A0A087XJV0_POEFO Loading...

Mitochondrial inner membrane m-AAA protease component paraplegin

AlphaFold DB , UniProt , Accession A0A087XJV0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 808 aa.

						>A0A087XJV0_POEFO|A0A087XJV0
MSALLLLNSAGICRKYSRCVIWTLSRRNYQVLTNKVISSEGAGNVLSRCANVRKTLHFPRSERTLTGQPQKKLIQSLLHKPLSPDMVGLSRELIRSNLLKNPAGLLNLLGSTNFFSSSQAKKQKNKSSGPKGKTPQEDEEEKKRREQEDQMYRERLRMLFIIALVMSLLNSINTSGGNISWNDFVNEMLAKGEVSRVQVVPESDIVEIYLHPGAVIFGRPRLALMYRMQVANIDKFEEKLRAAEEELNIDTKDRIPVTYKRTGFFGNAVYALGMAAIGVAILWYIFRLAGMGSREGGFSAFNQLKMAKFTIVDGKSGKGVSFKDVAGMHEAKMEVKEFVDYLKSPERYLQLGAKVPKGSLLLGPPGCGKTLLAKAVATEAQVPFLAMAGSEFVEVIGGLGAARVRSLFKEARARAPCIVYIDEIDAVGKKRSTNMSGFSNTEEEQTLNQLLVEMDGMGTTDHVIVLASTNRADILDNALMRPGRLDRHIFIDLPTLQERKEIFEQHLKILKLTQPAKFYSLRLAELTPGFSGADIANICNEAALHAAREGFKSIDTFNFEYAVERVIAGSVKKSKILSKEEQRVVAFHESGHALVGWLLEHTEAVMKVSIAPRTNAALGFTQILPRDQYLFTKDQLFQRMCMALGGRAAEAITFNKVTTGAQDDLRKVTRVAYSMVKQYGMCDSVGQVSFPETQEQGAVGRRPFSQGLQQQMDHEAKMLIARAYRHTEKLLLDNRDKLTLLANALLEREVVNYDDIEALLGPPPFGPKKIILPQSWVEAERDKQDTEEDEPQPPPRKRREDDVDPQLV
					

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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	30.4	Very low	25.7	Very low	225 Å²	225	127.8 Å²	127.8	100%	1.108	78%	0.78	S	S	*	*				0	123.4	0	-66.4	174.5	84.1	0	0	106.3
2	S	24.3	Very low	25.6	Very low	115 Å²	115	131.3 Å²	131.3	80%	0.804	79%	0.788	S	S	*	*				64.6	126.6	68.2	-45.6	0	0	0	0	110.9
3	A	23.8	Very low	25.6	Very low	78 Å²	78	128.5 Å²	128.5	65%	0.645	78%	0.776	S	S	*	*			cis	-168.5	178.4	-10.2	0	0	0	0	0	108.4
4	L	26.5	Very low	25.5	Very low	157 Å²	157	135.6 Å²	135.6	82%	0.822	78%	0.782	S	S	*	*			trans	65.1	158.7	164.6	-82.2	76.6	0	0	0	116.9
5	L	27.6	Very low	25.5	Very low	135 Å²	135	138.7 Å²	138.7	71%	0.707	78%	0.783	S	S	*	*			cis	-165.3	150.6	-36.5	-117.1	-178.7	0	0	0	107.5
6	L	25.7	Very low	25.4	Very low	132 Å²	132	143.8 Å²	143.8	69%	0.691	79%	0.788	S	S	*	*			trans	72.5	118.8	151.1	-60	167.7	0	0	0	122.6
7	L	26.6	Very low	25.2	Very low	139 Å²	139	142.4 Å²	142.4	73%	0.728	79%	0.791	S	S	*	*				68.8	111.9	124.6	-67.8	171.1	0	0	0	121.8
8	N	24.9	Very low	25.2	Very low	150 Å²	150	147.6 Å²	147.6	80%	0.802	80%	0.796	S	S	*	*				164.8	156	113.4	-88.6	-31.2	0	0	0	109.6
9	S	24.5	Very low	25.2	Very low	103 Å²	103	145 Å²	145	72%	0.72	79%	0.79	S	S	*	*			cis	-168.1	169	-7	46.2	0	0	0	0	110.4
10	A	24.8	Very low	25	Very low	108 Å²	108	144.2 Å²	144.2	89%	0.893	79%	0.789	S	S	*	*			trans	66.3	144.8	169.6	0	0	0	0	0	118.8
11	G	23.8	Very low	25	Very low	64 Å²	64	144 Å²	144	66%	0.66	79%	0.786	S	S	*	*			cis	173.2	154.7	-11.2	0	0	0	0	0	114.1
12	I	24.7	Very low	24.7	Very low	170 Å²	170	143.8 Å²	143.8	87%	0.872	77%	0.773	S	S	*	*			trans	68.3	115.4	158.6	-52.4	165.4	0	0	0	115.7
13	C	24.8	Very low	24.7	Very low	95 Å²	95	143.8 Å²	143.8	64%	0.642	77%	0.768	S	S	*	*				-179.3	152.9	72.4	-147.3	0	0	0	0	113.6
14	R	24.9	Very low	24.6	Very low	228 Å²	228	148.2 Å²	148.2	86%	0.86	78%	0.78	S	S	*	*			trans	30.2	130.2	147.5	-70.5	171.9	-176.7	176.6	0.2	119.7
15	K	24.8	Very low	24.4	Very low	182 Å²	182	145.6 Å²	145.6	79%	0.791	78%	0.775	S	S	*	*			cis	-160	146.4	37.2	-113	177.9	179.9	177.6	0	112
16	Y	25.2	Very low	24.3	Very low	219 Å²	219	149.6 Å²	149.6	86%	0.859	78%	0.781	S	S	*	*			trans	51.9	94.9	159.3	-75.9	-85.6	0	0	0	122.2
17	S	21.3	Very low	24.3	Very low	121 Å²	121	153.8 Å²	153.8	85%	0.846	79%	0.787	S	S	*	*				-148.7	133.9	125.5	-176.8	0	0	0	0	110
18	R	25.9	Very low	24.1	Very low	235 Å²	235	153.5 Å²	153.5	89%	0.887	79%	0.786	S	S	*	*			trans	-169.1	154.4	176.8	-80.9	-163	172.8	179.1	-4.6	107.6
19	C	23.8	Very low	24.1	Very low	99 Å²	99	155.3 Å²	155.3	67%	0.669	78%	0.783	S	S	*	*			cis	-156.7	135.6	-19.1	-96.2	0	0	0	0	104.3
20	V	22.9	Very low	24.2	Very low	129 Å²	129	158.2 Å²	158.2	78%	0.782	79%	0.786	S	S	*	*				47.3	135.1	78.1	-146.2	0	0	0	0	116.9
21	I	24.2	Very low	24.2	Very low	139 Å²	139	158.5 Å²	158.5	71%	0.713	78%	0.776	S	S	*	*			trans	74	119.5	164.9	-26.5	173.2	0	0	0	115.3
22	W	23.8	Very low	24.2	Very low	221 Å²	221	162 Å²	162	84%	0.837	78%	0.779	S	S	*	*				179.9	152.3	88.2	-94.3	74.4	0	0	0	106.9
23	T	24.4	Very low	24.2	Very low	116 Å²	116	159.1 Å²	159.1	71%	0.712	77%	0.769	S	S	*	*			cis	-158.1	-176.3	0.7	-9.8	0	0	0	0	110.9
24	L	21.1	Very low	24.1	Very low	170 Å²	170	160.6 Å²	160.6	89%	0.89	77%	0.771	S	S	*	*			trans	-126.4	131.5	166.4	-131.4	162.8	0	0	0	109.4
25	S	23.5	Very low	24.1	Very low	102 Å²	102	158.4 Å²	158.4	71%	0.713	77%	0.767	S	S	*	*			trans	147.5	115.9	143.2	-168	0	0	0	0	117
26	R	24.6	Very low	24.1	Very low	220 Å²	220	156 Å²	156	83%	0.83	77%	0.768	S	S	*	*			trans	52.8	146.1	138.5	-73.7	-177.1	163	-177.4	-4	125.3
27	R	25	Very low	24.1	Very low	220 Å²	220	152.9 Å²	152.9	83%	0.83	76%	0.764	S	S	*	*			trans	75.9	145.7	162.3	-70.2	175.1	174.8	169.3	-3.2	115.2
28	N	24.4	Very low	24.2	Very low	132 Å²	132	151.9 Å²	151.9	71%	0.706	76%	0.757	S	S	*	*			cis	-150.9	151.7	8.8	-121.5	-1.2	0	0	0	113
29	Y	24.9	Very low	24.1	Very low	189 Å²	189	144.5 Å²	144.5	74%	0.741	74%	0.742	S	S	*	*			trans	36.5	129.4	145.2	-97	-112.7	0	0	0	124.5
30	Q	24.7	Very low	24.1	Very low	164 Å²	164	148.5 Å²	148.5	77%	0.766	75%	0.751	S	S	*	*			trans	64.3	154.4	144.2	-76	-179.7	-21.5	0	0	118.6
31	V	24.9	Very low	24.2	Very low	114 Å²	114	145.6 Å²	145.6	69%	0.691	75%	0.746	S	S	*	*			cis	-149.6	175	7.8	105.1	0	0	0	0	110.6
32	L	23.9	Very low	24.2	Very low	138 Å²	138	144.4 Å²	144.4	72%	0.723	76%	0.758	S	S	*	*			trans	-47.1	164.5	172.2	-54.9	100.9	0	0	0	114.2
33	T	24.6	Very low	24.2	Very low	108 Å²	108	136.9 Å²	136.9	66%	0.663	75%	0.749	S	S	*	*			cis	-173.3	173.5	29.8	-17.3	0	0	0	0	112
34	N	24.4	Very low	24.2	Very low	126 Å²	126	139.3 Å²	139.3	67%	0.674	76%	0.757	S	S	*	*			trans	97.2	120.6	142.5	-77.7	-33.9	0	0	0	122.8
35	K	24.1	Very low	24.4	Very low	182 Å²	182	137.7 Å²	137.7	79%	0.791	75%	0.754	S	S	*	*			trans	59.4	115.6	137.5	-64	179.8	177.2	-179	0	118.7
36	V	24.1	Very low	24.4	Very low	133 Å²	133	140 Å²	140	81%	0.806	76%	0.758	S	S	*	*				72.4	114.9	59.9	176.9	0	0	0	0	113.4
37	I	25.3	Very low	24.2	Very low	153 Å²	153	134.1 Å²	134.1	79%	0.785	75%	0.751	S	S	*	*			trans	176.5	112.5	156.1	-89.5	147.1	0	0	0	102.6
38	S	22.9	Very low	24.1	Very low	99 Å²	99	135.4 Å²	135.4	69%	0.692	76%	0.755	S	S	*	*				59.8	151.9	67.9	92.9	0	0	0	0	113
39	S	24.6	Very low	24	Very low	81 Å²	81	135.2 Å²	135.2	57%	0.566	76%	0.763	S	S	*	*			cis	-168.6	163.3	-23.4	45.4	0	0	0	0	107.5
40	E	25.1	Very low	23.9	Very low	183 Å²	183	131.1 Å²	131.1	86%	0.855	77%	0.768	S	S	*	*			trans	63	161.2	158.7	-65.8	145.8	134	0	0	118.4
41	G	24.3	Very low	23.8	Very low	67 Å²	67	130.8 Å²	130.8	69%	0.691	77%	0.772	S	S	*	*			cis	170.4	167.4	-7.8	0	0	0	0	0	112.5
42	A	23.4	Very low	23.7	Very low	115 Å²	115	131.4 Å²	131.4	95%	0.95	78%	0.775	S	S	*	*			trans	61.1	154.5	170	0	0	0	0	0	118.8
43	G	23.3	Very low	23.7	Very low	63 Å²	63	135.2 Å²	135.2	65%	0.649	78%	0.78	S	S	*	*			cis	151.8	119.3	-11	0	0	0	0	0	114.1
44	N	26.1	Very low	23.6	Very low	166 Å²	166	139.1 Å²	139.1	89%	0.888	79%	0.788	S	S	*	*			trans	64.1	160.9	168.9	-58.9	-26	0	0	0	115.6
45	V	24.1	Very low	23.6	Very low	136 Å²	136	139.5 Å²	139.5	82%	0.824	80%	0.795	S	S	*	*			cis	-151.5	161.9	45.2	168.2	0	0	0	0	113.6
46	L	22.9	Very low	23.4	Very low	151 Å²	151	137.7 Å²	137.7	79%	0.791	79%	0.793	S	S	*	*			trans	-55.4	144.9	-177.7	-70.4	136.1	0	0	0	120.6
47	S	22.5	Very low	23.4	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	79%	0.792	S	S	*	*			trans	40.3	131.7	133.2	77.3	0	0	0	0	123.4
48	R	22.9	Very low	23.2	Very low	246 Å²	246	140 Å²	140	93%	0.928	79%	0.789	S	S	*	*				-175.9	159.2	102.2	-105.2	178	171.7	175.7	-2.9	113
49	C	21.1	Very low	23.3	Very low	129 Å²	129	141.2 Å²	141.2	87%	0.872	80%	0.795	S	S	*	*			trans	-87.7	149.4	-176.8	-48.1	0	0	0	0	113.3
50	A	22.9	Very low	23.2	Very low	103 Å²	103	147.5 Å²	147.5	85%	0.851	81%	0.806	S	S	*	*			trans	-171.5	140.7	132.5	0	0	0	0	0	113.7
51	N	22.9	Very low	23	Very low	157 Å²	157	144.5 Å²	144.5	84%	0.84	81%	0.805	S	S	*	*			trans	-58.7	155.8	177.7	-67	-48.7	0	0	0	116.4
52	V	23.1	Very low	23	Very low	126 Å²	126	149.4 Å²	149.4	76%	0.764	81%	0.81	S	S	*	*				156.3	123.6	112.7	163.5	0	0	0	0	114.6
53	R	22.4	Very low	23	Very low	219 Å²	219	154.2 Å²	154.2	83%	0.826	80%	0.804	S	S	*	*			trans	51.2	122.9	151.5	-71.9	173	177	177.1	-1.1	124
54	K	23.8	Very low	23	Very low	189 Å²	189	157.2 Å²	157.2	82%	0.822	81%	0.809	S	S	*	*				53.1	125	128.9	-63.1	-177.7	176	-173.2	0	118.3
55	T	23.1	Very low	23	Very low	134 Å²	134	156.2 Å²	156.2	82%	0.822	80%	0.804	S	S	*	*				-145.3	166.5	77.8	28.8	0	0	0	0	116.7
56	L	21.4	Very low	22.9	Very low	144 Å²	144	156.6 Å²	156.6	75%	0.754	81%	0.806	S	S	*	*			trans	-36.2	158.5	172.3	-58.4	138.1	0	0	0	116.3
57	H	22.8	Very low	23	Very low	169 Å²	169	153.1 Å²	153.1	78%	0.782	81%	0.807	S	S	*	*			cis	-150.1	174.8	27.9	-117.2	-70.7	0	0	0	113.5
58	F	21.5	Very low	23.1	Very low	166 Å²	166	156.9 Å²	156.9	73%	0.728	81%	0.814	S	S	*	*			trans	-70.9	168.4	-178.5	-96.8	-109.3	0	0	0	114.8	R60	F58-R60 HydrophobicContact CE1-CB 4.48Å
59	P	24.9	Very low	23.5	Very low	124 Å²	124	150.3 Å²	150.3	81%	0.805	80%	0.803	S	S	*	*			cis	-131.7	153.6	27.2	37.5	-18.8	0	0	0	119.9
60	R	22.2	Very low	23.9	Very low	213 Å²	213	153 Å²	153	80%	0.804	80%	0.802	S	S	*	*			trans	-93.2	151.6	166.1	-82.4	174.7	158.1	165.8	-7.3	111.2	F58	F58-R60 HydrophobicContact CE1-CB 4.48Å
61	S	21	Very low	24.2	Very low	120 Å²	120	156.9 Å²	156.9	84%	0.839	80%	0.8	S	S	*	*			trans	-138	103.4	149.9	59.5	0	0	0	0	111.2
62	E	23.8	Very low	24.6	Very low	171 Å²	171	157.9 Å²	157.9	80%	0.799	80%	0.797	S	S	*	*			trans	-137.2	114.4	166.7	-82.6	-162.9	125.2	0	0	111.7
63	R	23.9	Very low	24.8	Very low	216 Å²	216	158.7 Å²	158.7	82%	0.815	80%	0.797	S	S	*	*			trans	41.3	129.2	132.1	-71	-177.6	178.8	171.6	2.6	121.9
64	T	24.1	Very low	25.2	Very low	125 Å²	125	155 Å²	155	77%	0.767	79%	0.791	S	S	*	*			trans	80.9	152.2	134.5	55.6	0	0	0	0	119.1
65	L	25.2	Very low	25.5	Very low	146 Å²	146	153 Å²	153	76%	0.764	79%	0.786	S	S	*	*			cis	-158.7	149.8	13.8	-133.7	152.7	0	0	0	111.8
66	T	23.2	Very low	25.8	Very low	144 Å²	144	150.6 Å²	150.6	88%	0.883	77%	0.774	S	S	*	*			trans	175	146.3	131.7	27.2	0	0	0	0	111.5
67	G	24.3	Very low	26	Very low	78 Å²	78	151 Å²	151	80%	0.804	78%	0.776	S	S	*	*			trans	118.3	106	171.1	0	0	0	0	0	115.9
68	Q	25.5	Very low	26.3	Very low	176 Å²	176	149.3 Å²	149.3	82%	0.822	77%	0.772	S	S	*	*			trans	-74.4	175.9	-178.4	-91.2	-168.2	4.2	0	0	114.7
69	P	30.1	Very low	26.9	Very low	107 Å²	107	149.4 Å²	149.4	70%	0.695	77%	0.774	S	S	*	*			cis	-135.8	161	18.4	38.5	-18.9	0	0	0	119.5	K71	P69-K71 PolarHBondContact O-N 2.82Å; P69-K71 VanDerWaalsContact O-N 3.09Å
70	Q	31.2	Very low	27	Very low	185 Å²	185	152.5 Å²	152.5	86%	0.864	78%	0.775	S	S	*	*			trans	-80.3	70.3	-179.3	-63.4	170.5	-60.8	0	0	114.2
71	K	28.8	Very low	27.4	Very low	186 Å²	186	148.5 Å²	148.5	81%	0.809	78%	0.777	S	S	*	*			trans	-120.3	-3.4	170.6	-83.2	-170.9	175.8	-179.7	0	116.7	P69	P69-K71 PolarHBondContact O-N 2.82Å; P69-K71 VanDerWaalsContact O-N 3.09Å
72	K	30.2	Very low	27.9	Very low	177 Å²	177	150.4 Å²	150.4	77%	0.77	78%	0.777	S	S	*	*	S	Bend	trans	-104.2	-9.8	-176.6	-76.6	-171.7	174.1	-178.1	0	117.1
73	L	27.8	Very low	28.3	Very low	144 Å²	144	146.2 Å²	146.2	75%	0.754	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-21.9	-176.7	-140.9	81.9	0	0	0	114.4	S76	L73-S76 PolarHBondContact O-OG 3.29Å
74	I	30.1	Very low	28.8	Very low	140 Å²	140	141.1 Å²	141.1	72%	0.718	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-27.5	-177.3	-61.9	176.7	0	0	0	111.5
75	Q	30.6	Very low	29.1	Very low	149 Å²	149	142.1 Å²	142.1	70%	0.696	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-77.4	-23.2	177.6	-80.4	-178.3	-33.1	0	0	114	L77	Q75-L77 VanDerWaalsContact C-N 3.3Å; Q75-L77 PolarHBondContact O-N 2.6Å
76	S	29	Very low	29.5	Very low	83 Å²	83	142.5 Å²	142.5	58%	0.58	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-80.8	-2.4	-178.3	54.7	0	0	0	0	115.2	L73	L73-S76 PolarHBondContact O-OG 3.29Å
77	L	27.2	Very low	30	Very low	151 Å²	151	141.3 Å²	141.3	79%	0.791	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-103.8	-11.3	178.9	-81.2	165.4	0	0	0	114.2	Q75	Q75-L77 VanDerWaalsContact C-N 3.3Å; Q75-L77 PolarHBondContact O-N 2.6Å
78	L	28.7	Very low	30.5	Very low	134 Å²	134	141.2 Å²	141.2	70%	0.702	75%	0.753	S	S	*	*	S	Bend	trans	-95.3	-4.6	-176.5	-82.1	163.9	0	0	0	114.9
79	H	33.8	Very low	30.9	Very low	168 Å²	168	139.4 Å²	139.4	78%	0.778	75%	0.748	S	S	*	*			trans	-133.6	82.8	179.2	-65.8	-64.6	0	0	0	113.1
80	K	26	Very low	31.2	Very low	189 Å²	189	137.5 Å²	137.5	82%	0.822	74%	0.737	S	S	*	*			trans	-134.9	124.5	148.9	-81	-170.4	175.3	-177.8	0	108.9
81	P	31.9	Very low	31.5	Very low	130 Å²	130	139 Å²	139	84%	0.844	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-69.3	144.6	171.9	29.5	-33.1	0	0	0	110.3
82	L	32	Very low	31.8	Very low	160 Å²	160	137.9 Å²	137.9	84%	0.838	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-67.7	152.6	171.8	-75.2	89.8	0	0	0	110.8
83	S	30.6	Very low	32.2	Very low	82 Å²	82	134.3 Å²	134.3	57%	0.573	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-69.6	159	176.7	46.9	0	0	0	0	112.8	D85	S83-D85 VanDerWaalsContact C-N 3.29Å; S83-D85 PolarHBondContact O-N 3.06Å
84	P	34	Very low	32.9	Very low	110 Å²	110	132.2 Å²	132.2	71%	0.714	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-70.8	-13.5	-168.1	-20.5	34.7	0	0	0	116.3	M86	P84-M86 VanDerWaalsContact C-N 3.31Å; P84-M86 PolarHBondContact O-N 3.32Å
85	D	30.8	Very low	33.2	Very low	146 Å²	146	136.2 Å²	136.2	78%	0.781	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-83	0.8	-166.6	-59.6	-38	0	0	0	115	S83	S83-D85 VanDerWaalsContact C-N 3.29Å; S83-D85 PolarHBondContact O-N 3.06Å
86	M	33.4	Very low	33.6	Very low	153 Å²	153	132.1 Å²	132.1	75%	0.754	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-111.1	30.6	-176.4	-75.7	-67	-131.7	0	0	114.4	P84	P84-M86 VanDerWaalsContact C-N 3.31Å; P84-M86 PolarHBondContact O-N 3.32Å
87	V	34.8	Very low	34	Very low	120 Å²	120	133.7 Å²	133.7	73%	0.727	71%	0.706	S	S	*	*	S	Bend	trans	-102.8	-15.8	180	-177.1	0	0	0	0	113.3
88	G	34.3	Very low	34.7	Very low	75 Å²	75	133 Å²	133	77%	0.773	70%	0.703	S	S	*	*	S	Bend	trans	-87.4	-18.2	-169.9	0	0	0	0	0	117.9
89	L	33.3	Very low	35.4	Very low	138 Å²	138	134.4 Å²	134.4	72%	0.723	71%	0.71	S	S	*	*	S	Bend	trans	-110.7	-2.6	-161.3	-95.8	160.5	0	0	0	116.6	L93	L89-L93 HydrophobicContact CD2-CD1 4.29Å
90	S	36.5	Very low	35.8	Very low	68 Å²	68	134.6 Å²	134.6	48%	0.476	71%	0.708	S	S	.	*	S	Bend	trans	-100.4	-6.4	-168.3	56.9	0	0	0	0	116.3	I94	S90-I94 WeakPolarHBondContact O-CD1 3.34Å; S90-I94 WeakPolarHBondContact O-CG1 3.23Å
91	R	38.6	Very low	36.5	Very low	217 Å²	217	131.6 Å²	131.6	82%	0.819	70%	0.701	S	S	*	*	S	Bend	trans	-94.7	-45.9	-175.8	-101.8	-179.7	171.7	-177.6	-3	115.7
92	E	34.4	Very low	37.1	Very low	161 Å²	161	131 Å²	131	75%	0.752	70%	0.698	S	S	*	*	H	α-helix	trans	-68.9	-43.6	177.4	-105.3	70.1	-140.4	0	0	113.4	I94 R95 S96	E92-I94 PolarHBondContact O-N 3.22Å; E92-R95 PolarHBondContact O-N 3.31Å; E92-S96 PolarHBondContact O-N 3.29Å; E92-S96 PolarHBondContact O-OG 2.91Å
93	L	37.9	Very low	37.5	Very low	102 Å²	102	126.4 Å²	126.4	53%	0.534	68%	0.682	S	S	.	*	H	α-helix	trans	-70	-33.3	-173.3	-88.6	162	0	0	0	113.6	L89	L89-L93 HydrophobicContact CD2-CD1 4.29Å
94	I	42.2	Very low	37.8	Very low	101 Å²	101	124.7 Å²	124.7	52%	0.518	68%	0.677	S	S	.	*	H	α-helix	trans	-75.5	-30.7	179.8	-64.3	-173.4	0	0	0	110.8	S90 E92 L98	S90-I94 WeakPolarHBondContact O-CD1 3.34Å; S90-I94 WeakPolarHBondContact O-CG1 3.23Å; E92-I94 PolarHBondContact O-N 3.22Å; I94-L98 HydrophobicContact CG2-CD1 3.71Å
95	R	38.2	Very low	38.1	Very low	223 Å²	223	125.6 Å²	125.6	84%	0.842	68%	0.676	S	S	*	*	H	α-helix	trans	-80.8	-23.4	-175.6	-151.2	174.7	-168.4	175.1	2.9	114.1	E92	E92-R95 PolarHBondContact O-N 3.31Å
96	S	37.2	Very low	38.4	Very low	64 Å²	64	125 Å²	125	45%	0.448	67%	0.672	S	S	.	*	H	α-helix	trans	-94	-32.5	-174.1	52.5	0	0	0	0	114.8	E92	E92-S96 PolarHBondContact O-N 3.29Å; E92-S96 PolarHBondContact O-OG 2.91Å
97	N	39.3	Very low	38.6	Very low	116 Å²	116	124.5 Å²	124.5	62%	0.62	67%	0.672	S	S	*	*	H	α-helix	trans	-99.8	-21.3	-173.2	-80.5	-29.2	0	0	0	115.6	L99	N97-L99 VanDerWaalsContact C-N 3.3Å; N97-L99 PolarHBondContact O-N 3.24Å
98	L	41.2	Very low	38.6	Very low	137 Å²	137	126.3 Å²	126.3	72%	0.717	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-10.2	-175.9	-98.1	155.4	0	0	0	115.5	I94	I94-L98 HydrophobicContact CG2-CD1 3.71Å
99	L	43.9	Very low	38.7	Very low	163 Å²	163	129.2 Å²	129.2	85%	0.853	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	2.6	-177.5	-83.1	163.3	0	0	0	114.5	N97	N97-L99 VanDerWaalsContact C-N 3.3Å; N97-L99 PolarHBondContact O-N 3.24Å
100	K	41.7	Very low	38.4	Very low	172 Å²	172	125.9 Å²	125.9	75%	0.748	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	-14.6	-170	-80.9	-171.4	173.1	-176.6	0	117.8
101	N	40.4	Very low	38.1	Very low	126 Å²	126	127.8 Å²	127.8	67%	0.674	69%	0.686	S	S	*	*			trans	-159.7	94.2	174.5	-106.9	-38.1	0	0	0	113.9	A103	N101-A103 VanDerWaalsContact C-N 3.31Å; N101-A103 PolarHBondContact O-N 3.37Å
102	P	44.9	Very low	37.7	Very low	118 Å²	118	122.8 Å²	122.8	77%	0.766	68%	0.68	S	S	*	*	S	Bend	trans	-71.6	-23.3	175.2	28.9	-34	0	0	0	113.3
103	A	39.8	Very low	37.5	Very low	63 Å²	63	121.1 Å²	121.1	52%	0.521	68%	0.676	S	S	.	*	S	Bend	trans	-77.1	-26.7	-175.8	0	0	0	0	0	114.3	N101 L105 L106	N101-A103 VanDerWaalsContact C-N 3.31Å; N101-A103 PolarHBondContact O-N 3.37Å; A103-L105 VanDerWaalsContact C-N 3.29Å; A103-L105 PolarHBondContact O-N 3.36Å; A103-L106 PolarHBondContact O-N 3.1Å
104	G	37.9	Very low	37	Very low	45 Å²	45	124.9 Å²	124.9	46%	0.464	69%	0.689	S	S	.	*	H	α-helix	trans	-68.3	-27	-176.3	0	0	0	0	0	114	N107	G104-N107 PolarHBondContact O-N 2.96Å
105	L	38.6	Very low	36.3	Very low	130 Å²	130	130.1 Å²	130.1	68%	0.681	71%	0.708	S	S	*	*	H	α-helix	trans	-77.2	-24.1	-176.2	-149.7	144.2	0	0	0	112.4	A103	A103-L105 VanDerWaalsContact C-N 3.29Å; A103-L105 PolarHBondContact O-N 3.36Å
106	L	38.6	Very low	35.6	Very low	133 Å²	133	124.7 Å²	124.7	70%	0.696	70%	0.704	S	S	*	*	H	α-helix	trans	-72.7	-28.3	172.8	-83	156.8	0	0	0	112.9	A103	A103-L106 PolarHBondContact O-N 3.1Å
107	N	36.6	Very low	35.3	Very low	142 Å²	142	127.1 Å²	127.1	76%	0.759	72%	0.721	S	S	*	*	H	α-helix	trans	-83.9	-12.4	179.7	-74.7	-8.1	0	0	0	114	G104 L109	G104-N107 PolarHBondContact O-N 2.96Å; N107-L109 VanDerWaalsContact C-N 3.27Å
108	L	35.6	Very low	34.6	Very low	158 Å²	158	127 Å²	127	83%	0.827	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-9.6	172.1	-149.4	87.7	0	0	0	112.7
109	L	35.9	Very low	34.1	Very low	136 Å²	136	130.1 Å²	130.1	71%	0.712	74%	0.74	S	S	*	*	S	Bend	trans	-117.8	71.5	179.1	-68.3	168.6	0	0	0	108.3	N107 S111	N107-L109 VanDerWaalsContact C-N 3.27Å; L109-S111 PolarHBondContact O-N 3.34Å
110	G	27.7	Very low	33.2	Very low	68 Å²	68	127 Å²	127	70%	0.701	74%	0.738	S	S	*	*			trans	-54.6	131.7	-164.6	0	0	0	0	0	115.7
111	S	28.8	Very low	32.6	Very low	108 Å²	108	128.9 Å²	128.9	76%	0.755	75%	0.746	S	S	*	*			trans	-60.4	157.1	152.1	55.9	0	0	0	0	109.6	L109	L109-S111 PolarHBondContact O-N 3.34Å
112	T	31.6	Very low	31.9	Very low	112 Å²	112	132.4 Å²	132.4	69%	0.687	76%	0.755	S	S	*	*			cis	-161.2	167.4	48.2	53.1	0	0	0	0	107.1
113	N	29	Very low	31.1	Very low	127 Å²	127	135.2 Å²	135.2	68%	0.679	76%	0.758	S	S	*	*			cis	-174	-180	43.8	-130.1	-23.3	0	0	0	111.3
114	F	28.3	Very low	30.5	Very low	181 Å²	181	141.8 Å²	141.8	79%	0.794	78%	0.775	S	S	*	*			trans	82.4	81.6	167.7	-60.9	-68.8	0	0	0	119.9
115	F	26.4	Very low	29.9	Very low	211 Å²	211	147.6 Å²	147.6	93%	0.925	80%	0.796	S	S	*	*				-70.2	133.9	128.8	-105.4	-103.4	0	0	0	109.4
116	S	23.7	Very low	29.5	Very low	109 Å²	109	151.2 Å²	151.2	76%	0.762	81%	0.806	S	S	*	*			trans	-150.2	122.8	153.2	-171.6	0	0	0	0	109.6
117	S	31.6	Very low	28.8	Very low	114 Å²	114	150.1 Å²	150.1	80%	0.797	81%	0.81	S	S	*	*			trans	-94.2	127.8	177.7	55.6	0	0	0	0	110.5
118	S	24.8	Very low	28.3	Very low	113 Å²	113	148.9 Å²	148.9	79%	0.79	81%	0.812	S	S	*	*			trans	-138.3	121.1	159.8	55.8	0	0	0	0	111
119	Q	30.7	Very low	28	Very low	203 Å²	203	144.8 Å²	144.8	95%	0.949	81%	0.808	S	S	*	*			trans	-73.9	131.3	166.7	-70.5	178.4	-20.7	0	0	108.8
120	A	24.2	Very low	28.1	Very low	98 Å²	98	144.7 Å²	144.7	81%	0.81	82%	0.815	S	S	*	*			trans	-133.3	101	164.5	0	0	0	0	0	109.9
121	K	29.1	Very low	28.3	Very low	212 Å²	212	151.4 Å²	151.4	92%	0.922	83%	0.825	S	S	*	*			trans	-64.7	129.8	163.5	-79.2	175.3	173.8	172.8	0	108.6
122	K	26.8	Very low	28.9	Very low	199 Å²	199	149.7 Å²	149.7	87%	0.865	83%	0.825	S	S	*	*			trans	-149.3	144.3	145.1	-118.5	169.4	-174.4	179.3	0	113
123	Q	26.8	Very low	29.2	Very low	177 Å²	177	149.9 Å²	149.9	83%	0.827	82%	0.816	S	S	*	*			trans	-64.3	151.4	-160.1	-66.9	138.1	-49.6	0	0	115
124	K	28.1	Very low	30.1	Very low	201 Å²	201	147.3 Å²	147.3	87%	0.874	81%	0.805	S	S	*	*			trans	-62.2	136.4	152.2	-75.7	175.8	174.2	173.5	0	109.2
125	N	25.9	Very low	31.2	Very low	168 Å²	168	143.9 Å²	143.9	90%	0.898	80%	0.801	S	S	*	*			trans	-138.8	140.5	145.1	-101.2	-16.4	0	0	0	108.8
126	K	30.4	Very low	32.3	Very low	205 Å²	205	141.4 Å²	141.4	89%	0.891	79%	0.792	S	S	*	*			trans	-101.5	135.4	175.2	-80.3	-179.9	169.8	-177.5	0	109.1
127	S	23.8	Very low	33.6	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	78%	0.779	S	S	*	*			trans	-170.6	137.5	141.3	39.9	0	0	0	0	114
128	S	24.9	Very low	34.7	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	76%	0.761	S	S	*	*			trans	46.8	119.1	148.1	61.1	0	0	0	0	123.1
129	G	29.8	Very low	36.3	Very low	71 Å²	71	139.4 Å²	139.4	73%	0.732	75%	0.748	S	S	*	*				94.3	140.5	129.4	0	0	0	0	0	117.7
130	P	38.4	Very low	37.6	Very low	134 Å²	134	136.4 Å²	136.4	87%	0.87	73%	0.734	S	S	*	*			trans	-83.3	128.9	-175.7	33.1	-33.4	0	0	0	112.3
131	K	32.1	Very low	39.1	Very low	209 Å²	209	135 Å²	135	91%	0.909	71%	0.711	S	S	*	*			trans	-131.1	147.5	157.9	-77.9	-174	175	178.7	0	108.9
132	G	40.4	Very low	40.6	Very low	73 Å²	73	131.1 Å²	131.1	75%	0.753	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-60.8	143.3	-174.5	0	0	0	0	0	112.4
133	K	38	Very low	42.4	Very low	116 Å²	116	127.1 Å²	127.1	50%	0.504	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-54.7	147	177.5	-71.4	-172.7	166.3	-163.7	0	111.9	E137 D138 E141	K133-E137 WeakPolarHBondContact CA-OE2 3.36Å; K133-D138 WeakPolarHBondContact CD-OD1 3.42Å; K133-D138 IonicContact NZ-OD1 3.89Å; K133-D138 PolarHBondContact NZ-OD1 2.94Å; K133-E141 IonicContact NZ-OE2 3.17Å; K133-E141 PolarHBondContact NZ-OE2 3.05Å
134	T	48.2	Very low	44.1	Very low	72 Å²	72	127 Å²	127	44%	0.442	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-95.5	152.8	175.1	57.4	0	0	0	0	111.6	Q136 E137	T134-Q136 PolarHBondContact O-N 3.49Å; T134-E137 PolarHBondContact N-OE2 3.44Å; T134-E137 VanDerWaalsContact N-OE2 3.14Å; T134-E137 PolarHBondContact O-N 3.32Å
135	P	51.3	Low	45.4	Very low	110 Å²	110	124.3 Å²	124.3	71%	0.714	65%	0.653	S	S	*	*	H	α-helix	trans	-59.3	-19.7	-175.3	-26.4	35.3	0	0	0	115.6	E139	P135-E139 PolarHBondContact O-N 3.46Å
136	Q	50.2	Low	47.1	Very low	159 Å²	159	121 Å²	121	74%	0.743	63%	0.632	S	S	*	*	H	α-helix	trans	-75.5	-33.9	175.9	-74.7	179.8	-49.3	0	0	112.7	T134 E139 E140	T134-Q136 PolarHBondContact O-N 3.49Å; Q136-E139 PolarHBondContact O-N 2.84Å; Q136-E140 PolarHBondContact O-N 2.9Å
137	E	50.5	Low	48.5	Very low	102 Å²	102	117.3 Å²	117.3	48%	0.477	62%	0.618	S	S	.	*	H	α-helix	trans	-68.1	-39.2	177.9	-66.1	175	137	0	0	111.1	K133 T134 E140 E141	K133-E137 WeakPolarHBondContact CA-OE2 3.36Å; T134-E137 PolarHBondContact N-OE2 3.44Å; T134-E137 VanDerWaalsContact N-OE2 3.14Å; T134-E137 PolarHBondContact O-N 3.32Å; E137-E140 PolarHBondContact O-N 3.21Å; E137-E141 WeakPolarHBondContact O-CB 3.44Å; E137-E141 PolarHBondContact O-N 2.88Å
138	D	54.7	Low	50.2	Low	79 Å²	79	118.4 Å²	118.4	42%	0.422	61%	0.611	S	S	.	*	H	α-helix	trans	-69.8	-30.3	177.5	-70.9	-31.2	0	0	0	112.7	K133 K142	K133-D138 WeakPolarHBondContact CD-OD1 3.42Å; K133-D138 IonicContact NZ-OD1 3.89Å; K133-D138 PolarHBondContact NZ-OD1 2.94Å; D138-K142 WeakPolarHBondContact O-CB 3.42Å; D138-K142 PolarHBondContact O-N 3.03Å
139	E	57.8	Low	52.1	Low	113 Å²	113	117.1 Å²	117.1	53%	0.528	60%	0.595	S	S	.	*	H	α-helix	trans	-67	-42.8	171.1	-97.4	-115.5	163.9	0	0	112.3	P135 Q136 K142 K143	P135-E139 PolarHBondContact O-N 3.46Å; Q136-E139 PolarHBondContact O-N 2.84Å; E139-K142 PolarHBondContact O-N 3.25Å; E139-K143 WeakPolarHBondContact O-CG 3.34Å; E139-K143 PolarHBondContact O-N 3.47Å; E139-K143 IonicContact OE2-NZ 2.65Å; E139-K143 PolarHBondContact OE2-NZ 3.32Å
140	E	57.5	Low	53.7	Low	140 Å²	140	119.3 Å²	119.3	65%	0.654	59%	0.586	S	S	*	*	H	α-helix	trans	-69.1	-40	175.9	-70.8	-165.6	161.7	0	0	112.1	Q136 E137 K142 K143 R144	Q136-E140 PolarHBondContact O-N 2.9Å; E137-E140 PolarHBondContact O-N 3.21Å; E140-K142 VanDerWaalsContact C-N 3.31Å; E140-K142 PolarHBondContact O-N 3.46Å; E140-K143 PolarHBondContact O-N 2.96Å; E140-R144 WeakPolarHBondContact O-CG 3.4Å; E140-R144 PolarHBondContact O-N 3.32Å
141	E	56.7	Low	54.9	Low	68 Å²	68	117.8 Å²	117.8	32%	0.318	57%	0.569	S	S	.	*	H	α-helix	trans	-65.2	-36.5	176.1	-145.2	-170.6	126	0	0	111.4	K133 E137 R144 R145	K133-E141 IonicContact NZ-OE2 3.17Å; K133-E141 PolarHBondContact NZ-OE2 3.05Å; E137-E141 WeakPolarHBondContact O-CB 3.44Å; E137-E141 PolarHBondContact O-N 2.88Å; E141-R144 PolarHBondContact O-N 3.28Å; E141-R145 VanDerWaalsContact O-CG 3.32Å; E141-R145 WeakPolarHBondContact O-CG 3.36Å; E141-R145 PolarHBondContact O-N 3.03Å; E141-R145 IonicContact OE1-CZ 3.3Å; E141-R145 IonicContact OE1-NE 3.64Å; E141-R145 PolarHBondContact OE1-NE 2.83Å; E141-R145 IonicContact OE1-NH2 3.81Å; E141-R145 PolarHBondContact OE1-NH2 3.49Å
142	K	61.1	Low	56.5	Low	131 Å²	131	114.5 Å²	114.5	57%	0.57	55%	0.552	S	S	*	*	H	α-helix	trans	-68.6	-44.3	175.4	-170.3	178.2	179.3	-171.5	0	112.4	D138 E139 E140 R144 R145 E146	D138-K142 WeakPolarHBondContact O-CB 3.42Å; D138-K142 PolarHBondContact O-N 3.03Å; E139-K142 PolarHBondContact O-N 3.25Å; E140-K142 VanDerWaalsContact C-N 3.31Å; E140-K142 PolarHBondContact O-N 3.46Å; K142-R144 VanDerWaalsContact C-N 3.3Å; K142-R144 PolarHBondContact O-N 3.47Å; K142-R145 PolarHBondContact O-N 3.25Å; K142-E146 WeakPolarHBondContact CE-OE1 3.32Å; K142-E146 WeakPolarHBondContact O-CG 3.46Å; K142-E146 PolarHBondContact O-N 2.88Å
143	K	64.7	Low	57.6	Low	115 Å²	115	117.4 Å²	117.4	50%	0.5	54%	0.54	S	S	.	.	H	α-helix	trans	-61.3	-36.9	174.6	-78.3	164.1	176.6	154.3	0	112.3	E139 E140 Q147	E139-K143 WeakPolarHBondContact O-CG 3.34Å; E139-K143 PolarHBondContact O-N 3.47Å; E139-K143 IonicContact OE2-NZ 2.65Å; E139-K143 PolarHBondContact OE2-NZ 3.32Å; E140-K143 PolarHBondContact O-N 2.96Å; K143-Q147 WeakPolarHBondContact O-CG 3.47Å; K143-Q147 PolarHBondContact O-N 2.98Å; K143-Q147 VanDerWaalsContact O-N 3.1Å
144	R	61.7	Low	59	Low	174 Å²	174	117.7 Å²	117.7	66%	0.657	54%	0.543	S	S	*	.	H	α-helix	trans	-63.1	-48.3	171.8	-78.8	180	168	-141.7	-1	112.5	E140 E141 K142 E146 Q147 E148	E140-R144 WeakPolarHBondContact O-CG 3.4Å; E140-R144 PolarHBondContact O-N 3.32Å; E141-R144 PolarHBondContact O-N 3.28Å; K142-R144 VanDerWaalsContact C-N 3.3Å; K142-R144 PolarHBondContact O-N 3.47Å; R144-E146 VanDerWaalsContact C-N 3.33Å; R144-E146 PolarHBondContact O-N 3.13Å; R144-Q147 WeakPolarHBondContact O-CB 3.48Å; R144-Q147 PolarHBondContact O-N 3.48Å; R144-E148 WeakPolarHBondContact O-CG 3.38Å; R144-E148 PolarHBondContact O-N 3.38Å
145	R	56	Low	60	Low	145 Å²	145	119.1 Å²	119.1	55%	0.547	54%	0.54	S	S	.	.	H	α-helix	trans	-61.1	-40.4	177.3	-69.7	169.6	-173.6	-131.9	7.4	112	E141 K142 Q147 E148 D149	E141-R145 VanDerWaalsContact O-CG 3.32Å; E141-R145 WeakPolarHBondContact O-CG 3.36Å; E141-R145 PolarHBondContact O-N 3.03Å; E141-R145 IonicContact OE1-CZ 3.3Å; E141-R145 IonicContact OE1-NE 3.64Å; E141-R145 PolarHBondContact OE1-NE 2.83Å; E141-R145 IonicContact OE1-NH2 3.81Å; E141-R145 PolarHBondContact OE1-NH2 3.49Å; K142-R145 PolarHBondContact O-N 3.25Å; R145-Q147 VanDerWaalsContact C-N 3.34Å; R145-Q147 PolarHBondContact O-N 3.44Å; R145-E148 PolarHBondContact O-N 3.48Å; R145-D149 WeakPolarHBondContact O-CB 3.45Å; R145-D149 PolarHBondContact O-N 3.28Å
146	E	61.2	Low	60.6	Low	99 Å²	99	118 Å²	118	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-64.7	-35.4	176.4	-73.5	173.9	-172.2	0	0	112.6	K142 R144 Q150	K142-E146 WeakPolarHBondContact CE-OE1 3.32Å; K142-E146 WeakPolarHBondContact O-CG 3.46Å; K142-E146 PolarHBondContact O-N 2.88Å; R144-E146 VanDerWaalsContact C-N 3.33Å; R144-E146 PolarHBondContact O-N 3.13Å; E146-Q150 WeakPolarHBondContact O-CG 3.34Å; E146-Q150 PolarHBondContact O-N 3.44Å
147	Q	58.9	Low	61.4	Low	127 Å²	127	119 Å²	119	59%	0.593	53%	0.525	S	S	*	.	H	α-helix	trans	-69.6	-42.2	171.9	-74.8	177	-16.3	0	0	112.6	K143 R144 R145 Q150 M151	K143-Q147 WeakPolarHBondContact O-CG 3.47Å; K143-Q147 PolarHBondContact O-N 2.98Å; K143-Q147 VanDerWaalsContact O-N 3.1Å; R144-Q147 WeakPolarHBondContact O-CB 3.48Å; R144-Q147 PolarHBondContact O-N 3.48Å; R145-Q147 VanDerWaalsContact C-N 3.34Å; R145-Q147 PolarHBondContact O-N 3.44Å; Q147-Q150 PolarHBondContact O-N 3.04Å; Q147-M151 PolarHBondContact O-N 2.95Å
148	E	60.4	Low	62.3	Low	133 Å²	133	119.4 Å²	119.4	62%	0.621	53%	0.528	S	S	*	.	H	α-helix	trans	-62.7	-42.1	175	-72.3	176.1	171.7	0	0	111.4	R144 R145 Q150 M151 Y152	R144-E148 WeakPolarHBondContact O-CG 3.38Å; R144-E148 PolarHBondContact O-N 3.38Å; R145-E148 PolarHBondContact O-N 3.48Å; E148-Q150 PolarHBondContact O-N 3.41Å; E148-M151 PolarHBondContact O-N 2.89Å; E148-Y152 WeakPolarHBondContact O-CB 3.31Å; E148-Y152 PolarHBondContact O-N 3.03Å
149	D	64.2	Low	62.8	Low	90 Å²	90	119.7 Å²	119.7	48%	0.481	53%	0.529	S	S	.	.	H	α-helix	trans	-66.7	-32.7	174.5	-81.8	-20.3	0	0	0	112.9	R145 R153	R145-D149 WeakPolarHBondContact O-CB 3.45Å; R145-D149 PolarHBondContact O-N 3.28Å; D149-R153 WeakPolarHBondContact O-CB 3.45Å; D149-R153 WeakPolarHBondContact O-CG 3.3Å; D149-R153 PolarHBondContact O-N 3.31Å; D149-R153 VanDerWaalsContact O-N 3.13Å; D149-R153 PolarHBondContact O-NE 3.32Å
150	Q	64.3	Low	63.3	Low	116 Å²	116	121.1 Å²	121.1	54%	0.542	53%	0.534	S	S	.	.	H	α-helix	trans	-65.1	-50.6	170.1	-82	-179.2	-20.3	0	0	110.7	E146 Q147 E148 Y152 R153 E154	E146-Q150 WeakPolarHBondContact O-CG 3.34Å; E146-Q150 PolarHBondContact O-N 3.44Å; Q147-Q150 PolarHBondContact O-N 3.04Å; E148-Q150 PolarHBondContact O-N 3.41Å; Q150-Y152 VanDerWaalsContact C-N 3.27Å; Q150-Y152 PolarHBondContact O-N 3.38Å; Q150-R153 PolarHBondContact O-N 3.33Å; Q150-R153 VanDerWaalsContact O-N 3.12Å; Q150-E154 PolarHBondContact O-N 3.39Å
151	M	63.6	Low	63.9	Low	103 Å²	103	118.9 Å²	118.9	51%	0.507	53%	0.525	S	S	.	.	H	α-helix	trans	-60.1	-36.8	178.9	-159.4	-171.9	-138.6	0	0	112.2	Q147 E148 R155	Q147-M151 PolarHBondContact O-N 2.95Å; E148-M151 PolarHBondContact O-N 2.89Å; M151-R155 VanDerWaalsContact O-CG 3.28Å; M151-R155 WeakPolarHBondContact O-CG 3.48Å; M151-R155 PolarHBondContact O-N 3.15Å
152	Y	64.3	Low	64.7	Low	140 Å²	140	118.3 Å²	118.3	55%	0.549	52%	0.524	S	S	.	.	H	α-helix	trans	-66.9	-42.2	175.5	-171.3	-105.7	0	0	0	112.6	E148 Q150 E154 R155 L156	E148-Y152 WeakPolarHBondContact O-CB 3.31Å; E148-Y152 PolarHBondContact O-N 3.03Å; Q150-Y152 VanDerWaalsContact C-N 3.27Å; Q150-Y152 PolarHBondContact O-N 3.38Å; Y152-E154 PolarHBondContact O-N 3.29Å; Y152-R155 PolarHBondContact O-N 3.15Å; Y152-L156 HydrophobicContact CD1-CD1 3.84Å; Y152-L156 HydrophobicContact CE1-CD1 3.45Å; Y152-L156 VanDerWaalsContact CE1-CD1 3.45Å; Y152-L156 HydrophobicContact CE1-CG 4.2Å; Y152-L156 PolarHBondContact O-N 3.07Å
153	R	65.1	Low	64.9	Low	133 Å²	133	115 Å²	115	50%	0.502	52%	0.521	S	S	.	.	H	α-helix	trans	-65.3	-35.8	176	-78.2	174.6	-73.2	-156.8	-0.5	112.7	D149 Q150 R157	D149-R153 WeakPolarHBondContact O-CB 3.45Å; D149-R153 WeakPolarHBondContact O-CG 3.3Å; D149-R153 PolarHBondContact O-N 3.31Å; D149-R153 VanDerWaalsContact O-N 3.13Å; D149-R153 PolarHBondContact O-NE 3.32Å; Q150-R153 PolarHBondContact O-N 3.33Å; Q150-R153 VanDerWaalsContact O-N 3.12Å; R153-R157 WeakPolarHBondContact O-CG 3.47Å; R153-R157 PolarHBondContact O-N 3.24Å; R153-R157 VanDerWaalsContact O-N 3.08Å
154	E	66.9	Low	65.1	Low	123 Å²	123	113.9 Å²	113.9	58%	0.575	52%	0.52	S	S	*	.	H	α-helix	trans	-69.3	-41.8	174.8	-70.3	-178.3	171.5	0	0	112.2	Q150 Y152 L156 R157 M158	Q150-E154 PolarHBondContact O-N 3.39Å; Y152-E154 PolarHBondContact O-N 3.29Å; E154-L156 VanDerWaalsContact C-N 3.35Å; E154-L156 PolarHBondContact O-N 3.05Å; E154-R157 PolarHBondContact O-N 3.31Å; E154-M158 PolarHBondContact O-N 2.97Å
155	R	68.3	Low	65.5	Low	101 Å²	101	109.2 Å²	109.2	38%	0.381	51%	0.51	S	S	.	.	H	α-helix	trans	-59.1	-43	172.6	-74.2	168.3	172.1	174.7	-2.2	112.1	M151 Y152 M158 L159 L288	M151-R155 VanDerWaalsContact O-CG 3.28Å; M151-R155 WeakPolarHBondContact O-CG 3.48Å; M151-R155 PolarHBondContact O-N 3.15Å; Y152-R155 PolarHBondContact O-N 3.15Å; R155-M158 PolarHBondContact O-N 2.85Å; R155-L159 WeakPolarHBondContact O-CG 3.46Å; R155-L159 PolarHBondContact O-N 3.14Å; R155-L288 PolarHBondContact NH2-O 3.2Å
156	L	64.1	Low	65.7	Low	88 Å²	88	106.3 Å²	106.3	46%	0.461	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-41.1	174.8	-82.8	170.6	0	0	0	112.9	Y152 E154 L159 F160	Y152-L156 HydrophobicContact CD1-CD1 3.84Å; Y152-L156 HydrophobicContact CE1-CD1 3.45Å; Y152-L156 VanDerWaalsContact CE1-CD1 3.45Å; Y152-L156 HydrophobicContact CE1-CG 4.2Å; Y152-L156 PolarHBondContact O-N 3.07Å; E154-L156 VanDerWaalsContact C-N 3.35Å; E154-L156 PolarHBondContact O-N 3.05Å; L156-L159 PolarHBondContact O-N 2.95Å; L156-F160 WeakPolarHBondContact O-CB 3.39Å; L156-F160 PolarHBondContact O-N 3.14Å
157	R	67.7	Low	65.7	Low	179 Å²	179	105.6 Å²	105.6	68%	0.675	51%	0.51	S	S	*	.	H	α-helix	trans	-62.5	-43.4	175.5	-75.1	172.9	176.1	176	-1.5	111.9	R153 E154 F160 I161	R153-R157 WeakPolarHBondContact O-CG 3.47Å; R153-R157 PolarHBondContact O-N 3.24Å; R153-R157 VanDerWaalsContact O-N 3.08Å; E154-R157 PolarHBondContact O-N 3.31Å; R157-F160 PolarHBondContact O-N 3.44Å; R157-I161 WeakPolarHBondContact O-CG1 3.37Å; R157-I161 PolarHBondContact O-N 3.4Å
158	M	68.4	Low	65.8	Low	110 Å²	110	105 Å²	105	54%	0.542	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-44	176.1	-84.5	-66.3	-66.5	0	0	112.7	E154 R155 F160 I161 I162	E154-M158 PolarHBondContact O-N 2.97Å; R155-M158 PolarHBondContact O-N 2.85Å; M158-F160 VanDerWaalsContact C-N 3.32Å; M158-F160 PolarHBondContact O-N 3.34Å; M158-I161 PolarHBondContact O-N 3.25Å; M158-I162 WeakPolarHBondContact O-CG1 3.48Å; M158-I162 PolarHBondContact O-N 2.98Å
159	L	66	Low	65.8	Low	86 Å²	86	103 Å²	103	45%	0.45	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-39	175.8	-71.4	172.3	0	0	0	112.2	R155 L156 I162 A163 I285	R155-L159 WeakPolarHBondContact O-CG 3.46Å; R155-L159 PolarHBondContact O-N 3.14Å; L156-L159 PolarHBondContact O-N 2.95Å; L159-I162 PolarHBondContact O-N 3.08Å; L159-A163 WeakPolarHBondContact O-CB 3.46Å; L159-A163 PolarHBondContact O-N 3.04Å; L159-I285 HydrophobicContact CD2-CD1 3.76Å; L159-I285 HydrophobicContact CD2-CG1 4.49Å
160	F	68.9	Low	65.4	Low	142 Å²	142	104.1 Å²	104.1	62%	0.623	51%	0.51	S	S	*	.	H	α-helix	trans	-64.4	-40.1	175.3	-172.6	-96.7	0	0	0	112.4	L156 R157 M158 A163 L164	L156-F160 WeakPolarHBondContact O-CB 3.39Å; L156-F160 PolarHBondContact O-N 3.14Å; R157-F160 PolarHBondContact O-N 3.44Å; M158-F160 VanDerWaalsContact C-N 3.32Å; M158-F160 PolarHBondContact O-N 3.34Å; F160-A163 PolarHBondContact O-N 3.13Å; F160-L164 HydrophobicContact CE1-CD1 4.17Å; F160-L164 WeakPolarHBondContact O-CB 3.38Å; F160-L164 PolarHBondContact O-N 3.09Å
161	I	70.1	Confident	65	Low	93 Å²	93	102.9 Å²	102.9	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-44.1	175.4	-68.1	162.9	0	0	0	110.9	R157 M158 A163 L164 V165	R157-I161 WeakPolarHBondContact O-CG1 3.37Å; R157-I161 PolarHBondContact O-N 3.4Å; M158-I161 PolarHBondContact O-N 3.25Å; I161-A163 PolarHBondContact O-N 3.21Å; I161-L164 PolarHBondContact O-N 3.03Å; I161-V165 WeakPolarHBondContact O-CG2 3.5Å; I161-V165 PolarHBondContact O-N 2.96Å
162	I	72.3	Confident	64.5	Low	57 Å²	57	103.6 Å²	103.6	29%	0.292	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-45	176.5	-66.7	166.3	0	0	0	110.7	M158 L159 L164 V165 M166 I281	M158-I162 WeakPolarHBondContact O-CG1 3.48Å; M158-I162 PolarHBondContact O-N 2.98Å; L159-I162 PolarHBondContact O-N 3.08Å; I162-L164 VanDerWaalsContact C-N 3.31Å; I162-L164 PolarHBondContact O-N 3.13Å; I162-V165 PolarHBondContact O-N 3.45Å; I162-M166 HydrophobicContact CG2-CG 4.42Å; I162-M166 WeakPolarHBondContact O-CB 3.23Å; I162-M166 VanDerWaalsContact O-CG 3.28Å; I162-M166 WeakPolarHBondContact O-CG 3.41Å; I162-M166 PolarHBondContact O-N 2.74Å; I162-I281 HydrophobicContact CG2-CD1 4.48Å
163	A	65.3	Low	63.9	Low	60 Å²	60	101.8 Å²	101.8	50%	0.496	52%	0.518	S	S	.	.	H	α-helix	trans	-61.4	-39.1	176.2	0	0	0	0	0	112.4	L159 F160 I161 S167	L159-A163 WeakPolarHBondContact O-CB 3.46Å; L159-A163 PolarHBondContact O-N 3.04Å; F160-A163 PolarHBondContact O-N 3.13Å; I161-A163 PolarHBondContact O-N 3.21Å; A163-S167 WeakPolarHBondContact O-CB 3.28Å; A163-S167 PolarHBondContact O-N 3.37Å
164	L	68.8	Low	63.3	Low	93 Å²	93	100.7 Å²	100.7	49%	0.487	53%	0.526	S	S	.	.	H	α-helix	trans	-67.9	-41.6	177.3	-171	143	0	0	0	111.9	F160 I161 I162 S167 L168	F160-L164 HydrophobicContact CE1-CD1 4.17Å; F160-L164 WeakPolarHBondContact O-CB 3.38Å; F160-L164 PolarHBondContact O-N 3.09Å; I161-L164 PolarHBondContact O-N 3.03Å; I162-L164 VanDerWaalsContact C-N 3.31Å; I162-L164 PolarHBondContact O-N 3.13Å; L164-S167 PolarHBondContact O-N 2.95Å; L164-L168 WeakPolarHBondContact O-CB 3.5Å; L164-L168 PolarHBondContact O-N 3.49Å
165	V	71.4	Confident	62.7	Low	75 Å²	75	100 Å²	100	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-64.1	-43.3	174.6	170.1	0	0	0	0	111.5	I161 I162 L168 L169	I161-V165 WeakPolarHBondContact O-CG2 3.5Å; I161-V165 PolarHBondContact O-N 2.96Å; I162-V165 PolarHBondContact O-N 3.45Å; V165-L168 PolarHBondContact O-N 3.03Å; V165-L169 HydrophobicContact CG1-CD1 4.01Å; V165-L169 PolarHBondContact O-N 3.35Å
166	M	60.3	Low	62.2	Low	84 Å²	84	96.2 Å²	96.2	41%	0.414	53%	0.528	S	S	.	.	H	α-helix	trans	-63.8	-40.3	176.3	-71.9	-70.9	-71.5	0	0	112.2	I162 L169 N170 M274	I162-M166 HydrophobicContact CG2-CG 4.42Å; I162-M166 WeakPolarHBondContact O-CB 3.23Å; I162-M166 VanDerWaalsContact O-CG 3.28Å; I162-M166 WeakPolarHBondContact O-CG 3.41Å; I162-M166 PolarHBondContact O-N 2.74Å; M166-L169 PolarHBondContact O-N 3.22Å; M166-N170 PolarHBondContact O-N 2.91Å; M166-N170 VanDerWaalsContact O-N 3.11Å; M166-M274 HydrophobicContact CE-CE 3.66Å; M166-M274 HydrophobicContact SD-CE 4.2Å
167	S	59.6	Low	62.6	Low	85 Å²	85	93.4 Å²	93.4	59%	0.594	52%	0.52	S	S	*	.	H	α-helix	trans	-62.9	-42.6	173.4	-173.4	0	0	0	0	111.8	A163 L164 N170 S171	A163-S167 WeakPolarHBondContact O-CB 3.28Å; A163-S167 PolarHBondContact O-N 3.37Å; L164-S167 PolarHBondContact O-N 2.95Å; S167-N170 PolarHBondContact O-N 3.47Å; S167-S171 PolarHBondContact O-N 2.93Å; S167-S171 VanDerWaalsContact O-N 3.16Å
168	L	61.6	Low	63.2	Low	115 Å²	115	91.3 Å²	91.3	60%	0.602	52%	0.523	S	S	*	.	H	α-helix	trans	-66.1	-39.9	178.4	-146.9	79.4	0	0	0	112.4	L164 V165 S171	L164-L168 WeakPolarHBondContact O-CB 3.5Å; L164-L168 PolarHBondContact O-N 3.49Å; V165-L168 PolarHBondContact O-N 3.03Å; L168-S171 WeakPolarHBondContact O-CB 3.46Å; L168-S171 PolarHBondContact O-N 3.33Å
169	L	60.2	Low	63.9	Low	91 Å²	91	87.3 Å²	87.3	48%	0.476	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-42.6	174.6	-82.7	161.3	0	0	0	112	V165 M166 S171 I172	V165-L169 HydrophobicContact CG1-CD1 4.01Å; V165-L169 PolarHBondContact O-N 3.35Å; M166-L169 PolarHBondContact O-N 3.22Å; L169-S171 VanDerWaalsContact C-N 3.31Å; L169-S171 PolarHBondContact O-N 2.82Å; L169-I172 PolarHBondContact O-N 3.16Å
170	N	56.8	Low	64.9	Low	113 Å²	113	85.7 Å²	85.7	60%	0.604	50%	0.499	S	S	*	.	H	α-helix	trans	-66.1	-34.3	179.3	-161.9	28.4	0	0	0	112.4	M166 S167 I172 N173	M166-N170 PolarHBondContact O-N 2.91Å; M166-N170 VanDerWaalsContact O-N 3.11Å; S167-N170 PolarHBondContact O-N 3.47Å; N170-I172 PolarHBondContact O-N 2.92Å; N170-N173 PolarHBondContact O-N 2.94Å
171	S	54.6	Low	65.6	Low	90 Å²	90	82.6 Å²	82.6	63%	0.629	48%	0.483	S	S	*	.	H	α-helix	trans	-58	-33.6	176.7	-169.1	0	0	0	0	113.4	S167 L168 L169 N173	S167-S171 PolarHBondContact O-N 2.93Å; S167-S171 VanDerWaalsContact O-N 3.16Å; L168-S171 WeakPolarHBondContact O-CB 3.46Å; L168-S171 PolarHBondContact O-N 3.33Å; L169-S171 VanDerWaalsContact C-N 3.31Å; L169-S171 PolarHBondContact O-N 2.82Å; S171-N173 VanDerWaalsContact C-N 3.33Å; S171-N173 PolarHBondContact O-N 2.92Å
172	I	53.3	Low	66.4	Low	117 Å²	117	83.3 Å²	83.3	60%	0.6	49%	0.488	S	S	*	.	H	α-helix	trans	-69	-30	-175.2	-63.2	168.1	0	0	0	112.2	L169 N170 T174	L169-I172 PolarHBondContact O-N 3.16Å; N170-I172 PolarHBondContact O-N 2.92Å; I172-T174 VanDerWaalsContact C-N 3.34Å; I172-T174 PolarHBondContact O-N 3.02Å
173	N	53.3	Low	67	Low	103 Å²	103	83.4 Å²	83.4	55%	0.551	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-5.5	-174.5	-78.5	-16.2	0	0	0	115.1	N170 S171	N170-N173 PolarHBondContact O-N 2.94Å; S171-N173 VanDerWaalsContact C-N 3.33Å; S171-N173 PolarHBondContact O-N 2.92Å
174	T	51.3	Low	68	Low	109 Å²	109	80.6 Å²	80.6	67%	0.669	47%	0.466	S	S	*	.			trans	-111.1	53.8	-169.9	-41.6	0	0	0	0	112.5	I172	I172-T174 VanDerWaalsContact C-N 3.34Å; I172-T174 PolarHBondContact O-N 3.02Å
175	S	53.6	Low	68.8	Low	108 Å²	108	77.1 Å²	77.1	76%	0.755	45%	0.448	S	S	*	.			trans	-103.1	51.8	-175	43.3	0	0	0	0	113.9
176	G	59.6	Low	69.4	Low	22 Å²	22	78.3 Å²	78.3	23%	0.227	45%	0.452	C	S	.	.			trans	-138.6	136.2	170.1	0	0	0	0	0	111
177	G	71.9	Confident	70.4	Confident	30 Å²	30	76.4 Å²	76.4	31%	0.309	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.6	176.7	0	0	0	0	0	111.4	Y226 R227	G177-Y226 WeakPolarHBondContact O-CA 3.47Å; G177-Y226 WeakPolarHBondContact O-CD1 3.49Å; G177-R227 PolarHBondContact O-N 3.49Å
178	N	79	Confident	71.5	Confident	135 Å²	135	72.4 Å²	72.4	72%	0.722	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	138.9	173.6	-70.9	-0.4	0	0	0	110.9	R227	N178-R227 CarbonylContact C-O 3.54Å; N178-R227 VanDerWaalsContact CA-O 3.25Å; N178-R227 WeakPolarHBondContact CA-O 3.49Å
179	I	83.8	Confident	72.6	Confident	25 Å²	25	67.1 Å²	67.1	13%	0.128	39%	0.387	C	S	.	.			trans	-134.2	153.7	178.1	-167.3	164.9	0	0	0	111.8	D183 M188 I208 Y226 R227 M228	I179-D183 HydrophobicContact CD1-CB 3.78Å; I179-D183 HydrophobicContact CG1-CB 3.62Å; I179-M188 HydrophobicContact CD1-CE 3.24Å; I179-M188 HydrophobicContact CD1-SD 3.74Å; I179-I208 HydrophobicContact CG2-CD1 3.86Å; I179-Y226 HydrophobicContact CB-CD1 4.43Å; I179-R227 PolarHBondContact N-O 3.39Å; I179-M228 HydrophobicContact CG2-CB 4.18Å
180	S	86.7	Confident	73.7	Confident	52 Å²	52	65.3 Å²	65.3	36%	0.364	38%	0.384	S	S	.	.			trans	-89.6	160.6	175.1	86.8	0	0	0	0	112.6	N182 D183 F184	S180-N182 PolarHBondContact O-N 2.91Å; S180-D183 WeakPolarHBondContact CB-OD2 3.37Å; S180-D183 PolarHBondContact O-N 3.09Å; S180-D183 PolarHBondContact OG-N 2.94Å; S180-D183 PolarHBondContact OG-OD2 3.17Å; S180-F184 PolarHBondContact O-N 3.39Å
181	W	84.6	Confident	74.8	Confident	77 Å²	77	64.5 Å²	64.5	29%	0.292	38%	0.376	S	S	.	.	H	α-helix	trans	-58.2	-43.3	176.5	176.8	-100.9	0	0	0	112.9	D183 F184 V185 M228 F236 K239	W181-D183 PolarHBondContact O-N 3.38Å; W181-F184 HydrophobicContact CE3-CD1 4.08Å; W181-F184 HydrophobicContact CZ3-CD1 4.02Å; W181-F184 HydrophobicContact CZ3-CE1 4.06Å; W181-F184 PolarHBondContact O-N 3.4Å; W181-V185 HydrophobicContact CD2-CG2 4.22Å; W181-V185 HydrophobicContact CH2-CG2 4.49Å; W181-V185 HydrophobicContact CZ2-CG2 3.96Å; W181-V185 WeakPolarHBondContact O-CG2 3.25Å; W181-V185 PolarHBondContact O-N 3.13Å; W181-M228 VanDerWaalsContact CA-SD 3.59Å; W181-M228 HydrophobicContact CB-SD 4.1Å; W181-M228 HydrophobicContact CE3-CE 3.82Å; W181-M228 HydrophobicContact CE3-SD 4.01Å; W181-M228 HydrophobicContact CZ3-CE 4.23Å; W181-F236 HydrophobicContact CE3-CE2 4.02Å; W181-F236 HydrophobicContact CH2-CE2 4.39Å; W181-F236 HydrophobicContact CZ3-CD2 4.11Å; W181-F236 AromaticContact CZ3-CE2 3.41Å; W181-F236 HydrophobicContact CZ3-CE2 3.41Å; W181-F236 VanDerWaalsContact CZ3-CE2 3.41Å; W181-F236 AromaticContact CZ3-CZ 4Å; W181-F236 HydrophobicContact CZ3-CZ 4Å; W181-K239 HydrophobicContact CH2-CB 4.07Å; W181-K239 HydrophobicContact CZ2-CB 4.04Å
182	N	86.1	Confident	76.1	Confident	108 Å²	108	62.9 Å²	62.9	58%	0.578	37%	0.373	S	S	*	.	H	α-helix	trans	-67.7	-36.7	-178.3	-69.8	2.1	0	0	0	111.9	S180 N186	S180-N182 PolarHBondContact O-N 2.91Å; N182-N186 WeakPolarHBondContact O-CB 3.43Å; N182-N186 PolarHBondContact O-N 3.17Å; N182-N186 VanDerWaalsContact O-N 3.08Å; N182-N186 PolarHBondContact O-ND2 2.89Å
183	D	85	Confident	77.5	Confident	60 Å²	60	59.2 Å²	59.2	32%	0.321	35%	0.353	S	S	.	.	H	α-helix	trans	-69.2	-41.1	175.4	-57.6	-50.8	0	0	0	110.6	I179 S180 W181 E187 F217	I179-D183 HydrophobicContact CD1-CB 3.78Å; I179-D183 HydrophobicContact CG1-CB 3.62Å; S180-D183 WeakPolarHBondContact CB-OD2 3.37Å; S180-D183 PolarHBondContact O-N 3.09Å; S180-D183 PolarHBondContact OG-N 2.94Å; S180-D183 PolarHBondContact OG-OD2 3.17Å; W181-D183 PolarHBondContact O-N 3.38Å; D183-E187 WeakPolarHBondContact O-CA 3.41Å; D183-E187 VanDerWaalsContact O-CB 3.31Å; D183-E187 WeakPolarHBondContact O-CB 3.32Å; D183-E187 PolarHBondContact O-N 2.98Å; D183-F217 HydrophobicContact CB-CZ 4.16Å
184	F	86	Confident	79	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	33%	0.33	C	S	.	.	I	π-helix	trans	-58.7	-48.7	175.3	167.6	-110.2	0	0	0	112	S180 W181 M188 L189 V194 V197 I208 M228 L240	S180-F184 PolarHBondContact O-N 3.39Å; W181-F184 HydrophobicContact CE3-CD1 4.08Å; W181-F184 HydrophobicContact CZ3-CD1 4.02Å; W181-F184 HydrophobicContact CZ3-CE1 4.06Å; W181-F184 PolarHBondContact O-N 3.4Å; F184-M188 HydrophobicContact CD2-CB 4.28Å; F184-M188 HydrophobicContact CD2-SD 3.96Å; F184-M188 WeakPolarHBondContact O-CB 3.4Å; F184-M188 PolarHBondContact O-N 3.38Å; F184-L189 PolarHBondContact O-N 3.49Å; F184-V194 HydrophobicContact CD2-CG2 4.46Å; F184-V194 HydrophobicContact CE2-CG1 4.33Å; F184-V194 HydrophobicContact CE2-CG2 3.83Å; F184-V197 HydrophobicContact CE2-CG2 4.48Å; F184-V197 HydrophobicContact CZ-CG2 4.18Å; F184-I208 HydrophobicContact CB-CD1 4.28Å; F184-I208 HydrophobicContact CD2-CD1 3.4Å; F184-I208 VanDerWaalsContact CD2-CD1 3.4Å; F184-I208 HydrophobicContact CD2-CG1 3.92Å; F184-I208 HydrophobicContact CD2-CG2 3.98Å; F184-I208 HydrophobicContact CE2-CB 4.47Å; F184-I208 HydrophobicContact CE2-CD1 3.88Å; F184-I208 HydrophobicContact CE2-CG1 3.84Å; F184-I208 HydrophobicContact CE2-CG2 3.73Å; F184-I208 HydrophobicContact CG-CD1 3.9Å; F184-M228 HydrophobicContact CB-SD 4.42Å; F184-M228 HydrophobicContact CD1-CE 4.22Å; F184-M228 HydrophobicContact CG-CE 4.47Å; F184-L240 HydrophobicContact CE1-CD1 3.78Å; F184-L240 HydrophobicContact CZ-CD1 4Å
185	V	86.1	Confident	80.6	Confident	20 Å²	20	51.8 Å²	51.8	12%	0.121	31%	0.313	C	S	.	.	I	π-helix	trans	-66.1	-49.2	-179.6	175.4	0	0	0	0	111.8	W181 L189 A190 A243 L247	W181-V185 HydrophobicContact CD2-CG2 4.22Å; W181-V185 HydrophobicContact CH2-CG2 4.49Å; W181-V185 HydrophobicContact CZ2-CG2 3.96Å; W181-V185 WeakPolarHBondContact O-CG2 3.25Å; W181-V185 PolarHBondContact O-N 3.13Å; V185-L189 HydrophobicContact CG1-CD2 4.5Å; V185-L189 HydrophobicContact CG2-CD2 4.43Å; V185-L189 WeakPolarHBondContact O-CB 3.5Å; V185-A190 WeakPolarHBondContact O-CB 3.34Å; V185-A190 PolarHBondContact O-N 3.14Å; V185-A243 HydrophobicContact CG2-CB 4.44Å; V185-L247 HydrophobicContact CG1-CD1 4.43Å
186	N	83.4	Confident	82.2	Confident	101 Å²	101	51.4 Å²	51.4	54%	0.54	30%	0.295	S	S	.	.	I	π-helix	trans	-83.2	-33	-171.3	-66	-65.1	0	0	0	114.4	N182	N182-N186 WeakPolarHBondContact O-CB 3.43Å; N182-N186 PolarHBondContact O-N 3.17Å; N182-N186 VanDerWaalsContact O-N 3.08Å; N182-N186 PolarHBondContact O-ND2 2.89Å
187	E	81.7	Confident	83.5	Confident	44 Å²	44	50.4 Å²	50.4	21%	0.206	29%	0.285	C	S	.	.	I	π-helix	trans	-107.1	-13.8	-172.2	-77.3	-78.7	139.7	0	0	114.2	D183 K191 I216 F217	D183-E187 WeakPolarHBondContact O-CA 3.41Å; D183-E187 VanDerWaalsContact O-CB 3.31Å; D183-E187 WeakPolarHBondContact O-CB 3.32Å; D183-E187 PolarHBondContact O-N 2.98Å; E187-K191 IonicContact OE1-NZ 2.7Å; E187-K191 PolarHBondContact OE1-NZ 3.35Å; E187-K191 IonicContact OE2-NZ 3.82Å; E187-K191 PolarHBondContact OE2-NZ 3.25Å; E187-I216 HydrophobicContact CB-CG2 4.1Å; E187-F217 HydrophobicContact CB-CE1 4.36Å; E187-F217 HydrophobicContact CB-CZ 4.35Å; E187-F217 HydrophobicContact CG-CD1 3.89Å; E187-F217 HydrophobicContact CG-CE1 3.61Å; E187-F217 HydrophobicContact CG-CZ 4.08Å; E187-F217 VanDerWaalsContact OE2-CA 3.32Å; E187-F217 WeakPolarHBondContact OE2-CA 3.25Å; E187-F217 PolarHBondContact OE2-N 3.25Å
188	M	83.1	Confident	84.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.274	C	S	.	.	I	π-helix	trans	-118.1	-55.2	176.2	-54.8	175.1	162.8	0	0	112	I179 F184 K191 G192 E193 V194 I208 L210 I216 Y226	I179-M188 HydrophobicContact CD1-CE 3.24Å; I179-M188 HydrophobicContact CD1-SD 3.74Å; F184-M188 HydrophobicContact CD2-CB 4.28Å; F184-M188 HydrophobicContact CD2-SD 3.96Å; F184-M188 WeakPolarHBondContact O-CB 3.4Å; F184-M188 PolarHBondContact O-N 3.38Å; M188-K191 PolarHBondContact O-N 3.04Å; M188-G192 PolarHBondContact O-N 3.05Å; M188-E193 PolarHBondContact O-N 3.34Å; M188-E193 VanDerWaalsContact O-N 3.07Å; M188-V194 HydrophobicContact CB-CG2 3.53Å; M188-I208 HydrophobicContact SD-CG2 4.1Å; M188-L210 HydrophobicContact CB-CD2 4.28Å; M188-L210 HydrophobicContact CE-CD1 4.35Å; M188-L210 HydrophobicContact CE-CD2 4.33Å; M188-L210 HydrophobicContact CG-CD2 4.12Å; M188-L210 HydrophobicContact SD-CD2 4.07Å; M188-I216 HydrophobicContact CE-CD1 3.46Å; M188-I216 VanDerWaalsContact CE-CD1 3.46Å; M188-I216 HydrophobicContact CE-CG1 4.49Å; M188-I216 HydrophobicContact CE-CG2 4.44Å; M188-I216 HydrophobicContact CG-CD1 4.26Å; M188-I216 HydrophobicContact CG-CG1 4.45Å; M188-I216 HydrophobicContact CG-CG2 4.39Å; M188-Y226 HydrophobicContact CE-CD1 4.26Å; M188-Y226 HydrophobicContact CE-CD2 3.61Å; M188-Y226 HydrophobicContact CE-CE2 3.95Å; M188-Y226 HydrophobicContact CE-CG 3.78Å
