I771 Y789 L791	I715-F769 HydrophobicContact CD1-CD1 3.6Å; I715-F769 HydrophobicContact CD1-CE1 3.7Å; A729-F769 HydrophobicContact CB-CE2 3.58Å; A729-F769 HydrophobicContact CB-CZ 3.91Å; Q730-F769 WeakPolarHBondContact O-CA 3.29Å; L731-F769 HydrophobicContact CD1-CB 4.07Å; L731-F769 HydrophobicContact CD1-CD2 4.37Å; I746-F769 HydrophobicContact CD1-CD2 4.06Å; I746-F769 HydrophobicContact CD1-CE2 3.82Å; I746-F769 HydrophobicContact CG1-CE2 4.25Å; I746-F769 HydrophobicContact CG2-CE2 4.41Å; F757-F769 HydrophobicContact CB-CE1 4.39Å; F757-F769 HydrophobicContact CB-CE2 4.42Å; F757-F769 HydrophobicContact CB-CZ 3.69Å; F757-F769 HydrophobicContact CD1-CE2 4.36Å; F757-F769 AromaticContact CD1-CZ 3.81Å; F757-F769 HydrophobicContact CD1-CZ 3.81Å; F757-F769 HydrophobicContact CD2-CE1 4.4Å; F757-F769 AromaticContact CD2-CZ 3.95Å; F757-F769 HydrophobicContact CD2-CZ 3.95Å; F757-F769 HydrophobicContact CE1-CZ 4.38Å; F757-F769 HydrophobicContact CG-CE1 4.36Å; F757-F769 HydrophobicContact CG-CE2 4.43Å; F757-F769 AromaticContact CG-CZ 3.55Å; F757-F769 HydrophobicContact CG-CZ 3.55Å; I759-F769 HydrophobicContact CD1-CD1 4.07Å; I759-F769 HydrophobicContact CD1-CD2 3.72Å; I759-F769 HydrophobicContact CD1-CE1 4.19Å; I759-F769 HydrophobicContact CD1-CE2 3.83Å; I759-F769 HydrophobicContact CD1-CG 3.85Å; I759-F769 HydrophobicContact CD1-CZ 4.09Å; I759-F769 HydrophobicContact CG1-CE2 4.49Å; F769-I771 HydrophobicContact CE1-CD1 3.76Å; F769-I771 HydrophobicContact CE1-CG1 3.82Å; F769-I771 HydrophobicContact CZ-CD1 4.19Å; F769-I771 HydrophobicContact CZ-CG1 3.92Å; F769-Y789 AromaticContact CD1-CD2 3.64Å; F769-Y789 HydrophobicContact CD1-CD2 3.64Å; F769-Y789 HydrophobicContact CD1-CE2 4.34Å; F769-Y789 HydrophobicContact CD1-CG 4.31Å; F769-Y789 HydrophobicContact CE1-CD2 4.19Å; F769-Y789 HydrophobicContact CE1-CE2 4.47Å; F769-Y789 PolarHBondContact N-O 3.1Å; F769-Y789 PolarHBondContact O-N 2.89Å; F769-L791 HydrophobicContact CB-CD1 3.65Å; F769-L791 HydrophobicContact CB-CG 4.04Å; F769-L791 HydrophobicContact CG-CD1 4.33Å
770	Q	97.6	Very high	93.6	Very high	22 Å²	22	36 Å²	36	10%	0.103	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.9	-168.3	-57.8	176.3	-80.9	0	0	109.4	Y684 A729 Q730 I732 K768 Y772 N788	Y684-Q770 PolarHBondContact OH-NE2 3.46Å; A729-Q770 CarbonylContact C-O 3.55Å; A729-Q770 WeakPolarHBondContact CA-O 3.46Å; Q730-Q770 PolarHBondContact N-O 3.32Å; Q730-Q770 PolarHBondContact O-N 2.98Å; I732-Q770 VanDerWaalsContact CD1-OE1 3.29Å; K768-Q770 HydrophobicContact CB-CG 4.42Å; Q770-Y772 HydrophobicContact CB-CE2 3.62Å; Q770-Y772 PolarHBondContact NE2-OH 2.91Å; Q770-Y772 PolarHBondContact OE1-OH 3.27Å; Q770-N788 WeakPolarHBondContact CB-OD1 3.08Å; Q770-N788 WeakPolarHBondContact CG-OD1 3.25Å
771	I	97.1	Very high	92.9	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.015	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	133.4	178.5	-57.7	168.6	0	0	0	108.4	F717 I727 A729 F757 F769 S785 V786 Y787 Y789	F717-I771 HydrophobicContact CD2-CD1 4.05Å; F717-I771 HydrophobicContact CE1-CD1 4.38Å; F717-I771 HydrophobicContact CE2-CD1 3.25Å; F717-I771 HydrophobicContact CZ-CD1 3.47Å; F717-I771 VanDerWaalsContact CZ-CD1 3.47Å; I727-I771 HydrophobicContact CG2-CG2 4.16Å; A729-I771 HydrophobicContact CB-CG1 4.46Å; F757-I771 HydrophobicContact CD2-CD1 4.38Å; F757-I771 HydrophobicContact CE2-CD1 3.88Å; F757-I771 HydrophobicContact CE2-CG1 4.33Å; F757-I771 HydrophobicContact CZ-CD1 4.37Å; F757-I771 HydrophobicContact CZ-CG1 4.34Å; F757-I771 HydrophobicContact CZ-CG2 4.29Å; F769-I771 HydrophobicContact CE1-CD1 3.76Å; F769-I771 HydrophobicContact CE1-CG1 3.82Å; F769-I771 HydrophobicContact CZ-CD1 4.19Å; F769-I771 HydrophobicContact CZ-CG1 3.92Å; I771-S785 WeakPolarHBondContact O-CA 3.39Å; I771-V786 HydrophobicContact CB-CG2 4.13Å; I771-V786 HydrophobicContact CG2-CG2 3.72Å; I771-V786 WeakPolarHBondContact O-CG2 3.28Å; I771-V786 PolarHBondContact O-N 3.19Å; I771-Y787 PolarHBondContact N-O 3.47Å; I771-Y787 PolarHBondContact O-N 2.91Å; I771-Y789 HydrophobicContact CD1-CE2 4.3Å
772	Y	95.7	Very high	92.7	Very high	42 Å²	42	49.1 Å²	49.1	17%	0.165	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.7	178.7	-55.7	-94.6	0	0	0	109.2	I727 M728 Q730 Q770 L783 P784	I727-Y772 WeakPolarHBondContact CA-O 3.39Å; M728-Y772 PolarHBondContact N-O 3.37Å; M728-Y772 PolarHBondContact O-N 3.4Å; Q730-Y772 HydrophobicContact CB-CE2 4.25Å; Q730-Y772 HydrophobicContact CG-CE2 4.07Å; Q730-Y772 PolarHBondContact OE1-OH 3.11Å; Q770-Y772 HydrophobicContact CB-CE2 3.62Å; Q770-Y772 PolarHBondContact NE2-OH 2.91Å; Q770-Y772 PolarHBondContact OE1-OH 3.27Å; Y772-L783 VanDerWaalsContact CD1-O 3.26Å; Y772-L783 WeakPolarHBondContact CD1-O 3.25Å; Y772-P784 VanDerWaalsContact CA-O 3.23Å; Y772-P784 WeakPolarHBondContact CA-O 3.48Å
773	A	94.9	Very high	92.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	149.9	178.7	0	0	0	0	0	112.5	M694 L696 L725 R726 I727 P784 V786	M694-A773 VanDerWaalsContact CE-O 3.25Å; M694-A773 WeakPolarHBondContact CE-O 3.35Å; M694-A773 HydrophobicContact SD-CB 3.65Å; L696-A773 HydrophobicContact CD1-CB 4.22Å; L725-A773 HydrophobicContact CD1-CB 4.31Å; R726-A773 CarbonylContact O-C 3.53Å; R726-A773 WeakPolarHBondContact O-CA 3.49Å; I727-A773 HydrophobicContact CG1-CB 4.04Å; A773-P784 PolarHBondContact N-O 3.42Å; A773-P784 VanDerWaalsContact N-O 3.07Å; A773-P784 VanDerWaalsContact O-CD 3.26Å; A773-P784 WeakPolarHBondContact O-CD 3.29Å; A773-P784 WeakPolarHBondContact O-CG 2.84Å; A773-V786 HydrophobicContact CB-CG1 4.02Å; A773-V786 HydrophobicContact CB-CG2 4.02Å
774	L	93.8	Very high	92.7	Very high	9 Å²	9	48.7 Å²	48.7	5%	0.047	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	133.9	174.7	-170.9	65.8	0	0	0	109.7	R726 E778 L783 P784	R726-L774 PolarHBondContact N-O 2.81Å; R726-L774 VanDerWaalsContact NH2-CD2 3.25Å; R726-L774 PolarHBondContact O-N 3.15Å; L774-E778 HydrophobicContact CD1-CB 4.02Å; L774-E778 VanDerWaalsContact CD1-OE2 3.25Å; L774-E778 WeakPolarHBondContact CD1-OE2 3.44Å; L774-E778 HydrophobicContact CG-CB 4.17Å; L774-L783 HydrophobicContact CB-CG 4.01Å; L774-P784 HydrophobicContact CD1-CG 4.45Å
775	P	92.4	Very high	92.8	Very high	21 Å²	21	47.3 Å²	47.3	14%	0.136	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	143.7	174	-25.6	35.6	0	0	0	112.5	L725 T777 E778	L725-P775 HydrophobicContact CD2-CB 4.24Å; L725-P775 HydrophobicContact CD2-CG 3.9Å; P775-T777 PolarHBondContact O-N 2.75Å; P775-E778 HydrophobicContact CB-CB 4.36Å; P775-E778 HydrophobicContact CB-CG 4.16Å; P775-E778 HydrophobicContact CG-CG 4.18Å; P775-E778 PolarHBondContact O-N 3.15Å; P775-E778 VanDerWaalsContact O-N 3.11Å
776	Y	89.3	Confident	92.7	Very high	109 Å²	109	47.2 Å²	47.2	43%	0.427	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.6	174.1	-81.9	-84.7	0	0	0	112.7	P724 L725 R726 E778	P724-Y776 HydrophobicContact CB-CD2 3.84Å; P724-Y776 HydrophobicContact CB-CE2 4.48Å; P724-Y776 PolarHBondContact O-N 3.23Å; P724-Y776 VanDerWaalsContact O-N 3.1Å; L725-Y776 VanDerWaalsContact O-CE2 3.23Å; L725-Y776 WeakPolarHBondContact O-CE2 3.45Å; R726-Y776 HydrophobicContact CG-CD1 3.62Å; R726-Y776 HydrophobicContact CG-CD2 4.15Å; R726-Y776 HydrophobicContact CG-CE1 3.27Å; R726-Y776 HydrophobicContact CG-CE2 3.88Å; R726-Y776 HydrophobicContact CG-CG 4.05Å; R726-Y776 VanDerWaalsContact CG-CZ 3.41Å; Y776-E778 VanDerWaalsContact C-N 3.32Å
777	T	89.5	Confident	92.7	Very high	124 Å²	124	47.4 Å²	47.4	76%	0.761	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-20.3	175.5	51.3	0	0	0	0	113.4	P775	P775-T777 PolarHBondContact O-N 2.75Å
778	E	89.7	Confident	92.6	Very high	63 Å²	63	47.8 Å²	47.8	29%	0.294	27%	0.269	S	S	.	.	S	Bend	trans	-90.1	122.8	179.1	-74	-176.6	-159.9	0	0	109.8	R690 R726 L774 P775 Y776	R690-E778 IonicContact CZ-OE1 3.16Å; R690-E778 IonicContact CZ-OE2 3.93Å; R690-E778 IonicContact NH1-OE2 3.78Å; R690-E778 PolarHBondContact NH1-OE2 3.04Å; R690-E778 IonicContact NH2-OE1 2.76Å; R690-E778 PolarHBondContact NH2-OE1 3.25Å; R690-E778 IonicContact NH2-OE2 2.82Å; R690-E778 PolarHBondContact NH2-OE2 3.23Å; R726-E778 PolarHBondContact NH2-O 3.5Å; L774-E778 HydrophobicContact CD1-CB 4.02Å; L774-E778 VanDerWaalsContact CD1-OE2 3.25Å; L774-E778 WeakPolarHBondContact CD1-OE2 3.44Å; L774-E778 HydrophobicContact CG-CB 4.17Å; P775-E778 HydrophobicContact CB-CB 4.36Å; P775-E778 HydrophobicContact CB-CG 4.16Å; P775-E778 HydrophobicContact CG-CG 4.18Å; P775-E778 PolarHBondContact O-N 3.15Å; P775-E778 VanDerWaalsContact O-N 3.11Å; Y776-E778 VanDerWaalsContact C-N 3.32Å
779	P	86.3	Confident	92.6	Very high	129 Å²	129	45.8 Å²	45.8	84%	0.838	26%	0.26	S	S	*	.			trans	-69.1	144.6	173.8	29.5	-33.6	0	0	0	110.5
780	G	83	Confident	92.6	Very high	37 Å²	37	45.8 Å²	45.8	38%	0.381	26%	0.26	S	S	.	.			trans	145	143.2	177.7	0	0	0	0	0	112.6	R726	R726-G780 PolarHBondContact NH1-O 3.22Å; R726-G780 PolarHBondContact NH2-O 2.92Å
781	E	81.8	Confident	92.6	Very high	188 Å²	188	44.7 Å²	44.7	88%	0.879	26%	0.255	S	S	*	.	S	Bend	trans	-91.6	-27.2	175.5	-64.4	-173.2	172	0	0	112.4	L783	E781-L783 WeakPolarHBondContact O-CD1 3.07Å
782	S	89.4	Confident	92.6	Very high	104 Å²	104	44.8 Å²	44.8	73%	0.727	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-85	120.1	179.2	-173.1	0	0	0	0	110.8
783	L	92	Very high	92.6	Very high	20 Å²	20	42.8 Å²	42.8	11%	0.105	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-89.9	125	175.5	-73.5	66.8	0	0	0	109.2	R726 M728 Y772 L774 E781	R726-L783 HydrophobicContact CB-CD2 4.28Å; R726-L783 WeakPolarHBondContact O-CD2 3.49Å; M728-L783 HydrophobicContact CB-CD2 4.13Å; M728-L783 HydrophobicContact CE-CD1 3.92Å; M728-L783 HydrophobicContact CE-CD2 4.16Å; M728-L783 HydrophobicContact CE-CG 4.49Å; M728-L783 HydrophobicContact CG-CD2 3.78Å; Y772-L783 VanDerWaalsContact CD1-O 3.26Å; Y772-L783 WeakPolarHBondContact CD1-O 3.25Å; L774-L783 HydrophobicContact CB-CG 4.01Å; E781-L783 WeakPolarHBondContact O-CD1 3.07Å
784	P	93.4	Very high	92.5	Very high	45 Å²	45	44.4 Å²	44.4	29%	0.292	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-70.5	149.9	174.1	29.4	-36	0	0	0	112	M694 Y772 A773 L774	M694-P784 HydrophobicContact CE-CG 3.96Å; Y772-P784 VanDerWaalsContact CA-O 3.23Å; Y772-P784 WeakPolarHBondContact CA-O 3.48Å; A773-P784 PolarHBondContact N-O 3.42Å; A773-P784 VanDerWaalsContact N-O 3.07Å; A773-P784 VanDerWaalsContact O-CD 3.26Å; A773-P784 WeakPolarHBondContact O-CD 3.29Å; A773-P784 WeakPolarHBondContact O-CG 2.84Å; L774-P784 HydrophobicContact CD1-CG 4.45Å
785	S	94.5	Very high	92.4	Very high	33 Å²	33	49 Å²	49	23%	0.231	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	136	174	176.9	0	0	0	0	110.1	I771 N788	I771-S785 WeakPolarHBondContact O-CA 3.39Å; S785-N788 PolarHBondContact OG-ND2 3.49Å; S785-N788 PolarHBondContact OG-OD1 3.05Å; S785-N788 VanDerWaalsContact OG-OD1 3.09Å
786	V	95.6	Very high	92.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-26.6	-179.8	-65	0	0	0	0	113.1	V688 F691 M694 L696 I771 A773	V688-V786 PolarHBondContact N-O 2.81Å; F691-V786 WeakPolarHBondContact CB-O 3.38Å; F691-V786 HydrophobicContact CD2-CB 4.29Å; F691-V786 WeakPolarHBondContact CD2-O 3.47Å; M694-V786 HydrophobicContact CE-CG1 3.6Å; M694-V786 HydrophobicContact SD-CG1 3.49Å; M694-V786 WeakPolarHBondContact SD-CG1 3.32Å; L696-V786 HydrophobicContact CD1-CG2 3.97Å; I771-V786 HydrophobicContact CB-CG2 4.13Å; I771-V786 HydrophobicContact CG2-CG2 3.72Å; I771-V786 WeakPolarHBondContact O-CG2 3.28Å; I771-V786 PolarHBondContact O-N 3.19Å; A773-V786 HydrophobicContact CB-CG1 4.02Å; A773-V786 HydrophobicContact CB-CG2 4.02Å