189	L	85.1	Confident	84.6	Confident	5 Å²	5	43.4 Å²	43.4	3%	0.026	24%	0.24	C	C	.	.	I	π-helix	trans	-67.8	-54.5	-175	-178	62.2	0	0	0	111.8	F184 V185 K191 G192 L240 A243 L247 I249 I255	F184-L189 PolarHBondContact O-N 3.49Å; V185-L189 HydrophobicContact CG1-CD2 4.5Å; V185-L189 HydrophobicContact CG2-CD2 4.43Å; V185-L189 WeakPolarHBondContact O-CB 3.5Å; L189-K191 PolarHBondContact O-N 3.41Å; L189-G192 PolarHBondContact O-N 3.36Å; L189-L240 HydrophobicContact CD2-CD1 4.21Å; L189-A243 HydrophobicContact CD2-CB 4.13Å; L189-L247 HydrophobicContact CD2-CD1 3.96Å; L189-L247 HydrophobicContact CG-CD1 3.84Å; L189-I249 HydrophobicContact CD1-CD1 4.33Å; L189-I255 HydrophobicContact CD1-CD1 3.22Å; L189-I255 HydrophobicContact CD1-CG1 4.43Å
190	A	82.5	Confident	84.6	Confident	52 Å²	52	42.6 Å²	42.6	43%	0.43	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-12.9	179.7	0	0	0	0	0	114.6	V185 L247	V185-A190 WeakPolarHBondContact O-CB 3.34Å; V185-A190 PolarHBondContact O-N 3.14Å; A190-L247 HydrophobicContact CB-CD1 4.05Å; A190-L247 HydrophobicContact CB-CD2 3.89Å
191	K	80.8	Confident	84.2	Confident	97 Å²	97	42.2 Å²	42.2	42%	0.422	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-2.7	176.2	-60.8	-174.1	-172.1	173.5	0	113.5	E187 M188 L189 E193	E187-K191 IonicContact OE1-NZ 2.7Å; E187-K191 PolarHBondContact OE1-NZ 3.35Å; E187-K191 IonicContact OE2-NZ 3.82Å; E187-K191 PolarHBondContact OE2-NZ 3.25Å; M188-K191 PolarHBondContact O-N 3.04Å; L189-K191 PolarHBondContact O-N 3.41Å; K191-E193 VanDerWaalsContact C-N 3.27Å; K191-E193 HydrophobicContact CB-CG 3.89Å; K191-E193 PolarHBondContact O-N 2.91Å
192	G	80.5	Confident	83.7	Confident	55 Å²	55	43.8 Å²	43.8	57%	0.567	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.1	17.7	-177.8	0	0	0	0	0	114.6	M188 L189 V194	M188-G192 PolarHBondContact O-N 3.05Å; L189-G192 PolarHBondContact O-N 3.36Å; G192-V194 VanDerWaalsContact C-N 3.34Å; G192-V194 PolarHBondContact O-N 3.32Å
193	E	83.3	Confident	83.1	Confident	41 Å²	41	41 Å²	41	19%	0.192	23%	0.232	C	C	.	.			trans	-85.9	-6.8	-171	-69	-79	-144.6	0	0	113.5	M188 K191 L210 H211 A214 V215	M188-E193 PolarHBondContact O-N 3.34Å; M188-E193 VanDerWaalsContact O-N 3.07Å; K191-E193 VanDerWaalsContact C-N 3.27Å; K191-E193 HydrophobicContact CB-CG 3.89Å; K191-E193 PolarHBondContact O-N 2.91Å; E193-L210 HydrophobicContact CB-CD2 4.38Å; E193-L210 CarbonylContact O-C 3.5Å; E193-L210 VanDerWaalsContact O-CA 3.28Å; E193-L210 WeakPolarHBondContact O-CA 3.15Å; E193-L210 WeakPolarHBondContact O-CD2 3.48Å; E193-H211 PolarHBondContact O-N 3.49Å; E193-A214 HydrophobicContact CB-CB 4.04Å; E193-A214 HydrophobicContact CG-CB 4.31Å; E193-A214 WeakPolarHBondContact OE1-CA 3.46Å; E193-A214 VanDerWaalsContact OE2-CA 3.24Å; E193-A214 WeakPolarHBondContact OE2-CA 3.41Å; E193-A214 VanDerWaalsContact OE2-CB 3.23Å; E193-A214 WeakPolarHBondContact OE2-CB 3.45Å; E193-V215 PolarHBondContact OE1-N 2.95Å
194	V	85.4	Confident	83	Confident	9 Å²	9	42.2 Å²	42.2	6%	0.055	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	118.9	-176.5	-177	0	0	0	0	110.6	F184 M188 G192 V197 I208 L210 I255	F184-V194 HydrophobicContact CD2-CG2 4.46Å; F184-V194 HydrophobicContact CE2-CG1 4.33Å; F184-V194 HydrophobicContact CE2-CG2 3.83Å; M188-V194 HydrophobicContact CB-CG2 3.53Å; G192-V194 VanDerWaalsContact C-N 3.34Å; G192-V194 PolarHBondContact O-N 3.32Å; V194-V197 HydrophobicContact CG1-CG2 4.04Å; V194-I208 HydrophobicContact CG1-CG2 4.02Å; V194-I208 HydrophobicContact CG2-CG2 4.29Å; V194-L210 HydrophobicContact CG2-CD2 4.36Å; V194-I255 HydrophobicContact CB-CD1 3.75Å; V194-I255 HydrophobicContact CG1-CD1 3.83Å; V194-I255 HydrophobicContact CG1-CG2 4.18Å
195	S	84.6	Confident	82.9	Confident	47 Å²	47	44 Å²	44	33%	0.329	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-39.2	178.7	171.1	0	0	0	0	113.4	Y209 H211	S195-Y209 PolarHBondContact N-O 2.94Å; S195-H211 WeakPolarHBondContact CA-NE2 3.33Å
196	R	86.3	Confident	82.9	Confident	100 Å²	100	43 Å²	43	38%	0.377	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	158.5	177.2	62.9	177.8	-171.7	-175.9	-0.6	111.6	Q198 Y209 P256	R196-Q198 VanDerWaalsContact CZ-NE2 3.33Å; R196-Y209 HydrophobicContact CG-CD2 3.91Å; R196-Y209 HydrophobicContact CG-CG 4.08Å; R196-Y209 PolarHBondContact N-O 3.45Å; R196-Y209 PolarHBondContact O-N 3.5Å; R196-P256 HydrophobicContact CB-CG 3.95Å
197	V	88.3	Confident	83.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.3	175.3	176.7	0	0	0	0	109.6	F184 V194 V206 F236 I255 P256 V257 T258	F184-V197 HydrophobicContact CE2-CG2 4.48Å; F184-V197 HydrophobicContact CZ-CG2 4.18Å; V194-V197 HydrophobicContact CG1-CG2 4.04Å; V197-V206 HydrophobicContact CG1-CG1 3.26Å; V197-F236 HydrophobicContact CG1-CE1 3.89Å; V197-F236 HydrophobicContact CG1-CZ 4.26Å; V197-I255 HydrophobicContact CG2-CG2 4.02Å; V197-P256 PolarHBondContact N-O 3.29Å; V197-P256 VanDerWaalsContact N-O 3.08Å; V197-V257 CarbonylContact O-C 3.52Å; V197-V257 WeakPolarHBondContact O-CA 3.43Å; V197-T258 PolarHBondContact O-N 3.46Å
198	Q	87.5	Confident	83.4	Confident	18 Å²	18	36.5 Å²	36.5	8%	0.084	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.3	174.1	-63.8	-162.5	-17.2	0	0	111	R196 V206 E207 Y209 T258	R196-Q198 VanDerWaalsContact CZ-NE2 3.33Å; Q198-V206 CarbonylContact O-C 3.56Å; Q198-V206 WeakPolarHBondContact O-CA 3.4Å; Q198-E207 HydrophobicContact CB-CB 4.33Å; Q198-E207 PolarHBondContact N-O 2.86Å; Q198-E207 PolarHBondContact O-N 3.04Å; Q198-Y209 HydrophobicContact CB-CE2 4.08Å; Q198-Y209 HydrophobicContact CG-CD2 4.04Å; Q198-Y209 HydrophobicContact CG-CE2 3.65Å; Q198-T258 CarbonylContact C-O 3.59Å; Q198-T258 VanDerWaalsContact CA-O 3.23Å; Q198-T258 WeakPolarHBondContact CA-O 3.49Å
199	V	86.1	Confident	83.5	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.2	179.9	-179	0	0	0	0	108.9	P201 V206 I233 F236 V257 T258 Y259 K260	V199-P201 HydrophobicContact CG1-CG 4.26Å; V199-P201 WeakPolarHBondContact O-CD 3.46Å; V199-V206 HydrophobicContact CG2-CG2 4.28Å; V199-I233 HydrophobicContact CG1-CD1 3.8Å; V199-I233 HydrophobicContact CG1-CG1 3.41Å; V199-I233 VanDerWaalsContact CG1-CG1 3.41Å; V199-F236 HydrophobicContact CG2-CD1 4.12Å; V199-F236 HydrophobicContact CG2-CE1 4.33Å; V199-V257 HydrophobicContact CG2-CG1 3.72Å; V199-T258 PolarHBondContact N-O 3.21Å; V199-Y259 HydrophobicContact CB-CD1 3.77Å; V199-Y259 HydrophobicContact CB-CE1 3.81Å; V199-Y259 HydrophobicContact CB-CG 4.47Å; V199-Y259 HydrophobicContact CG1-CD1 3.85Å; V199-Y259 HydrophobicContact CG1-CE1 3.67Å; V199-Y259 HydrophobicContact CG2-CE1 4.24Å; V199-K260 PolarHBondContact O-N 2.67Å
200	V	83.7	Confident	83.5	Confident	8 Å²	8	38.8 Å²	38.8	5%	0.048	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	85.8	176.7	-173.1	0	0	0	0	109.1	E202 S203 I205 E207 K260 T262	V200-E202 PolarHBondContact O-N 2.76Å; V200-E202 VanDerWaalsContact O-N 3.17Å; V200-S203 WeakPolarHBondContact CG1-OG 3.26Å; V200-S203 PolarHBondContact O-N 2.77Å; V200-S203 PolarHBondContact O-OG 3Å; V200-I205 PolarHBondContact N-O 3.45Å; V200-E207 HydrophobicContact CG2-CG 4.32Å; V200-K260 HydrophobicContact CG2-CB 4.46Å; V200-T262 HydrophobicContact CG1-CG2 3.9Å
201	P	77.8	Confident	83.5	Confident	45 Å²	45	40.5 Å²	40.5	29%	0.292	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-60.5	-30.2	-169.4	-24.9	34.6	0	0	0	114.5	V199 S203 I233 Y259	V199-P201 HydrophobicContact CG1-CG 4.26Å; V199-P201 WeakPolarHBondContact O-CD 3.46Å; P201-S203 PolarHBondContact O-N 3.17Å; P201-S203 VanDerWaalsContact O-N 3.08Å; P201-I233 HydrophobicContact CB-CG2 4.35Å; P201-Y259 HydrophobicContact CG-CD1 4.06Å
202	E	75.2	Confident	83.2	Confident	109 Å²	109	41.4 Å²	41.4	51%	0.509	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-68.7	-5.7	-177.6	-64.8	152.2	177.4	0	0	113.7	V200 R261 T262	V200-E202 PolarHBondContact O-N 2.76Å; V200-E202 VanDerWaalsContact O-N 3.17Å; E202-R261 WeakPolarHBondContact OE1-CB 3.32Å; E202-T262 WeakPolarHBondContact OE2-CA 3.4Å; E202-T262 WeakPolarHBondContact OE2-CB 3.29Å; E202-T262 PolarHBondContact OE2-N 2.88Å; E202-T262 PolarHBondContact OE2-OG1 2.93Å
203	S	73.1	Confident	82.8	Confident	50 Å²	50	41.4 Å²	41.4	35%	0.35	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-137.8	5.6	-174	65.1	0	0	0	0	114.3	V200 P201 I205	V200-S203 WeakPolarHBondContact CG1-OG 3.26Å; V200-S203 PolarHBondContact O-N 2.77Å; V200-S203 PolarHBondContact O-OG 3Å; P201-S203 PolarHBondContact O-N 3.17Å; P201-S203 VanDerWaalsContact O-N 3.08Å; S203-I205 WeakPolarHBondContact O-CG1 3.49Å; S203-I205 PolarHBondContact O-N 3.26Å; S203-I205 VanDerWaalsContact O-N 3.08Å
204	D	82.4	Confident	82.4	Confident	85 Å²	85	39.6 Å²	39.6	46%	0.455	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	28.7	-174.6	-63.6	-45	0	0	0	114.2	Q229 V230	D204-Q229 WeakPolarHBondContact O-CA 3.13Å; D204-V230 PolarHBondContact O-N 3.06Å
205	I	84	Confident	81.9	Confident	37 Å²	37	42 Å²	42	19%	0.19	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.5	-177.4	-71.8	159.9	0	0	0	110.7	V200 S203 E207 R227 M228 Q229	V200-I205 PolarHBondContact N-O 3.45Å; S203-I205 WeakPolarHBondContact O-CG1 3.49Å; S203-I205 PolarHBondContact O-N 3.26Å; S203-I205 VanDerWaalsContact O-N 3.08Å; I205-E207 HydrophobicContact CG2-CG 4.44Å; I205-R227 HydrophobicContact CG2-CB 4.11Å; I205-R227 HydrophobicContact CG2-CG 4.11Å; I205-M228 WeakPolarHBondContact CA-O 3.42Å; I205-Q229 HydrophobicContact CG1-CG 3.9Å
206	V	86.3	Confident	81.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.9	169.9	179	0	0	0	0	109	V197 Q198 V199 I208 R227 M228 V230 I233 F236	V197-V206 HydrophobicContact CG1-CG1 3.26Å; Q198-V206 CarbonylContact O-C 3.56Å; Q198-V206 WeakPolarHBondContact O-CA 3.4Å; V199-V206 HydrophobicContact CG2-CG2 4.28Å; V206-I208 HydrophobicContact CG1-CG1 4.39Å; V206-R227 WeakPolarHBondContact O-CA 3.23Å; V206-M228 HydrophobicContact CB-CE 4.47Å; V206-M228 PolarHBondContact N-O 3.29Å; V206-M228 PolarHBondContact O-N 3.43Å; V206-V230 HydrophobicContact CB-CG2 4.43Å; V206-V230 HydrophobicContact CG2-CG2 3.76Å; V206-I233 HydrophobicContact CG2-CD1 3.86Å; V206-F236 HydrophobicContact CB-CZ 4.3Å; V206-F236 HydrophobicContact CG1-CE1 3.98Å; V206-F236 HydrophobicContact CG1-CE2 4.46Å; V206-F236 HydrophobicContact CG1-CZ 3.76Å; V206-F236 HydrophobicContact CG2-CD1 4.18Å; V206-F236 HydrophobicContact CG2-CD2 4.17Å; V206-F236 HydrophobicContact CG2-CE1 4.05Å; V206-F236 HydrophobicContact CG2-CE2 4Å; V206-F236 HydrophobicContact CG2-CG 4.25Å; V206-F236 HydrophobicContact CG2-CZ 3.96Å
207	E	87.3	Confident	80.5	Confident	9 Å²	9	40.2 Å²	40.2	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	112.9	173.6	-49.1	-161.5	112.6	0	0	109.5	Q198 V200 I205 Y209 Y226 R227 K260	Q198-E207 HydrophobicContact CB-CB 4.33Å; Q198-E207 PolarHBondContact N-O 2.86Å; Q198-E207 PolarHBondContact O-N 3.04Å; V200-E207 HydrophobicContact CG2-CG 4.32Å; I205-E207 HydrophobicContact CG2-CG 4.44Å; E207-Y209 HydrophobicContact CB-CE2 4.12Å; E207-Y226 CarbonylContact C-O 3.52Å; E207-Y226 WeakPolarHBondContact CA-O 3.42Å; E207-R227 HydrophobicContact CG-CG 4.36Å; E207-R227 IonicContact OE1-CZ 3.78Å; E207-R227 IonicContact OE1-NE 3.85Å; E207-R227 PolarHBondContact OE1-NE 2.7Å; E207-R227 IonicContact OE1-NH2 3.4Å; E207-R227 PolarHBondContact OE1-NH2 2.78Å; E207-K260 IonicContact OE2-NZ 2.65Å; E207-K260 PolarHBondContact OE2-NZ 3.14Å; E207-K260 VanDerWaalsContact OE2-NZ 3.09Å
208	I	87.8	Confident	79.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.8	-179.8	-61.5	150.9	0	0	0	108.6	I179 F184 M188 V194 V206 M225 Y226 M228	I179-I208 HydrophobicContact CG2-CD1 3.86Å; F184-I208 HydrophobicContact CB-CD1 4.28Å; F184-I208 HydrophobicContact CD2-CD1 3.4Å; F184-I208 VanDerWaalsContact CD2-CD1 3.4Å; F184-I208 HydrophobicContact CD2-CG1 3.92Å; F184-I208 HydrophobicContact CD2-CG2 3.98Å; F184-I208 HydrophobicContact CE2-CB 4.47Å; F184-I208 HydrophobicContact CE2-CD1 3.88Å; F184-I208 HydrophobicContact CE2-CG1 3.84Å; F184-I208 HydrophobicContact CE2-CG2 3.73Å; F184-I208 HydrophobicContact CG-CD1 3.9Å; M188-I208 HydrophobicContact SD-CG2 4.1Å; V194-I208 HydrophobicContact CG1-CG2 4.02Å; V194-I208 HydrophobicContact CG2-CG2 4.29Å; V206-I208 HydrophobicContact CG1-CG1 4.39Å; I208-M225 VanDerWaalsContact O-CA 3.32Å; I208-M225 WeakPolarHBondContact O-CA 3.49Å; I208-Y226 PolarHBondContact N-O 2.9Å; I208-Y226 PolarHBondContact O-N 3.07Å; I208-M228 HydrophobicContact CD1-CB 4.25Å; I208-M228 HydrophobicContact CD1-CE 4.13Å
209	Y	86.1	Confident	78.8	Confident	44 Å²	44	51.1 Å²	51.1	17%	0.173	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.3	176.2	-68.6	-87	0	0	0	111.2	S195 R196 Q198 E207 L224 M225	S195-Y209 PolarHBondContact N-O 2.94Å; R196-Y209 HydrophobicContact CG-CD2 3.91Å; R196-Y209 HydrophobicContact CG-CG 4.08Å; R196-Y209 PolarHBondContact N-O 3.45Å; R196-Y209 PolarHBondContact O-N 3.5Å; Q198-Y209 HydrophobicContact CB-CE2 4.08Å; Q198-Y209 HydrophobicContact CG-CD2 4.04Å; Q198-Y209 HydrophobicContact CG-CE2 3.65Å; E207-Y209 HydrophobicContact CB-CE2 4.12Å; Y209-L224 WeakPolarHBondContact CA-O 3.28Å; Y209-M225 HydrophobicContact CD1-CB 4.19Å; Y209-M225 HydrophobicContact CD1-CG 4.09Å; Y209-M225 HydrophobicContact CE1-CB 4.02Å; Y209-M225 HydrophobicContact CE1-CG 3.63Å; Y209-M225 HydrophobicContact CE1-SD 3.73Å; Y209-M225 PolarHBondContact OH-SD 3.34Å; Y209-M225 VanDerWaalsContact OH-SD 3.39Å
210	L	84.4	Confident	78	Confident	9 Å²	9	56 Å²	56	5%	0.047	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	158.7	-175.6	-60.9	159	0	0	0	111.8	M188 E193 V194 A214 I216 L224 Y226	M188-L210 HydrophobicContact CB-CD2 4.28Å; M188-L210 HydrophobicContact CE-CD1 4.35Å; M188-L210 HydrophobicContact CE-CD2 4.33Å; M188-L210 HydrophobicContact CG-CD2 4.12Å; M188-L210 HydrophobicContact SD-CD2 4.07Å; E193-L210 HydrophobicContact CB-CD2 4.38Å; E193-L210 CarbonylContact O-C 3.5Å; E193-L210 VanDerWaalsContact O-CA 3.28Å; E193-L210 WeakPolarHBondContact O-CA 3.15Å; E193-L210 WeakPolarHBondContact O-CD2 3.48Å; V194-L210 HydrophobicContact CG2-CD2 4.36Å; L210-A214 HydrophobicContact CB-CB 3.97Å; L210-I216 HydrophobicContact CD1-CD1 3.35Å; L210-I216 HydrophobicContact CD2-CD1 4.1Å; L210-I216 HydrophobicContact CG-CD1 4.36Å; L210-L224 PolarHBondContact N-O 3.33Å; L210-Y226 HydrophobicContact CD1-CD2 3.62Å; L210-Y226 HydrophobicContact CD1-CE2 3.5Å
211	H	82.3	Confident	77.2	Confident	88 Å²	88	61.6 Å²	61.6	41%	0.407	34%	0.339	S	S	.	.			trans	-66	146	170.9	-77.8	-76.2	0	0	0	111.9	E193 S195 G213 A214	E193-H211 PolarHBondContact O-N 3.49Å; S195-H211 WeakPolarHBondContact CA-NE2 3.33Å; H211-G213 PolarHBondContact O-N 2.92Å; H211-A214 WeakPolarHBondContact O-CB 3.26Å; H211-A214 PolarHBondContact O-N 3.38Å; H211-A214 VanDerWaalsContact O-N 3.13Å
212	P	75.7	Confident	76.3	Confident	115 Å²	115	68.1 Å²	68.1	75%	0.747	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	111.4	177.4	-20.2	32.7	0	0	0	111.1
213	G	71.6	Confident	75.8	Confident	56 Å²	56	65.1 Å²	65.1	58%	0.577	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.4	-3.6	-177.3	0	0	0	0	0	115.2	H211	H211-G213 PolarHBondContact O-N 2.92Å
214	A	74	Confident	76	Confident	2 Å²	2	66.2 Å²	66.2	2%	0.017	37%	0.366	C	S	.	.			trans	-50.9	137.2	-175.5	0	0	0	0	0	115.4	E193 L210 H211 R221	E193-A214 HydrophobicContact CB-CB 4.04Å; E193-A214 HydrophobicContact CG-CB 4.31Å; E193-A214 WeakPolarHBondContact OE1-CA 3.46Å; E193-A214 VanDerWaalsContact OE2-CA 3.24Å; E193-A214 WeakPolarHBondContact OE2-CA 3.41Å; E193-A214 VanDerWaalsContact OE2-CB 3.23Å; E193-A214 WeakPolarHBondContact OE2-CB 3.45Å; L210-A214 HydrophobicContact CB-CB 3.97Å; H211-A214 WeakPolarHBondContact O-CB 3.26Å; H211-A214 PolarHBondContact O-N 3.38Å; H211-A214 VanDerWaalsContact O-N 3.13Å; A214-R221 PolarHBondContact O-N 2.81Å
215	V	75.1	Confident	75.9	Confident	59 Å²	59	64.3 Å²	64.3	36%	0.358	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	95.5	-174.1	-176.5	0	0	0	0	111	E193	E193-V215 PolarHBondContact OE1-N 2.95Å
216	I	70.8	Confident	75.9	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	131.6	-178.3	-46.8	166.1	0	0	0	109.2	E187 M188 L210 G218 R219 R221 Y226	E187-I216 HydrophobicContact CB-CG2 4.1Å; M188-I216 HydrophobicContact CE-CD1 3.46Å; M188-I216 VanDerWaalsContact CE-CD1 3.46Å; M188-I216 HydrophobicContact CE-CG1 4.49Å; M188-I216 HydrophobicContact CE-CG2 4.44Å; M188-I216 HydrophobicContact CG-CD1 4.26Å; M188-I216 HydrophobicContact CG-CG1 4.45Å; M188-I216 HydrophobicContact CG-CG2 4.39Å; L210-I216 HydrophobicContact CD1-CD1 3.35Å; L210-I216 HydrophobicContact CD2-CD1 4.1Å; L210-I216 HydrophobicContact CG-CD1 4.36Å; I216-G218 PolarHBondContact O-N 2.77Å; I216-R219 PolarHBondContact N-O 3.44Å; I216-R219 PolarHBondContact O-N 3.08Å; I216-R221 HydrophobicContact CB-CG 4.33Å; I216-R221 HydrophobicContact CD1-CG 4.47Å; I216-Y226 HydrophobicContact CD1-CE2 3.88Å
217	F	71.7	Confident	76	Confident	109 Å²	109	67.9 Å²	67.9	48%	0.478	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	37.8	-172.3	-54.1	-76.9	0	0	0	113	D183 E187 R219	D183-F217 HydrophobicContact CB-CZ 4.16Å; E187-F217 HydrophobicContact CB-CE1 4.36Å; E187-F217 HydrophobicContact CB-CZ 4.35Å; E187-F217 HydrophobicContact CG-CD1 3.89Å; E187-F217 HydrophobicContact CG-CE1 3.61Å; E187-F217 HydrophobicContact CG-CZ 4.08Å; E187-F217 VanDerWaalsContact OE2-CA 3.32Å; E187-F217 WeakPolarHBondContact OE2-CA 3.25Å; E187-F217 PolarHBondContact OE2-N 3.25Å; F217-R219 VanDerWaalsContact C-N 3.3Å; F217-R219 PolarHBondContact O-N 2.94Å
218	G	67.4	Low	75.9	Confident	62 Å²	62	67.8 Å²	67.8	64%	0.639	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	17.1	176.1	0	0	0	0	0	115.4	I216	I216-G218 PolarHBondContact O-N 2.77Å
219	R	72.8	Confident	75.6	Confident	185 Å²	185	75 Å²	75	70%	0.698	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.2	174	-61.1	-174.7	-176.4	-172.3	0.8	111.3	I216 F217 R221	I216-R219 PolarHBondContact N-O 3.44Å; I216-R219 PolarHBondContact O-N 3.08Å; F217-R219 VanDerWaalsContact C-N 3.3Å; F217-R219 PolarHBondContact O-N 2.94Å; R219-R221 PolarHBondContact O-N 2.86Å
220	P	68.8	Low	75.4	Confident	102 Å²	102	74 Å²	74	66%	0.662	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	125.2	172.6	27	-33.5	0	0	0	109.6
221	R	66.4	Low	75.1	Confident	125 Å²	125	79 Å²	79	47%	0.472	44%	0.44	S	S	.	.			trans	-100	128.1	-178.9	-73.6	-71.1	-172.9	149.1	3.4	110.4	A214 I216 R219 A223	A214-R221 PolarHBondContact O-N 2.81Å; I216-R221 HydrophobicContact CB-CG 4.33Å; I216-R221 HydrophobicContact CD1-CG 4.47Å; R219-R221 PolarHBondContact O-N 2.86Å; R221-A223 PolarHBondContact O-N 3Å
222	L	58.2	Low	75	Confident	183 Å²	183	78.3 Å²	78.3	96%	0.958	44%	0.44	S	S	*	.	S	Bend	trans	-70.5	-14.4	176.2	-70.1	168.6	0	0	0	113.8
223	A	66.6	Low	75.2	Confident	46 Å²	46	73.5 Å²	73.5	38%	0.38	41%	0.408	S	S	.	.			trans	-92.5	109	176.2	0	0	0	0	0	109.4	R221 M225 Y226	R221-A223 PolarHBondContact O-N 3Å; A223-M225 VanDerWaalsContact C-N 3.27Å; A223-M225 PolarHBondContact O-N 3.04Å; A223-Y226 HydrophobicContact CB-CE2 4.4Å; A223-Y226 VanDerWaalsContact O-CE2 3.24Å; A223-Y226 WeakPolarHBondContact O-CE2 3.34Å
224	L	75.3	Confident	75.4	Confident	72 Å²	72	77.2 Å²	77.2	38%	0.377	42%	0.415	S	S	.	.			trans	-87.3	8.1	178.1	-60.4	176.7	0	0	0	113.4	Y209 L210	Y209-L224 WeakPolarHBondContact CA-O 3.28Å; L210-L224 PolarHBondContact N-O 3.33Å
225	M	82.3	Confident	75.8	Confident	46 Å²	46	82.8 Å²	82.8	23%	0.227	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	126.8	-177.9	-170.1	-172	82	0	0	110.6	I208 Y209 A223	I208-M225 VanDerWaalsContact O-CA 3.32Å; I208-M225 WeakPolarHBondContact O-CA 3.49Å; Y209-M225 HydrophobicContact CD1-CB 4.19Å; Y209-M225 HydrophobicContact CD1-CG 4.09Å; Y209-M225 HydrophobicContact CE1-CB 4.02Å; Y209-M225 HydrophobicContact CE1-CG 3.63Å; Y209-M225 HydrophobicContact CE1-SD 3.73Å; Y209-M225 PolarHBondContact OH-SD 3.34Å; Y209-M225 VanDerWaalsContact OH-SD 3.39Å; A223-M225 VanDerWaalsContact C-N 3.27Å; A223-M225 PolarHBondContact O-N 3.04Å
226	Y	83.8	Confident	76.3	Confident	26 Å²	26	80 Å²	80	10%	0.102	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	157.8	175.9	-74.2	-94.6	0	0	0	110.6	G177 I179 M188 E207 I208 L210 I216 A223	G177-Y226 WeakPolarHBondContact O-CA 3.47Å; G177-Y226 WeakPolarHBondContact O-CD1 3.49Å; I179-Y226 HydrophobicContact CB-CD1 4.43Å; M188-Y226 HydrophobicContact CE-CD1 4.26Å; M188-Y226 HydrophobicContact CE-CD2 3.61Å; M188-Y226 HydrophobicContact CE-CE2 3.95Å; M188-Y226 HydrophobicContact CE-CG 3.78Å; E207-Y226 CarbonylContact C-O 3.52Å; E207-Y226 WeakPolarHBondContact CA-O 3.42Å; I208-Y226 PolarHBondContact N-O 2.9Å; I208-Y226 PolarHBondContact O-N 3.07Å; L210-Y226 HydrophobicContact CD1-CD2 3.62Å; L210-Y226 HydrophobicContact CD1-CE2 3.5Å; I216-Y226 HydrophobicContact CD1-CE2 3.88Å; A223-Y226 HydrophobicContact CB-CE2 4.4Å; A223-Y226 VanDerWaalsContact O-CE2 3.24Å; A223-Y226 WeakPolarHBondContact O-CE2 3.34Å
227	R	86.6	Confident	76.9	Confident	86 Å²	86	83 Å²	83	33%	0.325	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.7	177.6	-71.3	-177.1	171.5	166.7	-1.9	110.7	G177 N178 I179 I205 V206 E207	G177-R227 PolarHBondContact O-N 3.49Å; N178-R227 CarbonylContact C-O 3.54Å; N178-R227 VanDerWaalsContact CA-O 3.25Å; N178-R227 WeakPolarHBondContact CA-O 3.49Å; I179-R227 PolarHBondContact N-O 3.39Å; I205-R227 HydrophobicContact CG2-CB 4.11Å; I205-R227 HydrophobicContact CG2-CG 4.11Å; V206-R227 WeakPolarHBondContact O-CA 3.23Å; E207-R227 HydrophobicContact CG-CG 4.36Å; E207-R227 IonicContact OE1-CZ 3.78Å; E207-R227 IonicContact OE1-NE 3.85Å; E207-R227 PolarHBondContact OE1-NE 2.7Å; E207-R227 IonicContact OE1-NH2 3.4Å; E207-R227 PolarHBondContact OE1-NH2 2.78Å
228	M	86.3	Confident	77.5	Confident	6 Å²	6	84 Å²	84	3%	0.03	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	131.5	176.5	178.5	171.3	56.3	0	0	108.7	I179 W181 F184 I205 V206 I208 V230 F236	I179-M228 HydrophobicContact CG2-CB 4.18Å; W181-M228 VanDerWaalsContact CA-SD 3.59Å; W181-M228 HydrophobicContact CB-SD 4.1Å; W181-M228 HydrophobicContact CE3-CE 3.82Å; W181-M228 HydrophobicContact CE3-SD 4.01Å; W181-M228 HydrophobicContact CZ3-CE 4.23Å; F184-M228 HydrophobicContact CB-SD 4.42Å; F184-M228 HydrophobicContact CD1-CE 4.22Å; F184-M228 HydrophobicContact CG-CE 4.47Å; I205-M228 WeakPolarHBondContact CA-O 3.42Å; V206-M228 HydrophobicContact CB-CE 4.47Å; V206-M228 PolarHBondContact N-O 3.29Å; V206-M228 PolarHBondContact O-N 3.43Å; I208-M228 HydrophobicContact CD1-CB 4.25Å; I208-M228 HydrophobicContact CD1-CE 4.13Å; M228-V230 HydrophobicContact CE-CG2 4.28Å; M228-V230 HydrophobicContact CG-CG2 4.28Å; M228-F236 HydrophobicContact CE-CE2 3.56Å; M228-F236 HydrophobicContact CE-CZ 3.96Å
229	Q	82	Confident	78.4	Confident	152 Å²	152	87.2 Å²	87.2	71%	0.71	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.4	171.3	-75.3	-177.6	-40.6	0	0	109.7	D204 I205	D204-Q229 WeakPolarHBondContact O-CA 3.13Å; I205-Q229 HydrophobicContact CG1-CG 3.9Å
230	V	81.8	Confident	79	Confident	23 Å²	23	78.4 Å²	78.4	14%	0.139	40%	0.404	C	S	.	.			trans	-128.2	120.3	-175.2	-176.3	0	0	0	0	109.3	D204 V206 M228 N232 I233 F236	D204-V230 PolarHBondContact O-N 3.06Å; V206-V230 HydrophobicContact CB-CG2 4.43Å; V206-V230 HydrophobicContact CG2-CG2 3.76Å; M228-V230 HydrophobicContact CE-CG2 4.28Å; M228-V230 HydrophobicContact CG-CG2 4.28Å; V230-N232 WeakPolarHBondContact CG1-O 3.45Å; V230-N232 PolarHBondContact O-N 3.27Å; V230-N232 VanDerWaalsContact O-N 3.12Å; V230-I233 HydrophobicContact CB-CD1 4.19Å; V230-F236 HydrophobicContact CB-CD2 4.38Å; V230-F236 HydrophobicContact CG1-CB 4.32Å; V230-F236 HydrophobicContact CG1-CD2 3.83Å; V230-F236 HydrophobicContact CG1-CG 4.49Å; V230-F236 HydrophobicContact CG2-CD2 3.74Å; V230-F236 HydrophobicContact CG2-CE2 3.93Å
231	A	77.3	Confident	79.9	Confident	113 Å²	113	76.2 Å²	76.2	93%	0.934	38%	0.383	S	S	*	.	S	Bend	trans	-67.9	-11.8	-173.5	0	0	0	0	0	115.5
232	N	80.7	Confident	80.9	Confident	74 Å²	74	73 Å²	73	40%	0.396	38%	0.383	S	S	.	.			trans	-153	108.6	170.6	-177.9	-67.7	0	0	0	108	V230 D234 K235	V230-N232 WeakPolarHBondContact CG1-O 3.45Å; V230-N232 PolarHBondContact O-N 3.27Å; V230-N232 VanDerWaalsContact O-N 3.12Å; N232-D234 PolarHBondContact OD1-N 3.32Å; N232-K235 WeakPolarHBondContact OD1-CG 3.44Å; N232-K235 PolarHBondContact OD1-N 3.15Å
233	I	79.4	Confident	82.1	Confident	14 Å²	14	64.7 Å²	64.7	7%	0.072	34%	0.341	C	S	.	.	S	Bend	trans	-73.3	-29.2	-174.6	-148.3	79.1	0	0	0	112.3	V199 P201 V206 V230 K235 F236	V199-I233 HydrophobicContact CG1-CD1 3.8Å; V199-I233 HydrophobicContact CG1-CG1 3.41Å; V199-I233 VanDerWaalsContact CG1-CG1 3.41Å; P201-I233 HydrophobicContact CB-CG2 4.35Å; V206-I233 HydrophobicContact CG2-CD1 3.86Å; V230-I233 HydrophobicContact CB-CD1 4.19Å; I233-K235 PolarHBondContact O-N 3.37Å; I233-F236 WeakPolarHBondContact O-CB 3.36Å; I233-F236 PolarHBondContact O-N 2.71Å; I233-F236 VanDerWaalsContact O-N 3.12Å
234	D	77.1	Confident	83	Confident	135 Å²	135	62.5 Å²	62.5	72%	0.722	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-35.6	-176.5	-53	-46.4	0	0	0	111.7	N232 F236	N232-D234 PolarHBondContact OD1-N 3.32Å; D234-F236 VanDerWaalsContact C-N 3.29Å; D234-F236 PolarHBondContact O-N 2.85Å
235	K	81.6	Confident	83.4	Confident	118 Å²	118	64.2 Å²	64.2	51%	0.513	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	5.5	173.9	-63	-166.5	176.1	-158.5	0	113.9	N232 I233 K239	N232-K235 WeakPolarHBondContact OD1-CG 3.44Å; N232-K235 PolarHBondContact OD1-N 3.15Å; I233-K235 PolarHBondContact O-N 3.37Å; K235-K239 WeakPolarHBondContact O-CG 3.31Å; K235-K239 PolarHBondContact O-N 3.37Å
236	F	84.8	Confident	83.5	Confident	2 Å²	2	70 Å²	70	1%	0.009	36%	0.355	C	S	.	.	H	α-helix	trans	-70.1	-46.5	-178.5	-179.2	-99	0	0	0	112.2	W181 V197 V199 V206 M228 V230 I233 D234 K239 L240	W181-F236 HydrophobicContact CE3-CE2 4.02Å; W181-F236 HydrophobicContact CH2-CE2 4.39Å; W181-F236 HydrophobicContact CZ3-CD2 4.11Å; W181-F236 AromaticContact CZ3-CE2 3.41Å; W181-F236 HydrophobicContact CZ3-CE2 3.41Å; W181-F236 VanDerWaalsContact CZ3-CE2 3.41Å; W181-F236 AromaticContact CZ3-CZ 4Å; W181-F236 HydrophobicContact CZ3-CZ 4Å; V197-F236 HydrophobicContact CG1-CE1 3.89Å; V197-F236 HydrophobicContact CG1-CZ 4.26Å; V199-F236 HydrophobicContact CG2-CD1 4.12Å; V199-F236 HydrophobicContact CG2-CE1 4.33Å; V206-F236 HydrophobicContact CB-CZ 4.3Å; V206-F236 HydrophobicContact CG1-CE1 3.98Å; V206-F236 HydrophobicContact CG1-CE2 4.46Å; V206-F236 HydrophobicContact CG1-CZ 3.76Å; V206-F236 HydrophobicContact CG2-CD1 4.18Å; V206-F236 HydrophobicContact CG2-CD2 4.17Å; V206-F236 HydrophobicContact CG2-CE1 4.05Å; V206-F236 HydrophobicContact CG2-CE2 4Å; V206-F236 HydrophobicContact CG2-CG 4.25Å; V206-F236 HydrophobicContact CG2-CZ 3.96Å; M228-F236 HydrophobicContact CE-CE2 3.56Å; M228-F236 HydrophobicContact CE-CZ 3.96Å; V230-F236 HydrophobicContact CB-CD2 4.38Å; V230-F236 HydrophobicContact CG1-CB 4.32Å; V230-F236 HydrophobicContact CG1-CD2 3.83Å; V230-F236 HydrophobicContact CG1-CG 4.49Å; V230-F236 HydrophobicContact CG2-CD2 3.74Å; V230-F236 HydrophobicContact CG2-CE2 3.93Å; I233-F236 WeakPolarHBondContact O-CB 3.36Å; I233-F236 PolarHBondContact O-N 2.71Å; I233-F236 VanDerWaalsContact O-N 3.12Å; D234-F236 VanDerWaalsContact C-N 3.29Å; D234-F236 PolarHBondContact O-N 2.85Å; F236-K239 PolarHBondContact O-N 3.08Å; F236-L240 HydrophobicContact CE1-CD2 4.37Å; F236-L240 PolarHBondContact O-N 3.43Å
237	E	84.3	Confident	83.4	Confident	65 Å²	65	71.9 Å²	71.9	30%	0.304	37%	0.367	S	S	.	.	H	α-helix	trans	-66	-43	-179	-177.1	165.9	-160.3	0	0	111.2	K239 L240 R241	E237-K239 VanDerWaalsContact C-N 3.31Å; E237-K239 PolarHBondContact O-N 3.17Å; E237-L240 WeakPolarHBondContact O-CB 3.39Å; E237-L240 PolarHBondContact O-N 2.9Å; E237-L240 VanDerWaalsContact O-N 3.07Å; E237-R241 HydrophobicContact CG-CG 4.36Å; E237-R241 WeakPolarHBondContact O-CG 3.41Å; E237-R241 PolarHBondContact O-N 3.49Å; E237-R241 IonicContact OE1-CZ 3.66Å; E237-R241 IonicContact OE1-NE 2.77Å; E237-R241 IonicContact OE1-NH2 3.68Å; E237-R241 PolarHBondContact OE1-NH2 2.96Å
238	E	84.9	Confident	83.1	Confident	130 Å²	130	75 Å²	75	61%	0.607	39%	0.39	S	S	*	.	H	α-helix	trans	-53.4	-46.7	174	-173.7	-176.6	-161.7	0	0	111.7	R241 A242	E238-R241 PolarHBondContact O-N 3.13Å; E238-A242 PolarHBondContact O-N 3.35Å
239	K	85.2	Confident	82.8	Confident	128 Å²	128	76.8 Å²	76.8	56%	0.557	40%	0.399	S	S	*	.	H	α-helix	trans	-67.9	-33.9	176.3	-75	-180	176.2	-173.6	0	113.7	W181 K235 F236 E237 A243	W181-K239 HydrophobicContact CH2-CB 4.07Å; W181-K239 HydrophobicContact CZ2-CB 4.04Å; K235-K239 WeakPolarHBondContact O-CG 3.31Å; K235-K239 PolarHBondContact O-N 3.37Å; F236-K239 PolarHBondContact O-N 3.08Å; E237-K239 VanDerWaalsContact C-N 3.31Å; E237-K239 PolarHBondContact O-N 3.17Å; K239-A243 PolarHBondContact O-N 3.21Å; K239-A243 VanDerWaalsContact O-N 3.13Å
240	L	86.6	Confident	82.6	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-67.1	-45.2	175.7	-176.8	65.3	0	0	0	110.6	F184 L189 F236 E237 A243 E244 V257	F184-L240 HydrophobicContact CE1-CD1 3.78Å; F184-L240 HydrophobicContact CZ-CD1 4Å; L189-L240 HydrophobicContact CD2-CD1 4.21Å; F236-L240 HydrophobicContact CE1-CD2 4.37Å; F236-L240 PolarHBondContact O-N 3.43Å; E237-L240 WeakPolarHBondContact O-CB 3.39Å; E237-L240 PolarHBondContact O-N 2.9Å; E237-L240 VanDerWaalsContact O-N 3.07Å; L240-A243 PolarHBondContact O-N 3.22Å; L240-E244 WeakPolarHBondContact O-CG 3.25Å; L240-E244 PolarHBondContact O-N 3.5Å; L240-V257 HydrophobicContact CD2-CG2 3.64Å
241	R	87.4	Confident	82.2	Confident	57 Å²	57	77.2 Å²	77.2	22%	0.215	41%	0.409	C	S	.	.	H	α-helix	trans	-63	-42.3	176.6	-61	-47.8	178.7	-163.6	-7.2	112.2	E237 E238 A243 E244 E245 I255	E237-R241 HydrophobicContact CG-CG 4.36Å; E237-R241 WeakPolarHBondContact O-CG 3.41Å; E237-R241 PolarHBondContact O-N 3.49Å; E237-R241 IonicContact OE1-CZ 3.66Å; E237-R241 IonicContact OE1-NE 2.77Å; E237-R241 IonicContact OE1-NH2 3.68Å; E237-R241 PolarHBondContact OE1-NH2 2.96Å; E238-R241 PolarHBondContact O-N 3.13Å; R241-A243 VanDerWaalsContact C-N 3.28Å; R241-A243 PolarHBondContact O-N 3.46Å; R241-E244 WeakPolarHBondContact CD-OE2 3.34Å; R241-E244 IonicContact CZ-OE2 3.66Å; R241-E244 IonicContact NE-OE2 3.53Å; R241-E244 IonicContact NH1-OE1 2.92Å; R241-E244 PolarHBondContact NH1-OE1 3.33Å; R241-E244 IonicContact NH1-OE2 3.44Å; R241-E244 PolarHBondContact NH1-OE2 3.43Å; R241-E244 PolarHBondContact O-N 2.92Å; R241-E245 WeakPolarHBondContact O-CG 3.43Å; R241-E245 PolarHBondContact O-N 2.92Å; R241-I255 PolarHBondContact NH1-O 2.96Å
242	A	86.4	Confident	82	Confident	56 Å²	56	80 Å²	80	46%	0.463	40%	0.4	S	S	.	.	H	α-helix	trans	-59.4	-38.9	174.6	0	0	0	0	0	112.4	E238 E245 E246	E238-A242 PolarHBondContact O-N 3.35Å; A242-E245 PolarHBondContact O-N 2.95Å; A242-E246 PolarHBondContact O-N 2.91Å
243	A	84.5	Confident	81.7	Confident	9 Å²	9	82.3 Å²	82.3	7%	0.074	41%	0.412	C	S	.	.	H	α-helix	trans	-72.3	-35.9	175.6	0	0	0	0	0	113.2	V185 L189 K239 L240 R241 E245 L247	V185-A243 HydrophobicContact CG2-CB 4.44Å; L189-A243 HydrophobicContact CD2-CB 4.13Å; K239-A243 PolarHBondContact O-N 3.21Å; K239-A243 VanDerWaalsContact O-N 3.13Å; L240-A243 PolarHBondContact O-N 3.22Å; R241-A243 VanDerWaalsContact C-N 3.28Å; R241-A243 PolarHBondContact O-N 3.46Å; A243-E245 VanDerWaalsContact C-N 3.29Å; A243-E245 PolarHBondContact O-N 2.79Å; A243-L247 WeakPolarHBondContact O-CB 3.48Å; A243-L247 WeakPolarHBondContact O-CD1 3.32Å; A243-L247 VanDerWaalsContact O-CG 3.25Å; A243-L247 WeakPolarHBondContact O-CG 3.38Å; A243-L247 PolarHBondContact O-N 3.23Å; A243-L247 VanDerWaalsContact O-N 3.16Å
244	E	84	Confident	81.8	Confident	0 Å²	0	85.3 Å²	85.3	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-62.7	-36.8	171.7	-71.2	178.8	148.2	0	0	111.5	L240 R241 N248 I249 I255	L240-E244 WeakPolarHBondContact O-CG 3.25Å; L240-E244 PolarHBondContact O-N 3.5Å; R241-E244 WeakPolarHBondContact CD-OE2 3.34Å; R241-E244 IonicContact CZ-OE2 3.66Å; R241-E244 IonicContact NE-OE2 3.53Å; R241-E244 IonicContact NH1-OE1 2.92Å; R241-E244 PolarHBondContact NH1-OE1 3.33Å; R241-E244 IonicContact NH1-OE2 3.44Å; R241-E244 PolarHBondContact NH1-OE2 3.43Å; R241-E244 PolarHBondContact O-N 2.92Å; E244-N248 PolarHBondContact O-N 2.94Å; E244-I249 HydrophobicContact CB-CB 4.48Å; E244-I249 HydrophobicContact CB-CD1 4.43Å; E244-I249 HydrophobicContact CG-CD1 4.34Å; E244-I249 PolarHBondContact O-N 2.89Å; E244-I255 PolarHBondContact OE1-N 3.45Å
245	E	84.3	Confident	82	Confident	109 Å²	109	79.7 Å²	79.7	51%	0.509	39%	0.393	S	S	.	.	H	α-helix	trans	-74.7	-40.8	178.2	-73.3	171.5	-171.6	0	0	112.7	R241 A242 A243 L247 N248 R254	R241-E245 WeakPolarHBondContact O-CG 3.43Å; R241-E245 PolarHBondContact O-N 2.92Å; A242-E245 PolarHBondContact O-N 2.95Å; A243-E245 VanDerWaalsContact C-N 3.29Å; A243-E245 PolarHBondContact O-N 2.79Å; E245-L247 PolarHBondContact O-N 2.89Å; E245-N248 PolarHBondContact O-N 2.87Å; E245-R254 VanDerWaalsContact CG-NH2 3.31Å; E245-R254 IonicContact OE1-CZ 3.55Å; E245-R254 IonicContact OE1-NH1 2.74Å; E245-R254 IonicContact OE1-NH2 3.63Å; E245-R254 PolarHBondContact OE1-NH2 2.95Å
246	E	85.4	Confident	82.1	Confident	167 Å²	167	77.6 Å²	77.6	78%	0.78	39%	0.391	S	S	*	.	H	α-helix	trans	-60.4	-31.1	171.9	-173.4	174.8	-171	0	0	112.2	A242	A242-E246 PolarHBondContact O-N 2.91Å
247	L	81.1	Confident	82	Confident	65 Å²	65	78.8 Å²	78.8	34%	0.34	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	3.8	176.7	-67.1	171.1	0	0	0	114.1	V185 L189 A190 A243 E245 I249	V185-L247 HydrophobicContact CG1-CD1 4.43Å; L189-L247 HydrophobicContact CD2-CD1 3.96Å; L189-L247 HydrophobicContact CG-CD1 3.84Å; A190-L247 HydrophobicContact CB-CD1 4.05Å; A190-L247 HydrophobicContact CB-CD2 3.89Å; A243-L247 WeakPolarHBondContact O-CB 3.48Å; A243-L247 WeakPolarHBondContact O-CD1 3.32Å; A243-L247 VanDerWaalsContact O-CG 3.25Å; A243-L247 WeakPolarHBondContact O-CG 3.38Å; A243-L247 PolarHBondContact O-N 3.23Å; A243-L247 VanDerWaalsContact O-N 3.16Å; E245-L247 PolarHBondContact O-N 2.89Å; L247-I249 VanDerWaalsContact C-N 3.28Å; L247-I249 HydrophobicContact CB-CD1 4.15Å; L247-I249 HydrophobicContact CB-CG1 4Å; L247-I249 HydrophobicContact CD1-CD1 4.47Å; L247-I249 PolarHBondContact O-N 3.3Å
248	N	80.7	Confident	82.1	Confident	151 Å²	151	78.8 Å²	78.8	81%	0.807	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	37.1	-177.4	-76.2	-46.2	0	0	0	114.6	E244 E245	E244-N248 PolarHBondContact O-N 2.94Å; E245-N248 PolarHBondContact O-N 2.87Å
249	I	80.5	Confident	81.9	Confident	45 Å²	45	78 Å²	78	23%	0.231	40%	0.395	C	S	.	.			trans	-76.6	124.3	176.9	-57.7	177.5	0	0	0	109.4	L189 E244 L247 D253	L189-I249 HydrophobicContact CD1-CD1 4.33Å; E244-I249 HydrophobicContact CB-CB 4.48Å; E244-I249 HydrophobicContact CB-CD1 4.43Å; E244-I249 HydrophobicContact CG-CD1 4.34Å; E244-I249 PolarHBondContact O-N 2.89Å; L247-I249 VanDerWaalsContact C-N 3.28Å; L247-I249 HydrophobicContact CB-CD1 4.15Å; L247-I249 HydrophobicContact CB-CG1 4Å; L247-I249 HydrophobicContact CD1-CD1 4.47Å; L247-I249 PolarHBondContact O-N 3.3Å; I249-D253 HydrophobicContact CG2-CB 4.04Å
250	D	77.8	Confident	81.6	Confident	86 Å²	86	76 Å²	76	46%	0.46	39%	0.386	S	S	.	.			trans	-62.2	146.6	178.3	-172.1	10.5	0	0	0	110.6	K252 D253 R254	D250-K252 PolarHBondContact O-N 2.99Å; D250-D253 PolarHBondContact O-N 3.46Å; D250-R254 PolarHBondContact O-N 3.34Å
251	T	72.4	Confident	80.8	Confident	97 Å²	97	85.8 Å²	85.8	60%	0.595	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	-25	177.6	53.4	0	0	0	0	115.2
252	K	73.1	Confident	79.7	Confident	173 Å²	173	85.7 Å²	85.7	75%	0.752	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-26.7	178.2	-66	172.7	-175.2	162.7	0	114.2	D250	D250-K252 PolarHBondContact O-N 2.99Å
253	D	74.4	Confident	78.4	Confident	121 Å²	121	85.6 Å²	85.6	65%	0.647	43%	0.434	S	S	*	.	S	Bend	trans	-101.7	7.9	-175.8	-61.6	-35.5	0	0	0	112.3	I249 D250	I249-D253 HydrophobicContact CG2-CB 4.04Å; D250-D253 PolarHBondContact O-N 3.46Å
254	R	80.5	Confident	77	Confident	77 Å²	77	93.4 Å²	93.4	29%	0.291	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-62.7	140.9	175.8	-72.7	-174.5	176.3	-157.8	-8.8	112	E245 D250	E245-R254 VanDerWaalsContact CG-NH2 3.31Å; E245-R254 IonicContact OE1-CZ 3.55Å; E245-R254 IonicContact OE1-NH1 2.74Å; E245-R254 IonicContact OE1-NH2 3.63Å; E245-R254 PolarHBondContact OE1-NH2 2.95Å; D250-R254 PolarHBondContact O-N 3.34Å
255	I	82.9	Confident	75.7	Confident	18 Å²	18	101.6 Å²	101.6	9%	0.092	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-76.3	136.2	-171.4	-64.2	169	0	0	0	110.8	L189 V194 V197 R241 E244 V257	L189-I255 HydrophobicContact CD1-CD1 3.22Å; L189-I255 HydrophobicContact CD1-CG1 4.43Å; V194-I255 HydrophobicContact CB-CD1 3.75Å; V194-I255 HydrophobicContact CG1-CD1 3.83Å; V194-I255 HydrophobicContact CG1-CG2 4.18Å; V197-I255 HydrophobicContact CG2-CG2 4.02Å; R241-I255 PolarHBondContact NH1-O 2.96Å; E244-I255 PolarHBondContact OE1-N 3.45Å; I255-V257 PolarHBondContact O-N 3.15Å
256	P	82.6	Confident	74.6	Confident	74 Å²	74	98.7 Å²	98.7	48%	0.481	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-71.9	121.8	174	28	-33.5	0	0	0	111.3	R196 V197	R196-P256 HydrophobicContact CB-CG 3.95Å; V197-P256 PolarHBondContact N-O 3.29Å; V197-P256 VanDerWaalsContact N-O 3.08Å
257	V	83.9	Confident	73.5	Confident	27 Å²	27	96.1 Å²	96.1	16%	0.164	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.8	171.3	-175.9	0	0	0	0	108.6	V197 V199 L240 I255 Y259	V197-V257 CarbonylContact O-C 3.52Å; V197-V257 WeakPolarHBondContact O-CA 3.43Å; V199-V257 HydrophobicContact CG2-CG1 3.72Å; L240-V257 HydrophobicContact CD2-CG2 3.64Å; I255-V257 PolarHBondContact O-N 3.15Å; V257-Y259 HydrophobicContact CG1-CE2 4.11Å
258	T	84.9	Confident	72.6	Confident	64 Å²	64	94.7 Å²	94.7	39%	0.393	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	127.2	178.9	-53.1	0	0	0	0	110.9	V197 Q198 V199	V197-T258 PolarHBondContact O-N 3.46Å; Q198-T258 CarbonylContact C-O 3.59Å; Q198-T258 VanDerWaalsContact CA-O 3.23Å; Q198-T258 WeakPolarHBondContact CA-O 3.49Å; V199-T258 PolarHBondContact N-O 3.21Å
259	Y	80.6	Confident	72.1	Confident	114 Å²	114	92.2 Å²	92.2	45%	0.447	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.8	177.2	-68.6	-92.6	0	0	0	111.1	V199 P201 V257	V199-Y259 HydrophobicContact CB-CD1 3.77Å; V199-Y259 HydrophobicContact CB-CE1 3.81Å; V199-Y259 HydrophobicContact CB-CG 4.47Å; V199-Y259 HydrophobicContact CG1-CD1 3.85Å; V199-Y259 HydrophobicContact CG1-CE1 3.67Å; V199-Y259 HydrophobicContact CG2-CE1 4.24Å; P201-Y259 HydrophobicContact CG-CD1 4.06Å; V257-Y259 HydrophobicContact CG1-CE2 4.11Å
260	K	79.9	Confident	71.6	Confident	85 Å²	85	96 Å²	96	37%	0.37	49%	0.493	S	S	.	.			trans	-117.1	100.4	-179.7	179.3	-178.6	168.1	-164.2	0	109.3	V199 V200 E207	V199-K260 PolarHBondContact O-N 2.67Å; V200-K260 HydrophobicContact CG2-CB 4.46Å; E207-K260 IonicContact OE2-NZ 2.65Å; E207-K260 PolarHBondContact OE2-NZ 3.14Å; E207-K260 VanDerWaalsContact OE2-NZ 3.09Å
261	R	70.5	Confident	71.1	Confident	207 Å²	207	94.8 Å²	94.8	78%	0.781	50%	0.495	S	S	*	.			trans	-75.8	124.8	169.6	-66.7	-177.2	-177.5	173.4	-0	109	E202 G263	E202-R261 WeakPolarHBondContact OE1-CB 3.32Å; R261-G263 PolarHBondContact O-N 2.93Å
262	T	63.4	Low	71.2	Confident	55 Å²	55	96 Å²	96	34%	0.337	50%	0.497	S	S	.	.			trans	-81.6	101.5	175.1	54.7	0	0	0	0	108.9	V200 E202 F264	V200-T262 HydrophobicContact CG1-CG2 3.9Å; E202-T262 WeakPolarHBondContact OE2-CA 3.4Å; E202-T262 WeakPolarHBondContact OE2-CB 3.29Å; E202-T262 PolarHBondContact OE2-N 2.88Å; E202-T262 PolarHBondContact OE2-OG1 2.93Å; T262-F264 PolarHBondContact O-N 3.47Å
263	G	59.2	Low	71.2	Confident	54 Å²	54	89.3 Å²	89.3	56%	0.557	48%	0.477	S	S	*	.			trans	-49.5	114.3	-174.5	0	0	0	0	0	112.8	R261 F265 G266	R261-G263 PolarHBondContact O-N 2.93Å; G263-F265 PolarHBondContact O-N 2.9Å; G263-G266 PolarHBondContact O-N 3.32Å
264	F	55.9	Low	71.1	Confident	173 Å²	173	86.5 Å²	86.5	76%	0.759	46%	0.461	S	S	*	.	H	α-helix	trans	-42.6	-36.7	-175	-172.5	-99.2	0	0	0	114.3	T262 G266 A268	T262-F264 PolarHBondContact O-N 3.47Å; F264-G266 VanDerWaalsContact C-N 3.34Å; F264-G266 PolarHBondContact O-N 3.26Å; F264-A268 WeakPolarHBondContact O-CB 3.35Å; F264-A268 PolarHBondContact O-N 3.43Å
265	F	56.7	Low	70.7	Confident	172 Å²	172	85.4 Å²	85.4	75%	0.754	47%	0.468	S	S	*	.	H	α-helix	trans	-59.4	-34.2	178.2	-70.6	-85	0	0	0	114.7	G263 V269	G263-F265 PolarHBondContact O-N 2.9Å; F265-V269 WeakPolarHBondContact O-CB 3.31Å; F265-V269 VanDerWaalsContact O-CG2 3.25Å; F265-V269 WeakPolarHBondContact O-CG2 3.36Å; F265-V269 PolarHBondContact O-N 2.96Å
266	G	60.8	Low	70.4	Confident	48 Å²	48	87.5 Å²	87.5	50%	0.495	49%	0.488	S	S	.	.	H	α-helix	trans	-67.4	-51	-177.2	0	0	0	0	0	112.7	G263 F264 V269 Y270	G263-G266 PolarHBondContact O-N 3.32Å; F264-G266 VanDerWaalsContact C-N 3.34Å; F264-G266 PolarHBondContact O-N 3.26Å; G266-V269 PolarHBondContact O-N 3.19Å; G266-Y270 PolarHBondContact O-N 2.86Å; G266-Y270 VanDerWaalsContact O-N 3.09Å
267	N	61.2	Low	70.2	Confident	113 Å²	113	88.2 Å²	88.2	60%	0.604	49%	0.487	S	S	*	.	H	α-helix	trans	-69.8	-35.8	179	-72.3	-14	0	0	0	111.8	Y270 A271	N267-Y270 PolarHBondContact O-N 3.49Å; N267-A271 VanDerWaalsContact O-CB 3.31Å; N267-A271 WeakPolarHBondContact O-CB 3.4Å; N267-A271 PolarHBondContact O-N 3Å
268	A	62.6	Low	69.6	Low	35 Å²	35	88.7 Å²	88.7	29%	0.289	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-44.4	175.6	0	0	0	0	0	112.2	F264 A271 L272	F264-A268 WeakPolarHBondContact O-CB 3.35Å; F264-A268 PolarHBondContact O-N 3.43Å; A268-A271 PolarHBondContact O-N 2.98Å; A268-L272 WeakPolarHBondContact O-CB 3.3Å; A268-L272 VanDerWaalsContact O-CG 3.29Å; A268-L272 WeakPolarHBondContact O-CG 3.14Å; A268-L272 PolarHBondContact O-N 3.41Å
269	V	70.3	Confident	69.2	Low	99 Å²	99	90.3 Å²	90.3	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-66.3	-39.5	176.9	170.3	0	0	0	0	111.4	F265 G266 L272 G273	F265-V269 WeakPolarHBondContact O-CB 3.31Å; F265-V269 VanDerWaalsContact O-CG2 3.25Å; F265-V269 WeakPolarHBondContact O-CG2 3.36Å; F265-V269 PolarHBondContact O-N 2.96Å; G266-V269 PolarHBondContact O-N 3.19Å; V269-L272 PolarHBondContact O-N 3.25Å; V269-G273 PolarHBondContact O-N 3.35Å
270	Y	70.1	Confident	68.9	Low	125 Å²	125	87.5 Å²	87.5	49%	0.49	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-45.4	174	-176.3	-101	0	0	0	112	G266 N267 G273 M274	G266-Y270 PolarHBondContact O-N 2.86Å; G266-Y270 VanDerWaalsContact O-N 3.09Å; N267-Y270 PolarHBondContact O-N 3.49Å; Y270-G273 PolarHBondContact O-N 3Å; Y270-M274 HydrophobicContact CD1-CG 4.23Å; Y270-M274 HydrophobicContact CE1-CG 3.85Å; Y270-M274 HydrophobicContact CE2-CG 4.21Å; Y270-M274 HydrophobicContact CE2-SD 4.46Å; Y270-M274 WeakPolarHBondContact O-CB 3.45Å; Y270-M274 WeakPolarHBondContact O-CG 3.44Å; Y270-M274 PolarHBondContact O-N 3.44Å
271	A	67	Low	68.6	Low	59 Å²	59	86.1 Å²	86.1	49%	0.488	50%	0.504	S	S	.	.	H	α-helix	trans	-62.6	-42.5	177	0	0	0	0	0	112.3	N267 A268 M274 A275	N267-A271 VanDerWaalsContact O-CB 3.31Å; N267-A271 WeakPolarHBondContact O-CB 3.4Å; N267-A271 PolarHBondContact O-N 3Å; A268-A271 PolarHBondContact O-N 2.98Å; A271-M274 PolarHBondContact O-N 2.88Å; A271-A275 VanDerWaalsContact O-CB 3.28Å; A271-A275 WeakPolarHBondContact O-CB 3.37Å; A271-A275 PolarHBondContact O-N 2.84Å
272	L	74.3	Confident	68.5	Low	123 Å²	123	80.9 Å²	80.9	64%	0.644	49%	0.49	S	S	*	.	H	α-helix	trans	-65.8	-39.2	175	-73.1	170.9	0	0	0	112.2	A268 V269 A275 A276	A268-L272 WeakPolarHBondContact O-CB 3.3Å; A268-L272 VanDerWaalsContact O-CG 3.29Å; A268-L272 WeakPolarHBondContact O-CG 3.14Å; A268-L272 PolarHBondContact O-N 3.41Å; V269-L272 PolarHBondContact O-N 3.25Å; L272-A275 PolarHBondContact O-N 3.24Å; L272-A276 WeakPolarHBondContact O-CB 3.46Å; L272-A276 PolarHBondContact O-N 3.27Å
273	G	73.3	Confident	68.8	Low	33 Å²	33	85.7 Å²	85.7	34%	0.34	50%	0.502	S	S	.	.	H	α-helix	trans	-62.9	-46	174	0	0	0	0	0	112.4	V269 Y270 A276 I277	V269-G273 PolarHBondContact O-N 3.35Å; Y270-G273 PolarHBondContact O-N 3Å; G273-A276 PolarHBondContact O-N 3.44Å; G273-I277 VanDerWaalsContact O-CG1 3.29Å; G273-I277 WeakPolarHBondContact O-CG1 3.48Å; G273-I277 PolarHBondContact O-N 3.46Å
274	M	72.6	Confident	69.2	Low	61 Å²	61	90 Å²	90	30%	0.3	50%	0.503	S	S	.	.	H	α-helix	trans	-66.7	-36.2	176.3	-68.1	-62.1	-74.9	0	0	112.3	M166 Y270 A271 I277 G278	M166-M274 HydrophobicContact CE-CE 3.66Å; M166-M274 HydrophobicContact SD-CE 4.2Å; Y270-M274 HydrophobicContact CD1-CG 4.23Å; Y270-M274 HydrophobicContact CE1-CG 3.85Å; Y270-M274 HydrophobicContact CE2-CG 4.21Å; Y270-M274 HydrophobicContact CE2-SD 4.46Å; Y270-M274 WeakPolarHBondContact O-CB 3.45Å; Y270-M274 WeakPolarHBondContact O-CG 3.44Å; Y270-M274 PolarHBondContact O-N 3.44Å; A271-M274 PolarHBondContact O-N 2.88Å; M274-I277 HydrophobicContact SD-CD1 4.48Å; M274-G278 PolarHBondContact O-N 3.21Å
275	A	72.7	Confident	69.6	Low	54 Å²	54	85 Å²	85	45%	0.446	48%	0.483	S	S	.	.	H	α-helix	trans	-65.2	-43.7	172.4	0	0	0	0	0	111.8	A271 L272 G278 V279	A271-A275 VanDerWaalsContact O-CB 3.28Å; A271-A275 WeakPolarHBondContact O-CB 3.37Å; A271-A275 PolarHBondContact O-N 2.84Å; L272-A275 PolarHBondContact O-N 3.24Å; A275-G278 PolarHBondContact O-N 3.12Å; A275-V279 WeakPolarHBondContact O-CG2 3.37Å; A275-V279 PolarHBondContact O-N 2.83Å
276	A	75.2	Confident	69.8	Low	62 Å²	62	82 Å²	82	51%	0.512	47%	0.471	S	S	.	.	H	α-helix	trans	-63.1	-41.6	176.4	0	0	0	0	0	112.1	L272 G273 V279 A280	L272-A276 WeakPolarHBondContact O-CB 3.46Å; L272-A276 PolarHBondContact O-N 3.27Å; G273-A276 PolarHBondContact O-N 3.44Å; A276-V279 PolarHBondContact O-N 3.05Å; A276-A280 WeakPolarHBondContact O-CB 3.17Å; A276-A280 PolarHBondContact O-N 3.29Å
277	I	78.5	Confident	69.6	Low	90 Å²	90	88.1 Å²	88.1	46%	0.462	48%	0.478	S	S	.	.	H	α-helix	trans	-64	-43.4	173.3	-68.1	164.2	0	0	0	110.6	G273 M274 V279 A280 I281	G273-I277 VanDerWaalsContact O-CG1 3.29Å; G273-I277 WeakPolarHBondContact O-CG1 3.48Å; G273-I277 PolarHBondContact O-N 3.46Å; M274-I277 HydrophobicContact SD-CD1 4.48Å; I277-V279 PolarHBondContact O-N 3.42Å; I277-A280 PolarHBondContact O-N 3.49Å; I277-I281 HydrophobicContact CG2-CD1 3.8Å; I277-I281 HydrophobicContact CG2-CG1 4.44Å; I277-I281 WeakPolarHBondContact O-CB 3.42Å; I277-I281 VanDerWaalsContact O-CG1 3.31Å; I277-I281 WeakPolarHBondContact O-CG1 3.22Å; I277-I281 PolarHBondContact O-N 2.64Å
278	G	71.6	Confident	69.2	Low	37 Å²	37	87.3 Å²	87.3	38%	0.381	47%	0.474	S	S	.	.	H	α-helix	trans	-59.6	-44.7	175.3	0	0	0	0	0	112.9	M274 A275 I281 L282	M274-G278 PolarHBondContact O-N 3.21Å; A275-G278 PolarHBondContact O-N 3.12Å; G278-I281 PolarHBondContact O-N 3.31Å; G278-L282 WeakPolarHBondContact O-CB 3.46Å; G278-L282 PolarHBondContact O-N 2.97Å
279	V	77.6	Confident	68.6	Low	98 Å²	98	87.9 Å²	87.9	59%	0.594	48%	0.479	S	S	*	.	H	α-helix	trans	-66.2	-39.1	175.1	171.6	0	0	0	0	111.5	A275 A276 I277 L282 W283	A275-V279 WeakPolarHBondContact O-CG2 3.37Å; A275-V279 PolarHBondContact O-N 2.83Å; A276-V279 PolarHBondContact O-N 3.05Å; I277-V279 PolarHBondContact O-N 3.42Å; V279-L282 PolarHBondContact O-N 3.02Å; V279-W283 VanDerWaalsContact O-CB 3.23Å; V279-W283 WeakPolarHBondContact O-CB 3.39Å; V279-W283 PolarHBondContact O-N 3.23Å
280	A	72.6	Confident	67.5	Low	55 Å²	55	86 Å²	86	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-65.5	-41.1	176	0	0	0	0	0	112.3	A276 I277 W283 Y284	A276-A280 WeakPolarHBondContact O-CB 3.17Å; A276-A280 PolarHBondContact O-N 3.29Å; I277-A280 PolarHBondContact O-N 3.49Å; A280-W283 PolarHBondContact O-N 3.03Å; A280-Y284 VanDerWaalsContact O-CB 3.27Å; A280-Y284 WeakPolarHBondContact O-CB 3.2Å; A280-Y284 PolarHBondContact O-N 3.25Å
281	I	74.9	Confident	66.4	Low	56 Å²	56	85 Å²	85	29%	0.287	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-45.5	173.4	-69.7	167.5	0	0	0	110.3	I162 I277 G278 W283 Y284 I285	I162-I281 HydrophobicContact CG2-CD1 4.48Å; I277-I281 HydrophobicContact CG2-CD1 3.8Å; I277-I281 HydrophobicContact CG2-CG1 4.44Å; I277-I281 WeakPolarHBondContact O-CB 3.42Å; I277-I281 VanDerWaalsContact O-CG1 3.31Å; I277-I281 WeakPolarHBondContact O-CG1 3.22Å; I277-I281 PolarHBondContact O-N 2.64Å; G278-I281 PolarHBondContact O-N 3.31Å; I281-W283 PolarHBondContact O-N 3.38Å; I281-Y284 PolarHBondContact O-N 3.04Å; I281-I285 HydrophobicContact CG2-CD1 3.76Å; I281-I285 HydrophobicContact CG2-CG1 4.48Å; I281-I285 VanDerWaalsContact O-CG1 3.27Å; I281-I285 WeakPolarHBondContact O-CG1 3.21Å; I281-I285 PolarHBondContact O-N 3.16Å
282	L	68.5	Low	65.2	Low	96 Å²	96	86 Å²	86	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-45.4	177.5	-166.3	73.6	0	0	0	111.3	G278 V279 Y284 I285 F286	G278-L282 WeakPolarHBondContact O-CB 3.46Å; G278-L282 PolarHBondContact O-N 2.97Å; V279-L282 PolarHBondContact O-N 3.02Å; L282-Y284 PolarHBondContact O-N 3.25Å; L282-I285 PolarHBondContact O-N 2.77Å; L282-F286 HydrophobicContact CD1-CE2 4.22Å; L282-F286 HydrophobicContact CD2-CE2 4.34Å; L282-F286 HydrophobicContact CG-CD2 4.05Å; L282-F286 HydrophobicContact CG-CE2 3.94Å; L282-F286 VanDerWaalsContact O-CD2 3.28Å; L282-F286 WeakPolarHBondContact O-CD2 3.49Å; L282-F286 PolarHBondContact O-N 2.95Å
283	W	69.7	Low	63.6	Low	156 Å²	156	85.2 Å²	85.2	59%	0.591	50%	0.501	S	S	*	.	H	α-helix	trans	-61.9	-41.5	175.4	-178.7	83.9	0	0	0	112.3	V279 A280 I281 F286 R287	V279-W283 VanDerWaalsContact O-CB 3.23Å; V279-W283 WeakPolarHBondContact O-CB 3.39Å; V279-W283 PolarHBondContact O-N 3.23Å; A280-W283 PolarHBondContact O-N 3.03Å; I281-W283 PolarHBondContact O-N 3.38Å; W283-F286 PolarHBondContact O-N 3.32Å; W283-R287 WeakPolarHBondContact O-CB 3.11Å; W283-R287 PolarHBondContact O-N 2.97Å
284	Y	66.8	Low	62.4	Low	144 Å²	144	95 Å²	95	57%	0.565	53%	0.527	S	S	*	.	H	α-helix	trans	-65.7	-39.6	176	-168.9	-113.9	0	0	0	111.9	A280 I281 L282 R287 L288	A280-Y284 VanDerWaalsContact O-CB 3.27Å; A280-Y284 WeakPolarHBondContact O-CB 3.2Å; A280-Y284 PolarHBondContact O-N 3.25Å; I281-Y284 PolarHBondContact O-N 3.04Å; L282-Y284 PolarHBondContact O-N 3.25Å; Y284-R287 PolarHBondContact O-N 3.49Å; Y284-L288 HydrophobicContact CD1-CD1 3.65Å; Y284-L288 HydrophobicContact CD2-CD1 4.37Å; Y284-L288 HydrophobicContact CE1-CD1 3.2Å; Y284-L288 HydrophobicContact CE2-CD1 3.99Å; Y284-L288 HydrophobicContact CG-CD1 4.22Å; Y284-L288 WeakPolarHBondContact O-CB 3.28Å; Y284-L288 PolarHBondContact O-N 3.12Å
285	I	65.4	Low	61	Low	68 Å²	68	100.8 Å²	100.8	35%	0.349	55%	0.554	S	S	.	*	H	α-helix	trans	-62.1	-47.6	172.3	-69.7	162.9	0	0	0	110.8	L159 I281 L282 R287 L288 A289	L159-I285 HydrophobicContact CD2-CD1 3.76Å; L159-I285 HydrophobicContact CD2-CG1 4.49Å; I281-I285 HydrophobicContact CG2-CD1 3.76Å; I281-I285 HydrophobicContact CG2-CG1 4.48Å; I281-I285 VanDerWaalsContact O-CG1 3.27Å; I281-I285 WeakPolarHBondContact O-CG1 3.21Å; I281-I285 PolarHBondContact O-N 3.16Å; L282-I285 PolarHBondContact O-N 2.77Å; I285-R287 VanDerWaalsContact C-N 3.27Å; I285-R287 PolarHBondContact O-N 3.39Å; I285-L288 PolarHBondContact O-N 2.91Å; I285-A289 VanDerWaalsContact O-CB 3.23Å; I285-A289 WeakPolarHBondContact O-CB 3.26Å; I285-A289 PolarHBondContact O-N 3.23Å
286	F	60.3	Low	59.4	Low	111 Å²	111	100.8 Å²	100.8	49%	0.487	56%	0.559	S	S	.	*	H	α-helix	trans	-60.8	-34.9	175.8	-88.4	-70.8	0	0	0	112.7	L282 W283 M291	L282-F286 HydrophobicContact CD1-CE2 4.22Å; L282-F286 HydrophobicContact CD2-CE2 4.34Å; L282-F286 HydrophobicContact CG-CD2 4.05Å; L282-F286 HydrophobicContact CG-CE2 3.94Å; L282-F286 VanDerWaalsContact O-CD2 3.28Å; L282-F286 WeakPolarHBondContact O-CD2 3.49Å; L282-F286 PolarHBondContact O-N 2.95Å; W283-F286 PolarHBondContact O-N 3.32Å; F286-M291 HydrophobicContact CD1-CE 4.29Å; F286-M291 HydrophobicContact CD1-SD 3.77Å; F286-M291 HydrophobicContact CE1-CE 4.27Å; F286-M291 HydrophobicContact CE1-SD 3.96Å
287	R	57.1	Low	57.9	Low	175 Å²	175	100 Å²	100	66%	0.66	56%	0.557	S	S	*	*	H	α-helix	trans	-72.8	-40.7	177.2	-164.1	173.5	-176.6	-174.6	-0.3	112.6	W283 Y284 I285 G290	W283-R287 WeakPolarHBondContact O-CB 3.11Å; W283-R287 PolarHBondContact O-N 2.97Å; Y284-R287 PolarHBondContact O-N 3.49Å; I285-R287 VanDerWaalsContact C-N 3.27Å; I285-R287 PolarHBondContact O-N 3.39Å; R287-G290 PolarHBondContact O-N 3.4Å
288	L	51.7	Low	56.2	Low	96 Å²	96	104 Å²	104	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-76.1	-20.9	175.1	-95.6	150	0	0	0	114	R155 Y284 I285 G290	R155-L288 PolarHBondContact NH2-O 3.2Å; Y284-L288 HydrophobicContact CD1-CD1 3.65Å; Y284-L288 HydrophobicContact CD2-CD1 4.37Å; Y284-L288 HydrophobicContact CE1-CD1 3.2Å; Y284-L288 HydrophobicContact CE2-CD1 3.99Å; Y284-L288 HydrophobicContact CG-CD1 4.22Å; Y284-L288 WeakPolarHBondContact O-CB 3.28Å; Y284-L288 PolarHBondContact O-N 3.12Å; I285-L288 PolarHBondContact O-N 2.91Å; L288-G290 PolarHBondContact O-N 2.99Å
289	A	50	Low	54.9	Low	48 Å²	48	105.7 Å²	105.7	40%	0.397	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.3	-4.8	170	0	0	0	0	0	113.1	I285	I285-A289 VanDerWaalsContact O-CB 3.23Å; I285-A289 WeakPolarHBondContact O-CB 3.26Å; I285-A289 PolarHBondContact O-N 3.23Å
290	G	48	Very low	53.8	Low	60 Å²	60	103.9 Å²	103.9	62%	0.619	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	75	23	172.4	0	0	0	0	0	114.5	R287 L288 G292	R287-G290 PolarHBondContact O-N 3.4Å; L288-G290 PolarHBondContact O-N 2.99Å; G290-G292 PolarHBondContact O-N 2.78Å
291	M	45.6	Very low	52.9	Low	104 Å²	104	106.9 Å²	106.9	51%	0.512	58%	0.576	S	S	.	*			trans	-77.8	52.8	178.4	-72	179.7	57.2	0	0	112.9	F286	F286-M291 HydrophobicContact CD1-CE 4.29Å; F286-M291 HydrophobicContact CD1-SD 3.77Å; F286-M291 HydrophobicContact CE1-CE 4.27Å; F286-M291 HydrophobicContact CE1-SD 3.96Å
292	G	43.2	Very low	51.9	Low	78 Å²	78	108.5 Å²	108.5	80%	0.804	59%	0.585	S	S	*	*			trans	-84.4	-8.2	171.4	0	0	0	0	0	114.4	G290	G290-G292 PolarHBondContact O-N 2.78Å
293	S	40.2	Very low	51.4	Low	108 Å²	108	110.9 Å²	110.9	76%	0.755	59%	0.593	S	S	*	*	S	Bend	trans	-126.6	147.2	178.3	-78.2	0	0	0	0	112
294	R	47.9	Very low	50.9	Low	237 Å²	237	108.1 Å²	108.1	89%	0.894	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	162.1	176.1	-69.4	162.9	132.5	131.7	-9.2	111.8
295	E	42.7	Very low	50.5	Low	184 Å²	184	105.1 Å²	105.1	86%	0.86	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	85	-15.4	167.4	-56.5	-176.5	114.7	0	0	120.4
296	G	38.9	Very low	50.2	Low	54 Å²	54	106.7 Å²	106.7	56%	0.557	59%	0.587	S	S	*	*	S	Bend	trans	-69.9	-69.3	-178.8	0	0	0	0	0	116	F298 S299	G296-F298 PolarHBondContact O-N 2.88Å; G296-S299 WeakPolarHBondContact O-CB 3.28Å; G296-S299 PolarHBondContact O-N 3.14Å
297	G	44.8	Very low	50.2	Low	45 Å²	45	101.9 Å²	101.9	46%	0.464	57%	0.567	S	S	.	*	H	α-helix	trans	-68.3	-29	-164.3	0	0	0	0	0	116.4	S299	G297-S299 VanDerWaalsContact C-N 3.32Å
298	F	42.1	Very low	50.4	Low	175 Å²	175	102.1 Å²	102.1	77%	0.768	57%	0.573	S	S	*	*	H	α-helix	trans	-75.6	-19.6	178.4	-82.1	-86.2	0	0	0	113.3	G296 F301 N302	G296-F298 PolarHBondContact O-N 2.88Å; F298-F301 PolarHBondContact O-N 3.5Å; F298-N302 PolarHBondContact O-N 3.48Å; F298-N302 VanDerWaalsContact O-N 3.14Å
299	S	45.2	Very low	51	Low	71 Å²	71	98.9 Å²	98.9	50%	0.497	56%	0.555	S	S	.	*	H	α-helix	trans	-66.6	-43.8	-177.3	-168.8	0	0	0	0	112.1	G296 G297 F301 N302 Q303	G296-S299 WeakPolarHBondContact O-CB 3.28Å; G296-S299 PolarHBondContact O-N 3.14Å; G297-S299 VanDerWaalsContact C-N 3.32Å; S299-F301 VanDerWaalsContact C-N 3.3Å; S299-F301 PolarHBondContact O-N 2.95Å; S299-N302 PolarHBondContact O-N 3.39Å; S299-N302 VanDerWaalsContact O-N 3.14Å; S299-Q303 WeakPolarHBondContact O-CB 3.43Å; S299-Q303 PolarHBondContact O-N 3.24Å
300	A	53.7	Low	52	Low	61 Å²	61	101 Å²	101	50%	0.504	56%	0.563	S	S	.	*	H	α-helix	trans	-60.1	-38.1	178.1	0	0	0	0	0	112.8	Q303 L304	A300-Q303 PolarHBondContact O-N 3.06Å; A300-L304 PolarHBondContact O-N 3.16Å
301	F	53.7	Low	53.1	Low	118 Å²	118	101.3 Å²	101.3	52%	0.518	55%	0.55	S	S	.	*	H	α-helix	trans	-75	-29.8	178.3	-147.6	-87.3	0	0	0	112.6	F298 S299	F298-F301 PolarHBondContact O-N 3.5Å; S299-F301 VanDerWaalsContact C-N 3.3Å; S299-F301 PolarHBondContact O-N 2.95Å
302	N	53.9	Low	54.1	Low	89 Å²	89	99.1 Å²	99.1	48%	0.476	54%	0.543	S	S	.	.	H	α-helix	trans	-72.5	-35.8	170.2	-80	-15.3	0	0	0	112	F298 S299 L304 K305 M306	F298-N302 PolarHBondContact O-N 3.48Å; F298-N302 VanDerWaalsContact O-N 3.14Å; S299-N302 PolarHBondContact O-N 3.39Å; S299-N302 VanDerWaalsContact O-N 3.14Å; N302-L304 PolarHBondContact O-N 3.35Å; N302-K305 WeakPolarHBondContact O-CB 3.33Å; N302-K305 PolarHBondContact O-N 3.25Å; N302-M306 PolarHBondContact O-N 3.48Å
303	Q	58.9	Low	55.2	Low	146 Å²	146	99.3 Å²	99.3	68%	0.682	53%	0.525	S	S	*	.	H	α-helix	trans	-64	-29.3	177.3	-163.6	175.6	19.2	0	0	112.6	S299 A300 K305	S299-Q303 WeakPolarHBondContact O-CB 3.43Å; S299-Q303 PolarHBondContact O-N 3.24Å; A300-Q303 PolarHBondContact O-N 3.06Å; Q303-K305 VanDerWaalsContact C-N 3.34Å
304	L	58.4	Low	55.9	Low	99 Å²	99	95 Å²	95	52%	0.518	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-19.2	173	-69.6	169.2	0	0	0	114.1	A300 N302	A300-L304 PolarHBondContact O-N 3.16Å; N302-L304 PolarHBondContact O-N 3.35Å
305	K	58.3	Low	56.3	Low	80 Å²	80	93 Å²	93	35%	0.348	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-16.9	176.9	-69.5	176.9	178.6	177.1	0	113.7	N302 Q303 A402	N302-K305 WeakPolarHBondContact O-CB 3.33Å; N302-K305 PolarHBondContact O-N 3.25Å; Q303-K305 VanDerWaalsContact C-N 3.34Å; K305-A402 HydrophobicContact CB-CB 4.22Å; K305-A402 HydrophobicContact CG-CB 4.36Å
306	M	60.8	Low	56.8	Low	101 Å²	101	88.2 Å²	88.2	50%	0.498	48%	0.483	S	S	.	.	S	Bend	trans	-75.6	142.5	177.8	-62.9	-70.2	90.6	0	0	110.8	N302	N302-M306 PolarHBondContact O-N 3.48Å
307	A	60.4	Low	57.5	Low	10 Å²	10	89.1 Å²	89.1	8%	0.083	49%	0.492	C	S	.	.			trans	-67.7	134.9	171	0	0	0	0	0	110.2	F309 M387 R403	A307-F309 HydrophobicContact CB-CD1 3.92Å; A307-F309 WeakPolarHBondContact O-CD1 3.43Å; A307-F309 PolarHBondContact O-N 3.17Å; A307-M387 HydrophobicContact CB-CE 3.77Å; A307-M387 HydrophobicContact CB-SD 4.39Å; A307-R403 HydrophobicContact CB-CB 4.36Å
308	K	60.2	Low	58.2	Low	180 Å²	180	96.7 Å²	96.7	78%	0.783	51%	0.512	S	S	*	.			trans	-97.8	69.9	169.2	-73.2	-176.1	179.6	174.7	0	110.1
309	F	64.6	Low	59.6	Low	29 Å²	29	89.8 Å²	89.8	13%	0.127	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-85	147.4	-179.5	57.3	-71.7	0	0	0	111.4	A307 I311 L385 A386 M387 L407 E410	A307-F309 HydrophobicContact CB-CD1 3.92Å; A307-F309 WeakPolarHBondContact O-CD1 3.43Å; A307-F309 PolarHBondContact O-N 3.17Å; F309-I311 HydrophobicContact CD2-CD1 4.21Å; F309-I311 HydrophobicContact CD2-CG1 3.53Å; F309-I311 HydrophobicContact CE2-CD1 3.51Å; F309-I311 HydrophobicContact CE2-CG1 3.3Å; F309-I311 HydrophobicContact CZ-CD1 3.92Å; F309-I311 HydrophobicContact CZ-CG1 4.17Å; F309-L385 HydrophobicContact CD2-CB 4.04Å; F309-L385 HydrophobicContact CD2-CD2 3.89Å; F309-L385 HydrophobicContact CD2-CG 3.89Å; F309-L385 HydrophobicContact CE2-CD2 3.66Å; F309-L385 HydrophobicContact CE2-CG 3.94Å; F309-A386 WeakPolarHBondContact CA-O 3.38Å; F309-A386 WeakPolarHBondContact CB-O 3.42Å; F309-M387 HydrophobicContact CB-CE 4.12Å; F309-L407 HydrophobicContact CB-CD1 4.26Å; F309-L407 HydrophobicContact CG-CD1 4.34Å; F309-E410 VanDerWaalsContact CE1-OE1 3.31Å; F309-E410 WeakPolarHBondContact CE1-OE1 3.18Å; F309-E410 VanDerWaalsContact CE1-OE2 3.25Å; F309-E410 WeakPolarHBondContact CE1-OE2 3.45Å; F309-E410 HydrophobicContact CZ-CB 3.99Å; F309-E410 VanDerWaalsContact CZ-CD 3.45Å; F309-E410 HydrophobicContact CZ-CG 4.26Å; F309-E410 VanDerWaalsContact CZ-OE1 3.24Å; F309-E410 WeakPolarHBondContact CZ-OE1 3.43Å
310	T	70.2	Confident	61.6	Low	92 Å²	92	88.8 Å²	88.8	56%	0.564	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	119	171.4	-60.2	0	0	0	0	108.9	V312 A386	T310-V312 HydrophobicContact CG2-CG2 4.33Å; T310-A386 PolarHBondContact N-O 3.4Å; T310-A386 PolarHBondContact O-N 2.98Å
311	I	71.1	Confident	63.2	Low	67 Å²	67	87.2 Å²	87.2	34%	0.344	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.6	176	-55.9	171.6	0	0	0	108.5	F309	F309-I311 HydrophobicContact CD2-CD1 4.21Å; F309-I311 HydrophobicContact CD2-CG1 3.53Å; F309-I311 HydrophobicContact CE2-CD1 3.51Å; F309-I311 HydrophobicContact CE2-CG1 3.3Å; F309-I311 HydrophobicContact CZ-CD1 3.92Å; F309-I311 HydrophobicContact CZ-CG1 4.17Å
312	V	67.9	Low	64.9	Low	58 Å²	58	83.3 Å²	83.3	35%	0.352	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	109.4	165.3	-173.3	0	0	0	0	107.8	T310 G314 F384	T310-V312 HydrophobicContact CG2-CG2 4.33Å; V312-G314 PolarHBondContact O-N 2.95Å; V312-F384 HydrophobicContact CB-CB 4.28Å; V312-F384 HydrophobicContact CG2-CD1 4.47Å; V312-F384 PolarHBondContact N-O 3.32Å; V312-F384 PolarHBondContact O-N 3.03Å
313	D	65.6	Low	66.6	Low	82 Å²	82	87.9 Å²	87.9	44%	0.439	47%	0.465	S	S	.	.			trans	-73.9	108.6	174	-69.9	-34.3	0	0	0	109	K315 S316 R414	D313-K315 PolarHBondContact O-N 3.5Å; D313-S316 PolarHBondContact O-N 2.64Å; D313-R414 IonicContact OD1-NH1 2.61Å
314	G	55.4	Low	67.9	Low	18 Å²	18	84.4 Å²	84.4	19%	0.186	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-56	-20.1	-177.8	0	0	0	0	0	114.6	V312 S316	V312-G314 PolarHBondContact O-N 2.95Å; G314-S316 VanDerWaalsContact C-N 3.32Å; G314-S316 PolarHBondContact O-N 3.22Å
315	K	55.2	Low	69.4	Low	193 Å²	193	80.1 Å²	80.1	84%	0.839	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-74.8	-12.2	176.9	-61.8	-175.1	179.7	-178.7	0	114.4	D313 G317	D313-K315 PolarHBondContact O-N 3.5Å; K315-G317 VanDerWaalsContact C-N 3.33Å; K315-G317 PolarHBondContact O-N 3.12Å
316	S	54.3	Low	70.8	Confident	85 Å²	85	77.2 Å²	77.2	59%	0.594	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-84.9	4.8	-175.3	-62.9	0	0	0	0	115.3	D313 G314 K318	D313-S316 PolarHBondContact O-N 2.64Å; G314-S316 VanDerWaalsContact C-N 3.32Å; G314-S316 PolarHBondContact O-N 3.22Å; S316-K318 PolarHBondContact O-N 3.47Å
317	G	53.3	Low	72.2	Confident	73 Å²	73	72.4 Å²	72.4	75%	0.753	40%	0.397	S	S	*	.	S	Bend	trans	66.8	-2.3	168.7	0	0	0	0	0	117.1	K315	K315-G317 VanDerWaalsContact C-N 3.33Å; K315-G317 PolarHBondContact O-N 3.12Å
318	K	60.1	Low	73.5	Confident	203 Å²	203	73.3 Å²	73.3	88%	0.883	40%	0.4	S	S	*	.			trans	-100.2	26.7	177.4	-65.1	-176.9	178.1	179.7	0	112.9	S316	S316-K318 PolarHBondContact O-N 3.47Å
319	G	71.6	Confident	74.9	Confident	31 Å²	31	69 Å²	69	32%	0.32	38%	0.382	S	S	.	.	S	Bend	trans	-82.6	160.6	176.9	0	0	0	0	0	112.3
320	V	85.8	Confident	76.1	Confident	49 Å²	49	74.9 Å²	74.9	30%	0.297	41%	0.41	S	S	.	.			trans	-77.7	135.9	166.8	-180	0	0	0	0	107.2	D324 L371 K374 A375 T378	V320-D324 HydrophobicContact CG1-CB 3.8Å; V320-L371 HydrophobicContact CG1-CD2 3.62Å; V320-L371 HydrophobicContact CG1-CG 4.16Å; V320-K374 HydrophobicContact CB-CB 4.48Å; V320-A375 VanDerWaalsContact O-CA 3.29Å; V320-A375 WeakPolarHBondContact O-CA 3.44Å; V320-T378 WeakPolarHBondContact O-CB 3.37Å; V320-T378 WeakPolarHBondContact O-CG2 3.39Å; V320-T378 PolarHBondContact O-OG1 3.06Å
321	S	88.1	Confident	77.2	Confident	29 Å²	29	70.8 Å²	70.8	20%	0.203	39%	0.385	C	S	.	.			trans	-106.4	170.1	179.1	74.2	0	0	0	0	112.5	K323 D324 V325	S321-K323 PolarHBondContact O-N 3.29Å; S321-K323 VanDerWaalsContact O-N 3.15Å; S321-K323 WeakPolarHBondContact OG-CB 3.14Å; S321-K323 PolarHBondContact OG-N 2.97Å; S321-D324 WeakPolarHBondContact CA-OD2 3.44Å; S321-D324 WeakPolarHBondContact CB-OD2 3.47Å; S321-D324 PolarHBondContact N-OD2 3Å; S321-D324 WeakPolarHBondContact O-CB 3.49Å; S321-D324 PolarHBondContact O-N 3.47Å; S321-D324 PolarHBondContact OG-OD2 3.43Å; S321-V325 PolarHBondContact O-N 3.35Å
322	F	89.9	Confident	78.1	Confident	36 Å²	36	69.4 Å²	69.4	16%	0.158	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-17	171	-76.9	-31.9	0	0	0	114	D324 V339 L372 A375 V376 E379	F322-D324 VanDerWaalsContact C-N 3.3Å; F322-V339 HydrophobicContact CE2-CG2 3.98Å; F322-V339 HydrophobicContact CZ-CG2 3.91Å; F322-L372 HydrophobicContact CE1-CD1 4.1Å; F322-A375 HydrophobicContact CD1-CB 3.66Å; F322-A375 HydrophobicContact CE1-CB 4.06Å; F322-V376 HydrophobicContact CE1-CG2 3.69Å; F322-V376 HydrophobicContact CZ-CG2 3.83Å; F322-E379 HydrophobicContact CD2-CB 4.05Å; F322-E379 HydrophobicContact CD2-CG 3.69Å; F322-E379 HydrophobicContact CE2-CB 4.06Å; F322-E379 HydrophobicContact CE2-CG 3.78Å
323	K	87.7	Confident	79.2	Confident	184 Å²	184	73 Å²	73	80%	0.8	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-18.8	173.2	-58.4	179.8	-179.5	178.1	0	112.7	S321	S321-K323 PolarHBondContact O-N 3.29Å; S321-K323 VanDerWaalsContact O-N 3.15Å; S321-K323 WeakPolarHBondContact OG-CB 3.14Å; S321-K323 PolarHBondContact OG-N 2.97Å
324	D	86.8	Confident	80.4	Confident	73 Å²	73	72.6 Å²	72.6	39%	0.39	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-20.5	179.8	-54.8	-60.7	0	0	0	112.3	V320 S321 F322	V320-D324 HydrophobicContact CG1-CB 3.8Å; S321-D324 WeakPolarHBondContact CA-OD2 3.44Å; S321-D324 WeakPolarHBondContact CB-OD2 3.47Å; S321-D324 PolarHBondContact N-OD2 3Å; S321-D324 WeakPolarHBondContact O-CB 3.49Å; S321-D324 PolarHBondContact O-N 3.47Å; S321-D324 PolarHBondContact OG-OD2 3.43Å; F322-D324 VanDerWaalsContact C-N 3.3Å
325	V	89.9	Confident	82.1	Confident	9 Å²	9	71.8 Å²	71.8	6%	0.055	38%	0.378	C	S	.	.	S	Bend	trans	-77.6	117.9	164.5	-170.2	0	0	0	0	108.1	S321 M328 K332 L371 L372 A375	S321-V325 PolarHBondContact O-N 3.35Å; V325-M328 HydrophobicContact CG1-SD 4Å; V325-K332 WeakPolarHBondContact O-CE 3.33Å; V325-K332 PolarHBondContact O-NZ 3.32Å; V325-L371 HydrophobicContact CB-CD2 4.18Å; V325-L371 HydrophobicContact CG2-CD2 3.47Å; V325-L371 VanDerWaalsContact CG2-CD2 3.47Å; V325-L372 HydrophobicContact CG1-CD1 4.47Å; V325-A375 HydrophobicContact CG2-CB 3.57Å
326	A	88.9	Confident	83.8	Confident	20 Å²	20	67.8 Å²	67.8	17%	0.165	36%	0.361	C	S	.	.			trans	-95.4	151.1	171	0	0	0	0	0	111.1	E501 I502 Q505	A326-E501 HydrophobicContact CB-CB 4.18Å; A326-I502 HydrophobicContact CB-CB 4.31Å; A326-I502 HydrophobicContact CB-CG1 3.75Å; A326-Q505 HydrophobicContact CB-CB 4Å; A326-Q505 HydrophobicContact CB-CG 4.48Å
327	G	88.9	Confident	85.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.353	C	S	.	.	S	Bend	trans	58.2	-149.1	-174.1	0	0	0	0	0	113.9	H329 K332 E501	G327-H329 PolarHBondContact O-N 2.58Å; G327-K332 WeakPolarHBondContact O-CD 3.49Å; G327-K332 WeakPolarHBondContact O-CE 3.21Å; G327-K332 PolarHBondContact O-NZ 3.49Å; G327-E501 VanDerWaalsContact CA-OE2 3.32Å; G327-E501 WeakPolarHBondContact CA-OE2 3.42Å; G327-E501 PolarHBondContact N-OE2 3.26Å
328	M	88.3	Confident	87.1	Confident	29 Å²	29	65 Å²	65	14%	0.143	32%	0.319	C	S	.	.			trans	58.4	43.1	178	-57.3	175.3	56.4	0	0	112.6	V325 E330 A331 K332 L372 I491 E498	V325-M328 HydrophobicContact CG1-SD 4Å; M328-E330 PolarHBondContact O-N 3.24Å; M328-A331 HydrophobicContact CE-CB 4.44Å; M328-K332 WeakPolarHBondContact O-CB 3.37Å; M328-K332 VanDerWaalsContact O-CG 3.27Å; M328-K332 WeakPolarHBondContact O-CG 3.32Å; M328-K332 PolarHBondContact O-N 3.07Å; M328-L372 HydrophobicContact CE-CB 4.07Å; M328-L372 HydrophobicContact CE-CD1 4.39Å; M328-L372 HydrophobicContact CE-CD2 3.84Å; M328-L372 HydrophobicContact CE-CG 4.32Å; M328-I491 HydrophobicContact CE-CB 4.36Å; M328-I491 HydrophobicContact CE-CD1 3.76Å; M328-I491 HydrophobicContact CE-CG1 3.88Å; M328-I491 HydrophobicContact CE-CG2 3.53Å; M328-I491 HydrophobicContact SD-CG2 4.32Å; M328-E498 WeakPolarHBondContact CA-OE1 3.18Å; M328-E498 PolarHBondContact N-OE1 3Å
329	H	89.5	Confident	88.5	Confident	89 Å²	89	55.3 Å²	55.3	41%	0.412	28%	0.277	S	S	.	.	H	α-helix	trans	-60.6	-47.7	-169.9	-68.3	93.8	0	0	0	113.1	G327 K332 M333 E498 E501	G327-H329 PolarHBondContact O-N 2.58Å; H329-K332 PolarHBondContact O-N 3.39Å; H329-M333 WeakPolarHBondContact O-CG 3.11Å; H329-M333 PolarHBondContact O-N 2.94Å; H329-M333 VanDerWaalsContact O-N 3.07Å; H329-E498 PolarHBondContact N-OE1 3.17Å; H329-E498 IonicContact ND1-OE1 3.84Å; H329-E501 IonicContact CE1-OE1 2.67Å; H329-E501 PolarHBondContact CE1-OE1 3.33Å; H329-E501 VanDerWaalsContact CE1-OE1 3.3Å; H329-E501 IonicContact CE1-OE2 2.87Å; H329-E501 PolarHBondContact CE1-OE2 3.37Å; H329-E501 VanDerWaalsContact CE1-OE2 3.3Å; H329-E501 IonicContact NE2-OE1 3.45Å; H329-E501 IonicContact NE2-OE2 3.32Å
330	E	90.1	Very high	89.3	Confident	152 Å²	152	56.6 Å²	56.6	71%	0.71	28%	0.276	S	S	*	.	H	α-helix	trans	-64.4	-53.4	-179.9	-62.4	175.6	175.8	0	0	110.9	M328 K332 M333 E334	M328-E330 PolarHBondContact O-N 3.24Å; E330-K332 VanDerWaalsContact C-N 3.28Å; E330-K332 PolarHBondContact O-N 2.9Å; E330-M333 WeakPolarHBondContact O-CB 3.43Å; E330-M333 PolarHBondContact O-N 2.91Å; E330-E334 PolarHBondContact O-N 3.08Å
331	A	92.1	Very high	89.3	Confident	6 Å²	6	54.7 Å²	54.7	5%	0.05	26%	0.264	C	S	.	.	H	α-helix	trans	-59.2	-35	176.7	0	0	0	0	0	113	M328 V335 L372 I489 I491	M328-A331 HydrophobicContact CE-CB 4.44Å; A331-V335 WeakPolarHBondContact O-CG2 3.37Å; A331-V335 PolarHBondContact O-N 3.5Å; A331-L372 HydrophobicContact CB-CD2 4.29Å; A331-I489 HydrophobicContact CB-CG2 3.86Å; A331-I491 HydrophobicContact CB-CG1 3.87Å
332	K	91.7	Very high	89.3	Confident	38 Å²	38	54 Å²	54	17%	0.165	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-40.7	172.5	-81.3	169.2	173	166.9	0	112.2	V325 G327 M328 H329 E330 K336 L372	V325-K332 WeakPolarHBondContact O-CE 3.33Å; V325-K332 PolarHBondContact O-NZ 3.32Å; G327-K332 WeakPolarHBondContact O-CD 3.49Å; G327-K332 WeakPolarHBondContact O-CE 3.21Å; G327-K332 PolarHBondContact O-NZ 3.49Å; M328-K332 WeakPolarHBondContact O-CB 3.37Å; M328-K332 VanDerWaalsContact O-CG 3.27Å; M328-K332 WeakPolarHBondContact O-CG 3.32Å; M328-K332 PolarHBondContact O-N 3.07Å; H329-K332 PolarHBondContact O-N 3.39Å; E330-K332 VanDerWaalsContact C-N 3.28Å; E330-K332 PolarHBondContact O-N 2.9Å; K332-K336 VanDerWaalsContact O-CB 3.31Å; K332-K336 WeakPolarHBondContact O-CB 3.33Å; K332-K336 PolarHBondContact O-N 2.84Å; K332-L372 HydrophobicContact CG-CD1 4.1Å
333	M	90.8	Very high	89.1	Confident	133 Å²	133	57.1 Å²	57.1	66%	0.655	27%	0.271	S	S	*	.	H	α-helix	trans	-64.2	-45.3	176.5	-71.3	-170.9	-66	0	0	111	H329 E330 K336	H329-M333 WeakPolarHBondContact O-CG 3.11Å; H329-M333 PolarHBondContact O-N 2.94Å; H329-M333 VanDerWaalsContact O-N 3.07Å; E330-M333 WeakPolarHBondContact O-CB 3.43Å; E330-M333 PolarHBondContact O-N 2.91Å; M333-K336 WeakPolarHBondContact O-CB 3.29Å; M333-K336 PolarHBondContact O-N 2.81Å
334	E	90.9	Very high	89	Confident	74 Å²	74	50.6 Å²	50.6	35%	0.346	25%	0.249	S	C	.	.	H	α-helix	trans	-61.1	-47.8	176	-72.1	-168.6	-128.4	0	0	112.4	E330 K336 E337 I489	E330-E334 PolarHBondContact O-N 3.08Å; E334-K336 PolarHBondContact O-N 3.24Å; E334-E337 PolarHBondContact O-N 3.17Å; E334-I489 HydrophobicContact CB-CD1 4.06Å; E334-I489 HydrophobicContact CB-CG1 4.36Å; E334-I489 HydrophobicContact CB-CG2 4.28Å
335	V	91.1	Very high	88.9	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-73.9	-16.7	-179.2	-156.3	0	0	0	0	112.9	A331 E337 F338 V339 L361 L372 V376 I489	A331-V335 WeakPolarHBondContact O-CG2 3.37Å; A331-V335 PolarHBondContact O-N 3.5Å; V335-E337 PolarHBondContact O-N 2.7Å; V335-F338 HydrophobicContact CB-CD2 4.41Å; V335-F338 HydrophobicContact CG1-CB 4.41Å; V335-F338 HydrophobicContact CG1-CD2 3.87Å; V335-F338 HydrophobicContact CG1-CE2 4.47Å; V335-F338 HydrophobicContact CG1-CG 4.39Å; V335-F338 PolarHBondContact O-N 2.71Å; V335-V339 PolarHBondContact O-N 3.13Å; V335-L361 HydrophobicContact CG2-CD2 4.41Å; V335-L372 HydrophobicContact CG2-CD2 3.83Å; V335-L372 HydrophobicContact CG2-CG 4.44Å; V335-V376 HydrophobicContact CB-CG2 3.82Å; V335-V376 HydrophobicContact CG1-CB 4.06Å; V335-V376 HydrophobicContact CG1-CG1 3.62Å; V335-V376 HydrophobicContact CG1-CG2 3.25Å; V335-I489 HydrophobicContact CG2-CD1 3.45Å; V335-I489 VanDerWaalsContact CG2-CD1 3.45Å
336	K	91.1	Very high	88.6	Confident	110 Å²	110	55 Å²	55	48%	0.478	27%	0.269	S	S	.	.	H	α-helix	trans	-61.9	-30.6	173.7	-169.9	-178.4	174.7	-170.6	0	112.4	K332 M333 E334 F338 V339 D340	K332-K336 VanDerWaalsContact O-CB 3.31Å; K332-K336 WeakPolarHBondContact O-CB 3.33Å; K332-K336 PolarHBondContact O-N 2.84Å; M333-K336 WeakPolarHBondContact O-CB 3.29Å; M333-K336 PolarHBondContact O-N 2.81Å; E334-K336 PolarHBondContact O-N 3.24Å; K336-F338 VanDerWaalsContact C-N 3.27Å; K336-F338 PolarHBondContact O-N 2.82Å; K336-V339 WeakPolarHBondContact O-CB 3.4Å; K336-V339 PolarHBondContact O-N 3.13Å; K336-V339 VanDerWaalsContact O-N 3.13Å; K336-D340 PolarHBondContact O-N 3.11Å
337	E	87.6	Confident	88.5	Confident	92 Å²	92	62 Å²	62	43%	0.43	29%	0.292	S	S	.	.	H	α-helix	trans	-55.9	-41.9	174.1	-63.3	-170.5	171.8	0	0	112	E334 V335 D340 Y341 R487	E334-E337 PolarHBondContact O-N 3.17Å; V335-E337 PolarHBondContact O-N 2.7Å; E337-D340 PolarHBondContact O-N 2.82Å; E337-Y341 WeakPolarHBondContact O-CB 3.45Å; E337-Y341 PolarHBondContact O-N 2.95Å; E337-R487 IonicContact OE2-CZ 2.67Å; E337-R487 IonicContact OE2-NH2 3.41Å; E337-R487 PolarHBondContact OE2-NH2 2.93Å
338	F	88.3	Confident	88.2	Confident	6 Å²	6	65 Å²	65	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-70.8	-34.9	179.4	-55.3	-103.6	0	0	0	111.6	V335 K336 L342 P356 I464 R487 I489	V335-F338 HydrophobicContact CB-CD2 4.41Å; V335-F338 HydrophobicContact CG1-CB 4.41Å; V335-F338 HydrophobicContact CG1-CD2 3.87Å; V335-F338 HydrophobicContact CG1-CE2 4.47Å; V335-F338 HydrophobicContact CG1-CG 4.39Å; V335-F338 PolarHBondContact O-N 2.71Å; K336-F338 VanDerWaalsContact C-N 3.27Å; K336-F338 PolarHBondContact O-N 2.82Å; F338-L342 WeakPolarHBondContact O-CB 3.31Å; F338-L342 VanDerWaalsContact O-CG 3.25Å; F338-L342 WeakPolarHBondContact O-CG 3.48Å; F338-L342 PolarHBondContact O-N 3.31Å; F338-P356 HydrophobicContact CD1-CG 3.98Å; F338-P356 HydrophobicContact CE1-CB 3.95Å; F338-P356 HydrophobicContact CE1-CG 3.5Å; F338-P356 VanDerWaalsContact CE1-CG 3.5Å; F338-P356 HydrophobicContact CZ-CB 4.48Å; F338-P356 HydrophobicContact CZ-CG 4.12Å; F338-I464 HydrophobicContact CB-CD1 4.25Å; F338-I464 HydrophobicContact CD1-CD1 4.18Å; F338-I464 HydrophobicContact CD1-CG2 3.86Å; F338-I464 HydrophobicContact CE1-CG2 4.35Å; F338-R487 HydrophobicContact CZ-CB 4Å; F338-R487 HydrophobicContact CZ-CG 3.93Å; F338-I489 HydrophobicContact CE2-CD1 4.07Å
339	V	89.5	Confident	87.9	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	32%	0.318	C	S	.	.	H	α-helix	trans	-64.4	-49.1	173.8	173.8	0	0	0	0	110.7	F322 V335 K336 Y341 L342 K343 V376 E379 A380	F322-V339 HydrophobicContact CE2-CG2 3.98Å; F322-V339 HydrophobicContact CZ-CG2 3.91Å; V335-V339 PolarHBondContact O-N 3.13Å; K336-V339 WeakPolarHBondContact O-CB 3.4Å; K336-V339 PolarHBondContact O-N 3.13Å; K336-V339 VanDerWaalsContact O-N 3.13Å; V339-Y341 VanDerWaalsContact C-N 3.31Å; V339-Y341 PolarHBondContact O-N 2.89Å; V339-L342 PolarHBondContact O-N 2.94Å; V339-K343 HydrophobicContact CG1-CD 4.07Å; V339-K343 WeakPolarHBondContact O-CB 3.37Å; V339-K343 WeakPolarHBondContact O-CG 3.37Å; V339-K343 PolarHBondContact O-N 3.27Å; V339-V376 HydrophobicContact CG2-CB 4.43Å; V339-V376 HydrophobicContact CG2-CG1 3.83Å; V339-E379 HydrophobicContact CG1-CB 4.25Å; V339-E379 HydrophobicContact CG1-CG 3.68Å; V339-E379 HydrophobicContact CG2-CB 4.41Å; V339-E379 HydrophobicContact CG2-CG 4.45Å; V339-A380 HydrophobicContact CG1-CB 4.34Å
340	D	88.4	Confident	87.7	Confident	57 Å²	57	71.2 Å²	71.2	31%	0.305	33%	0.334	S	S	.	.	H	α-helix	trans	-66.7	-35.5	-178.1	-71.1	-14.6	0	0	0	111	K336 E337 S344	K336-D340 PolarHBondContact O-N 3.11Å; E337-D340 PolarHBondContact O-N 2.82Å; D340-S344 PolarHBondContact O-N 2.83Å; D340-S344 PolarHBondContact O-OG 3.48Å
341	Y	86.3	Confident	87.6	Confident	10 Å²	10	70.5 Å²	70.5	4%	0.039	34%	0.335	C	S	.	.	H	α-helix	trans	-63.8	-48.3	169.5	170.2	-97.2	0	0	0	112.8	E337 V339 K343 S344 P345 Y348 V355 H462 I464	E337-Y341 WeakPolarHBondContact O-CB 3.45Å; E337-Y341 PolarHBondContact O-N 2.95Å; V339-Y341 VanDerWaalsContact C-N 3.31Å; V339-Y341 PolarHBondContact O-N 2.89Å; Y341-K343 VanDerWaalsContact C-N 3.26Å; Y341-K343 PolarHBondContact O-N 3.41Å; Y341-S344 CarbonylContact O-C 3.54Å; Y341-S344 PolarHBondContact O-N 2.88Å; Y341-P345 HydrophobicContact CD2-CB 4.23Å; Y341-P345 HydrophobicContact CE2-CB 3.66Å; Y341-P345 VanDerWaalsContact O-CA 3.31Å; Y341-P345 WeakPolarHBondContact O-CA 3.42Å; Y341-P345 VanDerWaalsContact O-CD 3.27Å; Y341-P345 WeakPolarHBondContact O-CD 3.39Å; Y341-Y348 AromaticContact CD2-CD2 3.86Å; Y341-Y348 HydrophobicContact CD2-CD2 3.86Å; Y341-Y348 AromaticContact CD2-CG 4Å; Y341-Y348 HydrophobicContact CD2-CG 4Å; Y341-V355 HydrophobicContact CD1-CG1 3.9Å; Y341-V355 HydrophobicContact CD2-CG1 4.34Å; Y341-V355 HydrophobicContact CD2-CG2 4.05Å; Y341-V355 HydrophobicContact CE1-CG1 3.51Å; Y341-V355 HydrophobicContact CE1-CG2 4.3Å; Y341-V355 HydrophobicContact CE2-CB 4.31Å; Y341-V355 HydrophobicContact CE2-CG1 3.99Å; Y341-V355 HydrophobicContact CE2-CG2 3.31Å; Y341-V355 HydrophobicContact CG-CG1 4.31Å; Y341-V355 VanDerWaalsContact CZ-CG2 3.47Å; Y341-H462 AromaticContact CZ-ND1 3.93Å; Y341-H462 PolarHBondContact OH-ND1 2.7Å; Y341-I464 HydrophobicContact CD1-CD1 3.93Å; Y341-I464 HydrophobicContact CE1-CD1 4.26Å
342	L	86.8	Confident	87.1	Confident	15 Å²	15	73.1 Å²	73.1	8%	0.079	36%	0.363	C	S	.	.	H	α-helix	trans	-64.3	-31	179.3	-74.7	169.2	0	0	0	112.6	F338 V339 A380 V382 P416 I418 I464	F338-L342 WeakPolarHBondContact O-CB 3.31Å; F338-L342 VanDerWaalsContact O-CG 3.25Å; F338-L342 WeakPolarHBondContact O-CG 3.48Å; F338-L342 PolarHBondContact O-N 3.31Å; V339-L342 PolarHBondContact O-N 2.94Å; L342-A380 HydrophobicContact CB-CB 3.96Å; L342-A380 HydrophobicContact CD1-CB 3.82Å; L342-V382 HydrophobicContact CB-CG1 4.37Å; L342-V382 HydrophobicContact CD1-CG1 4.44Å; L342-V382 HydrophobicContact CD1-CG2 4.09Å; L342-V382 HydrophobicContact CD2-CG1 4.42Å; L342-P416 HydrophobicContact CD2-CB 4.16Å; L342-I418 HydrophobicContact CD1-CD1 3.71Å; L342-I418 HydrophobicContact CD1-CG1 3.85Å; L342-I464 HydrophobicContact CD1-CD1 3.9Å; L342-I464 HydrophobicContact CD2-CD1 3.79Å; L342-I464 HydrophobicContact CD2-CG1 4.28Å; L342-I464 HydrophobicContact CG-CD1 3.69Å
343	K	87.1	Confident	86.7	Confident	101 Å²	101	73.3 Å²	73.3	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-76.5	-33	173.3	-73	177.4	179.9	173.5	0	113.2	V339 Y341 E379	V339-K343 HydrophobicContact CG1-CD 4.07Å; V339-K343 WeakPolarHBondContact O-CB 3.37Å; V339-K343 WeakPolarHBondContact O-CG 3.37Å; V339-K343 PolarHBondContact O-N 3.27Å; Y341-K343 VanDerWaalsContact C-N 3.26Å; Y341-K343 PolarHBondContact O-N 3.41Å; K343-E379 WeakPolarHBondContact CE-O 3.32Å; K343-E379 PolarHBondContact NZ-O 2.91Å; K343-E379 IonicContact NZ-OE1 3.97Å; K343-E379 PolarHBondContact NZ-OE1 3.16Å
344	S	85.8	Confident	86.1	Confident	46 Å²	46	76.3 Å²	76.3	32%	0.322	38%	0.381	S	S	.	.			trans	-144.1	62	-170.9	61.4	0	0	0	0	113.9	D340 Y341 E346 R347	D340-S344 PolarHBondContact O-N 2.83Å; D340-S344 PolarHBondContact O-OG 3.48Å; Y341-S344 CarbonylContact O-C 3.54Å; Y341-S344 PolarHBondContact O-N 2.88Å; S344-E346 VanDerWaalsContact C-N 3.3Å; S344-E346 PolarHBondContact O-N 3.05Å; S344-R347 PolarHBondContact O-N 2.67Å
345	P	83.5	Confident	85.3	Confident	33 Å²	33	74 Å²	74	21%	0.214	37%	0.371	C	S	.	.	H	α-helix	trans	-65.9	-30.9	-170.9	26	-34.7	0	0	0	113.2	Y341 R347 Y348 L349	Y341-P345 HydrophobicContact CD2-CB 4.23Å; Y341-P345 HydrophobicContact CE2-CB 3.66Å; Y341-P345 VanDerWaalsContact O-CA 3.31Å; Y341-P345 WeakPolarHBondContact O-CA 3.42Å; Y341-P345 VanDerWaalsContact O-CD 3.27Å; Y341-P345 WeakPolarHBondContact O-CD 3.39Å; P345-R347 VanDerWaalsContact C-N 3.29Å; P345-R347 PolarHBondContact O-N 3.43Å; P345-Y348 PolarHBondContact O-N 2.95Å; P345-L349 WeakPolarHBondContact O-CG 3.28Å; P345-L349 PolarHBondContact O-N 3.41Å; P345-L349 VanDerWaalsContact O-N 3.11Å
346	E	84	Confident	84.7	Confident	142 Å²	142	75.1 Å²	75.1	66%	0.664	38%	0.379	S	S	*	.	H	α-helix	trans	-57.5	-39.5	-179.7	-63.6	-178.4	-175.2	0	0	112.8	S344 Y348 L349 Q350	S344-E346 VanDerWaalsContact C-N 3.3Å; S344-E346 PolarHBondContact O-N 3.05Å; E346-Y348 VanDerWaalsContact C-N 3.27Å; E346-Y348 PolarHBondContact O-N 2.97Å; E346-L349 PolarHBondContact O-N 2.99Å; E346-Q350 WeakPolarHBondContact O-CB 3.23Å; E346-Q350 VanDerWaalsContact O-CG 3.3Å; E346-Q350 WeakPolarHBondContact O-CG 3.24Å; E346-Q350 PolarHBondContact O-N 3.38Å
347	R	86.1	Confident	84.5	Confident	168 Å²	168	71.7 Å²	71.7	63%	0.634	36%	0.364	S	S	*	.	H	α-helix	trans	-60.6	-37.7	-179.9	-177	-179	177.1	-166.1	-1.8	112	S344 P345 L351	S344-R347 PolarHBondContact O-N 2.67Å; P345-R347 VanDerWaalsContact C-N 3.29Å; P345-R347 PolarHBondContact O-N 3.43Å; R347-L351 WeakPolarHBondContact O-CD1 3.27Å; R347-L351 WeakPolarHBondContact O-CG 3.44Å
348	Y	83.9	Confident	84.6	Confident	63 Å²	63	67.3 Å²	67.3	25%	0.247	34%	0.343	C	S	.	.	H	α-helix	trans	-77.5	-39.2	178.6	-68.2	-90.1	0	0	0	111.5	Y341 P345 E346 L351 G352 A353	Y341-Y348 AromaticContact CD2-CD2 3.86Å; Y341-Y348 HydrophobicContact CD2-CD2 3.86Å; Y341-Y348 AromaticContact CD2-CG 4Å; Y341-Y348 HydrophobicContact CD2-CG 4Å; P345-Y348 PolarHBondContact O-N 2.95Å; E346-Y348 VanDerWaalsContact C-N 3.27Å; E346-Y348 PolarHBondContact O-N 2.97Å; Y348-L351 PolarHBondContact O-N 2.78Å; Y348-G352 PolarHBondContact O-N 2.71Å; Y348-A353 HydrophobicContact CD1-CB 4.45Å; Y348-A353 WeakPolarHBondContact O-CB 3Å; Y348-A353 PolarHBondContact O-N 3.06Å
349	L	81.9	Confident	84.8	Confident	87 Å²	87	67 Å²	67	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-40.2	177.4	-68.4	171.3	0	0	0	112.5	P345 E346 L351 G352	P345-L349 WeakPolarHBondContact O-CG 3.28Å; P345-L349 PolarHBondContact O-N 3.41Å; P345-L349 VanDerWaalsContact O-N 3.11Å; E346-L349 PolarHBondContact O-N 2.99Å; L349-L351 PolarHBondContact O-N 3.26Å; L349-G352 PolarHBondContact O-N 3.33Å
350	Q	85.6	Confident	85.1	Confident	160 Å²	160	67 Å²	67	75%	0.748	34%	0.342	S	S	*	.	H	α-helix	trans	-61.2	-32	175.3	-74.6	173.8	11.5	0	0	112.9	E346 G352	E346-Q350 WeakPolarHBondContact O-CB 3.23Å; E346-Q350 VanDerWaalsContact O-CG 3.3Å; E346-Q350 WeakPolarHBondContact O-CG 3.24Å; E346-Q350 PolarHBondContact O-N 3.38Å; Q350-G352 VanDerWaalsContact C-N 3.27Å; Q350-G352 PolarHBondContact O-N 2.91Å
351	L	86.8	Confident	85.4	Confident	137 Å²	137	64.3 Å²	64.3	72%	0.717	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	1.2	176	-64.7	172.1	0	0	0	113.2	R347 Y348 L349 A353	R347-L351 WeakPolarHBondContact O-CD1 3.27Å; R347-L351 WeakPolarHBondContact O-CG 3.44Å; Y348-L351 PolarHBondContact O-N 2.78Å; L349-L351 PolarHBondContact O-N 3.26Å; L351-A353 PolarHBondContact O-N 2.9Å
352	G	83.1	Confident	85.8	Confident	62 Å²	62	64.3 Å²	64.3	64%	0.639	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	14.5	-175.6	0	0	0	0	0	114.2	Y348 L349 Q350 K354	Y348-G352 PolarHBondContact O-N 2.71Å; L349-G352 PolarHBondContact O-N 3.33Å; Q350-G352 VanDerWaalsContact C-N 3.27Å; Q350-G352 PolarHBondContact O-N 2.91Å; G352-K354 PolarHBondContact O-N 2.88Å
353	A	82.8	Confident	86	Confident	42 Å²	42	64.4 Å²	64.4	35%	0.347	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-68.8	127.3	-177.8	0	0	0	0	0	110.7	Y348 L351	Y348-A353 HydrophobicContact CD1-CB 4.45Å; Y348-A353 WeakPolarHBondContact O-CB 3Å; Y348-A353 PolarHBondContact O-N 3.06Å; L351-A353 PolarHBondContact O-N 2.9Å
354	K	76.9	Confident	86.2	Confident	196 Å²	196	61.4 Å²	61.4	85%	0.852	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-77.8	128.3	172.8	-69.3	-177.6	-179	177	0	109.5	G352	G352-K354 PolarHBondContact O-N 2.88Å
355	V	74.7	Confident	86.5	Confident	24 Å²	24	63.3 Å²	63.3	15%	0.145	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-76.2	131.5	-178.4	-174.4	0	0	0	0	109.3	Y341 K357	Y341-V355 HydrophobicContact CD1-CG1 3.9Å; Y341-V355 HydrophobicContact CD2-CG1 4.34Å; Y341-V355 HydrophobicContact CD2-CG2 4.05Å; Y341-V355 HydrophobicContact CE1-CG1 3.51Å; Y341-V355 HydrophobicContact CE1-CG2 4.3Å; Y341-V355 HydrophobicContact CE2-CB 4.31Å; Y341-V355 HydrophobicContact CE2-CG1 3.99Å; Y341-V355 HydrophobicContact CE2-CG2 3.31Å; Y341-V355 HydrophobicContact CG-CG1 4.31Å; Y341-V355 VanDerWaalsContact CZ-CG2 3.47Å; V355-K357 PolarHBondContact O-N 3.46Å
356	P	78.9	Confident	86.7	Confident	25 Å²	25	63.3 Å²	63.3	16%	0.162	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-63.7	120	171.5	27	-33.7	0	0	0	109.4	F338 G358 D486 R487	F338-P356 HydrophobicContact CD1-CG 3.98Å; F338-P356 HydrophobicContact CE1-CB 3.95Å; F338-P356 HydrophobicContact CE1-CG 3.5Å; F338-P356 VanDerWaalsContact CE1-CG 3.5Å; F338-P356 HydrophobicContact CZ-CB 4.48Å; F338-P356 HydrophobicContact CZ-CG 4.12Å; P356-G358 PolarHBondContact O-N 3.06Å; P356-D486 VanDerWaalsContact CB-OD1 3.23Å; P356-D486 WeakPolarHBondContact CB-OD1 3.27Å; P356-R487 HydrophobicContact CB-CG 3.83Å; P356-R487 HydrophobicContact CG-CG 4.48Å
357	K	85.8	Confident	87.1	Confident	39 Å²	39	56.9 Å²	56.9	17%	0.17	31%	0.311	C	S	.	.	S	Bend	trans	-69.6	-25.5	-177.1	-81.5	177.8	156.4	-159.4	0	112.4	V355 M454 D455 M457 V465 G483	V355-K357 PolarHBondContact O-N 3.46Å; K357-M454 PolarHBondContact NZ-O 3.39Å; K357-D455 PolarHBondContact NZ-O 3.39Å; K357-M457 HydrophobicContact CB-CE 4.32Å; K357-M457 WeakPolarHBondContact CE-O 3.45Å; K357-M457 PolarHBondContact NZ-O 3.03Å; K357-V465 PolarHBondContact O-N 3.37Å; K357-V465 VanDerWaalsContact O-N 3.08Å; K357-G483 WeakPolarHBondContact CD-O 3Å
358	G	90.3	Very high	87.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	158.2	176.5	0	0	0	0	0	113.7	P356 V465 R484 L485 D486 R487	P356-G358 PolarHBondContact O-N 3.06Å; G358-V465 CarbonylContact C-O 3.58Å; G358-V465 WeakPolarHBondContact CA-O 3.45Å; G358-R484 WeakPolarHBondContact CA-O 3.3Å; G358-R484 PolarHBondContact N-O 3.38Å; G358-R484 VanDerWaalsContact N-O 3.1Å; G358-L485 WeakPolarHBondContact O-CA 3.49Å; G358-D486 PolarHBondContact O-N 3.49Å; G358-D486 VanDerWaalsContact O-OD1 3.06Å; G358-R487 PolarHBondContact O-N 3.24Å
359	S	93.6	Very high	87.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137	-176.8	-165.7	0	0	0	0	110.8	V465 L466 A467 R487 I489	S359-V465 PolarHBondContact N-O 3.19Å; S359-L466 WeakPolarHBondContact O-CA 3.47Å; S359-A467 PolarHBondContact O-N 3.48Å; S359-R487 CarbonylContact C-O 3.6Å; S359-R487 WeakPolarHBondContact CA-O 3.16Å; S359-R487 WeakPolarHBondContact OG-CB 3.49Å; S359-R487 PolarHBondContact OG-O 2.9Å; S359-I489 VanDerWaalsContact OG-CD1 3.27Å; S359-I489 WeakPolarHBondContact OG-CD1 3.5Å; S359-I489 WeakPolarHBondContact OG-CG1 3.38Å
360	L	94.6	Very high	88.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	118.3	175.8	-174.9	62.1	0	0	0	109.8	L362 I424 A467 T469 L475 M480 L485 R487 I489	L360-L362 HydrophobicContact CD1-CD2 4.39Å; L360-L362 HydrophobicContact CD2-CD2 3.59Å; L360-L362 HydrophobicContact CD2-CG 4.2Å; L360-L362 HydrophobicContact CG-CD2 3.62Å; L360-L362 HydrophobicContact CG-CG 4.05Å; L360-I424 HydrophobicContact CD1-CG2 3.88Å; L360-A467 CarbonylContact C-O 3.44Å; L360-A467 WeakPolarHBondContact CA-O 3.29Å; L360-A467 HydrophobicContact CD1-CB 3.8Å; L360-T469 HydrophobicContact CD1-CG2 4.24Å; L360-L475 HydrophobicContact CD1-CD1 4.28Å; L360-L475 HydrophobicContact CD2-CD1 3.69Å; L360-M480 HydrophobicContact CD2-CG 4.43Å; L360-L485 HydrophobicContact CB-CB 4.31Å; L360-L485 HydrophobicContact CB-CD1 4.33Å; L360-L485 HydrophobicContact CD1-CD1 4.17Å; L360-R487 PolarHBondContact N-O 3.22Å; L360-I489 PolarHBondContact O-N 3.11Å
361	L	95.6	Very high	88.5	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	108.8	173	-56.6	-175.6	0	0	0	108.8	V335 K369 L372 A373 A467 S468 T469 I489 I491	V335-L361 HydrophobicContact CG2-CD2 4.41Å; L361-K369 HydrophobicContact CB-CB 4.44Å; L361-K369 HydrophobicContact CB-CD 4.27Å; L361-K369 WeakPolarHBondContact O-CD 3.39Å; L361-L372 HydrophobicContact CD2-CD2 4.48Å; L361-A373 HydrophobicContact CD1-CB 4.23Å; L361-A467 PolarHBondContact N-O 3.34Å; L361-S468 WeakPolarHBondContact O-CA 3.33Å; L361-T469 PolarHBondContact O-N 2.97Å; L361-T469 VanDerWaalsContact O-N 3.16Å; L361-I489 HydrophobicContact CD2-CB 3.96Å; L361-I489 HydrophobicContact CD2-CD1 4.11Å; L361-I489 HydrophobicContact CD2-CG1 4.45Å; L361-I489 HydrophobicContact CD2-CG2 4.43Å; L361-I491 HydrophobicContact CB-CD1 4.14Å; L361-I491 HydrophobicContact CD2-CD1 4.22Å
362	L	93.8	Very high	88.9	Confident	10 Å²	10	35.1 Å²	35.1	5%	0.052	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	146.4	-178.2	-64.5	-178.6	0	0	0	110.3	L360 T469 A472 H488 I489 F490 I491	L360-L362 HydrophobicContact CD1-CD2 4.39Å; L360-L362 HydrophobicContact CD2-CD2 3.59Å; L360-L362 HydrophobicContact CD2-CG 4.2Å; L360-L362 HydrophobicContact CG-CD2 3.62Å; L360-L362 HydrophobicContact CG-CG 4.05Å; L362-T469 HydrophobicContact CD2-CG2 3.38Å; L362-A472 HydrophobicContact CD1-CB 4.16Å; L362-A472 HydrophobicContact CD2-CB 3.82Å; L362-H488 HydrophobicContact CD1-CB 4.21Å; L362-I489 PolarHBondContact N-O 3.49Å; L362-F490 HydrophobicContact CB-CD1 3.95Å; L362-F490 HydrophobicContact CB-CE1 4.19Å; L362-F490 HydrophobicContact CD1-CD1 4.09Å; L362-F490 HydrophobicContact CD1-CE1 3.49Å; L362-F490 VanDerWaalsContact CD1-CE1 3.49Å; L362-F490 HydrophobicContact CD1-CE2 4.46Å; L362-F490 HydrophobicContact CD1-CZ 3.71Å; L362-F490 HydrophobicContact CG-CE1 4.47Å; L362-I491 WeakPolarHBondContact O-CA 3.34Å; L362-I491 WeakPolarHBondContact O-CB 3.49Å; L362-I491 PolarHBondContact O-N 3.01Å
363	G	92.1	Very high	89.3	Confident	16 Å²	16	32.2 Å²	32.2	17%	0.165	20%	0.195	C	C	.	.			trans	154.9	173.1	174.1	0	0	0	0	0	114	K369 N470 I491	G363-K369 PolarHBondContact O-NZ 2.86Å; G363-N470 WeakPolarHBondContact O-CA 3.44Å; G363-I491 WeakPolarHBondContact CA-O 3.17Å
364	P	90.9	Very high	89.7	Confident	39 Å²	39	34.5 Å²	34.5	25%	0.253	20%	0.197	S	C	.	.			trans	-64	160.9	175	5.4	3	0	0	0	112.4	K369 I491 L493	P364-K369 PolarHBondContact O-NZ 2.92Å; P364-I491 WeakPolarHBondContact CD-O 3.5Å; P364-L493 HydrophobicContact CB-CD2 4.49Å; P364-L493 HydrophobicContact CG-CD2 4.01Å; P364-L493 HydrophobicContact CG-CG 3.91Å
365	P	91.1	Very high	90.4	Very high	85 Å²	85	25.1 Å²	25.1	55%	0.552	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	157.2	171.4	27.9	-35	0	0	0	110.9	C367 N470	P365-C367 PolarHBondContact O-N 2.73Å; P365-C367 VanDerWaalsContact O-N 3.16Å; P365-N470 WeakPolarHBondContact CA-OD1 3.33Å
366	G	89.3	Confident	91.2	Very high	33 Å²	33	24 Å²	24	34%	0.34	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	-8.9	176.9	0	0	0	0	0	116.5	G368 A533	G366-G368 PolarHBondContact O-N 2.65Å; G366-G368 VanDerWaalsContact O-N 3.11Å; G366-A533 PolarHBondContact O-N 3.23Å
367	C	91.4	Very high	91.8	Very high	8 Å²	8	23 Å²	23	5%	0.054	14%	0.143	C	C	.	.	S	Bend	trans	-84.3	30.8	-178.3	-55	0	0	0	0	114	P365 K369 I491	P365-C367 PolarHBondContact O-N 2.73Å; P365-C367 VanDerWaalsContact O-N 3.16Å; C367-K369 VanDerWaalsContact C-N 3.33Å; C367-K369 PolarHBondContact O-N 2.91Å; C367-K369 VanDerWaalsContact O-N 3.15Å; C367-I491 HydrophobicContact CB-CG2 3.86Å; C367-I491 VanDerWaalsContact O-CG2 3.26Å; C367-I491 WeakPolarHBondContact O-CG2 3.24Å
368	G	90.8	Very high	92	Very high	26 Å²	26	22.7 Å²	22.7	27%	0.268	14%	0.144	S	C	.	.	S	Bend	trans	70.8	9.1	169.1	0	0	0	0	0	118	G366 T370 L371 L372	G366-G368 PolarHBondContact O-N 2.65Å; G366-G368 VanDerWaalsContact O-N 3.11Å; G368-T370 PolarHBondContact O-N 2.9Å; G368-L371 CarbonylContact O-C 3.45Å; G368-L371 WeakPolarHBondContact O-CA 3.46Å; G368-L371 VanDerWaalsContact O-CB 3.27Å; G368-L371 WeakPolarHBondContact O-CB 3.47Å; G368-L371 PolarHBondContact O-N 2.84Å; G368-L372 PolarHBondContact O-N 2.91Å
369	K	93.6	Very high	92	Very high	11 Å²	11	26 Å²	26	5%	0.048	16%	0.16	C	C	.	.	H	α-helix	trans	-47.1	-51.9	-179	-58.7	-166.4	-72.8	-89.1	0	114	L361 G363 P364 C367 L371 L372 A373 T469 N470 I491	L361-K369 HydrophobicContact CB-CB 4.44Å; L361-K369 HydrophobicContact CB-CD 4.27Å; L361-K369 WeakPolarHBondContact O-CD 3.39Å; G363-K369 PolarHBondContact O-NZ 2.86Å; P364-K369 PolarHBondContact O-NZ 2.92Å; C367-K369 VanDerWaalsContact C-N 3.33Å; C367-K369 PolarHBondContact O-N 2.91Å; C367-K369 VanDerWaalsContact O-N 3.15Å; K369-L371 VanDerWaalsContact C-N 3.26Å; K369-L371 PolarHBondContact O-N 3.12Å; K369-L372 PolarHBondContact O-N 2.91Å; K369-A373 PolarHBondContact O-N 2.87Å; K369-A373 VanDerWaalsContact O-N 3.08Å; K369-T469 VanDerWaalsContact CE-O 3.25Å; K369-T469 WeakPolarHBondContact CE-O 3.33Å; K369-T469 PolarHBondContact NZ-O 3Å; K369-N470 PolarHBondContact NZ-OD1 3.26Å; K369-I491 HydrophobicContact CB-CD1 4.45Å; K369-I491 HydrophobicContact CG-CB 4.46Å; K369-I491 HydrophobicContact CG-CD1 3.9Å; K369-I491 HydrophobicContact CG-CG2 4.44Å
370	T	91.6	Very high	91.8	Very high	49 Å²	49	26.4 Å²	26.4	30%	0.301	16%	0.163	S	C	.	.	H	α-helix	trans	-65.1	-27.3	176.7	-37.1	0	0	0	0	113.4	G368 K374 Y420 D422	G368-T370 PolarHBondContact O-N 2.9Å; T370-K374 WeakPolarHBondContact O-CD 3.31Å; T370-K374 WeakPolarHBondContact O-CG 3.26Å; T370-K374 PolarHBondContact O-N 2.81Å; T370-Y420 VanDerWaalsContact CA-OH 3.28Å; T370-Y420 WeakPolarHBondContact CA-OH 3.16Å; T370-Y420 HydrophobicContact CG2-CE1 3.83Å; T370-Y420 PolarHBondContact OG1-OH 2.93Å; T370-D422 WeakPolarHBondContact CB-OD2 3.1Å; T370-D422 VanDerWaalsContact CG2-OD2 3.28Å; T370-D422 WeakPolarHBondContact CG2-OD2 3.45Å; T370-D422 PolarHBondContact OG1-OD2 2.91Å
371	L	91.6	Very high	91.6	Very high	72 Å²	72	33 Å²	33	38%	0.377	19%	0.194	S	C	.	.	H	α-helix	trans	-77.7	-43.1	178.9	-162	161	0	0	0	109.8	V320 V325 G368 K369 K374 A375	V320-L371 HydrophobicContact CG1-CD2 3.62Å; V320-L371 HydrophobicContact CG1-CG 4.16Å; V325-L371 HydrophobicContact CB-CD2 4.18Å; V325-L371 HydrophobicContact CG2-CD2 3.47Å; V325-L371 VanDerWaalsContact CG2-CD2 3.47Å; G368-L371 CarbonylContact O-C 3.45Å; G368-L371 WeakPolarHBondContact O-CA 3.46Å; G368-L371 VanDerWaalsContact O-CB 3.27Å; G368-L371 WeakPolarHBondContact O-CB 3.47Å; G368-L371 PolarHBondContact O-N 2.84Å; K369-L371 VanDerWaalsContact C-N 3.26Å; K369-L371 PolarHBondContact O-N 3.12Å; L371-K374 PolarHBondContact O-N 2.84Å; L371-A375 WeakPolarHBondContact O-CB 3.45Å; L371-A375 PolarHBondContact O-N 3.33Å
372	L	93.6	Very high	91.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-50.2	171.7	-174.2	71.3	0	0	0	111.1	F322 V325 M328 A331 K332 V335 L361 G368 K369 K374 A375 V376 I491	F322-L372 HydrophobicContact CE1-CD1 4.1Å; V325-L372 HydrophobicContact CG1-CD1 4.47Å; M328-L372 HydrophobicContact CE-CB 4.07Å; M328-L372 HydrophobicContact CE-CD1 4.39Å; M328-L372 HydrophobicContact CE-CD2 3.84Å; M328-L372 HydrophobicContact CE-CG 4.32Å; A331-L372 HydrophobicContact CB-CD2 4.29Å; K332-L372 HydrophobicContact CG-CD1 4.1Å; V335-L372 HydrophobicContact CG2-CD2 3.83Å; V335-L372 HydrophobicContact CG2-CG 4.44Å; L361-L372 HydrophobicContact CD2-CD2 4.48Å; G368-L372 PolarHBondContact O-N 2.91Å; K369-L372 PolarHBondContact O-N 2.91Å; L372-K374 VanDerWaalsContact C-N 3.28Å; L372-K374 PolarHBondContact O-N 2.93Å; L372-A375 WeakPolarHBondContact O-CA 3.41Å; L372-A375 WeakPolarHBondContact O-CB 3.16Å; L372-A375 PolarHBondContact O-N 3.05Å; L372-V376 HydrophobicContact CG-CG2 4.43Å; L372-V376 WeakPolarHBondContact O-CG2 3.25Å; L372-V376 PolarHBondContact O-N 2.93Å; L372-I491 HydrophobicContact CD2-CD1 3.84Å
373	A	92.4	Very high	91.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.7	-38.2	179.3	0	0	0	0	0	113.4	L361 K369 A377 F384 Y420 L466	L361-A373 HydrophobicContact CD1-CB 4.23Å; K369-A373 PolarHBondContact O-N 2.87Å; K369-A373 VanDerWaalsContact O-N 3.08Å; A373-A377 PolarHBondContact O-N 2.76Å; A373-F384 HydrophobicContact CB-CE2 4.28Å; A373-F384 HydrophobicContact CB-CZ 4.27Å; A373-F384 WeakPolarHBondContact O-CE2 3.4Å; A373-Y420 HydrophobicContact CB-CD2 3.42Å; A373-Y420 VanDerWaalsContact CB-CD2 3.42Å; A373-Y420 HydrophobicContact CB-CE2 3.36Å; A373-Y420 HydrophobicContact CB-CG 4.2Å; A373-L466 HydrophobicContact CB-CD1 4.19Å
374	K	91.1	Very high	91.1	Very high	90 Å²	90	33.9 Å²	33.9	39%	0.391	20%	0.197	S	C	.	.	H	α-helix	trans	-68.9	-36.7	173.5	-73.3	170.4	-178.5	175.2	0	112.7	V320 T370 L371 L372 T378 F384	V320-K374 HydrophobicContact CB-CB 4.48Å; T370-K374 WeakPolarHBondContact O-CD 3.31Å; T370-K374 WeakPolarHBondContact O-CG 3.26Å; T370-K374 PolarHBondContact O-N 2.81Å; L371-K374 PolarHBondContact O-N 2.84Å; L372-K374 VanDerWaalsContact C-N 3.28Å; L372-K374 PolarHBondContact O-N 2.93Å; K374-T378 PolarHBondContact O-N 3.13Å; K374-T378 VanDerWaalsContact O-N 3.17Å; K374-T378 PolarHBondContact O-OG1 3.33Å; K374-F384 HydrophobicContact CG-CD1 4.33Å; K374-F384 HydrophobicContact CG-CE1 3.58Å; K374-F384 HydrophobicContact CG-CZ 3.81Å
375	A	91.5	Very high	91.1	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-41.7	176.5	0	0	0	0	0	112.2	V320 F322 V325 L371 L372 T378 E379	V320-A375 VanDerWaalsContact O-CA 3.29Å; V320-A375 WeakPolarHBondContact O-CA 3.44Å; F322-A375 HydrophobicContact CD1-CB 3.66Å; F322-A375 HydrophobicContact CE1-CB 4.06Å; V325-A375 HydrophobicContact CG2-CB 3.57Å; L371-A375 WeakPolarHBondContact O-CB 3.45Å; L371-A375 PolarHBondContact O-N 3.33Å; L372-A375 WeakPolarHBondContact O-CA 3.41Å; L372-A375 WeakPolarHBondContact O-CB 3.16Å; L372-A375 PolarHBondContact O-N 3.05Å; A375-T378 PolarHBondContact O-N 2.81Å; A375-E379 VanDerWaalsContact O-CB 3.29Å; A375-E379 WeakPolarHBondContact O-CB 3.46Å; A375-E379 PolarHBondContact O-N 3.29Å
376	V	92.1	Very high	91.2	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-60.9	-47.5	178.5	173.6	0	0	0	0	111.4	F322 V335 V339 L372 E379 A380 I418 L466	F322-V376 HydrophobicContact CE1-CG2 3.69Å; F322-V376 HydrophobicContact CZ-CG2 3.83Å; V335-V376 HydrophobicContact CB-CG2 3.82Å; V335-V376 HydrophobicContact CG1-CB 4.06Å; V335-V376 HydrophobicContact CG1-CG1 3.62Å; V335-V376 HydrophobicContact CG1-CG2 3.25Å; V339-V376 HydrophobicContact CG2-CB 4.43Å; V339-V376 HydrophobicContact CG2-CG1 3.83Å; L372-V376 HydrophobicContact CG-CG2 4.43Å; L372-V376 WeakPolarHBondContact O-CG2 3.25Å; L372-V376 PolarHBondContact O-N 2.93Å; V376-E379 PolarHBondContact O-N 3.34Å; V376-A380 VanDerWaalsContact O-CB 3.28Å; V376-A380 WeakPolarHBondContact O-CB 3.47Å; V376-A380 PolarHBondContact O-N 2.75Å; V376-I418 HydrophobicContact CG1-CD1 3.81Å; V376-L466 HydrophobicContact CG1-CD1 4.36Å
377	A	90.8	Very high	91.2	Very high	2 Å²	2	27.7 Å²	27.7	2%	0.017	15%	0.151	C	C	.	.	H	α-helix	trans	-66.8	-37.6	179	0	0	0	0	0	113.1	A373 Q381 V382 F384 I418	A373-A377 PolarHBondContact O-N 2.76Å; A377-Q381 PolarHBondContact O-N 2.83Å; A377-V382 HydrophobicContact CB-CG2 4.41Å; A377-V382 PolarHBondContact O-N 3.31Å; A377-F384 HydrophobicContact CB-CB 3.78Å; A377-F384 HydrophobicContact CB-CD2 3.51Å; A377-F384 HydrophobicContact CB-CE2 4.35Å; A377-F384 HydrophobicContact CB-CG 3.95Å; A377-I418 HydrophobicContact CB-CD1 3.95Å
378	T	90.3	Very high	91.2	Very high	33 Å²	33	28.6 Å²	28.6	20%	0.202	16%	0.159	C	C	.	.	H	α-helix	trans	-67.7	-44.1	176.3	-54.9	0	0	0	0	111.1	V320 K374 A375 Q381	V320-T378 WeakPolarHBondContact O-CB 3.37Å; V320-T378 WeakPolarHBondContact O-CG2 3.39Å; V320-T378 PolarHBondContact O-OG1 3.06Å; K374-T378 PolarHBondContact O-N 3.13Å; K374-T378 VanDerWaalsContact O-N 3.17Å; K374-T378 PolarHBondContact O-OG1 3.33Å; A375-T378 PolarHBondContact O-N 2.81Å; T378-Q381 PolarHBondContact O-N 3.4Å; T378-Q381 VanDerWaalsContact O-N 3.13Å