787	Y	96.4	Very high	92.1	Very high	5 Å²	5	46 Å²	46	2%	0.02	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	134.7	178	-154.2	-69.4	0	0	0	110.4	G686 P687 F691 A698 T702 P704 F717 I771 Y789	G686-Y787 WeakPolarHBondContact O-CA 3.31Å; P687-Y787 HydrophobicContact CB-CD2 3.77Å; P687-Y787 HydrophobicContact CB-CE2 3.77Å; P687-Y787 HydrophobicContact CG-CE2 4.11Å; F691-Y787 HydrophobicContact CD1-CD2 4.37Å; F691-Y787 AromaticContact CD2-CD2 3.75Å; F691-Y787 HydrophobicContact CD2-CD2 3.75Å; F691-Y787 HydrophobicContact CD2-CG 4.46Å; F691-Y787 HydrophobicContact CE1-CD2 4.18Å; F691-Y787 HydrophobicContact CE1-CE2 4.33Å; F691-Y787 AromaticContact CE2-CD2 3.54Å; F691-Y787 HydrophobicContact CE2-CD2 3.54Å; F691-Y787 HydrophobicContact CE2-CE2 4.39Å; F691-Y787 HydrophobicContact CE2-CG 4.32Å; F691-Y787 HydrophobicContact CG-CD2 4.17Å; F691-Y787 AromaticContact CZ-CD2 3.77Å; F691-Y787 HydrophobicContact CZ-CD2 3.77Å; F691-Y787 HydrophobicContact CZ-CE2 4.17Å; A698-Y787 HydrophobicContact CB-CE2 4.34Å; T702-Y787 PolarHBondContact O-OH 2.96Å; P704-Y787 HydrophobicContact CB-CE1 4.28Å; F717-Y787 AromaticContact CE1-CD2 3.99Å; F717-Y787 HydrophobicContact CE1-CD2 3.99Å; F717-Y787 HydrophobicContact CE1-CE2 4.39Å; F717-Y787 HydrophobicContact CE1-CG 4.27Å; F717-Y787 HydrophobicContact CZ-CD1 4.41Å; F717-Y787 HydrophobicContact CZ-CD2 4.25Å; F717-Y787 HydrophobicContact CZ-CG 4.12Å; I771-Y787 PolarHBondContact N-O 3.47Å; I771-Y787 PolarHBondContact O-N 2.91Å; Y787-Y789 AromaticContact CD1-CD2 3.58Å; Y787-Y789 HydrophobicContact CD1-CD2 3.58Å; Y787-Y789 HydrophobicContact CD1-CE1 4.33Å; Y787-Y789 AromaticContact CD1-CE2 3.23Å; Y787-Y789 HydrophobicContact CD1-CE2 3.23Å; Y787-Y789 HydrophobicContact CD1-CG 4.29Å; Y787-Y789 AromaticContact CD1-CZ 3.63Å; Y787-Y789 HydrophobicContact CE1-CD1 4.02Å; Y787-Y789 AromaticContact CE1-CD2 3.76Å; Y787-Y789 HydrophobicContact CE1-CD2 3.76Å; Y787-Y789 AromaticContact CE1-CE1 3.54Å; Y787-Y789 HydrophobicContact CE1-CE1 3.54Å; Y787-Y789 AromaticContact CE1-CE2 3.31Å; Y787-Y789 HydrophobicContact CE1-CE2 3.31Å; Y787-Y789 HydrophobicContact CE1-CG 4.11Å; Y787-Y789 AromaticContact CE1-CZ 3.15Å; Y787-Y789 WeakPolarHBondContact CE1-OH 3.23Å; Y787-Y789 HydrophobicContact CG-CE2 4.17Å; Y787-Y789 AromaticContact CZ-CZ 3.76Å
788	N	96.8	Very high	91.8	Very high	7 Å²	7	48.3 Å²	48.3	4%	0.037	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.2	175.4	-56.1	-53.7	0	0	0	111.4	Y684 G686 Q770 S785	Y684-N788 HydrophobicContact CD1-CB 4.32Å; Y684-N788 HydrophobicContact CE1-CB 3.88Å; Y684-N788 WeakPolarHBondContact O-CB 3.13Å; Y684-N788 PolarHBondContact O-ND2 2.91Å; Y684-N788 VanDerWaalsContact O-ND2 3.08Å; G686-N788 PolarHBondContact N-O 3.47Å; G686-N788 PolarHBondContact O-N 3.32Å; G686-N788 VanDerWaalsContact O-N 3.08Å; Q770-N788 WeakPolarHBondContact CB-OD1 3.08Å; Q770-N788 WeakPolarHBondContact CG-OD1 3.25Å; S785-N788 PolarHBondContact OG-ND2 3.49Å; S785-N788 PolarHBondContact OG-OD1 3.05Å; S785-N788 VanDerWaalsContact OG-OD1 3.09Å
789	Y	97.6	Very high	91	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	154	170.3	-67.1	-92.6	0	0	0	111.4	H701 P704 I706 I715 F717 K768 F769 I771 Y787 L791	H701-Y789 HydrophobicContact CB-CE1 4.07Å; H701-Y789 WeakPolarHBondContact O-CE1 3.42Å; H701-Y789 PolarHBondContact O-OH 3.23Å; P704-Y789 VanDerWaalsContact CA-CD1 3.47Å; P704-Y789 HydrophobicContact CB-CD1 4.39Å; P704-Y789 CarbonylContact O-C 3.58Å; P704-Y789 WeakPolarHBondContact O-CA 3.41Å; P704-Y789 WeakPolarHBondContact O-CB 3.44Å; P704-Y789 WeakPolarHBondContact O-CD1 3.31Å; I706-Y789 HydrophobicContact CD1-CD1 3.56Å; I706-Y789 HydrophobicContact CD1-CE1 3.76Å; I706-Y789 HydrophobicContact CD1-CG 4.33Å; I706-Y789 HydrophobicContact CG1-CD1 3.98Å; I706-Y789 HydrophobicContact CG1-CE1 4.35Å; I715-Y789 HydrophobicContact CD1-CD2 4.43Å; I715-Y789 HydrophobicContact CG2-CE2 4.15Å; F717-Y789 HydrophobicContact CE2-CE2 4.04Å; F717-Y789 AromaticContact CZ-CE2 3.69Å; F717-Y789 HydrophobicContact CZ-CE2 3.69Å; F717-Y789 AromaticContact CZ-CZ 3.95Å; F717-Y789 VanDerWaalsContact CZ-OH 3.28Å; F717-Y789 WeakPolarHBondContact CZ-OH 3.38Å; K768-Y789 WeakPolarHBondContact CA-O 3.45Å; F769-Y789 AromaticContact CD1-CD2 3.64Å; F769-Y789 HydrophobicContact CD1-CD2 3.64Å; F769-Y789 HydrophobicContact CD1-CE2 4.34Å; F769-Y789 HydrophobicContact CD1-CG 4.31Å; F769-Y789 HydrophobicContact CE1-CD2 4.19Å; F769-Y789 HydrophobicContact CE1-CE2 4.47Å; F769-Y789 PolarHBondContact N-O 3.1Å; F769-Y789 PolarHBondContact O-N 2.89Å; I771-Y789 HydrophobicContact CD1-CE2 4.3Å; Y787-Y789 AromaticContact CD1-CD2 3.58Å; Y787-Y789 HydrophobicContact CD1-CD2 3.58Å; Y787-Y789 HydrophobicContact CD1-CE1 4.33Å; Y787-Y789 AromaticContact CD1-CE2 3.23Å; Y787-Y789 HydrophobicContact CD1-CE2 3.23Å; Y787-Y789 HydrophobicContact CD1-CG 4.29Å; Y787-Y789 AromaticContact CD1-CZ 3.63Å; Y787-Y789 HydrophobicContact CE1-CD1 4.02Å; Y787-Y789 AromaticContact CE1-CD2 3.76Å; Y787-Y789 HydrophobicContact CE1-CD2 3.76Å; Y787-Y789 AromaticContact CE1-CE1 3.54Å; Y787-Y789 HydrophobicContact CE1-CE1 3.54Å; Y787-Y789 AromaticContact CE1-CE2 3.31Å; Y787-Y789 HydrophobicContact CE1-CE2 3.31Å; Y787-Y789 HydrophobicContact CE1-CG 4.11Å; Y787-Y789 AromaticContact CE1-CZ 3.15Å; Y787-Y789 WeakPolarHBondContact CE1-OH 3.23Å; Y787-Y789 HydrophobicContact CG-CE2 4.17Å; Y787-Y789 AromaticContact CZ-CZ 3.76Å; Y789-L791 HydrophobicContact CG-CD2 4.47Å
790	L	97.7	Very high	90.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123	158.7	-178.6	67.6	0	0	0	108.4	L620 L677 P678 I680 L685 P704 F705 I706 F766 F767	L620-L790 HydrophobicContact CD1-CD2 3.9Å; L620-L790 HydrophobicContact CD2-CD2 3.65Å; L620-L790 HydrophobicContact CG-CD2 4.39Å; L677-L790 HydrophobicContact CD2-CD2 3.89Å; P678-L790 HydrophobicContact CG-CD1 3.71Å; P678-L790 HydrophobicContact CG-CD2 4.42Å; I680-L790 HydrophobicContact CD1-CB 4.42Å; I680-L790 HydrophobicContact CD1-CD1 4.25Å; I680-L790 HydrophobicContact CD1-CD2 3.57Å; I680-L790 HydrophobicContact CD1-CG 4.28Å; L685-L790 HydrophobicContact CD1-CB 4.4Å; L685-L790 HydrophobicContact CD2-CB 3.81Å; P704-L790 PolarHBondContact O-N 3.07Å; F705-L790 VanDerWaalsContact CA-O 3.3Å; F705-L790 WeakPolarHBondContact CA-O 3.45Å; F705-L790 HydrophobicContact CD2-CB 4.18Å; F705-L790 HydrophobicContact CD2-CD2 4.07Å; F705-L790 HydrophobicContact CD2-CG 4.12Å; F705-L790 VanDerWaalsContact CD2-O 3.32Å; F705-L790 WeakPolarHBondContact CD2-O 3.45Å; F705-L790 HydrophobicContact CE2-CD2 4.3Å; F705-L790 HydrophobicContact CE2-CG 4.41Å; I706-L790 PolarHBondContact N-O 3.3Å; F766-L790 HydrophobicContact CB-CD1 4.14Å; F766-L790 HydrophobicContact CD1-CD1 4.5Å; F766-L790 HydrophobicContact CD1-CD2 4.38Å; F766-L790 HydrophobicContact CD1-CG 4.43Å; F767-L790 CarbonylContact O-C 3.5Å; F767-L790 WeakPolarHBondContact O-CA 3.46Å
791	L	97.6	Very high	89.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	129.9	-178.6	-44.9	178.4	0	0	0	109.1	I706 L713 I715 L731 I759 F761 F766 F767 F769 Y789	I706-L791 HydrophobicContact CB-CD2 3.82Å; I706-L791 HydrophobicContact CD1-CD2 3.8Å; I706-L791 HydrophobicContact CG1-CD2 4.11Å; I706-L791 CarbonylContact O-C 3.5Å; I706-L791 WeakPolarHBondContact O-CA 3.27Å; L713-L791 HydrophobicContact CD2-CD1 4.2Å; L713-L791 HydrophobicContact CD2-CD2 3.97Å; I715-L791 HydrophobicContact CD1-CD2 4.25Å; L731-L791 HydrophobicContact CD1-CD1 4Å; I759-L791 HydrophobicContact CD1-CD1 3.89Å; F761-L791 HydrophobicContact CE1-CB 4.1Å; F761-L791 HydrophobicContact CE1-CD1 3.87Å; F761-L791 HydrophobicContact CZ-CB 4.24Å; F761-L791 HydrophobicContact CZ-CD1 3.88Å; F766-L791 CarbonylContact C-O 3.56Å; F766-L791 VanDerWaalsContact CA-O 3.27Å; F766-L791 WeakPolarHBondContact CA-O 3.4Å; F767-L791 HydrophobicContact CB-CB 4.26Å; F767-L791 PolarHBondContact N-O 3.16Å; F767-L791 PolarHBondContact O-N 3.49Å; F769-L791 HydrophobicContact CB-CD1 3.65Å; F769-L791 HydrophobicContact CB-CG 4.04Å; F769-L791 HydrophobicContact CG-CD1 4.33Å; Y789-L791 HydrophobicContact CG-CD2 4.47Å
792	E	96.8	Very high	89.2	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.019	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	107	168.2	179.9	-161	-176.8	0	0	108.8	F635 V674 F705 I706 Q707 A708 F766 T794	F635-E792 VanDerWaalsContact CE1-CD 3.49Å; F635-E792 HydrophobicContact CE1-CG 4.38Å; F635-E792 WeakPolarHBondContact CE1-OE2 3.35Å; V674-E792 HydrophobicContact CB-CG 4.12Å; V674-E792 HydrophobicContact CG1-CG 4.3Å; V674-E792 HydrophobicContact CG2-CG 4.25Å; F705-E792 HydrophobicContact CE2-CB 3.86Å; F705-E792 HydrophobicContact CZ-CB 3.68Å; I706-E792 PolarHBondContact O-N 3.28Å; Q707-E792 WeakPolarHBondContact CG-OE2 3.43Å; Q707-E792 PolarHBondContact NE2-OE2 3.19Å; A708-E792 PolarHBondContact N-O 2.94Å; F766-E792 HydrophobicContact CD1-CB 4.12Å; F766-E792 HydrophobicContact CD1-CG 4.43Å; F766-E792 HydrophobicContact CE1-CB 3.87Å; F766-E792 HydrophobicContact CE1-CG 3.9Å; E792-T794 HydrophobicContact CG-CG2 4.35Å
793	A	96.3	Very high	88.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	118	175.7	0	0	0	0	0	110.5	V674 A708 F761 P764 G765 F767	V674-A793 WeakPolarHBondContact CG2-O 3.23Å; A708-A793 WeakPolarHBondContact O-CA 3.28Å; F761-A793 HydrophobicContact CB-CB 3.73Å; F761-A793 HydrophobicContact CD1-CB 3.39Å; F761-A793 HydrophobicContact CD2-CB 3.86Å; F761-A793 HydrophobicContact CE1-CB 3.9Å; F761-A793 HydrophobicContact CE2-CB 4.36Å; F761-A793 HydrophobicContact CG-CB 3.35Å; F761-A793 HydrophobicContact CZ-CB 4.35Å; P764-A793 CarbonylContact C-O 3.55Å; P764-A793 WeakPolarHBondContact CA-O 3.2Å; P764-A793 WeakPolarHBondContact CB-O 3.37Å; G765-A793 PolarHBondContact N-O 3.32Å; G765-A793 PolarHBondContact O-N 2.9Å; F767-A793 HydrophobicContact CD2-CB 4.12Å; F767-A793 HydrophobicContact CE2-CB 3.84Å
794	T	93.1	Very high	88	Confident	34 Å²	34	49.3 Å²	49.3	21%	0.209	25%	0.247	C	C	.	.			trans	-99.7	-13.3	177.3	57.9	0	0	0	0	113.1	P673 V674 A708 E792	P673-T794 HydrophobicContact CG-CG2 4.02Å; V674-T794 HydrophobicContact CG2-CG2 3.89Å; A708-T794 PolarHBondContact O-N 3.26Å; A708-T794 VanDerWaalsContact O-N 3.11Å; E792-T794 HydrophobicContact CG-CG2 4.35Å
795	Q	91.2	Very high	87.7	Confident	106 Å²	106	47.7 Å²	47.7	50%	0.495	24%	0.236	S	C	.	.	S	Bend	trans	-129.1	162.4	179.8	-65.3	-162.8	14.2	0	0	111	N709	N709-Q795 VanDerWaalsContact O-CG 3.23Å; N709-Q795 WeakPolarHBondContact O-CG 3.23Å; N709-Q795 PolarHBondContact O-NE2 3.09Å; N709-Q795 VanDerWaalsContact O-NE2 3.09Å; N709-Q795 PolarHBondContact O-OE1 2.9Å
796	V	90.8	Very high	87.5	Confident	36 Å²	36	46.7 Å²	46.7	22%	0.218	23%	0.229	C	C	.	.			trans	-116	136.4	-175.7	-175.2	0	0	0	0	109	F761 P762 P764 R798 V804	F761-V796 WeakPolarHBondContact O-CG1 3.39Å; P762-V796 WeakPolarHBondContact O-CG1 3.37Å; P764-V796 VanDerWaalsContact CD-CG2 3.45Å; P764-V796 HydrophobicContact CG-CG2 3.93Å; V796-R798 HydrophobicContact CB-CG 4.39Å; V796-R798 HydrophobicContact CG1-CG 3.98Å; V796-R798 PolarHBondContact O-N 2.9Å; V796-V804 HydrophobicContact CG1-CG2 4.3Å
797	N	85.1	Confident	87.5	Confident	30 Å²	30	46.9 Å²	46.9	16%	0.16	23%	0.229	C	C	.	.			trans	-79	109.3	167.2	-169.4	-34.6	0	0	0	109.2	G711 E712 R760 F761	G711-N797 WeakPolarHBondContact O-CB 3.29Å; E712-N797 PolarHBondContact OE2-ND2 2.96Å; R760-N797 HydrophobicContact CB-CB 4.08Å; R760-N797 HydrophobicContact CG-CB 4.19Å; R760-N797 WeakPolarHBondContact CG-ND2 3.5Å; R760-N797 PolarHBondContact NE-ND2 3.04Å; F761-N797 PolarHBondContact O-N 3.38Å; F761-N797 VanDerWaalsContact O-N 3.11Å
798	R	82.6	Confident	87.5	Confident	173 Å²	173	46.7 Å²	46.7	65%	0.653	23%	0.229	S	C	*	.	B	Isolated β-bridge	trans	-108.9	128.8	173.2	-65.2	-173.7	178.9	-167.5	-0.3	109.2	V796 G802	V796-R798 HydrophobicContact CB-CG 4.39Å; V796-R798 HydrophobicContact CG1-CG 3.98Å; V796-R798 PolarHBondContact O-N 2.9Å; R798-G802 WeakPolarHBondContact CD-O 3.4Å; R798-G802 WeakPolarHBondContact CG-O 3.2Å
799	G	72.4	Confident	87.5	Confident	19 Å²	19	50 Å²	50	20%	0.196	24%	0.244	C	C	.	.			trans	-69.9	-178.5	169.5	0	0	0	0	0	112.2	N801 G802 H803	G799-N801 PolarHBondContact O-N 3.27Å; G799-N801 VanDerWaalsContact O-N 3.08Å; G799-G802 PolarHBondContact O-N 3.17Å; G799-H803 PolarHBondContact N-O 2.97Å
800	R	69.2	Low	87.4	Confident	241 Å²	241	52 Å²	52	91%	0.909	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-33.4	-178.4	-71.7	-175.4	-179.4	-172.3	0.8	114.2	G802	R800-G802 VanDerWaalsContact C-N 3.3Å; R800-G802 PolarHBondContact O-N 3.21Å
801	N	69.9	Low	87.3	Confident	96 Å²	96	55.3 Å²	55.3	51%	0.513	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	8.3	-178.7	-61.7	-14.1	0	0	0	113.2	G799 H803 Y829	G799-N801 PolarHBondContact O-N 3.27Å; G799-N801 VanDerWaalsContact O-N 3.08Å; N801-H803 PolarHBondContact O-N 2.83Å; N801-Y829 WeakPolarHBondContact ND2-CD1 3.23Å; N801-Y829 WeakPolarHBondContact ND2-CE1 3.42Å
802	G	74.4	Confident	86.9	Confident	36 Å²	36	59.1 Å²	59.1	37%	0.371	30%	0.3	S	S	.	.	S	Bend	trans	78.3	-9.2	-177.2	0	0	0	0	0	115	R798 G799 R800	R798-G802 WeakPolarHBondContact CD-O 3.4Å; R798-G802 WeakPolarHBondContact CG-O 3.2Å; G799-G802 PolarHBondContact O-N 3.17Å; R800-G802 VanDerWaalsContact C-N 3.3Å; R800-G802 PolarHBondContact O-N 3.21Å
803	H	79.4	Confident	86.6	Confident	120 Å²	120	62.1 Å²	62.1	56%	0.556	31%	0.314	S	S	*	.	S	Bend	trans	-75.5	150.9	175.6	-63.8	-62.7	0	0	0	112.4	G799 N801 M805	G799-H803 PolarHBondContact N-O 2.97Å; N801-H803 PolarHBondContact O-N 2.83Å; H803-M805 PolarHBondContact O-N 3.45Å
804	V	78.3	Confident	86.5	Confident	51 Å²	51	62.1 Å²	62.1	31%	0.309	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-65.3	127.3	171.1	178.7	0	0	0	0	109.1	P762 V796	P762-V804 HydrophobicContact CB-CG1 3.8Å; P762-V804 HydrophobicContact CB-CG2 4.18Å; P762-V804 VanDerWaalsContact O-CG2 3.24Å; P762-V804 WeakPolarHBondContact O-CG2 3.34Å; V796-V804 HydrophobicContact CG1-CG2 4.3Å
805	M	85.7	Confident	86.3	Confident	10 Å²	10	63.3 Å²	63.3	5%	0.049	32%	0.316	C	S	.	.			trans	-102.4	107.1	-176.7	-164.2	70.9	83	0	0	111.4	Q745 R760 H803 D825 I827 Y829	Q745-M805 PolarHBondContact OE1-O 3.24Å; R760-M805 WeakPolarHBondContact CD-O 3.36Å; R760-M805 PolarHBondContact NH1-O 2.88Å; R760-M805 VanDerWaalsContact NH1-O 3.09Å; H803-M805 PolarHBondContact O-N 3.45Å; M805-D825 HydrophobicContact CE-CB 4.29Å; M805-D825 HydrophobicContact CG-CB 3.69Å; M805-D825 VanDerWaalsContact CG-CG 3.47Å; M805-D825 WeakPolarHBondContact CG-OD1 3.28Å; M805-D825 HydrophobicContact SD-CB 3.98Å; M805-I827 HydrophobicContact SD-CB 3.98Å; M805-Y829 HydrophobicContact CE-CD2 4.16Å; M805-Y829 HydrophobicContact CE-CE2 3.61Å; M805-Y829 HydrophobicContact SD-CE2 4Å
806	C	90.8	Very high	86.1	Confident	13 Å²	13	63.2 Å²	63.2	9%	0.088	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-72.4	167.2	174.1	67.6	0	0	0	0	112	G826	C806-G826 PolarHBondContact O-N 2.73Å
807	F	95.6	Very high	86	Confident	3 Å²	3	62 Å²	62	1%	0.013	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-82.1	166.2	168.4	-68.9	-71.3	0	0	0	110.8	Q744 Q745 L747 V758 R760 M824 G826	Q744-F807 PolarHBondContact O-N 3Å; Q745-F807 WeakPolarHBondContact O-CD2 3.41Å; Q745-F807 VanDerWaalsContact O-CE2 3.24Å; Q745-F807 WeakPolarHBondContact O-CE2 3.39Å; L747-F807 HydrophobicContact CB-CB 4.12Å; L747-F807 HydrophobicContact CB-CD1 3.62Å; L747-F807 HydrophobicContact CB-CD2 3.77Å; L747-F807 HydrophobicContact CB-CE1 3.91Å; L747-F807 HydrophobicContact CB-CE2 4.02Å; L747-F807 HydrophobicContact CB-CG 3.56Å; L747-F807 HydrophobicContact CB-CZ 4.09Å; L747-F807 HydrophobicContact CD2-CD1 4.02Å; L747-F807 HydrophobicContact CD2-CE1 4.16Å; L747-F807 HydrophobicContact CG-CD1 4.33Å; V758-F807 HydrophobicContact CB-CZ 3.98Å; V758-F807 HydrophobicContact CG1-CE1 4.41Å; V758-F807 HydrophobicContact CG1-CZ 3.7Å; V758-F807 VanDerWaalsContact O-CE2 3.25Å; V758-F807 WeakPolarHBondContact O-CE2 3.38Å; R760-F807 HydrophobicContact CB-CE2 4.22Å; R760-F807 HydrophobicContact CG-CE2 3.63Å; R760-F807 HydrophobicContact CG-CZ 3.61Å; R760-F807 VanDerWaalsContact NE-CZ 3.33Å; F807-M824 VanDerWaalsContact CD1-O 3.24Å; F807-M824 WeakPolarHBondContact CD1-O 3.18Å; F807-M824 HydrophobicContact CE1-CE 4Å; F807-G826 VanDerWaalsContact C-CA 3.48Å
808	P	96.7	Very high	86.5	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.006	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-60.9	147.6	172.3	-18	32.6	0	0	0	109.6	Q810 L820 M824 L904 E905 Y906	P808-Q810 PolarHBondContact O-N 2.93Å; P808-L820 HydrophobicContact CG-CD2 4.14Å; P808-M824 WeakPolarHBondContact CD-O 3.35Å; P808-L904 HydrophobicContact CB-CB 4.11Å; P808-L904 HydrophobicContact CB-CD1 4.43Å; P808-L904 HydrophobicContact CB-CD2 4.32Å; P808-E905 CarbonylContact C-O 3.59Å; P808-E905 WeakPolarHBondContact CA-O 3.31Å; P808-E905 WeakPolarHBondContact CB-O 3.49Å; P808-Y906 HydrophobicContact CB-CD1 3.94Å; P808-Y906 HydrophobicContact CB-CD2 4.14Å; P808-Y906 HydrophobicContact CB-CE1 3.77Å; P808-Y906 HydrophobicContact CB-CE2 3.96Å; P808-Y906 HydrophobicContact CB-CG 4.11Å; P808-Y906 HydrophobicContact CG-CD1 3.65Å; P808-Y906 HydrophobicContact CG-CE1 3.14Å; P808-Y906 HydrophobicContact CG-CE2 4.14Å; P808-Y906 HydrophobicContact CG-CG 4.31Å; P808-Y906 VanDerWaalsContact CG-CZ 3.41Å
809	Q	96.7	Very high	87.2	Confident	78 Å²	78	54.8 Å²	54.8	36%	0.364	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	128.5	176	175.2	169.3	-17	0	0	109.2	F811 L904 E905	Q809-F811 HydrophobicContact CG-CE2 4.14Å; Q809-F811 HydrophobicContact CG-CZ 4.47Å; Q809-L904 CarbonylContact O-C 3.56Å; Q809-L904 VanDerWaalsContact O-CA 3.22Å; Q809-L904 WeakPolarHBondContact O-CA 3.15Å; Q809-E905 HydrophobicContact CB-CB 4.27Å; Q809-E905 PolarHBondContact N-O 2.99Å; Q809-E905 PolarHBondContact O-N 2.78Å
810	Q	96.3	Very high	88.4	Confident	42 Å²	42	54 Å²	54	20%	0.196	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.8	-173	-69.3	153.1	77.6	0	0	111.4	I746 L747 Q748 P808 W814 L904	I746-Q810 PolarHBondContact O-NE2 3.43Å; L747-Q810 HydrophobicContact CD1-CG 4.27Å; Q748-Q810 PolarHBondContact O-OE1 2.84Å; P808-Q810 PolarHBondContact O-N 2.93Å; Q810-W814 HydrophobicContact CB-CG 4.43Å; Q810-W814 HydrophobicContact CG-CG 4.29Å; Q810-L904 HydrophobicContact CB-CD2 4.26Å; Q810-L904 HydrophobicContact CG-CD2 3.58Å
811	F	94.5	Very high	89.7	Confident	69 Å²	69	44.8 Å²	44.8	30%	0.303	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-96.6	167	176.2	-68	-98.1	0	0	0	111.5	Q809 Q813 W814 T902 L903 E905	Q809-F811 HydrophobicContact CG-CE2 4.14Å; Q809-F811 HydrophobicContact CG-CZ 4.47Å; F811-Q813 PolarHBondContact O-N 3.41Å; F811-W814 WeakPolarHBondContact O-CB 3.19Å; F811-W814 PolarHBondContact O-N 3.19Å; F811-T902 WeakPolarHBondContact CB-O 3.11Å; F811-T902 HydrophobicContact CD2-CG2 3.7Å; F811-T902 HydrophobicContact CE2-CG2 3.58Å; F811-T902 HydrophobicContact CG-CG2 4.25Å; F811-T902 HydrophobicContact CZ-CG2 4.03Å; F811-L903 PolarHBondContact N-O 2.98Å; F811-E905 HydrophobicContact CE2-CB 3.8Å; F811-E905 HydrophobicContact CZ-CB 4.41Å
812	A	88.8	Confident	91	Very high	80 Å²	80	42.2 Å²	42.2	66%	0.661	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-55	-46.3	-170.8	0	0	0	0	0	113.5	W814 K815	A812-W814 PolarHBondContact O-N 3.41Å; A812-K815 PolarHBondContact O-N 3.46Å; A812-K815 VanDerWaalsContact O-N 3.1Å
813	Q	90.2	Very high	91.9	Very high	67 Å²	67	41 Å²	41	31%	0.313	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-63	-25.1	-179.3	-71.5	177.3	-18.5	0	0	113.4	F811 K815 E816 L903	F811-Q813 PolarHBondContact O-N 3.41Å; Q813-K815 PolarHBondContact O-N 3.25Å; Q813-E816 WeakPolarHBondContact O-CB 3.44Å; Q813-E816 PolarHBondContact O-N 2.99Å; Q813-L903 HydrophobicContact CB-CD2 3.47Å; Q813-L903 VanDerWaalsContact CB-CD2 3.47Å
814	W	94.7	Very high	92.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-58.3	-36	174.8	174.6	-104.7	0	0	0	111.9	L747 Q748 Q749 Q810 F811 A812 E816 C818 L820 L903 L904	L747-W814 HydrophobicContact CD1-CZ2 4.3Å; Q748-W814 PolarHBondContact O-NE1 3.35Å; Q749-W814 HydrophobicContact CB-CZ2 4.27Å; Q810-W814 HydrophobicContact CB-CG 4.43Å; Q810-W814 HydrophobicContact CG-CG 4.29Å; F811-W814 WeakPolarHBondContact O-CB 3.19Å; F811-W814 PolarHBondContact O-N 3.19Å; A812-W814 PolarHBondContact O-N 3.41Å; W814-E816 PolarHBondContact O-N 3.38Å; W814-E816 VanDerWaalsContact O-N 3.15Å; W814-C818 HydrophobicContact CD2-CB 3.85Å; W814-C818 HydrophobicContact CE3-CB 3.41Å; W814-C818 VanDerWaalsContact CE3-CB 3.41Å; W814-C818 HydrophobicContact CH2-CB 3.93Å; W814-C818 HydrophobicContact CZ2-CB 4.33Å; W814-C818 HydrophobicContact CZ3-CB 3.47Å; W814-C818 VanDerWaalsContact CZ3-CB 3.47Å; W814-C818 WeakPolarHBondContact O-CB 3.46Å; W814-C818 PolarHBondContact O-N 3.15Å; W814-C818 PolarHBondContact O-SG 3.05Å; W814-L820 HydrophobicContact CH2-CB 3.58Å; W814-L820 HydrophobicContact CZ2-CB 3.73Å; W814-L903 HydrophobicContact CE3-CB 4.16Å; W814-L904 HydrophobicContact CB-CD2 4.48Å; W814-L904 HydrophobicContact CD2-CD1 4.31Å; W814-L904 HydrophobicContact CD2-CD2 3.6Å; W814-L904 HydrophobicContact CD2-CG 3.97Å; W814-L904 HydrophobicContact CE3-CD1 3.95Å; W814-L904 HydrophobicContact CE3-CD2 3.92Å; W814-L904 HydrophobicContact CE3-CG 3.73Å; W814-L904 HydrophobicContact CG-CD2 3.83Å; W814-L904 HydrophobicContact CH2-CD1 3.87Å; W814-L904 HydrophobicContact CZ2-CD1 4.24Å; W814-L904 HydrophobicContact CZ2-CD2 4.49Å; W814-L904 HydrophobicContact CZ3-CD1 3.7Å; W814-L904 HydrophobicContact CZ3-CD2 4.48Å; W814-L904 HydrophobicContact CZ3-CG 4.02Å
815	K	89	Confident	93.2	Very high	59 Å²	59	37.8 Å²	37.8	26%	0.257	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-75.2	-1.8	-175.8	-59.1	179.8	179.8	-177.9	0	113	A812 Q813 G817	A812-K815 PolarHBondContact O-N 3.46Å; A812-K815 VanDerWaalsContact O-N 3.1Å; Q813-K815 PolarHBondContact O-N 3.25Å; K815-G817 VanDerWaalsContact C-N 3.33Å; K815-G817 PolarHBondContact O-N 3.04Å
816	E	86.4	Confident	93.6	Very high	104 Å²	104	37.5 Å²	37.5	49%	0.486	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	51.3	-178.9	-59.7	-176.7	-167	0	0	112.8	Q813 W814	Q813-E816 WeakPolarHBondContact O-CB 3.44Å; Q813-E816 PolarHBondContact O-N 2.99Å; W814-E816 PolarHBondContact O-N 3.38Å; W814-E816 VanDerWaalsContact O-N 3.15Å
817	G	89.7	Confident	93.6	Very high	10 Å²	10	38.3 Å²	38.3	10%	0.103	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	8.7	175.7	0	0	0	0	0	115.5	T750 K815 P848	T750-G817 CarbonylContact O-C 3.55Å; T750-G817 VanDerWaalsContact O-C 3.32Å; K815-G817 VanDerWaalsContact C-N 3.33Å; K815-G817 PolarHBondContact O-N 3.04Å; G817-P848 WeakPolarHBondContact O-CD 3.38Å; G817-P848 WeakPolarHBondContact O-CG 3.35Å
818	C	96	Very high	93.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.202	C	C	.	.			trans	-78.9	153.9	178.7	-52.7	0	0	0	0	112.4	Q749 T750 W814 T846 I847	Q749-C818 WeakPolarHBondContact CA-O 3.41Å; Q749-C818 WeakPolarHBondContact CB-O 3.19Å; T750-C818 PolarHBondContact N-O 3.18Å; T750-C818 CarbonylContact O-C 3.43Å; W814-C818 HydrophobicContact CD2-CB 3.85Å; W814-C818 HydrophobicContact CE3-CB 3.41Å; W814-C818 VanDerWaalsContact CE3-CB 3.41Å; W814-C818 HydrophobicContact CH2-CB 3.93Å; W814-C818 HydrophobicContact CZ2-CB 4.33Å; W814-C818 HydrophobicContact CZ3-CB 3.47Å; W814-C818 VanDerWaalsContact CZ3-CB 3.47Å; W814-C818 WeakPolarHBondContact O-CB 3.46Å; W814-C818 PolarHBondContact O-N 3.15Å; W814-C818 PolarHBondContact O-SG 3.05Å; C818-T846 CarbonylContact C-O 3.54Å; C818-T846 VanDerWaalsContact CA-O 3.24Å; C818-T846 WeakPolarHBondContact CA-O 3.49Å; C818-I847 HydrophobicContact CB-CG1 4.45Å