379	E	90.4	Very high	91.1	Very high	70 Å²	70	27.3 Å²	27.3	33%	0.327	15%	0.147	S	C	.	.	H	α-helix	trans	-65.6	-39.3	178	-174.1	60.7	-129.5	0	0	111.6	F322 V339 K343 A375 V376 Q381	F322-E379 HydrophobicContact CD2-CB 4.05Å; F322-E379 HydrophobicContact CD2-CG 3.69Å; F322-E379 HydrophobicContact CE2-CB 4.06Å; F322-E379 HydrophobicContact CE2-CG 3.78Å; V339-E379 HydrophobicContact CG1-CB 4.25Å; V339-E379 HydrophobicContact CG1-CG 3.68Å; V339-E379 HydrophobicContact CG2-CB 4.41Å; V339-E379 HydrophobicContact CG2-CG 4.45Å; K343-E379 WeakPolarHBondContact CE-O 3.32Å; K343-E379 PolarHBondContact NZ-O 2.91Å; K343-E379 IonicContact NZ-OE1 3.97Å; K343-E379 PolarHBondContact NZ-OE1 3.16Å; A375-E379 VanDerWaalsContact O-CB 3.29Å; A375-E379 WeakPolarHBondContact O-CB 3.46Å; A375-E379 PolarHBondContact O-N 3.29Å; V376-E379 PolarHBondContact O-N 3.34Å; E379-Q381 VanDerWaalsContact C-N 3.27Å; E379-Q381 PolarHBondContact O-N 2.9Å
380	A	89.2	Confident	90.8	Very high	8 Å²	8	30 Å²	30	7%	0.066	17%	0.167	C	C	.	.	H	α-helix	trans	-74.4	-10.8	173.2	0	0	0	0	0	114.2	V339 L342 V376 V382	V339-A380 HydrophobicContact CG1-CB 4.34Å; L342-A380 HydrophobicContact CB-CB 3.96Å; L342-A380 HydrophobicContact CD1-CB 3.82Å; V376-A380 VanDerWaalsContact O-CB 3.28Å; V376-A380 WeakPolarHBondContact O-CB 3.47Å; V376-A380 PolarHBondContact O-N 2.75Å; A380-V382 HydrophobicContact CB-CG1 4.3Å; A380-V382 HydrophobicContact CB-CG2 4.07Å; A380-V382 PolarHBondContact O-N 2.77Å
381	Q	89.4	Confident	90.6	Very high	140 Å²	140	31.4 Å²	31.4	65%	0.654	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	26.2	-177.2	-55.5	-174.4	-5.2	0	0	115.3	A377 T378 E379	A377-Q381 PolarHBondContact O-N 2.83Å; T378-Q381 PolarHBondContact O-N 3.4Å; T378-Q381 VanDerWaalsContact O-N 3.13Å; E379-Q381 VanDerWaalsContact C-N 3.27Å; E379-Q381 PolarHBondContact O-N 2.9Å
382	V	89.8	Confident	90.3	Very high	8 Å²	8	28 Å²	28	5%	0.048	15%	0.152	C	C	.	.			trans	-98.9	160.7	-179.5	-61.8	0	0	0	0	112.4	L342 A377 A380 P416 I418	L342-V382 HydrophobicContact CB-CG1 4.37Å; L342-V382 HydrophobicContact CD1-CG1 4.44Å; L342-V382 HydrophobicContact CD1-CG2 4.09Å; L342-V382 HydrophobicContact CD2-CG1 4.42Å; A377-V382 HydrophobicContact CB-CG2 4.41Å; A377-V382 PolarHBondContact O-N 3.31Å; A380-V382 HydrophobicContact CB-CG1 4.3Å; A380-V382 HydrophobicContact CB-CG2 4.07Å; A380-V382 PolarHBondContact O-N 2.77Å; V382-P416 HydrophobicContact CG1-CB 4.36Å; V382-P416 HydrophobicContact CG1-CG 4.3Å; V382-I418 HydrophobicContact CG2-CD1 3.99Å; V382-I418 HydrophobicContact CG2-CG1 3.95Å
383	P	90.6	Very high	89.8	Confident	31 Å²	31	30.5 Å²	30.5	20%	0.201	17%	0.167	C	C	.	.			trans	-62.4	138.1	170	-20	33.9	0	0	0	111.7	L385 P416 C417 I418	P383-L385 HydrophobicContact CB-CD1 4.27Å; P383-P416 VanDerWaalsContact CD-O 3.26Å; P383-P416 WeakPolarHBondContact CD-O 3.35Å; P383-C417 HydrophobicContact CB-CB 4.15Å; P383-C417 HydrophobicContact CG-CB 4.37Å; P383-C417 WeakPolarHBondContact O-CB 3.45Å; P383-I418 PolarHBondContact O-N 2.81Å
384	F	91.2	Very high	89	Confident	5 Å²	5	33.9 Å²	33.9	2%	0.022	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	116.6	176.1	-173.8	-112.6	0	0	0	109.7	V312 A373 K374 A377 A386 I418 Y420	V312-F384 HydrophobicContact CB-CB 4.28Å; V312-F384 HydrophobicContact CG2-CD1 4.47Å; V312-F384 PolarHBondContact N-O 3.32Å; V312-F384 PolarHBondContact O-N 3.03Å; A373-F384 HydrophobicContact CB-CE2 4.28Å; A373-F384 HydrophobicContact CB-CZ 4.27Å; A373-F384 WeakPolarHBondContact O-CE2 3.4Å; K374-F384 HydrophobicContact CG-CD1 4.33Å; K374-F384 HydrophobicContact CG-CE1 3.58Å; K374-F384 HydrophobicContact CG-CZ 3.81Å; A377-F384 HydrophobicContact CB-CB 3.78Å; A377-F384 HydrophobicContact CB-CD2 3.51Å; A377-F384 HydrophobicContact CB-CE2 4.35Å; A377-F384 HydrophobicContact CB-CG 3.95Å; F384-A386 HydrophobicContact CD1-CB 4.12Å; F384-A386 HydrophobicContact CE1-CB 3.68Å; F384-A386 HydrophobicContact CZ-CB 4.35Å; F384-I418 HydrophobicContact CD2-CB 4.26Å; F384-I418 HydrophobicContact CD2-CG2 3.88Å; F384-I418 HydrophobicContact CE2-CG2 4.05Å; F384-Y420 VanDerWaalsContact CE2-CB 3.46Å; F384-Y420 HydrophobicContact CE2-CG 4.01Å; F384-Y420 VanDerWaalsContact CZ-CB 3.44Å; F384-Y420 AromaticContact CZ-CD1 3.89Å; F384-Y420 HydrophobicContact CZ-CD1 3.89Å; F384-Y420 HydrophobicContact CZ-CD2 4.37Å; F384-Y420 AromaticContact CZ-CG 3.64Å; F384-Y420 HydrophobicContact CZ-CG 3.64Å
385	L	92.2	Very high	88.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	101.8	177.6	-69.5	79	0	0	0	108.6	F309 P383 L407 E410 A411 C417 I418 Y420	F309-L385 HydrophobicContact CD2-CB 4.04Å; F309-L385 HydrophobicContact CD2-CD2 3.89Å; F309-L385 HydrophobicContact CD2-CG 3.89Å; F309-L385 HydrophobicContact CE2-CD2 3.66Å; F309-L385 HydrophobicContact CE2-CG 3.94Å; P383-L385 HydrophobicContact CB-CD1 4.27Å; L385-L407 HydrophobicContact CB-CD1 4.25Å; L385-L407 HydrophobicContact CD2-CD1 4.28Å; L385-E410 HydrophobicContact CD2-CB 4.43Å; L385-A411 HydrophobicContact CD2-CB 4.23Å; L385-C417 HydrophobicContact CD1-CB 4.04Å; L385-I418 PolarHBondContact N-O 2.72Å; L385-Y420 PolarHBondContact O-N 2.87Å
386	A	91.3	Very high	87.2	Confident	18 Å²	18	41.5 Å²	41.5	15%	0.149	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	136	-178.5	0	0	0	0	0	112.9	F309 T310 F384 Y420	F309-A386 WeakPolarHBondContact CA-O 3.38Å; F309-A386 WeakPolarHBondContact CB-O 3.42Å; T310-A386 PolarHBondContact N-O 3.4Å; T310-A386 PolarHBondContact O-N 2.98Å; F384-A386 HydrophobicContact CD1-CB 4.12Å; F384-A386 HydrophobicContact CE1-CB 3.68Å; F384-A386 HydrophobicContact CZ-CB 4.35Å; A386-Y420 WeakPolarHBondContact CA-O 3.34Å; A386-Y420 HydrophobicContact CB-CD1 4.25Å
387	M	90.9	Very high	86.5	Confident	9 Å²	9	44.1 Å²	44.1	4%	0.044	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	145.8	174.5	178.4	144.5	-76.2	0	0	109.3	A307 F309 E391 F392 L407 Y420 I421 D422	A307-M387 HydrophobicContact CB-CE 3.77Å; A307-M387 HydrophobicContact CB-SD 4.39Å; F309-M387 HydrophobicContact CB-CE 4.12Å; M387-E391 HydrophobicContact CG-CB 4.26Å; M387-E391 WeakPolarHBondContact CG-OE2 3.39Å; M387-F392 HydrophobicContact CB-CZ 4.41Å; M387-F392 HydrophobicContact CG-CD2 4.4Å; M387-F392 HydrophobicContact CG-CE1 4.23Å; M387-F392 HydrophobicContact CG-CE2 3.75Å; M387-F392 HydrophobicContact CG-CZ 3.66Å; M387-F392 HydrophobicContact SD-CD1 4.04Å; M387-F392 HydrophobicContact SD-CE1 3.36Å; M387-F392 WeakPolarHBondContact SD-CE1 3.24Å; M387-F392 HydrophobicContact SD-CE2 4.02Å; M387-F392 HydrophobicContact SD-CZ 3.36Å; M387-F392 WeakPolarHBondContact SD-CZ 3.41Å; M387-L407 HydrophobicContact CB-CD2 4.43Å; M387-L407 HydrophobicContact SD-CD2 4.36Å; M387-Y420 PolarHBondContact N-O 2.91Å; M387-I421 WeakPolarHBondContact O-CA 3.33Å; M387-D422 PolarHBondContact O-N 2.82Å; M387-D422 VanDerWaalsContact O-N 3.08Å
388	A	91.3	Very high	85.9	Confident	27 Å²	27	45 Å²	45	22%	0.223	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	144.2	171.9	0	0	0	0	0	110.5	S390 E391	A388-S390 PolarHBondContact O-N 2.97Å; A388-E391 HydrophobicContact CB-CG 4.18Å; A388-E391 PolarHBondContact N-OE2 3.48Å; A388-E391 WeakPolarHBondContact O-CB 3.23Å; A388-E391 PolarHBondContact O-N 2.95Å
389	G	87.3	Confident	85.6	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-57.9	-35.2	-179	0	0	0	0	0	112.8	E391 F392 D422	G389-E391 VanDerWaalsContact C-N 3.25Å; G389-E391 PolarHBondContact O-N 3.44Å; G389-F392 WeakPolarHBondContact O-CB 3.44Å; G389-F392 PolarHBondContact O-N 2.9Å; G389-D422 WeakPolarHBondContact CA-O 3.38Å; G389-D422 PolarHBondContact N-O 2.9Å
390	S	87.8	Confident	85.4	Confident	67 Å²	67	40.9 Å²	40.9	47%	0.469	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-65.5	-20.3	174.2	49.4	0	0	0	0	114.2	A388 F392 V393	A388-S390 PolarHBondContact O-N 2.97Å; S390-F392 PolarHBondContact O-N 3.01Å; S390-V393 PolarHBondContact O-N 2.67Å
391	E	87.8	Confident	85.4	Confident	79 Å²	79	40.5 Å²	40.5	37%	0.369	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-76.7	-7.3	174.4	-63.4	179.9	148.4	0	0	113.2	M387 A388 G389 R403	M387-E391 HydrophobicContact CG-CB 4.26Å; M387-E391 WeakPolarHBondContact CG-OE2 3.39Å; A388-E391 HydrophobicContact CB-CG 4.18Å; A388-E391 PolarHBondContact N-OE2 3.48Å; A388-E391 WeakPolarHBondContact O-CB 3.23Å; A388-E391 PolarHBondContact O-N 2.95Å; G389-E391 VanDerWaalsContact C-N 3.25Å; G389-E391 PolarHBondContact O-N 3.44Å; E391-R403 WeakPolarHBondContact O-CD 3.41Å; E391-R403 PolarHBondContact O-NH1 3.12Å
392	F	85.6	Confident	85.4	Confident	1 Å²	1	34.8 Å²	34.8	0%	0.004	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-93.2	-20.9	173.2	-66.2	-65.8	0	0	0	113.3	M387 G389 S390 G400 R403 V404 L407 I421 V427 T446	M387-F392 HydrophobicContact CB-CZ 4.41Å; M387-F392 HydrophobicContact CG-CD2 4.4Å; M387-F392 HydrophobicContact CG-CE1 4.23Å; M387-F392 HydrophobicContact CG-CE2 3.75Å; M387-F392 HydrophobicContact CG-CZ 3.66Å; M387-F392 HydrophobicContact SD-CD1 4.04Å; M387-F392 HydrophobicContact SD-CE1 3.36Å; M387-F392 WeakPolarHBondContact SD-CE1 3.24Å; M387-F392 HydrophobicContact SD-CE2 4.02Å; M387-F392 HydrophobicContact SD-CZ 3.36Å; M387-F392 WeakPolarHBondContact SD-CZ 3.41Å; G389-F392 WeakPolarHBondContact O-CB 3.44Å; G389-F392 PolarHBondContact O-N 2.9Å; S390-F392 PolarHBondContact O-N 3.01Å; F392-G400 WeakPolarHBondContact O-CA 3.32Å; F392-R403 HydrophobicContact CD1-CB 4.13Å; F392-R403 HydrophobicContact CE1-CB 4.32Å; F392-V404 HydrophobicContact CD1-CG2 3.6Å; F392-V404 HydrophobicContact CE1-CB 4.36Å; F392-V404 HydrophobicContact CE1-CG2 3.49Å; F392-V404 VanDerWaalsContact CE1-CG2 3.49Å; F392-V404 HydrophobicContact CG-CG2 4.43Å; F392-V404 HydrophobicContact CZ-CG2 4.25Å; F392-L407 HydrophobicContact CE1-CD2 4.44Å; F392-L407 HydrophobicContact CZ-CD2 3.85Å; F392-I421 HydrophobicContact CE2-CD1 4.33Å; F392-I421 HydrophobicContact CE2-CG1 4.42Å; F392-I421 HydrophobicContact CE2-CG2 4.08Å; F392-V427 HydrophobicContact CB-CG1 3.47Å; F392-V427 VanDerWaalsContact CB-CG1 3.47Å; F392-V427 HydrophobicContact CD2-CG1 4.29Å; F392-V427 HydrophobicContact CD2-CG2 4.45Å; F392-V427 HydrophobicContact CG-CG1 4.28Å; F392-T446 HydrophobicContact CB-CG2 3.85Å
393	V	82.4	Confident	85.4	Confident	52 Å²	52	36 Å²	36	32%	0.315	23%	0.225	S	C	.	.			trans	-88.8	119.7	-177.4	-176	0	0	0	0	109.6	S390 A426 V427 E443	S390-V393 PolarHBondContact O-N 2.67Å; V393-A426 HydrophobicContact CG2-CB 4.45Å; V393-A426 WeakPolarHBondContact CG2-O 3.37Å; V393-V427 HydrophobicContact CG2-CG1 3.87Å; V393-E443 HydrophobicContact CG1-CG 4.49Å
394	E	76.6	Confident	85.4	Confident	71 Å²	71	34.6 Å²	34.6	33%	0.332	22%	0.216	S	C	.	.			trans	-141.5	149.7	-172.6	-79.3	-75.8	-167.3	0	0	112.4	I396 L399 R403 E442	E394-I396 PolarHBondContact O-N 2.77Å; E394-L399 HydrophobicContact CB-CB 4.29Å; E394-L399 HydrophobicContact CG-CB 4.44Å; E394-R403 IonicContact OE1-CZ 2.91Å; E394-R403 IonicContact OE1-NH1 3.88Å; E394-R403 PolarHBondContact OE1-NH1 2.82Å; E394-R403 IonicContact OE1-NH2 2.78Å; E394-R403 PolarHBondContact OE1-NH2 3.44Å; E394-E442 PolarHBondContact N-OE2 3.25Å; E394-E442 VanDerWaalsContact N-OE2 3.13Å
395	V	71.4	Confident	85.4	Confident	151 Å²	151	39.9 Å²	39.9	92%	0.915	24%	0.235	S	C	*	.	S	Bend	trans	-67.4	-18.6	179.3	-173.7	0	0	0	0	112.2
396	I	73.4	Confident	85.3	Confident	98 Å²	98	40.3 Å²	40.3	50%	0.503	24%	0.238	S	C	.	.	S	Bend	trans	-101.5	108.7	-178.7	-50.2	177.8	0	0	0	109.3	E394 G398 L399	E394-I396 PolarHBondContact O-N 2.77Å; I396-G398 PolarHBondContact O-N 3Å; I396-L399 HydrophobicContact CB-CD1 3.95Å; I396-L399 HydrophobicContact CB-CD2 4.22Å; I396-L399 HydrophobicContact CD1-CD2 4.42Å; I396-L399 HydrophobicContact CG2-CD1 3.65Å; I396-L399 PolarHBondContact O-N 2.94Å
397	G	76.9	Confident	85.3	Confident	57 Å²	57	39.5 Å²	39.5	59%	0.588	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.5	132.7	-178.5	0	0	0	0	0	113.9
398	G	78	Confident	85.3	Confident	20 Å²	20	39.1 Å²	39.1	21%	0.206	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	-1.1	177	0	0	0	0	0	115.9	I396 A402	I396-G398 PolarHBondContact O-N 3Å; G398-A402 PolarHBondContact O-N 2.82Å
399	L	84.6	Confident	85.3	Confident	17 Å²	17	45 Å²	45	9%	0.089	25%	0.25	C	S	.	.	H	α-helix	trans	-70	-42.7	170.7	-95.9	64.8	0	0	0	111.9	E394 I396 A402 R403	E394-L399 HydrophobicContact CB-CB 4.29Å; E394-L399 HydrophobicContact CG-CB 4.44Å; I396-L399 HydrophobicContact CB-CD1 3.95Å; I396-L399 HydrophobicContact CB-CD2 4.22Å; I396-L399 HydrophobicContact CD1-CD2 4.42Å; I396-L399 HydrophobicContact CG2-CD1 3.65Å; I396-L399 PolarHBondContact O-N 2.94Å; L399-A402 WeakPolarHBondContact O-CB 3.38Å; L399-A402 PolarHBondContact O-N 2.96Å; L399-R403 WeakPolarHBondContact O-CG 3.35Å; L399-R403 PolarHBondContact O-N 3.25Å
400	G	86.6	Confident	85.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-56.3	-53.9	176.5	0	0	0	0	0	112	F392 A402 R403 V404 T446	F392-G400 WeakPolarHBondContact O-CA 3.32Å; G400-A402 PolarHBondContact O-N 3.08Å; G400-R403 WeakPolarHBondContact O-CB 3.28Å; G400-R403 PolarHBondContact O-N 2.87Å; G400-V404 WeakPolarHBondContact O-CG2 3.44Å; G400-V404 PolarHBondContact O-N 2.76Å; G400-T446 WeakPolarHBondContact CA-OG1 3.43Å
401	A	88.8	Confident	85.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.5	-32.7	173.2	0	0	0	0	0	113.9	R405 Q445 T446 Q449	A401-R405 WeakPolarHBondContact O-CG 3.3Å; A401-R405 PolarHBondContact O-N 2.86Å; A401-Q445 HydrophobicContact CB-CG 4.38Å; A401-T446 PolarHBondContact N-OG1 3.38Å; A401-Q449 HydrophobicContact CB-CB 3.84Å; A401-Q449 HydrophobicContact CB-CG 4.12Å
402	A	88.6	Confident	85.6	Confident	20 Å²	20	45.9 Å²	45.9	17%	0.165	24%	0.242	C	C	.	.	H	α-helix	trans	-71.3	-40.3	174.3	0	0	0	0	0	112.5	K305 G398 L399 G400 R405 S406	K305-A402 HydrophobicContact CB-CB 4.22Å; K305-A402 HydrophobicContact CG-CB 4.36Å; G398-A402 PolarHBondContact O-N 2.82Å; L399-A402 WeakPolarHBondContact O-CB 3.38Å; L399-A402 PolarHBondContact O-N 2.96Å; G400-A402 PolarHBondContact O-N 3.08Å; A402-R405 PolarHBondContact O-N 3.48Å; A402-S406 PolarHBondContact O-N 2.95Å; A402-S406 VanDerWaalsContact O-N 3.07Å
403	R	89.2	Confident	85.8	Confident	33 Å²	33	50 Å²	50	13%	0.125	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-42.9	175.4	-68.6	177.1	-174.9	167.4	9.5	111.6	A307 E391 F392 E394 L399 G400 R405 S406 L407	A307-R403 HydrophobicContact CB-CB 4.36Å; E391-R403 WeakPolarHBondContact O-CD 3.41Å; E391-R403 PolarHBondContact O-NH1 3.12Å; F392-R403 HydrophobicContact CD1-CB 4.13Å; F392-R403 HydrophobicContact CE1-CB 4.32Å; E394-R403 IonicContact OE1-CZ 2.91Å; E394-R403 IonicContact OE1-NH1 3.88Å; E394-R403 PolarHBondContact OE1-NH1 2.82Å; E394-R403 IonicContact OE1-NH2 2.78Å; E394-R403 PolarHBondContact OE1-NH2 3.44Å; L399-R403 WeakPolarHBondContact O-CG 3.35Å; L399-R403 PolarHBondContact O-N 3.25Å; G400-R403 WeakPolarHBondContact O-CB 3.28Å; G400-R403 PolarHBondContact O-N 2.87Å; R403-R405 PolarHBondContact O-N 3.17Å; R403-S406 WeakPolarHBondContact O-CB 3.46Å; R403-S406 PolarHBondContact O-N 3.48Å; R403-S406 VanDerWaalsContact O-N 3.14Å; R403-L407 PolarHBondContact O-N 3.17Å
404	V	91.7	Very high	86	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-54.4	-50.2	173.5	173.8	0	0	0	0	111	F392 G400 S406 L407 F408 T446 Q449 L450 E453	F392-V404 HydrophobicContact CD1-CG2 3.6Å; F392-V404 HydrophobicContact CE1-CB 4.36Å; F392-V404 HydrophobicContact CE1-CG2 3.49Å; F392-V404 VanDerWaalsContact CE1-CG2 3.49Å; F392-V404 HydrophobicContact CG-CG2 4.43Å; F392-V404 HydrophobicContact CZ-CG2 4.25Å; G400-V404 WeakPolarHBondContact O-CG2 3.44Å; G400-V404 PolarHBondContact O-N 2.76Å; V404-S406 VanDerWaalsContact C-N 3.32Å; V404-S406 PolarHBondContact O-N 3.15Å; V404-L407 PolarHBondContact O-N 3.08Å; V404-F408 HydrophobicContact CG1-CD2 4.07Å; V404-F408 HydrophobicContact CG1-CE2 4.25Å; V404-F408 WeakPolarHBondContact O-CD2 3.44Å; V404-F408 PolarHBondContact O-N 3.19Å; V404-F408 VanDerWaalsContact O-N 3.11Å; V404-T446 HydrophobicContact CG2-CG2 4.24Å; V404-Q449 HydrophobicContact CB-CG 4.2Å; V404-Q449 HydrophobicContact CG1-CB 4.48Å; V404-Q449 HydrophobicContact CG1-CG 4Å; V404-L450 HydrophobicContact CG1-CB 4.22Å; V404-L450 HydrophobicContact CG1-CD1 4.36Å; V404-E453 HydrophobicContact CG1-CG 4.01Å
405	R	91.3	Very high	86.5	Confident	116 Å²	116	50.7 Å²	50.7	44%	0.438	28%	0.28	S	S	.	.	H	α-helix	trans	-61.2	-37.6	177.2	-67	179.7	-162.3	119.3	1.9	113	A401 A402 R403 K409 Q449	A401-R405 WeakPolarHBondContact O-CG 3.3Å; A401-R405 PolarHBondContact O-N 2.86Å; A402-R405 PolarHBondContact O-N 3.48Å; R403-R405 PolarHBondContact O-N 3.17Å; R405-K409 VanDerWaalsContact O-CB 3.25Å; R405-K409 WeakPolarHBondContact O-CB 3.3Å; R405-K409 PolarHBondContact O-N 3.08Å; R405-K409 VanDerWaalsContact O-N 3.08Å; R405-Q449 HydrophobicContact CG-CG 3.92Å; R405-Q449 VanDerWaalsContact CZ-OE1 3.26Å
406	S	90.1	Very high	87.4	Confident	9 Å²	9	46.3 Å²	46.3	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-51.5	175.1	-161.1	0	0	0	0	110.8	A402 R403 V404 F408 K409 E410	A402-S406 PolarHBondContact O-N 2.95Å; A402-S406 VanDerWaalsContact O-N 3.07Å; R403-S406 WeakPolarHBondContact O-CB 3.46Å; R403-S406 PolarHBondContact O-N 3.48Å; R403-S406 VanDerWaalsContact O-N 3.14Å; V404-S406 VanDerWaalsContact C-N 3.32Å; V404-S406 PolarHBondContact O-N 3.15Å; S406-F408 PolarHBondContact O-N 3.18Å; S406-K409 WeakPolarHBondContact O-CB 3.27Å; S406-K409 PolarHBondContact O-N 2.88Å; S406-K409 VanDerWaalsContact O-N 3.1Å; S406-E410 WeakPolarHBondContact O-CG 3.47Å; S406-E410 PolarHBondContact O-N 2.87Å; S406-E410 PolarHBondContact OG-OE2 3.41Å
407	L	90.9	Very high	88.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-55.9	-50.5	-178.4	-178.6	63.9	0	0	0	112	F309 L385 M387 F392 R403 V404 K409 E410 A411 V419	F309-L407 HydrophobicContact CB-CD1 4.26Å; F309-L407 HydrophobicContact CG-CD1 4.34Å; L385-L407 HydrophobicContact CB-CD1 4.25Å; L385-L407 HydrophobicContact CD2-CD1 4.28Å; M387-L407 HydrophobicContact CB-CD2 4.43Å; M387-L407 HydrophobicContact SD-CD2 4.36Å; F392-L407 HydrophobicContact CE1-CD2 4.44Å; F392-L407 HydrophobicContact CZ-CD2 3.85Å; R403-L407 PolarHBondContact O-N 3.17Å; V404-L407 PolarHBondContact O-N 3.08Å; L407-K409 VanDerWaalsContact C-N 3.33Å; L407-K409 PolarHBondContact O-N 2.94Å; L407-E410 PolarHBondContact O-N 3.39Å; L407-A411 WeakPolarHBondContact O-CB 3.43Å; L407-A411 PolarHBondContact O-N 3.49Å; L407-V419 HydrophobicContact CD1-CG1 4.32Å; L407-V419 HydrophobicContact CD2-CG1 3.82Å; L407-V419 HydrophobicContact CG-CG1 4.06Å
408	F	91.4	Very high	89	Confident	2 Å²	2	39 Å²	39	1%	0.009	20%	0.203	C	C	.	.	H	α-helix	trans	-72.1	-23.2	178.9	-79.5	-88.2	0	0	0	113.8	V404 S406 R412 L450 E453 M454 M457 V465	V404-F408 HydrophobicContact CG1-CD2 4.07Å; V404-F408 HydrophobicContact CG1-CE2 4.25Å; V404-F408 WeakPolarHBondContact O-CD2 3.44Å; V404-F408 PolarHBondContact O-N 3.19Å; V404-F408 VanDerWaalsContact O-N 3.11Å; S406-F408 PolarHBondContact O-N 3.18Å; F408-R412 WeakPolarHBondContact O-CG 3.39Å; F408-R412 PolarHBondContact O-N 3.25Å; F408-R412 PolarHBondContact O-NE 2.87Å; F408-L450 HydrophobicContact CE2-CD1 3.52Å; F408-L450 HydrophobicContact CZ-CD1 3.84Å; F408-E453 HydrophobicContact CB-CB 4.02Å; F408-E453 HydrophobicContact CB-CG 3.98Å; F408-E453 HydrophobicContact CD1-CB 3.99Å; F408-E453 HydrophobicContact CD2-CB 3.66Å; F408-E453 HydrophobicContact CD2-CG 3.92Å; F408-E453 HydrophobicContact CE1-CB 4.39Å; F408-E453 HydrophobicContact CE2-CB 4.11Å; F408-E453 HydrophobicContact CG-CB 3.6Å; F408-E453 HydrophobicContact CG-CG 3.99Å; F408-E453 HydrophobicContact CZ-CB 4.45Å; F408-M454 HydrophobicContact CE1-CG 4.44Å; F408-M454 HydrophobicContact CZ-CG 4.08Å; F408-M457 HydrophobicContact CD1-CG 4.44Å; F408-M457 HydrophobicContact CD1-SD 4.04Å; F408-M457 HydrophobicContact CE1-CE 4.13Å; F408-M457 HydrophobicContact CE1-SD 3.77Å; F408-V465 HydrophobicContact CE1-CG2 3.72Å; F408-V465 HydrophobicContact CZ-CG2 3.87Å
409	K	90.6	Very high	89.7	Confident	151 Å²	151	38 Å²	38	66%	0.657	19%	0.193	S	C	*	.	H	α-helix	trans	-70.8	-41.7	170.2	-176.8	-178.4	178.4	-175.6	0	111.3	R405 S406 L407 A413	R405-K409 VanDerWaalsContact O-CB 3.25Å; R405-K409 WeakPolarHBondContact O-CB 3.3Å; R405-K409 PolarHBondContact O-N 3.08Å; R405-K409 VanDerWaalsContact O-N 3.08Å; S406-K409 WeakPolarHBondContact O-CB 3.27Å; S406-K409 PolarHBondContact O-N 2.88Å; S406-K409 VanDerWaalsContact O-N 3.1Å; L407-K409 VanDerWaalsContact C-N 3.33Å; L407-K409 PolarHBondContact O-N 2.94Å; K409-A413 PolarHBondContact O-N 2.75Å
410	E	89.5	Confident	90.3	Very high	57 Å²	57	37.4 Å²	37.4	27%	0.266	19%	0.19	S	C	.	.	H	α-helix	trans	-76.8	-31.4	-179.1	-70	171	105	0	0	112.4	F309 L385 S406 L407 A413 R414	F309-E410 VanDerWaalsContact CE1-OE1 3.31Å; F309-E410 WeakPolarHBondContact CE1-OE1 3.18Å; F309-E410 VanDerWaalsContact CE1-OE2 3.25Å; F309-E410 WeakPolarHBondContact CE1-OE2 3.45Å; F309-E410 HydrophobicContact CZ-CB 3.99Å; F309-E410 VanDerWaalsContact CZ-CD 3.45Å; F309-E410 HydrophobicContact CZ-CG 4.26Å; F309-E410 VanDerWaalsContact CZ-OE1 3.24Å; F309-E410 WeakPolarHBondContact CZ-OE1 3.43Å; L385-E410 HydrophobicContact CD2-CB 4.43Å; S406-E410 WeakPolarHBondContact O-CG 3.47Å; S406-E410 PolarHBondContact O-N 2.87Å; S406-E410 PolarHBondContact OG-OE2 3.41Å; L407-E410 PolarHBondContact O-N 3.39Å; E410-A413 PolarHBondContact O-N 2.87Å; E410-R414 WeakPolarHBondContact O-CG 3.5Å; E410-R414 PolarHBondContact O-N 2.67Å
411	A	90.6	Very high	90.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.5	-51.6	169.6	0	0	0	0	0	111.7	L385 L407 A413 R414 A415 C417 V419 V463	L385-A411 HydrophobicContact CD2-CB 4.23Å; L407-A411 WeakPolarHBondContact O-CB 3.43Å; L407-A411 PolarHBondContact O-N 3.49Å; A411-A413 VanDerWaalsContact C-N 3.27Å; A411-A413 PolarHBondContact O-N 3.32Å; A411-R414 CarbonylContact O-C 3.52Å; A411-R414 PolarHBondContact O-N 2.78Å; A411-A415 PolarHBondContact O-N 3.43Å; A411-A415 VanDerWaalsContact O-N 3.14Å; A411-C417 PolarHBondContact O-SG 3.06Å; A411-V419 HydrophobicContact CB-CG2 3.45Å; A411-V419 VanDerWaalsContact CB-CG2 3.45Å; A411-V463 HydrophobicContact CB-CG1 4.05Å; A411-V463 HydrophobicContact CB-CG2 4.29Å
412	R	89.1	Confident	90.9	Very high	107 Å²	107	39 Å²	39	40%	0.404	20%	0.198	S	C	.	.	H	α-helix	trans	-58.1	-37.7	175.9	-78.9	178	-74	-163.2	-11.8	112.8	F408 R414 E453	F408-R412 WeakPolarHBondContact O-CG 3.39Å; F408-R412 PolarHBondContact O-N 3.25Å; F408-R412 PolarHBondContact O-NE 2.87Å; R412-R414 PolarHBondContact O-N 3.25Å; R412-E453 IonicContact CZ-OE2 3.31Å; R412-E453 IonicContact NH2-OE2 2.64Å; R412-E453 PolarHBondContact NH2-OE2 3.12Å
413	A	89.4	Confident	91.1	Very high	86 Å²	86	42.3 Å²	42.3	71%	0.711	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-11	176.2	0	0	0	0	0	114.4	K409 E410 A411	K409-A413 PolarHBondContact O-N 2.75Å; E410-A413 PolarHBondContact O-N 2.87Å; A411-A413 VanDerWaalsContact C-N 3.27Å; A411-A413 PolarHBondContact O-N 3.32Å
414	R	88.3	Confident	91.3	Very high	93 Å²	93	40.8 Å²	40.8	35%	0.351	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122	12	-177	-66.7	175.9	-179.6	-111.4	-0.3	113.2	D313 E410 A411 R412 P416	D313-R414 IonicContact OD1-NH1 2.61Å; E410-R414 WeakPolarHBondContact O-CG 3.5Å; E410-R414 PolarHBondContact O-N 2.67Å; A411-R414 CarbonylContact O-C 3.52Å; A411-R414 PolarHBondContact O-N 2.78Å; R412-R414 PolarHBondContact O-N 3.25Å; R414-P416 CarbonylContact O-C 3.55Å
415	A	86.6	Confident	91.2	Very high	45 Å²	45	42.2 Å²	42.2	37%	0.372	21%	0.212	S	C	.	.			trans	-58.7	142.9	179.4	0	0	0	0	0	112.3	A411 D461 V463	A411-A415 PolarHBondContact O-N 3.43Å; A411-A415 VanDerWaalsContact O-N 3.14Å; A415-D461 WeakPolarHBondContact CB-O 3.25Å; A415-V463 HydrophobicContact CB-CG2 4.43Å
416	P	89.3	Confident	91.1	Very high	60 Å²	60	38.1 Å²	38.1	39%	0.39	20%	0.203	S	C	.	.	S	Bend	cis	-71.6	135.3	-5.2	30.6	-35.5	0	0	0	112.1	L342 V382 P383 R414 H462	L342-P416 HydrophobicContact CD2-CB 4.16Å; V382-P416 HydrophobicContact CG1-CB 4.36Å; V382-P416 HydrophobicContact CG1-CG 4.3Å; P383-P416 VanDerWaalsContact CD-O 3.26Å; P383-P416 WeakPolarHBondContact CD-O 3.35Å; R414-P416 CarbonylContact O-C 3.55Å; P416-H462 WeakPolarHBondContact CA-O 3.47Å; P416-H462 HydrophobicContact CB-CB 3.88Å
417	C	91.1	Very high	90.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	165	180	73.1	0	0	0	0	113.7	P383 L385 A411 H462 I464	P383-C417 HydrophobicContact CB-CB 4.15Å; P383-C417 HydrophobicContact CG-CB 4.37Å; P383-C417 WeakPolarHBondContact O-CB 3.45Å; L385-C417 HydrophobicContact CD1-CB 4.04Å; A411-C417 PolarHBondContact O-SG 3.06Å; C417-H462 PolarHBondContact N-O 3.15Å; C417-I464 PolarHBondContact O-N 2.98Å; C417-I464 VanDerWaalsContact O-N 3.12Å
418	I	92.7	Very high	90.6	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.5	172.7	-69	173	0	0	0	109.5	L342 V376 A377 V382 P383 F384 L385 I464 L466	L342-I418 HydrophobicContact CD1-CD1 3.71Å; L342-I418 HydrophobicContact CD1-CG1 3.85Å; V376-I418 HydrophobicContact CG1-CD1 3.81Å; A377-I418 HydrophobicContact CB-CD1 3.95Å; V382-I418 HydrophobicContact CG2-CD1 3.99Å; V382-I418 HydrophobicContact CG2-CG1 3.95Å; P383-I418 PolarHBondContact O-N 2.81Å; F384-I418 HydrophobicContact CD2-CB 4.26Å; F384-I418 HydrophobicContact CD2-CG2 3.88Å; F384-I418 HydrophobicContact CE2-CG2 4.05Å; L385-I418 PolarHBondContact N-O 2.72Å; I418-I464 WeakPolarHBondContact CA-O 3.41Å; I418-I464 HydrophobicContact CG1-CB 4.48Å; I418-L466 HydrophobicContact CG2-CB 4.39Å; I418-L466 HydrophobicContact CG2-CD1 3.85Å; I418-L466 HydrophobicContact CG2-CG 3.96Å
419	V	94.1	Very high	90.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	125.6	167.5	177.3	0	0	0	0	107.8	L407 A411 I421 V463 I464 V465 L466	L407-V419 HydrophobicContact CD1-CG1 4.32Å; L407-V419 HydrophobicContact CD2-CG1 3.82Å; L407-V419 HydrophobicContact CG-CG1 4.06Å; A411-V419 HydrophobicContact CB-CG2 3.45Å; A411-V419 VanDerWaalsContact CB-CG2 3.45Å; V419-I421 HydrophobicContact CG1-CG1 4.45Å; V419-V463 HydrophobicContact CG2-CG1 3.85Å; V419-I464 PolarHBondContact N-O 2.81Å; V419-V465 HydrophobicContact CB-CG2 4.43Å; V419-V465 CarbonylContact O-C 3.37Å; V419-V465 WeakPolarHBondContact O-CA 3.49Å; V419-L466 PolarHBondContact O-N 3.48Å
420	Y	95.6	Very high	89.7	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.016	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125	178.5	179.3	-102.1	0	0	0	111.9	T370 A373 F384 L385 A386 M387 D422 L466 S468	T370-Y420 VanDerWaalsContact CA-OH 3.28Å; T370-Y420 WeakPolarHBondContact CA-OH 3.16Å; T370-Y420 HydrophobicContact CG2-CE1 3.83Å; T370-Y420 PolarHBondContact OG1-OH 2.93Å; A373-Y420 HydrophobicContact CB-CD2 3.42Å; A373-Y420 VanDerWaalsContact CB-CD2 3.42Å; A373-Y420 HydrophobicContact CB-CE2 3.36Å; A373-Y420 HydrophobicContact CB-CG 4.2Å; F384-Y420 VanDerWaalsContact CE2-CB 3.46Å; F384-Y420 HydrophobicContact CE2-CG 4.01Å; F384-Y420 VanDerWaalsContact CZ-CB 3.44Å; F384-Y420 AromaticContact CZ-CD1 3.89Å; F384-Y420 HydrophobicContact CZ-CD1 3.89Å; F384-Y420 HydrophobicContact CZ-CD2 4.37Å; F384-Y420 AromaticContact CZ-CG 3.64Å; F384-Y420 HydrophobicContact CZ-CG 3.64Å; L385-Y420 PolarHBondContact O-N 2.87Å; A386-Y420 WeakPolarHBondContact CA-O 3.34Å; A386-Y420 HydrophobicContact CB-CD1 4.25Å; M387-Y420 PolarHBondContact N-O 2.91Å; Y420-D422 HydrophobicContact CE1-CB 3.63Å; Y420-D422 VanDerWaalsContact CE1-OD2 3.23Å; Y420-D422 WeakPolarHBondContact CE1-OD2 3.34Å; Y420-D422 PolarHBondContact OH-OD2 3.14Å; Y420-L466 CarbonylContact C-O 3.58Å; Y420-L466 VanDerWaalsContact CA-O 3.24Å; Y420-L466 WeakPolarHBondContact CA-O 3.48Å; Y420-L466 HydrophobicContact CD2-CB 3.92Å; Y420-S468 PolarHBondContact OH-OG 2.98Å
421	I	94.9	Very high	88.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	104.1	176.8	-57.4	175.2	0	0	0	108.8	M387 F392 V419 I424 L450 V465 L466 A467 S468	M387-I421 WeakPolarHBondContact O-CA 3.33Å; F392-I421 HydrophobicContact CE2-CD1 4.33Å; F392-I421 HydrophobicContact CE2-CG1 4.42Å; F392-I421 HydrophobicContact CE2-CG2 4.08Å; V419-I421 HydrophobicContact CG1-CG1 4.45Å; I421-I424 HydrophobicContact CG2-CB 4.05Å; I421-I424 HydrophobicContact CG2-CD1 4.39Å; I421-I424 HydrophobicContact CG2-CG1 4.06Å; I421-L450 HydrophobicContact CD1-CD1 4.1Å; I421-L450 HydrophobicContact CD1-CD2 4.41Å; I421-V465 HydrophobicContact CD1-CG1 4.48Å; I421-L466 PolarHBondContact N-O 3.05Å; I421-A467 CarbonylContact O-C 3.55Å; I421-A467 VanDerWaalsContact O-CA 3.31Å; I421-A467 WeakPolarHBondContact O-CA 3.4Å; I421-S468 PolarHBondContact O-N 2.77Å
422	D	93.9	Very high	87.5	Confident	33 Å²	33	45.3 Å²	45.3	18%	0.176	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	156.4	172.1	-137.3	-45.5	0	0	0	111.1	T370 M387 G389 Y420 I424 S468	T370-D422 WeakPolarHBondContact CB-OD2 3.1Å; T370-D422 VanDerWaalsContact CG2-OD2 3.28Å; T370-D422 WeakPolarHBondContact CG2-OD2 3.45Å; T370-D422 PolarHBondContact OG1-OD2 2.91Å; M387-D422 PolarHBondContact O-N 2.82Å; M387-D422 VanDerWaalsContact O-N 3.08Å; G389-D422 WeakPolarHBondContact CA-O 3.38Å; G389-D422 PolarHBondContact N-O 2.9Å; Y420-D422 HydrophobicContact CE1-CB 3.63Å; Y420-D422 VanDerWaalsContact CE1-OD2 3.23Å; Y420-D422 WeakPolarHBondContact CE1-OD2 3.34Å; Y420-D422 PolarHBondContact OH-OD2 3.14Å; D422-I424 VanDerWaalsContact C-N 3.27Å; D422-I424 PolarHBondContact O-N 3.05Å; D422-S468 WeakPolarHBondContact CA-OG 3.09Å; D422-S468 PolarHBondContact OD1-OG 2.81Å
423	E	92.7	Very high	86	Confident	90 Å²	90	47.2 Å²	47.2	42%	0.421	26%	0.259	S	S	.	.	S	Bend	trans	45.6	47	178.4	-57.6	-172.3	146.9	0	0	113.8	D425 A426 S468	E423-D425 PolarHBondContact O-N 2.88Å; E423-A426 WeakPolarHBondContact O-CB 3.3Å; E423-A426 PolarHBondContact O-N 3.21Å; E423-S468 PolarHBondContact N-O 3.5Å
424	I	92.9	Very high	84.2	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-59.6	-20.5	-175.1	-166.5	168.5	0	0	0	112.8	L360 I421 D422 A426 V427 G428 L450 A467 S468 L475 L479 L485	L360-I424 HydrophobicContact CD1-CG2 3.88Å; I421-I424 HydrophobicContact CG2-CB 4.05Å; I421-I424 HydrophobicContact CG2-CD1 4.39Å; I421-I424 HydrophobicContact CG2-CG1 4.06Å; D422-I424 VanDerWaalsContact C-N 3.27Å; D422-I424 PolarHBondContact O-N 3.05Å; I424-A426 PolarHBondContact O-N 3.05Å; I424-V427 HydrophobicContact CG1-CG2 4.23Å; I424-V427 WeakPolarHBondContact O-CG2 3.44Å; I424-V427 PolarHBondContact O-N 2.96Å; I424-V427 VanDerWaalsContact O-N 3.1Å; I424-G428 WeakPolarHBondContact O-CA 3.41Å; I424-G428 PolarHBondContact O-N 2.7Å; I424-L450 HydrophobicContact CD1-CD2 4.25Å; I424-A467 HydrophobicContact CB-CB 4.29Å; I424-A467 HydrophobicContact CD1-CB 3.62Å; I424-A467 HydrophobicContact CG2-CB 4.2Å; I424-S468 PolarHBondContact N-O 3.21Å; I424-L475 HydrophobicContact CG2-CD1 4.19Å; I424-L475 HydrophobicContact CG2-CD2 4.07Å; I424-L479 HydrophobicContact CD1-CD1 4.45Å; I424-L485 HydrophobicContact CD1-CD1 3.88Å
425	D	90.7	Very high	82.5	Confident	32 Å²	32	53.3 Å²	53.3	17%	0.171	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-63.3	-13.3	173.6	52.6	-63.4	0	0	0	115	E423 V427 T469 I474 L475	E423-D425 PolarHBondContact O-N 2.88Å; D425-V427 VanDerWaalsContact C-N 3.34Å; D425-T469 WeakPolarHBondContact OD1-CB 3.41Å; D425-T469 PolarHBondContact OD1-OG1 3.01Å; D425-I474 HydrophobicContact CB-CD1 3.86Å; D425-I474 HydrophobicContact CB-CG1 4.11Å; D425-L475 HydrophobicContact CB-CD2 3.83Å; D425-L475 HydrophobicContact CB-CG 4.47Å
426	A	88.1	Confident	81	Confident	30 Å²	30	55 Å²	55	25%	0.248	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-65.8	-32.3	168.9	0	0	0	0	0	113.3	V393 E423 I424	V393-A426 HydrophobicContact CG2-CB 4.45Å; V393-A426 WeakPolarHBondContact CG2-O 3.37Å; E423-A426 WeakPolarHBondContact O-CB 3.3Å; E423-A426 PolarHBondContact O-N 3.21Å; I424-A426 PolarHBondContact O-N 3.05Å
427	V	86.6	Confident	79.3	Confident	3 Å²	3	55 Å²	55	2%	0.018	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-26.7	176.1	-72.8	0	0	0	0	113.5	F392 V393 I424 D425 K429 T446	F392-V427 HydrophobicContact CB-CG1 3.47Å; F392-V427 VanDerWaalsContact CB-CG1 3.47Å; F392-V427 HydrophobicContact CD2-CG1 4.29Å; F392-V427 HydrophobicContact CD2-CG2 4.45Å; F392-V427 HydrophobicContact CG-CG1 4.28Å; V393-V427 HydrophobicContact CG2-CG1 3.87Å; I424-V427 HydrophobicContact CG1-CG2 4.23Å; I424-V427 WeakPolarHBondContact O-CG2 3.44Å; I424-V427 PolarHBondContact O-N 2.96Å; I424-V427 VanDerWaalsContact O-N 3.1Å; D425-V427 VanDerWaalsContact C-N 3.34Å; V427-K429 VanDerWaalsContact C-N 3.27Å; V427-K429 PolarHBondContact O-N 2.64Å; V427-T446 HydrophobicContact CG1-CG2 3.94Å
428	G	84.4	Confident	77.6	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.346	C	S	.	.	S	Bend	trans	-85.8	13.1	-172.7	0	0	0	0	0	114.6	I424 L475 D476 L479	I424-G428 WeakPolarHBondContact O-CA 3.41Å; I424-G428 PolarHBondContact O-N 2.7Å; G428-L475 CarbonylContact O-C 3.56Å; G428-L475 WeakPolarHBondContact O-CA 3.11Å; G428-D476 PolarHBondContact O-N 2.66Å; G428-L479 VanDerWaalsContact CA-CD1 3.44Å
429	K	84.5	Confident	76	Confident	105 Å²	105	68.7 Å²	68.7	46%	0.457	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-68.6	139.4	-172.6	-168.5	177.4	176.8	-174.2	0	112.1	V427 R431 I474	V427-K429 VanDerWaalsContact C-N 3.27Å; V427-K429 PolarHBondContact O-N 2.64Å; K429-R431 PolarHBondContact O-N 3.3Å; K429-I474 CarbonylContact C-O 3.57Å; K429-I474 WeakPolarHBondContact CA-O 3.1Å
430	K	78	Confident	74.6	Confident	90 Å²	90	70.4 Å²	70.4	39%	0.391	38%	0.382	S	S	.	.			trans	-51.9	128.4	171.1	-80.4	168.7	174.7	146.1	0	110.3	S432 D473 I474 L475 N477	K430-S432 PolarHBondContact O-N 3.09Å; K430-D473 PolarHBondContact NZ-O 3.41Å; K430-I474 PolarHBondContact N-O 2.84Å; K430-L475 WeakPolarHBondContact CE-O 3.35Å; K430-L475 WeakPolarHBondContact CG-O 3.25Å; K430-N477 WeakPolarHBondContact CE-OD1 3.15Å
431	R	71.9	Confident	73.5	Confident	125 Å²	125	75 Å²	75	47%	0.472	41%	0.41	S	S	.	.			trans	-51.2	113.4	174.5	-55.1	-175.5	-166.5	-166.8	-5.6	109.6	K429 T433 E444 N448 D476	K429-R431 PolarHBondContact O-N 3.3Å; R431-T433 PolarHBondContact O-N 2.84Å; R431-E444 HydrophobicContact CG-CG 4.19Å; R431-N448 PolarHBondContact NH2-OD1 3.32Å; R431-D476 IonicContact NE-OD2 2.8Å
432	S	62	Low	72.9	Confident	47 Å²	47	76 Å²	76	33%	0.329	42%	0.415	S	S	.	.			trans	-74.8	126.8	-179.2	77.3	0	0	0	0	109.6	K430 N434 N440	K430-S432 PolarHBondContact O-N 3.09Å; S432-N434 PolarHBondContact O-N 2.79Å; S432-N440 PolarHBondContact OG-ND2 2.73Å
433	T	57.4	Low	72.3	Confident	147 Å²	147	77 Å²	77	90%	0.902	42%	0.419	S	S	*	.			trans	-71.1	19.9	-179.1	-17.2	0	0	0	0	113.8	R431 M435	R431-T433 PolarHBondContact O-N 2.84Å; T433-M435 PolarHBondContact O-N 3.36Å
434	N	53.2	Low	71.9	Confident	113 Å²	113	75.4 Å²	75.4	60%	0.604	41%	0.411	S	S	*	.			trans	-78.5	119.2	-176.4	-74.5	-14.7	0	0	0	110.1	S432 S436	S432-N434 PolarHBondContact O-N 2.79Å; N434-S436 PolarHBondContact O-N 2.86Å
435	M	51.5	Low	71.6	Confident	193 Å²	193	79.9 Å²	79.9	95%	0.951	43%	0.432	S	S	*	.	S	Bend	trans	-59.6	-5.3	-177.3	-162.3	64.9	75.9	0	0	114.9	T433 G437	T433-M435 PolarHBondContact O-N 3.36Å; M435-G437 PolarHBondContact O-N 2.78Å; M435-G437 VanDerWaalsContact O-N 3.14Å
436	S	56.1	Low	71.6	Confident	80 Å²	80	78.4 Å²	78.4	56%	0.559	43%	0.425	S	S	*	.			trans	-84.4	73.6	177.3	58	0	0	0	0	111.7	N434 F438	N434-S436 PolarHBondContact O-N 2.86Å; S436-F438 PolarHBondContact O-N 2.91Å
437	G	53.9	Low	71.7	Confident	62 Å²	62	77 Å²	77	64%	0.639	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	43.3	-169.8	0	0	0	0	0	118	M435	M435-G437 PolarHBondContact O-N 2.78Å; M435-G437 VanDerWaalsContact O-N 3.14Å
438	F	55.2	Low	71.9	Confident	206 Å²	206	79.9 Å²	79.9	90%	0.904	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-8.5	-177.6	-88.3	-82	0	0	0	116.2	S436	S436-F438 PolarHBondContact O-N 2.91Å
439	S	57.9	Low	72.3	Confident	81 Å²	81	81 Å²	81	57%	0.566	43%	0.433	S	S	*	.	S	Bend	trans	-113.4	-26.7	-174.2	55.7	0	0	0	0	116.8
440	N	64.7	Low	72.6	Confident	36 Å²	36	76.1 Å²	76.1	19%	0.193	41%	0.412	C	S	.	.	S	Bend	trans	-99.7	-3.7	-161.9	-52.6	-16.5	0	0	0	114.7	S432 E442 E444	S432-N440 PolarHBondContact OG-ND2 2.73Å; N440-E442 VanDerWaalsContact C-N 3.32Å; N440-E442 PolarHBondContact O-N 2.99Å; N440-E444 WeakPolarHBondContact O-CB 3.43Å; N440-E444 WeakPolarHBondContact O-CG 3.45Å; N440-E444 PolarHBondContact O-N 3.33Å; N440-E444 VanDerWaalsContact O-N 3.11Å
441	T	74.1	Confident	73.3	Confident	100 Å²	100	72.3 Å²	72.3	61%	0.613	40%	0.396	S	S	*	.	H	α-helix	trans	-70.5	-24.3	-169.2	49.9	0	0	0	0	114.1	Q445	T441-Q445 VanDerWaalsContact O-CB 3.28Å; T441-Q445 WeakPolarHBondContact O-CB 3.36Å; T441-Q445 PolarHBondContact O-N 3.3Å; T441-Q445 VanDerWaalsContact O-N 3.12Å
442	E	81.3	Confident	74.3	Confident	21 Å²	21	70.6 Å²	70.6	10%	0.098	40%	0.399	C	S	.	.	H	α-helix	trans	-77.2	-52.3	177.5	-162.3	-79.5	129.2	0	0	111.3	E394 N440 E444 Q445 T446	E394-E442 PolarHBondContact N-OE2 3.25Å; E394-E442 VanDerWaalsContact N-OE2 3.13Å; N440-E442 VanDerWaalsContact C-N 3.32Å; N440-E442 PolarHBondContact O-N 2.99Å; E442-E444 VanDerWaalsContact C-N 3.3Å; E442-E444 PolarHBondContact O-N 3.38Å; E442-Q445 PolarHBondContact O-N 3.46Å; E442-Q445 VanDerWaalsContact O-N 3.1Å; E442-T446 WeakPolarHBondContact O-CB 3.21Å; E442-T446 PolarHBondContact O-N 3.22Å; E442-T446 PolarHBondContact O-OG1 2.74Å; E442-T446 PolarHBondContact OE1-OG1 3.35Å
443	E	81.8	Confident	75.7	Confident	55 Å²	55	69.5 Å²	69.5	26%	0.257	39%	0.389	S	S	.	.	H	α-helix	trans	-51.6	-48.8	173.1	-65.9	177.4	-169.9	0	0	110.7	V393 Q445 T446 L447	V393-E443 HydrophobicContact CG1-CG 4.49Å; E443-Q445 PolarHBondContact O-N 3.02Å; E443-T446 PolarHBondContact O-N 3.08Å; E443-L447 VanDerWaalsContact O-CB 3.26Å; E443-L447 WeakPolarHBondContact O-CB 3.3Å; E443-L447 PolarHBondContact O-N 2.79Å
444	E	84.2	Confident	77.2	Confident	56 Å²	56	62.5 Å²	62.5	26%	0.262	35%	0.346	S	S	.	.	H	α-helix	trans	-64.1	-40.1	177.9	-73.7	-174.4	-168.3	0	0	113.2	R431 N440 E442 N448	R431-E444 HydrophobicContact CG-CG 4.19Å; N440-E444 WeakPolarHBondContact O-CB 3.43Å; N440-E444 WeakPolarHBondContact O-CG 3.45Å; N440-E444 PolarHBondContact O-N 3.33Å; N440-E444 VanDerWaalsContact O-N 3.11Å; E442-E444 VanDerWaalsContact C-N 3.3Å; E442-E444 PolarHBondContact O-N 3.38Å; E444-N448 WeakPolarHBondContact O-CB 3.36Å; E444-N448 PolarHBondContact O-N 3.3Å; E444-N448 PolarHBondContact O-ND2 2.97Å
445	Q	86.9	Confident	78.9	Confident	96 Å²	96	61 Å²	61	45%	0.449	34%	0.338	S	S	.	.	H	α-helix	trans	-65.6	-42.7	178.1	-175.5	178.9	25.8	0	0	111.3	A401 T441 E442 E443 N448 Q449	A401-Q445 HydrophobicContact CB-CG 4.38Å; T441-Q445 VanDerWaalsContact O-CB 3.28Å; T441-Q445 WeakPolarHBondContact O-CB 3.36Å; T441-Q445 PolarHBondContact O-N 3.3Å; T441-Q445 VanDerWaalsContact O-N 3.12Å; E442-Q445 PolarHBondContact O-N 3.46Å; E442-Q445 VanDerWaalsContact O-N 3.1Å; E443-Q445 PolarHBondContact O-N 3.02Å; Q445-N448 PolarHBondContact O-N 3.26Å; Q445-Q449 PolarHBondContact O-N 2.98Å
446	T	89.8	Confident	80.5	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-68.8	-41.4	179.8	-70.1	0	0	0	0	111.3	F392 G400 A401 V404 V427 E442 E443 Q449 L450	F392-T446 HydrophobicContact CB-CG2 3.85Å; G400-T446 WeakPolarHBondContact CA-OG1 3.43Å; A401-T446 PolarHBondContact N-OG1 3.38Å; V404-T446 HydrophobicContact CG2-CG2 4.24Å; V427-T446 HydrophobicContact CG1-CG2 3.94Å; E442-T446 WeakPolarHBondContact O-CB 3.21Å; E442-T446 PolarHBondContact O-N 3.22Å; E442-T446 PolarHBondContact O-OG1 2.74Å; E442-T446 PolarHBondContact OE1-OG1 3.35Å; E443-T446 PolarHBondContact O-N 3.08Å; T446-Q449 PolarHBondContact O-N 3.25Å; T446-L450 PolarHBondContact O-N 2.64Å; T446-L450 VanDerWaalsContact O-N 3.08Å
447	L	89.9	Confident	81.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-58.6	-52.4	170	177.3	53.8	0	0	0	112	E443 Q449 L450 L451 D476 L479	E443-L447 VanDerWaalsContact O-CB 3.26Å; E443-L447 WeakPolarHBondContact O-CB 3.3Å; E443-L447 PolarHBondContact O-N 2.79Å; L447-Q449 PolarHBondContact O-N 3.36Å; L447-L450 WeakPolarHBondContact O-CB 3.47Å; L447-L450 PolarHBondContact O-N 3.34Å; L447-L451 HydrophobicContact CD1-CD2 4.43Å; L447-L451 HydrophobicContact CD1-CG 4.37Å; L447-L451 WeakPolarHBondContact O-CG 3.46Å; L447-L451 PolarHBondContact O-N 3.31Å; L447-D476 HydrophobicContact CD2-CB 4.15Å; L447-L479 HydrophobicContact CD1-CD1 3.74Å; L447-L479 HydrophobicContact CD1-CD2 3.96Å; L447-L479 HydrophobicContact CD1-CG 3.83Å
448	N	90.8	Very high	82.3	Confident	62 Å²	62	49.7 Å²	49.7	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-59.8	-34.4	180	-72.8	-49.1	0	0	0	111.8	R431 E444 Q445 L451 V452	R431-N448 PolarHBondContact NH2-OD1 3.32Å; E444-N448 WeakPolarHBondContact O-CB 3.36Å; E444-N448 PolarHBondContact O-N 3.3Å; E444-N448 PolarHBondContact O-ND2 2.97Å; Q445-N448 PolarHBondContact O-N 3.26Å; N448-L451 PolarHBondContact O-N 3.42Å; N448-V452 WeakPolarHBondContact O-CG2 3.45Å; N448-V452 PolarHBondContact O-N 2.95Å
449	Q	92.3	Very high	82.8	Confident	24 Å²	24	44 Å²	44	11%	0.112	26%	0.263	C	S	.	.	H	α-helix	trans	-67.6	-38.5	173.7	-172.8	60.2	49.4	0	0	112.8	A401 V404 R405 Q445 T446 L447 L451 V452 E453	A401-Q449 HydrophobicContact CB-CB 3.84Å; A401-Q449 HydrophobicContact CB-CG 4.12Å; V404-Q449 HydrophobicContact CB-CG 4.2Å; V404-Q449 HydrophobicContact CG1-CB 4.48Å; V404-Q449 HydrophobicContact CG1-CG 4Å; R405-Q449 HydrophobicContact CG-CG 3.92Å; R405-Q449 VanDerWaalsContact CZ-OE1 3.26Å; Q445-Q449 PolarHBondContact O-N 2.98Å; T446-Q449 PolarHBondContact O-N 3.25Å; L447-Q449 PolarHBondContact O-N 3.36Å; Q449-L451 VanDerWaalsContact C-N 3.33Å; Q449-V452 PolarHBondContact O-N 3.13Å; Q449-E453 PolarHBondContact NE2-OE1 3.37Å; Q449-E453 PolarHBondContact O-N 3.23Å
450	L	92.5	Very high	83.1	Confident	2 Å²	2	45 Å²	45	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-44.4	174.2	177.9	60.8	0	0	0	110.8	V404 F408 I421 I424 T446 L447 V452 E453 M454 L479	V404-L450 HydrophobicContact CG1-CB 4.22Å; V404-L450 HydrophobicContact CG1-CD1 4.36Å; F408-L450 HydrophobicContact CE2-CD1 3.52Å; F408-L450 HydrophobicContact CZ-CD1 3.84Å; I421-L450 HydrophobicContact CD1-CD1 4.1Å; I421-L450 HydrophobicContact CD1-CD2 4.41Å; I424-L450 HydrophobicContact CD1-CD2 4.25Å; T446-L450 PolarHBondContact O-N 2.64Å; T446-L450 VanDerWaalsContact O-N 3.08Å; L447-L450 WeakPolarHBondContact O-CB 3.47Å; L447-L450 PolarHBondContact O-N 3.34Å; L450-V452 VanDerWaalsContact C-N 3.33Å; L450-V452 PolarHBondContact O-N 3.22Å; L450-E453 PolarHBondContact O-N 2.91Å; L450-M454 HydrophobicContact CD1-CG 4.24Å; L450-M454 HydrophobicContact CD1-SD 4.22Å; L450-M454 HydrophobicContact CG-SD 4.21Å; L450-M454 VanDerWaalsContact O-CG 3.29Å; L450-M454 WeakPolarHBondContact O-CG 3.35Å; L450-M454 PolarHBondContact O-N 3.06Å; L450-L479 HydrophobicContact CD2-CD2 4.08Å
451	L	91.9	Very high	83.5	Confident	11 Å²	11	45.4 Å²	45.4	6%	0.058	27%	0.268	C	S	.	.	H	α-helix	trans	-59.1	-42.8	174.9	-58.9	-178.9	0	0	0	112.1	L447 N448 Q449 M454 D455 A478 L479	L447-L451 HydrophobicContact CD1-CD2 4.43Å; L447-L451 HydrophobicContact CD1-CG 4.37Å; L447-L451 WeakPolarHBondContact O-CG 3.46Å; L447-L451 PolarHBondContact O-N 3.31Å; N448-L451 PolarHBondContact O-N 3.42Å; Q449-L451 VanDerWaalsContact C-N 3.33Å; L451-M454 PolarHBondContact O-N 3.48Å; L451-D455 WeakPolarHBondContact O-CB 3.45Å; L451-D455 VanDerWaalsContact O-CG 3.24Å; L451-D455 PolarHBondContact O-N 2.93Å; L451-A478 HydrophobicContact CD1-CB 3.93Å; L451-L479 HydrophobicContact CD2-CD2 3.56Å; L451-L479 HydrophobicContact CD2-CG 4Å
452	V	92.6	Very high	84	Confident	88 Å²	88	43.4 Å²	43.4	53%	0.533	25%	0.251	S	S	.	.	H	α-helix	trans	-65.5	-42.8	178.7	168.3	0	0	0	0	112.4	N448 Q449 L450 G456	N448-V452 WeakPolarHBondContact O-CG2 3.45Å; N448-V452 PolarHBondContact O-N 2.95Å; Q449-V452 PolarHBondContact O-N 3.13Å; L450-V452 VanDerWaalsContact C-N 3.33Å; L450-V452 PolarHBondContact O-N 3.22Å; V452-G456 PolarHBondContact O-N 3.3Å
453	E	91.6	Very high	84.4	Confident	24 Å²	24	43 Å²	43	11%	0.112	25%	0.251	C	S	.	.	H	α-helix	trans	-65.8	-40.9	175.4	-65.3	-60.6	140.9	0	0	111.4	V404 F408 R412 Q449 L450 G456 M457	V404-E453 HydrophobicContact CG1-CG 4.01Å; F408-E453 HydrophobicContact CB-CB 4.02Å; F408-E453 HydrophobicContact CB-CG 3.98Å; F408-E453 HydrophobicContact CD1-CB 3.99Å; F408-E453 HydrophobicContact CD2-CB 3.66Å; F408-E453 HydrophobicContact CD2-CG 3.92Å; F408-E453 HydrophobicContact CE1-CB 4.39Å; F408-E453 HydrophobicContact CE2-CB 4.11Å; F408-E453 HydrophobicContact CG-CB 3.6Å; F408-E453 HydrophobicContact CG-CG 3.99Å; F408-E453 HydrophobicContact CZ-CB 4.45Å; R412-E453 IonicContact CZ-OE2 3.31Å; R412-E453 IonicContact NH2-OE2 2.64Å; R412-E453 PolarHBondContact NH2-OE2 3.12Å; Q449-E453 PolarHBondContact NE2-OE1 3.37Å; Q449-E453 PolarHBondContact O-N 3.23Å; L450-E453 PolarHBondContact O-N 2.91Å; E453-G456 PolarHBondContact O-N 3.1Å; E453-M457 WeakPolarHBondContact O-CG 3.4Å; E453-M457 PolarHBondContact O-N 2.83Å; E453-M457 VanDerWaalsContact O-N 3.14Å
454	M	89.6	Confident	84.8	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-43.3	179.6	-69.6	-175.4	81.9	0	0	113.2	K357 F408 L450 L451 G456 M457 V465 R484 L485	K357-M454 PolarHBondContact NZ-O 3.39Å; F408-M454 HydrophobicContact CE1-CG 4.44Å; F408-M454 HydrophobicContact CZ-CG 4.08Å; L450-M454 HydrophobicContact CD1-CG 4.24Å; L450-M454 HydrophobicContact CD1-SD 4.22Å; L450-M454 HydrophobicContact CG-SD 4.21Å; L450-M454 VanDerWaalsContact O-CG 3.29Å; L450-M454 WeakPolarHBondContact O-CG 3.35Å; L450-M454 PolarHBondContact O-N 3.06Å; L451-M454 PolarHBondContact O-N 3.48Å; M454-G456 VanDerWaalsContact C-N 3.29Å; M454-G456 PolarHBondContact O-N 3.01Å; M454-M457 HydrophobicContact CB-CE 4.41Å; M454-M457 HydrophobicContact CG-CE 4.39Å; M454-M457 PolarHBondContact O-N 2.91Å; M454-V465 HydrophobicContact CE-CB 4.23Å; M454-V465 HydrophobicContact CE-CG1 4.25Å; M454-V465 HydrophobicContact CE-CG2 4.46Å; M454-R484 HydrophobicContact CB-CG 4.36Å; M454-R484 HydrophobicContact CE-CB 4.02Å; M454-R484 WeakPolarHBondContact CE-O 3.27Å; M454-R484 HydrophobicContact SD-CB 4.42Å; M454-L485 HydrophobicContact CE-CD2 3.72Å; M454-L485 HydrophobicContact CE-CG 3.96Å
455	D	88.2	Confident	85.3	Confident	81 Å²	81	37.9 Å²	37.9	43%	0.433	23%	0.227	S	C	.	.	H	α-helix	trans	-63.2	-40.1	173.9	-70.1	-11	0	0	0	110.5	K357 L451 M457 R484	K357-D455 PolarHBondContact NZ-O 3.39Å; L451-D455 WeakPolarHBondContact O-CB 3.45Å; L451-D455 VanDerWaalsContact O-CG 3.24Å; L451-D455 PolarHBondContact O-N 2.93Å; D455-M457 VanDerWaalsContact C-N 3.31Å; D455-M457 PolarHBondContact O-N 3.2Å; D455-R484 WeakPolarHBondContact OD1-CG 3.49Å; D455-R484 IonicContact OD1-CZ 2.72Å; D455-R484 IonicContact OD1-NE 2.84Å; D455-R484 PolarHBondContact OD1-NE 2.57Å; D455-R484 IonicContact OD1-NH2 3.21Å; D455-R484 PolarHBondContact OD1-NH2 3.32Å; D455-R484 IonicContact OD2-CZ 3.63Å; D455-R484 IonicContact OD2-NE 2.73Å; D455-R484 IonicContact OD2-NH2 3.09Å; D455-R484 PolarHBondContact OD2-NH2 3.16Å
456	G	84.4	Confident	85.7	Confident	54 Å²	54	33.4 Å²	33.4	56%	0.557	21%	0.206	S	C	*	.	H	α-helix	trans	-72	-9.4	-179.9	0	0	0	0	0	116.5	V452 E453 M454	V452-G456 PolarHBondContact O-N 3.3Å; E453-G456 PolarHBondContact O-N 3.1Å; M454-G456 VanDerWaalsContact C-N 3.29Å; M454-G456 PolarHBondContact O-N 3.01Å
457	M	79.8	Confident	85.9	Confident	11 Å²	11	33.3 Å²	33.3	5%	0.054	21%	0.205	C	C	.	.			trans	-69.3	130.4	172.2	-65.8	-166.7	-70.8	0	0	111	K357 F408 E453 M454 D455 V463 V465	K357-M457 HydrophobicContact CB-CE 4.32Å; K357-M457 WeakPolarHBondContact CE-O 3.45Å; K357-M457 PolarHBondContact NZ-O 3.03Å; F408-M457 HydrophobicContact CD1-CG 4.44Å; F408-M457 HydrophobicContact CD1-SD 4.04Å; F408-M457 HydrophobicContact CE1-CE 4.13Å; F408-M457 HydrophobicContact CE1-SD 3.77Å; E453-M457 WeakPolarHBondContact O-CG 3.4Å; E453-M457 PolarHBondContact O-N 2.83Å; E453-M457 VanDerWaalsContact O-N 3.14Å; M454-M457 HydrophobicContact CB-CE 4.41Å; M454-M457 HydrophobicContact CG-CE 4.39Å; M454-M457 PolarHBondContact O-N 2.91Å; D455-M457 VanDerWaalsContact C-N 3.31Å; D455-M457 PolarHBondContact O-N 3.2Å; M457-V463 HydrophobicContact SD-CB 4.09Å; M457-V463 HydrophobicContact SD-CG1 4.1Å; M457-V465 HydrophobicContact CE-CG2 3.69Å; M457-V465 HydrophobicContact SD-CG2 4.32Å
458	G	69.8	Low	86.2	Confident	33 Å²	33	33.3 Å²	33.3	34%	0.34	21%	0.205	S	C	.	.			trans	-77.5	159.5	169.8	0	0	0	0	0	112.2	T460 D461	G458-T460 PolarHBondContact O-N 3.16Å; G458-D461 PolarHBondContact N-OD2 3.28Å; G458-D461 PolarHBondContact O-N 2.73Å
459	T	64.9	Low	86.4	Confident	85 Å²	85	30.4 Å²	30.4	52%	0.521	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.6	169.4	46.3	0	0	0	0	112.9
460	T	64.4	Low	86.4	Confident	103 Å²	103	32.4 Å²	32.4	63%	0.632	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-11.1	178	49.2	0	0	0	0	114.3	G458 H462	G458-T460 PolarHBondContact O-N 3.16Å; T460-H462 VanDerWaalsContact C-N 3.27Å; T460-H462 PolarHBondContact O-CD2 3.15Å; T460-H462 PolarHBondContact O-N 3.4Å
461	D	72.9	Confident	86.2	Confident	44 Å²	44	36.7 Å²	36.7	24%	0.235	22%	0.217	C	C	.	.	S	Bend	trans	-79.4	-12.2	-170.4	-65.7	-11	0	0	0	112.6	A415 G458 V463	A415-D461 WeakPolarHBondContact CB-O 3.25Å; G458-D461 PolarHBondContact N-OD2 3.28Å; G458-D461 PolarHBondContact O-N 2.73Å; D461-V463 WeakPolarHBondContact O-CG2 3.34Å; D461-V463 PolarHBondContact O-N 3.23Å
462	H	84.6	Confident	85.9	Confident	58 Å²	58	38 Å²	38	27%	0.269	23%	0.23	S	C	.	.			trans	47.9	30	-180	-55.9	-71.8	0	0	0	115	Y341 P416 C417 T460	Y341-H462 AromaticContact CZ-ND1 3.93Å; Y341-H462 PolarHBondContact OH-ND1 2.7Å; P416-H462 WeakPolarHBondContact CA-O 3.47Å; P416-H462 HydrophobicContact CB-CB 3.88Å; C417-H462 PolarHBondContact N-O 3.15Å; T460-H462 VanDerWaalsContact C-N 3.27Å; T460-H462 PolarHBondContact O-CD2 3.15Å; T460-H462 PolarHBondContact O-N 3.4Å