819	Y	97.1	Very high	93	Very high	51 Å²	51	42.3 Å²	42.3	20%	0.2	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	131.9	178.8	-166.8	-81	0	0	0	111.7	Q749 R751 Y756 H821 V845 T846	Q749-Y819 HydrophobicContact CB-CD2 4.14Å; Q749-Y819 HydrophobicContact CG-CD2 3.77Å; Q749-Y819 HydrophobicContact CG-CE2 3.91Å; Q749-Y819 HydrophobicContact CG-CG 4.48Å; R751-Y819 HydrophobicContact CB-CD2 3.73Å; R751-Y819 HydrophobicContact CB-CE2 4.37Å; R751-Y819 HydrophobicContact CB-CG 4.3Å; Y756-Y819 HydrophobicContact CD2-CD2 4.36Å; Y756-Y819 AromaticContact CD2-CE2 3.91Å; Y756-Y819 HydrophobicContact CD2-CE2 3.91Å; Y756-Y819 HydrophobicContact CE2-CE2 4.15Å; Y756-Y819 HydrophobicContact CG-CE2 4.22Å; Y819-H821 AromaticContact CD1-CE1 3.71Å; Y819-H821 AromaticContact CD1-NE2 3.72Å; Y819-H821 AromaticContact CE1-CE1 3.83Å; Y819-H821 AromaticContact CE1-ND1 3.91Å; Y819-V845 CarbonylContact O-C 3.52Å; Y819-V845 WeakPolarHBondContact O-CA 3.4Å; Y819-T846 PolarHBondContact N-O 3.41Å; Y819-T846 PolarHBondContact O-N 3.43Å
820	L	97.5	Very high	92.5	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124.7	-178	-176.6	56.3	0	0	0	109.6	L747 Q749 P808 W814 P823 M824 V845 L904	L747-L820 HydrophobicContact CD1-CD2 4.42Å; L747-L820 HydrophobicContact CD2-CB 4.36Å; L747-L820 HydrophobicContact CD2-CD2 4.22Å; Q749-L820 PolarHBondContact OE1-O 2.68Å; P808-L820 HydrophobicContact CG-CD2 4.14Å; W814-L820 HydrophobicContact CH2-CB 3.58Å; W814-L820 HydrophobicContact CZ2-CB 3.73Å; L820-P823 WeakPolarHBondContact CD2-O 3.48Å; L820-M824 HydrophobicContact CB-SD 3.93Å; L820-M824 HydrophobicContact CD2-SD 3.79Å; L820-M824 HydrophobicContact CG-SD 3.59Å; L820-M824 VanDerWaalsContact CG-SD 3.59Å; L820-V845 HydrophobicContact CD1-CG1 3.45Å; L820-V845 VanDerWaalsContact CD1-CG1 3.45Å; L820-L904 HydrophobicContact CD1-CD1 4.24Å; L820-L904 HydrophobicContact CD2-CD1 3.96Å
821	H	96.2	Very high	91.9	Very high	48 Å²	48	39.9 Å²	39.9	22%	0.222	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-42.9	172.6	-56.6	-94.9	0	0	0	111.4	R751 Y819 R844 T846	R751-H821 PolarHBondContact NH1-CE1 2.99Å; Y819-H821 AromaticContact CD1-CE1 3.71Å; Y819-H821 AromaticContact CD1-NE2 3.72Å; Y819-H821 AromaticContact CE1-CE1 3.83Å; Y819-H821 AromaticContact CE1-ND1 3.91Å; H821-R844 WeakPolarHBondContact CA-O 3.41Å; H821-R844 HydrophobicContact CB-CB 3.95Å; H821-R844 HydrophobicContact CB-CG 3.75Å; H821-R844 VanDerWaalsContact CB-O 3.28Å; H821-R844 WeakPolarHBondContact CB-O 3.26Å; H821-R844 PolarHBondContact N-O 3.39Å; H821-T846 PolarHBondContact NE2-OG1 3.46Å
822	T	96.3	Very high	91.1	Very high	43 Å²	43	43.2 Å²	43.2	26%	0.264	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	150.7	174.8	172.4	0	0	0	0	110.3	P842 F843 R844	T822-P842 CarbonylContact C-O 3.58Å; T822-P842 HydrophobicContact CG2-CB 4.39Å; T822-P842 HydrophobicContact CG2-CG 4.48Å; T822-P842 WeakPolarHBondContact CG2-O 3.34Å; T822-P842 PolarHBondContact OG1-O 3.47Å; T822-F843 CarbonylContact O-C 3.59Å; T822-F843 WeakPolarHBondContact O-CA 3.43Å; T822-R844 HydrophobicContact CG2-CB 3.67Å; T822-R844 PolarHBondContact N-O 3.15Å; T822-R844 VanDerWaalsContact N-O 3.14Å; T822-R844 PolarHBondContact O-N 2.9Å
823	P	94.9	Very high	90.6	Very high	11 Å²	11	41.5 Å²	41.5	7%	0.071	22%	0.22	C	C	.	.			cis	-80.1	138.5	-9.7	31.9	-31.2	0	0	0	111.5	L820 L828 V841 P842 F843 Y906	L820-P823 WeakPolarHBondContact CD2-O 3.48Å; P823-L828 HydrophobicContact CB-CD2 3.94Å; P823-L828 HydrophobicContact CG-CD2 3.98Å; P823-V841 HydrophobicContact CB-CG1 4.02Å; P823-V841 HydrophobicContact CG-CG1 3.76Å; P823-P842 WeakPolarHBondContact CD-O 3.45Å; P823-F843 HydrophobicContact CG-CD1 4.38Å; P823-F843 HydrophobicContact CG-CE1 3.94Å; P823-F843 HydrophobicContact CG-CE2 4.31Å; P823-F843 HydrophobicContact CG-CZ 3.9Å; P823-Y906 HydrophobicContact CB-CE1 4.5Å; P823-Y906 HydrophobicContact CG-CD1 4.41Å; P823-Y906 HydrophobicContact CG-CE1 3.69Å; P823-Y906 WeakPolarHBondContact O-CE1 3.36Å; P823-Y906 PolarHBondContact O-OH 3.02Å
824	M	93.4	Very high	89.7	Confident	45 Å²	45	46.6 Å²	46.6	22%	0.222	25%	0.25	C	C	.	.			trans	-85	-19	-179.6	-66.1	-71.6	-74.9	0	0	113.1	L747 F807 P808 L820	L747-M824 HydrophobicContact CD2-CE 3.17Å; L747-M824 HydrophobicContact CD2-SD 3.76Å; F807-M824 VanDerWaalsContact CD1-O 3.24Å; F807-M824 WeakPolarHBondContact CD1-O 3.18Å; F807-M824 HydrophobicContact CE1-CE 4Å; P808-M824 WeakPolarHBondContact CD-O 3.35Å; L820-M824 HydrophobicContact CB-SD 3.93Å; L820-M824 HydrophobicContact CD2-SD 3.79Å; L820-M824 HydrophobicContact CG-SD 3.59Å; L820-M824 VanDerWaalsContact CG-SD 3.59Å
825	D	91.8	Very high	88.9	Confident	58 Å²	58	52.7 Å²	52.7	31%	0.31	28%	0.278	S	S	.	.			trans	-82.3	126	-177.8	-67.4	-17.4	0	0	0	109.9	R760 M805 I827 Y906	R760-D825 IonicContact CZ-OD1 2.74Å; R760-D825 VanDerWaalsContact CZ-OD1 3.28Å; R760-D825 IonicContact NH1-OD1 2.71Å; R760-D825 PolarHBondContact NH1-OD1 2.86Å; R760-D825 IonicContact NH2-OD1 3.15Å; R760-D825 PolarHBondContact NH2-OD1 2.54Å; M805-D825 HydrophobicContact CE-CB 4.29Å; M805-D825 HydrophobicContact CG-CB 3.69Å; M805-D825 VanDerWaalsContact CG-CG 3.47Å; M805-D825 WeakPolarHBondContact CG-OD1 3.28Å; M805-D825 HydrophobicContact SD-CB 3.98Å; D825-I827 PolarHBondContact O-N 2.74Å; D825-Y906 VanDerWaalsContact O-CD1 3.26Å; D825-Y906 WeakPolarHBondContact O-CD1 3.26Å
826	G	93.2	Very high	87.9	Confident	3 Å²	3	56 Å²	56	3%	0.031	31%	0.306	C	S	.	.	S	Bend	trans	-73.1	-13.1	178.8	0	0	0	0	0	114.3	C806 F807 Y906 R907	C806-G826 PolarHBondContact O-N 2.73Å; F807-G826 VanDerWaalsContact C-CA 3.48Å; G826-Y906 CarbonylContact O-C 3.47Å; G826-Y906 WeakPolarHBondContact O-CA 3.39Å; G826-R907 PolarHBondContact O-N 3.12Å
827	I	91.5	Very high	87.4	Confident	31 Å²	31	55.5 Å²	55.5	16%	0.159	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	116.5	172.7	-52.1	176.1	0	0	0	107.8	M805 D825 Y829 R907 A909	M805-I827 HydrophobicContact SD-CB 3.98Å; D825-I827 PolarHBondContact O-N 2.74Å; I827-Y829 HydrophobicContact CB-CE2 3.91Å; I827-Y829 HydrophobicContact CG2-CD2 4.26Å; I827-Y829 HydrophobicContact CG2-CE1 4.47Å; I827-Y829 HydrophobicContact CG2-CE2 3.54Å; I827-Y829 WeakPolarHBondContact O-CD2 3.43Å; I827-Y829 WeakPolarHBondContact O-CE2 3.46Å; I827-R907 WeakPolarHBondContact CA-O 3.28Å; I827-R907 HydrophobicContact CG1-CB 4.41Å; I827-A909 HydrophobicContact CG2-CB 4.09Å
828	L	91.7	Very high	86.8	Confident	12 Å²	12	55.8 Å²	55.8	6%	0.063	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	136.9	177.5	-56.3	-179.2	0	0	0	109.6	P823 V841 F843 L877 W881 L887 Y906 R907 L908 A909	P823-L828 HydrophobicContact CB-CD2 3.94Å; P823-L828 HydrophobicContact CG-CD2 3.98Å; L828-V841 HydrophobicContact CD1-CG1 4.39Å; L828-F843 HydrophobicContact CD1-CZ 4.49Å; L828-L877 HydrophobicContact CB-CD1 4.3Å; L828-L877 HydrophobicContact CD1-CD1 3.77Å; L828-W881 HydrophobicContact CB-CH2 4.02Å; L828-W881 WeakPolarHBondContact O-CZ3 3.23Å; L828-L887 HydrophobicContact CD1-CD2 3.51Å; L828-Y906 HydrophobicContact CD1-CD1 4.26Å; L828-Y906 HydrophobicContact CD1-CG 4.48Å; L828-Y906 HydrophobicContact CD2-CD1 4.21Å; L828-Y906 HydrophobicContact CG-CD1 4.15Å; L828-R907 PolarHBondContact N-O 3.34Å; L828-L908 HydrophobicContact CB-CD2 4.27Å; L828-A909 WeakPolarHBondContact O-CB 3.5Å; L828-A909 PolarHBondContact O-N 2.98Å
829	Y	87.6	Confident	86.4	Confident	76 Å²	76	56.6 Å²	56.6	30%	0.298	32%	0.316	S	S	.	.			trans	-113.1	146.5	-177.6	-69.6	-94.7	0	0	0	111	N801 M805 I827 W881 A909	N801-Y829 WeakPolarHBondContact ND2-CD1 3.23Å; N801-Y829 WeakPolarHBondContact ND2-CE1 3.42Å; M805-Y829 HydrophobicContact CE-CD2 4.16Å; M805-Y829 HydrophobicContact CE-CE2 3.61Å; M805-Y829 HydrophobicContact SD-CE2 4Å; I827-Y829 HydrophobicContact CB-CE2 3.91Å; I827-Y829 HydrophobicContact CG2-CD2 4.26Å; I827-Y829 HydrophobicContact CG2-CE1 4.47Å; I827-Y829 HydrophobicContact CG2-CE2 3.54Å; I827-Y829 WeakPolarHBondContact O-CD2 3.43Å; I827-Y829 WeakPolarHBondContact O-CE2 3.46Å; Y829-W881 VanDerWaalsContact C-CH2 3.41Å; Y829-A909 HydrophobicContact CD1-CB 3.41Å; Y829-A909 VanDerWaalsContact CD1-CB 3.41Å; Y829-A909 HydrophobicContact CE1-CB 3.55Å; Y829-A909 HydrophobicContact CG-CB 4Å
830	P	86.8	Confident	86.2	Confident	25 Å²	25	56 Å²	56	16%	0.162	32%	0.318	C	S	.	.			trans	-54.2	141.2	166.1	-17.5	26.3	0	0	0	110.5	W881 R911	P830-W881 HydrophobicContact CB-CD2 4.15Å; P830-W881 HydrophobicContact CB-CG 4.29Å; P830-W881 HydrophobicContact CB-CZ2 4.47Å; P830-W881 HydrophobicContact CG-CD2 3.72Å; P830-W881 HydrophobicContact CG-CE3 3.87Å; P830-W881 HydrophobicContact CG-CG 4.01Å; P830-W881 HydrophobicContact CG-CZ3 4.34Å; P830-R911 HydrophobicContact CB-CG 3.76Å; P830-R911 HydrophobicContact CG-CB 4.39Å; P830-R911 HydrophobicContact CG-CG 3.36Å
831	S	81.9	Confident	86	Confident	43 Å²	43	56.9 Å²	56.9	30%	0.301	32%	0.323	S	S	.	.			trans	-74.7	142.3	179	-174.8	0	0	0	0	111.5	S833 A838 D839	S831-S833 PolarHBondContact OG-N 3.39Å; S831-A838 WeakPolarHBondContact CB-O 3.47Å; S831-A838 PolarHBondContact OG-O 2.88Å; S831-D839 PolarHBondContact N-OD1 3.09Å
832	V	78	Confident	86	Confident	139 Å²	139	57.2 Å²	57.2	84%	0.842	33%	0.329	S	S	*	.	S	Bend	trans	-77.3	-16.2	174.8	-166.4	0	0	0	0	110.9
833	S	78.6	Confident	86	Confident	45 Å²	45	55.2 Å²	55.2	32%	0.315	32%	0.317	S	S	.	.			trans	-78.3	140.6	179.7	176.8	0	0	0	0	111.1	S831 Q835 A838	S831-S833 PolarHBondContact OG-N 3.39Å; S833-Q835 VanDerWaalsContact C-N 3.27Å; S833-Q835 WeakPolarHBondContact OG-CB 3.47Å; S833-Q835 VanDerWaalsContact OG-CG 3.32Å; S833-Q835 WeakPolarHBondContact OG-CG 3.49Å; S833-Q835 PolarHBondContact OG-N 3.09Å; S833-Q835 VanDerWaalsContact OG-N 3.14Å; S833-A838 WeakPolarHBondContact O-CB 3.45Å
834	N	72.5	Confident	86.2	Confident	173 Å²	173	60.2 Å²	60.2	93%	0.925	33%	0.334	S	S	*	.			trans	-87.1	9.4	170.8	-76.8	-19.4	0	0	0	113.1
835	Q	78	Confident	86.4	Confident	128 Å²	128	58.1 Å²	58.1	60%	0.598	32%	0.324	S	S	*	.	S	Bend	trans	-63.9	150.5	176.9	-73.6	174.8	-13.8	0	0	111.5	S833 T837 A838	S833-Q835 VanDerWaalsContact C-N 3.27Å; S833-Q835 WeakPolarHBondContact OG-CB 3.47Å; S833-Q835 VanDerWaalsContact OG-CG 3.32Å; S833-Q835 WeakPolarHBondContact OG-CG 3.49Å; S833-Q835 PolarHBondContact OG-N 3.09Å; S833-Q835 VanDerWaalsContact OG-N 3.14Å; Q835-T837 PolarHBondContact O-N 3.27Å; Q835-T837 VanDerWaalsContact O-N 3.16Å; Q835-A838 HydrophobicContact CB-CB 4.34Å; Q835-A838 WeakPolarHBondContact O-CB 3.4Å; Q835-A838 PolarHBondContact O-N 3.47Å
836	P	68.1	Low	86.6	Confident	130 Å²	130	56 Å²	56	84%	0.844	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-34.2	-179.2	-22.6	31.6	0	0	0	113.5	A838	P836-A838 VanDerWaalsContact C-N 3.33Å
837	T	74	Confident	86.7	Confident	92 Å²	92	56.1 Å²	56.1	56%	0.564	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	6.3	179.7	55	0	0	0	0	113.2	Q835 D839 T840	Q835-T837 PolarHBondContact O-N 3.27Å; Q835-T837 VanDerWaalsContact O-N 3.16Å; T837-D839 VanDerWaalsContact C-N 3.33Å; T837-D839 PolarHBondContact O-N 3.02Å; T837-T840 VanDerWaalsContact O-CB 3.32Å; T837-T840 WeakPolarHBondContact O-CB 3.15Å; T837-T840 PolarHBondContact O-N 2.62Å; T837-T840 PolarHBondContact O-OG1 2.82Å
838	A	78.5	Confident	86.7	Confident	17 Å²	17	57.1 Å²	57.1	14%	0.14	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-42.3	-170.4	0	0	0	0	0	112.4	S831 S833 Q835 P836 T840	S831-A838 WeakPolarHBondContact CB-O 3.47Å; S831-A838 PolarHBondContact OG-O 2.88Å; S833-A838 WeakPolarHBondContact O-CB 3.45Å; Q835-A838 HydrophobicContact CB-CB 4.34Å; Q835-A838 WeakPolarHBondContact O-CB 3.4Å; Q835-A838 PolarHBondContact O-N 3.47Å; P836-A838 VanDerWaalsContact C-N 3.33Å; A838-T840 VanDerWaalsContact C-N 3.26Å; A838-T840 PolarHBondContact O-N 3.42Å
839	D	87	Confident	86.5	Confident	16 Å²	16	62.1 Å²	62.1	9%	0.086	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	13.7	178.6	-70.4	-53.9	0	0	0	113.2	S831 T837 L877 K878 W881 R911	S831-D839 PolarHBondContact N-OD1 3.09Å; T837-D839 VanDerWaalsContact C-N 3.33Å; T837-D839 PolarHBondContact O-N 3.02Å; D839-L877 PolarHBondContact O-N 3.5Å; D839-K878 HydrophobicContact CB-CB 3.79Å; D839-K878 HydrophobicContact CB-CG 4.48Å; D839-W881 PolarHBondContact OD1-NE1 3.41Å; D839-R911 IonicContact OD2-NH2 3.45Å; D839-R911 PolarHBondContact OD2-NH2 3.22Å
840	T	92.5	Very high	86.7	Confident	39 Å²	39	58.7 Å²	58.7	24%	0.239	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120.2	175.8	-52.7	0	0	0	0	110.3	T837 A838 Q874 V875	T837-T840 VanDerWaalsContact O-CB 3.32Å; T837-T840 WeakPolarHBondContact O-CB 3.15Å; T837-T840 PolarHBondContact O-N 2.62Å; T837-T840 PolarHBondContact O-OG1 2.82Å; A838-T840 VanDerWaalsContact C-N 3.26Å; A838-T840 PolarHBondContact O-N 3.42Å; T840-Q874 HydrophobicContact CG2-CB 3.62Å; T840-Q874 HydrophobicContact CG2-CG 4.39Å; T840-V875 CarbonylContact C-O 3.54Å; T840-V875 WeakPolarHBondContact CA-O 3.43Å
841	V	93.9	Very high	87	Confident	21 Å²	21	62.8 Å²	62.8	13%	0.127	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124.2	-178.6	-178.7	0	0	0	0	110.2	P823 L828 F843 V875 L877	P823-V841 HydrophobicContact CB-CG1 4.02Å; P823-V841 HydrophobicContact CG-CG1 3.76Å; L828-V841 HydrophobicContact CD1-CG1 4.39Å; V841-F843 HydrophobicContact CB-CE2 4.2Å; V841-F843 HydrophobicContact CG1-CD2 4.32Å; V841-F843 HydrophobicContact CG1-CE2 3.89Å; V841-F843 PolarHBondContact O-N 3.4Å; V841-V875 PolarHBondContact N-O 3.33Å; V841-V875 PolarHBondContact O-N 3.19Å; V841-L877 HydrophobicContact CB-CD1 4.34Å; V841-L877 HydrophobicContact CG2-CD1 3.55Å; V841-L877 HydrophobicContact CG2-CG 4.15Å
842	P	95.4	Very high	87.7	Confident	54 Å²	54	61.7 Å²	61.7	35%	0.351	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.4	176.5	29.8	-33	0	0	0	110.9	T822 P823	T822-P842 CarbonylContact C-O 3.58Å; T822-P842 HydrophobicContact CG2-CB 4.39Å; T822-P842 HydrophobicContact CG2-CG 4.48Å; T822-P842 WeakPolarHBondContact CG2-O 3.34Å; T822-P842 PolarHBondContact OG1-O 3.47Å; P823-P842 WeakPolarHBondContact CD-O 3.45Å
843	F	97.8	Very high	88.6	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.009	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.1	168.4	-78.2	-99.2	0	0	0	109.7	T822 P823 L828 V841 V855 L864 T872 G873 V875 L887 L889 Y906	T822-F843 CarbonylContact O-C 3.59Å; T822-F843 WeakPolarHBondContact O-CA 3.43Å; P823-F843 HydrophobicContact CG-CD1 4.38Å; P823-F843 HydrophobicContact CG-CE1 3.94Å; P823-F843 HydrophobicContact CG-CE2 4.31Å; P823-F843 HydrophobicContact CG-CZ 3.9Å; L828-F843 HydrophobicContact CD1-CZ 4.49Å; V841-F843 HydrophobicContact CB-CE2 4.2Å; V841-F843 HydrophobicContact CG1-CD2 4.32Å; V841-F843 HydrophobicContact CG1-CE2 3.89Å; V841-F843 PolarHBondContact O-N 3.4Å; F843-V855 HydrophobicContact CB-CG2 4.45Å; F843-V855 HydrophobicContact CD1-CG2 3.72Å; F843-V855 HydrophobicContact CD2-CG2 4.05Å; F843-V855 HydrophobicContact CE1-CG2 3.9Å; F843-V855 HydrophobicContact CE2-CG1 4.3Å; F843-V855 HydrophobicContact CE2-CG2 4.22Å; F843-V855 HydrophobicContact CG-CG2 3.8Å; F843-V855 HydrophobicContact CZ-CG1 4.13Å; F843-V855 HydrophobicContact CZ-CG2 4.15Å; F843-L864 HydrophobicContact CB-CD1 4.07Å; F843-L864 HydrophobicContact CB-CD2 4.11Å; F843-T872 CarbonylContact O-C 3.5Å; F843-T872 VanDerWaalsContact O-CA 3.28Å; F843-T872 WeakPolarHBondContact O-CA 3.33Å; F843-G873 PolarHBondContact N-O 3.48Å; F843-G873 PolarHBondContact O-N 3.38Å; F843-V875 HydrophobicContact CD2-CB 4.02Å; F843-V875 HydrophobicContact CD2-CG2 3.5Å; F843-V875 VanDerWaalsContact CD2-CG2 3.5Å; F843-V875 HydrophobicContact CE2-CB 3.95Å; F843-V875 HydrophobicContact CE2-CG2 3.78Å; F843-V875 HydrophobicContact CG-CG2 4.39Å; F843-L887 HydrophobicContact CE1-CD1 4.22Å; F843-L887 HydrophobicContact CZ-CD1 3.76Å; F843-L887 HydrophobicContact CZ-CD2 4.43Å; F843-L889 HydrophobicContact CD1-CD1 4.43Å; F843-Y906 AromaticContact CE1-CE2 3.92Å; F843-Y906 HydrophobicContact CE1-CE2 3.92Å; F843-Y906 AromaticContact CE1-CZ 3.97Å
844	R	97.9	Very high	89.5	Confident	116 Å²	116	53 Å²	53	44%	0.438	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	116.1	171.8	-178.4	177.6	-179.4	-153.2	0.9	109.1	H821 T822 C870 W871 T872	H821-R844 WeakPolarHBondContact CA-O 3.41Å; H821-R844 HydrophobicContact CB-CB 3.95Å; H821-R844 HydrophobicContact CB-CG 3.75Å; H821-R844 VanDerWaalsContact CB-O 3.28Å; H821-R844 WeakPolarHBondContact CB-O 3.26Å; H821-R844 PolarHBondContact N-O 3.39Å; T822-R844 HydrophobicContact CG2-CB 3.67Å; T822-R844 PolarHBondContact N-O 3.15Å; T822-R844 VanDerWaalsContact N-O 3.14Å; T822-R844 PolarHBondContact O-N 2.9Å; R844-C870 HydrophobicContact CG-CB 4.42Å; R844-W871 VanDerWaalsContact CA-O 3.28Å; R844-W871 WeakPolarHBondContact CA-O 3.45Å; R844-T872 HydrophobicContact CB-CG2 4.19Å; R844-T872 HydrophobicContact CG-CG2 3.8Å
845	V	97.4	Very high	90.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	147	-175.5	-65.6	0	0	0	0	110.9	Y819 L820 I847 V853 L864 C870 W871 L889	Y819-V845 CarbonylContact O-C 3.52Å; Y819-V845 WeakPolarHBondContact O-CA 3.4Å; L820-V845 HydrophobicContact CD1-CG1 3.45Å; L820-V845 VanDerWaalsContact CD1-CG1 3.45Å; V845-I847 HydrophobicContact CB-CD1 4.3Å; V845-I847 HydrophobicContact CB-CG1 4.34Å; V845-I847 HydrophobicContact CG2-CD1 3.58Å; V845-I847 HydrophobicContact CG2-CG1 4.05Å; V845-V853 HydrophobicContact CG2-CG1 4.36Å; V845-L864 HydrophobicContact CG2-CD1 4.23Å; V845-C870 CarbonylContact O-C 3.57Å; V845-C870 WeakPolarHBondContact O-CA 3.5Å; V845-W871 HydrophobicContact CG2-CB 3.88Å; V845-W871 PolarHBondContact N-O 2.88Å; V845-W871 PolarHBondContact O-N 3.43Å; V845-L889 HydrophobicContact CB-CD2 4.47Å; V845-L889 HydrophobicContact CG1-CD2 3.84Å; V845-L889 HydrophobicContact CG2-CD2 4.25Å
846	T	96.8	Very high	91.6	Very high	13 Å²	13	39.6 Å²	39.6	8%	0.08	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	118.2	167.8	-62.9	0	0	0	0	107.1	C818 Y819 H821 D869	C818-T846 CarbonylContact C-O 3.54Å; C818-T846 VanDerWaalsContact CA-O 3.24Å; C818-T846 WeakPolarHBondContact CA-O 3.49Å; Y819-T846 PolarHBondContact N-O 3.41Å; Y819-T846 PolarHBondContact O-N 3.43Å; H821-T846 PolarHBondContact NE2-OG1 3.46Å; T846-D869 WeakPolarHBondContact CG2-O 2.97Å; T846-D869 PolarHBondContact OG1-O 3.45Å
847	I	95.6	Very high	92.9	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.031	19%	0.189	C	C	.	.			trans	-127.6	101	178.5	-61.4	162.3	0	0	0	105.8	C818 V845 A850 V853 L889 A891 Y893 L903	C818-I847 HydrophobicContact CB-CG1 4.45Å; V845-I847 HydrophobicContact CB-CD1 4.3Å; V845-I847 HydrophobicContact CB-CG1 4.34Å; V845-I847 HydrophobicContact CG2-CD1 3.58Å; V845-I847 HydrophobicContact CG2-CG1 4.05Å; I847-A850 HydrophobicContact CB-CB 4.2Å; I847-A850 HydrophobicContact CG2-CB 3.59Å; I847-V853 HydrophobicContact CB-CG2 4.43Å; I847-V853 HydrophobicContact CD1-CB 4.31Å; I847-V853 HydrophobicContact CD1-CG1 3.63Å; I847-V853 HydrophobicContact CD1-CG2 3.63Å; I847-L889 HydrophobicContact CD1-CD2 4.41Å; I847-A891 HydrophobicContact CD1-CB 4.47Å; I847-A891 HydrophobicContact CG2-CB 4.2Å; I847-Y893 HydrophobicContact CG2-CE1 4.2Å; I847-L903 HydrophobicContact CD1-CD1 3.42Å; I847-L903 VanDerWaalsContact CD1-CD1 3.42Å; I847-L903 HydrophobicContact CG1-CD1 3.85Å; I847-L903 HydrophobicContact CG2-CD1 3.97Å
848	P	90	Very high	93.8	Very high	52 Å²	52	30.6 Å²	30.6	34%	0.338	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	150.3	176.9	-23.3	34.1	0	0	0	110.9	G817 A850	G817-P848 WeakPolarHBondContact O-CD 3.38Å; G817-P848 WeakPolarHBondContact O-CG 3.35Å; P848-A850 PolarHBondContact O-N 2.91Å
849	T	87.9	Confident	94.4	Very high	117 Å²	117	38.2 Å²	38.2	72%	0.718	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	-5.9	174.3	71	0	0	0	0	117.8
850	A	93.1	Very high	94.8	Very high	5 Å²	5	41.6 Å²	41.6	4%	0.041	23%	0.229	C	C	.	.			trans	-63.6	140.1	174.9	0	0	0	0	0	111.9	I847 P848 V853 W871 A891 Y893	I847-A850 HydrophobicContact CB-CB 4.2Å; I847-A850 HydrophobicContact CG2-CB 3.59Å; P848-A850 PolarHBondContact O-N 2.91Å; A850-V853 HydrophobicContact CB-CG2 3.94Å; A850-W871 HydrophobicContact CB-CZ2 4.3Å; A850-W871 WeakPolarHBondContact O-CZ2 3.2Å; A850-A891 HydrophobicContact CB-CB 4.26Å; A850-Y893 HydrophobicContact CB-CD1 4.49Å; A850-Y893 HydrophobicContact CB-CE1 4.28Å
851	H	93.1	Very high	95	Very high	110 Å²	110	45.4 Å²	45.4	51%	0.509	24%	0.239	S	C	.	.	S	Bend	trans	-93.6	-31	174.3	-69.7	91.8	0	0	0	112.1	W871 K892 Y893 V895	H851-W871 WeakPolarHBondContact O-CH2 3.48Å; H851-K892 PolarHBondContact N-O 2.98Å; H851-Y893 PolarHBondContact CE1-O 2.93Å; H851-Y893 PolarHBondContact ND1-O 3.39Å; H851-V895 HydrophobicContact CB-CG2 4.47Å; H851-V895 WeakPolarHBondContact CD2-CG2 3.31Å; H851-V895 WeakPolarHBondContact NE2-CG2 3.48Å
852	A	94.9	Very high	95.1	Very high	21 Å²	21	46.6 Å²	46.6	17%	0.174	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	148.3	173.4	0	0	0	0	0	110.2	A891 K892 Y900	A852-A891 WeakPolarHBondContact O-CA 3.39Å; A852-K892 HydrophobicContact CB-CB 4.26Å; A852-K892 PolarHBondContact N-O 3.11Å; A852-K892 PolarHBondContact O-N 3.22Å; A852-Y900 HydrophobicContact CB-CE1 4.21Å
853	V	97.1	Very high	95.2	Very high	1 Å²	1	49 Å²	49	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	135	176.9	-180	0	0	0	0	108.1	V845 I847 A850 L864 W871 L889 C890 A891	V845-V853 HydrophobicContact CG2-CG1 4.36Å; I847-V853 HydrophobicContact CB-CG2 4.43Å; I847-V853 HydrophobicContact CD1-CB 4.31Å; I847-V853 HydrophobicContact CD1-CG1 3.63Å; I847-V853 HydrophobicContact CD1-CG2 3.63Å; A850-V853 HydrophobicContact CB-CG2 3.94Å; V853-L864 HydrophobicContact CG1-CD1 3.78Å; V853-L864 HydrophobicContact CG1-CG 4.28Å; V853-L864 PolarHBondContact O-N 3.14Å; V853-W871 HydrophobicContact CB-CB 4.29Å; V853-W871 HydrophobicContact CB-CD2 3.83Å; V853-W871 HydrophobicContact CB-CE3 3.92Å; V853-W871 HydrophobicContact CB-CG 4Å; V853-W871 HydrophobicContact CG1-CB 4.47Å; V853-W871 HydrophobicContact CG2-CB 4.38Å; V853-W871 HydrophobicContact CG2-CD2 3.47Å; V853-W871 VanDerWaalsContact CG2-CD2 3.47Å; V853-W871 HydrophobicContact CG2-CE3 3.98Å; V853-W871 HydrophobicContact CG2-CG 3.64Å; V853-W871 HydrophobicContact CG2-CZ2 4.12Å; V853-W871 HydrophobicContact CG2-CZ3 4.49Å; V853-L889 HydrophobicContact CG1-CD1 3.76Å; V853-L889 HydrophobicContact CG1-CG 4.48Å; V853-C890 WeakPolarHBondContact CA-O 3.41Å; V853-A891 HydrophobicContact CG2-CB 4.24Å
854	A	97.2	Very high	95.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	151.9	-179.6	0	0	0	0	0	111.4	W861 T862 C890 Y900	A854-W861 HydrophobicContact CB-CE3 3.73Å; A854-W861 HydrophobicContact CB-CZ3 4.19Å; A854-T862 CarbonylContact C-O 3.52Å; A854-T862 WeakPolarHBondContact CA-O 3.47Å; A854-C890 PolarHBondContact N-O 3Å; A854-C890 PolarHBondContact O-N 3.26Å; A854-Y900 HydrophobicContact CB-CE1 4.42Å