463	V	89.1	Confident	85.6	Confident	13 Å²	13	37.2 Å²	37.2	8%	0.079	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.2	172.3	-179	0	0	0	0	108.9	A411 A415 V419 M457 D461	A411-V463 HydrophobicContact CB-CG1 4.05Å; A411-V463 HydrophobicContact CB-CG2 4.29Å; A415-V463 HydrophobicContact CB-CG2 4.43Å; V419-V463 HydrophobicContact CG2-CG1 3.85Å; M457-V463 HydrophobicContact SD-CB 4.09Å; M457-V463 HydrophobicContact SD-CG1 4.1Å; D461-V463 WeakPolarHBondContact O-CG2 3.34Å; D461-V463 PolarHBondContact O-N 3.23Å
464	I	91.3	Very high	85.4	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.5	174.5	-57.1	-178.7	0	0	0	109	F338 Y341 L342 C417 I418 V419 L466	F338-I464 HydrophobicContact CB-CD1 4.25Å; F338-I464 HydrophobicContact CD1-CD1 4.18Å; F338-I464 HydrophobicContact CD1-CG2 3.86Å; F338-I464 HydrophobicContact CE1-CG2 4.35Å; Y341-I464 HydrophobicContact CD1-CD1 3.93Å; Y341-I464 HydrophobicContact CE1-CD1 4.26Å; L342-I464 HydrophobicContact CD1-CD1 3.9Å; L342-I464 HydrophobicContact CD2-CD1 3.79Å; L342-I464 HydrophobicContact CD2-CG1 4.28Å; L342-I464 HydrophobicContact CG-CD1 3.69Å; C417-I464 PolarHBondContact O-N 2.98Å; C417-I464 VanDerWaalsContact O-N 3.12Å; I418-I464 WeakPolarHBondContact CA-O 3.41Å; I418-I464 HydrophobicContact CG1-CB 4.48Å; V419-I464 PolarHBondContact N-O 2.81Å; I464-L466 HydrophobicContact CG2-CD2 4.29Å
465	V	93.8	Very high	85.4	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	109.2	177.2	-177.7	0	0	0	0	109.9	K357 G358 S359 F408 V419 I421 M454 M457 L485	K357-V465 PolarHBondContact O-N 3.37Å; K357-V465 VanDerWaalsContact O-N 3.08Å; G358-V465 CarbonylContact C-O 3.58Å; G358-V465 WeakPolarHBondContact CA-O 3.45Å; S359-V465 PolarHBondContact N-O 3.19Å; F408-V465 HydrophobicContact CE1-CG2 3.72Å; F408-V465 HydrophobicContact CZ-CG2 3.87Å; V419-V465 HydrophobicContact CB-CG2 4.43Å; V419-V465 CarbonylContact O-C 3.37Å; V419-V465 WeakPolarHBondContact O-CA 3.49Å; I421-V465 HydrophobicContact CD1-CG1 4.48Å; M454-V465 HydrophobicContact CE-CB 4.23Å; M454-V465 HydrophobicContact CE-CG1 4.25Å; M454-V465 HydrophobicContact CE-CG2 4.46Å; M457-V465 HydrophobicContact CE-CG2 3.69Å; M457-V465 HydrophobicContact SD-CG2 4.32Å; V465-L485 HydrophobicContact CG1-CD2 4.26Å
466	L	95	Very high	85.4	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.6	167.3	-62.5	-175.8	0	0	0	109.1	S359 A373 V376 I418 V419 Y420 I421 I464	S359-L466 WeakPolarHBondContact O-CA 3.47Å; A373-L466 HydrophobicContact CB-CD1 4.19Å; V376-L466 HydrophobicContact CG1-CD1 4.36Å; I418-L466 HydrophobicContact CG2-CB 4.39Å; I418-L466 HydrophobicContact CG2-CD1 3.85Å; I418-L466 HydrophobicContact CG2-CG 3.96Å; V419-L466 PolarHBondContact O-N 3.48Å; Y420-L466 CarbonylContact C-O 3.58Å; Y420-L466 VanDerWaalsContact CA-O 3.24Å; Y420-L466 WeakPolarHBondContact CA-O 3.48Å; Y420-L466 HydrophobicContact CD2-CB 3.92Å; I421-L466 PolarHBondContact N-O 3.05Å; I464-L466 HydrophobicContact CG2-CD2 4.29Å
467	A	95.5	Very high	85.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.2	174.3	0	0	0	0	0	109.7	S359 L360 L361 I421 I424 L485	S359-A467 PolarHBondContact O-N 3.48Å; L360-A467 CarbonylContact C-O 3.44Å; L360-A467 WeakPolarHBondContact CA-O 3.29Å; L360-A467 HydrophobicContact CD1-CB 3.8Å; L361-A467 PolarHBondContact N-O 3.34Å; I421-A467 CarbonylContact O-C 3.55Å; I421-A467 VanDerWaalsContact O-CA 3.31Å; I421-A467 WeakPolarHBondContact O-CA 3.4Å; I424-A467 HydrophobicContact CB-CB 4.29Å; I424-A467 HydrophobicContact CD1-CB 3.62Å; I424-A467 HydrophobicContact CG2-CB 4.2Å; A467-L485 HydrophobicContact CB-CD1 3.85Å; A467-L485 HydrophobicContact CB-CD2 4.04Å
468	S	95.3	Very high	86.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147.9	172.7	61	0	0	0	0	112	L361 Y420 I421 D422 E423 I424	L361-S468 WeakPolarHBondContact O-CA 3.33Å; Y420-S468 PolarHBondContact OH-OG 2.98Å; I421-S468 PolarHBondContact O-N 2.77Å; D422-S468 WeakPolarHBondContact CA-OG 3.09Å; D422-S468 PolarHBondContact OD1-OG 2.81Å; E423-S468 PolarHBondContact N-O 3.5Å; I424-S468 PolarHBondContact N-O 3.21Å
469	T	94.1	Very high	87.1	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	158.6	172	-175.6	0	0	0	0	111.1	L360 L361 L362 K369 D425 R471 L475	L360-T469 HydrophobicContact CD1-CG2 4.24Å; L361-T469 PolarHBondContact O-N 2.97Å; L361-T469 VanDerWaalsContact O-N 3.16Å; L362-T469 HydrophobicContact CD2-CG2 3.38Å; K369-T469 VanDerWaalsContact CE-O 3.25Å; K369-T469 WeakPolarHBondContact CE-O 3.33Å; K369-T469 PolarHBondContact NZ-O 3Å; D425-T469 WeakPolarHBondContact OD1-CB 3.41Å; D425-T469 PolarHBondContact OD1-OG1 3.01Å; T469-R471 PolarHBondContact OG1-N 3.1Å; T469-L475 HydrophobicContact CG2-CD1 3.62Å; T469-L475 HydrophobicContact CG2-CG 4.46Å
470	N	93.4	Very high	88.2	Confident	66 Å²	66	33 Å²	33	35%	0.353	18%	0.178	S	C	.	.	S	Bend	trans	-91.5	-7.3	165.3	-56.7	-55.3	0	0	0	112.4	G363 P365 K369	G363-N470 WeakPolarHBondContact O-CA 3.44Å; P365-N470 WeakPolarHBondContact CA-OD1 3.33Å; K369-N470 PolarHBondContact NZ-OD1 3.26Å
471	R	88.6	Confident	89.5	Confident	92 Å²	92	35.3 Å²	35.3	35%	0.347	18%	0.175	S	C	.	.			trans	-143.9	78.7	-164.3	-68.9	-163.2	66.1	178.2	3.6	113.2	T469 D473 I474	T469-R471 PolarHBondContact OG1-N 3.1Å; R471-D473 WeakPolarHBondContact CA-OD1 3.43Å; R471-D473 WeakPolarHBondContact CB-OD1 3.34Å; R471-D473 IonicContact CZ-OD2 2.67Å; R471-D473 IonicContact NE-OD1 2.81Å; R471-D473 PolarHBondContact NE-OD1 3.21Å; R471-D473 IonicContact NE-OD2 3.39Å; R471-D473 IonicContact NH2-OD1 3.79Å; R471-D473 IonicContact NH2-OD2 3.6Å; R471-D473 PolarHBondContact NH2-OD2 2.75Å; R471-D473 PolarHBondContact O-N 3.03Å; R471-I474 HydrophobicContact CB-CD1 3.93Å; R471-I474 HydrophobicContact CB-CG1 3.84Å; R471-I474 VanDerWaalsContact NH2-CG2 3.25Å; R471-I474 WeakPolarHBondContact O-CG1 3.49Å
472	A	85.8	Confident	90.1	Very high	39 Å²	39	39.1 Å²	39.1	32%	0.322	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-61.1	-26.7	173.2	0	0	0	0	0	113.3	L362 I474 L475	L362-A472 HydrophobicContact CD1-CB 4.16Å; L362-A472 HydrophobicContact CD2-CB 3.82Å; A472-I474 VanDerWaalsContact C-N 3.31Å; A472-I474 PolarHBondContact O-N 2.97Å; A472-L475 PolarHBondContact O-N 2.94Å
473	D	85.5	Confident	90.1	Very high	71 Å²	71	37.7 Å²	37.7	38%	0.38	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-60.8	-36.7	-175.7	64.1	-50.1	0	0	0	113.2	K430 R471	K430-D473 PolarHBondContact NZ-O 3.41Å; R471-D473 WeakPolarHBondContact CA-OD1 3.43Å; R471-D473 WeakPolarHBondContact CB-OD1 3.34Å; R471-D473 IonicContact CZ-OD2 2.67Å; R471-D473 IonicContact NE-OD1 2.81Å; R471-D473 PolarHBondContact NE-OD1 3.21Å; R471-D473 IonicContact NE-OD2 3.39Å; R471-D473 IonicContact NH2-OD1 3.79Å; R471-D473 IonicContact NH2-OD2 3.6Å; R471-D473 PolarHBondContact NH2-OD2 2.75Å; R471-D473 PolarHBondContact O-N 3.03Å
474	I	87.4	Confident	90.2	Very high	26 Å²	26	38.6 Å²	38.6	13%	0.133	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-93	-8.4	-177.1	61.3	176	0	0	0	114.4	D425 K429 K430 R471 A472	D425-I474 HydrophobicContact CB-CD1 3.86Å; D425-I474 HydrophobicContact CB-CG1 4.11Å; K429-I474 CarbonylContact C-O 3.57Å; K429-I474 WeakPolarHBondContact CA-O 3.1Å; K430-I474 PolarHBondContact N-O 2.84Å; R471-I474 HydrophobicContact CB-CD1 3.93Å; R471-I474 HydrophobicContact CB-CG1 3.84Å; R471-I474 VanDerWaalsContact NH2-CG2 3.25Å; R471-I474 WeakPolarHBondContact O-CG1 3.49Å; A472-I474 VanDerWaalsContact C-N 3.31Å; A472-I474 PolarHBondContact O-N 2.97Å
475	L	88.8	Confident	90.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-71.8	140.1	-178.6	-73.9	179.6	0	0	0	112.5	L360 I424 D425 G428 K430 T469 A472 N477 L479 M480	L360-L475 HydrophobicContact CD1-CD1 4.28Å; L360-L475 HydrophobicContact CD2-CD1 3.69Å; I424-L475 HydrophobicContact CG2-CD1 4.19Å; I424-L475 HydrophobicContact CG2-CD2 4.07Å; D425-L475 HydrophobicContact CB-CD2 3.83Å; D425-L475 HydrophobicContact CB-CG 4.47Å; G428-L475 CarbonylContact O-C 3.56Å; G428-L475 WeakPolarHBondContact O-CA 3.11Å; K430-L475 WeakPolarHBondContact CE-O 3.35Å; K430-L475 WeakPolarHBondContact CG-O 3.25Å; T469-L475 HydrophobicContact CG2-CD1 3.62Å; T469-L475 HydrophobicContact CG2-CG 4.46Å; A472-L475 PolarHBondContact O-N 2.94Å; L475-N477 PolarHBondContact O-N 2.94Å; L475-L479 HydrophobicContact CD2-CD1 4.47Å; L475-M480 HydrophobicContact CB-CE 4.48Å
476	D	89.5	Confident	89.7	Confident	24 Å²	24	41 Å²	41	13%	0.128	22%	0.217	C	C	.	.			trans	-64	125.2	175.5	-168.3	-26.7	0	0	0	109.6	G428 R431 L447 A478 L479	G428-D476 PolarHBondContact O-N 2.66Å; R431-D476 IonicContact NE-OD2 2.8Å; L447-D476 HydrophobicContact CD2-CB 4.15Å; D476-A478 PolarHBondContact O-N 2.58Å; D476-A478 VanDerWaalsContact OD1-CB 3.29Å; D476-A478 WeakPolarHBondContact OD1-CB 3.42Å; D476-A478 PolarHBondContact OD1-N 2.91Å; D476-L479 PolarHBondContact O-N 3.42Å
477	N	89	Confident	89.4	Confident	95 Å²	95	45.7 Å²	45.7	51%	0.508	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-17.5	175.5	-65.2	2.4	0	0	0	112.5	K430 L475 M480 R481	K430-N477 WeakPolarHBondContact CE-OD1 3.15Å; L475-N477 PolarHBondContact O-N 2.94Å; N477-M480 WeakPolarHBondContact OD1-CE 3.23Å; N477-R481 VanDerWaalsContact O-CG 3.3Å; N477-R481 WeakPolarHBondContact O-CG 3.49Å
478	A	90.1	Very high	89.3	Confident	11 Å²	11	48.8 Å²	48.8	9%	0.091	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-35.4	171.4	0	0	0	0	0	113.5	L451 D476 R484	L451-A478 HydrophobicContact CD1-CB 3.93Å; D476-A478 PolarHBondContact O-N 2.58Å; D476-A478 VanDerWaalsContact OD1-CB 3.29Å; D476-A478 WeakPolarHBondContact OD1-CB 3.42Å; D476-A478 PolarHBondContact OD1-N 2.91Å; A478-R484 WeakPolarHBondContact O-CD 3.42Å; A478-R484 PolarHBondContact O-NH1 2.74Å
479	L	89.9	Confident	89.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-38.5	177.7	-77.9	165.9	0	0	0	111.9	I424 G428 L447 L450 L451 L475 D476 R481 R484 L485	I424-L479 HydrophobicContact CD1-CD1 4.45Å; G428-L479 VanDerWaalsContact CA-CD1 3.44Å; L447-L479 HydrophobicContact CD1-CD1 3.74Å; L447-L479 HydrophobicContact CD1-CD2 3.96Å; L447-L479 HydrophobicContact CD1-CG 3.83Å; L450-L479 HydrophobicContact CD2-CD2 4.08Å; L451-L479 HydrophobicContact CD2-CD2 3.56Å; L451-L479 HydrophobicContact CD2-CG 4Å; L475-L479 HydrophobicContact CD2-CD1 4.47Å; D476-L479 PolarHBondContact O-N 3.42Å; L479-R481 PolarHBondContact O-N 2.74Å; L479-R484 VanDerWaalsContact O-CB 3.27Å; L479-R484 WeakPolarHBondContact O-CB 3.33Å; L479-L485 HydrophobicContact CB-CD1 4.39Å; L479-L485 PolarHBondContact O-N 3.05Å; L479-L485 VanDerWaalsContact O-N 3.11Å
480	M	88.9	Confident	89.1	Confident	45 Å²	45	54.8 Å²	54.8	22%	0.222	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	16.6	-177.3	-61.7	-177.2	-69.8	0	0	113.9	L360 L475 N477	L360-M480 HydrophobicContact CD2-CG 4.43Å; L475-M480 HydrophobicContact CB-CE 4.48Å; N477-M480 WeakPolarHBondContact OD1-CE 3.23Å
481	R	90.8	Very high	89.1	Confident	151 Å²	151	51.9 Å²	51.9	57%	0.57	26%	0.26	S	S	*	.	S	Bend	trans	-83.7	145.9	178.1	-67.7	-172.3	-179.3	-179.4	-1.4	110.8	N477 L479 G483 R484	N477-R481 VanDerWaalsContact O-CG 3.3Å; N477-R481 WeakPolarHBondContact O-CG 3.49Å; L479-R481 PolarHBondContact O-N 2.74Å; R481-G483 PolarHBondContact O-N 2.82Å; R481-R484 PolarHBondContact O-N 3.46Å
482	P	85.9	Confident	89.1	Confident	125 Å²	125	53.3 Å²	53.3	81%	0.812	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	133.9	172.3	-28.7	36	0	0	0	112.3
483	G	83.6	Confident	89.3	Confident	27 Å²	27	55 Å²	55	28%	0.278	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	6	-172.9	0	0	0	0	0	115.5	K357 R481	K357-G483 WeakPolarHBondContact CD-O 3Å; R481-G483 PolarHBondContact O-N 2.82Å
484	R	91.3	Very high	89.6	Confident	32 Å²	32	52.2 Å²	52.2	12%	0.121	26%	0.264	C	S	.	.	S	Bend	trans	-123	-106	171.3	-66.2	171.3	177.8	175.6	-4.2	110.3	G358 M454 D455 A478 L479 R481 D486	G358-R484 WeakPolarHBondContact CA-O 3.3Å; G358-R484 PolarHBondContact N-O 3.38Å; G358-R484 VanDerWaalsContact N-O 3.1Å; M454-R484 HydrophobicContact CB-CG 4.36Å; M454-R484 HydrophobicContact CE-CB 4.02Å; M454-R484 WeakPolarHBondContact CE-O 3.27Å; M454-R484 HydrophobicContact SD-CB 4.42Å; D455-R484 WeakPolarHBondContact OD1-CG 3.49Å; D455-R484 IonicContact OD1-CZ 2.72Å; D455-R484 IonicContact OD1-NE 2.84Å; D455-R484 PolarHBondContact OD1-NE 2.57Å; D455-R484 IonicContact OD1-NH2 3.21Å; D455-R484 PolarHBondContact OD1-NH2 3.32Å; D455-R484 IonicContact OD2-CZ 3.63Å; D455-R484 IonicContact OD2-NE 2.73Å; D455-R484 IonicContact OD2-NH2 3.09Å; D455-R484 PolarHBondContact OD2-NH2 3.16Å; A478-R484 WeakPolarHBondContact O-CD 3.42Å; A478-R484 PolarHBondContact O-NH1 2.74Å; L479-R484 VanDerWaalsContact O-CB 3.27Å; L479-R484 WeakPolarHBondContact O-CB 3.33Å; R481-R484 PolarHBondContact O-N 3.46Å; R484-D486 PolarHBondContact O-N 3.03Å
485	L	91.2	Very high	89.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.278	C	S	.	.	S	Bend	trans	-92.3	84.6	164.4	-58.3	177.5	0	0	0	106.4	G358 L360 I424 M454 V465 A467 L479 H488	G358-L485 WeakPolarHBondContact O-CA 3.49Å; L360-L485 HydrophobicContact CB-CB 4.31Å; L360-L485 HydrophobicContact CB-CD1 4.33Å; L360-L485 HydrophobicContact CD1-CD1 4.17Å; I424-L485 HydrophobicContact CD1-CD1 3.88Å; M454-L485 HydrophobicContact CE-CD2 3.72Å; M454-L485 HydrophobicContact CE-CG 3.96Å; V465-L485 HydrophobicContact CG1-CD2 4.26Å; A467-L485 HydrophobicContact CB-CD1 3.85Å; A467-L485 HydrophobicContact CB-CD2 4.04Å; L479-L485 HydrophobicContact CB-CD1 4.39Å; L479-L485 PolarHBondContact O-N 3.05Å; L479-L485 VanDerWaalsContact O-N 3.11Å; L485-H488 PolarHBondContact O-NE2 2.85Å
486	D	83.8	Confident	89.6	Confident	53 Å²	53	57 Å²	57	28%	0.283	29%	0.292	S	S	.	.			trans	-94.1	-23.9	-170.9	56.3	13.8	0	0	0	113.5	P356 G358 R484	P356-D486 VanDerWaalsContact CB-OD1 3.23Å; P356-D486 WeakPolarHBondContact CB-OD1 3.27Å; G358-D486 PolarHBondContact O-N 3.49Å; G358-D486 VanDerWaalsContact O-OD1 3.06Å; R484-D486 PolarHBondContact O-N 3.03Å
487	R	89.6	Confident	89.5	Confident	101 Å²	101	60.1 Å²	60.1	38%	0.381	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.3	168.8	-64.2	-59.9	-162.9	124.5	18.3	110.6	E337 F338 P356 G358 S359 L360	E337-R487 IonicContact OE2-CZ 2.67Å; E337-R487 IonicContact OE2-NH2 3.41Å; E337-R487 PolarHBondContact OE2-NH2 2.93Å; F338-R487 HydrophobicContact CZ-CB 4Å; F338-R487 HydrophobicContact CZ-CG 3.93Å; P356-R487 HydrophobicContact CB-CG 3.83Å; P356-R487 HydrophobicContact CG-CG 4.48Å; G358-R487 PolarHBondContact O-N 3.24Å; S359-R487 CarbonylContact C-O 3.6Å; S359-R487 WeakPolarHBondContact CA-O 3.16Å; S359-R487 WeakPolarHBondContact OG-CB 3.49Å; S359-R487 PolarHBondContact OG-O 2.9Å; L360-R487 PolarHBondContact N-O 3.22Å
488	H	91.9	Very high	89.7	Confident	65 Å²	65	56.9 Å²	56.9	30%	0.301	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	110.2	175.5	-58.5	150.7	0	0	0	108	L362 L485 F490	L362-H488 HydrophobicContact CD1-CB 4.21Å; L485-H488 PolarHBondContact O-NE2 2.85Å; H488-F490 HydrophobicContact CB-CE2 4.21Å
489	I	93.7	Very high	89.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.5	-175.9	-53.1	179.7	0	0	0	107.1	A331 E334 V335 F338 S359 L360 L361 L362	A331-I489 HydrophobicContact CB-CG2 3.86Å; E334-I489 HydrophobicContact CB-CD1 4.06Å; E334-I489 HydrophobicContact CB-CG1 4.36Å; E334-I489 HydrophobicContact CB-CG2 4.28Å; V335-I489 HydrophobicContact CG2-CD1 3.45Å; V335-I489 VanDerWaalsContact CG2-CD1 3.45Å; F338-I489 HydrophobicContact CE2-CD1 4.07Å; S359-I489 VanDerWaalsContact OG-CD1 3.27Å; S359-I489 WeakPolarHBondContact OG-CD1 3.5Å; S359-I489 WeakPolarHBondContact OG-CG1 3.38Å; L360-I489 PolarHBondContact O-N 3.11Å; L361-I489 HydrophobicContact CD2-CB 3.96Å; L361-I489 HydrophobicContact CD2-CD1 4.11Å; L361-I489 HydrophobicContact CD2-CG1 4.45Å; L361-I489 HydrophobicContact CD2-CG2 4.43Å; L362-I489 PolarHBondContact N-O 3.49Å
490	F	92	Very high	90	Very high	128 Å²	128	59.1 Å²	59.1	56%	0.561	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	132	179.9	-65	-90.5	0	0	0	109.9	L362 H488	L362-F490 HydrophobicContact CB-CD1 3.95Å; L362-F490 HydrophobicContact CB-CE1 4.19Å; L362-F490 HydrophobicContact CD1-CD1 4.09Å; L362-F490 HydrophobicContact CD1-CE1 3.49Å; L362-F490 VanDerWaalsContact CD1-CE1 3.49Å; L362-F490 HydrophobicContact CD1-CE2 4.46Å; L362-F490 HydrophobicContact CD1-CZ 3.71Å; L362-F490 HydrophobicContact CG-CE1 4.47Å; H488-F490 HydrophobicContact CB-CE2 4.21Å
491	I	92.9	Very high	90.2	Very high	5 Å²	5	59.4 Å²	59.4	3%	0.026	30%	0.296	C	S	.	.			trans	-126.3	88.9	179.6	-64.6	165.9	0	0	0	105.9	M328 A331 L361 L362 G363 P364 C367 K369 L372	M328-I491 HydrophobicContact CE-CB 4.36Å; M328-I491 HydrophobicContact CE-CD1 3.76Å; M328-I491 HydrophobicContact CE-CG1 3.88Å; M328-I491 HydrophobicContact CE-CG2 3.53Å; M328-I491 HydrophobicContact SD-CG2 4.32Å; A331-I491 HydrophobicContact CB-CG1 3.87Å; L361-I491 HydrophobicContact CB-CD1 4.14Å; L361-I491 HydrophobicContact CD2-CD1 4.22Å; L362-I491 WeakPolarHBondContact O-CA 3.34Å; L362-I491 WeakPolarHBondContact O-CB 3.49Å; L362-I491 PolarHBondContact O-N 3.01Å; G363-I491 WeakPolarHBondContact CA-O 3.17Å; P364-I491 WeakPolarHBondContact CD-O 3.5Å; C367-I491 HydrophobicContact CB-CG2 3.86Å; C367-I491 VanDerWaalsContact O-CG2 3.26Å; C367-I491 WeakPolarHBondContact O-CG2 3.24Å; K369-I491 HydrophobicContact CB-CD1 4.45Å; K369-I491 HydrophobicContact CG-CB 4.46Å; K369-I491 HydrophobicContact CG-CD1 3.9Å; K369-I491 HydrophobicContact CG-CG2 4.44Å; L372-I491 HydrophobicContact CD2-CD1 3.84Å
492	D	89.8	Confident	90.3	Very high	121 Å²	121	53 Å²	53	65%	0.647	27%	0.273	S	S	*	.			trans	-80.2	-177.6	-179	-74.1	-39.5	0	0	0	112.4
493	L	90.4	Very high	90.8	Very high	74 Å²	74	47 Å²	47	39%	0.387	23%	0.234	S	C	.	.	S	Bend	trans	-65.4	139	172.7	-69.5	167.8	0	0	0	110	P364 T495	P364-L493 HydrophobicContact CB-CD2 4.49Å; P364-L493 HydrophobicContact CG-CD2 4.01Å; P364-L493 HydrophobicContact CG-CG 3.91Å; L493-T495 PolarHBondContact O-N 3Å
494	P	91.1	Very high	91.2	Very high	14 Å²	14	47.5 Å²	47.5	9%	0.091	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-63.7	135.8	-174.6	25.3	-35.2	0	0	0	112.9	E498 R499 I502 F530	P494-E498 HydrophobicContact CB-CB 3.84Å; P494-R499 HydrophobicContact CB-CG 3.85Å; P494-R499 HydrophobicContact CG-CG 3.71Å; P494-R499 WeakPolarHBondContact O-CG 3.38Å; P494-R499 PolarHBondContact O-NH1 3.34Å; P494-I502 HydrophobicContact CB-CD1 3.82Å; P494-I502 HydrophobicContact CG-CD1 4.08Å; P494-F530 WeakPolarHBondContact CD-O 3.45Å; P494-F530 WeakPolarHBondContact CG-O 3.33Å
495	T	89.4	Confident	91.3	Very high	71 Å²	71	47.9 Å²	47.9	44%	0.436	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-62.9	164.4	170.2	61.7	0	0	0	0	111.6	L493 Q497 E498 R499	L493-T495 PolarHBondContact O-N 3Å; T495-Q497 VanDerWaalsContact C-N 3.25Å; T495-Q497 PolarHBondContact O-N 3.09Å; T495-E498 WeakPolarHBondContact CG2-OE2 3.35Å; T495-E498 PolarHBondContact N-OE2 3.01Å; T495-E498 PolarHBondContact O-N 3.32Å; T495-E498 VanDerWaalsContact OG1-CG 3.27Å; T495-E498 WeakPolarHBondContact OG1-CG 3.3Å; T495-E498 PolarHBondContact OG1-N 3Å; T495-E498 PolarHBondContact OG1-OE2 3.11Å; T495-R499 WeakPolarHBondContact O-CG 3.42Å; T495-R499 PolarHBondContact O-N 2.99Å
496	L	86.7	Confident	91.4	Very high	56 Å²	56	51 Å²	51	29%	0.293	25%	0.246	S	C	.	.	H	α-helix	trans	-52.3	-42.1	-179.8	-176.5	152.4	0	0	0	113.1	R499 K500 L521 E525	L496-R499 PolarHBondContact O-N 3.14Å; L496-K500 PolarHBondContact O-N 2.87Å; L496-L521 HydrophobicContact CD2-CD1 4.31Å; L496-E525 HydrophobicContact CD1-CG 4.15Å
497	Q	88.5	Confident	91.8	Very high	89 Å²	89	48.5 Å²	48.5	42%	0.416	23%	0.233	S	C	.	.	H	α-helix	trans	-68.1	-41.4	178	-179.5	67.2	0.5	0	0	111.8	T495 K500 E501	T495-Q497 VanDerWaalsContact C-N 3.25Å; T495-Q497 PolarHBondContact O-N 3.09Å; Q497-K500 WeakPolarHBondContact O-CB 3.18Å; Q497-K500 PolarHBondContact O-N 3.03Å; Q497-E501 PolarHBondContact O-N 2.79Å
498	E	91.6	Very high	91.9	Very high	27 Å²	27	50.2 Å²	50.2	13%	0.126	24%	0.243	C	C	.	.	H	α-helix	trans	-68.5	-37.4	176.7	-65.9	172.8	125.5	0	0	111.8	M328 H329 P494 T495 K500 E501 I502	M328-E498 WeakPolarHBondContact CA-OE1 3.18Å; M328-E498 PolarHBondContact N-OE1 3Å; H329-E498 PolarHBondContact N-OE1 3.17Å; H329-E498 IonicContact ND1-OE1 3.84Å; P494-E498 HydrophobicContact CB-CB 3.84Å; T495-E498 WeakPolarHBondContact CG2-OE2 3.35Å; T495-E498 PolarHBondContact N-OE2 3.01Å; T495-E498 PolarHBondContact O-N 3.32Å; T495-E498 VanDerWaalsContact OG1-CG 3.27Å; T495-E498 WeakPolarHBondContact OG1-CG 3.3Å; T495-E498 PolarHBondContact OG1-N 3Å; T495-E498 PolarHBondContact OG1-OE2 3.11Å; E498-K500 VanDerWaalsContact C-N 3.31Å; E498-K500 PolarHBondContact O-N 2.76Å; E498-E501 PolarHBondContact O-N 3.1Å; E498-I502 WeakPolarHBondContact O-CB 3.18Å; E498-I502 WeakPolarHBondContact O-CD1 3.41Å; E498-I502 WeakPolarHBondContact O-CG1 3.25Å; E498-I502 PolarHBondContact O-N 3.18Å
499	R	93.1	Very high	91.8	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.015	26%	0.264	C	S	.	.	H	α-helix	trans	-57.4	-45.9	171.2	-68.5	-165.5	-57.4	-93.6	10.5	110.6	P494 T495 L496 E501 I502 F503 A524 T527 I535 D627	P494-R499 HydrophobicContact CB-CG 3.85Å; P494-R499 HydrophobicContact CG-CG 3.71Å; P494-R499 WeakPolarHBondContact O-CG 3.38Å; P494-R499 PolarHBondContact O-NH1 3.34Å; T495-R499 WeakPolarHBondContact O-CG 3.42Å; T495-R499 PolarHBondContact O-N 2.99Å; L496-R499 PolarHBondContact O-N 3.14Å; R499-E501 PolarHBondContact O-N 3.09Å; R499-I502 PolarHBondContact O-N 3.35Å; R499-F503 WeakPolarHBondContact O-CD2 3.22Å; R499-F503 PolarHBondContact O-N 3.33Å; R499-A524 HydrophobicContact CB-CB 3.83Å; R499-A524 PolarHBondContact NE-O 3.4Å; R499-A524 PolarHBondContact NH2-O 3.36Å; R499-T527 WeakPolarHBondContact CD-O 3.47Å; R499-T527 PolarHBondContact NE-O 3.49Å; R499-I535 HydrophobicContact CB-CD1 3.89Å; R499-I535 HydrophobicContact CG-CD1 3.78Å; R499-D627 IonicContact CZ-OD2 2.75Å; R499-D627 VanDerWaalsContact CZ-OD2 3.32Å; R499-D627 IonicContact NH1-OD1 3.7Å; R499-D627 IonicContact NH1-OD2 3.83Å; R499-D627 PolarHBondContact NH1-OD2 2.69Å; R499-D627 IonicContact NH2-OD1 3.18Å; R499-D627 IonicContact NH2-OD2 3.01Å; R499-D627 PolarHBondContact NH2-OD2 3.32Å
500	K	92.9	Very high	91.8	Very high	54 Å²	54	56.1 Å²	56.1	24%	0.235	28%	0.276	C	S	.	.	H	α-helix	trans	-58.4	-45.3	175.8	176.6	-168.3	172.6	-172.7	0	111.8	L496 Q497 E498 F503 E504 L521 A524	L496-K500 PolarHBondContact O-N 2.87Å; Q497-K500 WeakPolarHBondContact O-CB 3.18Å; Q497-K500 PolarHBondContact O-N 3.03Å; E498-K500 VanDerWaalsContact C-N 3.31Å; E498-K500 PolarHBondContact O-N 2.76Å; K500-F503 WeakPolarHBondContact O-CB 3.35Å; K500-F503 PolarHBondContact O-N 3.28Å; K500-E504 WeakPolarHBondContact O-CG 3.32Å; K500-E504 PolarHBondContact O-N 2.65Å; K500-L521 HydrophobicContact CD-CD1 4.45Å; K500-A524 HydrophobicContact CB-CB 3.95Å
501	E	93.6	Very high	91.9	Very high	51 Å²	51	57 Å²	57	24%	0.238	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-42.1	175.8	-70.4	171.7	-156.8	0	0	113	A326 G327 H329 Q497 E498 R499 E504 Q505	A326-E501 HydrophobicContact CB-CB 4.18Å; G327-E501 VanDerWaalsContact CA-OE2 3.32Å; G327-E501 WeakPolarHBondContact CA-OE2 3.42Å; G327-E501 PolarHBondContact N-OE2 3.26Å; H329-E501 IonicContact CE1-OE1 2.67Å; H329-E501 PolarHBondContact CE1-OE1 3.33Å; H329-E501 VanDerWaalsContact CE1-OE1 3.3Å; H329-E501 IonicContact CE1-OE2 2.87Å; H329-E501 PolarHBondContact CE1-OE2 3.37Å; H329-E501 VanDerWaalsContact CE1-OE2 3.3Å; H329-E501 IonicContact NE2-OE1 3.45Å; H329-E501 IonicContact NE2-OE2 3.32Å; Q497-E501 PolarHBondContact O-N 2.79Å; E498-E501 PolarHBondContact O-N 3.1Å; R499-E501 PolarHBondContact O-N 3.09Å; E501-E504 PolarHBondContact O-N 2.89Å; E501-Q505 PolarHBondContact O-N 3.35Å
502	I	94.3	Very high	91.9	Very high	16 Å²	16	58.3 Å²	58.3	8%	0.082	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-43.2	176.5	-65.4	160.3	0	0	0	109.9	A326 P494 E498 R499 Q505 H506 I535	A326-I502 HydrophobicContact CB-CB 4.31Å; A326-I502 HydrophobicContact CB-CG1 3.75Å; P494-I502 HydrophobicContact CB-CD1 3.82Å; P494-I502 HydrophobicContact CG-CD1 4.08Å; E498-I502 WeakPolarHBondContact O-CB 3.18Å; E498-I502 WeakPolarHBondContact O-CD1 3.41Å; E498-I502 WeakPolarHBondContact O-CG1 3.25Å; E498-I502 PolarHBondContact O-N 3.18Å; R499-I502 PolarHBondContact O-N 3.35Å; I502-Q505 PolarHBondContact O-N 3.27Å; I502-H506 PolarHBondContact O-CD2 3.39Å; I502-H506 PolarHBondContact O-N 3.4Å; I502-I535 HydrophobicContact CB-CD1 4.37Å; I502-I535 HydrophobicContact CB-CG2 4.44Å; I502-I535 HydrophobicContact CG2-CB 4.06Å; I502-I535 HydrophobicContact CG2-CD1 4.19Å; I502-I535 HydrophobicContact CG2-CG2 3.68Å
503	F	95	Very high	92	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.5	-52.8	170.1	-86.3	-68.6	0	0	0	111.1	R499 K500 Q505 H506 L507 L523 A524 T527 I535 I538	R499-F503 WeakPolarHBondContact O-CD2 3.22Å; R499-F503 PolarHBondContact O-N 3.33Å; K500-F503 WeakPolarHBondContact O-CB 3.35Å; K500-F503 PolarHBondContact O-N 3.28Å; F503-Q505 PolarHBondContact O-N 3.16Å; F503-H506 PolarHBondContact O-N 3.43Å; F503-L507 HydrophobicContact CB-CD1 4.15Å; F503-L507 WeakPolarHBondContact O-CB 3.24Å; F503-L507 WeakPolarHBondContact O-CD1 3.42Å; F503-L507 WeakPolarHBondContact O-CG 3.39Å; F503-L507 PolarHBondContact O-N 3.33Å; F503-L523 HydrophobicContact CD1-CB 3.97Å; F503-L523 HydrophobicContact CD1-CD1 3.92Å; F503-L523 HydrophobicContact CD2-CB 4.01Å; F503-L523 HydrophobicContact CE1-CB 3.73Å; F503-L523 HydrophobicContact CE1-CD1 3.91Å; F503-L523 HydrophobicContact CE1-CG 4.41Å; F503-L523 HydrophobicContact CE2-CB 3.8Å; F503-L523 HydrophobicContact CG-CB 4.13Å; F503-L523 HydrophobicContact CZ-CB 3.67Å; F503-A524 HydrophobicContact CD2-CB 4.34Å; F503-T527 WeakPolarHBondContact CE2-OG1 3.35Å; F503-T527 HydrophobicContact CZ-CG2 4.12Å; F503-I535 HydrophobicContact CD1-CG2 3.67Å; F503-I535 HydrophobicContact CD2-CD1 4.42Å; F503-I535 HydrophobicContact CD2-CG2 3.91Å; F503-I535 HydrophobicContact CE1-CG2 3.63Å; F503-I535 HydrophobicContact CE2-CB 4.44Å; F503-I535 HydrophobicContact CE2-CD1 4.06Å; F503-I535 HydrophobicContact CE2-CG1 3.87Å; F503-I535 HydrophobicContact CE2-CG2 3.84Å; F503-I535 HydrophobicContact CG-CG2 3.8Å; F503-I535 HydrophobicContact CZ-CB 4.25Å; F503-I535 HydrophobicContact CZ-CG1 3.96Å; F503-I535 HydrophobicContact CZ-CG2 3.7Å; F503-I538 HydrophobicContact CE1-CG2 4.28Å
504	E	93.1	Very high	92	Very high	37 Å²	37	56.3 Å²	56.3	17%	0.173	28%	0.276	C	S	.	.	H	α-helix	trans	-55.7	-38.1	178.7	-74.4	-172.7	-159.2	0	0	112.3	K500 E501 K508 S520	K500-E504 WeakPolarHBondContact O-CG 3.32Å; K500-E504 PolarHBondContact O-N 2.65Å; E501-E504 PolarHBondContact O-N 2.89Å; E504-K508 WeakPolarHBondContact O-CE 3.49Å; E504-K508 VanDerWaalsContact O-CG 3.24Å; E504-K508 WeakPolarHBondContact O-CG 3.35Å; E504-K508 PolarHBondContact O-N 3.44Å; E504-S520 PolarHBondContact OE1-OG 3.09Å; E504-S520 VanDerWaalsContact OE1-OG 3.1Å
505	Q	92.6	Very high	91.9	Very high	40 Å²	40	60.2 Å²	60.2	19%	0.187	30%	0.302	C	S	.	.	H	α-helix	trans	-68.2	-44.6	178.2	-171.9	64.8	-2.7	0	0	112.9	A326 E501 I502 F503	A326-Q505 HydrophobicContact CB-CB 4Å; A326-Q505 HydrophobicContact CB-CG 4.48Å; E501-Q505 PolarHBondContact O-N 3.35Å; I502-Q505 PolarHBondContact O-N 3.27Å; F503-Q505 PolarHBondContact O-N 3.16Å
506	H	92.6	Very high	91.9	Very high	64 Å²	64	57.8 Å²	57.8	30%	0.296	29%	0.289	S	S	.	.	H	α-helix	trans	-72.7	-34.3	176.8	-71.9	-63.9	0	0	0	112.9	I502 F503 K508 I509 C539	I502-H506 PolarHBondContact O-CD2 3.39Å; I502-H506 PolarHBondContact O-N 3.4Å; F503-H506 PolarHBondContact O-N 3.43Å; H506-K508 VanDerWaalsContact C-N 3.34Å; H506-K508 PolarHBondContact O-N 3.15Å; H506-I509 PolarHBondContact O-N 3.21Å; H506-C539 HydrophobicContact CB-CB 4.15Å
507	L	93.6	Very high	91.9	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-66.8	-30.4	179.2	-74.8	173.3	0	0	0	113	F503 I509 L510 L512 A516 F559	F503-L507 HydrophobicContact CB-CD1 4.15Å; F503-L507 WeakPolarHBondContact O-CB 3.24Å; F503-L507 WeakPolarHBondContact O-CD1 3.42Å; F503-L507 WeakPolarHBondContact O-CG 3.39Å; F503-L507 PolarHBondContact O-N 3.33Å; L507-I509 PolarHBondContact O-N 3.05Å; L507-I509 VanDerWaalsContact O-N 3.17Å; L507-L510 HydrophobicContact CD2-CD1 4.49Å; L507-L510 PolarHBondContact O-N 2.81Å; L507-L510 VanDerWaalsContact O-N 3.07Å; L507-L512 HydrophobicContact CB-CD1 4.04Å; L507-L512 HydrophobicContact CD2-CD1 3.96Å; L507-L512 HydrophobicContact CD2-CD2 4.05Å; L507-L512 HydrophobicContact CG-CD1 4.47Å; L507-A516 HydrophobicContact CB-CB 3.61Å; L507-A516 HydrophobicContact CD1-CB 4.17Å; L507-F559 HydrophobicContact CD2-CE1 3.61Å; L507-F559 HydrophobicContact CD2-CE2 4.29Å; L507-F559 HydrophobicContact CD2-CZ 3.35Å
508	K	90.4	Very high	91.9	Very high	137 Å²	137	63.3 Å²	63.3	60%	0.596	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.6	175	-76.9	161.1	-159.8	173.2	0	114	E504 H506	E504-K508 WeakPolarHBondContact O-CE 3.49Å; E504-K508 VanDerWaalsContact O-CG 3.24Å; E504-K508 WeakPolarHBondContact O-CG 3.35Å; E504-K508 PolarHBondContact O-N 3.44Å; H506-K508 VanDerWaalsContact C-N 3.34Å; H506-K508 PolarHBondContact O-N 3.15Å
509	I	90.6	Very high	91.8	Very high	143 Å²	143	62.3 Å²	62.3	73%	0.733	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-17.6	-176.8	-53.5	167.3	0	0	0	110.9	H506 L507	H506-I509 PolarHBondContact O-N 3.21Å; L507-I509 PolarHBondContact O-N 3.05Å; L507-I509 VanDerWaalsContact O-N 3.17Å
510	L	93.5	Very high	91.6	Very high	47 Å²	47	62.1 Å²	62.1	25%	0.246	30%	0.304	C	S	.	.	S	Bend	trans	-97.3	152.5	-171.7	-62.3	-179.1	0	0	0	112.6	L507 L512 C539 A543 I554	L507-L510 HydrophobicContact CD2-CD1 4.49Å; L507-L510 PolarHBondContact O-N 2.81Å; L507-L510 VanDerWaalsContact O-N 3.07Å; L510-L512 HydrophobicContact CB-CD2 3.83Å; L510-L512 HydrophobicContact CB-CG 4.43Å; L510-L512 PolarHBondContact O-N 3.39Å; L510-C539 HydrophobicContact CD1-CB 3.99Å; L510-C539 WeakPolarHBondContact CD1-O 3.18Å; L510-A543 HydrophobicContact CD2-CB 4.08Å; L510-I554 HydrophobicContact CB-CD1 4Å; L510-I554 HydrophobicContact CD1-CD1 3.9Å; L510-I554 HydrophobicContact CD2-CD1 4.33Å; L510-I554 HydrophobicContact CG-CD1 4.3Å
511	K	93.9	Very high	91.3	Very high	145 Å²	145	62.3 Å²	62.3	63%	0.63	31%	0.307	S	S	*	.			trans	-89.1	94.9	176	-170.9	-177.6	176.1	-156.9	0	110.6	K552 S553 I554	K511-K552 WeakPolarHBondContact CD-O 3.31Å; K511-K552 WeakPolarHBondContact CE-O 3.45Å; K511-K552 PolarHBondContact NZ-O 3.12Å; K511-S553 CarbonylContact O-C 3.59Å; K511-S553 WeakPolarHBondContact O-CA 3.34Å; K511-I554 PolarHBondContact O-N 3.31Å
512	L	93.2	Very high	90.9	Very high	33 Å²	33	65.9 Å²	65.9	17%	0.173	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-94.5	159.8	-175.3	-50.5	-178.3	0	0	0	112.5	L507 L510 Q514 A516 Y519 I554 F559	L507-L512 HydrophobicContact CB-CD1 4.04Å; L507-L512 HydrophobicContact CD2-CD1 3.96Å; L507-L512 HydrophobicContact CD2-CD2 4.05Å; L507-L512 HydrophobicContact CG-CD1 4.47Å; L510-L512 HydrophobicContact CB-CD2 3.83Å; L510-L512 HydrophobicContact CB-CG 4.43Å; L510-L512 PolarHBondContact O-N 3.39Å; L512-Q514 WeakPolarHBondContact CB-O 3.39Å; L512-A516 HydrophobicContact CD1-CB 4.1Å; L512-Y519 HydrophobicContact CB-CE2 4.17Å; L512-Y519 HydrophobicContact CD1-CD2 4.12Å; L512-Y519 HydrophobicContact CD1-CE2 4.3Å; L512-I554 HydrophobicContact CD2-CB 4.06Å; L512-I554 HydrophobicContact CD2-CD1 4.33Å; L512-F559 HydrophobicContact CD2-CE2 4.1Å; L512-F559 HydrophobicContact CD2-CZ 3.71Å
513	T	92.4	Very high	90.6	Very high	78 Å²	78	65.4 Å²	65.4	48%	0.479	32%	0.316	S	S	.	.	S	Bend	trans	-80.4	-37.8	171.2	-58.6	0	0	0	0	111.8	S553 I554	T513-S553 WeakPolarHBondContact OG1-CB 3.26Å; T513-S553 PolarHBondContact OG1-OG 2.91Å; T513-I554 PolarHBondContact N-O 2.8Å; T513-I554 PolarHBondContact OG1-O 3.35Å
514	Q	91	Very high	90.3	Very high	75 Å²	75	65.4 Å²	65.4	35%	0.35	32%	0.316	S	S	.	.	S	Bend	trans	-116.8	162.2	176.1	-61.9	-161.6	43.1	0	0	111.2	L512 F518 Y519	L512-Q514 WeakPolarHBondContact CB-O 3.39Å; Q514-F518 HydrophobicContact CB-CB 4.26Å; Q514-F518 HydrophobicContact CB-CD1 3.99Å; Q514-F518 HydrophobicContact CB-CG 4.24Å; Q514-F518 HydrophobicContact CG-CD1 4.37Å; Q514-F518 VanDerWaalsContact OE1-CG 3.32Å; Q514-Y519 HydrophobicContact CB-CE2 3.7Å; Q514-Y519 PolarHBondContact N-OH 3.25Å; Q514-Y519 WeakPolarHBondContact O-CE2 3.38Å
515	P	89.1	Confident	89.8	Confident	96 Å²	96	65.7 Å²	65.7	62%	0.623	32%	0.317	S	S	*	.			trans	-59.2	146	176.7	23.8	-35.7	0	0	0	112.4	K517 F518	P515-K517 PolarHBondContact O-N 3.18Å; P515-F518 VanDerWaalsContact O-CB 3.32Å; P515-F518 WeakPolarHBondContact O-CB 3.49Å; P515-F518 PolarHBondContact O-N 3Å
516	A	88.2	Confident	89.3	Confident	21 Å²	21	64.8 Å²	64.8	17%	0.174	31%	0.314	C	S	.	.	H	α-helix	trans	-50.1	-37.3	-176.7	0	0	0	0	0	114.3	L507 L512 F518 Y519 S520	L507-A516 HydrophobicContact CB-CB 3.61Å; L507-A516 HydrophobicContact CD1-CB 4.17Å; L512-A516 HydrophobicContact CD1-CB 4.1Å; A516-F518 PolarHBondContact O-N 3.01Å; A516-Y519 PolarHBondContact O-N 2.99Å; A516-S520 PolarHBondContact O-N 3.46Å
517	K	87.8	Confident	89.1	Confident	152 Å²	152	61.8 Å²	61.8	66%	0.661	30%	0.3	S	S	*	.	H	α-helix	trans	-59.7	-29	178.2	-66	-165.7	169.9	-171.4	0	114.2	P515 S520	P515-K517 PolarHBondContact O-N 3.18Å; K517-S520 PolarHBondContact O-OG 3.03Å
518	F	88.2	Confident	88.7	Confident	109 Å²	109	62.8 Å²	62.8	48%	0.478	31%	0.306	S	S	.	.	H	α-helix	trans	-66.9	-41	177.5	175.7	-95.9	0	0	0	111.5	Q514 P515 A516	Q514-F518 HydrophobicContact CB-CB 4.26Å; Q514-F518 HydrophobicContact CB-CD1 3.99Å; Q514-F518 HydrophobicContact CB-CG 4.24Å; Q514-F518 HydrophobicContact CG-CD1 4.37Å; Q514-F518 VanDerWaalsContact OE1-CG 3.32Å; P515-F518 VanDerWaalsContact O-CB 3.32Å; P515-F518 WeakPolarHBondContact O-CB 3.49Å; P515-F518 PolarHBondContact O-N 3Å; A516-F518 PolarHBondContact O-N 3.01Å
519	Y	88.9	Confident	88.4	Confident	6 Å²	6	58.1 Å²	58.1	2%	0.024	30%	0.298	C	S	.	.	H	α-helix	trans	-83.1	-33.2	-179.6	-57.3	-71.4	0	0	0	112.7	L512 Q514 A516 L521 R522 L523 D555 T556 F559	L512-Y519 HydrophobicContact CB-CE2 4.17Å; L512-Y519 HydrophobicContact CD1-CD2 4.12Å; L512-Y519 HydrophobicContact CD1-CE2 4.3Å; Q514-Y519 HydrophobicContact CB-CE2 3.7Å; Q514-Y519 PolarHBondContact N-OH 3.25Å; Q514-Y519 WeakPolarHBondContact O-CE2 3.38Å; A516-Y519 PolarHBondContact O-N 2.99Å; Y519-L521 PolarHBondContact O-N 3.42Å; Y519-R522 PolarHBondContact O-N 2.75Å; Y519-L523 WeakPolarHBondContact O-CB 3.22Å; Y519-L523 VanDerWaalsContact O-CG 3.27Å; Y519-L523 WeakPolarHBondContact O-CG 3.41Å; Y519-L523 PolarHBondContact O-N 3.3Å; Y519-D555 PolarHBondContact OH-OD1 3.21Å; Y519-T556 WeakPolarHBondContact CE1-OG1 3.49Å; Y519-F559 HydrophobicContact CD1-CD2 4.17Å; Y519-F559 HydrophobicContact CD1-CE2 4.32Å; Y519-F559 HydrophobicContact CD2-CE2 4.34Å; Y519-F559 HydrophobicContact CE1-CD2 4.47Å; Y519-F559 HydrophobicContact CG-CD2 4.43Å; Y519-F559 HydrophobicContact CG-CE2 4.22Å
520	S	89.4	Confident	88.4	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57	-44.2	-167	62.8	0	0	0	0	114.6	E504 A516 K517 A524	E504-S520 PolarHBondContact OE1-OG 3.09Å; E504-S520 VanDerWaalsContact OE1-OG 3.1Å; A516-S520 PolarHBondContact O-N 3.46Å; K517-S520 PolarHBondContact O-OG 3.03Å; S520-A524 WeakPolarHBondContact O-CB 3.36Å; S520-A524 PolarHBondContact O-N 3.47Å
521	L	86.3	Confident	88.4	Confident	57 Å²	57	51 Å²	51	30%	0.298	26%	0.26	S	S	.	.	H	α-helix	trans	-65.2	-54.9	-179	-177.6	64.1	0	0	0	111.8	L496 K500 Y519 L523 A524 E525 P773	L496-L521 HydrophobicContact CD2-CD1 4.31Å; K500-L521 HydrophobicContact CD-CD1 4.45Å; Y519-L521 PolarHBondContact O-N 3.42Å; L521-L523 VanDerWaalsContact C-N 3.25Å; L521-L523 PolarHBondContact O-N 3.3Å; L521-A524 WeakPolarHBondContact O-CB 3.31Å; L521-A524 PolarHBondContact O-N 3.05Å; L521-A524 VanDerWaalsContact O-N 3.1Å; L521-E525 WeakPolarHBondContact CG-OE1 3.38Å; L521-E525 WeakPolarHBondContact O-CG 3.4Å; L521-E525 PolarHBondContact O-N 3.03Å; L521-P773 HydrophobicContact CD1-CG 4.24Å; L521-P773 HydrophobicContact CD2-CG 4.32Å
522	R	84.3	Confident	88.4	Confident	126 Å²	126	44.8 Å²	44.8	48%	0.475	24%	0.237	S	C	.	.	H	α-helix	trans	-59.9	-35	179.8	-176.3	175.4	174.3	174.9	0.4	112.2	Y519 L526 E560	Y519-R522 PolarHBondContact O-N 2.75Å; R522-L526 HydrophobicContact CG-CD1 4.15Å; R522-L526 WeakPolarHBondContact O-CB 3.45Å; R522-L526 VanDerWaalsContact O-CG 3.24Å; R522-L526 WeakPolarHBondContact O-CG 3.22Å; R522-L526 PolarHBondContact O-N 3.21Å; R522-L526 VanDerWaalsContact O-N 3.08Å; R522-E560 IonicContact CZ-OE1 2.72Å; R522-E560 VanDerWaalsContact CZ-OE1 3.31Å; R522-E560 IonicContact NE-OE1 3.88Å; R522-E560 IonicContact NH1-OE1 2.67Å; R522-E560 IonicContact NH2-OE1 2.75Å; R522-E560 PolarHBondContact NH2-OE1 3.4Å
523	L	88.4	Confident	88.3	Confident	7 Å²	7	45.5 Å²	45.5	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-73.9	-36.6	176.6	-64.3	177.6	0	0	0	112.6	F503 Y519 L521 E525 L526 T527 F559 V563	F503-L523 HydrophobicContact CD1-CB 3.97Å; F503-L523 HydrophobicContact CD1-CD1 3.92Å; F503-L523 HydrophobicContact CD2-CB 4.01Å; F503-L523 HydrophobicContact CE1-CB 3.73Å; F503-L523 HydrophobicContact CE1-CD1 3.91Å; F503-L523 HydrophobicContact CE1-CG 4.41Å; F503-L523 HydrophobicContact CE2-CB 3.8Å; F503-L523 HydrophobicContact CG-CB 4.13Å; F503-L523 HydrophobicContact CZ-CB 3.67Å; Y519-L523 WeakPolarHBondContact O-CB 3.22Å; Y519-L523 VanDerWaalsContact O-CG 3.27Å; Y519-L523 WeakPolarHBondContact O-CG 3.41Å; Y519-L523 PolarHBondContact O-N 3.3Å; L521-L523 VanDerWaalsContact C-N 3.25Å; L521-L523 PolarHBondContact O-N 3.3Å; L523-E525 VanDerWaalsContact C-N 3.32Å; L523-L526 PolarHBondContact O-N 3.04Å; L523-T527 WeakPolarHBondContact O-CB 3.39Å; L523-T527 WeakPolarHBondContact O-CG2 3.43Å; L523-T527 PolarHBondContact O-N 3.39Å; L523-T527 PolarHBondContact O-OG1 3.39Å; L523-F559 HydrophobicContact CD1-CB 4.07Å; L523-F559 HydrophobicContact CD1-CD1 3.83Å; L523-F559 HydrophobicContact CD1-CD2 4.42Å; L523-F559 HydrophobicContact CD1-CE1 4.37Å; L523-F559 HydrophobicContact CD1-CG 3.87Å; L523-F559 HydrophobicContact CD2-CB 3.67Å; L523-F559 HydrophobicContact CD2-CG 4.39Å; L523-F559 HydrophobicContact CG-CB 4.5Å; L523-V563 HydrophobicContact CD2-CG2 4.32Å
524	A	88	Confident	88.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-34.4	174.1	0	0	0	0	0	112.8	R499 K500 F503 S520 L521	R499-A524 HydrophobicContact CB-CB 3.83Å; R499-A524 PolarHBondContact NE-O 3.4Å; R499-A524 PolarHBondContact NH2-O 3.36Å; K500-A524 HydrophobicContact CB-CB 3.95Å; F503-A524 HydrophobicContact CD2-CB 4.34Å; S520-A524 WeakPolarHBondContact O-CB 3.36Å; S520-A524 PolarHBondContact O-N 3.47Å; L521-A524 WeakPolarHBondContact O-CB 3.31Å; L521-A524 PolarHBondContact O-N 3.05Å; L521-A524 VanDerWaalsContact O-N 3.1Å
525	E	83.1	Confident	88.6	Confident	42 Å²	42	41.1 Å²	41.1	20%	0.196	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-45.6	171	-72.6	165.4	-169.5	0	0	111.7	L496 L521 L523 T527 P528 L624	L496-E525 HydrophobicContact CD1-CG 4.15Å; L521-E525 WeakPolarHBondContact CG-OE1 3.38Å; L521-E525 WeakPolarHBondContact O-CG 3.4Å; L521-E525 PolarHBondContact O-N 3.03Å; L523-E525 VanDerWaalsContact C-N 3.32Å; E525-T527 PolarHBondContact O-N 3.26Å; E525-P528 WeakPolarHBondContact O-CD 3.25Å; E525-L624 WeakPolarHBondContact O-CD1 3.45Å
526	L	83.1	Confident	88.8	Confident	22 Å²	22	38 Å²	38	12%	0.115	21%	0.206	C	C	.	.	S	Bend	trans	-73	-4.9	-179.4	-71.4	172.5	0	0	0	114.9	R522 L523 V563 L624	R522-L526 HydrophobicContact CG-CD1 4.15Å; R522-L526 WeakPolarHBondContact O-CB 3.45Å; R522-L526 VanDerWaalsContact O-CG 3.24Å; R522-L526 WeakPolarHBondContact O-CG 3.22Å; R522-L526 PolarHBondContact O-N 3.21Å; R522-L526 VanDerWaalsContact O-N 3.08Å; L523-L526 PolarHBondContact O-N 3.04Å; L526-V563 HydrophobicContact CB-CG1 4.47Å; L526-L624 HydrophobicContact CD2-CD1 4.26Å
527	T	87.9	Confident	89.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.215	C	C	.	.			trans	-127.1	48.9	-175.6	56	0	0	0	0	114.4	R499 F503 L523 E525 G529 F530 I538 V563	R499-T527 WeakPolarHBondContact CD-O 3.47Å; R499-T527 PolarHBondContact NE-O 3.49Å; F503-T527 WeakPolarHBondContact CE2-OG1 3.35Å; F503-T527 HydrophobicContact CZ-CG2 4.12Å; L523-T527 WeakPolarHBondContact O-CB 3.39Å; L523-T527 WeakPolarHBondContact O-CG2 3.43Å; L523-T527 PolarHBondContact O-N 3.39Å; L523-T527 PolarHBondContact O-OG1 3.39Å; E525-T527 PolarHBondContact O-N 3.26Å; T527-G529 PolarHBondContact O-N 2.83Å; T527-F530 HydrophobicContact CG2-CD2 4.1Å; T527-F530 HydrophobicContact CG2-CE2 4.34Å; T527-F530 HydrophobicContact CG2-CG 4.3Å; T527-F530 WeakPolarHBondContact O-CB 3.36Å; T527-F530 PolarHBondContact O-N 3.45Å; T527-I538 HydrophobicContact CG2-CD1 3.51Å; T527-V563 HydrophobicContact CG2-CG1 4.34Å; T527-V563 HydrophobicContact CG2-CG2 4.07Å
528	P	84.8	Confident	89.5	Confident	22 Å²	22	33 Å²	33	14%	0.143	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	134.9	178.1	29.7	-34.9	0	0	0	111.2	E525 F530 P625 D627	E525-P528 WeakPolarHBondContact O-CD 3.25Å; P528-F530 VanDerWaalsContact C-N 3.29Å; P528-F530 WeakPolarHBondContact O-CD1 3.37Å; P528-F530 PolarHBondContact O-N 3.07Å; P528-P625 HydrophobicContact CB-CG 4.28Å; P528-P625 HydrophobicContact CG-CG 3.48Å; P528-P625 VanDerWaalsContact CG-CG 3.48Å; P528-D627 WeakPolarHBondContact CB-OD1 3.34Å
529	G	84.6	Confident	89.8	Confident	40 Å²	40	28 Å²	28	41%	0.412	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	10.1	-178.2	0	0	0	0	0	116.3	T527	T527-G529 PolarHBondContact O-N 2.83Å
530	F	90.3	Very high	90.1	Very high	34 Å²	34	31.7 Å²	31.7	15%	0.149	18%	0.182	C	C	.	.			trans	-79.8	141	177.7	-83.2	48.4	0	0	0	111.6	P494 T527 P528 D534 I535 I538 V566 I567	P494-F530 WeakPolarHBondContact CD-O 3.45Å; P494-F530 WeakPolarHBondContact CG-O 3.33Å; T527-F530 HydrophobicContact CG2-CD2 4.1Å; T527-F530 HydrophobicContact CG2-CE2 4.34Å; T527-F530 HydrophobicContact CG2-CG 4.3Å; T527-F530 WeakPolarHBondContact O-CB 3.36Å; T527-F530 PolarHBondContact O-N 3.45Å; P528-F530 VanDerWaalsContact C-N 3.29Å; P528-F530 WeakPolarHBondContact O-CD1 3.37Å; P528-F530 PolarHBondContact O-N 3.07Å; F530-D534 HydrophobicContact CB-CB 4.15Å; F530-D534 HydrophobicContact CD2-CB 3.57Å; F530-D534 HydrophobicContact CE2-CB 4.3Å; F530-D534 HydrophobicContact CG-CB 4.2Å; F530-I535 HydrophobicContact CB-CG1 4.31Å; F530-I538 HydrophobicContact CD2-CD1 3.66Å; F530-I538 HydrophobicContact CE2-CD1 3.67Å; F530-V566 HydrophobicContact CE2-CB 4.5Å; F530-V566 HydrophobicContact CE2-CG1 3.75Å; F530-V566 HydrophobicContact CZ-CG1 4.4Å; F530-I567 HydrophobicContact CE1-CG1 4.38Å; F530-I567 HydrophobicContact CZ-CD1 4.35Å; F530-I567 HydrophobicContact CZ-CG1 3.68Å
531	S	93.7	Very high	90.4	Very high	6 Å²	6	33.2 Å²	33.2	4%	0.042	19%	0.19	C	C	.	.			trans	-77.5	164.4	173.1	77.6	0	0	0	0	111.7	A533 D534 I535	S531-A533 PolarHBondContact O-N 2.9Å; S531-A533 PolarHBondContact OG-N 2.88Å; S531-D534 VanDerWaalsContact CB-OD2 3.24Å; S531-D534 WeakPolarHBondContact CB-OD2 3.32Å; S531-D534 PolarHBondContact N-OD2 3.46Å; S531-D534 PolarHBondContact O-N 3.47Å; S531-D534 VanDerWaalsContact OG-CG 3.28Å; S531-D534 PolarHBondContact OG-N 2.88Å; S531-D534 PolarHBondContact OG-OD2 3.27Å; S531-I535 PolarHBondContact O-N 2.84Å
532	G	92.8	Very high	90.8	Very high	15 Å²	15	30.5 Å²	30.5	16%	0.155	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-33.4	174.6	0	0	0	0	0	113.4	I535 A536	G532-I535 PolarHBondContact O-N 3.29Å; G532-A536 WeakPolarHBondContact O-CB 3.17Å; G532-A536 PolarHBondContact O-N 3.02Å
533	A	93	Very high	91.3	Very high	48 Å²	48	25.7 Å²	25.7	40%	0.397	16%	0.163	S	C	.	.	H	α-helix	trans	-68.6	-36	174	0	0	0	0	0	113	G366 S531 A536 N537	G366-A533 PolarHBondContact O-N 3.23Å; S531-A533 PolarHBondContact O-N 2.9Å; S531-A533 PolarHBondContact OG-N 2.88Å; A533-A536 PolarHBondContact O-N 3.19Å; A533-N537 WeakPolarHBondContact O-CB 3.44Å; A533-N537 PolarHBondContact O-N 3.44Å
534	D	93.9	Very high	91.6	Very high	60 Å²	60	28.9 Å²	28.9	32%	0.321	18%	0.179	S	C	.	.	H	α-helix	trans	-68.5	-39.3	176	-56.2	-56.3	0	0	0	110.9	F530 S531 N537 I538	F530-D534 HydrophobicContact CB-CB 4.15Å; F530-D534 HydrophobicContact CD2-CB 3.57Å; F530-D534 HydrophobicContact CE2-CB 4.3Å; F530-D534 HydrophobicContact CG-CB 4.2Å; S531-D534 VanDerWaalsContact CB-OD2 3.24Å; S531-D534 WeakPolarHBondContact CB-OD2 3.32Å; S531-D534 PolarHBondContact N-OD2 3.46Å; S531-D534 PolarHBondContact O-N 3.47Å; S531-D534 VanDerWaalsContact OG-CG 3.28Å; S531-D534 PolarHBondContact OG-N 2.88Å; S531-D534 PolarHBondContact OG-OD2 3.27Å; D534-N537 WeakPolarHBondContact O-CB 3.44Å; D534-N537 PolarHBondContact O-N 2.87Å; D534-I538 WeakPolarHBondContact O-CG1 3.5Å; D534-I538 PolarHBondContact O-N 3.37Å
535	I	94.8	Very high	91.9	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-46.1	173.5	-68	170.1	0	0	0	111.1	R499 I502 F503 F530 S531 G532 N537 I538 C539	R499-I535 HydrophobicContact CB-CD1 3.89Å; R499-I535 HydrophobicContact CG-CD1 3.78Å; I502-I535 HydrophobicContact CB-CD1 4.37Å; I502-I535 HydrophobicContact CB-CG2 4.44Å; I502-I535 HydrophobicContact CG2-CB 4.06Å; I502-I535 HydrophobicContact CG2-CD1 4.19Å; I502-I535 HydrophobicContact CG2-CG2 3.68Å; F503-I535 HydrophobicContact CD1-CG2 3.67Å; F503-I535 HydrophobicContact CD2-CD1 4.42Å; F503-I535 HydrophobicContact CD2-CG2 3.91Å; F503-I535 HydrophobicContact CE1-CG2 3.63Å; F503-I535 HydrophobicContact CE2-CB 4.44Å; F503-I535 HydrophobicContact CE2-CD1 4.06Å; F503-I535 HydrophobicContact CE2-CG1 3.87Å; F503-I535 HydrophobicContact CE2-CG2 3.84Å; F503-I535 HydrophobicContact CG-CG2 3.8Å; F503-I535 HydrophobicContact CZ-CB 4.25Å; F503-I535 HydrophobicContact CZ-CG1 3.96Å; F503-I535 HydrophobicContact CZ-CG2 3.7Å; F530-I535 HydrophobicContact CB-CG1 4.31Å; S531-I535 PolarHBondContact O-N 2.84Å; G532-I535 PolarHBondContact O-N 3.29Å; I535-N537 VanDerWaalsContact C-N 3.26Å; I535-N537 PolarHBondContact O-N 3.39Å; I535-I538 PolarHBondContact O-N 3.11Å; I535-C539 PolarHBondContact O-N 3.11Å
536	A	93.7	Very high	92.5	Very high	31 Å²	31	28.2 Å²	28.2	26%	0.256	18%	0.177	S	C	.	.	H	α-helix	trans	-58.9	-39.1	174.1	0	0	0	0	0	111.8	G532 A533 C539 N540	G532-A536 WeakPolarHBondContact O-CB 3.17Å; G532-A536 PolarHBondContact O-N 3.02Å; A533-A536 PolarHBondContact O-N 3.19Å; A536-C539 PolarHBondContact O-N 2.87Å; A536-N540 WeakPolarHBondContact O-CB 3.38Å; A536-N540 PolarHBondContact O-N 2.67Å
537	N	94.9	Very high	93.1	Very high	67 Å²	67	30.7 Å²	30.7	36%	0.358	20%	0.201	S	C	.	.	H	α-helix	trans	-66.8	-41.3	176.6	-170.6	39.7	0	0	0	112.5	A533 D534 I535 N540 E541	A533-N537 WeakPolarHBondContact O-CB 3.44Å; A533-N537 PolarHBondContact O-N 3.44Å; D534-N537 WeakPolarHBondContact O-CB 3.44Å; D534-N537 PolarHBondContact O-N 2.87Å; I535-N537 VanDerWaalsContact C-N 3.26Å; I535-N537 PolarHBondContact O-N 3.39Å; N537-N540 PolarHBondContact O-N 3.43Å; N537-E541 WeakPolarHBondContact O-CB 3.47Å; N537-E541 WeakPolarHBondContact O-CG 3.48Å; N537-E541 PolarHBondContact O-N 2.75Å
538	I	95.2	Very high	93.3	Very high	0 Å²	0	37 Å²	37	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.9	-48.6	173.8	-70.6	164.3	0	0	0	110.8	F503 T527 F530 D534 I535 N540 E541 A542 A562 V563 V566	F503-I538 HydrophobicContact CE1-CG2 4.28Å; T527-I538 HydrophobicContact CG2-CD1 3.51Å; F530-I538 HydrophobicContact CD2-CD1 3.66Å; F530-I538 HydrophobicContact CE2-CD1 3.67Å; D534-I538 WeakPolarHBondContact O-CG1 3.5Å; D534-I538 PolarHBondContact O-N 3.37Å; I535-I538 PolarHBondContact O-N 3.11Å; I538-N540 VanDerWaalsContact C-N 3.28Å; I538-N540 PolarHBondContact O-N 2.76Å; I538-E541 PolarHBondContact O-N 3.16Å; I538-A542 WeakPolarHBondContact O-CB 3.27Å; I538-A542 PolarHBondContact O-N 3.15Å; I538-A562 HydrophobicContact CG2-CB 4.03Å; I538-A562 WeakPolarHBondContact O-CB 3.46Å; I538-V563 HydrophobicContact CD1-CG2 4.13Å; I538-V563 HydrophobicContact CG2-CG2 3.85Å; I538-V566 HydrophobicContact CG1-CB 4.22Å; I538-V566 HydrophobicContact CG1-CG2 3.86Å
539	C	95.4	Very high	93.7	Very high	4 Å²	4	41 Å²	41	3%	0.027	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-40.9	177.7	-73.7	0	0	0	0	112	H506 L510 I535 A536 A543	H506-C539 HydrophobicContact CB-CB 4.15Å; L510-C539 HydrophobicContact CD1-CB 3.99Å; L510-C539 WeakPolarHBondContact CD1-O 3.18Å; I535-C539 PolarHBondContact O-N 3.11Å; A536-C539 PolarHBondContact O-N 2.87Å; C539-A543 PolarHBondContact O-N 3.33Å
540	N	95.5	Very high	94.1	Very high	84 Å²	84	42 Å²	42	45%	0.449	25%	0.252	S	S	.	.	H	α-helix	trans	-69.8	-45.1	176.5	-178	63	0	0	0	112.8	A536 N537 I538 A542 A543 L544	A536-N540 WeakPolarHBondContact O-CB 3.38Å; A536-N540 PolarHBondContact O-N 2.67Å; N537-N540 PolarHBondContact O-N 3.43Å; I538-N540 VanDerWaalsContact C-N 3.28Å; I538-N540 PolarHBondContact O-N 2.76Å; N540-A542 VanDerWaalsContact C-N 3.31Å; N540-A542 PolarHBondContact O-N 3.02Å; N540-A543 WeakPolarHBondContact O-CB 3.27Å; N540-A543 PolarHBondContact O-N 2.98Å; N540-L544 WeakPolarHBondContact O-CG 3.48Å; N540-L544 PolarHBondContact O-N 2.91Å
541	E	94.8	Very high	94.2	Very high	32 Å²	32	45.2 Å²	45.2	15%	0.15	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-33	177.8	-75.8	-68.4	141.9	0	0	112.2	N537 I538 L544 H545 A562 R565	N537-E541 WeakPolarHBondContact O-CB 3.47Å; N537-E541 WeakPolarHBondContact O-CG 3.48Å; N537-E541 PolarHBondContact O-N 2.75Å; I538-E541 PolarHBondContact O-N 3.16Å; E541-L544 PolarHBondContact O-N 3.02Å; E541-H545 WeakPolarHBondContact O-CB 3.32Å; E541-H545 PolarHBondContact O-N 3Å; E541-A562 HydrophobicContact CB-CB 4Å; E541-R565 WeakPolarHBondContact OE2-CD 3.3Å; E541-R565 IonicContact OE2-CZ 3.84Å; E541-R565 IonicContact OE2-NE 3.75Å; E541-R565 PolarHBondContact OE2-NE 3.12Å; E541-R565 IonicContact OE2-NH2 3.74Å; E541-R565 PolarHBondContact OE2-NH2 3.28Å