855	V	97.8	Very high	95.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.5	167.1	177.6	0	0	0	0	108.1	F843 V857 T862 L864 V875 L887 A888 L889	F843-V855 HydrophobicContact CB-CG2 4.45Å; F843-V855 HydrophobicContact CD1-CG2 3.72Å; F843-V855 HydrophobicContact CD2-CG2 4.05Å; F843-V855 HydrophobicContact CE1-CG2 3.9Å; F843-V855 HydrophobicContact CE2-CG1 4.3Å; F843-V855 HydrophobicContact CE2-CG2 4.22Å; F843-V855 HydrophobicContact CG-CG2 3.8Å; F843-V855 HydrophobicContact CZ-CG1 4.13Å; F843-V855 HydrophobicContact CZ-CG2 4.15Å; V855-V857 HydrophobicContact CG1-CG2 4.39Å; V855-T862 PolarHBondContact N-O 3.42Å; V855-T862 PolarHBondContact O-N 3.26Å; V855-L864 HydrophobicContact CG2-CD2 4.2Å; V855-V875 HydrophobicContact CB-CG2 3.84Å; V855-V875 HydrophobicContact CG1-CG1 4.13Å; V855-V875 HydrophobicContact CG1-CG2 4.02Å; V855-V875 HydrophobicContact CG2-CG2 3.95Å; V855-L887 HydrophobicContact CG1-CD1 3.8Å; V855-A888 CarbonylContact C-O 3.49Å; V855-A888 WeakPolarHBondContact CA-O 3.35Å; V855-L889 HydrophobicContact CG2-CD1 3.82Å
856	V	97.2	Very high	95	Very high	19 Å²	19	53.9 Å²	53.9	12%	0.115	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.5	-175.2	-170.6	0	0	0	0	109.4	D860 W861 L887 A888 C890	V856-D860 WeakPolarHBondContact CA-O 3.31Å; V856-W861 HydrophobicContact CG1-CD2 4.3Å; V856-W861 HydrophobicContact CG1-CZ2 4.24Å; V856-W861 HydrophobicContact CG2-CD2 3.58Å; V856-W861 HydrophobicContact CG2-CE3 3.52Å; V856-W861 HydrophobicContact CG2-CG 4.27Å; V856-W861 HydrophobicContact CG2-CH2 3.79Å; V856-W861 HydrophobicContact CG2-CZ2 3.85Å; V856-W861 HydrophobicContact CG2-CZ3 3.62Å; V856-L887 CarbonylContact O-C 3.54Å; V856-L887 VanDerWaalsContact O-CA 3.28Å; V856-L887 WeakPolarHBondContact O-CA 3.45Å; V856-L887 WeakPolarHBondContact O-CB 3.36Å; V856-A888 PolarHBondContact N-O 2.96Å; V856-A888 PolarHBondContact O-N 2.92Å; V856-C890 HydrophobicContact CG2-CB 4.44Å
857	V	96.1	Very high	94.9	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	113.2	177	-164.1	0	0	0	0	107.9	V855 E859 D860 L877 Y880 E884 L887 L908	V855-V857 HydrophobicContact CG1-CG2 4.39Å; V857-E859 PolarHBondContact O-N 3.39Å; V857-D860 PolarHBondContact N-O 2.97Å; V857-D860 PolarHBondContact O-N 2.96Å; V857-L877 HydrophobicContact CG2-CD2 4.07Å; V857-Y880 HydrophobicContact CB-CD1 4.3Å; V857-Y880 HydrophobicContact CB-CD2 4.02Å; V857-Y880 HydrophobicContact CB-CE1 4.25Å; V857-Y880 HydrophobicContact CB-CE2 3.98Å; V857-Y880 HydrophobicContact CB-CG 4.2Å; V857-Y880 HydrophobicContact CG1-CD1 3.74Å; V857-Y880 HydrophobicContact CG1-CD2 3.58Å; V857-Y880 HydrophobicContact CG1-CE1 4.2Å; V857-Y880 HydrophobicContact CG1-CE2 4.07Å; V857-Y880 HydrophobicContact CG1-CG 3.42Å; V857-Y880 VanDerWaalsContact CG1-CG 3.42Å; V857-Y880 HydrophobicContact CG2-CD2 4.28Å; V857-Y880 HydrophobicContact CG2-CE2 4.19Å; V857-E884 HydrophobicContact CG1-CB 4.12Å; V857-E884 HydrophobicContact CG1-CG 4.1Å; V857-L887 HydrophobicContact CB-CB 4.39Å; V857-L887 HydrophobicContact CG1-CB 4.36Å; V857-L887 HydrophobicContact CG2-CB 3.73Å; V857-L908 HydrophobicContact CG1-CD1 4.05Å
858	G	92.2	Very high	94.6	Very high	33 Å²	33	63.4 Å²	63.4	34%	0.34	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-120.2	-169.2	0	0	0	0	0	111.1
859	E	91.7	Very high	94.7	Very high	177 Å²	177	64.3 Å²	64.3	83%	0.827	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-4.9	176.6	-61	-63.3	154.3	0	0	113.4	V857	V857-E859 PolarHBondContact O-N 3.39Å
860	D	95.1	Very high	95	Very high	86 Å²	86	59 Å²	59	46%	0.46	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	129.9	-171.6	-71.3	-46.2	0	0	0	112.3	V856 V857 Y880	V856-D860 WeakPolarHBondContact CA-O 3.31Å; V857-D860 PolarHBondContact N-O 2.97Å; V857-D860 PolarHBondContact O-N 2.96Å; D860-Y880 HydrophobicContact CB-CE1 4.32Å; D860-Y880 WeakPolarHBondContact CB-OH 3.29Å; D860-Y880 WeakPolarHBondContact OD2-CE1 3.23Å; D860-Y880 PolarHBondContact OD2-OH 3.34Å
861	W	95.8	Very high	95.2	Very high	119 Å²	119	59.5 Å²	59.5	45%	0.451	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.4	-178.4	-70	67.2	0	0	0	111.2	A854 V856 Y900	A854-W861 HydrophobicContact CB-CE3 3.73Å; A854-W861 HydrophobicContact CB-CZ3 4.19Å; V856-W861 HydrophobicContact CG1-CD2 4.3Å; V856-W861 HydrophobicContact CG1-CZ2 4.24Å; V856-W861 HydrophobicContact CG2-CD2 3.58Å; V856-W861 HydrophobicContact CG2-CE3 3.52Å; V856-W861 HydrophobicContact CG2-CG 4.27Å; V856-W861 HydrophobicContact CG2-CH2 3.79Å; V856-W861 HydrophobicContact CG2-CZ2 3.85Å; V856-W861 HydrophobicContact CG2-CZ3 3.62Å; W861-Y900 HydrophobicContact CH2-CD1 4.48Å; W861-Y900 HydrophobicContact CH2-CD2 4.06Å; W861-Y900 AromaticContact CH2-CG 3.93Å; W861-Y900 HydrophobicContact CH2-CG 3.93Å; W861-Y900 AromaticContact CZ3-CD1 3.8Å; W861-Y900 HydrophobicContact CZ3-CD1 3.8Å; W861-Y900 AromaticContact CZ3-CD2 3.87Å; W861-Y900 HydrophobicContact CZ3-CD2 3.87Å; W861-Y900 HydrophobicContact CZ3-CE1 4.11Å; W861-Y900 HydrophobicContact CZ3-CE2 4.17Å; W861-Y900 AromaticContact CZ3-CG 3.67Å; W861-Y900 HydrophobicContact CZ3-CG 3.67Å
862	T	96.7	Very high	95.5	Very high	46 Å²	46	56.2 Å²	56.2	28%	0.282	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	103.9	172.9	-54.9	0	0	0	0	110.3	A854 V855 V875	A854-T862 CarbonylContact C-O 3.52Å; A854-T862 WeakPolarHBondContact CA-O 3.47Å; V855-T862 PolarHBondContact N-O 3.42Å; V855-T862 PolarHBondContact O-N 3.26Å; T862-V875 HydrophobicContact CG2-CG2 4.07Å
863	H	96.8	Very high	95.5	Very high	106 Å²	106	56.1 Å²	56.1	49%	0.491	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	135	177.7	-68.2	80.6	0	0	0	112.3	Y900	H863-Y900 PolarHBondContact NE2-OH 3.01Å
864	L	97.6	Very high	95.4	Very high	9 Å²	9	61.8 Å²	61.8	5%	0.047	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-87.1	146.2	176.6	-53	-172.8	0	0	0	110.5	F843 V845 V853 V855 W871 L889	F843-L864 HydrophobicContact CB-CD1 4.07Å; F843-L864 HydrophobicContact CB-CD2 4.11Å; V845-L864 HydrophobicContact CG2-CD1 4.23Å; V853-L864 HydrophobicContact CG1-CD1 3.78Å; V853-L864 HydrophobicContact CG1-CG 4.28Å; V853-L864 PolarHBondContact O-N 3.14Å; V855-L864 HydrophobicContact CG2-CD2 4.2Å; L864-W871 HydrophobicContact CB-CB 4.1Å; L864-W871 HydrophobicContact CB-CE3 4.46Å; L864-W871 HydrophobicContact CD1-CB 4.17Å; L864-L889 HydrophobicContact CD1-CD1 4.09Å
865	S	97.4	Very high	95.3	Very high	81 Å²	81	61.9 Å²	61.9	57%	0.566	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.1	176.1	-64.7	0	0	0	0	110.6	T872	S865-T872 PolarHBondContact N-O 2.91Å; S865-T872 PolarHBondContact O-N 3.34Å; S865-T872 PolarHBondContact O-OG1 2.68Å
866	K	95.7	Very high	95.1	Very high	129 Å²	129	64.8 Å²	64.8	56%	0.561	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	120.8	175.8	-165.7	176.7	-174.7	173.2	0	110.5	C870 W871	K866-C870 CarbonylContact C-O 3.58Å; K866-C870 WeakPolarHBondContact CA-O 3.32Å; K866-W871 HydrophobicContact CB-CD2 4.16Å; K866-W871 HydrophobicContact CB-CE3 3.86Å; K866-W871 HydrophobicContact CB-CH2 3.96Å; K866-W871 HydrophobicContact CB-CZ2 4.25Å; K866-W871 HydrophobicContact CB-CZ3 3.77Å; K866-W871 HydrophobicContact CD-CH2 4.04Å; K866-W871 HydrophobicContact CD-CZ2 3.75Å; K866-W871 HydrophobicContact CG-CD2 4.3Å; K866-W871 HydrophobicContact CG-CE3 4.49Å; K866-W871 HydrophobicContact CG-CH2 4.35Å; K866-W871 HydrophobicContact CG-CZ2 4.16Å
867	V	93	Very high	94.9	Very high	74 Å²	74	63.9 Å²	63.9	45%	0.448	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	108.9	174	-177.8	0	0	0	0	107.7	D869 C870 T872	V867-D869 PolarHBondContact O-N 3.02Å; V867-C870 CarbonylContact C-O 3.58Å; V867-C870 PolarHBondContact N-O 2.95Å; V867-C870 PolarHBondContact O-N 3.18Å; V867-C870 VanDerWaalsContact O-O 3.07Å; V867-T872 WeakPolarHBondContact CG2-OG1 3.47Å
868	N	90.6	Very high	94.6	Very high	146 Å²	146	70.5 Å²	70.5	78%	0.781	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	-120.9	-171.8	-56	-34.6	0	0	0	111.8
869	D	91	Very high	94.5	Very high	71 Å²	71	72.5 Å²	72.5	38%	0.38	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	0.4	176.7	68.4	-29.8	0	0	0	113.2	R751 T846 V867	R751-D869 IonicContact CZ-OD2 3.24Å; R751-D869 IonicContact NH1-OD2 3.26Å; R751-D869 IonicContact NH2-OD2 3.19Å; R751-D869 PolarHBondContact NH2-OD2 3.08Å; T846-D869 WeakPolarHBondContact CG2-O 2.97Å; T846-D869 PolarHBondContact OG1-O 3.45Å; V867-D869 PolarHBondContact O-N 3.02Å
870	C	95.5	Very high	94.5	Very high	4 Å²	4	65.7 Å²	65.7	3%	0.027	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.2	-175.4	-64.9	0	0	0	0	111.5	R844 V845 K866 V867 T872	R844-C870 HydrophobicContact CG-CB 4.42Å; V845-C870 CarbonylContact O-C 3.57Å; V845-C870 WeakPolarHBondContact O-CA 3.5Å; K866-C870 CarbonylContact C-O 3.58Å; K866-C870 WeakPolarHBondContact CA-O 3.32Å; V867-C870 CarbonylContact C-O 3.58Å; V867-C870 PolarHBondContact N-O 2.95Å; V867-C870 PolarHBondContact O-N 3.18Å; V867-C870 VanDerWaalsContact O-O 3.07Å; C870-T872 HydrophobicContact CB-CG2 4.39Å
871	W	97.6	Very high	94.3	Very high	16 Å²	16	62.7 Å²	62.7	6%	0.061	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	123.2	164.8	-63.2	90.5	0	0	0	108.3	R844 V845 A850 H851 V853 L864 K866	R844-W871 VanDerWaalsContact CA-O 3.28Å; R844-W871 WeakPolarHBondContact CA-O 3.45Å; V845-W871 HydrophobicContact CG2-CB 3.88Å; V845-W871 PolarHBondContact N-O 2.88Å; V845-W871 PolarHBondContact O-N 3.43Å; A850-W871 HydrophobicContact CB-CZ2 4.3Å; A850-W871 WeakPolarHBondContact O-CZ2 3.2Å; H851-W871 WeakPolarHBondContact O-CH2 3.48Å; V853-W871 HydrophobicContact CB-CB 4.29Å; V853-W871 HydrophobicContact CB-CD2 3.83Å; V853-W871 HydrophobicContact CB-CE3 3.92Å; V853-W871 HydrophobicContact CB-CG 4Å; V853-W871 HydrophobicContact CG1-CB 4.47Å; V853-W871 HydrophobicContact CG2-CB 4.38Å; V853-W871 HydrophobicContact CG2-CD2 3.47Å; V853-W871 VanDerWaalsContact CG2-CD2 3.47Å; V853-W871 HydrophobicContact CG2-CE3 3.98Å; V853-W871 HydrophobicContact CG2-CG 3.64Å; V853-W871 HydrophobicContact CG2-CZ2 4.12Å; V853-W871 HydrophobicContact CG2-CZ3 4.49Å; L864-W871 HydrophobicContact CB-CB 4.1Å; L864-W871 HydrophobicContact CB-CE3 4.46Å; L864-W871 HydrophobicContact CD1-CB 4.17Å; K866-W871 HydrophobicContact CB-CD2 4.16Å; K866-W871 HydrophobicContact CB-CE3 3.86Å; K866-W871 HydrophobicContact CB-CH2 3.96Å; K866-W871 HydrophobicContact CB-CZ2 4.25Å; K866-W871 HydrophobicContact CB-CZ3 3.77Å; K866-W871 HydrophobicContact CD-CH2 4.04Å; K866-W871 HydrophobicContact CD-CZ2 3.75Å; K866-W871 HydrophobicContact CG-CD2 4.3Å; K866-W871 HydrophobicContact CG-CE3 4.49Å; K866-W871 HydrophobicContact CG-CH2 4.35Å; K866-W871 HydrophobicContact CG-CZ2 4.16Å
872	T	97.7	Very high	93.9	Very high	42 Å²	42	59.3 Å²	59.3	26%	0.258	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.1	-175	54.8	0	0	0	0	111.5	F843 R844 S865 V867 C870	F843-T872 CarbonylContact O-C 3.5Å; F843-T872 VanDerWaalsContact O-CA 3.28Å; F843-T872 WeakPolarHBondContact O-CA 3.33Å; R844-T872 HydrophobicContact CB-CG2 4.19Å; R844-T872 HydrophobicContact CG-CG2 3.8Å; S865-T872 PolarHBondContact N-O 2.91Å; S865-T872 PolarHBondContact O-N 3.34Å; S865-T872 PolarHBondContact O-OG1 2.68Å; V867-T872 WeakPolarHBondContact CG2-OG1 3.47Å; C870-T872 HydrophobicContact CB-CG2 4.39Å
873	G	96	Very high	93.7	Very high	18 Å²	18	62.9 Å²	62.9	19%	0.186	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	169.2	172.4	0	0	0	0	0	112.3	F843	F843-G873 PolarHBondContact N-O 3.48Å; F843-G873 PolarHBondContact O-N 3.38Å
874	Q	95	Very high	93.5	Very high	121 Å²	121	61 Å²	61	57%	0.565	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	119.1	-178	-66.6	-63.7	-21.8	0	0	107.8	T840	T840-Q874 HydrophobicContact CG2-CB 3.62Å; T840-Q874 HydrophobicContact CG2-CG 4.39Å