542	A	95.4	Very high	94.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-41.3	172.2	0	0	0	0	0	111.7	I538 N540 H545 A546 I554 N558 F559 A562	I538-A542 WeakPolarHBondContact O-CB 3.27Å; I538-A542 PolarHBondContact O-N 3.15Å; N540-A542 VanDerWaalsContact C-N 3.31Å; N540-A542 PolarHBondContact O-N 3.02Å; A542-H545 PolarHBondContact O-N 3.19Å; A542-A546 WeakPolarHBondContact O-CB 3.46Å; A542-A546 PolarHBondContact O-N 2.95Å; A542-I554 HydrophobicContact CB-CG2 4.14Å; A542-N558 HydrophobicContact CB-CB 4.41Å; A542-F559 HydrophobicContact CB-CD1 3.4Å; A542-F559 VanDerWaalsContact CB-CD1 3.4Å; A542-F559 HydrophobicContact CB-CE1 3.64Å; A542-F559 HydrophobicContact CB-CG 4.05Å; A542-F559 HydrophobicContact CB-CZ 4.46Å; A542-A562 HydrophobicContact CB-CB 3.83Å
543	A	95.1	Very high	94.2	Very high	25 Å²	25	54.9 Å²	54.9	21%	0.207	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-41.8	174.3	0	0	0	0	0	112.3	L510 C539 N540 A546 A547 I554	L510-A543 HydrophobicContact CD2-CB 4.08Å; C539-A543 PolarHBondContact O-N 3.33Å; N540-A543 WeakPolarHBondContact O-CB 3.27Å; N540-A543 PolarHBondContact O-N 2.98Å; A543-A546 PolarHBondContact O-N 3.48Å; A543-A547 WeakPolarHBondContact O-CB 3.49Å; A543-A547 PolarHBondContact O-N 2.85Å; A543-I554 HydrophobicContact CB-CD1 3.62Å
544	L	94.4	Very high	94.3	Very high	75 Å²	75	53 Å²	53	39%	0.393	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-34.8	176.1	-70.3	174.9	0	0	0	112.6	N540 E541 R548	N540-L544 WeakPolarHBondContact O-CG 3.48Å; N540-L544 PolarHBondContact O-N 2.91Å; E541-L544 PolarHBondContact O-N 3.02Å; L544-R548 WeakPolarHBondContact O-CB 3.34Å; L544-R548 PolarHBondContact O-N 3.24Å
545	H	94	Very high	94.1	Very high	22 Å²	22	52.2 Å²	52.2	10%	0.102	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-51	171.4	-176.3	-97.5	0	0	0	110.8	E541 A542 A547 R548 E549 N558 Y561	E541-H545 WeakPolarHBondContact O-CB 3.32Å; E541-H545 PolarHBondContact O-N 3Å; A542-H545 PolarHBondContact O-N 3.19Å; H545-A547 VanDerWaalsContact C-N 3.29Å; H545-A547 PolarHBondContact O-N 3.44Å; H545-R548 PolarHBondContact O-N 3.36Å; H545-R548 VanDerWaalsContact O-N 3.07Å; H545-E549 PolarHBondContact O-N 2.98Å; H545-E549 VanDerWaalsContact O-N 3.1Å; H545-N558 PolarHBondContact ND1-OD1 3.02Å; H545-Y561 HydrophobicContact CB-CD1 3.8Å; H545-Y561 HydrophobicContact CB-CE1 4.04Å; H545-Y561 AromaticContact CD2-CD1 3.22Å; H545-Y561 WeakPolarHBondContact CD2-CD1 3.4Å; H545-Y561 AromaticContact CD2-CD2 3.97Å; H545-Y561 AromaticContact CD2-CE1 3.22Å; H545-Y561 WeakPolarHBondContact CD2-CE1 3.48Å; H545-Y561 AromaticContact CD2-CE2 3.96Å; H545-Y561 AromaticContact CD2-CG 3.62Å; H545-Y561 AromaticContact CD2-CZ 3.6Å; H545-Y561 AromaticContact CG-CD1 3.48Å; H545-Y561 VanDerWaalsContact CG-CD1 3.48Å; H545-Y561 AromaticContact CG-CE1 3.82Å; H545-Y561 AromaticContact NE2-CD1 3.87Å; H545-Y561 AromaticContact NE2-CD2 3.83Å; H545-Y561 AromaticContact NE2-CG 3.75Å
546	A	95.2	Very high	93.8	Very high	5 Å²	5	53.6 Å²	53.6	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-57	-43	179	0	0	0	0	0	112.1	A542 A543 G550 F551 I554	A542-A546 WeakPolarHBondContact O-CB 3.46Å; A542-A546 PolarHBondContact O-N 2.95Å; A543-A546 PolarHBondContact O-N 3.48Å; A546-G550 PolarHBondContact O-N 3.06Å; A546-G550 VanDerWaalsContact O-N 3.17Å; A546-F551 HydrophobicContact CB-CB 4.34Å; A546-F551 PolarHBondContact O-N 3.25Å; A546-I554 HydrophobicContact CB-CG1 3.97Å
547	A	94.8	Very high	93.5	Very high	75 Å²	75	56.1 Å²	56.1	62%	0.62	30%	0.301	S	S	*	.	H	α-helix	trans	-66.9	-35.4	176.6	0	0	0	0	0	113.5	A543 H545 G550	A543-A547 WeakPolarHBondContact O-CB 3.49Å; A543-A547 PolarHBondContact O-N 2.85Å; H545-A547 VanDerWaalsContact C-N 3.29Å; H545-A547 PolarHBondContact O-N 3.44Å; A547-G550 PolarHBondContact O-N 3.07Å
548	R	93.6	Very high	93.4	Very high	133 Å²	133	53 Å²	53	50%	0.502	28%	0.284	S	S	.	.	H	α-helix	trans	-68.3	-42.5	179.3	-175.5	-175	-58.8	133.4	9.2	112.3	L544 H545 G550	L544-R548 WeakPolarHBondContact O-CB 3.34Å; L544-R548 PolarHBondContact O-N 3.24Å; H545-R548 PolarHBondContact O-N 3.36Å; H545-R548 VanDerWaalsContact O-N 3.07Å; R548-G550 VanDerWaalsContact C-N 3.27Å
549	E	92.9	Very high	93.2	Very high	106 Å²	106	53 Å²	53	50%	0.495	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-2.3	179.6	-56.2	-56.4	133.6	0	0	112.6	H545 F551	H545-E549 PolarHBondContact O-N 2.98Å; H545-E549 VanDerWaalsContact O-N 3.1Å; E549-F551 HydrophobicContact CB-CD2 3.69Å; E549-F551 HydrophobicContact CB-CE2 3.35Å; E549-F551 HydrophobicContact CB-CZ 4.16Å; E549-F551 HydrophobicContact CG-CE2 4.11Å
550	G	92.3	Very high	92.8	Very high	61 Å²	61	55.6 Å²	55.6	63%	0.629	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	17.8	174	0	0	0	0	0	115.5	A546 A547 R548	A546-G550 PolarHBondContact O-N 3.06Å; A546-G550 VanDerWaalsContact O-N 3.17Å; A547-G550 PolarHBondContact O-N 3.07Å; R548-G550 VanDerWaalsContact C-N 3.27Å
551	F	93.6	Very high	92.4	Very high	101 Å²	101	53.9 Å²	53.9	44%	0.443	28%	0.283	S	S	.	.			trans	-71.8	144.1	178.2	-61.9	-62.8	0	0	0	112.3	A546 E549 F557	A546-F551 HydrophobicContact CB-CB 4.34Å; A546-F551 PolarHBondContact O-N 3.25Å; E549-F551 HydrophobicContact CB-CD2 3.69Å; E549-F551 HydrophobicContact CB-CE2 3.35Å; E549-F551 HydrophobicContact CB-CZ 4.16Å; E549-F551 HydrophobicContact CG-CE2 4.11Å; F551-F557 HydrophobicContact CD1-CZ 4.36Å; F551-F557 HydrophobicContact CD2-CE2 4.04Å; F551-F557 AromaticContact CD2-CZ 3.85Å; F551-F557 HydrophobicContact CD2-CZ 3.85Å; F551-F557 HydrophobicContact CE1-CZ 4.04Å; F551-F557 AromaticContact CE2-CE2 3.45Å; F551-F557 HydrophobicContact CE2-CE2 3.45Å; F551-F557 VanDerWaalsContact CE2-CE2 3.45Å; F551-F557 AromaticContact CE2-CZ 3.49Å; F551-F557 HydrophobicContact CE2-CZ 3.49Å; F551-F557 VanDerWaalsContact CE2-CZ 3.49Å; F551-F557 HydrophobicContact CG-CZ 4.29Å; F551-F557 AromaticContact CZ-CE2 3.84Å; F551-F557 HydrophobicContact CZ-CE2 3.84Å; F551-F557 AromaticContact CZ-CZ 3.6Å; F551-F557 HydrophobicContact CZ-CZ 3.6Å
552	K	92.6	Very high	92.3	Very high	185 Å²	185	52.3 Å²	52.3	80%	0.804	28%	0.276	S	S	*	.	S	Bend	trans	-83.8	-14.6	-177.2	-68.7	-179.1	-179.9	174.5	0	114.5	K511	K511-K552 WeakPolarHBondContact CD-O 3.31Å; K511-K552 WeakPolarHBondContact CE-O 3.45Å; K511-K552 PolarHBondContact NZ-O 3.12Å
553	S	93.6	Very high	92	Very high	38 Å²	38	52.4 Å²	52.4	27%	0.266	28%	0.276	S	S	.	.	S	Bend	trans	-153.8	155.9	179.3	50.3	0	0	0	0	108.8	K511 T513	K511-S553 CarbonylContact O-C 3.59Å; K511-S553 WeakPolarHBondContact O-CA 3.34Å; T513-S553 WeakPolarHBondContact OG1-CB 3.26Å; T513-S553 PolarHBondContact OG1-OG 2.91Å
554	I	94.3	Very high	91.4	Very high	10 Å²	10	52.1 Å²	52.1	5%	0.051	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-86.6	132.2	178.1	-46.8	173.6	0	0	0	108.8	L510 K511 L512 T513 A542 A543 A546 N558 F559	L510-I554 HydrophobicContact CB-CD1 4Å; L510-I554 HydrophobicContact CD1-CD1 3.9Å; L510-I554 HydrophobicContact CD2-CD1 4.33Å; L510-I554 HydrophobicContact CG-CD1 4.3Å; K511-I554 PolarHBondContact O-N 3.31Å; L512-I554 HydrophobicContact CD2-CB 4.06Å; L512-I554 HydrophobicContact CD2-CD1 4.33Å; T513-I554 PolarHBondContact N-O 2.8Å; T513-I554 PolarHBondContact OG1-O 3.35Å; A542-I554 HydrophobicContact CB-CG2 4.14Å; A543-I554 HydrophobicContact CB-CD1 3.62Å; A546-I554 HydrophobicContact CB-CG1 3.97Å; I554-N558 HydrophobicContact CG2-CB 3.76Å; I554-F559 HydrophobicContact CB-CE2 4.29Å; I554-F559 HydrophobicContact CB-CZ 4.33Å; I554-F559 HydrophobicContact CG2-CD2 4.05Å; I554-F559 HydrophobicContact CG2-CE1 4.26Å; I554-F559 HydrophobicContact CG2-CE2 3.52Å; I554-F559 HydrophobicContact CG2-CZ 3.63Å
555	D	90.8	Very high	91.1	Very high	43 Å²	43	51.4 Å²	51.4	23%	0.23	26%	0.263	C	S	.	.			trans	-128.9	168.1	176.1	-174.1	38.9	0	0	0	112.3	Y519 F557 N558	Y519-D555 PolarHBondContact OH-OD1 3.21Å; D555-F557 VanDerWaalsContact C-N 3.33Å; D555-F557 HydrophobicContact CB-CD1 4.21Å; D555-F557 HydrophobicContact CB-CE1 3.94Å; D555-F557 PolarHBondContact O-N 3.04Å; D555-F557 VanDerWaalsContact O-N 3.09Å; D555-N558 PolarHBondContact N-ND2 2.93Å; D555-N558 VanDerWaalsContact O-CB 3.3Å; D555-N558 WeakPolarHBondContact O-CB 3.41Å; D555-N558 PolarHBondContact O-N 3.24Å; D555-N558 PolarHBondContact O-ND2 2.94Å
556	T	88.5	Confident	90.8	Very high	29 Å²	29	52.3 Å²	52.3	18%	0.178	27%	0.27	C	S	.	.	H	α-helix	trans	-36.2	-53.8	-172.3	-40.7	0	0	0	0	114.3	Y519 N558 F559 E560	Y519-T556 WeakPolarHBondContact CE1-OG1 3.49Å; T556-N558 PolarHBondContact O-N 3.33Å; T556-N558 VanDerWaalsContact O-N 3.14Å; T556-F559 PolarHBondContact O-N 2.85Å; T556-E560 PolarHBondContact O-N 2.72Å
557	F	86.9	Confident	90.2	Very high	84 Å²	84	55.8 Å²	55.8	37%	0.368	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-25.6	-176.6	69	-92.5	0	0	0	113.8	F551 D555 Y561	F551-F557 HydrophobicContact CD1-CZ 4.36Å; F551-F557 HydrophobicContact CD2-CE2 4.04Å; F551-F557 AromaticContact CD2-CZ 3.85Å; F551-F557 HydrophobicContact CD2-CZ 3.85Å; F551-F557 HydrophobicContact CE1-CZ 4.04Å; F551-F557 AromaticContact CE2-CE2 3.45Å; F551-F557 HydrophobicContact CE2-CE2 3.45Å; F551-F557 VanDerWaalsContact CE2-CE2 3.45Å; F551-F557 AromaticContact CE2-CZ 3.49Å; F551-F557 HydrophobicContact CE2-CZ 3.49Å; F551-F557 VanDerWaalsContact CE2-CZ 3.49Å; F551-F557 HydrophobicContact CG-CZ 4.29Å; F551-F557 AromaticContact CZ-CE2 3.84Å; F551-F557 HydrophobicContact CZ-CE2 3.84Å; F551-F557 AromaticContact CZ-CZ 3.6Å; F551-F557 HydrophobicContact CZ-CZ 3.6Å; D555-F557 VanDerWaalsContact C-N 3.33Å; D555-F557 HydrophobicContact CB-CD1 4.21Å; D555-F557 HydrophobicContact CB-CE1 3.94Å; D555-F557 PolarHBondContact O-N 3.04Å; D555-F557 VanDerWaalsContact O-N 3.09Å; F557-Y561 VanDerWaalsContact O-CB 3.31Å; F557-Y561 WeakPolarHBondContact O-CB 3.48Å; F557-Y561 PolarHBondContact O-N 2.89Å
558	N	91.9	Very high	89.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-74.3	-35.9	175.7	-58	-85.8	0	0	0	111.3	A542 H545 I554 D555 T556 A562	A542-N558 HydrophobicContact CB-CB 4.41Å; H545-N558 PolarHBondContact ND1-OD1 3.02Å; I554-N558 HydrophobicContact CG2-CB 3.76Å; D555-N558 PolarHBondContact N-ND2 2.93Å; D555-N558 VanDerWaalsContact O-CB 3.3Å; D555-N558 WeakPolarHBondContact O-CB 3.41Å; D555-N558 PolarHBondContact O-N 3.24Å; D555-N558 PolarHBondContact O-ND2 2.94Å; T556-N558 PolarHBondContact O-N 3.33Å; T556-N558 VanDerWaalsContact O-N 3.14Å; N558-A562 WeakPolarHBondContact O-CB 3.46Å; N558-A562 PolarHBondContact O-N 3.48Å
559	F	91.8	Very high	88.9	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-72.6	-41.3	174.9	-67.9	-71.4	0	0	0	111.3	L507 L512 Y519 L523 A542 I554 T556 Y561 A562 V563	L507-F559 HydrophobicContact CD2-CE1 3.61Å; L507-F559 HydrophobicContact CD2-CE2 4.29Å; L507-F559 HydrophobicContact CD2-CZ 3.35Å; L512-F559 HydrophobicContact CD2-CE2 4.1Å; L512-F559 HydrophobicContact CD2-CZ 3.71Å; Y519-F559 HydrophobicContact CD1-CD2 4.17Å; Y519-F559 HydrophobicContact CD1-CE2 4.32Å; Y519-F559 HydrophobicContact CD2-CE2 4.34Å; Y519-F559 HydrophobicContact CE1-CD2 4.47Å; Y519-F559 HydrophobicContact CG-CD2 4.43Å; Y519-F559 HydrophobicContact CG-CE2 4.22Å; L523-F559 HydrophobicContact CD1-CB 4.07Å; L523-F559 HydrophobicContact CD1-CD1 3.83Å; L523-F559 HydrophobicContact CD1-CD2 4.42Å; L523-F559 HydrophobicContact CD1-CE1 4.37Å; L523-F559 HydrophobicContact CD1-CG 3.87Å; L523-F559 HydrophobicContact CD2-CB 3.67Å; L523-F559 HydrophobicContact CD2-CG 4.39Å; L523-F559 HydrophobicContact CG-CB 4.5Å; A542-F559 HydrophobicContact CB-CD1 3.4Å; A542-F559 VanDerWaalsContact CB-CD1 3.4Å; A542-F559 HydrophobicContact CB-CE1 3.64Å; A542-F559 HydrophobicContact CB-CG 4.05Å; A542-F559 HydrophobicContact CB-CZ 4.46Å; I554-F559 HydrophobicContact CB-CE2 4.29Å; I554-F559 HydrophobicContact CB-CZ 4.33Å; I554-F559 HydrophobicContact CG2-CD2 4.05Å; I554-F559 HydrophobicContact CG2-CE1 4.26Å; I554-F559 HydrophobicContact CG2-CE2 3.52Å; I554-F559 HydrophobicContact CG2-CZ 3.63Å; T556-F559 PolarHBondContact O-N 2.85Å; F559-Y561 PolarHBondContact O-N 3.08Å; F559-A562 WeakPolarHBondContact O-CB 3.47Å; F559-A562 PolarHBondContact O-N 3.18Å; F559-A562 VanDerWaalsContact O-N 3.11Å; F559-V563 WeakPolarHBondContact O-CG2 3.39Å; F559-V563 PolarHBondContact O-N 3.18Å
560	E	87	Confident	88.3	Confident	58 Å²	58	43.5 Å²	43.5	27%	0.271	23%	0.23	S	C	.	.	H	α-helix	trans	-58.8	-47.1	173.1	-67.7	175.5	161.8	0	0	111.3	R522 T556 A562 V563 E564	R522-E560 IonicContact CZ-OE1 2.72Å; R522-E560 VanDerWaalsContact CZ-OE1 3.31Å; R522-E560 IonicContact NE-OE1 3.88Å; R522-E560 IonicContact NH1-OE1 2.67Å; R522-E560 IonicContact NH2-OE1 2.75Å; R522-E560 PolarHBondContact NH2-OE1 3.4Å; T556-E560 PolarHBondContact O-N 2.72Å; E560-A562 VanDerWaalsContact C-N 3.3Å; E560-A562 PolarHBondContact O-N 3.26Å; E560-V563 PolarHBondContact O-N 2.82Å; E560-E564 PolarHBondContact O-N 2.97Å
561	Y	88	Confident	87.7	Confident	48 Å²	48	43.2 Å²	43.2	19%	0.188	22%	0.216	C	C	.	.	H	α-helix	trans	-56.9	-42	172	174.7	-88.8	0	0	0	112.5	H545 F557 F559 R565	H545-Y561 HydrophobicContact CB-CD1 3.8Å; H545-Y561 HydrophobicContact CB-CE1 4.04Å; H545-Y561 AromaticContact CD2-CD1 3.22Å; H545-Y561 WeakPolarHBondContact CD2-CD1 3.4Å; H545-Y561 AromaticContact CD2-CD2 3.97Å; H545-Y561 AromaticContact CD2-CE1 3.22Å; H545-Y561 WeakPolarHBondContact CD2-CE1 3.48Å; H545-Y561 AromaticContact CD2-CE2 3.96Å; H545-Y561 AromaticContact CD2-CG 3.62Å; H545-Y561 AromaticContact CD2-CZ 3.6Å; H545-Y561 AromaticContact CG-CD1 3.48Å; H545-Y561 VanDerWaalsContact CG-CD1 3.48Å; H545-Y561 AromaticContact CG-CE1 3.82Å; H545-Y561 AromaticContact NE2-CD1 3.87Å; H545-Y561 AromaticContact NE2-CD2 3.83Å; H545-Y561 AromaticContact NE2-CG 3.75Å; F557-Y561 VanDerWaalsContact O-CB 3.31Å; F557-Y561 WeakPolarHBondContact O-CB 3.48Å; F557-Y561 PolarHBondContact O-N 2.89Å; F559-Y561 PolarHBondContact O-N 3.08Å; Y561-R565 HydrophobicContact CE1-CB 4.3Å; Y561-R565 HydrophobicContact CE1-CG 4.49Å; Y561-R565 WeakPolarHBondContact O-CB 3.47Å; Y561-R565 PolarHBondContact O-N 3.39Å; Y561-R565 PolarHBondContact OH-NH1 3.1Å
562	A	92.2	Very high	87	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.7	-43.9	-179.9	0	0	0	0	0	112.2	I538 E541 A542 N558 F559 E560 R565 V566	I538-A562 HydrophobicContact CG2-CB 4.03Å; I538-A562 WeakPolarHBondContact O-CB 3.46Å; E541-A562 HydrophobicContact CB-CB 4Å; A542-A562 HydrophobicContact CB-CB 3.83Å; N558-A562 WeakPolarHBondContact O-CB 3.46Å; N558-A562 PolarHBondContact O-N 3.48Å; F559-A562 WeakPolarHBondContact O-CB 3.47Å; F559-A562 PolarHBondContact O-N 3.18Å; F559-A562 VanDerWaalsContact O-N 3.11Å; E560-A562 VanDerWaalsContact C-N 3.3Å; E560-A562 PolarHBondContact O-N 3.26Å; A562-R565 PolarHBondContact O-N 3.47Å; A562-V566 WeakPolarHBondContact O-CG2 3.36Å; A562-V566 PolarHBondContact O-N 2.99Å
563	V	88.5	Confident	85.9	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-58.1	-51.3	173.8	172	0	0	0	0	110.2	L523 L526 T527 I538 F559 E560 R565 V566 I567	L523-V563 HydrophobicContact CD2-CG2 4.32Å; L526-V563 HydrophobicContact CB-CG1 4.47Å; T527-V563 HydrophobicContact CG2-CG1 4.34Å; T527-V563 HydrophobicContact CG2-CG2 4.07Å; I538-V563 HydrophobicContact CD1-CG2 4.13Å; I538-V563 HydrophobicContact CG2-CG2 3.85Å; F559-V563 WeakPolarHBondContact O-CG2 3.39Å; F559-V563 PolarHBondContact O-N 3.18Å; E560-V563 PolarHBondContact O-N 2.82Å; V563-R565 VanDerWaalsContact C-N 3.29Å; V563-R565 PolarHBondContact O-N 3.42Å; V563-V566 PolarHBondContact O-N 2.83Å; V563-I567 HydrophobicContact CG1-CD1 3.64Å; V563-I567 WeakPolarHBondContact O-CG1 3.39Å; V563-I567 PolarHBondContact O-N 2.87Å
564	E	83.3	Confident	84.7	Confident	18 Å²	18	46.2 Å²	46.2	8%	0.084	24%	0.239	C	C	.	.	H	α-helix	trans	-56.6	-42	175.4	-79	-176.5	-145.7	0	0	112.8	E560 V566 I567 A568 K607 R613 F620	E560-E564 PolarHBondContact O-N 2.97Å; E564-V566 VanDerWaalsContact C-N 3.35Å; E564-I567 PolarHBondContact O-N 2.79Å; E564-A568 WeakPolarHBondContact O-CB 3.26Å; E564-A568 PolarHBondContact O-N 3.45Å; E564-K607 WeakPolarHBondContact OE1-CE 3.39Å; E564-K607 IonicContact OE1-NZ 3.26Å; E564-K607 PolarHBondContact OE1-NZ 3.08Å; E564-R613 IonicContact OE2-CZ 2.71Å; E564-R613 IonicContact OE2-NH1 3.48Å; E564-R613 IonicContact OE2-NH2 3.32Å; E564-R613 PolarHBondContact OE2-NH2 3.25Å; E564-F620 HydrophobicContact CG-CZ 4.44Å
565	R	87	Confident	83.5	Confident	61 Å²	61	50.6 Å²	50.6	23%	0.23	26%	0.257	C	S	.	.	H	α-helix	trans	-70.1	-31.3	-177.1	176.8	171.8	168	101.5	6	112.4	E541 Y561 A562 V563 G569 S570	E541-R565 WeakPolarHBondContact OE2-CD 3.3Å; E541-R565 IonicContact OE2-CZ 3.84Å; E541-R565 IonicContact OE2-NE 3.75Å; E541-R565 PolarHBondContact OE2-NE 3.12Å; E541-R565 IonicContact OE2-NH2 3.74Å; E541-R565 PolarHBondContact OE2-NH2 3.28Å; Y561-R565 HydrophobicContact CE1-CB 4.3Å; Y561-R565 HydrophobicContact CE1-CG 4.49Å; Y561-R565 WeakPolarHBondContact O-CB 3.47Å; Y561-R565 PolarHBondContact O-N 3.39Å; Y561-R565 PolarHBondContact OH-NH1 3.1Å; A562-R565 PolarHBondContact O-N 3.47Å; V563-R565 VanDerWaalsContact C-N 3.29Å; V563-R565 PolarHBondContact O-N 3.42Å; R565-G569 CarbonylContact O-C 3.54Å; R565-G569 WeakPolarHBondContact O-CA 3.39Å; R565-G569 PolarHBondContact O-N 2.92Å; R565-G569 VanDerWaalsContact O-N 3.13Å; R565-S570 VanDerWaalsContact NH1-CB 3.31Å
566	V	87.6	Confident	82.7	Confident	41 Å²	41	56 Å²	56	25%	0.248	29%	0.285	C	S	.	.	H	α-helix	trans	-75.9	-40.9	173	175.3	0	0	0	0	110.9	F530 I538 A562 V563 E564	F530-V566 HydrophobicContact CE2-CB 4.5Å; F530-V566 HydrophobicContact CE2-CG1 3.75Å; F530-V566 HydrophobicContact CZ-CG1 4.4Å; I538-V566 HydrophobicContact CG1-CB 4.22Å; I538-V566 HydrophobicContact CG1-CG2 3.86Å; A562-V566 WeakPolarHBondContact O-CG2 3.36Å; A562-V566 PolarHBondContact O-N 2.99Å; V563-V566 PolarHBondContact O-N 2.83Å; E564-V566 VanDerWaalsContact C-N 3.35Å
567	I	83	Confident	82.3	Confident	78 Å²	78	55.5 Å²	55.5	40%	0.4	28%	0.281	S	S	.	.	H	α-helix	trans	-69.4	-59.2	178.6	-65.6	167.9	0	0	0	112.2	F530 V563 E564	F530-I567 HydrophobicContact CE1-CG1 4.38Å; F530-I567 HydrophobicContact CZ-CD1 4.35Å; F530-I567 HydrophobicContact CZ-CG1 3.68Å; V563-I567 HydrophobicContact CG1-CD1 3.64Å; V563-I567 WeakPolarHBondContact O-CG1 3.39Å; V563-I567 PolarHBondContact O-N 2.87Å; E564-I567 PolarHBondContact O-N 2.79Å
568	A	78.1	Confident	82.4	Confident	13 Å²	13	54.1 Å²	54.1	11%	0.107	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-10.7	-168.7	0	0	0	0	0	113.5	E564 R613 F620	E564-A568 WeakPolarHBondContact O-CB 3.26Å; E564-A568 PolarHBondContact O-N 3.45Å; A568-R613 HydrophobicContact CB-CG 4.2Å; A568-R613 WeakPolarHBondContact O-CB 3.4Å; A568-F620 HydrophobicContact CB-CD1 4.49Å; A568-F620 HydrophobicContact CB-CD2 4.28Å; A568-F620 HydrophobicContact CB-CE2 4.44Å; A568-F620 HydrophobicContact CB-CG 4.3Å
569	G	83.8	Confident	82.3	Confident	7 Å²	7	62.8 Å²	62.8	7%	0.072	32%	0.319	C	S	.	.			trans	83.8	178.7	-171.6	0	0	0	0	0	113.4	R565 R613 T614	R565-G569 CarbonylContact O-C 3.54Å; R565-G569 WeakPolarHBondContact O-CA 3.39Å; R565-G569 PolarHBondContact O-N 2.92Å; R565-G569 VanDerWaalsContact O-N 3.13Å; G569-R613 PolarHBondContact O-NH1 2.85Å; G569-T614 WeakPolarHBondContact CA-OG1 3.27Å
570	S	80.1	Confident	82.2	Confident	36 Å²	36	70.4 Å²	70.4	25%	0.252	36%	0.355	S	S	.	.			trans	-76.3	147.5	-175.9	68.9	0	0	0	0	113.4	R565 K572 R613 T614	R565-S570 VanDerWaalsContact NH1-CB 3.31Å; S570-K572 PolarHBondContact O-N 3.19Å; S570-R613 CarbonylContact O-C 3.35Å; S570-R613 WeakPolarHBondContact O-CA 2.9Å; S570-T614 PolarHBondContact N-OG1 3.2Å; S570-T614 PolarHBondContact O-N 3.19Å; S570-T614 WeakPolarHBondContact OG-CG2 3.46Å
571	V	79	Confident	82.4	Confident	54 Å²	54	72.2 Å²	72.2	33%	0.327	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-68.2	125.3	177.7	-175.9	0	0	0	0	111.1	K573	V571-K573 HydrophobicContact CG1-CG 4.34Å; V571-K573 PolarHBondContact O-N 3.07Å
572	K	78.3	Confident	82.5	Confident	81 Å²	81	72 Å²	72	35%	0.352	36%	0.364	S	S	.	.			trans	-87.4	78.2	174.5	-78.4	-179.7	172.6	149.2	0	110.9	S570 S574 K575 P612 T614	S570-K572 PolarHBondContact O-N 3.19Å; K572-S574 PolarHBondContact O-N 3.33Å; K572-K575 HydrophobicContact CB-CB 4.27Å; K572-K575 PolarHBondContact O-N 3.22Å; K572-P612 PolarHBondContact N-O 2.87Å; K572-T614 HydrophobicContact CG-CG2 4.19Å; K572-T614 PolarHBondContact NZ-O 2.81Å
573	K	69.6	Low	82.5	Confident	192 Å²	192	77.8 Å²	77.8	84%	0.835	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-19.3	175	-66.6	-170.3	177.3	-175.4	0	114.5	V571	V571-K573 HydrophobicContact CG1-CG 4.34Å; V571-K573 PolarHBondContact O-N 3.07Å
574	S	68.5	Low	82.8	Confident	114 Å²	114	79.2 Å²	79.2	80%	0.797	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-15.2	179.2	55.2	0	0	0	0	115.3	K572 I576	K572-S574 PolarHBondContact O-N 3.33Å; S574-I576 PolarHBondContact O-N 3.06Å
575	K	70.4	Confident	83.3	Confident	102 Å²	102	79 Å²	79	44%	0.443	39%	0.394	S	S	.	.			trans	-97.2	82.7	179.4	-168.4	-173.1	178.1	-168.7	0	109.5	K572 L577 P612 L618	K572-K575 HydrophobicContact CB-CB 4.27Å; K572-K575 PolarHBondContact O-N 3.22Å; K575-L577 PolarHBondContact O-N 3.31Å; K575-P612 VanDerWaalsContact O-CG 3.3Å; K575-P612 WeakPolarHBondContact O-CG 3.46Å; K575-L618 VanDerWaalsContact NZ-CD2 3.34Å
576	I	74.1	Confident	83.6	Confident	157 Å²	157	76.1 Å²	76.1	81%	0.805	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-72.3	124.5	171.5	-56.6	171.1	0	0	0	107.8	S574	S574-I576 PolarHBondContact O-N 3.06Å
577	L	80.3	Confident	84	Confident	19 Å²	19	74.2 Å²	74.2	10%	0.099	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-81.7	152.5	172.9	-63.5	175	0	0	0	109.9	K575 E581 Q582 V585 L618	K575-L577 PolarHBondContact O-N 3.31Å; L577-E581 HydrophobicContact CB-CB 4.29Å; L577-Q582 HydrophobicContact CB-CB 4.43Å; L577-V585 HydrophobicContact CD1-CG2 4.48Å; L577-L618 HydrophobicContact CD2-CD2 4.15Å
578	S	89	Confident	84.5	Confident	55 Å²	55	71.2 Å²	71.2	39%	0.385	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-65.2	154.2	167.9	66.2	0	0	0	0	110.4	E580 E581 Q582	S578-E580 PolarHBondContact O-N 3.42Å; S578-E581 VanDerWaalsContact CB-OE2 3.29Å; S578-E581 WeakPolarHBondContact CB-OE2 3.37Å; S578-E581 PolarHBondContact N-OE2 2.89Å; S578-E581 PolarHBondContact O-N 3.18Å; S578-E581 VanDerWaalsContact O-N 3.16Å; S578-E581 WeakPolarHBondContact OG-CB 3.38Å; S578-E581 VanDerWaalsContact OG-CD 3.26Å; S578-E581 WeakPolarHBondContact OG-CG 3.35Å; S578-E581 PolarHBondContact OG-N 3.5Å; S578-E581 PolarHBondContact OG-OE2 3.1Å; S578-Q582 WeakPolarHBondContact O-CB 3.46Å; S578-Q582 PolarHBondContact O-N 3.38Å
579	K	89.5	Confident	85.3	Confident	181 Å²	181	71.4 Å²	71.4	79%	0.787	36%	0.355	S	S	*	.	H	α-helix	trans	-59.1	-29.7	178.8	-67.4	-171.4	176.6	-172.3	0	112.9	R583	K579-R583 WeakPolarHBondContact O-CB 3.37Å; K579-R583 PolarHBondContact O-N 3.47Å
580	E	89.6	Confident	85.8	Confident	161 Å²	161	71 Å²	71	75%	0.752	35%	0.351	S	S	*	.	H	α-helix	trans	-71.7	-48.1	175.5	-64.8	-175.6	-172.8	0	0	111.5	S578 Q582 R583 V584	S578-E580 PolarHBondContact O-N 3.42Å; E580-Q582 PolarHBondContact O-N 3.13Å; E580-R583 WeakPolarHBondContact O-CB 3.4Å; E580-R583 PolarHBondContact O-N 2.86Å; E580-V584 WeakPolarHBondContact O-CG2 3.28Å; E580-V584 PolarHBondContact O-N 2.9Å
581	E	89.6	Confident	86.5	Confident	97 Å²	97	69.3 Å²	69.3	45%	0.453	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-43.7	174.2	-70.6	164.9	126.7	0	0	111.7	L577 S578 R583 V584 V585	L577-E581 HydrophobicContact CB-CB 4.29Å; S578-E581 VanDerWaalsContact CB-OE2 3.29Å; S578-E581 WeakPolarHBondContact CB-OE2 3.37Å; S578-E581 PolarHBondContact N-OE2 2.89Å; S578-E581 PolarHBondContact O-N 3.18Å; S578-E581 VanDerWaalsContact O-N 3.16Å; S578-E581 WeakPolarHBondContact OG-CB 3.38Å; S578-E581 VanDerWaalsContact OG-CD 3.26Å; S578-E581 WeakPolarHBondContact OG-CG 3.35Å; S578-E581 PolarHBondContact OG-N 3.5Å; S578-E581 PolarHBondContact OG-OE2 3.1Å; E581-R583 VanDerWaalsContact C-N 3.29Å; E581-R583 PolarHBondContact O-N 3.03Å; E581-V584 PolarHBondContact O-N 3.3Å; E581-V584 VanDerWaalsContact O-N 3.14Å; E581-V585 WeakPolarHBondContact O-CG2 3.46Å; E581-V585 PolarHBondContact O-N 3.11Å
582	Q	90.8	Very high	87.3	Confident	44 Å²	44	67.4 Å²	67.4	21%	0.206	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-39.4	177.1	-170.6	178.5	18.3	0	0	111.3	L577 S578 E580 V585 A586 I610 L746	L577-Q582 HydrophobicContact CB-CB 4.43Å; S578-Q582 WeakPolarHBondContact O-CB 3.46Å; S578-Q582 PolarHBondContact O-N 3.38Å; E580-Q582 PolarHBondContact O-N 3.13Å; Q582-V585 PolarHBondContact O-N 3.48Å; Q582-A586 WeakPolarHBondContact O-CB 3.33Å; Q582-A586 PolarHBondContact O-N 2.93Å; Q582-I610 HydrophobicContact CG-CD1 3.72Å; Q582-L746 HydrophobicContact CG-CD2 4Å
583	R	93.6	Very high	88	Confident	121 Å²	121	63.6 Å²	63.6	46%	0.457	31%	0.31	S	S	.	.	H	α-helix	trans	-64.6	-43.6	172.5	-175.8	178	-179.1	135.6	3.9	112.2	K579 E580 E581 A586 F587 F654 L746	K579-R583 WeakPolarHBondContact O-CB 3.37Å; K579-R583 PolarHBondContact O-N 3.47Å; E580-R583 WeakPolarHBondContact O-CB 3.4Å; E580-R583 PolarHBondContact O-N 2.86Å; E581-R583 VanDerWaalsContact C-N 3.29Å; E581-R583 PolarHBondContact O-N 3.03Å; R583-A586 PolarHBondContact O-N 3.45Å; R583-F587 HydrophobicContact CG-CD2 4.08Å; R583-F587 HydrophobicContact CG-CE2 4.14Å; R583-F587 WeakPolarHBondContact O-CD2 3.38Å; R583-F587 PolarHBondContact O-N 3.27Å; R583-F587 VanDerWaalsContact O-N 3.12Å; R583-F654 HydrophobicContact CG-CE1 4.16Å; R583-F654 HydrophobicContact CG-CZ 4.05Å; R583-L746 HydrophobicContact CB-CD1 4.43Å; R583-L746 HydrophobicContact CG-CD1 4.19Å
584	V	93.3	Very high	89.2	Confident	32 Å²	32	54.4 Å²	54.4	19%	0.194	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-45.2	176.8	175.8	0	0	0	0	111	E580 E581 A586 F587 H588 E650 F654 T658	E580-V584 WeakPolarHBondContact O-CG2 3.28Å; E580-V584 PolarHBondContact O-N 2.9Å; E581-V584 PolarHBondContact O-N 3.3Å; E581-V584 VanDerWaalsContact O-N 3.14Å; V584-A586 PolarHBondContact O-N 3.36Å; V584-F587 PolarHBondContact O-N 2.94Å; V584-H588 VanDerWaalsContact O-CB 3.32Å; V584-H588 WeakPolarHBondContact O-CB 3.06Å; V584-H588 PolarHBondContact O-N 3.42Å; V584-E650 HydrophobicContact CG1-CG 4.08Å; V584-F654 HydrophobicContact CB-CE2 4.24Å; V584-F654 HydrophobicContact CG1-CE2 4.35Å; V584-F654 HydrophobicContact CG2-CD2 4.19Å; V584-F654 HydrophobicContact CG2-CE1 4.36Å; V584-F654 HydrophobicContact CG2-CE2 3.92Å; V584-F654 HydrophobicContact CG2-CZ 4.02Å; V584-T658 HydrophobicContact CG1-CG2 3.71Å
585	V	93.3	Very high	90.5	Very high	13 Å²	13	49 Å²	49	8%	0.079	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-41.8	176.1	174.5	0	0	0	0	111.5	L577 E581 Q582 F587 H588 E589 I610 L618	L577-V585 HydrophobicContact CD1-CG2 4.48Å; E581-V585 WeakPolarHBondContact O-CG2 3.46Å; E581-V585 PolarHBondContact O-N 3.11Å; Q582-V585 PolarHBondContact O-N 3.48Å; V585-F587 PolarHBondContact O-N 3.41Å; V585-H588 WeakPolarHBondContact O-CB 3.48Å; V585-H588 PolarHBondContact O-N 3.5Å; V585-E589 HydrophobicContact CG1-CG 4.24Å; V585-E589 WeakPolarHBondContact O-CG 3.34Å; V585-E589 PolarHBondContact O-N 3.14Å; V585-I610 HydrophobicContact CG1-CB 4.01Å; V585-I610 HydrophobicContact CG1-CG2 4.02Å; V585-L618 HydrophobicContact CG1-CB 4.37Å; V585-L618 HydrophobicContact CG2-CB 3.72Å; V585-L618 HydrophobicContact CG2-CD1 4.05Å
586	A	94.3	Very high	91.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-46.5	177.1	0	0	0	0	0	112.8	Q582 R583 V584 H588 S590 I610 L745 L746	Q582-A586 WeakPolarHBondContact O-CB 3.33Å; Q582-A586 PolarHBondContact O-N 2.93Å; R583-A586 PolarHBondContact O-N 3.45Å; V584-A586 PolarHBondContact O-N 3.36Å; A586-H588 VanDerWaalsContact C-N 3.34Å; A586-S590 VanDerWaalsContact O-CB 3.26Å; A586-S590 WeakPolarHBondContact O-CB 3.33Å; A586-S590 PolarHBondContact O-N 3.01Å; A586-S590 PolarHBondContact O-OG 2.98Å; A586-I610 HydrophobicContact CB-CD1 4.43Å; A586-I610 HydrophobicContact CB-CG2 4.04Å; A586-L745 HydrophobicContact CB-CB 4.3Å; A586-L746 HydrophobicContact CB-CD1 4.39Å; A586-L746 HydrophobicContact CB-CD2 3.91Å; A586-L746 HydrophobicContact CB-CG 3.76Å
587	F	95.6	Very high	92.3	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.009	17%	0.173	C	C	.	.	H	α-helix	trans	-67.5	-33.8	175.8	-84.9	-92.9	0	0	0	112.5	R583 V584 V585 G591 A649 T653 F654 L738 T739 A742	R583-F587 HydrophobicContact CG-CD2 4.08Å; R583-F587 HydrophobicContact CG-CE2 4.14Å; R583-F587 WeakPolarHBondContact O-CD2 3.38Å; R583-F587 PolarHBondContact O-N 3.27Å; R583-F587 VanDerWaalsContact O-N 3.12Å; V584-F587 PolarHBondContact O-N 2.94Å; V585-F587 PolarHBondContact O-N 3.41Å; F587-G591 PolarHBondContact O-N 3.27Å; F587-A649 VanDerWaalsContact O-CB 3.23Å; F587-A649 WeakPolarHBondContact O-CB 3.48Å; F587-T653 HydrophobicContact CD1-CG2 3.59Å; F587-T653 WeakPolarHBondContact CD1-OG1 3.34Å; F587-T653 HydrophobicContact CD2-CG2 4.39Å; F587-T653 HydrophobicContact CE1-CG2 3.57Å; F587-T653 HydrophobicContact CE2-CG2 4.38Å; F587-T653 HydrophobicContact CG-CG2 4.02Å; F587-T653 HydrophobicContact CZ-CG2 3.99Å; F587-F654 HydrophobicContact CB-CE2 3.82Å; F587-F654 HydrophobicContact CB-CZ 4.05Å; F587-F654 HydrophobicContact CD2-CE2 4.45Å; F587-F654 AromaticContact CD2-CZ 3.81Å; F587-F654 HydrophobicContact CD2-CZ 3.81Å; F587-F654 HydrophobicContact CG-CE2 4.21Å; F587-F654 HydrophobicContact CG-CZ 4Å; F587-L738 HydrophobicContact CD1-CD2 4.45Å; F587-L738 HydrophobicContact CD1-CG 4.26Å; F587-T739 HydrophobicContact CZ-CG2 4.32Å; F587-A742 HydrophobicContact CD1-CB 3.85Å; F587-A742 HydrophobicContact CD2-CB 3.64Å; F587-A742 HydrophobicContact CE1-CB 3.82Å; F587-A742 HydrophobicContact CE2-CB 3.61Å; F587-A742 HydrophobicContact CG-CB 3.77Å; F587-A742 HydrophobicContact CZ-CB 3.7Å
588	H	94.8	Very high	92.9	Very high	14 Å²	14	36.7 Å²	36.7	7%	0.065	17%	0.173	C	C	.	.	H	α-helix	trans	-64	-54.3	175.7	-173.2	118.1	0	0	0	112.1	V584 V585 A586 S590 G591 H592 G646 E650	V584-H588 VanDerWaalsContact O-CB 3.32Å; V584-H588 WeakPolarHBondContact O-CB 3.06Å; V584-H588 PolarHBondContact O-N 3.42Å; V585-H588 WeakPolarHBondContact O-CB 3.48Å; V585-H588 PolarHBondContact O-N 3.5Å; A586-H588 VanDerWaalsContact C-N 3.34Å; H588-S590 VanDerWaalsContact C-N 3.3Å; H588-S590 PolarHBondContact O-N 3.33Å; H588-G591 WeakPolarHBondContact O-CA 3.42Å; H588-G591 PolarHBondContact O-N 3Å; H588-H592 AromaticContact CD2-CD2 3.66Å; H588-H592 AromaticContact CD2-NE2 3.44Å; H588-H592 PolarHBondContact CD2-NE2 3.1Å; H588-H592 AromaticContact NE2-CD2 3.99Å; H588-H592 AromaticContact NE2-NE2 3.27Å; H588-H592 PolarHBondContact NE2-NE2 3.39Å; H588-H592 PolarHBondContact O-CD2 2.98Å; H588-H592 PolarHBondContact O-N 3.41Å; H588-G646 WeakPolarHBondContact O-CA 3.4Å; H588-E650 HydrophobicContact CB-CG 4.39Å; H588-E650 IonicContact CE1-OE1 2.78Å; H588-E650 IonicContact CG-OE1 2.77Å; H588-E650 IonicContact ND1-OE1 3.64Å; H588-E650 PolarHBondContact ND1-OE1 3.49Å
589	E	93.8	Very high	93.1	Very high	17 Å²	17	34.7 Å²	34.7	8%	0.079	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-37.4	177.6	-62.6	-59.4	156.4	0	0	111.5	V585 G591 H592 A593 V608 G619 F620 T621	V585-E589 HydrophobicContact CG1-CG 4.24Å; V585-E589 WeakPolarHBondContact O-CG 3.34Å; V585-E589 PolarHBondContact O-N 3.14Å; E589-G591 PolarHBondContact O-N 3.07Å; E589-H592 PolarHBondContact O-N 2.88Å; E589-A593 WeakPolarHBondContact O-CB 3.45Å; E589-A593 PolarHBondContact O-N 3.1Å; E589-V608 HydrophobicContact CB-CG1 3.6Å; E589-G619 WeakPolarHBondContact OE1-CA 3.29Å; E589-F620 PolarHBondContact OE1-N 3.19Å; E589-F620 WeakPolarHBondContact OE2-CA 3.4Å; E589-T621 PolarHBondContact O-OG1 3.05Å; E589-T621 PolarHBondContact OE2-N 3.27Å; E589-T621 PolarHBondContact OE2-OG1 3.42Å
590	S	95.1	Very high	93.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.1	-34.6	172.2	-57.9	0	0	0	0	112.9	A586 H588 A593 L594 L741 A742 L745	A586-S590 VanDerWaalsContact O-CB 3.26Å; A586-S590 WeakPolarHBondContact O-CB 3.33Å; A586-S590 PolarHBondContact O-N 3.01Å; A586-S590 PolarHBondContact O-OG 2.98Å; H588-S590 VanDerWaalsContact C-N 3.3Å; H588-S590 PolarHBondContact O-N 3.33Å; S590-A593 PolarHBondContact O-N 3.31Å; S590-L594 WeakPolarHBondContact O-CB 3.45Å; S590-L594 PolarHBondContact O-N 2.73Å; S590-L741 WeakPolarHBondContact OG-CD2 3.49Å; S590-A742 WeakPolarHBondContact OG-CA 3.43Å; S590-A742 WeakPolarHBondContact OG-CB 3.2Å; S590-A742 PolarHBondContact OG-N 3.45Å; S590-L745 WeakPolarHBondContact OG-CD1 3.22Å
591	G	95.2	Very high	93	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63	-44.2	175.7	0	0	0	0	0	112.4	F587 H588 E589 V595	F587-G591 PolarHBondContact O-N 3.27Å; H588-G591 WeakPolarHBondContact O-CA 3.42Å; H588-G591 PolarHBondContact O-N 3Å; E589-G591 PolarHBondContact O-N 3.07Å; G591-V595 WeakPolarHBondContact O-CB 3.37Å; G591-V595 WeakPolarHBondContact O-CG2 3.31Å; G591-V595 PolarHBondContact O-N 2.75Å
592	H	94.3	Very high	92.9	Very high	14 Å²	14	21.6 Å²	21.6	7%	0.065	10%	0.1	C	C	.	.	H	α-helix	trans	-64.7	-46.8	173.2	-66	-63	0	0	0	111.9	H588 E589 G596 T621 M642 A643	H588-H592 AromaticContact CD2-CD2 3.66Å; H588-H592 AromaticContact CD2-NE2 3.44Å; H588-H592 PolarHBondContact CD2-NE2 3.1Å; H588-H592 AromaticContact NE2-CD2 3.99Å; H588-H592 AromaticContact NE2-NE2 3.27Å; H588-H592 PolarHBondContact NE2-NE2 3.39Å; H588-H592 PolarHBondContact O-CD2 2.98Å; H588-H592 PolarHBondContact O-N 3.41Å; E589-H592 PolarHBondContact O-N 2.88Å; H592-G596 PolarHBondContact O-N 3.32Å; H592-T621 HydrophobicContact CB-CG2 4.28Å; H592-M642 PolarHBondContact ND1-O 2.94Å; H592-A643 PolarHBondContact CE1-O 3.5Å; H592-A643 VanDerWaalsContact CE1-O 3.24Å
593	A	93.8	Very high	92.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.4	-47.9	-177.7	0	0	0	0	0	112.4	E589 S590 G596 W597 V605 V608 L741	E589-A593 WeakPolarHBondContact O-CB 3.45Å; E589-A593 PolarHBondContact O-N 3.1Å; S590-A593 PolarHBondContact O-N 3.31Å; A593-G596 CarbonylContact O-C 3.55Å; A593-G596 WeakPolarHBondContact O-CA 3.34Å; A593-G596 PolarHBondContact O-N 3.23Å; A593-W597 WeakPolarHBondContact O-CB 3.32Å; A593-W597 PolarHBondContact O-N 3.04Å; A593-V605 HydrophobicContact CB-CG1 4.18Å; A593-V608 HydrophobicContact CB-CG2 3.63Å; A593-L741 HydrophobicContact CB-CD2 4.33Å
594	L	94.9	Very high	91.8	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-69.2	-43.4	-177.3	-178	62.6	0	0	0	112.5	S590 G596 W597 L598 L731 N734 K737 L738 L760	S590-L594 WeakPolarHBondContact O-CB 3.45Å; S590-L594 PolarHBondContact O-N 2.73Å; L594-G596 VanDerWaalsContact C-N 3.27Å; L594-G596 PolarHBondContact O-N 3.25Å; L594-W597 WeakPolarHBondContact O-CB 3.27Å; L594-W597 PolarHBondContact O-N 3.27Å; L594-W597 VanDerWaalsContact O-N 3.13Å; L594-L598 HydrophobicContact CD1-CD1 3.77Å; L594-L598 HydrophobicContact CD1-CG 3.97Å; L594-L598 HydrophobicContact CD2-CD1 4.5Å; L594-L598 HydrophobicContact CG-CD1 3.8Å; L594-L598 HydrophobicContact CG-CG 4.35Å; L594-L598 WeakPolarHBondContact O-CB 3.42Å; L594-L598 VanDerWaalsContact O-CG 3.3Å; L594-L598 WeakPolarHBondContact O-CG 3.32Å; L594-L598 PolarHBondContact O-N 2.93Å; L594-L731 HydrophobicContact CB-CD2 4.43Å; L594-L731 HydrophobicContact CD2-CD2 3.89Å; L594-L731 HydrophobicContact CG-CD2 4.36Å; L594-N734 HydrophobicContact CD2-CB 4.22Å; L594-K737 HydrophobicContact CD1-CB 3.98Å; L594-K737 HydrophobicContact CD1-CD 4.45Å; L594-K737 HydrophobicContact CD2-CB 4.18Å; L594-L738 HydrophobicContact CD2-CB 3.69Å; L594-L738 HydrophobicContact CD2-CD1 4.29Å; L594-L760 HydrophobicContact CD1-CD1 3.79Å; L594-L760 HydrophobicContact CD1-CD2 4.44Å
595	V	95.1	Very high	91.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-64.8	-38.4	174.5	177.6	0	0	0	0	110.1	G591 W597 L598 L599 C641 M642 T727 L730 L731	G591-V595 WeakPolarHBondContact O-CB 3.37Å; G591-V595 WeakPolarHBondContact O-CG2 3.31Å; G591-V595 PolarHBondContact O-N 2.75Å; V595-W597 VanDerWaalsContact C-N 3.32Å; V595-W597 PolarHBondContact O-N 2.9Å; V595-L598 PolarHBondContact O-N 3.21Å; V595-L599 HydrophobicContact CG1-CD1 3.56Å; V595-L599 HydrophobicContact CG1-CG 4.2Å; V595-L599 WeakPolarHBondContact O-CG 3.23Å; V595-L599 PolarHBondContact O-N 3.05Å; V595-C641 HydrophobicContact CG1-CB 4.39Å; V595-M642 HydrophobicContact CG1-CB 4.38Å; V595-T727 HydrophobicContact CG2-CG2 3.84Å; V595-L730 HydrophobicContact CG1-CD2 4.13Å; V595-L730 HydrophobicContact CG2-CD2 4.41Å; V595-L731 HydrophobicContact CG2-CD1 4.21Å; V595-L731 HydrophobicContact CG2-CD2 3.73Å; V595-L731 HydrophobicContact CG2-CG 3.84Å
596	G	92.1	Very high	90.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-55.8	-42.5	169.1	0	0	0	0	0	113.6	H592 A593 L594 T602 K768	H592-G596 PolarHBondContact O-N 3.32Å; A593-G596 CarbonylContact O-C 3.55Å; A593-G596 WeakPolarHBondContact O-CA 3.34Å; A593-G596 PolarHBondContact O-N 3.23Å; L594-G596 VanDerWaalsContact C-N 3.27Å; L594-G596 PolarHBondContact O-N 3.25Å; G596-T602 PolarHBondContact O-OG1 3.43Å; G596-K768 WeakPolarHBondContact O-CE 3.32Å; G596-K768 PolarHBondContact O-NZ 3.35Å
597	W	91.5	Very high	90.5	Very high	3 Å²	3	16.8 Å²	16.8	1%	0.011	8%	0.08	C	C	.	.	H	α-helix	trans	-73.1	-38.6	-179.5	-160.8	-104	0	0	0	113.5	A593 L594 V595 Y753 I756 E757 L760 G761 P763 K768	A593-W597 WeakPolarHBondContact O-CB 3.32Å; A593-W597 PolarHBondContact O-N 3.04Å; L594-W597 WeakPolarHBondContact O-CB 3.27Å; L594-W597 PolarHBondContact O-N 3.27Å; L594-W597 VanDerWaalsContact O-N 3.13Å; V595-W597 VanDerWaalsContact C-N 3.32Å; V595-W597 PolarHBondContact O-N 2.9Å; W597-Y753 HydrophobicContact CH2-CD2 4.21Å; W597-Y753 HydrophobicContact CH2-CE1 4.22Å; W597-Y753 AromaticContact CH2-CE2 3.68Å; W597-Y753 HydrophobicContact CH2-CE2 3.68Å; W597-Y753 AromaticContact CH2-CZ 3.65Å; W597-Y753 AromaticContact CZ3-CD2 3.87Å; W597-Y753 HydrophobicContact CZ3-CD2 3.87Å; W597-Y753 AromaticContact CZ3-CE2 3.51Å; W597-Y753 HydrophobicContact CZ3-CE2 3.51Å; W597-I756 HydrophobicContact CD2-CG2 3.81Å; W597-I756 HydrophobicContact CE3-CG2 3.63Å; W597-I756 HydrophobicContact CG-CG2 4.47Å; W597-I756 HydrophobicContact CH2-CB 4.43Å; W597-I756 HydrophobicContact CH2-CG2 4.06Å; W597-I756 HydrophobicContact CZ2-CG2 4.22Å; W597-I756 HydrophobicContact CZ3-CB 4.26Å; W597-I756 HydrophobicContact CZ3-CG2 3.75Å; W597-E757 HydrophobicContact CH2-CB 3.94Å; W597-E757 HydrophobicContact CZ2-CB 3.93Å; W597-E757 HydrophobicContact CZ2-CG 4.32Å; W597-L760 HydrophobicContact CB-CD1 4.23Å; W597-L760 HydrophobicContact CD2-CD1 4.44Å; W597-L760 HydrophobicContact CG-CD1 3.89Å; W597-G761 PolarHBondContact NE1-O 2.99Å; W597-G761 VanDerWaalsContact NE1-O 3.13Å; W597-P763 HydrophobicContact CD2-CB 4.45Å; W597-P763 HydrophobicContact CZ2-CB 4.4Å; W597-P763 HydrophobicContact CZ2-CG 4.3Å; W597-K768 WeakPolarHBondContact O-CE 3.46Å
598	L	92.7	Very high	90.2	Very high	17 Å²	17	16.7 Å²	16.7	9%	0.089	8%	0.079	C	C	.	.	H	α-helix	trans	-85.8	-29.3	-171.1	-68	173.9	0	0	0	114.6	L594 V595 L730 N734 P764 F765	L594-L598 HydrophobicContact CD1-CD1 3.77Å; L594-L598 HydrophobicContact CD1-CG 3.97Å; L594-L598 HydrophobicContact CD2-CD1 4.5Å; L594-L598 HydrophobicContact CG-CD1 3.8Å; L594-L598 HydrophobicContact CG-CG 4.35Å; L594-L598 WeakPolarHBondContact O-CB 3.42Å; L594-L598 VanDerWaalsContact O-CG 3.3Å; L594-L598 WeakPolarHBondContact O-CG 3.32Å; L594-L598 PolarHBondContact O-N 2.93Å; V595-L598 PolarHBondContact O-N 3.21Å; L598-L730 HydrophobicContact CB-CD1 4.24Å; L598-L730 HydrophobicContact CB-CD2 4.24Å; L598-L730 HydrophobicContact CD1-CD1 4.07Å; L598-L730 HydrophobicContact CD1-CG 4.12Å; L598-N734 HydrophobicContact CD1-CB 3.86Å; L598-P764 HydrophobicContact CD2-CG 4.27Å; L598-F765 WeakPolarHBondContact O-CD2 3.44Å; L598-F765 VanDerWaalsContact O-CE2 3.25Å; L598-F765 WeakPolarHBondContact O-CE2 3.28Å
599	L	92.9	Very high	89.9	Confident	12 Å²	12	16.1 Å²	16.1	6%	0.063	8%	0.077	C	C	.	.	S	Bend	trans	-79	150.5	-179.3	-69.6	177	0	0	0	112.1	V595 T602 Q638 C641 L730 K768	V595-L599 HydrophobicContact CG1-CD1 3.56Å; V595-L599 HydrophobicContact CG1-CG 4.2Å; V595-L599 WeakPolarHBondContact O-CG 3.23Å; V595-L599 PolarHBondContact O-N 3.05Å; L599-T602 HydrophobicContact CB-CG2 3.75Å; L599-T602 HydrophobicContact CD1-CG2 3.99Å; L599-T602 PolarHBondContact O-OG1 3.36Å; L599-T602 VanDerWaalsContact O-OG1 3.08Å; L599-Q638 HydrophobicContact CD1-CB 3.99Å; L599-Q638 HydrophobicContact CD1-CG 4.17Å; L599-Q638 HydrophobicContact CD2-CG 4.41Å; L599-C641 HydrophobicContact CD1-CB 3.82Å; L599-L730 HydrophobicContact CD1-CD2 4.49Å; L599-L730 HydrophobicContact CD2-CD2 3.85Å; L599-L730 HydrophobicContact CG-CD2 3.9Å; L599-K768 WeakPolarHBondContact O-CE 3.04Å; L599-K768 PolarHBondContact O-NZ 2.93Å
600	E	89.5	Confident	89.7	Confident	101 Å²	101	15.4 Å²	15.4	47%	0.472	7%	0.074	S	C	.	.	S	Bend	trans	-72.4	-52.2	-174.5	-174.8	-171.2	152.4	0	0	112.8	T602 F765	E600-T602 PolarHBondContact O-N 2.9Å; E600-F765 HydrophobicContact CB-CB 4.21Å; E600-F765 HydrophobicContact CB-CD1 4.04Å; E600-F765 HydrophobicContact CB-CD2 3.82Å; E600-F765 HydrophobicContact CB-CE1 4.4Å; E600-F765 HydrophobicContact CB-CE2 4.2Å; E600-F765 HydrophobicContact CB-CG 3.75Å; E600-F765 HydrophobicContact CB-CZ 4.48Å; E600-F765 HydrophobicContact CG-CB 3.95Å; E600-F765 HydrophobicContact CG-CD1 3.97Å; E600-F765 HydrophobicContact CG-CD2 4.45Å; E600-F765 HydrophobicContact CG-CG 3.86Å
601	H	88.1	Confident	89.1	Confident	60 Å²	60	16.2 Å²	16.2	28%	0.278	8%	0.08	S	C	.	.	S	Bend	trans	-92.8	8.3	-170.2	-49.9	-35.2	0	0	0	113.6	Q635 Q638	H601-Q635 HydrophobicContact CB-CG 3.7Å; H601-Q638 PolarHBondContact CD2-NE2 2.72Å
602	T	86.4	Confident	88.5	Confident	4 Å²	4	17.1 Å²	17.1	3%	0.025	9%	0.086	C	C	.	.	S	Bend	trans	-79.5	146.2	172.3	46.4	0	0	0	0	112	G596 L599 E600 Q638 M642 K768	G596-T602 PolarHBondContact O-OG1 3.43Å; L599-T602 HydrophobicContact CB-CG2 3.75Å; L599-T602 HydrophobicContact CD1-CG2 3.99Å; L599-T602 PolarHBondContact O-OG1 3.36Å; L599-T602 VanDerWaalsContact O-OG1 3.08Å; E600-T602 PolarHBondContact O-N 2.9Å; T602-Q638 HydrophobicContact CG2-CB 4.15Å; T602-M642 HydrophobicContact CG2-CB 4.12Å; T602-M642 HydrophobicContact CG2-CG 4.48Å; T602-M642 HydrophobicContact CG2-SD 4.12Å; T602-K768 PolarHBondContact O-NZ 2.91Å; T602-K768 PolarHBondContact OG1-NZ 3.19Å
603	E	82.8	Confident	87.7	Confident	23 Å²	23	17.1 Å²	17.1	11%	0.107	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-63	160.4	175.9	-67.8	162.3	170.8	0	0	111.9	I623 P625 R639	E603-I623 HydrophobicContact CB-CG2 3.28Å; E603-I623 HydrophobicContact CG-CG2 4.28Å; E603-I623 VanDerWaalsContact OE2-CG2 3.27Å; E603-I623 WeakPolarHBondContact OE2-CG2 3.14Å; E603-P625 VanDerWaalsContact CD-CA 3.47Å; E603-P625 WeakPolarHBondContact OE1-CA 3.47Å; E603-P625 WeakPolarHBondContact OE1-CB 3.27Å; E603-R639 IonicContact OE1-CZ 3.6Å; E603-R639 IonicContact OE1-NH1 3.3Å; E603-R639 IonicContact OE1-NH2 3.3Å; E603-R639 PolarHBondContact OE1-NH2 3.49Å; E603-R639 IonicContact OE2-NH2 3.05Å; E603-R639 PolarHBondContact OE2-NH2 2.85Å
604	A	78.1	Confident	86.4	Confident	4 Å²	4	19.4 Å²	19.4	3%	0.033	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.1	-178.8	0	0	0	0	0	111.5	I623 L624 K768	A604-I623 WeakPolarHBondContact O-CA 3.09Å; A604-L624 PolarHBondContact O-N 2.74Å; A604-K768 HydrophobicContact CB-CB 4.19Å
605	V	86.1	Confident	84.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	103.9	176	179.5	0	0	0	0	108.3	A593 V608 T621 M642 Y753 I756	A593-V605 HydrophobicContact CB-CG1 4.18Å; V605-V608 HydrophobicContact CG1-CG2 3.71Å; V605-T621 HydrophobicContact CG1-CG2 3.74Å; V605-T621 HydrophobicContact CG2-CG2 4.43Å; V605-M642 HydrophobicContact CG2-CE 3.84Å; V605-Y753 WeakPolarHBondContact O-CD2 3.35Å; V605-I756 HydrophobicContact CB-CD1 4.47Å; V605-I756 HydrophobicContact CG1-CD1 3.89Å
606	M	81.8	Confident	83	Confident	42 Å²	42	28.4 Å²	28.4	21%	0.207	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-35.3	-174.5	-66	-58.6	-61	0	0	112.8	Q622 L624 N752 Y753	M606-Q622 PolarHBondContact N-O 2.61Å; M606-L624 HydrophobicContact CG-CB 3.79Å; M606-L624 HydrophobicContact CG-CD2 4.5Å; M606-L624 HydrophobicContact SD-CB 4.39Å; M606-L624 HydrophobicContact SD-CD2 4.24Å; M606-N752 CarbonylContact O-C 3.55Å; M606-Y753 PolarHBondContact O-N 2.85Å
607	K	85.6	Confident	81.7	Confident	39 Å²	39	30.4 Å²	30.4	17%	0.17	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	142.7	-172.1	-168.4	168.7	-168.7	168.5	0	111.1	E564 Q622 V750 V751 N752	E564-K607 WeakPolarHBondContact OE1-CE 3.39Å; E564-K607 IonicContact OE1-NZ 3.26Å; E564-K607 PolarHBondContact OE1-NZ 3.08Å; K607-Q622 HydrophobicContact CB-CB 4.14Å; K607-Q622 PolarHBondContact O-N 2.91Å; K607-V750 HydrophobicContact CD-CG1 4.31Å; K607-V750 HydrophobicContact CG-CG1 4.17Å; K607-V751 WeakPolarHBondContact CA-O 3.14Å; K607-N752 VanDerWaalsContact CE-OD1 3.3Å; K607-N752 WeakPolarHBondContact CE-OD1 3.43Å
608	V	90.3	Very high	80.8	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.1	175	-169.5	0	0	0	0	108.3	E589 A593 V605 T621 L745 V750 V751 I756	E589-V608 HydrophobicContact CB-CG1 3.6Å; A593-V608 HydrophobicContact CB-CG2 3.63Å; V605-V608 HydrophobicContact CG1-CG2 3.71Å; V608-T621 HydrophobicContact CG2-CG2 4.32Å; V608-L745 HydrophobicContact CB-CD1 4.36Å; V608-L745 HydrophobicContact CB-CD2 4.05Å; V608-L745 HydrophobicContact CG1-CD1 3.64Å; V608-L745 HydrophobicContact CG1-CD2 3.92Å; V608-L745 HydrophobicContact CG1-CG 4.42Å; V608-V750 WeakPolarHBondContact O-CA 3.24Å; V608-V751 PolarHBondContact N-O 2.87Å; V608-V751 PolarHBondContact O-N 2.79Å; V608-I756 HydrophobicContact CG2-CD1 3.99Å
609	S	89.2	Confident	80	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.014	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	142.4	177.6	-177.4	0	0	0	0	112.9	A611 G619 F620 E749	S609-A611 PolarHBondContact OG-N 3.08Å; S609-G619 CarbonylContact O-C 3.58Å; S609-G619 WeakPolarHBondContact O-CA 3.44Å; S609-F620 PolarHBondContact N-O 3.37Å; S609-F620 PolarHBondContact O-N 2.99Å; S609-E749 WeakPolarHBondContact CA-O 3.42Å; S609-E749 PolarHBondContact OG-O 3.35Å; S609-E749 VanDerWaalsContact OG-O 3.12Å
610	I	88.4	Confident	79.6	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.015	19%	0.189	C	C	.	.			trans	-100.4	11.4	176.1	64.6	179.4	0	0	0	113	Q582 V585 A586 L618 L745 L746 E749	Q582-I610 HydrophobicContact CG-CD1 3.72Å; V585-I610 HydrophobicContact CG1-CB 4.01Å; V585-I610 HydrophobicContact CG1-CG2 4.02Å; A586-I610 HydrophobicContact CB-CD1 4.43Å; A586-I610 HydrophobicContact CB-CG2 4.04Å; I610-L618 CarbonylContact C-O 3.53Å; I610-L745 VanDerWaalsContact CD1-O 3.25Å; I610-L745 WeakPolarHBondContact CD1-O 3.44Å; I610-L745 HydrophobicContact CG2-CB 4.35Å; I610-L745 HydrophobicContact CG2-CD2 4.44Å; I610-L746 HydrophobicContact CD1-CD2 4.31Å; I610-E749 HydrophobicContact CG1-CB 4.26Å; I610-E749 PolarHBondContact N-O 3.37Å; I610-E749 VanDerWaalsContact N-O 3.08Å
611	A	83.4	Confident	79.3	Confident	17 Å²	17	29.1 Å²	29.1	14%	0.14	17%	0.174	C	C	.	.			trans	-82.2	121.5	-177.9	0	0	0	0	0	111.6	S609 L618	S609-A611 PolarHBondContact OG-N 3.08Å; A611-L618 CarbonylContact C-O 3.49Å
612	P	80.9	Confident	79	Confident	19 Å²	19	27.3 Å²	27.3	12%	0.123	17%	0.166	C	C	.	.			trans	-67.8	134.9	-170.7	23.7	-32.4	0	0	0	113.3	K572 K575 L618	K572-P612 PolarHBondContact N-O 2.87Å; K575-P612 VanDerWaalsContact O-CG 3.3Å; K575-P612 WeakPolarHBondContact O-CG 3.46Å; P612-L618 WeakPolarHBondContact CA-O 3.35Å
613	R	79	Confident	78.8	Confident	13 Å²	13	29.8 Å²	29.8	5%	0.049	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-108.1	173.4	-175.4	-60.2	-64.3	-178.6	131.6	-6.2	113	E564 A568 G569 S570 A617 F620	E564-R613 IonicContact OE2-CZ 2.71Å; E564-R613 IonicContact OE2-NH1 3.48Å; E564-R613 IonicContact OE2-NH2 3.32Å; E564-R613 PolarHBondContact OE2-NH2 3.25Å; A568-R613 HydrophobicContact CB-CG 4.2Å; A568-R613 WeakPolarHBondContact O-CB 3.4Å; G569-R613 PolarHBondContact O-NH1 2.85Å; S570-R613 CarbonylContact O-C 3.35Å; S570-R613 WeakPolarHBondContact O-CA 2.9Å; R613-A617 PolarHBondContact N-O 3.4Å; R613-F620 HydrophobicContact CG-CD1 4.31Å
614	T	65.6	Low	78.5	Confident	49 Å²	49	30 Å²	30	30%	0.301	18%	0.18	S	C	.	.	S	Bend	trans	-65.5	-39.1	178.5	38.3	0	0	0	0	113.3	G569 S570 K572 A616	G569-T614 WeakPolarHBondContact CA-OG1 3.27Å; S570-T614 PolarHBondContact N-OG1 3.2Å; S570-T614 PolarHBondContact O-N 3.19Å; S570-T614 WeakPolarHBondContact OG-CG2 3.46Å; K572-T614 HydrophobicContact CG-CG2 4.19Å; K572-T614 PolarHBondContact NZ-O 2.81Å; T614-A616 PolarHBondContact O-N 3.05Å
615	N	62.6	Low	78.1	Confident	100 Å²	100	32.2 Å²	32.2	54%	0.535	19%	0.194	S	C	.	.	S	Bend	trans	-83.9	44.6	-167.4	-63.5	5.7	0	0	0	113.1	A617	N615-A617 PolarHBondContact O-N 2.94Å
616	A	57.1	Low	77.4	Confident	88 Å²	88	36.1 Å²	36.1	73%	0.727	21%	0.209	S	C	*	.	S	Bend	trans	61.2	-14.6	179.6	0	0	0	0	0	117.8	T614 L618	T614-A616 PolarHBondContact O-N 3.05Å; A616-L618 PolarHBondContact O-N 3.01Å
617	A	63.6	Low	76.7	Confident	42 Å²	42	37.7 Å²	37.7	35%	0.347	22%	0.218	S	C	.	.			trans	-65.3	128.1	173.6	0	0	0	0	0	111.9	R613 N615 G619	R613-A617 PolarHBondContact N-O 3.4Å; N615-A617 PolarHBondContact O-N 2.94Å; A617-G619 WeakPolarHBondContact CB-O 3.49Å
618	L	73.1	Confident	76.2	Confident	55 Å²	55	39.1 Å²	39.1	29%	0.288	23%	0.225	S	C	.	.	S	Bend	trans	-83.9	-36.6	178.3	-62.3	-178.5	0	0	0	112	K575 L577 V585 I610 A611 P612 A616	K575-L618 VanDerWaalsContact NZ-CD2 3.34Å; L577-L618 HydrophobicContact CD2-CD2 4.15Å; V585-L618 HydrophobicContact CG1-CB 4.37Å; V585-L618 HydrophobicContact CG2-CB 3.72Å; V585-L618 HydrophobicContact CG2-CD1 4.05Å; I610-L618 CarbonylContact C-O 3.53Å; A611-L618 CarbonylContact C-O 3.49Å; P612-L618 WeakPolarHBondContact CA-O 3.35Å; A616-L618 PolarHBondContact O-N 3.01Å