875	V	94.7	Very high	93.3	Very high	1 Å²	1	65 Å²	65	1%	0.006	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.5	-175.8	-177.4	0	0	0	0	108.9	T840 V841 F843 V855 T862 L877	T840-V875 CarbonylContact C-O 3.54Å; T840-V875 WeakPolarHBondContact CA-O 3.43Å; V841-V875 PolarHBondContact N-O 3.33Å; V841-V875 PolarHBondContact O-N 3.19Å; F843-V875 HydrophobicContact CD2-CB 4.02Å; F843-V875 HydrophobicContact CD2-CG2 3.5Å; F843-V875 VanDerWaalsContact CD2-CG2 3.5Å; F843-V875 HydrophobicContact CE2-CB 3.95Å; F843-V875 HydrophobicContact CE2-CG2 3.78Å; F843-V875 HydrophobicContact CG-CG2 4.39Å; V855-V875 HydrophobicContact CB-CG2 3.84Å; V855-V875 HydrophobicContact CG1-CG1 4.13Å; V855-V875 HydrophobicContact CG1-CG2 4.02Å; V855-V875 HydrophobicContact CG2-CG2 3.95Å; T862-V875 HydrophobicContact CG2-CG2 4.07Å; V875-L877 HydrophobicContact CG1-CD2 3.85Å; V875-L877 PolarHBondContact O-N 3.16Å
876	C	93.4	Very high	93.3	Very high	61 Å²	61	65.8 Å²	65.8	41%	0.412	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	113.1	177.5	-174.1	0	0	0	0	110.2	Y880	C876-Y880 WeakPolarHBondContact O-CE2 3.31Å
877	L	92.9	Very high	93.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.325	C	S	.	.			trans	-94.3	-3.2	-178.4	-62.6	-178.5	0	0	0	114.4	L828 D839 V841 V857 V875 P879 Y880 W881 L887 L908	L828-L877 HydrophobicContact CB-CD1 4.3Å; L828-L877 HydrophobicContact CD1-CD1 3.77Å; D839-L877 PolarHBondContact O-N 3.5Å; V841-L877 HydrophobicContact CB-CD1 4.34Å; V841-L877 HydrophobicContact CG2-CD1 3.55Å; V841-L877 HydrophobicContact CG2-CG 4.15Å; V857-L877 HydrophobicContact CG2-CD2 4.07Å; V875-L877 HydrophobicContact CG1-CD2 3.85Å; V875-L877 PolarHBondContact O-N 3.16Å; L877-P879 VanDerWaalsContact C-N 3.31Å; L877-Y880 HydrophobicContact CD2-CD2 4.09Å; L877-Y880 PolarHBondContact O-N 2.75Å; L877-W881 HydrophobicContact CB-CD2 4.47Å; L877-W881 HydrophobicContact CB-CH2 4.08Å; L877-W881 HydrophobicContact CB-CZ2 3.48Å; L877-W881 VanDerWaalsContact CB-CZ2 3.48Å; L877-W881 HydrophobicContact CD1-CH2 3.63Å; L877-W881 HydrophobicContact CD1-CZ2 3.78Å; L877-W881 HydrophobicContact CG-CZ2 4.29Å; L877-W881 PolarHBondContact O-N 2.88Å; L877-L887 HydrophobicContact CD1-CD2 4.16Å; L877-L887 HydrophobicContact CD2-CD2 3.94Å; L877-L908 HydrophobicContact CD1-CD2 3.92Å; L877-L908 HydrophobicContact CD2-CD2 4.49Å
878	K	89.7	Confident	93.5	Very high	141 Å²	141	57 Å²	57	61%	0.613	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-42.3	-178	-168.5	175.2	-179.9	178.7	0	114.4	D839 Y880	D839-K878 HydrophobicContact CB-CB 3.79Å; D839-K878 HydrophobicContact CB-CG 4.48Å; K878-Y880 VanDerWaalsContact C-N 3.32Å; K878-Y880 PolarHBondContact O-N 3Å
879	P	90.6	Very high	93.9	Very high	75 Å²	75	50 Å²	50	49%	0.487	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-22.4	-178.9	-17.5	33	0	0	0	114	L877 I883	L877-P879 VanDerWaalsContact C-N 3.31Å; P879-I883 VanDerWaalsContact O-CD1 3.31Å; P879-I883 WeakPolarHBondContact O-CD1 3.49Å
880	Y	92	Very high	94.2	Very high	33 Å²	33	47 Å²	47	13%	0.129	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-14.3	-166	-48.4	-66.5	0	0	0	113.7	V857 D860 C876 L877 K878 G882 I883 E884	V857-Y880 HydrophobicContact CB-CD1 4.3Å; V857-Y880 HydrophobicContact CB-CD2 4.02Å; V857-Y880 HydrophobicContact CB-CE1 4.25Å; V857-Y880 HydrophobicContact CB-CE2 3.98Å; V857-Y880 HydrophobicContact CB-CG 4.2Å; V857-Y880 HydrophobicContact CG1-CD1 3.74Å; V857-Y880 HydrophobicContact CG1-CD2 3.58Å; V857-Y880 HydrophobicContact CG1-CE1 4.2Å; V857-Y880 HydrophobicContact CG1-CE2 4.07Å; V857-Y880 HydrophobicContact CG1-CG 3.42Å; V857-Y880 VanDerWaalsContact CG1-CG 3.42Å; V857-Y880 HydrophobicContact CG2-CD2 4.28Å; V857-Y880 HydrophobicContact CG2-CE2 4.19Å; D860-Y880 HydrophobicContact CB-CE1 4.32Å; D860-Y880 WeakPolarHBondContact CB-OH 3.29Å; D860-Y880 WeakPolarHBondContact OD2-CE1 3.23Å; D860-Y880 PolarHBondContact OD2-OH 3.34Å; C876-Y880 WeakPolarHBondContact O-CE2 3.31Å; L877-Y880 HydrophobicContact CD2-CD2 4.09Å; L877-Y880 PolarHBondContact O-N 2.75Å; K878-Y880 VanDerWaalsContact C-N 3.32Å; K878-Y880 PolarHBondContact O-N 3Å; Y880-G882 PolarHBondContact O-N 3Å; Y880-G882 VanDerWaalsContact O-N 3.13Å; Y880-I883 PolarHBondContact O-N 2.91Å; Y880-E884 HydrophobicContact CD1-CG 4.1Å; Y880-E884 PolarHBondContact O-N 2.94Å
881	W	90.5	Very high	94.2	Very high	24 Å²	24	46.8 Å²	46.8	9%	0.091	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-57.6	118.1	-178.9	-64.6	131.3	0	0	0	112.2	L828 Y829 P830 D839 L877 I883 L908	L828-W881 HydrophobicContact CB-CH2 4.02Å; L828-W881 WeakPolarHBondContact O-CZ3 3.23Å; Y829-W881 VanDerWaalsContact C-CH2 3.41Å; P830-W881 HydrophobicContact CB-CD2 4.15Å; P830-W881 HydrophobicContact CB-CG 4.29Å; P830-W881 HydrophobicContact CB-CZ2 4.47Å; P830-W881 HydrophobicContact CG-CD2 3.72Å; P830-W881 HydrophobicContact CG-CE3 3.87Å; P830-W881 HydrophobicContact CG-CG 4.01Å; P830-W881 HydrophobicContact CG-CZ3 4.34Å; D839-W881 PolarHBondContact OD1-NE1 3.41Å; L877-W881 HydrophobicContact CB-CD2 4.47Å; L877-W881 HydrophobicContact CB-CH2 4.08Å; L877-W881 HydrophobicContact CB-CZ2 3.48Å; L877-W881 VanDerWaalsContact CB-CZ2 3.48Å; L877-W881 HydrophobicContact CD1-CH2 3.63Å; L877-W881 HydrophobicContact CD1-CZ2 3.78Å; L877-W881 HydrophobicContact CG-CZ2 4.29Å; L877-W881 PolarHBondContact O-N 2.88Å; W881-I883 PolarHBondContact O-N 2.88Å; W881-L908 HydrophobicContact CE3-CB 4.32Å; W881-L908 HydrophobicContact CE3-CD2 4.38Å; W881-L908 HydrophobicContact CH2-CD2 4.07Å; W881-L908 HydrophobicContact CZ3-CB 4.05Å; W881-L908 HydrophobicContact CZ3-CD2 3.65Å; W881-L908 HydrophobicContact CZ3-CG 4.42Å
882	G	88.2	Confident	94	Very high	48 Å²	48	47.8 Å²	47.8	50%	0.495	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	-3.1	-179.1	0	0	0	0	0	115	Y880	Y880-G882 PolarHBondContact O-N 3Å; Y880-G882 VanDerWaalsContact O-N 3.13Å
883	I	91.6	Very high	93.7	Very high	121 Å²	121	48 Å²	48	62%	0.621	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-57.9	174.4	-55.7	-174.4	0	0	0	109.1	P879 Y880 W881	P879-I883 VanDerWaalsContact O-CD1 3.31Å; P879-I883 WeakPolarHBondContact O-CD1 3.49Å; Y880-I883 PolarHBondContact O-N 2.91Å; W881-I883 PolarHBondContact O-N 2.88Å
884	E	93.5	Very high	93.2	Very high	66 Å²	66	52.3 Å²	52.3	31%	0.308	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-93.8	146.6	177.1	-63.5	-61	154.8	0	0	110.5	V857 Y880 L908	V857-E884 HydrophobicContact CG1-CB 4.12Å; V857-E884 HydrophobicContact CG1-CG 4.1Å; Y880-E884 HydrophobicContact CD1-CG 4.1Å; Y880-E884 PolarHBondContact O-N 2.94Å; E884-L908 HydrophobicContact CB-CD1 3.83Å
885	N	93.9	Very high	92.5	Very high	94 Å²	94	50.7 Å²	50.7	50%	0.503	27%	0.274	S	S	.	.	S	Bend	trans	-100.7	-15.3	179.3	-63.3	-56.9	0	0	0	112.9	R907 L908	N885-R907 WeakPolarHBondContact O-CA 3.14Å; N885-L908 PolarHBondContact O-N 3.02Å
886	Q	95.6	Very high	91.9	Very high	97 Å²	97	58.4 Å²	58.4	45%	0.453	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	161.3	-173.3	66.8	-170.4	29.3	0	0	112.6	E905 Y906	Q886-E905 HydrophobicContact CB-CG 4.28Å; Q886-E905 PolarHBondContact NE2-OE2 3.19Å; Q886-Y906 CarbonylContact C-O 3.58Å; Q886-Y906 WeakPolarHBondContact CA-O 3.42Å; Q886-Y906 WeakPolarHBondContact CB-O 3.26Å
887	L	96.7	Very high	91.1	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	150.7	166.5	69.3	88.9	0	0	0	110	L828 F843 V855 V856 V857 L877 E905 Y906 L908	L828-L887 HydrophobicContact CD1-CD2 3.51Å; F843-L887 HydrophobicContact CE1-CD1 4.22Å; F843-L887 HydrophobicContact CZ-CD1 3.76Å; F843-L887 HydrophobicContact CZ-CD2 4.43Å; V855-L887 HydrophobicContact CG1-CD1 3.8Å; V856-L887 CarbonylContact O-C 3.54Å; V856-L887 VanDerWaalsContact O-CA 3.28Å; V856-L887 WeakPolarHBondContact O-CA 3.45Å; V856-L887 WeakPolarHBondContact O-CB 3.36Å; V857-L887 HydrophobicContact CB-CB 4.39Å; V857-L887 HydrophobicContact CG1-CB 4.36Å; V857-L887 HydrophobicContact CG2-CB 3.73Å; L877-L887 HydrophobicContact CD1-CD2 4.16Å; L877-L887 HydrophobicContact CD2-CD2 3.94Å; L887-E905 WeakPolarHBondContact O-CA 2.97Å; L887-Y906 HydrophobicContact CD1-CD2 3.41Å; L887-Y906 VanDerWaalsContact CD1-CD2 3.41Å; L887-Y906 HydrophobicContact CD1-CE2 4.15Å; L887-Y906 HydrophobicContact CD1-CG 3.91Å; L887-Y906 HydrophobicContact CG-CD2 4.27Å; L887-Y906 HydrophobicContact CG-CG 4.35Å; L887-Y906 PolarHBondContact N-O 3.22Å; L887-Y906 PolarHBondContact O-N 3.48Å; L887-L908 HydrophobicContact CD2-CD2 3.76Å
888	A	97.6	Very high	90.4	Very high	16 Å²	16	62.2 Å²	62.2	13%	0.132	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139	179.8	0	0	0	0	0	111.3	V855 V856 T902 L904	V855-A888 CarbonylContact C-O 3.49Å; V855-A888 WeakPolarHBondContact CA-O 3.35Å; V856-A888 PolarHBondContact N-O 2.96Å; V856-A888 PolarHBondContact O-N 2.92Å; A888-T902 HydrophobicContact CB-CG2 4.06Å; A888-L904 CarbonylContact C-O 3.56Å; A888-L904 WeakPolarHBondContact CA-O 3.29Å
889	L	98	Very high	90.4	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.3	163.6	178.7	73.4	0	0	0	108	F843 V845 I847 V853 V855 L864 L903 L904	F843-L889 HydrophobicContact CD1-CD1 4.43Å; V845-L889 HydrophobicContact CB-CD2 4.47Å; V845-L889 HydrophobicContact CG1-CD2 3.84Å; V845-L889 HydrophobicContact CG2-CD2 4.25Å; I847-L889 HydrophobicContact CD1-CD2 4.41Å; V853-L889 HydrophobicContact CG1-CD1 3.76Å; V853-L889 HydrophobicContact CG1-CG 4.48Å; V855-L889 HydrophobicContact CG2-CD1 3.82Å; L864-L889 HydrophobicContact CD1-CD1 4.09Å; L889-L903 WeakPolarHBondContact O-CB 3.46Å; L889-L903 PolarHBondContact O-N 3.47Å; L889-L904 HydrophobicContact CB-CB 4.11Å; L889-L904 HydrophobicContact CD2-CB 4.48Å; L889-L904 HydrophobicContact CD2-CD1 3.99Å; L889-L904 HydrophobicContact CD2-CG 4.35Å; L889-L904 PolarHBondContact N-O 3.18Å; L889-L904 PolarHBondContact O-N 2.99Å
890	C	97.2	Very high	90.5	Very high	6 Å²	6	59.5 Å²	59.5	4%	0.041	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	148.6	-174.1	-58.3	0	0	0	0	111.5	V853 A854 V856 Y900 G901	V853-C890 WeakPolarHBondContact CA-O 3.41Å; A854-C890 PolarHBondContact N-O 3Å; A854-C890 PolarHBondContact O-N 3.26Å; V856-C890 HydrophobicContact CG2-CB 4.44Å; C890-Y900 HydrophobicContact CB-CD1 4.14Å; C890-G901 CarbonylContact C-O 3.6Å; C890-G901 WeakPolarHBondContact CA-O 3.18Å
891	A	96.2	Very high	90.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146	176.1	0	0	0	0	0	112.1	I847 A850 A852 V853 Y893 Y900 G901 L903	I847-A891 HydrophobicContact CD1-CB 4.47Å; I847-A891 HydrophobicContact CG2-CB 4.2Å; A850-A891 HydrophobicContact CB-CB 4.26Å; A852-A891 WeakPolarHBondContact O-CA 3.39Å; V853-A891 HydrophobicContact CG2-CB 4.24Å; A891-Y893 HydrophobicContact CB-CE2 3.99Å; A891-Y900 WeakPolarHBondContact O-CA 3.3Å; A891-G901 PolarHBondContact N-O 2.71Å; A891-G901 PolarHBondContact O-N 2.79Å; A891-L903 HydrophobicContact CB-CD1 3.57Å; A891-L903 HydrophobicContact CB-CD2 4.5Å; A891-L903 HydrophobicContact CB-CG 4.04Å
892	K	94	Very high	90.8	Very high	38 Å²	38	60.1 Å²	60.1	17%	0.165	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.8	174.9	177.1	171.9	169.2	163.2	0	109.5	H851 A852 N894 V895 D897 Y900	H851-K892 PolarHBondContact N-O 2.98Å; A852-K892 HydrophobicContact CB-CB 4.26Å; A852-K892 PolarHBondContact N-O 3.11Å; A852-K892 PolarHBondContact O-N 3.22Å; K892-N894 WeakPolarHBondContact CE-O 3.12Å; K892-N894 WeakPolarHBondContact CG-O 3.25Å; K892-V895 WeakPolarHBondContact CE-O 3.4Å; K892-V895 PolarHBondContact NZ-O 3.25Å; K892-D897 WeakPolarHBondContact CE-O 3.43Å; K892-D897 PolarHBondContact NZ-O 3.18Å; K892-Y900 HydrophobicContact CB-CD1 3.84Å; K892-Y900 HydrophobicContact CB-CD2 4.32Å; K892-Y900 HydrophobicContact CB-CE1 3.67Å; K892-Y900 HydrophobicContact CB-CE2 4.16Å; K892-Y900 HydrophobicContact CB-CG 4.17Å; K892-Y900 HydrophobicContact CD-CE2 3.97Å
893	Y	89.7	Confident	91.2	Very high	45 Å²	45	57.8 Å²	57.8	18%	0.176	32%	0.32	C	S	.	.			trans	-103.9	-29.9	-176.9	-65.7	-80.5	0	0	0	114	I847 A850 H851 A891 L903	I847-Y893 HydrophobicContact CG2-CE1 4.2Å; A850-Y893 HydrophobicContact CB-CD1 4.49Å; A850-Y893 HydrophobicContact CB-CE1 4.28Å; H851-Y893 PolarHBondContact CE1-O 2.93Å; H851-Y893 PolarHBondContact ND1-O 3.39Å; A891-Y893 HydrophobicContact CB-CE2 3.99Å; Y893-L903 HydrophobicContact CE2-CD2 4.37Å
894	N	86.5	Confident	91.5	Very high	109 Å²	109	52 Å²	52	58%	0.583	29%	0.291	S	S	*	.			trans	-103.1	131.4	176.1	-69.3	-29.6	0	0	0	109.7	K892 D896 D897	K892-N894 WeakPolarHBondContact CE-O 3.12Å; K892-N894 WeakPolarHBondContact CG-O 3.25Å; N894-D896 VanDerWaalsContact C-N 3.3Å; N894-D896 PolarHBondContact O-N 2.75Å; N894-D897 HydrophobicContact CB-CB 4.18Å
895	V	80.9	Confident	91.7	Very high	88 Å²	88	50.8 Å²	50.8	53%	0.533	29%	0.285	S	S	.	.	S	Bend	trans	-65.9	-37.5	179	-179.2	0	0	0	0	111.1	H851 K892	H851-V895 HydrophobicContact CB-CG2 4.47Å; H851-V895 WeakPolarHBondContact CD2-CG2 3.31Å; H851-V895 WeakPolarHBondContact NE2-CG2 3.48Å; K892-V895 WeakPolarHBondContact CE-O 3.4Å; K892-V895 PolarHBondContact NZ-O 3.25Å
896	D	82.1	Confident	91.9	Very high	163 Å²	163	46.3 Å²	46.3	87%	0.872	26%	0.261	S	S	*	.	S	Bend	trans	-85.2	-17.8	-169.2	-54.7	-42.9	0	0	0	114.6	N894	N894-D896 VanDerWaalsContact C-N 3.3Å; N894-D896 PolarHBondContact O-N 2.75Å
897	D	76.4	Confident	91.8	Very high	78 Å²	78	48 Å²	48	42%	0.417	26%	0.263	S	S	.	.			trans	-95.9	136.4	174.8	-170.3	-5.2	0	0	0	109.6	K892 N894 N899	K892-D897 WeakPolarHBondContact CE-O 3.43Å; K892-D897 PolarHBondContact NZ-O 3.18Å; N894-D897 HydrophobicContact CB-CB 4.18Å; D897-N899 HydrophobicContact CB-CB 4.41Å; D897-N899 VanDerWaalsContact CG-CB 3.41Å; D897-N899 PolarHBondContact O-N 2.99Å; D897-N899 WeakPolarHBondContact OD1-CB 3.08Å; D897-N899 PolarHBondContact OD1-N 3.21Å; D897-N899 VanDerWaalsContact OD1-N 3.08Å; D897-N899 VanDerWaalsContact OD2-CB 3.24Å; D897-N899 WeakPolarHBondContact OD2-CB 3.4Å
898	G	77.8	Confident	91.6	Very high	62 Å²	62	48.3 Å²	48.3	64%	0.639	27%	0.265	S	S	*	.			trans	-68.8	-4.9	172.6	0	0	0	0	0	113.4
899	N	89.2	Confident	91.1	Very high	107 Å²	107	48.2 Å²	48.2	57%	0.572	26%	0.264	S	S	*	.			trans	-76	128.6	-168.8	-160.6	6.5	0	0	0	114.1	D897	D897-N899 HydrophobicContact CB-CB 4.41Å; D897-N899 VanDerWaalsContact CG-CB 3.41Å; D897-N899 PolarHBondContact O-N 2.99Å; D897-N899 WeakPolarHBondContact OD1-CB 3.08Å; D897-N899 PolarHBondContact OD1-N 3.21Å; D897-N899 VanDerWaalsContact OD1-N 3.08Å; D897-N899 VanDerWaalsContact OD2-CB 3.24Å; D897-N899 WeakPolarHBondContact OD2-CB 3.4Å
900	Y	93	Very high	90.2	Very high	53 Å²	53	55.5 Å²	55.5	21%	0.208	30%	0.296	C	S	.	.			trans	-109	124	172.1	-82	-101.4	0	0	0	109	A852 A854 W861 H863 C890 A891 K892	A852-Y900 HydrophobicContact CB-CE1 4.21Å; A854-Y900 HydrophobicContact CB-CE1 4.42Å; W861-Y900 HydrophobicContact CH2-CD1 4.48Å; W861-Y900 HydrophobicContact CH2-CD2 4.06Å; W861-Y900 AromaticContact CH2-CG 3.93Å; W861-Y900 HydrophobicContact CH2-CG 3.93Å; W861-Y900 AromaticContact CZ3-CD1 3.8Å; W861-Y900 HydrophobicContact CZ3-CD1 3.8Å; W861-Y900 AromaticContact CZ3-CD2 3.87Å; W861-Y900 HydrophobicContact CZ3-CD2 3.87Å; W861-Y900 HydrophobicContact CZ3-CE1 4.11Å; W861-Y900 HydrophobicContact CZ3-CE2 4.17Å; W861-Y900 AromaticContact CZ3-CG 3.67Å; W861-Y900 HydrophobicContact CZ3-CG 3.67Å; H863-Y900 PolarHBondContact NE2-OH 3.01Å; C890-Y900 HydrophobicContact CB-CD1 4.14Å; A891-Y900 WeakPolarHBondContact O-CA 3.3Å; K892-Y900 HydrophobicContact CB-CD1 3.84Å; K892-Y900 HydrophobicContact CB-CD2 4.32Å; K892-Y900 HydrophobicContact CB-CE1 3.67Å; K892-Y900 HydrophobicContact CB-CE2 4.16Å; K892-Y900 HydrophobicContact CB-CG 4.17Å; K892-Y900 HydrophobicContact CD-CE2 3.97Å
901	G	92.8	Very high	88.7	Confident	17 Å²	17	65.7 Å²	65.7	18%	0.175	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	136.6	171.9	0	0	0	0	0	111	C890 A891	C890-G901 CarbonylContact C-O 3.6Å; C890-G901 WeakPolarHBondContact CA-O 3.18Å; A891-G901 PolarHBondContact N-O 2.71Å; A891-G901 PolarHBondContact O-N 2.79Å
902	T	95.9	Very high	88.3	Confident	52 Å²	52	69 Å²	69	32%	0.319	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	127.5	170.7	-58.5	0	0	0	0	109.3	F811 A888	F811-T902 WeakPolarHBondContact CB-O 3.11Å; F811-T902 HydrophobicContact CD2-CG2 3.7Å; F811-T902 HydrophobicContact CE2-CG2 3.58Å; F811-T902 HydrophobicContact CG-CG2 4.25Å; F811-T902 HydrophobicContact CZ-CG2 4.03Å; A888-T902 HydrophobicContact CB-CG2 4.06Å
903	L	96.9	Very high	88	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-49.4	178	-60.8	-175.5	0	0	0	111.7	F811 Q813 W814 I847 L889 A891 Y893	F811-L903 PolarHBondContact N-O 2.98Å; Q813-L903 HydrophobicContact CB-CD2 3.47Å; Q813-L903 VanDerWaalsContact CB-CD2 3.47Å; W814-L903 HydrophobicContact CE3-CB 4.16Å; I847-L903 HydrophobicContact CD1-CD1 3.42Å; I847-L903 VanDerWaalsContact CD1-CD1 3.42Å; I847-L903 HydrophobicContact CG1-CD1 3.85Å; I847-L903 HydrophobicContact CG2-CD1 3.97Å; L889-L903 WeakPolarHBondContact O-CB 3.46Å; L889-L903 PolarHBondContact O-N 3.47Å; A891-L903 HydrophobicContact CB-CD1 3.57Å; A891-L903 HydrophobicContact CB-CD2 4.5Å; A891-L903 HydrophobicContact CB-CG 4.04Å; Y893-L903 HydrophobicContact CE2-CD2 4.37Å
904	L	97.8	Very high	87.9	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	147.7	179.8	-61.2	176.1	0	0	0	110.5	P808 Q809 Q810 W814 L820 A888 L889 Y906	P808-L904 HydrophobicContact CB-CB 4.11Å; P808-L904 HydrophobicContact CB-CD1 4.43Å; P808-L904 HydrophobicContact CB-CD2 4.32Å; Q809-L904 CarbonylContact O-C 3.56Å; Q809-L904 VanDerWaalsContact O-CA 3.22Å; Q809-L904 WeakPolarHBondContact O-CA 3.15Å; Q810-L904 HydrophobicContact CB-CD2 4.26Å; Q810-L904 HydrophobicContact CG-CD2 3.58Å; W814-L904 HydrophobicContact CB-CD2 4.48Å; W814-L904 HydrophobicContact CD2-CD1 4.31Å; W814-L904 HydrophobicContact CD2-CD2 3.6Å; W814-L904 HydrophobicContact CD2-CG 3.97Å; W814-L904 HydrophobicContact CE3-CD1 3.95Å; W814-L904 HydrophobicContact CE3-CD2 3.92Å; W814-L904 HydrophobicContact CE3-CG 3.73Å; W814-L904 HydrophobicContact CG-CD2 3.83Å; W814-L904 HydrophobicContact CH2-CD1 3.87Å; W814-L904 HydrophobicContact CZ2-CD1 4.24Å; W814-L904 HydrophobicContact CZ2-CD2 4.49Å; W814-L904 HydrophobicContact CZ3-CD1 3.7Å; W814-L904 HydrophobicContact CZ3-CD2 4.48Å; W814-L904 HydrophobicContact CZ3-CG 4.02Å; L820-L904 HydrophobicContact CD1-CD1 4.24Å; L820-L904 HydrophobicContact CD2-CD1 3.96Å; A888-L904 CarbonylContact C-O 3.56Å; A888-L904 WeakPolarHBondContact CA-O 3.29Å; L889-L904 HydrophobicContact CB-CB 4.11Å; L889-L904 HydrophobicContact CD2-CB 4.48Å; L889-L904 HydrophobicContact CD2-CD1 3.99Å; L889-L904 HydrophobicContact CD2-CG 4.35Å; L889-L904 PolarHBondContact N-O 3.18Å; L889-L904 PolarHBondContact O-N 2.99Å; L904-Y906 HydrophobicContact CB-CE2 3.88Å; L904-Y906 HydrophobicContact CD1-CE2 4.38Å
905	E	97.9	Very high	88	Confident	40 Å²	40	69.8 Å²	69.8	19%	0.187	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.9	170.2	-177.9	-178.6	83.6	0	0	110.3	P808 Q809 F811 Q886 L887	P808-E905 CarbonylContact C-O 3.59Å; P808-E905 WeakPolarHBondContact CA-O 3.31Å; P808-E905 WeakPolarHBondContact CB-O 3.49Å; Q809-E905 HydrophobicContact CB-CB 4.27Å; Q809-E905 PolarHBondContact N-O 2.99Å; Q809-E905 PolarHBondContact O-N 2.78Å; F811-E905 HydrophobicContact CE2-CB 3.8Å; F811-E905 HydrophobicContact CZ-CB 4.41Å; Q886-E905 HydrophobicContact CB-CG 4.28Å; Q886-E905 PolarHBondContact NE2-OE2 3.19Å; L887-E905 WeakPolarHBondContact O-CA 2.97Å
906	Y	96.8	Very high	88.5	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	148	178.9	-55.2	-115	0	0	0	109.1	P808 P823 D825 G826 L828 F843 Q886 L887 L904	P808-Y906 HydrophobicContact CB-CD1 3.94Å; P808-Y906 HydrophobicContact CB-CD2 4.14Å; P808-Y906 HydrophobicContact CB-CE1 3.77Å; P808-Y906 HydrophobicContact CB-CE2 3.96Å; P808-Y906 HydrophobicContact CB-CG 4.11Å; P808-Y906 HydrophobicContact CG-CD1 3.65Å; P808-Y906 HydrophobicContact CG-CE1 3.14Å; P808-Y906 HydrophobicContact CG-CE2 4.14Å; P808-Y906 HydrophobicContact CG-CG 4.31Å; P808-Y906 VanDerWaalsContact CG-CZ 3.41Å; P823-Y906 HydrophobicContact CB-CE1 4.5Å; P823-Y906 HydrophobicContact CG-CD1 4.41Å; P823-Y906 HydrophobicContact CG-CE1 3.69Å; P823-Y906 WeakPolarHBondContact O-CE1 3.36Å; P823-Y906 PolarHBondContact O-OH 3.02Å; D825-Y906 VanDerWaalsContact O-CD1 3.26Å; D825-Y906 WeakPolarHBondContact O-CD1 3.26Å; G826-Y906 CarbonylContact O-C 3.47Å; G826-Y906 WeakPolarHBondContact O-CA 3.39Å; L828-Y906 HydrophobicContact CD1-CD1 4.26Å; L828-Y906 HydrophobicContact CD1-CG 4.48Å; L828-Y906 HydrophobicContact CD2-CD1 4.21Å; L828-Y906 HydrophobicContact CG-CD1 4.15Å; F843-Y906 AromaticContact CE1-CE2 3.92Å; F843-Y906 HydrophobicContact CE1-CE2 3.92Å; F843-Y906 AromaticContact CE1-CZ 3.97Å; Q886-Y906 CarbonylContact C-O 3.58Å; Q886-Y906 WeakPolarHBondContact CA-O 3.42Å; Q886-Y906 WeakPolarHBondContact CB-O 3.26Å; L887-Y906 HydrophobicContact CD1-CD2 3.41Å; L887-Y906 VanDerWaalsContact CD1-CD2 3.41Å; L887-Y906 HydrophobicContact CD1-CE2 4.15Å; L887-Y906 HydrophobicContact CD1-CG 3.91Å; L887-Y906 HydrophobicContact CG-CD2 4.27Å; L887-Y906 HydrophobicContact CG-CG 4.35Å; L887-Y906 PolarHBondContact N-O 3.22Å; L887-Y906 PolarHBondContact O-N 3.48Å; L904-Y906 HydrophobicContact CB-CE2 3.88Å; L904-Y906 HydrophobicContact CD1-CE2 4.38Å
907	R	94.5	Very high	88.9	Confident	131 Å²	131	62.4 Å²	62.4	49%	0.494	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	140.5	171	-58.6	-176	-151.4	140.2	7.8	110.3	G826 I827 L828 N885	G826-R907 PolarHBondContact O-N 3.12Å; I827-R907 WeakPolarHBondContact CA-O 3.28Å; I827-R907 HydrophobicContact CG1-CB 4.41Å; L828-R907 PolarHBondContact N-O 3.34Å; N885-R907 WeakPolarHBondContact O-CA 3.14Å
908	L	93	Very high	89.8	Confident	10 Å²	10	61.3 Å²	61.3	5%	0.052	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	121.5	172.3	-63.2	178.1	0	0	0	108.6	L828 V857 L877 W881 E884 N885 L887	L828-L908 HydrophobicContact CB-CD2 4.27Å; V857-L908 HydrophobicContact CG1-CD1 4.05Å; L877-L908 HydrophobicContact CD1-CD2 3.92Å; L877-L908 HydrophobicContact CD2-CD2 4.49Å; W881-L908 HydrophobicContact CE3-CB 4.32Å; W881-L908 HydrophobicContact CE3-CD2 4.38Å; W881-L908 HydrophobicContact CH2-CD2 4.07Å; W881-L908 HydrophobicContact CZ3-CB 4.05Å; W881-L908 HydrophobicContact CZ3-CD2 3.65Å; W881-L908 HydrophobicContact CZ3-CG 4.42Å; E884-L908 HydrophobicContact CB-CD1 3.83Å; N885-L908 PolarHBondContact O-N 3.02Å; L887-L908 HydrophobicContact CD2-CD2 3.76Å
909	A	85.9	Confident	90.7	Very high	13 Å²	13	61.2 Å²	61.2	11%	0.107	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-67.3	143.4	173.2	0	0	0	0	0	110.4	I827 L828 Y829	I827-A909 HydrophobicContact CG2-CB 4.09Å; L828-A909 WeakPolarHBondContact O-CB 3.5Å; L828-A909 PolarHBondContact O-N 2.98Å; Y829-A909 HydrophobicContact CD1-CB 3.41Å; Y829-A909 VanDerWaalsContact CD1-CB 3.41Å; Y829-A909 HydrophobicContact CE1-CB 3.55Å; Y829-A909 HydrophobicContact CG-CB 4Å
910	K	80.3	Confident	90.8	Very high	153 Å²	153	57.4 Å²	57.4	67%	0.665	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-73	140.3	166.9	-62.7	-175.8	179.8	-176.5	0	108.4
911	R	65.1	Low	90.6	Very high	220 Å²	220	57.8 Å²	57.8	83%	0.83	26%	0.257	S	S	*	.			trans	-58.4	0	175.4	-97.8	-172.5	179.7	-176.2	0	112.2	P830 D839	P830-R911 HydrophobicContact CB-CG 3.76Å; P830-R911 HydrophobicContact CG-CB 4.39Å; P830-R911 HydrophobicContact CG-CG 3.36Å; D839-R911 IonicContact OD2-NH2 3.45Å; D839-R911 PolarHBondContact OD2-NH2 3.22Å

Retrieved 911 of 911 residues in 558 ms (Link to these results)

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