619	G	76.2	Confident	75.6	Confident	4 Å²	4	48.8 Å²	48.8	4%	0.041	26%	0.263	C	S	.	.	S	Bend	trans	-126.7	-177.8	162.6	0	0	0	0	0	109.7	E589 S609 A617	E589-G619 WeakPolarHBondContact OE1-CA 3.29Å; S609-G619 CarbonylContact O-C 3.58Å; S609-G619 WeakPolarHBondContact O-CA 3.44Å; A617-G619 WeakPolarHBondContact CB-O 3.49Å
620	F	82.9	Confident	75.5	Confident	24 Å²	24	55.7 Å²	55.7	11%	0.105	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	146.9	164.8	73.4	-72.9	0	0	0	111.9	E564 A568 E589 S609 R613 Q622	E564-F620 HydrophobicContact CG-CZ 4.44Å; A568-F620 HydrophobicContact CB-CD1 4.49Å; A568-F620 HydrophobicContact CB-CD2 4.28Å; A568-F620 HydrophobicContact CB-CE2 4.44Å; A568-F620 HydrophobicContact CB-CG 4.3Å; E589-F620 PolarHBondContact OE1-N 3.19Å; E589-F620 WeakPolarHBondContact OE2-CA 3.4Å; S609-F620 PolarHBondContact N-O 3.37Å; S609-F620 PolarHBondContact O-N 2.99Å; R613-F620 HydrophobicContact CG-CD1 4.31Å; F620-Q622 HydrophobicContact CD2-CB 4.32Å; F620-Q622 HydrophobicContact CE2-CB 4.09Å
621	T	84.1	Confident	75.6	Confident	23 Å²	23	59.1 Å²	59.1	14%	0.141	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.8	170.2	-64.6	0	0	0	0	108.4	E589 H592 V605 V608 I623	E589-T621 PolarHBondContact O-OG1 3.05Å; E589-T621 PolarHBondContact OE2-N 3.27Å; E589-T621 PolarHBondContact OE2-OG1 3.42Å; H592-T621 HydrophobicContact CB-CG2 4.28Å; V605-T621 HydrophobicContact CG1-CG2 3.74Å; V605-T621 HydrophobicContact CG2-CG2 4.43Å; V608-T621 HydrophobicContact CG2-CG2 4.32Å; T621-I623 HydrophobicContact CG2-CG1 4.15Å; T621-I623 PolarHBondContact O-N 3.26Å
622	Q	82	Confident	76	Confident	23 Å²	23	61.4 Å²	61.4	11%	0.107	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	113	176.8	-171.8	172.9	-2.6	0	0	110	M606 K607 F620	M606-Q622 PolarHBondContact N-O 2.61Å; K607-Q622 HydrophobicContact CB-CB 4.14Å; K607-Q622 PolarHBondContact O-N 2.91Å; F620-Q622 HydrophobicContact CD2-CB 4.32Å; F620-Q622 HydrophobicContact CE2-CB 4.09Å
623	I	82.5	Confident	76.6	Confident	56 Å²	56	64.7 Å²	64.7	29%	0.287	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	139.9	177.7	-54	165.9	0	0	0	107.3	E603 A604 T621 P625 M642	E603-I623 HydrophobicContact CB-CG2 3.28Å; E603-I623 HydrophobicContact CG-CG2 4.28Å; E603-I623 VanDerWaalsContact OE2-CG2 3.27Å; E603-I623 WeakPolarHBondContact OE2-CG2 3.14Å; A604-I623 WeakPolarHBondContact O-CA 3.09Å; T621-I623 HydrophobicContact CG2-CG1 4.15Å; T621-I623 PolarHBondContact O-N 3.26Å; I623-P625 WeakPolarHBondContact O-CD 3.18Å; I623-M642 HydrophobicContact CB-CE 4.49Å; I623-M642 HydrophobicContact CD1-CE 3.37Å; I623-M642 HydrophobicContact CD1-SD 3.88Å; I623-M642 HydrophobicContact CG1-CE 3.59Å; I623-M642 HydrophobicContact CG2-CE 4.06Å
624	L	76.1	Confident	77.3	Confident	28 Å²	28	68.5 Å²	68.5	15%	0.147	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	98.5	174.5	-168.6	67.5	0	0	0	109.8	E525 L526 A604 M606	E525-L624 WeakPolarHBondContact O-CD1 3.45Å; L526-L624 HydrophobicContact CD2-CD1 4.26Å; A604-L624 PolarHBondContact O-N 2.74Å; M606-L624 HydrophobicContact CG-CB 3.79Å; M606-L624 HydrophobicContact CG-CD2 4.5Å; M606-L624 HydrophobicContact SD-CB 4.39Å; M606-L624 HydrophobicContact SD-CD2 4.24Å
625	P	70.7	Confident	78.7	Confident	50 Å²	50	67.9 Å²	67.9	33%	0.325	35%	0.353	S	S	.	.			trans	-72.8	150.7	-179.6	31.9	-35	0	0	0	110.9	P528 E603 I623	P528-P625 HydrophobicContact CB-CG 4.28Å; P528-P625 HydrophobicContact CG-CG 3.48Å; P528-P625 VanDerWaalsContact CG-CG 3.48Å; E603-P625 VanDerWaalsContact CD-CA 3.47Å; E603-P625 WeakPolarHBondContact OE1-CA 3.47Å; E603-P625 WeakPolarHBondContact OE1-CB 3.27Å; I623-P625 WeakPolarHBondContact O-CD 3.18Å
626	R	69.9	Low	80.2	Confident	82 Å²	82	63.7 Å²	63.7	31%	0.309	33%	0.331	S	S	.	.			trans	-86.4	142.8	176.9	-62.1	-178.8	177.2	159.5	2.6	109.5	Q628 I771	R626-Q628 HydrophobicContact CB-CB 4.2Å; R626-Q628 PolarHBondContact O-N 2.89Å; R626-I771 HydrophobicContact CG-CD1 4.38Å
627	D	66.8	Low	82	Confident	75 Å²	75	61.5 Å²	61.5	40%	0.401	31%	0.305	S	S	.	.			trans	-71.7	66	169	-75	-17.3	0	0	0	109.5	R499 P528	R499-D627 IonicContact CZ-OD2 2.75Å; R499-D627 VanDerWaalsContact CZ-OD2 3.32Å; R499-D627 IonicContact NH1-OD1 3.7Å; R499-D627 IonicContact NH1-OD2 3.83Å; R499-D627 PolarHBondContact NH1-OD2 2.69Å; R499-D627 IonicContact NH2-OD1 3.18Å; R499-D627 IonicContact NH2-OD2 3.01Å; R499-D627 PolarHBondContact NH2-OD2 3.32Å; P528-D627 WeakPolarHBondContact CB-OD1 3.34Å
628	Q	75.5	Confident	83.5	Confident	68 Å²	68	60.9 Å²	60.9	32%	0.318	30%	0.295	S	S	.	.			trans	-122.1	122.8	-176.1	179.2	178.7	-12.3	0	0	110	R626 L630 F631	R626-Q628 HydrophobicContact CB-CB 4.2Å; R626-Q628 PolarHBondContact O-N 2.89Å; Q628-L630 PolarHBondContact NE2-O 2.8Å; Q628-F631 VanDerWaalsContact O-CE2 3.28Å; Q628-F631 WeakPolarHBondContact O-CE2 3.31Å; Q628-F631 VanDerWaalsContact O-CZ 3.3Å; Q628-F631 WeakPolarHBondContact O-CZ 3.29Å
629	Y	77.3	Confident	84.5	Confident	204 Å²	204	63 Å²	63	80%	0.8	30%	0.299	S	S	*	.			trans	-90.3	-23.9	-176.9	-61.8	-84.9	0	0	0	114.2
630	L	87.2	Confident	85.4	Confident	146 Å²	146	62.9 Å²	62.9	76%	0.764	30%	0.297	S	S	*	.			trans	-107.9	116.8	-175.1	-59.3	178	0	0	0	110.4	Q628	Q628-L630 PolarHBondContact NE2-O 2.8Å
631	F	90.6	Very high	86.1	Confident	76 Å²	76	61.7 Å²	61.7	33%	0.333	29%	0.292	S	S	.	.			trans	-110.3	135	179.9	-67.3	-82.5	0	0	0	112.3	Q628 Q635 L636	Q628-F631 VanDerWaalsContact O-CE2 3.28Å; Q628-F631 WeakPolarHBondContact O-CE2 3.31Å; Q628-F631 VanDerWaalsContact O-CZ 3.3Å; Q628-F631 WeakPolarHBondContact O-CZ 3.29Å; F631-Q635 HydrophobicContact CD1-CB 4.46Å; F631-L636 HydrophobicContact CB-CD1 4.37Å; F631-L636 HydrophobicContact CB-CD2 3.84Å; F631-L636 HydrophobicContact CB-CG 3.93Å; F631-L636 HydrophobicContact CD1-CD2 4.47Å; F631-L636 HydrophobicContact CG-CD2 4.11Å
632	T	93.3	Very high	86.6	Confident	64 Å²	64	61 Å²	61	39%	0.393	29%	0.287	S	S	.	.			trans	-80.3	162.1	173.1	71.5	0	0	0	0	112.2	D634 Q635 L636	T632-D634 PolarHBondContact O-N 2.89Å; T632-Q635 PolarHBondContact O-N 3.08Å; T632-Q635 WeakPolarHBondContact OG1-CB 3.24Å; T632-Q635 WeakPolarHBondContact OG1-CG 3.39Å; T632-Q635 PolarHBondContact OG1-N 3.06Å; T632-Q635 VanDerWaalsContact OG1-N 3.15Å; T632-L636 PolarHBondContact O-N 3.28Å
633	K	93.6	Very high	87.2	Confident	89 Å²	89	60.8 Å²	60.8	39%	0.387	29%	0.289	S	S	.	.	H	α-helix	trans	-55.2	-40.8	174.7	-174.7	168.3	175.5	165.7	0	111.4	F637 M675 M681 D683	K633-F637 WeakPolarHBondContact O-CB 3.32Å; K633-F637 PolarHBondContact O-N 3.38Å; K633-M675 HydrophobicContact CG-CE 3.97Å; K633-M681 HydrophobicContact CB-SD 4.22Å; K633-M681 HydrophobicContact CD-CB 4.44Å; K633-M681 WeakPolarHBondContact CE-O 3.46Å; K633-M681 PolarHBondContact NZ-O 3.26Å; K633-D683 IonicContact NZ-OD2 3.97Å
634	D	93.6	Very high	87.8	Confident	93 Å²	93	58.2 Å²	58.2	50%	0.497	28%	0.277	S	S	.	.	H	α-helix	trans	-74.2	-36.8	-179.6	-53.3	-57.7	0	0	0	112.9	T632 F637 Q638	T632-D634 PolarHBondContact O-N 2.89Å; D634-F637 PolarHBondContact O-N 2.93Å; D634-Q638 WeakPolarHBondContact O-CB 3.28Å; D634-Q638 VanDerWaalsContact O-CG 3.31Å; D634-Q638 WeakPolarHBondContact O-CG 3.23Å; D634-Q638 PolarHBondContact O-N 3.19Å
635	Q	93.2	Very high	88.8	Confident	36 Å²	36	56.9 Å²	56.9	17%	0.168	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-46.9	171.6	-80.4	160.9	7.8	0	0	111.4	H601 F631 T632 Q638 R639	H601-Q635 HydrophobicContact CB-CG 3.7Å; F631-Q635 HydrophobicContact CD1-CB 4.46Å; T632-Q635 PolarHBondContact O-N 3.08Å; T632-Q635 WeakPolarHBondContact OG1-CB 3.24Å; T632-Q635 WeakPolarHBondContact OG1-CG 3.39Å; T632-Q635 PolarHBondContact OG1-N 3.06Å; T632-Q635 VanDerWaalsContact OG1-N 3.15Å; Q635-Q638 PolarHBondContact O-N 3.27Å; Q635-R639 WeakPolarHBondContact O-CB 3.28Å; Q635-R639 PolarHBondContact O-N 3.22Å
636	L	94.4	Very high	89.9	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-66.8	-39.9	177.3	-64.8	179	0	0	0	112	F631 T632 R639 M640 V671 M675 Y679 M681	F631-L636 HydrophobicContact CB-CD1 4.37Å; F631-L636 HydrophobicContact CB-CD2 3.84Å; F631-L636 HydrophobicContact CB-CG 3.93Å; F631-L636 HydrophobicContact CD1-CD2 4.47Å; F631-L636 HydrophobicContact CG-CD2 4.11Å; T632-L636 PolarHBondContact O-N 3.28Å; L636-R639 PolarHBondContact O-N 2.96Å; L636-M640 WeakPolarHBondContact O-CG 3.48Å; L636-M640 PolarHBondContact O-N 3.02Å; L636-V671 HydrophobicContact CB-CG1 4.16Å; L636-V671 HydrophobicContact CD2-CG1 4.37Å; L636-M675 HydrophobicContact CB-CE 4.04Å; L636-M675 HydrophobicContact CB-CG 4.23Å; L636-M675 HydrophobicContact CB-SD 3.56Å; L636-M675 VanDerWaalsContact CB-SD 3.56Å; L636-M675 HydrophobicContact CD1-CG 3.67Å; L636-M675 HydrophobicContact CD1-SD 4.15Å; L636-Y679 HydrophobicContact CD1-CD2 3.9Å; L636-Y679 HydrophobicContact CD1-CE2 3.89Å; L636-M681 HydrophobicContact CD1-CE 3.86Å; L636-M681 HydrophobicContact CD1-SD 3.84Å
637	F	96	Very high	91.1	Very high	43 Å²	43	52.5 Å²	52.5	19%	0.189	25%	0.247	C	C	.	.	H	α-helix	trans	-61.9	-47.3	175	-177.9	-99.8	0	0	0	112.1	K633 D634 R639 M640 C641 L719 R722 A723 H726	K633-F637 WeakPolarHBondContact O-CB 3.32Å; K633-F637 PolarHBondContact O-N 3.38Å; D634-F637 PolarHBondContact O-N 2.93Å; F637-R639 VanDerWaalsContact C-N 3.32Å; F637-R639 PolarHBondContact O-N 2.91Å; F637-M640 WeakPolarHBondContact O-CB 3.49Å; F637-M640 PolarHBondContact O-N 3.45Å; F637-M640 VanDerWaalsContact O-N 3.13Å; F637-C641 PolarHBondContact O-N 2.9Å; F637-C641 PolarHBondContact O-SG 3.17Å; F637-C641 VanDerWaalsContact O-SG 3.33Å; F637-L719 HydrophobicContact CD2-CD1 4.06Å; F637-L719 HydrophobicContact CE2-CD1 4.44Å; F637-R722 HydrophobicContact CE2-CB 4.24Å; F637-A723 HydrophobicContact CD2-CB 4.32Å; F637-A723 HydrophobicContact CE2-CB 3.79Å; F637-A723 HydrophobicContact CZ-CB 4.22Å; F637-H726 HydrophobicContact CE1-CB 4.39Å; F637-H726 HydrophobicContact CZ-CB 4.22Å
638	Q	95	Very high	92.6	Very high	28 Å²	28	49 Å²	49	13%	0.131	23%	0.227	C	C	.	.	H	α-helix	trans	-66.2	-33.5	177.4	-70	-176.8	24.7	0	0	112.2	L599 H601 T602 D634 Q635 C641 M642	L599-Q638 HydrophobicContact CD1-CB 3.99Å; L599-Q638 HydrophobicContact CD1-CG 4.17Å; L599-Q638 HydrophobicContact CD2-CG 4.41Å; H601-Q638 PolarHBondContact CD2-NE2 2.72Å; T602-Q638 HydrophobicContact CG2-CB 4.15Å; D634-Q638 WeakPolarHBondContact O-CB 3.28Å; D634-Q638 VanDerWaalsContact O-CG 3.31Å; D634-Q638 WeakPolarHBondContact O-CG 3.23Å; D634-Q638 PolarHBondContact O-N 3.19Å; Q635-Q638 PolarHBondContact O-N 3.27Å; Q638-C641 WeakPolarHBondContact O-CB 3.33Å; Q638-C641 PolarHBondContact O-N 2.72Å; Q638-M642 PolarHBondContact O-N 2.75Å
639	R	93.3	Very high	93.6	Very high	99 Å²	99	45.7 Å²	45.7	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-63.9	-37.7	170.8	-165.5	175.7	-163.7	149.3	18.2	112.3	E603 Q635 L636 F637 A643	E603-R639 IonicContact OE1-CZ 3.6Å; E603-R639 IonicContact OE1-NH1 3.3Å; E603-R639 IonicContact OE1-NH2 3.3Å; E603-R639 PolarHBondContact OE1-NH2 3.49Å; E603-R639 IonicContact OE2-NH2 3.05Å; E603-R639 PolarHBondContact OE2-NH2 2.85Å; Q635-R639 WeakPolarHBondContact O-CB 3.28Å; Q635-R639 PolarHBondContact O-N 3.22Å; L636-R639 PolarHBondContact O-N 2.96Å; F637-R639 VanDerWaalsContact C-N 3.32Å; F637-R639 PolarHBondContact O-N 2.91Å; R639-A643 PolarHBondContact O-N 2.88Å; R639-A643 VanDerWaalsContact O-N 3.15Å
640	M	96	Very high	94.4	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-43.6	170	-67.7	171.1	63.9	0	0	111.4	L636 F637 M642 A643 L644 V668 V671 A672 M675 L719 I720 A723	L636-M640 WeakPolarHBondContact O-CG 3.48Å; L636-M640 PolarHBondContact O-N 3.02Å; F637-M640 WeakPolarHBondContact O-CB 3.49Å; F637-M640 PolarHBondContact O-N 3.45Å; F637-M640 VanDerWaalsContact O-N 3.13Å; M640-M642 PolarHBondContact O-N 3.41Å; M640-A643 PolarHBondContact O-N 2.94Å; M640-L644 WeakPolarHBondContact O-CG 3.46Å; M640-L644 PolarHBondContact O-N 3.24Å; M640-V668 HydrophobicContact CB-CG1 4.35Å; M640-V668 HydrophobicContact CE-CG1 3.83Å; M640-V668 HydrophobicContact CG-CG1 4.38Å; M640-V671 HydrophobicContact CG-CB 4.07Å; M640-V671 HydrophobicContact CG-CG1 3.74Å; M640-V671 HydrophobicContact SD-CB 4.47Å; M640-V671 HydrophobicContact SD-CG1 3.94Å; M640-A672 HydrophobicContact CE-CB 3.8Å; M640-A672 HydrophobicContact SD-CB 4.42Å; M640-M675 HydrophobicContact SD-SD 4.01Å; M640-L719 HydrophobicContact CE-CD2 4.22Å; M640-L719 HydrophobicContact CE-CG 3.99Å; M640-L719 HydrophobicContact SD-CD2 4.09Å; M640-L719 HydrophobicContact SD-CG 4.26Å; M640-I720 HydrophobicContact CE-CB 4.43Å; M640-I720 HydrophobicContact CE-CG1 3.71Å; M640-A723 HydrophobicContact CB-CB 4.14Å; M640-A723 HydrophobicContact CE-CB 4.34Å
641	C	96.9	Very high	94.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.9	-44.1	177.7	-67.7	0	0	0	0	112.4	V595 L599 F637 Q638 L644 G645 T727	V595-C641 HydrophobicContact CG1-CB 4.39Å; L599-C641 HydrophobicContact CD1-CB 3.82Å; F637-C641 PolarHBondContact O-N 2.9Å; F637-C641 PolarHBondContact O-SG 3.17Å; F637-C641 VanDerWaalsContact O-SG 3.33Å; Q638-C641 WeakPolarHBondContact O-CB 3.33Å; Q638-C641 PolarHBondContact O-N 2.72Å; C641-L644 PolarHBondContact O-N 3.32Å; C641-G645 PolarHBondContact O-N 2.86Å; C641-G645 VanDerWaalsContact O-N 3.14Å; C641-T727 WeakPolarHBondContact CA-OG1 3.29Å; C641-T727 VanDerWaalsContact CB-OG1 3.25Å; C641-T727 WeakPolarHBondContact CB-OG1 3.5Å; C641-T727 WeakPolarHBondContact O-CG2 3.28Å; C641-T727 PolarHBondContact O-OG1 3.3Å
642	M	94.6	Very high	95	Very high	8 Å²	8	27.8 Å²	27.8	4%	0.039	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-44.5	175.8	-171.5	-171.6	-165.5	0	0	112	H592 V595 T602 V605 I623 Q638 M640 L644 G645	H592-M642 PolarHBondContact ND1-O 2.94Å; V595-M642 HydrophobicContact CG1-CB 4.38Å; T602-M642 HydrophobicContact CG2-CB 4.12Å; T602-M642 HydrophobicContact CG2-CG 4.48Å; T602-M642 HydrophobicContact CG2-SD 4.12Å; V605-M642 HydrophobicContact CG2-CE 3.84Å; I623-M642 HydrophobicContact CB-CE 4.49Å; I623-M642 HydrophobicContact CD1-CE 3.37Å; I623-M642 HydrophobicContact CD1-SD 3.88Å; I623-M642 HydrophobicContact CG1-CE 3.59Å; I623-M642 HydrophobicContact CG2-CE 4.06Å; Q638-M642 PolarHBondContact O-N 2.75Å; M640-M642 PolarHBondContact O-N 3.41Å; M642-L644 VanDerWaalsContact C-N 3.32Å; M642-L644 PolarHBondContact O-N 2.96Å; M642-G645 PolarHBondContact O-N 2.88Å; M642-G645 VanDerWaalsContact O-N 3.12Å
643	A	94.1	Very high	95.1	Very high	18 Å²	18	26.4 Å²	26.4	15%	0.149	13%	0.129	C	C	.	.	H	α-helix	trans	-70	-24.9	176	0	0	0	0	0	113.2	H592 R639 M640 G645 D664 V668	H592-A643 PolarHBondContact CE1-O 3.5Å; H592-A643 VanDerWaalsContact CE1-O 3.24Å; R639-A643 PolarHBondContact O-N 2.88Å; R639-A643 VanDerWaalsContact O-N 3.15Å; M640-A643 PolarHBondContact O-N 2.94Å; A643-G645 VanDerWaalsContact C-N 3.29Å; A643-D664 HydrophobicContact CB-CB 4.38Å; A643-D664 WeakPolarHBondContact O-CB 3.45Å; A643-V668 HydrophobicContact CB-CG2 3.47Å; A643-V668 VanDerWaalsContact CB-CG2 3.47Å
644	L	96.4	Very high	95.1	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-80.3	-9.7	170.7	-68.3	172	0	0	0	113.5	M640 C641 M642 G646 R647 A648 L665 V668 I720 A723 Y724	M640-L644 WeakPolarHBondContact O-CG 3.46Å; M640-L644 PolarHBondContact O-N 3.24Å; C641-L644 PolarHBondContact O-N 3.32Å; M642-L644 VanDerWaalsContact C-N 3.32Å; M642-L644 PolarHBondContact O-N 2.96Å; L644-G646 PolarHBondContact O-N 3.4Å; L644-R647 PolarHBondContact O-N 2.92Å; L644-A648 WeakPolarHBondContact O-CB 3.36Å; L644-A648 PolarHBondContact O-N 2.94Å; L644-L665 HydrophobicContact CD2-CD2 4.03Å; L644-V668 HydrophobicContact CD1-CG1 4.15Å; L644-V668 HydrophobicContact CD2-CB 4.48Å; L644-V668 HydrophobicContact CD2-CG1 4.12Å; L644-V668 HydrophobicContact CD2-CG2 4.06Å; L644-V668 HydrophobicContact CG-CG1 4.14Å; L644-V668 HydrophobicContact CG-CG2 3.9Å; L644-I720 HydrophobicContact CD1-CG2 4.5Å; L644-A723 HydrophobicContact CD1-CB 3.76Å; L644-Y724 HydrophobicContact CB-CD2 4.4Å; L644-Y724 HydrophobicContact CD1-CD2 4.46Å; L644-Y724 HydrophobicContact CD2-CD2 4.35Å
645	G	95.8	Very high	95.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-51.9	-52	-176.4	0	0	0	0	0	114.1	C641 M642 A643 R647 A648 A649	C641-G645 PolarHBondContact O-N 2.86Å; C641-G645 VanDerWaalsContact O-N 3.14Å; M642-G645 PolarHBondContact O-N 2.88Å; M642-G645 VanDerWaalsContact O-N 3.12Å; A643-G645 VanDerWaalsContact C-N 3.29Å; G645-R647 PolarHBondContact O-N 3.33Å; G645-A648 PolarHBondContact O-N 3.42Å; G645-A649 WeakPolarHBondContact O-CB 3.35Å; G645-A649 PolarHBondContact O-N 3.28Å
646	G	94.7	Very high	95	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.1	-45.3	-178.6	0	0	0	0	0	114	H588 L644 A648 A649 E650	H588-G646 WeakPolarHBondContact O-CA 3.4Å; L644-G646 PolarHBondContact O-N 3.4Å; G646-A648 PolarHBondContact O-N 3.24Å; G646-A649 PolarHBondContact O-N 3.41Å; G646-E650 WeakPolarHBondContact O-CG 3.33Å; G646-E650 PolarHBondContact O-N 2.91Å
647	R	95.3	Very high	94.9	Very high	40 Å²	40	37.2 Å²	37.2	15%	0.151	19%	0.185	C	C	.	.	H	α-helix	trans	-64.3	-38.4	176.4	-178.2	170.2	-74.3	-79.8	-7.4	112.7	L644 G645 A651 V657 T658 A661 Y724	L644-R647 PolarHBondContact O-N 2.92Å; G645-R647 PolarHBondContact O-N 3.33Å; R647-A651 PolarHBondContact O-N 3.13Å; R647-A651 VanDerWaalsContact O-N 3.14Å; R647-V657 HydrophobicContact CG-CG1 4.41Å; R647-T658 PolarHBondContact NH2-O 3.43Å; R647-A661 HydrophobicContact CB-CB 3.82Å; R647-A661 HydrophobicContact CG-CB 4.49Å; R647-Y724 HydrophobicContact CG-CE2 4.22Å
648	A	97	Very high	94.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69.1	-41.2	177.3	0	0	0	0	0	111.4	L644 G645 G646 E650 A651 I652 Y724 T727 L731	L644-A648 WeakPolarHBondContact O-CB 3.36Å; L644-A648 PolarHBondContact O-N 2.94Å; G645-A648 PolarHBondContact O-N 3.42Å; G646-A648 PolarHBondContact O-N 3.24Å; A648-E650 PolarHBondContact O-N 3.32Å; A648-A651 PolarHBondContact O-N 3.3Å; A648-I652 WeakPolarHBondContact O-CB 3.43Å; A648-I652 WeakPolarHBondContact O-CD1 3.41Å; A648-I652 VanDerWaalsContact O-CG1 3.28Å; A648-I652 WeakPolarHBondContact O-CG1 3.5Å; A648-I652 PolarHBondContact O-N 3.49Å; A648-Y724 HydrophobicContact CB-CE2 4.06Å; A648-T727 HydrophobicContact CB-CG2 3.81Å; A648-L731 HydrophobicContact CB-CD1 3.69Å
649	A	96.6	Very high	94.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-39.7	175.3	0	0	0	0	0	112.8	F587 G645 G646 T653 L731 L738	F587-A649 VanDerWaalsContact O-CB 3.23Å; F587-A649 WeakPolarHBondContact O-CB 3.48Å; G645-A649 WeakPolarHBondContact O-CB 3.35Å; G645-A649 PolarHBondContact O-N 3.28Å; G646-A649 PolarHBondContact O-N 3.41Å; A649-T653 VanDerWaalsContact O-CB 3.26Å; A649-T653 WeakPolarHBondContact O-CB 3.28Å; A649-T653 PolarHBondContact O-N 3.31Å; A649-T653 VanDerWaalsContact O-N 3.09Å; A649-T653 PolarHBondContact O-OG1 3.48Å; A649-L731 HydrophobicContact CB-CD1 4.11Å; A649-L738 HydrophobicContact CB-CD1 4.06Å; A649-L738 HydrophobicContact CB-CD2 3.95Å
650	E	94.9	Very high	94.2	Very high	3 Å²	3	39.7 Å²	39.7	1%	0.014	22%	0.224	C	C	.	.	H	α-helix	trans	-57.7	-51.3	170.7	-75	-178.4	-170.4	0	0	111.8	V584 H588 G646 A648 T653 F654 K656 T658	V584-E650 HydrophobicContact CG1-CG 4.08Å; H588-E650 HydrophobicContact CB-CG 4.39Å; H588-E650 IonicContact CE1-OE1 2.78Å; H588-E650 IonicContact CG-OE1 2.77Å; H588-E650 IonicContact ND1-OE1 3.64Å; H588-E650 PolarHBondContact ND1-OE1 3.49Å; G646-E650 WeakPolarHBondContact O-CG 3.33Å; G646-E650 PolarHBondContact O-N 2.91Å; A648-E650 PolarHBondContact O-N 3.32Å; E650-T653 PolarHBondContact O-N 3.17Å; E650-F654 WeakPolarHBondContact O-CD2 3.36Å; E650-F654 PolarHBondContact O-N 3.02Å; E650-K656 CarbonylContact C-O 3.52Å; E650-T658 PolarHBondContact OE1-OG1 2.98Å; E650-T658 PolarHBondContact OE2-N 2.9Å; E650-T658 PolarHBondContact OE2-OG1 3.24Å
651	A	95.5	Very high	93.9	Very high	21 Å²	21	39.6 Å²	39.6	17%	0.174	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-47	-177.2	0	0	0	0	0	112.1	R647 A648 T653 N655 V657 Y724	R647-A651 PolarHBondContact O-N 3.13Å; R647-A651 VanDerWaalsContact O-N 3.14Å; A648-A651 PolarHBondContact O-N 3.3Å; A651-T653 VanDerWaalsContact C-N 3.34Å; A651-T653 PolarHBondContact O-N 2.96Å; A651-N655 VanDerWaalsContact O-CA 3.23Å; A651-N655 WeakPolarHBondContact O-CA 3.46Å; A651-N655 PolarHBondContact O-N 3.37Å; A651-V657 HydrophobicContact CB-CG1 4.08Å; A651-Y724 WeakPolarHBondContact CB-OH 3.27Å
652	I	95.3	Very high	93.6	Very high	26 Å²	26	46.2 Å²	46.2	13%	0.133	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-38.4	179.2	-68	162.9	0	0	0	111.7	A648 E728 L731 L732	A648-I652 WeakPolarHBondContact O-CB 3.43Å; A648-I652 WeakPolarHBondContact O-CD1 3.41Å; A648-I652 VanDerWaalsContact O-CG1 3.28Å; A648-I652 WeakPolarHBondContact O-CG1 3.5Å; A648-I652 PolarHBondContact O-N 3.49Å; I652-E728 HydrophobicContact CD1-CG 4.38Å; I652-L731 HydrophobicContact CD1-CB 3.52Å; I652-L731 HydrophobicContact CD1-CD1 4.23Å; I652-L732 HydrophobicContact CD1-CD2 4.29Å; I652-L732 HydrophobicContact CD1-CG 3.99Å; I652-L732 HydrophobicContact CG1-CD2 4.1Å; I652-L732 HydrophobicContact CG1-CG 4.23Å; I652-L732 HydrophobicContact CG2-CD2 3.76Å
653	T	95.4	Very high	93.3	Very high	35 Å²	35	49.1 Å²	49.1	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-87.9	-43.4	-171.3	-50.9	0	0	0	0	112.8	F587 A649 E650 A651	F587-T653 HydrophobicContact CD1-CG2 3.59Å; F587-T653 WeakPolarHBondContact CD1-OG1 3.34Å; F587-T653 HydrophobicContact CD2-CG2 4.39Å; F587-T653 HydrophobicContact CE1-CG2 3.57Å; F587-T653 HydrophobicContact CE2-CG2 4.38Å; F587-T653 HydrophobicContact CG-CG2 4.02Å; F587-T653 HydrophobicContact CZ-CG2 3.99Å; A649-T653 VanDerWaalsContact O-CB 3.26Å; A649-T653 WeakPolarHBondContact O-CB 3.28Å; A649-T653 PolarHBondContact O-N 3.31Å; A649-T653 VanDerWaalsContact O-N 3.09Å; A649-T653 PolarHBondContact O-OG1 3.48Å; E650-T653 PolarHBondContact O-N 3.17Å; A651-T653 VanDerWaalsContact C-N 3.34Å; A651-T653 PolarHBondContact O-N 2.96Å
654	F	94.1	Very high	93.3	Very high	55 Å²	55	49.1 Å²	49.1	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-109.8	-7.7	-171.2	-52.9	-69.4	0	0	0	113.8	R583 V584 F587 E650 K656	R583-F654 HydrophobicContact CG-CE1 4.16Å; R583-F654 HydrophobicContact CG-CZ 4.05Å; V584-F654 HydrophobicContact CB-CE2 4.24Å; V584-F654 HydrophobicContact CG1-CE2 4.35Å; V584-F654 HydrophobicContact CG2-CD2 4.19Å; V584-F654 HydrophobicContact CG2-CE1 4.36Å; V584-F654 HydrophobicContact CG2-CE2 3.92Å; V584-F654 HydrophobicContact CG2-CZ 4.02Å; F587-F654 HydrophobicContact CB-CE2 3.82Å; F587-F654 HydrophobicContact CB-CZ 4.05Å; F587-F654 HydrophobicContact CD2-CE2 4.45Å; F587-F654 AromaticContact CD2-CZ 3.81Å; F587-F654 HydrophobicContact CD2-CZ 3.81Å; F587-F654 HydrophobicContact CG-CE2 4.21Å; F587-F654 HydrophobicContact CG-CZ 4Å; E650-F654 WeakPolarHBondContact O-CD2 3.36Å; E650-F654 PolarHBondContact O-N 3.02Å; F654-K656 HydrophobicContact CB-CB 4.37Å; F654-K656 PolarHBondContact O-N 3.32Å; F654-K656 VanDerWaalsContact O-N 3.13Å
655	N	93.2	Very high	93.2	Very high	153 Å²	153	51.8 Å²	51.8	82%	0.818	28%	0.282	S	S	*	.	S	Bend	trans	50.4	32	-170.8	-160.3	16.1	0	0	0	112.9	A651	A651-N655 VanDerWaalsContact O-CA 3.23Å; A651-N655 WeakPolarHBondContact O-CA 3.46Å; A651-N655 PolarHBondContact O-N 3.37Å
656	K	91.1	Very high	93.1	Very high	164 Å²	164	59.8 Å²	59.8	71%	0.713	31%	0.312	S	S	*	.			trans	-147.2	151.2	-177.6	-69	177.1	-174.8	174.9	0	107.5	E650 F654	E650-K656 CarbonylContact C-O 3.52Å; F654-K656 HydrophobicContact CB-CB 4.37Å; F654-K656 PolarHBondContact O-N 3.32Å; F654-K656 VanDerWaalsContact O-N 3.13Å
657	V	92.1	Very high	92.9	Very high	84 Å²	84	65.4 Å²	65.4	51%	0.509	34%	0.337	S	S	.	.			trans	-125.7	144.9	177.2	-64.9	0	0	0	0	110.6	R647 A651	R647-V657 HydrophobicContact CG-CG1 4.41Å; A651-V657 HydrophobicContact CB-CG1 4.08Å
658	T	92.1	Very high	93	Very high	56 Å²	56	63.6 Å²	63.6	34%	0.344	33%	0.33	S	S	.	.			trans	-102.4	176.1	-178.6	76.6	0	0	0	0	113.1	V584 R647 E650 G660	V584-T658 HydrophobicContact CG1-CG2 3.71Å; R647-T658 PolarHBondContact NH2-O 3.43Å; E650-T658 PolarHBondContact OE1-OG1 2.98Å; E650-T658 PolarHBondContact OE2-N 2.9Å; E650-T658 PolarHBondContact OE2-OG1 3.24Å; T658-G660 VanDerWaalsContact C-N 3.29Å; T658-G660 PolarHBondContact OG1-N 3.15Å
659	T	90.5	Very high	92.9	Very high	124 Å²	124	66.1 Å²	66.1	76%	0.761	35%	0.346	S	S	*	.	S	Bend	trans	-78.5	-9.3	166.6	49.1	0	0	0	0	113.1	A661 Q662	T659-A661 PolarHBondContact O-N 3.24Å; T659-Q662 WeakPolarHBondContact O-CB 3.29Å; T659-Q662 PolarHBondContact O-N 2.86Å
660	G	86.3	Confident	92.8	Very high	41 Å²	41	73.4 Å²	73.4	42%	0.423	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-45.1	-176.8	0	0	0	0	0	113	T658 Q662	T658-G660 VanDerWaalsContact C-N 3.29Å; T658-G660 PolarHBondContact OG1-N 3.15Å; G660-Q662 PolarHBondContact O-N 3.14Å
661	A	89.9	Confident	92.8	Very high	1 Å²	1	74.9 Å²	74.9	1%	0.008	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	23	178.5	0	0	0	0	0	114.6	R647 T659 L665	R647-A661 HydrophobicContact CB-CB 3.82Å; R647-A661 HydrophobicContact CG-CB 4.49Å; T659-A661 PolarHBondContact O-N 3.24Å; A661-L665 WeakPolarHBondContact O-CB 3.28Å; A661-L665 VanDerWaalsContact O-CG 3.28Å; A661-L665 WeakPolarHBondContact O-CG 3.46Å; A661-L665 PolarHBondContact O-N 2.93Å; A661-L665 VanDerWaalsContact O-N 3.16Å
662	Q	90.9	Very high	92.8	Very high	138 Å²	138	73.9 Å²	73.9	65%	0.645	37%	0.374	S	S	*	.	H	α-helix	trans	-64.5	-43.7	176.8	177.4	177.8	-4.8	0	0	111.3	T659 G660 R666	T659-Q662 WeakPolarHBondContact O-CB 3.29Å; T659-Q662 PolarHBondContact O-N 2.86Å; G660-Q662 PolarHBondContact O-N 3.14Å; Q662-R666 WeakPolarHBondContact O-CB 3.34Å; Q662-R666 PolarHBondContact O-N 3.12Å
663	D	88.9	Confident	92.8	Very high	69 Å²	69	76.7 Å²	76.7	37%	0.369	38%	0.384	S	S	.	.	H	α-helix	trans	-69.1	-34.9	-178	-85.2	-29.7	0	0	0	112.5	R666 K667	D663-R666 WeakPolarHBondContact O-CB 3.33Å; D663-R666 PolarHBondContact O-N 2.96Å; D663-R666 IonicContact OD1-CZ 3.53Å; D663-R666 VanDerWaalsContact OD1-CZ 3.32Å; D663-R666 IonicContact OD1-NE 3.8Å; D663-R666 PolarHBondContact OD1-NE 3.35Å; D663-R666 IonicContact OD1-NH2 3.74Å; D663-R666 PolarHBondContact OD1-NH2 3.26Å; D663-K667 VanDerWaalsContact O-CG 3.31Å; D663-K667 WeakPolarHBondContact O-CG 3.46Å; D663-K667 PolarHBondContact O-N 3.33Å
664	D	93.1	Very high	92.7	Very high	18 Å²	18	75.6 Å²	75.6	10%	0.096	38%	0.377	C	S	.	.	H	α-helix	trans	-75.5	-38.2	179.4	-47.8	-67	0	0	0	111.8	A643 R666 K667 V668	A643-D664 HydrophobicContact CB-CB 4.38Å; A643-D664 WeakPolarHBondContact O-CB 3.45Å; D664-R666 PolarHBondContact O-N 3.29Å; D664-K667 PolarHBondContact O-N 3Å; D664-K667 IonicContact OD1-NZ 3.64Å; D664-K667 PolarHBondContact OD1-NZ 3.38Å; D664-V668 VanDerWaalsContact O-CB 3.28Å; D664-V668 WeakPolarHBondContact O-CB 3.35Å; D664-V668 WeakPolarHBondContact O-CG2 3.37Å; D664-V668 PolarHBondContact O-N 2.99Å
665	L	94.3	Very high	92.7	Very high	60 Å²	60	73.1 Å²	73.1	31%	0.314	37%	0.367	S	S	.	.	H	α-helix	trans	-57.2	-39.9	167	-73.5	178.3	0	0	0	111.6	L644 A661 T669	L644-L665 HydrophobicContact CD2-CD2 4.03Å; A661-L665 WeakPolarHBondContact O-CB 3.28Å; A661-L665 VanDerWaalsContact O-CG 3.28Å; A661-L665 WeakPolarHBondContact O-CG 3.46Å; A661-L665 PolarHBondContact O-N 2.93Å; A661-L665 VanDerWaalsContact O-N 3.16Å; L665-T669 WeakPolarHBondContact O-CB 3.4Å; L665-T669 PolarHBondContact O-N 2.96Å; L665-T669 PolarHBondContact O-OG1 3.36Å
666	R	93.5	Very high	92.7	Very high	168 Å²	168	66 Å²	66	63%	0.634	33%	0.329	S	S	*	.	H	α-helix	trans	-64.9	-45.4	175.9	179.5	169.3	63.5	142.5	-1.4	112.1	Q662 D663 D664 R670	Q662-R666 WeakPolarHBondContact O-CB 3.34Å; Q662-R666 PolarHBondContact O-N 3.12Å; D663-R666 WeakPolarHBondContact O-CB 3.33Å; D663-R666 PolarHBondContact O-N 2.96Å; D663-R666 IonicContact OD1-CZ 3.53Å; D663-R666 VanDerWaalsContact OD1-CZ 3.32Å; D663-R666 IonicContact OD1-NE 3.8Å; D663-R666 PolarHBondContact OD1-NE 3.35Å; D663-R666 IonicContact OD1-NH2 3.74Å; D663-R666 PolarHBondContact OD1-NH2 3.26Å; D664-R666 PolarHBondContact O-N 3.29Å; R666-R670 PolarHBondContact O-N 3.45Å
667	K	91.9	Very high	92.7	Very high	117 Å²	117	59.8 Å²	59.8	51%	0.509	30%	0.302	S	S	.	.	H	α-helix	trans	-59.2	-51.9	174.4	-67.1	165.8	-159	161.3	0	111.2	D663 D664 T669 R670 V671	D663-K667 VanDerWaalsContact O-CG 3.31Å; D663-K667 WeakPolarHBondContact O-CG 3.46Å; D663-K667 PolarHBondContact O-N 3.33Å; D664-K667 PolarHBondContact O-N 3Å; D664-K667 IonicContact OD1-NZ 3.64Å; D664-K667 PolarHBondContact OD1-NZ 3.38Å; K667-T669 VanDerWaalsContact C-N 3.35Å; K667-T669 PolarHBondContact O-N 3.17Å; K667-R670 PolarHBondContact O-N 3.07Å; K667-V671 WeakPolarHBondContact O-CG2 3.37Å; K667-V671 PolarHBondContact O-N 2.82Å
668	V	96.3	Very high	92.7	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.012	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-44.4	-179.7	169.5	0	0	0	0	111.3	M640 A643 L644 D664 V671 A672 I720	M640-V668 HydrophobicContact CB-CG1 4.35Å; M640-V668 HydrophobicContact CE-CG1 3.83Å; M640-V668 HydrophobicContact CG-CG1 4.38Å; A643-V668 HydrophobicContact CB-CG2 3.47Å; A643-V668 VanDerWaalsContact CB-CG2 3.47Å; L644-V668 HydrophobicContact CD1-CG1 4.15Å; L644-V668 HydrophobicContact CD2-CB 4.48Å; L644-V668 HydrophobicContact CD2-CG1 4.12Å; L644-V668 HydrophobicContact CD2-CG2 4.06Å; L644-V668 HydrophobicContact CG-CG1 4.14Å; L644-V668 HydrophobicContact CG-CG2 3.9Å; D664-V668 VanDerWaalsContact O-CB 3.28Å; D664-V668 WeakPolarHBondContact O-CB 3.35Å; D664-V668 WeakPolarHBondContact O-CG2 3.37Å; D664-V668 PolarHBondContact O-N 2.99Å; V668-V671 PolarHBondContact O-N 3.33Å; V668-A672 WeakPolarHBondContact O-CB 3.43Å; V668-A672 PolarHBondContact O-N 2.89Å; V668-I720 HydrophobicContact CG1-CB 4.5Å; V668-I720 HydrophobicContact CG1-CD1 4.44Å; V668-I720 HydrophobicContact CG1-CG1 3.94Å; V668-I720 HydrophobicContact CG1-CG2 3.98Å
669	T	95.4	Very high	92.7	Very high	54 Å²	54	61.1 Å²	61.1	33%	0.331	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-45.2	176.4	-59	0	0	0	0	110.9	L665 K667 A672 Y673	L665-T669 WeakPolarHBondContact O-CB 3.4Å; L665-T669 PolarHBondContact O-N 2.96Å; L665-T669 PolarHBondContact O-OG1 3.36Å; K667-T669 VanDerWaalsContact C-N 3.35Å; K667-T669 PolarHBondContact O-N 3.17Å; T669-A672 PolarHBondContact O-N 3.11Å; T669-Y673 HydrophobicContact CG2-CD2 3.68Å; T669-Y673 HydrophobicContact CG2-CE2 3.63Å; T669-Y673 VanDerWaalsContact O-CD2 3.29Å; T669-Y673 WeakPolarHBondContact O-CD2 3.03Å; T669-Y673 PolarHBondContact O-N 2.94Å
670	R	94.4	Very high	92.8	Very high	153 Å²	153	55.9 Å²	55.9	58%	0.577	26%	0.264	S	S	*	.	H	α-helix	trans	-60	-48	176.9	-169.2	179.1	-171.4	-159.6	-1.1	111.8	R666 K667 A672 Y673 S674 E692	R666-R670 PolarHBondContact O-N 3.45Å; K667-R670 PolarHBondContact O-N 3.07Å; R670-A672 PolarHBondContact O-N 3.4Å; R670-Y673 PolarHBondContact O-N 3.43Å; R670-S674 PolarHBondContact O-N 3.31Å; R670-S674 PolarHBondContact O-OG 2.95Å; R670-E692 IonicContact CZ-OE1 3.36Å; R670-E692 IonicContact NE-OE1 3.37Å; R670-E692 IonicContact NH2-OE1 2.65Å; R670-E692 PolarHBondContact NH2-OE1 3.27Å; R670-E692 IonicContact NH2-OE2 3.93Å
671	V	94.9	Very high	93.2	Very high	33 Å²	33	56.1 Å²	56.1	20%	0.2	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-44.8	177.8	174.8	0	0	0	0	111.1	L636 M640 K667 V668 Y673 S674 M675	L636-V671 HydrophobicContact CB-CG1 4.16Å; L636-V671 HydrophobicContact CD2-CG1 4.37Å; M640-V671 HydrophobicContact CG-CB 4.07Å; M640-V671 HydrophobicContact CG-CG1 3.74Å; M640-V671 HydrophobicContact SD-CB 4.47Å; M640-V671 HydrophobicContact SD-CG1 3.94Å; K667-V671 WeakPolarHBondContact O-CG2 3.37Å; K667-V671 PolarHBondContact O-N 2.82Å; V668-V671 PolarHBondContact O-N 3.33Å; V671-Y673 PolarHBondContact O-N 3.34Å; V671-S674 PolarHBondContact O-N 3.36Å; V671-M675 HydrophobicContact CG1-CG 4.36Å; V671-M675 HydrophobicContact CG1-SD 3.99Å; V671-M675 VanDerWaalsContact O-CG 3.31Å; V671-M675 WeakPolarHBondContact O-CG 3.48Å; V671-M675 PolarHBondContact O-N 2.92Å
672	A	95.8	Very high	93.2	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-46	177.1	0	0	0	0	0	112.4	M640 V668 T669 R670 M675 V676 A716 L719 I720	M640-A672 HydrophobicContact CE-CB 3.8Å; M640-A672 HydrophobicContact SD-CB 4.42Å; V668-A672 WeakPolarHBondContact O-CB 3.43Å; V668-A672 PolarHBondContact O-N 2.89Å; T669-A672 PolarHBondContact O-N 3.11Å; R670-A672 PolarHBondContact O-N 3.4Å; A672-M675 PolarHBondContact O-N 3.26Å; A672-V676 WeakPolarHBondContact O-CG2 3.38Å; A672-V676 PolarHBondContact O-N 3.03Å; A672-V676 VanDerWaalsContact O-N 3.09Å; A672-A716 HydrophobicContact CB-CB 4.28Å; A672-L719 HydrophobicContact CB-CD2 4.21Å; A672-I720 HydrophobicContact CB-CD1 3.92Å; A672-I720 HydrophobicContact CB-CG1 3.75Å
673	Y	93.9	Very high	93.2	Very high	86 Å²	86	56.6 Å²	56.6	34%	0.337	26%	0.263	S	S	.	.	H	α-helix	trans	-66.7	-37.8	175.5	-82.5	-72	0	0	0	112.6	T669 R670 V671 V676 K677 D713 A716	T669-Y673 HydrophobicContact CG2-CD2 3.68Å; T669-Y673 HydrophobicContact CG2-CE2 3.63Å; T669-Y673 VanDerWaalsContact O-CD2 3.29Å; T669-Y673 WeakPolarHBondContact O-CD2 3.03Å; T669-Y673 PolarHBondContact O-N 2.94Å; R670-Y673 PolarHBondContact O-N 3.43Å; V671-Y673 PolarHBondContact O-N 3.34Å; Y673-V676 PolarHBondContact O-N 3.14Å; Y673-K677 WeakPolarHBondContact O-CA 3.46Å; Y673-K677 WeakPolarHBondContact O-CB 3.43Å; Y673-K677 PolarHBondContact O-N 2.96Å; Y673-D713 WeakPolarHBondContact CE1-OD1 3.33Å; Y673-D713 PolarHBondContact OH-OD1 3.38Å; Y673-A716 HydrophobicContact CD1-CB 4.28Å; Y673-A716 HydrophobicContact CE1-CB 4.1Å; Y673-A716 HydrophobicContact CE2-CB 4.4Å
674	S	93.8	Very high	93.3	Very high	12 Å²	12	56.3 Å²	56.3	8%	0.084	27%	0.266	C	S	.	.	I	π-helix	trans	-61.8	-44.7	173.4	-70.9	0	0	0	0	111.9	R670 V671 V676 Q678 Y679	R670-S674 PolarHBondContact O-N 3.31Å; R670-S674 PolarHBondContact O-OG 2.95Å; V671-S674 PolarHBondContact O-N 3.36Å; S674-V676 VanDerWaalsContact C-N 3.34Å; S674-V676 PolarHBondContact O-N 3.07Å; S674-Q678 VanDerWaalsContact CB-OE1 3.23Å; S674-Q678 WeakPolarHBondContact O-CA 3.37Å; S674-Q678 WeakPolarHBondContact O-CB 3.17Å; S674-Q678 PolarHBondContact O-N 2.82Å; S674-Q678 PolarHBondContact OG-OE1 3.49Å; S674-Y679 PolarHBondContact O-N 3.43Å
675	M	94.4	Very high	93.1	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.015	27%	0.267	C	S	.	.	I	π-helix	trans	-58.9	-42.4	176.1	-70.9	176.5	74	0	0	112.7	K633 L636 M640 V671 A672 Y679 G680 M681 L719	K633-M675 HydrophobicContact CG-CE 3.97Å; L636-M675 HydrophobicContact CB-CE 4.04Å; L636-M675 HydrophobicContact CB-CG 4.23Å; L636-M675 HydrophobicContact CB-SD 3.56Å; L636-M675 VanDerWaalsContact CB-SD 3.56Å; L636-M675 HydrophobicContact CD1-CG 3.67Å; L636-M675 HydrophobicContact CD1-SD 4.15Å; M640-M675 HydrophobicContact SD-SD 4.01Å; V671-M675 HydrophobicContact CG1-CG 4.36Å; V671-M675 HydrophobicContact CG1-SD 3.99Å; V671-M675 VanDerWaalsContact O-CG 3.31Å; V671-M675 WeakPolarHBondContact O-CG 3.48Å; V671-M675 PolarHBondContact O-N 2.92Å; A672-M675 PolarHBondContact O-N 3.26Å; M675-Y679 HydrophobicContact CG-CD2 4.39Å; M675-G680 PolarHBondContact O-N 2.9Å; M675-M681 HydrophobicContact CB-CB 4.35Å; M675-M681 HydrophobicContact CB-SD 4.37Å; M675-M681 HydrophobicContact CE-SD 3.99Å; M675-M681 HydrophobicContact CG-SD 3.97Å; M675-M681 WeakPolarHBondContact O-CB 3.49Å; M675-M681 PolarHBondContact O-N 2.88Å; M675-L719 HydrophobicContact CB-CD2 4.33Å; M675-L719 HydrophobicContact CE-CD2 4.11Å; M675-L719 HydrophobicContact SD-CD2 3.85Å
676	V	93.9	Very high	92.9	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.018	26%	0.264	C	S	.	.	I	π-helix	trans	-81.9	-41	-176.9	176.2	0	0	0	0	112.9	A672 Y673 S674 C682 V685 M712 E715 A716	A672-V676 WeakPolarHBondContact O-CG2 3.38Å; A672-V676 PolarHBondContact O-N 3.03Å; A672-V676 VanDerWaalsContact O-N 3.09Å; Y673-V676 PolarHBondContact O-N 3.14Å; S674-V676 VanDerWaalsContact C-N 3.34Å; S674-V676 PolarHBondContact O-N 3.07Å; V676-C682 HydrophobicContact CG1-CB 4.36Å; V676-C682 HydrophobicContact CG2-CB 4.16Å; V676-V685 HydrophobicContact CG1-CG2 3.98Å; V676-M712 HydrophobicContact CG1-CB 3.9Å; V676-M712 HydrophobicContact CG1-CG 3.91Å; V676-E715 HydrophobicContact CG1-CB 4.39Å; V676-E715 HydrophobicContact CG2-CB 4.32Å; V676-A716 HydrophobicContact CG2-CB 4.48Å
677	K	91	Very high	92.9	Very high	34 Å²	34	55.9 Å²	55.9	15%	0.148	28%	0.277	C	S	.	.	I	π-helix	trans	-99.5	-34.1	-169.9	-177.2	-174	165.4	-166.6	0	114.2	Y673 F690 P691	Y673-K677 WeakPolarHBondContact O-CA 3.46Å; Y673-K677 WeakPolarHBondContact O-CB 3.43Å; Y673-K677 PolarHBondContact O-N 2.96Å; K677-F690 HydrophobicContact CD-CB 4.42Å; K677-F690 HydrophobicContact CG-CB 3.83Å; K677-F690 HydrophobicContact CG-CD2 4.23Å; K677-F690 HydrophobicContact CG-CG 4.47Å; K677-F690 PolarHBondContact O-N 3.06Å; K677-P691 WeakPolarHBondContact CE-O 3.48Å; K677-P691 PolarHBondContact NZ-O 3.04Å
678	Q	91.1	Very high	92.8	Very high	37 Å²	37	53.6 Å²	53.6	17%	0.173	27%	0.272	C	S	.	.	I	π-helix	trans	-104	-43.5	-172.9	-65.3	173.4	-27.3	0	0	112.1	S674 S689 E692	S674-Q678 VanDerWaalsContact CB-OE1 3.23Å; S674-Q678 WeakPolarHBondContact O-CA 3.37Å; S674-Q678 WeakPolarHBondContact O-CB 3.17Å; S674-Q678 PolarHBondContact O-N 2.82Å; S674-Q678 PolarHBondContact OG-OE1 3.49Å; Q678-S689 WeakPolarHBondContact O-CB 3.29Å; Q678-S689 PolarHBondContact O-OG 3.42Å; Q678-E692 PolarHBondContact NE2-OE2 3.37Å
679	Y	92.8	Very high	92.5	Very high	131 Å²	131	57.5 Å²	57.5	51%	0.514	30%	0.3	S	S	.	.	S	Bend	trans	-95.7	-7.9	-172.7	-53.5	-32.5	0	0	0	114.5	L636 S674 M675 M681	L636-Y679 HydrophobicContact CD1-CD2 3.9Å; L636-Y679 HydrophobicContact CD1-CE2 3.89Å; S674-Y679 PolarHBondContact O-N 3.43Å; M675-Y679 HydrophobicContact CG-CD2 4.39Å; Y679-M681 VanDerWaalsContact C-N 3.27Å; Y679-M681 HydrophobicContact CD2-CE 4.18Å; Y679-M681 HydrophobicContact CD2-SD 4.36Å; Y679-M681 HydrophobicContact CG-CE 4.4Å; Y679-M681 PolarHBondContact O-N 3.44Å
680	G	92.6	Very high	92.2	Very high	14 Å²	14	56 Å²	56	14%	0.144	29%	0.289	C	S	.	.			trans	62.3	28.7	178.7	0	0	0	0	0	114.5	M675 C682	M675-G680 PolarHBondContact O-N 2.9Å; G680-C682 PolarHBondContact O-N 2.87Å
681	M	93.6	Very high	91.4	Very high	45 Å²	45	53.3 Å²	53.3	22%	0.222	29%	0.291	C	S	.	.			trans	-83.2	7.2	-175.4	-65.1	-177.3	173.7	0	0	114	K633 L636 M675 Y679	K633-M681 HydrophobicContact CB-SD 4.22Å; K633-M681 HydrophobicContact CD-CB 4.44Å; K633-M681 WeakPolarHBondContact CE-O 3.46Å; K633-M681 PolarHBondContact NZ-O 3.26Å; L636-M681 HydrophobicContact CD1-CE 3.86Å; L636-M681 HydrophobicContact CD1-SD 3.84Å; M675-M681 HydrophobicContact CB-CB 4.35Å; M675-M681 HydrophobicContact CB-SD 4.37Å; M675-M681 HydrophobicContact CE-SD 3.99Å; M675-M681 HydrophobicContact CG-SD 3.97Å; M675-M681 WeakPolarHBondContact O-CB 3.49Å; M675-M681 PolarHBondContact O-N 2.88Å; Y679-M681 VanDerWaalsContact C-N 3.27Å; Y679-M681 HydrophobicContact CD2-CE 4.18Å; Y679-M681 HydrophobicContact CD2-SD 4.36Å; Y679-M681 HydrophobicContact CG-CE 4.4Å; Y679-M681 PolarHBondContact O-N 3.44Å
682	C	91.4	Very high	90.3	Very high	11 Å²	11	56.5 Å²	56.5	7%	0.074	30%	0.304	C	S	.	.			trans	-113.1	119.1	-177.6	176.8	0	0	0	0	110.5	V676 G680 S684 V685 G686 E715	V676-C682 HydrophobicContact CG1-CB 4.36Å; V676-C682 HydrophobicContact CG2-CB 4.16Å; G680-C682 PolarHBondContact O-N 2.87Å; C682-S684 VanDerWaalsContact C-N 3.28Å; C682-S684 PolarHBondContact O-N 3.45Å; C682-V685 HydrophobicContact CB-CB 4.37Å; C682-V685 PolarHBondContact O-N 3.31Å; C682-G686 PolarHBondContact O-N 3.01Å; C682-E715 VanDerWaalsContact SG-CG 3.54Å
683	D	90.2	Very high	88.8	Confident	139 Å²	139	61.2 Å²	61.2	74%	0.743	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-33.6	-173.1	-45	-67.9	0	0	0	111.9	K633	K633-D683 IonicContact NZ-OD2 3.97Å
684	S	90.5	Very high	86.9	Confident	63 Å²	63	62.3 Å²	62.3	44%	0.441	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-34.4	177.6	-47.4	0	0	0	0	113.8	C682 Q711 E715	C682-S684 VanDerWaalsContact C-N 3.28Å; C682-S684 PolarHBondContact O-N 3.45Å; S684-Q711 PolarHBondContact O-NE2 2.95Å; S684-E715 VanDerWaalsContact CB-OE1 3.23Å; S684-E715 WeakPolarHBondContact CB-OE1 3.5Å; S684-E715 PolarHBondContact OG-OE1 3Å
685	V	90.3	Very high	84.7	Confident	18 Å²	18	71.4 Å²	71.4	11%	0.109	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-27.9	-179.5	174.1	0	0	0	0	111.2	V676 C682 L708 M712	V676-V685 HydrophobicContact CG1-CG2 3.98Å; C682-V685 HydrophobicContact CB-CB 4.37Å; C682-V685 PolarHBondContact O-N 3.31Å; V685-L708 HydrophobicContact CG1-CD1 4.41Å; V685-M712 HydrophobicContact CG1-CE 3.71Å; V685-M712 HydrophobicContact CG1-CG 4.31Å; V685-M712 HydrophobicContact CG2-CG 3.94Å
686	G	90.1	Very high	82.2	Confident	25 Å²	25	76.4 Å²	76.4	26%	0.258	41%	0.406	S	S	.	.			trans	82.6	-177	-179.1	0	0	0	0	0	113.8	C682 V688	C682-G686 PolarHBondContact O-N 3.01Å; G686-V688 PolarHBondContact O-N 3.39Å
687	Q	93	Very high	79.9	Confident	193 Å²	193	80.2 Å²	80.2	90%	0.902	45%	0.445	S	S	*	.	S	Bend	trans	-82	54.7	-174.4	-61.4	176	4.2	0	0	111.9
688	V	90.3	Very high	77.7	Confident	69 Å²	69	82.6 Å²	82.6	42%	0.418	47%	0.471	S	S	.	.			trans	-113.7	135.7	-179.8	-170.9	0	0	0	0	110	G686 F690	G686-V688 PolarHBondContact O-N 3.39Å; V688-F690 HydrophobicContact CB-CE2 3.92Å; V688-F690 HydrophobicContact CB-CZ 4.2Å; V688-F690 HydrophobicContact CG1-CD2 4.25Å; V688-F690 HydrophobicContact CG1-CE1 4.07Å; V688-F690 HydrophobicContact CG1-CE2 3.52Å; V688-F690 HydrophobicContact CG1-CZ 3.44Å; V688-F690 VanDerWaalsContact CG1-CZ 3.44Å
689	S	89.9	Confident	75.7	Confident	85 Å²	85	88.3 Å²	88.3	59%	0.594	51%	0.508	S	S	*	.			trans	-109.9	128.4	176.7	-166.4	0	0	0	0	110.9	Q678	Q678-S689 WeakPolarHBondContact O-CB 3.29Å; Q678-S689 PolarHBondContact O-OG 3.42Å
690	F	87.3	Confident	73.9	Confident	23 Å²	23	84.7 Å²	84.7	10%	0.101	51%	0.511	C	S	.	.			trans	-116.2	131.7	174.1	-56.7	-87.6	0	0	0	110	K677 V688 P703 F704 L708 M712	K677-F690 HydrophobicContact CD-CB 4.42Å; K677-F690 HydrophobicContact CG-CB 3.83Å; K677-F690 HydrophobicContact CG-CD2 4.23Å; K677-F690 HydrophobicContact CG-CG 4.47Å; K677-F690 PolarHBondContact O-N 3.06Å; V688-F690 HydrophobicContact CB-CE2 3.92Å; V688-F690 HydrophobicContact CB-CZ 4.2Å; V688-F690 HydrophobicContact CG1-CD2 4.25Å; V688-F690 HydrophobicContact CG1-CE1 4.07Å; V688-F690 HydrophobicContact CG1-CE2 3.52Å; V688-F690 HydrophobicContact CG1-CZ 3.44Å; V688-F690 VanDerWaalsContact CG1-CZ 3.44Å; F690-P703 HydrophobicContact CD1-CB 4.46Å; F690-P703 HydrophobicContact CD1-CG 4.03Å; F690-F704 HydrophobicContact CB-CD1 4.45Å; F690-F704 AromaticContact CD1-CD1 3.77Å; F690-F704 HydrophobicContact CD1-CD1 3.77Å; F690-F704 HydrophobicContact CE1-CB 4.01Å; F690-F704 HydrophobicContact CE1-CD1 4.13Å; F690-F704 HydrophobicContact CG-CD1 4.05Å; F690-F704 HydrophobicContact CZ-CB 4.37Å; F690-L708 HydrophobicContact CE2-CD2 4.44Å; F690-L708 HydrophobicContact CZ-CD2 3.88Å; F690-M712 HydrophobicContact CD2-CE 3.58Å; F690-M712 HydrophobicContact CE2-CE 3.22Å; F690-M712 HydrophobicContact CZ-CE 3.99Å
691	P	79.6	Confident	72.4	Confident	96 Å²	96	95.9 Å²	95.9	62%	0.623	55%	0.549	S	S	*	.			trans	-59.6	148.8	-177.5	23.6	-33.3	0	0	0	112.2	K677 T693	K677-P691 WeakPolarHBondContact CE-O 3.48Å; K677-P691 PolarHBondContact NZ-O 3.04Å; P691-T693 PolarHBondContact O-N 3.02Å; P691-T693 VanDerWaalsContact O-N 3.16Å
692	E	71.1	Confident	71.5	Confident	100 Å²	100	101.3 Å²	101.3	47%	0.467	57%	0.567	S	S	.	*			trans	-64.2	115.7	166.5	-143.3	162.3	163.9	0	0	107	R670 Q678 Q694	R670-E692 IonicContact CZ-OE1 3.36Å; R670-E692 IonicContact NE-OE1 3.37Å; R670-E692 IonicContact NH2-OE1 2.65Å; R670-E692 PolarHBondContact NH2-OE1 3.27Å; R670-E692 IonicContact NH2-OE2 3.93Å; Q678-E692 PolarHBondContact NE2-OE2 3.37Å; E692-Q694 VanDerWaalsContact C-N 3.3Å; E692-Q694 PolarHBondContact O-N 3Å
693	T	63.9	Low	71	Confident	98 Å²	98	104.7 Å²	104.7	60%	0.601	59%	0.588	S	S	*	*			trans	-70.1	95.7	172.6	-47.8	0	0	0	0	105.7	P691	P691-T693 PolarHBondContact O-N 3.02Å; P691-T693 VanDerWaalsContact O-N 3.16Å
694	Q	54.6	Low	70.8	Confident	110 Å²	110	99.6 Å²	99.6	51%	0.514	56%	0.56	S	S	.	*			trans	-51.9	144.5	172.8	-70.8	-172.4	6.4	0	0	108.9	E692 Q696	E692-Q694 VanDerWaalsContact C-N 3.3Å; E692-Q694 PolarHBondContact O-N 3Å; Q694-Q696 HydrophobicContact CB-CG 4.33Å; Q694-Q696 PolarHBondContact O-N 3.47Å
695	E	46.6	Very low	70.8	Confident	203 Å²	203	100.3 Å²	100.3	95%	0.949	56%	0.564	S	S	*	*	S	Bend	trans	-67.1	20.1	-177.1	-58.1	-178.3	141.6	0	0	114.3	G697	E695-G697 PolarHBondContact O-N 3.49Å; E695-G697 VanDerWaalsContact O-N 3.15Å
696	Q	43.1	Very low	70.8	Confident	108 Å²	108	107 Å²	107	51%	0.505	59%	0.594	S	S	.	*			trans	-68.3	110.7	168.1	-57.6	-169.7	30.8	0	0	107.7	Q694 A698	Q694-Q696 HydrophobicContact CB-CG 4.33Å; Q694-Q696 PolarHBondContact O-N 3.47Å; Q696-A698 PolarHBondContact O-N 3.01Å
697	G	44.3	Very low	70.9	Confident	82 Å²	82	107.8 Å²	107.8	85%	0.845	60%	0.603	S	S	*	*			trans	-66.5	34.4	-169.4	0	0	0	0	0	117.2	E695	E695-G697 PolarHBondContact O-N 3.49Å; E695-G697 VanDerWaalsContact O-N 3.15Å
698	A	46.4	Very low	70.9	Confident	85 Å²	85	100.6 Å²	100.6	70%	0.702	57%	0.57	S	S	*	*			trans	-65.8	135.9	160.8	0	0	0	0	0	109.3	Q696 G700	Q696-A698 PolarHBondContact O-N 3.01Å; A698-G700 PolarHBondContact O-N 3.39Å
699	V	47.6	Very low	70.9	Confident	156 Å²	156	99.4 Å²	99.4	95%	0.945	56%	0.56	S	S	*	*			trans	-74.2	65.9	169.9	-174.5	0	0	0	0	108.8
700	G	55.9	Low	71.1	Confident	55 Å²	55	101.8 Å²	101.8	57%	0.567	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-73.3	127.6	177.9	0	0	0	0	0	110.5	A698 R702	A698-G700 PolarHBondContact O-N 3.39Å; G700-R702 PolarHBondContact O-N 3.34Å
701	R	61.3	Low	71.4	Confident	249 Å²	249	104.4 Å²	104.4	94%	0.94	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-57	125.3	166.3	-84.2	178.3	161.3	162.1	-6.3	108.7
702	R	73.3	Confident	72.1	Confident	160 Å²	160	100 Å²	100	60%	0.604	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-58.8	136.4	171.4	-65.7	179.1	-179.7	156.7	5.8	108.4	G700 F704	G700-R702 PolarHBondContact O-N 3.34Å; R702-F704 HydrophobicContact CB-CD2 4.26Å; R702-F704 HydrophobicContact CB-CE1 4.43Å; R702-F704 HydrophobicContact CB-CE2 3.96Å; R702-F704 HydrophobicContact CB-CZ 4.06Å; R702-F704 HydrophobicContact CG-CE2 4.33Å; R702-F704 HydrophobicContact CG-CZ 4.29Å; R702-F704 PolarHBondContact O-N 3.29Å
703	P	81.6	Confident	73.2	Confident	81 Å²	81	97.9 Å²	97.9	53%	0.526	54%	0.537	S	S	.	.	S	Bend	trans	-75.3	11.3	-177	30.7	-35.6	0	0	0	114	F690	F690-P703 HydrophobicContact CD1-CB 4.46Å; F690-P703 HydrophobicContact CD1-CG 4.03Å
704	F	85.2	Confident	74.7	Confident	33 Å²	33	98.4 Å²	98.4	15%	0.145	53%	0.533	C	S	.	.	S	Bend	trans	-138.6	157.3	-176.7	46.4	-100.7	0	0	0	110.9	F690 R702 L708 Q709	F690-F704 HydrophobicContact CB-CD1 4.45Å; F690-F704 AromaticContact CD1-CD1 3.77Å; F690-F704 HydrophobicContact CD1-CD1 3.77Å; F690-F704 HydrophobicContact CE1-CB 4.01Å; F690-F704 HydrophobicContact CE1-CD1 4.13Å; F690-F704 HydrophobicContact CG-CD1 4.05Å; F690-F704 HydrophobicContact CZ-CB 4.37Å; R702-F704 HydrophobicContact CB-CD2 4.26Å; R702-F704 HydrophobicContact CB-CE1 4.43Å; R702-F704 HydrophobicContact CB-CE2 3.96Å; R702-F704 HydrophobicContact CB-CZ 4.06Å; R702-F704 HydrophobicContact CG-CE2 4.33Å; R702-F704 HydrophobicContact CG-CZ 4.29Å; R702-F704 PolarHBondContact O-N 3.29Å; F704-L708 HydrophobicContact CB-CD2 3.98Å; F704-Q709 HydrophobicContact CD2-CB 3.95Å; F704-Q709 HydrophobicContact CD2-CG 4.42Å; F704-Q709 HydrophobicContact CE2-CB 3.79Å; F704-Q709 HydrophobicContact CE2-CG 3.75Å
705	S	90.6	Very high	76.6	Confident	77 Å²	77	94.8 Å²	94.8	54%	0.538	52%	0.516	S	S	.	.			trans	-72	160.1	177.9	71	0	0	0	0	112.2	G707 L708 Q709	S705-G707 VanDerWaalsContact C-N 3.28Å; S705-G707 PolarHBondContact O-N 3.11Å; S705-L708 PolarHBondContact O-N 3.31Å; S705-L708 PolarHBondContact OG-N 2.89Å; S705-Q709 PolarHBondContact O-N 2.94Å
706	Q	90.3	Very high	79	Confident	158 Å²	158	85.2 Å²	85.2	74%	0.738	47%	0.471	S	S	*	.	H	α-helix	trans	-62.2	-35.3	175.3	-68.3	-175.2	-1.1	0	0	112.5	Q709 Q710	Q706-Q709 WeakPolarHBondContact O-CB 3.43Å; Q706-Q709 PolarHBondContact O-N 3.19Å; Q706-Q710 WeakPolarHBondContact O-CG 3.47Å; Q706-Q710 PolarHBondContact O-N 3.24Å
707	G	93.8	Very high	81.5	Confident	42 Å²	42	87.4 Å²	87.4	43%	0.433	48%	0.479	S	S	.	.	H	α-helix	trans	-64.2	-45.3	176.6	0	0	0	0	0	112.4	S705 Q709 Q710 Q711	S705-G707 VanDerWaalsContact C-N 3.28Å; S705-G707 PolarHBondContact O-N 3.11Å; G707-Q709 VanDerWaalsContact C-N 3.27Å; G707-Q709 PolarHBondContact O-N 3.34Å; G707-Q710 PolarHBondContact O-N 3.18Å; G707-Q711 PolarHBondContact O-N 3.32Å
708	L	91.3	Very high	84	Confident	42 Å²	42	87.6 Å²	87.6	22%	0.22	46%	0.459	C	S	.	.	H	α-helix	trans	-63.8	-35.5	175.6	-176.7	57.9	0	0	0	111.5	V685 F690 F704 S705 Q711 M712	V685-L708 HydrophobicContact CG1-CD1 4.41Å; F690-L708 HydrophobicContact CE2-CD2 4.44Å; F690-L708 HydrophobicContact CZ-CD2 3.88Å; F704-L708 HydrophobicContact CB-CD2 3.98Å; S705-L708 PolarHBondContact O-N 3.31Å; S705-L708 PolarHBondContact OG-N 2.89Å; L708-Q711 WeakPolarHBondContact O-CB 3.42Å; L708-Q711 PolarHBondContact O-N 3.36Å; L708-M712 HydrophobicContact CD1-CE 4.17Å; L708-M712 HydrophobicContact CD2-CE 3.98Å; L708-M712 HydrophobicContact CG-CE 3.76Å; L708-M712 VanDerWaalsContact O-CG 3.32Å; L708-M712 WeakPolarHBondContact O-CG 3.35Å; L708-M712 PolarHBondContact O-N 3.26Å
709	Q	91.6	Very high	86.4	Confident	44 Å²	44	84.4 Å²	84.4	21%	0.206	43%	0.43	C	S	.	.	H	α-helix	trans	-63.3	-48.1	173	-164.3	-162.2	-46.4	0	0	112.2	F704 S705 Q706 G707 Q711 M712 D713	F704-Q709 HydrophobicContact CD2-CB 3.95Å; F704-Q709 HydrophobicContact CD2-CG 4.42Å; F704-Q709 HydrophobicContact CE2-CB 3.79Å; F704-Q709 HydrophobicContact CE2-CG 3.75Å; S705-Q709 PolarHBondContact O-N 2.94Å; Q706-Q709 WeakPolarHBondContact O-CB 3.43Å; Q706-Q709 PolarHBondContact O-N 3.19Å; G707-Q709 VanDerWaalsContact C-N 3.27Å; G707-Q709 PolarHBondContact O-N 3.34Å; Q709-Q711 PolarHBondContact O-N 2.95Å; Q709-M712 WeakPolarHBondContact O-CB 3.38Å; Q709-M712 PolarHBondContact O-N 3.05Å; Q709-M712 VanDerWaalsContact O-N 3.1Å; Q709-D713 PolarHBondContact NE2-OD2 2.92Å; Q709-D713 VanDerWaalsContact NE2-OD2 3.08Å; Q709-D713 WeakPolarHBondContact O-CB 3.47Å; Q709-D713 PolarHBondContact O-N 3.24Å
710	Q	94	Very high	88.8	Confident	136 Å²	136	78.5 Å²	78.5	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-57.8	-36.8	177.4	-72.2	173.7	-2.1	0	0	111.8	Q706 G707 H714	Q706-Q710 WeakPolarHBondContact O-CG 3.47Å; Q706-Q710 PolarHBondContact O-N 3.24Å; G707-Q710 PolarHBondContact O-N 3.18Å; Q710-H714 WeakPolarHBondContact O-CB 3.45Å; Q710-H714 PolarHBondContact O-N 3.25Å
711	Q	93.6	Very high	90.7	Very high	78 Å²	78	77.8 Å²	77.8	36%	0.364	38%	0.382	S	S	.	.	H	α-helix	trans	-66	-46.2	174.6	-168.3	-176.1	-4.6	0	0	112.1	S684 G707 L708 Q709 H714 E715	S684-Q711 PolarHBondContact O-NE2 2.95Å; G707-Q711 PolarHBondContact O-N 3.32Å; L708-Q711 WeakPolarHBondContact O-CB 3.42Å; L708-Q711 PolarHBondContact O-N 3.36Å; Q709-Q711 PolarHBondContact O-N 2.95Å; Q711-H714 PolarHBondContact O-N 3.46Å; Q711-E715 WeakPolarHBondContact O-CG 3.47Å; Q711-E715 PolarHBondContact O-N 2.93Å
712	M	93.3	Very high	92.4	Very high	4 Å²	4	72.4 Å²	72.4	2%	0.02	36%	0.361	C	S	.	.	H	α-helix	trans	-60.5	-45.3	174.5	-69.4	170.5	176.1	0	0	112.3	V676 V685 F690 L708 Q709 H714 E715 A716	V676-M712 HydrophobicContact CG1-CB 3.9Å; V676-M712 HydrophobicContact CG1-CG 3.91Å; V685-M712 HydrophobicContact CG1-CE 3.71Å; V685-M712 HydrophobicContact CG1-CG 4.31Å; V685-M712 HydrophobicContact CG2-CG 3.94Å; F690-M712 HydrophobicContact CD2-CE 3.58Å; F690-M712 HydrophobicContact CE2-CE 3.22Å; F690-M712 HydrophobicContact CZ-CE 3.99Å; L708-M712 HydrophobicContact CD1-CE 4.17Å; L708-M712 HydrophobicContact CD2-CE 3.98Å; L708-M712 HydrophobicContact CG-CE 3.76Å; L708-M712 VanDerWaalsContact O-CG 3.32Å; L708-M712 WeakPolarHBondContact O-CG 3.35Å; L708-M712 PolarHBondContact O-N 3.26Å; Q709-M712 WeakPolarHBondContact O-CB 3.38Å; Q709-M712 PolarHBondContact O-N 3.05Å; Q709-M712 VanDerWaalsContact O-N 3.1Å; M712-H714 VanDerWaalsContact C-N 3.3Å; M712-H714 PolarHBondContact O-N 2.81Å; M712-E715 PolarHBondContact O-N 3.35Å; M712-A716 WeakPolarHBondContact O-CB 3.39Å; M712-A716 PolarHBondContact O-N 3.26Å
713	D	94.6	Very high	93.6	Very high	54 Å²	54	64.8 Å²	64.8	29%	0.289	33%	0.333	S	S	.	.	H	α-helix	trans	-63.3	-37.8	179.8	-63	-12.2	0	0	0	110.5	Y673 Q709 K717	Y673-D713 WeakPolarHBondContact CE1-OD1 3.33Å; Y673-D713 PolarHBondContact OH-OD1 3.38Å; Q709-D713 PolarHBondContact NE2-OD2 2.92Å; Q709-D713 VanDerWaalsContact NE2-OD2 3.08Å; Q709-D713 WeakPolarHBondContact O-CB 3.47Å; Q709-D713 PolarHBondContact O-N 3.24Å; D713-K717 WeakPolarHBondContact O-CB 3.23Å; D713-K717 PolarHBondContact O-N 3.28Å; D713-K717 VanDerWaalsContact O-N 3.14Å
714	H	95.8	Very high	94.4	Very high	110 Å²	110	63.6 Å²	63.6	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-66.2	-49.5	173.4	-176.2	88.1	0	0	0	112.2	Q710 Q711 M712 A716 K717 M718	Q710-H714 WeakPolarHBondContact O-CB 3.45Å; Q710-H714 PolarHBondContact O-N 3.25Å; Q711-H714 PolarHBondContact O-N 3.46Å; M712-H714 VanDerWaalsContact C-N 3.3Å; M712-H714 PolarHBondContact O-N 2.81Å; H714-A716 PolarHBondContact O-N 3.02Å; H714-K717 WeakPolarHBondContact O-CB 3.33Å; H714-K717 PolarHBondContact O-N 3.43Å; H714-M718 WeakPolarHBondContact O-CG 3.38Å; H714-M718 PolarHBondContact O-N 2.86Å
715	E	95.2	Very high	95	Very high	34 Å²	34	70.9 Å²	70.9	16%	0.159	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-41.9	-179.7	-75.1	-69.2	173.4	0	0	112.3	V676 C682 S684 Q711 M712 K717 M718 L719	V676-E715 HydrophobicContact CG1-CB 4.39Å; V676-E715 HydrophobicContact CG2-CB 4.32Å; C682-E715 VanDerWaalsContact SG-CG 3.54Å; S684-E715 VanDerWaalsContact CB-OE1 3.23Å; S684-E715 WeakPolarHBondContact CB-OE1 3.5Å; S684-E715 PolarHBondContact OG-OE1 3Å; Q711-E715 WeakPolarHBondContact O-CG 3.47Å; Q711-E715 PolarHBondContact O-N 2.93Å; M712-E715 PolarHBondContact O-N 3.35Å; E715-K717 PolarHBondContact O-N 2.63Å; E715-M718 PolarHBondContact O-N 3.19Å; E715-L719 WeakPolarHBondContact O-CB 3.31Å; E715-L719 PolarHBondContact O-N 2.81Å
716	A	95.8	Very high	95.3	Very high	1 Å²	1	71.3 Å²	71.3	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-59.6	-45.6	173.2	0	0	0	0	0	111.2	A672 Y673 V676 M712 H714 M718 L719 I720	A672-A716 HydrophobicContact CB-CB 4.28Å; Y673-A716 HydrophobicContact CD1-CB 4.28Å; Y673-A716 HydrophobicContact CE1-CB 4.1Å; Y673-A716 HydrophobicContact CE2-CB 4.4Å; V676-A716 HydrophobicContact CG2-CB 4.48Å; M712-A716 WeakPolarHBondContact O-CB 3.39Å; M712-A716 PolarHBondContact O-N 3.26Å; H714-A716 PolarHBondContact O-N 3.02Å; A716-M718 PolarHBondContact O-N 2.85Å; A716-L719 PolarHBondContact O-N 2.8Å; A716-I720 VanDerWaalsContact O-CG1 3.26Å; A716-I720 WeakPolarHBondContact O-CG1 3.45Å; A716-I720 PolarHBondContact O-N 3.29Å
717	K	96.5	Very high	95.6	Very high	155 Å²	155	63.8 Å²	63.8	67%	0.674	30%	0.303	S	S	*	.	H	α-helix	trans	-60.7	-42.7	175.2	-176.6	-179.5	178.7	-178.6	0	112.2	D713 H714 E715 I720 A721	D713-K717 WeakPolarHBondContact O-CB 3.23Å; D713-K717 PolarHBondContact O-N 3.28Å; D713-K717 VanDerWaalsContact O-N 3.14Å; H714-K717 WeakPolarHBondContact O-CB 3.33Å; H714-K717 PolarHBondContact O-N 3.43Å; E715-K717 PolarHBondContact O-N 2.63Å; K717-I720 PolarHBondContact O-N 3.22Å; K717-A721 WeakPolarHBondContact O-CB 3.39Å; K717-A721 PolarHBondContact O-N 3.17Å
718	M	96.4	Very high	95.8	Very high	85 Å²	85	65 Å²	65	42%	0.419	30%	0.297	S	S	.	.	H	α-helix	trans	-69.7	-32.8	178.7	-70.8	-58.6	-69.7	0	0	112.7	H714 E715 A716 R722	H714-M718 WeakPolarHBondContact O-CG 3.38Å; H714-M718 PolarHBondContact O-N 2.86Å; E715-M718 PolarHBondContact O-N 3.19Å; A716-M718 PolarHBondContact O-N 2.85Å; M718-R722 WeakPolarHBondContact O-CB 3.49Å; M718-R722 WeakPolarHBondContact O-CG 3.32Å; M718-R722 PolarHBondContact O-N 3.01Å; M718-R722 PolarHBondContact O-NE 2.9Å
719	L	96.3	Very high	96.1	Very high	18 Å²	18	69.2 Å²	69.2	9%	0.094	31%	0.314	C	S	.	.	H	α-helix	trans	-66.4	-46.8	172.6	-174	65	0	0	0	111.4	F637 M640 A672 M675 E715 A716 A721 R722 A723	F637-L719 HydrophobicContact CD2-CD1 4.06Å; F637-L719 HydrophobicContact CE2-CD1 4.44Å; M640-L719 HydrophobicContact CE-CD2 4.22Å; M640-L719 HydrophobicContact CE-CG 3.99Å; M640-L719 HydrophobicContact SD-CD2 4.09Å; M640-L719 HydrophobicContact SD-CG 4.26Å; A672-L719 HydrophobicContact CB-CD2 4.21Å; M675-L719 HydrophobicContact CB-CD2 4.33Å; M675-L719 HydrophobicContact CE-CD2 4.11Å; M675-L719 HydrophobicContact SD-CD2 3.85Å; E715-L719 WeakPolarHBondContact O-CB 3.31Å; E715-L719 PolarHBondContact O-N 2.81Å; A716-L719 PolarHBondContact O-N 2.8Å; L719-A721 PolarHBondContact O-N 2.93Å; L719-R722 PolarHBondContact O-N 3.3Å; L719-A723 PolarHBondContact O-N 3.02Å
720	I	97.5	Very high	96.3	Very high	33 Å²	33	68.6 Å²	68.6	17%	0.169	31%	0.312	C	S	.	.	H	α-helix	trans	-62.6	-42.4	176.6	-62.5	168.2	0	0	0	111	M640 L644 V668 A672 A716 K717 R722 A723 Y724	M640-I720 HydrophobicContact CE-CB 4.43Å; M640-I720 HydrophobicContact CE-CG1 3.71Å; L644-I720 HydrophobicContact CD1-CG2 4.5Å; V668-I720 HydrophobicContact CG1-CB 4.5Å; V668-I720 HydrophobicContact CG1-CD1 4.44Å; V668-I720 HydrophobicContact CG1-CG1 3.94Å; V668-I720 HydrophobicContact CG1-CG2 3.98Å; A672-I720 HydrophobicContact CB-CD1 3.92Å; A672-I720 HydrophobicContact CB-CG1 3.75Å; A716-I720 VanDerWaalsContact O-CG1 3.26Å; A716-I720 WeakPolarHBondContact O-CG1 3.45Å; A716-I720 PolarHBondContact O-N 3.29Å; K717-I720 PolarHBondContact O-N 3.22Å; I720-R722 PolarHBondContact O-N 2.87Å; I720-A723 PolarHBondContact O-N 3Å; I720-Y724 WeakPolarHBondContact O-CB 3.5Å; I720-Y724 PolarHBondContact O-N 2.92Å
721	A	97.5	Very high	96.5	Very high	40 Å²	40	62.1 Å²	62.1	33%	0.331	28%	0.281	S	S	.	.	H	α-helix	trans	-64.2	-37.2	177.2	0	0	0	0	0	112.9	K717 L719 R725	K717-A721 WeakPolarHBondContact O-CB 3.39Å; K717-A721 PolarHBondContact O-N 3.17Å; L719-A721 PolarHBondContact O-N 2.93Å; A721-R725 WeakPolarHBondContact O-CG 3.49Å; A721-R725 PolarHBondContact O-N 2.95Å; A721-R725 VanDerWaalsContact O-N 3.13Å
722	R	97.2	Very high	96.6	Very high	135 Å²	135	62.5 Å²	62.5	51%	0.509	29%	0.285	S	S	.	.	H	α-helix	trans	-65.2	-46.5	172.6	-79	-178.4	-74	-175.4	-5.9	111.7	F637 M718 L719 I720 Y724 R725 H726	F637-R722 HydrophobicContact CE2-CB 4.24Å; M718-R722 WeakPolarHBondContact O-CB 3.49Å; M718-R722 WeakPolarHBondContact O-CG 3.32Å; M718-R722 PolarHBondContact O-N 3.01Å; M718-R722 PolarHBondContact O-NE 2.9Å; L719-R722 PolarHBondContact O-N 3.3Å; I720-R722 PolarHBondContact O-N 2.87Å; R722-Y724 PolarHBondContact O-N 3.28Å; R722-R725 PolarHBondContact O-N 3.44Å; R722-H726 WeakPolarHBondContact O-CB 3.4Å; R722-H726 PolarHBondContact O-N 3.49Å
723	A	97.6	Very high	96.8	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.5	-46	176.6	0	0	0	0	0	111.3	F637 M640 L644 L719 I720 R725 H726 T727	F637-A723 HydrophobicContact CD2-CB 4.32Å; F637-A723 HydrophobicContact CE2-CB 3.79Å; F637-A723 HydrophobicContact CZ-CB 4.22Å; M640-A723 HydrophobicContact CB-CB 4.14Å; M640-A723 HydrophobicContact CE-CB 4.34Å; L644-A723 HydrophobicContact CD1-CB 3.76Å; L719-A723 PolarHBondContact O-N 3.02Å; I720-A723 PolarHBondContact O-N 3Å; A723-R725 PolarHBondContact O-N 2.8Å; A723-H726 PolarHBondContact O-N 3.36Å; A723-T727 PolarHBondContact O-N 3.44Å; A723-T727 PolarHBondContact O-OG1 3.41Å; A723-T727 VanDerWaalsContact O-OG1 3.13Å
724	Y	97.8	Very high	96.8	Very high	56 Å²	56	66.3 Å²	66.3	22%	0.22	31%	0.306	C	S	.	.	H	α-helix	trans	-59.7	-49.1	178.4	-172.1	-95.5	0	0	0	112.6	L644 R647 A648 A651 I720 R722 H726 T727 E728	L644-Y724 HydrophobicContact CB-CD2 4.4Å; L644-Y724 HydrophobicContact CD1-CD2 4.46Å; L644-Y724 HydrophobicContact CD2-CD2 4.35Å; R647-Y724 HydrophobicContact CG-CE2 4.22Å; A648-Y724 HydrophobicContact CB-CE2 4.06Å; A651-Y724 WeakPolarHBondContact CB-OH 3.27Å; I720-Y724 WeakPolarHBondContact O-CB 3.5Å; I720-Y724 PolarHBondContact O-N 2.92Å; R722-Y724 PolarHBondContact O-N 3.28Å; Y724-H726 VanDerWaalsContact C-N 3.29Å; Y724-H726 PolarHBondContact O-N 3.33Å; Y724-T727 PolarHBondContact O-N 3.1Å; Y724-E728 VanDerWaalsContact O-CB 3.31Å; Y724-E728 WeakPolarHBondContact O-CB 3.31Å; Y724-E728 PolarHBondContact O-N 3.08Å
725	R	97.6	Very high	96.8	Very high	186 Å²	186	66.9 Å²	66.9	70%	0.702	30%	0.304	S	S	*	.	H	α-helix	trans	-62.6	-35.3	178	-74.4	178.1	177.4	174.2	-0.3	112.8	A721 R722 A723 K729	A721-R725 WeakPolarHBondContact O-CG 3.49Å; A721-R725 PolarHBondContact O-N 2.95Å; A721-R725 VanDerWaalsContact O-N 3.13Å; R722-R725 PolarHBondContact O-N 3.44Å; A723-R725 PolarHBondContact O-N 2.8Å; R725-K729 WeakPolarHBondContact O-CB 3.1Å; R725-K729 PolarHBondContact O-N 3.31Å
726	H	97.4	Very high	96.8	Very high	86 Å²	86	71.8 Å²	71.8	40%	0.398	33%	0.331	S	S	.	.	H	α-helix	trans	-67.3	-46.7	175.7	-175.5	80.1	0	0	0	111.2	F637 R722 A723 Y724 K729 L730	F637-H726 HydrophobicContact CE1-CB 4.39Å; F637-H726 HydrophobicContact CZ-CB 4.22Å; R722-H726 WeakPolarHBondContact O-CB 3.4Å; R722-H726 PolarHBondContact O-N 3.49Å; A723-H726 PolarHBondContact O-N 3.36Å; Y724-H726 VanDerWaalsContact C-N 3.29Å; Y724-H726 PolarHBondContact O-N 3.33Å; H726-K729 PolarHBondContact O-N 2.89Å; H726-L730 WeakPolarHBondContact O-CB 3.46Å; H726-L730 PolarHBondContact O-N 3.27Å
727	T	97.5	Very high	96.8	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-45.2	173.8	-60.5	0	0	0	0	112.5	V595 C641 A648 A723 Y724 L730 L731	V595-T727 HydrophobicContact CG2-CG2 3.84Å; C641-T727 WeakPolarHBondContact CA-OG1 3.29Å; C641-T727 VanDerWaalsContact CB-OG1 3.25Å; C641-T727 WeakPolarHBondContact CB-OG1 3.5Å; C641-T727 WeakPolarHBondContact O-CG2 3.28Å; C641-T727 PolarHBondContact O-OG1 3.3Å; A648-T727 HydrophobicContact CB-CG2 3.81Å; A723-T727 PolarHBondContact O-N 3.44Å; A723-T727 PolarHBondContact O-OG1 3.41Å; A723-T727 VanDerWaalsContact O-OG1 3.13Å; Y724-T727 PolarHBondContact O-N 3.1Å; T727-L730 PolarHBondContact O-N 2.91Å; T727-L731 HydrophobicContact CG2-CD1 4.05Å; T727-L731 HydrophobicContact CG2-CG 4.47Å; T727-L731 WeakPolarHBondContact O-CB 3.25Å; T727-L731 WeakPolarHBondContact O-CG 3.4Å; T727-L731 PolarHBondContact O-N 3.14Å
728	E	97	Very high	96.8	Very high	68 Å²	68	68 Å²	68	32%	0.318	31%	0.314	S	S	.	.	H	α-helix	trans	-59.1	-48.6	178.3	178.6	175.2	-141.8	0	0	111.2	I652 Y724 L731 L732	I652-E728 HydrophobicContact CD1-CG 4.38Å; Y724-E728 VanDerWaalsContact O-CB 3.31Å; Y724-E728 WeakPolarHBondContact O-CB 3.31Å; Y724-E728 PolarHBondContact O-N 3.08Å; E728-L731 PolarHBondContact O-N 2.85Å; E728-L732 HydrophobicContact CG-CD1 4.09Å; E728-L732 WeakPolarHBondContact O-CB 3.37Å; E728-L732 VanDerWaalsContact O-CG 3.3Å; E728-L732 WeakPolarHBondContact O-CG 3.47Å; E728-L732 PolarHBondContact O-N 3.14Å
729	K	97.7	Very high	96.8	Very high	131 Å²	131	66.2 Å²	66.2	57%	0.57	31%	0.308	S	S	*	.	H	α-helix	trans	-59.3	-49.6	174.8	-175.2	-178.3	175.5	-173.4	0	111.8	R725 H726 L731 L732 D733	R725-K729 WeakPolarHBondContact O-CB 3.1Å; R725-K729 PolarHBondContact O-N 3.31Å; H726-K729 PolarHBondContact O-N 2.89Å; K729-L731 VanDerWaalsContact C-N 3.27Å; K729-L731 PolarHBondContact O-N 3.5Å; K729-L732 PolarHBondContact O-N 3.49Å; K729-L732 VanDerWaalsContact O-N 3.15Å; K729-D733 WeakPolarHBondContact CE-OD2 3.32Å; K729-D733 WeakPolarHBondContact O-CB 3.04Å; K729-D733 VanDerWaalsContact O-CG 3.23Å; K729-D733 PolarHBondContact O-N 3.29Å
730	L	96.6	Very high	96.7	Very high	30 Å²	30	69.1 Å²	69.1	16%	0.157	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-39.2	-178.6	-177.3	66.4	0	0	0	112.7	V595 L598 L599 H726 T727 N734	V595-L730 HydrophobicContact CG1-CD2 4.13Å; V595-L730 HydrophobicContact CG2-CD2 4.41Å; L598-L730 HydrophobicContact CB-CD1 4.24Å; L598-L730 HydrophobicContact CB-CD2 4.24Å; L598-L730 HydrophobicContact CD1-CD1 4.07Å; L598-L730 HydrophobicContact CD1-CG 4.12Å; L599-L730 HydrophobicContact CD1-CD2 4.49Å; L599-L730 HydrophobicContact CD2-CD2 3.85Å; L599-L730 HydrophobicContact CG-CD2 3.9Å; H726-L730 WeakPolarHBondContact O-CB 3.46Å; H726-L730 PolarHBondContact O-N 3.27Å; T727-L730 PolarHBondContact O-N 2.91Å; L730-N734 PolarHBondContact O-N 2.87Å; L730-N734 PolarHBondContact O-ND2 2.99Å
731	L	96.7	Very high	96.6	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-74.5	-34.9	176.8	-74.2	177.5	0	0	0	113.1	L594 V595 A648 A649 I652 T727 E728 K729 N734 R735 L738	L594-L731 HydrophobicContact CB-CD2 4.43Å; L594-L731 HydrophobicContact CD2-CD2 3.89Å; L594-L731 HydrophobicContact CG-CD2 4.36Å; V595-L731 HydrophobicContact CG2-CD1 4.21Å; V595-L731 HydrophobicContact CG2-CD2 3.73Å; V595-L731 HydrophobicContact CG2-CG 3.84Å; A648-L731 HydrophobicContact CB-CD1 3.69Å; A649-L731 HydrophobicContact CB-CD1 4.11Å; I652-L731 HydrophobicContact CD1-CB 3.52Å; I652-L731 HydrophobicContact CD1-CD1 4.23Å; T727-L731 HydrophobicContact CG2-CD1 4.05Å; T727-L731 HydrophobicContact CG2-CG 4.47Å; T727-L731 WeakPolarHBondContact O-CB 3.25Å; T727-L731 WeakPolarHBondContact O-CG 3.4Å; T727-L731 PolarHBondContact O-N 3.14Å; E728-L731 PolarHBondContact O-N 2.85Å; K729-L731 VanDerWaalsContact C-N 3.27Å; K729-L731 PolarHBondContact O-N 3.5Å; L731-N734 CarbonylContact O-C 3.36Å; L731-N734 PolarHBondContact O-N 3.36Å; L731-R735 WeakPolarHBondContact O-CA 3.41Å; L731-R735 PolarHBondContact O-N 3.5Å; L731-L738 HydrophobicContact CD2-CD1 4.24Å; L731-L738 HydrophobicContact CD2-CD2 4.44Å
732	L	96.8	Very high	96.5	Very high	86 Å²	86	65.6 Å²	65.6	45%	0.45	30%	0.3	S	S	.	.	H	α-helix	trans	-64.9	-46.5	172.5	-75	168.8	0	0	0	111.1	I652 E728 K729 N734 R735	I652-L732 HydrophobicContact CD1-CD2 4.29Å; I652-L732 HydrophobicContact CD1-CG 3.99Å; I652-L732 HydrophobicContact CG1-CD2 4.1Å; I652-L732 HydrophobicContact CG1-CG 4.23Å; I652-L732 HydrophobicContact CG2-CD2 3.76Å; E728-L732 HydrophobicContact CG-CD1 4.09Å; E728-L732 WeakPolarHBondContact O-CB 3.37Å; E728-L732 VanDerWaalsContact O-CG 3.3Å; E728-L732 WeakPolarHBondContact O-CG 3.47Å; E728-L732 PolarHBondContact O-N 3.14Å; K729-L732 PolarHBondContact O-N 3.49Å; K729-L732 VanDerWaalsContact O-N 3.15Å; L732-N734 PolarHBondContact O-N 3.45Å; L732-N734 VanDerWaalsContact O-N 3.15Å; L732-R735 PolarHBondContact O-N 2.9Å
733	D	96.4	Very high	96.5	Very high	106 Å²	106	62.4 Å²	62.4	57%	0.567	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.7	177.8	-65.5	-15.2	0	0	0	112.4	K729	K729-D733 WeakPolarHBondContact CE-OD2 3.32Å; K729-D733 WeakPolarHBondContact O-CB 3.04Å; K729-D733 VanDerWaalsContact O-CG 3.23Å; K729-D733 PolarHBondContact O-N 3.29Å
734	N	95.9	Very high	96.3	Very high	32 Å²	32	62.9 Å²	62.9	17%	0.171	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	29	-179.2	-68.2	-95.4	0	0	0	113.3	L594 L598 L730 L731 L732 D736 K737 L738	L594-N734 HydrophobicContact CD2-CB 4.22Å; L598-N734 HydrophobicContact CD1-CB 3.86Å; L730-N734 PolarHBondContact O-N 2.87Å; L730-N734 PolarHBondContact O-ND2 2.99Å; L731-N734 CarbonylContact O-C 3.36Å; L731-N734 PolarHBondContact O-N 3.36Å; L732-N734 PolarHBondContact O-N 3.45Å; L732-N734 VanDerWaalsContact O-N 3.15Å; N734-D736 VanDerWaalsContact C-N 3.26Å; N734-D736 PolarHBondContact O-N 3.49Å; N734-K737 HydrophobicContact CB-CD 4.42Å; N734-K737 WeakPolarHBondContact O-CB 3.5Å; N734-K737 PolarHBondContact O-N 3Å; N734-K737 VanDerWaalsContact O-N 3.14Å; N734-K737 PolarHBondContact OD1-NZ 3.35Å; N734-L738 PolarHBondContact O-N 3.4Å
735	R	95.4	Very high	96.1	Very high	123 Å²	123	60.2 Å²	60.2	46%	0.464	29%	0.286	S	S	.	.	H	α-helix	trans	-56.7	-34.6	-173.3	-176.5	178	179.8	161	5.3	114.4	L731 L732 L738 T739	L731-R735 WeakPolarHBondContact O-CA 3.41Å; L731-R735 PolarHBondContact O-N 3.5Å; L732-R735 PolarHBondContact O-N 2.9Å; R735-L738 WeakPolarHBondContact O-CB 3.42Å; R735-L738 PolarHBondContact O-N 2.74Å; R735-T739 PolarHBondContact O-N 3.45Å; R735-T739 PolarHBondContact O-OG1 3.28Å
736	D	95.7	Very high	95.9	Very high	136 Å²	136	53.9 Å²	53.9	73%	0.727	27%	0.265	S	S	*	.	H	α-helix	trans	-66.9	-42.9	-179.6	-56.9	-37.9	0	0	0	111.1	N734 L738 T739 L740	N734-D736 VanDerWaalsContact C-N 3.26Å; N734-D736 PolarHBondContact O-N 3.49Å; D736-L738 PolarHBondContact O-N 3.13Å; D736-T739 PolarHBondContact O-N 3.37Å; D736-L740 VanDerWaalsContact O-CB 3.32Å; D736-L740 WeakPolarHBondContact O-CB 3.44Å; D736-L740 PolarHBondContact O-N 3.38Å
737	K	95.3	Very high	95.7	Very high	77 Å²	77	57.4 Å²	57.4	34%	0.335	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-40.9	174.5	-69.1	179.5	-175.8	169.6	0	112	L594 N734 T739 L740 L741 L760	L594-K737 HydrophobicContact CD1-CB 3.98Å; L594-K737 HydrophobicContact CD1-CD 4.45Å; L594-K737 HydrophobicContact CD2-CB 4.18Å; N734-K737 HydrophobicContact CB-CD 4.42Å; N734-K737 WeakPolarHBondContact O-CB 3.5Å; N734-K737 PolarHBondContact O-N 3Å; N734-K737 VanDerWaalsContact O-N 3.14Å; N734-K737 PolarHBondContact OD1-NZ 3.35Å; K737-T739 VanDerWaalsContact C-N 3.33Å; K737-T739 PolarHBondContact O-N 3.22Å; K737-L740 PolarHBondContact O-N 3.08Å; K737-L741 WeakPolarHBondContact O-CB 3.36Å; K737-L741 PolarHBondContact O-N 3.46Å; K737-L760 HydrophobicContact CB-CD2 3.82Å; K737-L760 HydrophobicContact CD-CD2 4.43Å; K737-L760 HydrophobicContact CG-CD2 4.13Å
738	L	95.8	Very high	95.3	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60	-45.6	175.3	-179.8	67.2	0	0	0	111	F587 L594 A649 L731 N734 R735 D736 A742	F587-L738 HydrophobicContact CD1-CD2 4.45Å; F587-L738 HydrophobicContact CD1-CG 4.26Å; L594-L738 HydrophobicContact CD2-CB 3.69Å; L594-L738 HydrophobicContact CD2-CD1 4.29Å; A649-L738 HydrophobicContact CB-CD1 4.06Å; A649-L738 HydrophobicContact CB-CD2 3.95Å; L731-L738 HydrophobicContact CD2-CD1 4.24Å; L731-L738 HydrophobicContact CD2-CD2 4.44Å; N734-L738 PolarHBondContact O-N 3.4Å; R735-L738 WeakPolarHBondContact O-CB 3.42Å; R735-L738 PolarHBondContact O-N 2.74Å; D736-L738 PolarHBondContact O-N 3.13Å; L738-A742 VanDerWaalsContact O-CB 3.28Å; L738-A742 WeakPolarHBondContact O-CB 3.25Å; L738-A742 PolarHBondContact O-N 3.25Å
739	T	96.3	Very high	94.8	Very high	47 Å²	47	65.6 Å²	65.6	29%	0.288	32%	0.315	S	S	.	.	H	α-helix	trans	-67.3	-41.7	-179.3	-53.4	0	0	0	0	111.4	F587 R735 D736 K737 A742 N743	F587-T739 HydrophobicContact CZ-CG2 4.32Å; R735-T739 PolarHBondContact O-N 3.45Å; R735-T739 PolarHBondContact O-OG1 3.28Å; D736-T739 PolarHBondContact O-N 3.37Å; K737-T739 VanDerWaalsContact C-N 3.33Å; K737-T739 PolarHBondContact O-N 3.22Å; T739-A742 PolarHBondContact O-N 3.33Å; T739-N743 WeakPolarHBondContact O-CB 3.49Å; T739-N743 PolarHBondContact O-N 3Å; T739-N743 PolarHBondContact O-ND2 3.13Å
740	L	96	Very high	94.4	Very high	79 Å²	79	61.7 Å²	61.7	41%	0.414	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-48.1	177.7	-176.1	156.1	0	0	0	111.6	D736 K737 N743 A744 L759	D736-L740 VanDerWaalsContact O-CB 3.32Å; D736-L740 WeakPolarHBondContact O-CB 3.44Å; D736-L740 PolarHBondContact O-N 3.38Å; K737-L740 PolarHBondContact O-N 3.08Å; L740-N743 PolarHBondContact O-N 3.14Å; L740-A744 PolarHBondContact O-N 2.96Å; L740-L759 HydrophobicContact CD2-CB 3.66Å; L740-L759 HydrophobicContact CD2-CD1 4.5Å; L740-L759 HydrophobicContact CD2-CD2 3.67Å; L740-L759 HydrophobicContact CD2-CG 4.12Å
741	L	95.1	Very high	94	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-69	-36.9	179.5	-163.9	148.6	0	0	0	112.1	S590 A593 K737 A744 L745 I756 L760	S590-L741 WeakPolarHBondContact OG-CD2 3.49Å; A593-L741 HydrophobicContact CB-CD2 4.33Å; K737-L741 WeakPolarHBondContact O-CB 3.36Å; K737-L741 PolarHBondContact O-N 3.46Å; L741-A744 PolarHBondContact O-N 3.44Å; L741-L745 HydrophobicContact CD2-CD1 3.73Å; L741-L745 HydrophobicContact CD2-CG 4.38Å; L741-L745 PolarHBondContact O-N 3.18Å; L741-I756 HydrophobicContact CD1-CG1 4.35Å; L741-I756 HydrophobicContact CD1-CG2 4.1Å; L741-L760 HydrophobicContact CD1-CD1 3.78Å; L741-L760 HydrophobicContact CD1-CD2 4.25Å; L741-L760 HydrophobicContact CD1-CG 4.07Å
742	A	95.4	Very high	93.6	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-38.4	174.5	0	0	0	0	0	112.8	F587 S590 L738 T739 L745 L746	F587-A742 HydrophobicContact CD1-CB 3.85Å; F587-A742 HydrophobicContact CD2-CB 3.64Å; F587-A742 HydrophobicContact CE1-CB 3.82Å; F587-A742 HydrophobicContact CE2-CB 3.61Å; F587-A742 HydrophobicContact CG-CB 3.77Å; F587-A742 HydrophobicContact CZ-CB 3.7Å; S590-A742 WeakPolarHBondContact OG-CA 3.43Å; S590-A742 WeakPolarHBondContact OG-CB 3.2Å; S590-A742 PolarHBondContact OG-N 3.45Å; L738-A742 VanDerWaalsContact O-CB 3.28Å; L738-A742 WeakPolarHBondContact O-CB 3.25Å; L738-A742 PolarHBondContact O-N 3.25Å; T739-A742 PolarHBondContact O-N 3.33Å; A742-L745 PolarHBondContact O-N 3.25Å; A742-L746 WeakPolarHBondContact O-CG 3.24Å; A742-L746 PolarHBondContact O-N 2.99Å
743	N	95.7	Very high	93.1	Very high	68 Å²	68	60.1 Å²	60.1	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-66.6	-43.3	174.4	-70.2	-18.4	0	0	0	111.3	T739 L740 L745 L746 E747	T739-N743 WeakPolarHBondContact O-CB 3.49Å; T739-N743 PolarHBondContact O-N 3Å; T739-N743 PolarHBondContact O-ND2 3.13Å; L740-N743 PolarHBondContact O-N 3.14Å; N743-L745 VanDerWaalsContact C-N 3.31Å; N743-L745 PolarHBondContact O-N 3.35Å; N743-L746 WeakPolarHBondContact O-CB 3.25Å; N743-L746 PolarHBondContact O-N 3.32Å; N743-E747 PolarHBondContact O-N 2.89Å
744	A	94.8	Very high	92.7	Very high	9 Å²	9	60.9 Å²	60.9	7%	0.074	30%	0.297	C	S	.	.	H	α-helix	trans	-60.2	-38.9	175.3	0	0	0	0	0	112.6	L740 L741 E747 R748 V751 L759	L740-A744 PolarHBondContact O-N 2.96Å; L741-A744 PolarHBondContact O-N 3.44Å; A744-E747 PolarHBondContact O-N 3.34Å; A744-R748 WeakPolarHBondContact O-CB 3.31Å; A744-R748 PolarHBondContact O-N 2.91Å; A744-V751 HydrophobicContact CB-CG2 4.37Å; A744-L759 HydrophobicContact CB-CD1 3.61Å
745	L	93.6	Very high	92.3	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.4	-35.4	172.4	-81.7	167.1	0	0	0	113	A586 S590 V608 I610 L741 A742 N743 E747 E749 V751	A586-L745 HydrophobicContact CB-CB 4.3Å; S590-L745 WeakPolarHBondContact OG-CD1 3.22Å; V608-L745 HydrophobicContact CB-CD1 4.36Å; V608-L745 HydrophobicContact CB-CD2 4.05Å; V608-L745 HydrophobicContact CG1-CD1 3.64Å; V608-L745 HydrophobicContact CG1-CD2 3.92Å; V608-L745 HydrophobicContact CG1-CG 4.42Å; I610-L745 VanDerWaalsContact CD1-O 3.25Å; I610-L745 WeakPolarHBondContact CD1-O 3.44Å; I610-L745 HydrophobicContact CG2-CB 4.35Å; I610-L745 HydrophobicContact CG2-CD2 4.44Å; L741-L745 HydrophobicContact CD2-CD1 3.73Å; L741-L745 HydrophobicContact CD2-CG 4.38Å; L741-L745 PolarHBondContact O-N 3.18Å; A742-L745 PolarHBondContact O-N 3.25Å; N743-L745 VanDerWaalsContact C-N 3.31Å; N743-L745 PolarHBondContact O-N 3.35Å; L745-E747 VanDerWaalsContact C-N 3.33Å; L745-E749 WeakPolarHBondContact O-CA 3.48Å; L745-E749 PolarHBondContact O-N 3.27Å; L745-V751 HydrophobicContact CD2-CB 4.05Å; L745-V751 HydrophobicContact CD2-CG2 3.66Å; L745-V751 HydrophobicContact CG-CB 4.46Å; L745-V751 HydrophobicContact CG-CG2 3.81Å
746	L	93.4	Very high	92	Very high	53 Å²	53	55.5 Å²	55.5	28%	0.277	28%	0.277	S	S	.	.	H	α-helix	trans	-70.2	-29.5	175.9	-75.1	169.6	0	0	0	113.2	Q582 R583 A586 I610 A742 N743	Q582-L746 HydrophobicContact CG-CD2 4Å; R583-L746 HydrophobicContact CB-CD1 4.43Å; R583-L746 HydrophobicContact CG-CD1 4.19Å; A586-L746 HydrophobicContact CB-CD1 4.39Å; A586-L746 HydrophobicContact CB-CD2 3.91Å; A586-L746 HydrophobicContact CB-CG 3.76Å; I610-L746 HydrophobicContact CD1-CD2 4.31Å; A742-L746 WeakPolarHBondContact O-CG 3.24Å; A742-L746 PolarHBondContact O-N 2.99Å; N743-L746 WeakPolarHBondContact O-CB 3.25Å; N743-L746 PolarHBondContact O-N 3.32Å
747	E	92.6	Very high	91.7	Very high	161 Å²	161	52.2 Å²	52.2	75%	0.752	26%	0.258	S	S	*	.	H	α-helix	trans	-81.1	-40.3	176.6	-70.9	176.9	-173.9	0	0	113	N743 A744 L745	N743-E747 PolarHBondContact O-N 2.89Å; A744-E747 PolarHBondContact O-N 3.34Å; L745-E747 VanDerWaalsContact C-N 3.33Å
748	R	89.1	Confident	91.5	Very high	138 Å²	138	52.7 Å²	52.7	52%	0.521	28%	0.276	S	S	.	.	H	α-helix	trans	-105.9	-11.9	-170.9	-59.5	-173.7	-178.4	-172.2	4.6	115.2	A744 V750 D755	A744-R748 WeakPolarHBondContact O-CB 3.31Å; A744-R748 PolarHBondContact O-N 2.91Å; R748-V750 WeakPolarHBondContact CB-O 3.28Å; R748-V750 PolarHBondContact O-N 3.29Å; R748-D755 IonicContact CZ-OD1 3.78Å; R748-D755 VanDerWaalsContact NH1-CG 3.35Å; R748-D755 IonicContact NH1-OD1 3.55Å; R748-D755 PolarHBondContact NH1-OD1 3.12Å; R748-D755 IonicContact NH1-OD2 3.49Å
749	E	87.4	Confident	91.2	Very high	102 Å²	102	55.4 Å²	55.4	48%	0.477	29%	0.29	S	S	.	.	S	Bend	trans	58.8	-17.6	-169.3	-55.2	-169	149.7	0	0	116.5	S609 I610 L745	S609-E749 WeakPolarHBondContact CA-O 3.42Å; S609-E749 PolarHBondContact OG-O 3.35Å; S609-E749 VanDerWaalsContact OG-O 3.12Å; I610-E749 HydrophobicContact CG1-CB 4.26Å; I610-E749 PolarHBondContact N-O 3.37Å; I610-E749 VanDerWaalsContact N-O 3.08Å; L745-E749 WeakPolarHBondContact O-CA 3.48Å; L745-E749 PolarHBondContact O-N 3.27Å
750	V	88.2	Confident	90.9	Very high	48 Å²	48	54.2 Å²	54.2	29%	0.291	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	135.3	-175.1	179.4	0	0	0	0	108.6	K607 V608 R748	K607-V750 HydrophobicContact CD-CG1 4.31Å; K607-V750 HydrophobicContact CG-CG1 4.17Å; V608-V750 WeakPolarHBondContact O-CA 3.24Å; R748-V750 WeakPolarHBondContact CB-O 3.28Å; R748-V750 PolarHBondContact O-N 3.29Å
751	V	89.3	Confident	90.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.1	175	178.7	0	0	0	0	107.6	K607 V608 A744 L745 D755 I756 L759	K607-V751 WeakPolarHBondContact CA-O 3.14Å; V608-V751 PolarHBondContact N-O 2.87Å; V608-V751 PolarHBondContact O-N 2.79Å; A744-V751 HydrophobicContact CB-CG2 4.37Å; L745-V751 HydrophobicContact CD2-CB 4.05Å; L745-V751 HydrophobicContact CD2-CG2 3.66Å; L745-V751 HydrophobicContact CG-CB 4.46Å; L745-V751 HydrophobicContact CG-CG2 3.81Å; V751-D755 HydrophobicContact CG1-CB 3.52Å; V751-I756 HydrophobicContact CG1-CG1 3.69Å; V751-L759 HydrophobicContact CG1-CD1 4.26Å
752	N	88.5	Confident	90.2	Very high	67 Å²	67	56.3 Å²	56.3	36%	0.358	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	170	179.7	-60.1	-46.2	0	0	0	111.3	M606 K607 D754 D755 I756	M606-N752 CarbonylContact O-C 3.55Å; K607-N752 VanDerWaalsContact CE-OD1 3.3Å; K607-N752 WeakPolarHBondContact CE-OD1 3.43Å; N752-D754 VanDerWaalsContact C-N 3.31Å; N752-D754 PolarHBondContact O-N 3.13Å; N752-D755 PolarHBondContact N-OD2 2.87Å; N752-D755 VanDerWaalsContact N-OD2 3.12Å; N752-D755 WeakPolarHBondContact O-CA 3.36Å; N752-D755 WeakPolarHBondContact O-CB 3.27Å; N752-D755 PolarHBondContact O-N 2.83Å; N752-I756 WeakPolarHBondContact O-CG1 3.38Å; N752-I756 PolarHBondContact O-N 3.29Å
753	Y	86.3	Confident	89.7	Confident	16 Å²	16	56.6 Å²	56.6	6%	0.063	31%	0.307	C	S	.	.	H	α-helix	trans	-46.3	-51.1	177.2	-177.1	-83.4	0	0	0	113	W597 V605 M606 D755 I756 E757 I770	W597-Y753 HydrophobicContact CH2-CD2 4.21Å; W597-Y753 HydrophobicContact CH2-CE1 4.22Å; W597-Y753 AromaticContact CH2-CE2 3.68Å; W597-Y753 HydrophobicContact CH2-CE2 3.68Å; W597-Y753 AromaticContact CH2-CZ 3.65Å; W597-Y753 AromaticContact CZ3-CD2 3.87Å; W597-Y753 HydrophobicContact CZ3-CD2 3.87Å; W597-Y753 AromaticContact CZ3-CE2 3.51Å; W597-Y753 HydrophobicContact CZ3-CE2 3.51Å; V605-Y753 WeakPolarHBondContact O-CD2 3.35Å; M606-Y753 PolarHBondContact O-N 2.85Å; Y753-D755 VanDerWaalsContact C-N 3.28Å; Y753-D755 PolarHBondContact O-N 2.82Å; Y753-I756 WeakPolarHBondContact O-CB 3.47Å; Y753-I756 PolarHBondContact O-N 3.06Å; Y753-E757 WeakPolarHBondContact CE1-OE2 3.3Å; Y753-E757 PolarHBondContact O-N 3.49Å; Y753-I770 HydrophobicContact CE1-CD1 4.35Å
754	D	86.5	Confident	89.3	Confident	123 Å²	123	57.2 Å²	57.2	66%	0.658	31%	0.314	S	S	*	.	H	α-helix	trans	-62.5	-34.7	-178.4	-48.9	-26.9	0	0	0	112.2	N752 A758	N752-D754 VanDerWaalsContact C-N 3.31Å; N752-D754 PolarHBondContact O-N 3.13Å; D754-A758 VanDerWaalsContact O-CB 3.3Å; D754-A758 WeakPolarHBondContact O-CB 3.47Å; D754-A758 PolarHBondContact O-N 3.02Å
755	D	88.1	Confident	88.8	Confident	41 Å²	41	63 Å²	63	22%	0.219	34%	0.338	C	S	.	.	H	α-helix	trans	-70.2	-39.6	173.7	-62.4	-61.7	0	0	0	111.1	R748 V751 N752 Y753 A758 L759	R748-D755 IonicContact CZ-OD1 3.78Å; R748-D755 VanDerWaalsContact NH1-CG 3.35Å; R748-D755 IonicContact NH1-OD1 3.55Å; R748-D755 PolarHBondContact NH1-OD1 3.12Å; R748-D755 IonicContact NH1-OD2 3.49Å; V751-D755 HydrophobicContact CG1-CB 3.52Å; N752-D755 PolarHBondContact N-OD2 2.87Å; N752-D755 VanDerWaalsContact N-OD2 3.12Å; N752-D755 WeakPolarHBondContact O-CA 3.36Å; N752-D755 WeakPolarHBondContact O-CB 3.27Å; N752-D755 PolarHBondContact O-N 2.83Å; Y753-D755 VanDerWaalsContact C-N 3.28Å; Y753-D755 PolarHBondContact O-N 2.82Å; D755-A758 PolarHBondContact O-N 2.85Å; D755-L759 VanDerWaalsContact O-CB 3.26Å; D755-L759 WeakPolarHBondContact O-CB 2.81Å; D755-L759 WeakPolarHBondContact O-CD1 3.35Å; D755-L759 WeakPolarHBondContact O-CG 3.26Å; D755-L759 PolarHBondContact O-N 3.01Å
756	I	89.1	Confident	88	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-62.9	-44.7	176.3	-61	172.4	0	0	0	110	W597 V605 V608 L741 V751 N752 Y753 L759 L760	W597-I756 HydrophobicContact CD2-CG2 3.81Å; W597-I756 HydrophobicContact CE3-CG2 3.63Å; W597-I756 HydrophobicContact CG-CG2 4.47Å; W597-I756 HydrophobicContact CH2-CB 4.43Å; W597-I756 HydrophobicContact CH2-CG2 4.06Å; W597-I756 HydrophobicContact CZ2-CG2 4.22Å; W597-I756 HydrophobicContact CZ3-CB 4.26Å; W597-I756 HydrophobicContact CZ3-CG2 3.75Å; V605-I756 HydrophobicContact CB-CD1 4.47Å; V605-I756 HydrophobicContact CG1-CD1 3.89Å; V608-I756 HydrophobicContact CG2-CD1 3.99Å; L741-I756 HydrophobicContact CD1-CG1 4.35Å; L741-I756 HydrophobicContact CD1-CG2 4.1Å; V751-I756 HydrophobicContact CG1-CG1 3.69Å; N752-I756 WeakPolarHBondContact O-CG1 3.38Å; N752-I756 PolarHBondContact O-N 3.29Å; Y753-I756 WeakPolarHBondContact O-CB 3.47Å; Y753-I756 PolarHBondContact O-N 3.06Å; I756-L759 PolarHBondContact O-N 3.29Å; I756-L760 HydrophobicContact CG2-CD1 3.71Å; I756-L760 HydrophobicContact CG2-CG 4.13Å; I756-L760 WeakPolarHBondContact O-CB 3.47Å; I756-L760 WeakPolarHBondContact O-CG 3.27Å; I756-L760 PolarHBondContact O-N 2.95Å
757	E	89.9	Confident	86.9	Confident	67 Å²	67	67 Å²	67	31%	0.313	37%	0.374	S	S	.	.	H	α-helix	trans	-65.1	-40.9	177.3	-173.8	158.6	-145.5	0	0	111.8	W597 Y753 L759 G761	W597-E757 HydrophobicContact CH2-CB 3.94Å; W597-E757 HydrophobicContact CZ2-CB 3.93Å; W597-E757 HydrophobicContact CZ2-CG 4.32Å; Y753-E757 WeakPolarHBondContact CE1-OE2 3.3Å; Y753-E757 PolarHBondContact O-N 3.49Å; E757-L759 VanDerWaalsContact C-N 3.31Å; E757-L759 PolarHBondContact O-N 3.27Å; E757-G761 CarbonylContact O-C 3.49Å; E757-G761 WeakPolarHBondContact O-CA 3.23Å; E757-G761 PolarHBondContact O-N 3.48Å
758	A	90.6	Very high	85.7	Confident	87 Å²	87	59.9 Å²	59.9	72%	0.719	34%	0.34	S	S	*	.	H	α-helix	trans	-65.1	-31.1	174.4	0	0	0	0	0	113.5	D754 D755	D754-A758 VanDerWaalsContact O-CB 3.3Å; D754-A758 WeakPolarHBondContact O-CB 3.47Å; D754-A758 PolarHBondContact O-N 3.02Å; D755-A758 PolarHBondContact O-N 2.85Å
759	L	90.4	Very high	84	Confident	57 Å²	57	60.7 Å²	60.7	30%	0.298	35%	0.347	S	S	.	.	H	α-helix	trans	-86.8	-36.7	-178.7	-72.4	170	0	0	0	113.7	L740 A744 V751 D755 I756 E757	L740-L759 HydrophobicContact CD2-CB 3.66Å; L740-L759 HydrophobicContact CD2-CD1 4.5Å; L740-L759 HydrophobicContact CD2-CD2 3.67Å; L740-L759 HydrophobicContact CD2-CG 4.12Å; A744-L759 HydrophobicContact CB-CD1 3.61Å; V751-L759 HydrophobicContact CG1-CD1 4.26Å; D755-L759 VanDerWaalsContact O-CB 3.26Å; D755-L759 WeakPolarHBondContact O-CB 2.81Å; D755-L759 WeakPolarHBondContact O-CD1 3.35Å; D755-L759 WeakPolarHBondContact O-CG 3.26Å; D755-L759 PolarHBondContact O-N 3.01Å; I756-L759 PolarHBondContact O-N 3.29Å; E757-L759 VanDerWaalsContact C-N 3.31Å; E757-L759 PolarHBondContact O-N 3.27Å
760	L	89.4	Confident	82.2	Confident	22 Å²	22	59.6 Å²	59.6	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-103.9	-15.5	-174.3	-60.8	-169.6	0	0	0	114.1	L594 W597 K737 L741 I756	L594-L760 HydrophobicContact CD1-CD1 3.79Å; L594-L760 HydrophobicContact CD1-CD2 4.44Å; W597-L760 HydrophobicContact CB-CD1 4.23Å; W597-L760 HydrophobicContact CD2-CD1 4.44Å; W597-L760 HydrophobicContact CG-CD1 3.89Å; K737-L760 HydrophobicContact CB-CD2 3.82Å; K737-L760 HydrophobicContact CD-CD2 4.43Å; K737-L760 HydrophobicContact CG-CD2 4.13Å; L741-L760 HydrophobicContact CD1-CD1 3.78Å; L741-L760 HydrophobicContact CD1-CD2 4.25Å; L741-L760 HydrophobicContact CD1-CG 4.07Å; I756-L760 HydrophobicContact CG2-CD1 3.71Å; I756-L760 HydrophobicContact CG2-CG 4.13Å; I756-L760 WeakPolarHBondContact O-CB 3.47Å; I756-L760 WeakPolarHBondContact O-CG 3.27Å; I756-L760 PolarHBondContact O-N 2.95Å
761	G	89.1	Confident	80.1	Confident	26 Å²	26	61.5 Å²	61.5	27%	0.268	35%	0.352	S	S	.	.			trans	78.3	173.5	-162.9	0	0	0	0	0	112.6	W597 E757	W597-G761 PolarHBondContact NE1-O 2.99Å; W597-G761 VanDerWaalsContact NE1-O 3.13Å; E757-G761 CarbonylContact O-C 3.49Å; E757-G761 WeakPolarHBondContact O-CA 3.23Å; E757-G761 PolarHBondContact O-N 3.48Å
762	P	86.4	Confident	77.6	Confident	96 Å²	96	68.1 Å²	68.1	62%	0.623	39%	0.386	S	S	*	.	S	Bend	trans	-59.9	148.9	179.6	26	-35.1	0	0	0	111.4
763	P	85.5	Confident	75.2	Confident	7 Å²	7	67.4 Å²	67.4	5%	0.045	39%	0.385	C	S	.	.			trans	-61.6	139.6	-179.9	23.2	-31.9	0	0	0	111.8	W597 F765 G766 K768	W597-P763 HydrophobicContact CD2-CB 4.45Å; W597-P763 HydrophobicContact CZ2-CB 4.4Å; W597-P763 HydrophobicContact CZ2-CG 4.3Å; P763-F765 VanDerWaalsContact C-N 3.25Å; P763-F765 PolarHBondContact O-N 3.42Å; P763-F765 VanDerWaalsContact O-N 3.17Å; P763-G766 VanDerWaalsContact CG-O 3.27Å; P763-G766 WeakPolarHBondContact CG-O 3.41Å; P763-G766 PolarHBondContact O-N 2.67Å; P763-G766 VanDerWaalsContact O-N 3.17Å; P763-K768 HydrophobicContact CB-CD 4.17Å; P763-K768 HydrophobicContact CB-CG 4.09Å; P763-K768 HydrophobicContact CG-CG 4.26Å
764	P	86.4	Confident	73.2	Confident	81 Å²	81	73.3 Å²	73.3	53%	0.526	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-22.5	-167.9	25.2	-34.5	0	0	0	114.5	L598	L598-P764 HydrophobicContact CD2-CG 4.27Å
765	F	84.7	Confident	71	Confident	129 Å²	129	71.1 Å²	71.1	57%	0.566	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	28.6	179.3	-65.1	-76.9	0	0	0	112.7	L598 E600 P763	L598-F765 WeakPolarHBondContact O-CD2 3.44Å; L598-F765 VanDerWaalsContact O-CE2 3.25Å; L598-F765 WeakPolarHBondContact O-CE2 3.28Å; E600-F765 HydrophobicContact CB-CB 4.21Å; E600-F765 HydrophobicContact CB-CD1 4.04Å; E600-F765 HydrophobicContact CB-CD2 3.82Å; E600-F765 HydrophobicContact CB-CE1 4.4Å; E600-F765 HydrophobicContact CB-CE2 4.2Å; E600-F765 HydrophobicContact CB-CG 3.75Å; E600-F765 HydrophobicContact CB-CZ 4.48Å; E600-F765 HydrophobicContact CG-CB 3.95Å; E600-F765 HydrophobicContact CG-CD1 3.97Å; E600-F765 HydrophobicContact CG-CD2 4.45Å; E600-F765 HydrophobicContact CG-CG 3.86Å; P763-F765 VanDerWaalsContact C-N 3.25Å; P763-F765 PolarHBondContact O-N 3.42Å; P763-F765 VanDerWaalsContact O-N 3.17Å
766	G	78	Confident	68.7	Low	34 Å²	34	77 Å²	77	35%	0.351	43%	0.427	S	S	.	.	S	Bend	trans	78.2	169	-174.5	0	0	0	0	0	112.8	P763 K768	P763-G766 VanDerWaalsContact CG-O 3.27Å; P763-G766 WeakPolarHBondContact CG-O 3.41Å; P763-G766 PolarHBondContact O-N 2.67Å; P763-G766 VanDerWaalsContact O-N 3.17Å; G766-K768 PolarHBondContact O-N 3.41Å; G766-K768 VanDerWaalsContact O-N 3.11Å
767	P	69.3	Low	66.6	Low	104 Å²	104	81.2 Å²	81.2	68%	0.675	45%	0.452	S	S	*	.			trans	-55.3	121	-175.5	23.2	-33.6	0	0	0	110	K769	P767-K769 PolarHBondContact O-N 2.86Å
768	K	67.9	Low	64.4	Low	12 Å²	12	82.5 Å²	82.5	5%	0.052	46%	0.458	C	S	.	.			trans	-67.1	86	-179.9	-78.1	175.6	163.6	-76.8	0	109	G596 W597 L599 T602 A604 P763 G766 I770	G596-K768 WeakPolarHBondContact O-CE 3.32Å; G596-K768 PolarHBondContact O-NZ 3.35Å; W597-K768 WeakPolarHBondContact O-CE 3.46Å; L599-K768 WeakPolarHBondContact O-CE 3.04Å; L599-K768 PolarHBondContact O-NZ 2.93Å; T602-K768 PolarHBondContact O-NZ 2.91Å; T602-K768 PolarHBondContact OG1-NZ 3.19Å; A604-K768 HydrophobicContact CB-CB 4.19Å; P763-K768 HydrophobicContact CB-CD 4.17Å; P763-K768 HydrophobicContact CB-CG 4.09Å; P763-K768 HydrophobicContact CG-CG 4.26Å; G766-K768 PolarHBondContact O-N 3.41Å; G766-K768 VanDerWaalsContact O-N 3.11Å; K768-I770 PolarHBondContact O-N 3.32Å
769	K	53	Low	62.4	Low	155 Å²	155	80 Å²	80	67%	0.674	44%	0.438	S	S	*	.			trans	-29.7	94.9	-166.6	-65.5	-171.8	178.3	-171.6	0	113.1	P767 I771	P767-K769 PolarHBondContact O-N 2.86Å; K769-I771 PolarHBondContact O-N 3.43Å
770	I	50.5	Low	60.4	Low	79 Å²	79	82 Å²	82	41%	0.405	45%	0.446	S	S	.	.			trans	-58.5	114	142.5	-57	170.9	0	0	0	102.8	Y753 K768 L772	Y753-I770 HydrophobicContact CE1-CD1 4.35Å; K768-I770 PolarHBondContact O-N 3.32Å; I770-L772 VanDerWaalsContact C-N 3.31Å; I770-L772 PolarHBondContact O-N 2.92Å
771	I	42.2	Very low	58.3	Low	88 Å²	88	88.8 Å²	88.8	45%	0.451	47%	0.47	S	S	.	.			trans	-74.6	91.1	-170.7	-58	175.3	0	0	0	107.8	R626 K769	R626-I771 HydrophobicContact CG-CD1 4.38Å; K769-I771 PolarHBondContact O-N 3.43Å
772	L	38.5	Very low	56.4	Low	138 Å²	138	92.6 Å²	92.6	72%	0.723	48%	0.484	S	S	*	.			trans	-56.3	131.1	154.4	-86.4	148.2	0	0	0	107.5	I770 Q774	I770-L772 VanDerWaalsContact C-N 3.31Å; I770-L772 PolarHBondContact O-N 2.92Å; L772-Q774 VanDerWaalsContact C-N 3.34Å; L772-Q774 PolarHBondContact O-N 3.45Å
773	P	36.5	Very low	54.6	Low	52 Å²	52	93.7 Å²	93.7	34%	0.338	48%	0.479	S	S	.	.			trans	-68.1	84.4	-175.7	-20	31.3	0	0	0	113.2	L521	L521-P773 HydrophobicContact CD1-CG 4.24Å; L521-P773 HydrophobicContact CD2-CG 4.32Å
774	Q	44.3	Very low	52.8	Low	141 Å²	141	99.6 Å²	99.6	66%	0.659	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	97.3	169.3	-72.6	-172.1	-62.1	0	0	109.9	L772 E778	L772-Q774 VanDerWaalsContact C-N 3.34Å; L772-Q774 PolarHBondContact O-N 3.45Å; Q774-E778 PolarHBondContact NE2-OE1 3.06Å
775	S	41.4	Very low	51	Low	76 Å²	76	100.9 Å²	100.9	53%	0.531	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	174.7	-22.6	162.8	49.5	0	0	0	0	110.6	A779	S775-A779 VanDerWaalsContact O-CB 3.25Å; S775-A779 WeakPolarHBondContact O-CB 3.49Å; S775-A779 PolarHBondContact O-N 3.1Å
776	W	40.2	Very low	49.1	Very low	166 Å²	166	99.4 Å²	99.4	63%	0.629	51%	0.51	S	S	*	.	H	α-helix	trans	-96.4	-41.2	174.7	-78.2	76.2	0	0	0	113.8	E778 A779 E780	W776-E778 PolarHBondContact O-N 2.87Å; W776-A779 CarbonylContact O-C 3.56Å; W776-A779 PolarHBondContact O-N 2.61Å; W776-A779 VanDerWaalsContact O-N 3.16Å; W776-E780 VanDerWaalsContact O-CB 3.27Å; W776-E780 WeakPolarHBondContact O-CB 3.41Å; W776-E780 VanDerWaalsContact O-CG 3.3Å; W776-E780 WeakPolarHBondContact O-CG 3.38Å; W776-E780 PolarHBondContact O-N 2.98Å
777	V	44	Very low	47.4	Very low	89 Å²	89	105.5 Å²	105.5	54%	0.539	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-29.7	173.6	-179.2	0	0	0	0	111.5	R781	V777-R781 WeakPolarHBondContact O-CG 3.42Å; V777-R781 PolarHBondContact O-N 3.3Å; V777-R781 VanDerWaalsContact O-N 3.15Å
778	E	44.4	Very low	46.1	Very low	93 Å²	93	109.1 Å²	109.1	44%	0.435	54%	0.537	S	S	.	.	H	α-helix	trans	-75.9	-47.3	172.8	-72.5	157.1	-177.2	0	0	110.7	Q774 W776 E780 R781 D782	Q774-E778 PolarHBondContact NE2-OE1 3.06Å; W776-E778 PolarHBondContact O-N 2.87Å; E778-E780 VanDerWaalsContact C-N 3.27Å; E778-E780 PolarHBondContact O-N 3.41Å; E778-R781 WeakPolarHBondContact O-CB 3.47Å; E778-R781 PolarHBondContact O-N 3.22Å; E778-R781 VanDerWaalsContact O-N 3.15Å; E778-D782 VanDerWaalsContact O-CG 3.31Å; E778-D782 PolarHBondContact O-N 3.41Å
779	A	48.2	Very low	45.1	Very low	35 Å²	35	115.4 Å²	115.4	29%	0.289	57%	0.571	S	S	.	*	H	α-helix	trans	-67	-20.9	175.1	0	0	0	0	0	114.9	S775 W776 K783	S775-A779 VanDerWaalsContact O-CB 3.25Å; S775-A779 WeakPolarHBondContact O-CB 3.49Å; S775-A779 PolarHBondContact O-N 3.1Å; W776-A779 CarbonylContact O-C 3.56Å; W776-A779 PolarHBondContact O-N 2.61Å; W776-A779 VanDerWaalsContact O-N 3.16Å; A779-K783 WeakPolarHBondContact O-CB 3.32Å; A779-K783 VanDerWaalsContact O-CG 3.23Å; A779-K783 WeakPolarHBondContact O-CG 3.41Å; A779-K783 PolarHBondContact O-N 3.17Å; A779-K783 VanDerWaalsContact O-N 3.1Å
780	E	47.9	Very low	44.2	Very low	99 Å²	99	116.5 Å²	116.5	46%	0.463	58%	0.579	S	S	.	*	H	α-helix	trans	-85.2	-28.9	173.6	-73.5	171.6	146.6	0	0	111.4	W776 E778 Q784	W776-E780 VanDerWaalsContact O-CB 3.27Å; W776-E780 WeakPolarHBondContact O-CB 3.41Å; W776-E780 VanDerWaalsContact O-CG 3.3Å; W776-E780 WeakPolarHBondContact O-CG 3.38Å; W776-E780 PolarHBondContact O-N 2.98Å; E778-E780 VanDerWaalsContact C-N 3.27Å; E778-E780 PolarHBondContact O-N 3.41Å; E780-Q784 WeakPolarHBondContact O-CG 3.18Å; E780-Q784 PolarHBondContact O-N 3.46Å
781	R	46.9	Very low	43.7	Very low	165 Å²	165	118.4 Å²	118.4	62%	0.623	60%	0.596	S	S	*	*	H	α-helix	trans	-67	-50.2	163.5	-75.8	178.2	92.6	-177.1	6.6	110.7	V777 E778 K783 Q784 D785	V777-R781 WeakPolarHBondContact O-CG 3.42Å; V777-R781 PolarHBondContact O-N 3.3Å; V777-R781 VanDerWaalsContact O-N 3.15Å; E778-R781 WeakPolarHBondContact O-CB 3.47Å; E778-R781 PolarHBondContact O-N 3.22Å; E778-R781 VanDerWaalsContact O-N 3.15Å; R781-K783 PolarHBondContact O-N 3.49Å; R781-Q784 PolarHBondContact O-N 3.01Å; R781-D785 WeakPolarHBondContact O-CB 3.43Å; R781-D785 VanDerWaalsContact O-CG 3.27Å; R781-D785 PolarHBondContact O-N 3.48Å
782	D	47.5	Very low	43.5	Very low	106 Å²	106	123.1 Å²	123.1	57%	0.567	62%	0.616	S	S	*	*	H	α-helix	trans	-56.4	-36.3	177	-66.2	-16.6	0	0	0	111.5	E778 T786	E778-D782 VanDerWaalsContact O-CG 3.31Å; E778-D782 PolarHBondContact O-N 3.41Å; D782-T786 WeakPolarHBondContact O-CG2 3.38Å; D782-T786 PolarHBondContact O-N 2.9Å; D782-T786 PolarHBondContact O-OG1 3.43Å
783	K	49.8	Very low	43.3	Very low	118 Å²	118	122.1 Å²	122.1	51%	0.513	62%	0.618	S	S	.	*	H	α-helix	trans	-68.2	-45.7	173	-81.5	172.5	-178.4	176.2	0	113.4	A779 R781 D785 T786 E787	A779-K783 WeakPolarHBondContact O-CB 3.32Å; A779-K783 VanDerWaalsContact O-CG 3.23Å; A779-K783 WeakPolarHBondContact O-CG 3.41Å; A779-K783 PolarHBondContact O-N 3.17Å; A779-K783 VanDerWaalsContact O-N 3.1Å; R781-K783 PolarHBondContact O-N 3.49Å; K783-D785 VanDerWaalsContact C-N 3.31Å; K783-T786 WeakPolarHBondContact CA-OG1 3.49Å; K783-T786 PolarHBondContact O-N 3.37Å; K783-T786 PolarHBondContact O-OG1 3.01Å; K783-E787 PolarHBondContact O-N 3Å; K783-E787 VanDerWaalsContact O-N 3.12Å
784	Q	47.5	Very low	43.3	Very low	132 Å²	132	125 Å²	125	62%	0.617	64%	0.637	S	S	*	*	H	α-helix	trans	-61.6	-41.7	176	-77.1	-179.5	-24	0	0	111.3	E780 R781 T786 E787	E780-Q784 WeakPolarHBondContact O-CG 3.18Å; E780-Q784 PolarHBondContact O-N 3.46Å; R781-Q784 PolarHBondContact O-N 3.01Å; Q784-T786 VanDerWaalsContact C-N 3.28Å; Q784-T786 PolarHBondContact O-N 3.41Å; Q784-E787 PolarHBondContact O-N 3.17Å
785	D	48.1	Very low	42.9	Very low	107 Å²	107	124.3 Å²	124.3	57%	0.572	65%	0.645	S	S	*	*	H	α-helix	trans	-67.7	-26.3	177.4	-64.1	-17.8	0	0	0	111.8	R781 K783	R781-D785 WeakPolarHBondContact O-CB 3.43Å; R781-D785 VanDerWaalsContact O-CG 3.27Å; R781-D785 PolarHBondContact O-N 3.48Å; K783-D785 VanDerWaalsContact C-N 3.31Å
786	T	45.9	Very low	42.5	Very low	99 Å²	99	132.5 Å²	132.5	61%	0.607	66%	0.664	S	S	*	*	H	α-helix	trans	-82.3	-18.5	171.2	53.1	0	0	0	0	115.6	D782 K783 Q784 E788	D782-T786 WeakPolarHBondContact O-CG2 3.38Å; D782-T786 PolarHBondContact O-N 2.9Å; D782-T786 PolarHBondContact O-OG1 3.43Å; K783-T786 WeakPolarHBondContact CA-OG1 3.49Å; K783-T786 PolarHBondContact O-N 3.37Å; K783-T786 PolarHBondContact O-OG1 3.01Å; Q784-T786 VanDerWaalsContact C-N 3.28Å; Q784-T786 PolarHBondContact O-N 3.41Å; T786-E788 VanDerWaalsContact C-N 3.34Å
787	E	42.3	Very low	42.3	Very low	162 Å²	162	134.1 Å²	134.1	76%	0.757	68%	0.676	S	S	*	*	H	α-helix	trans	-79.9	-15.6	178.1	-77.5	-177.3	-177.1	0	0	112.8	K783 Q784	K783-E787 PolarHBondContact O-N 3Å; K783-E787 VanDerWaalsContact O-N 3.12Å; Q784-E787 PolarHBondContact O-N 3.17Å
788	E	42.1	Very low	41.8	Very low	179 Å²	179	141.5 Å²	141.5	84%	0.836	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-7.3	176.6	-63.6	-161.6	157.3	0	0	114.3	T786	T786-E788 VanDerWaalsContact C-N 3.34Å
789	D	45.8	Very low	41.2	Very low	144 Å²	144	148.9 Å²	148.9	77%	0.77	72%	0.717	S	S	*	*			trans	-125.8	35.5	-169.5	-131.9	1	0	0	0	114	P791	D789-P791 WeakPolarHBondContact O-CD 3.44Å
790	E	35.1	Very low	40.8	Very low	178 Å²	178	155.9 Å²	155.9	83%	0.832	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-71.6	122.8	170.1	-92.7	-155.1	155.4	0	0	112.1
791	P	38.9	Very low	40.1	Very low	119 Å²	119	158.8 Å²	158.8	77%	0.773	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-74.4	131.9	174.9	29.5	-33.5	0	0	0	111.7	D789	D789-P791 WeakPolarHBondContact O-CD 3.44Å
792	Q	37.5	Very low	39.7	Very low	187 Å²	187	159 Å²	159	87%	0.874	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-55	140.8	-178.8	-67.7	-175.2	-3.4	0	0	113.2
793	P	34.4	Very low	39.2	Very low	117 Å²	117	160.7 Å²	160.7	76%	0.76	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-68.6	141.3	-178.1	27.6	-34.8	0	0	0	112.1
794	P	36.3	Very low	38.5	Very low	112 Å²	112	161.6 Å²	161.6	73%	0.727	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-70.1	150.5	-175.8	28.5	-35.4	0	0	0	112.6	R796	P794-R796 PolarHBondContact O-N 3Å
795	P	37.1	Very low	38.2	Very low	127 Å²	127	161.1 Å²	161.1	83%	0.825	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-66.7	134.5	-176.8	26.6	-34.2	0	0	0	112.2	K797	P795-K797 PolarHBondContact O-N 2.65Å
796	R	33.3	Very low	37.6	Very low	249 Å²	249	164 Å²	164	94%	0.94	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-61.8	121.7	179.1	-74	179.9	171.7	176.4	-2.3	111.5	P794	P794-R796 PolarHBondContact O-N 3Å
797	K	36.4	Very low	37.3	Very low	200 Å²	200	167.3 Å²	167.3	87%	0.87	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-65.9	139.5	161.8	-75	-175.2	174.3	-177.9	0	110	P795	P795-K797 PolarHBondContact O-N 2.65Å
798	R	32.9	Very low	37	Very low	244 Å²	244	170 Å²	170	92%	0.921	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-65.5	147.3	168.9	-69.3	-179.4	176	-177.2	-2.5	109.5
799	R	31.9	Very low	36.7	Very low	247 Å²	247	169.5 Å²	169.5	93%	0.932	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-86.7	131	164.4	-67.2	-178.9	177.9	-178.5	-2.9	107.9
800	E	38.3	Very low	36.3	Very low	182 Å²	182	170.8 Å²	170.8	85%	0.85	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-84.6	145.4	149.8	-69.9	172.1	153.8	0	0	106.8
801	D	34.5	Very low	36.3	Very low	161 Å²	161	170.4 Å²	170.4	86%	0.861	87%	0.867	S	S	*	*			trans	141.3	62.6	165.8	-73.1	-16	0	0	0	110.6
802	D	38.3	Very low	36.2	Very low	168 Å²	168	173.5 Å²	173.5	90%	0.898	87%	0.872	S	S	*	*			trans	-112.7	97.4	156.6	-94.1	-33.6	0	0	0	107.1
803	V	36.6	Very low	36.1	Very low	143 Å²	143	172.6 Å²	172.6	87%	0.867	87%	0.872	S	S	*	*			trans	-137.7	117.2	161.9	-175.4	0	0	0	0	108.8
804	D	34.8	Very low	36.2	Very low	136 Å²	136	176.3 Å²	176.3	73%	0.727	88%	0.88	S	S	*	*			trans	-81.9	130.8	-174.3	-170.8	10.7	0	0	0	111.5	Q806	D804-Q806 PolarHBondContact O-N 3.14Å
805	P	41	Very low	36.2	Very low	122 Å²	122	180.9 Å²	180.9	79%	0.792	89%	0.891	S	S	*	*			trans	-79.9	79.2	179.1	32.5	-36	0	0	0	112.5
806	Q	36.2	Very low	36.1	Very low	168 Å²	168	185.1 Å²	185.1	79%	0.785	90%	0.896	S	S	*	*			trans	-132.6	85.3	156.4	-75	-161.8	-1.9	0	0	111.8	D804	D804-Q806 PolarHBondContact O-N 3.14Å
807	L	39.7	Very low	36.4	Very low	169 Å²	169	179.8 Å²	179.8	89%	0.885	89%	0.892	S	S	*	*			trans	-173	102.3	139.5	-103.5	160.4	0	0	0	110.9
808	V	35.6	Very low	36.4	Very low	217 Å²	217	177.9 Å²	177.9	100%	1.315	89%	0.894	S	S	*	*			trans	70.4	0	172.1	-167.6	0	0	0	0	116.4

Retrieved 808 of 808 residues in 755.8 ms (Link to these results)

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