A0A087XT18_POEFO Loading...

Phosphodiesterase

Hydrolyzes the second messenger cAMP, which is a key regulator of many important physiological processes. May be involved in maintaining basal levels of the cyclic nucleotide and/or in the cAMP regulation of germ cell development. Binding to RAF1 reduces RAF1 'Ser-259' inhibitory-phosphorylation and stimulates RAF1-dependent EGF-activated ERK-signaling. Protects against cell death induced by hydrogen peroxide and staurosporine.

AlphaFold DB , UniProt , Accession A0A087XT18, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 874 aa.

						>A0A087XT18_POEFO|A0A087XT18
MGCAPSIHVSQSGVIYCRDSDESNSPHQTTTISQGTAAATLHGLFIKTDAAETIPSVITYQSRHSRNNSHRGRRENSGGHVRIEAETQTSHASVKQVSATEECVGPMRLTKEPIQVLLVFAKEDSQSDAFWWACDRAGFRCNIARTPESAVECFLDKHHEIIVIDGRHSRYFEPEAVCRMIRATKPSESTVILAVVPQKLPDQEEPSVLPLLCAGFSRRFVENSSVSACYNELIQIEHGEVRCQFKLRACNSVFTALEYCQEAVEITSEDHIIQYVNPAFERMMGYHRGELIGKELTELPKSDKNRADLLDTINTCIKKGKEWQGIYFARKKSGDSIQQQVKILPVIGQGGKIRHFVAIKRAHTDNNNQVLKMNKEDRCSGDHSQSECHSLRHRDRRKDSIDARSVGSRGSDAPSLQNRRYSSVARIHSMTIEAPITKVINIINTAQESSPVTVAEALDRVLEILRTTELYSPQLASKDDDPHTNDLVGGLMTDGLRRLSGNEYVFSKRTYMSQSQLAIPVTLSDVPPSIAEMLNDEERWEFNILDLEAATHKRPLTYLGLKIFTSFGVCDFLNCSEATLRSWLQLMEANYHSSNSYHNSTHAADVLHATAYFLRKERVKSSLDQLDEVAALIAATVHDVDHPGRTNSFLCNAGSELAILYNDTAVLESHHAALAFQLTIRDGKSNIFKNIDRNQFRTLRQAIIDMVLATEMTRHFEHVSKFVNSINKPMAAIEETSTSSTNSDCEGQSNIRNSPENRLLIKRMLIKCADVANPCRPLELCIEWAGRISEEYFAQTDEEKRQGLPVVMPVFDRNTCSVPKSQISFIDYFITDMFDAWDAFASLPNLMEHLSENYKYWKNLDDMKCKSLRPPPPS
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28	Very low	23.5	Very low	248 Å²	248	139.1 Å²	139.1	100%	1.222	84%	0.835	S	S	*	*				0	98.4	0	-68	-160.1	-90.4	0	0	105.7
2	G	22.4	Very low	23.7	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	84%	0.839	S	S	*	*				95.7	119.2	58.1	0	0	0	0	0	106.2
3	C	21.2	Very low	23.8	Very low	135 Å²	135	132.5 Å²	132.5	91%	0.912	83%	0.827	S	S	*	*			cis	-153	149.6	30.9	-71.1	0	0	0	0	112.2
4	A	21.7	Very low	23.7	Very low	90 Å²	90	132.9 Å²	132.9	74%	0.744	83%	0.828	S	S	*	*			trans	-72.6	-177.6	165.7	0	0	0	0	0	111.2
5	P	29.3	Very low	23.6	Very low	121 Å²	121	134.5 Å²	134.5	79%	0.786	83%	0.826	S	S	*	*				-140.1	173.4	56.2	39.4	-19.9	0	0	0	112.9
6	S	21.2	Very low	23.6	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	83%	0.828	S	S	*	*			cis	-174.7	152	-12.4	43.3	0	0	0	0	108.4
7	I	21.8	Very low	23.5	Very low	143 Å²	143	139.8 Å²	139.8	73%	0.733	84%	0.835	S	S	*	*			trans	-64.7	149.8	168.6	-67.2	156.8	0	0	0	111.7	V9	I7-V9 HydrophobicContact CG2-CG2 3.9Å
8	H	21.1	Very low	23.5	Very low	194 Å²	194	144 Å²	144	90%	0.898	83%	0.834	S	S	*	*			trans	-134	115	143.7	-107.1	-52.2	0	0	0	110.8
9	V	24.9	Very low	23.6	Very low	112 Å²	112	143.7 Å²	143.7	68%	0.679	83%	0.829	S	S	*	*			trans	-104.4	141	163.2	172.3	0	0	0	0	106.6	I7	I7-V9 HydrophobicContact CG2-CG2 3.9Å
10	S	22.1	Very low	23.7	Very low	119 Å²	119	142 Å²	142	83%	0.832	83%	0.826	S	S	*	*			trans	-139.1	109.3	155	63.4	0	0	0	0	110.2
11	Q	25	Very low	23.8	Very low	186 Å²	186	142.5 Å²	142.5	87%	0.869	83%	0.826	S	S	*	*			trans	-84.2	136.4	155.2	-78.9	178.1	-28.1	0	0	108.6
12	S	25.8	Very low	23.6	Very low	125 Å²	125	139.4 Å²	139.4	87%	0.874	81%	0.808	S	S	*	*			trans	-152.7	137.6	148.3	54.2	0	0	0	0	107.7
13	G	24.3	Very low	23.8	Very low	67 Å²	67	140.2 Å²	140.2	69%	0.691	80%	0.802	S	S	*	*			trans	-118.8	177.4	-167.9	0	0	0	0	0	115.3
14	V	22.8	Very low	24	Very low	139 Å²	139	140.9 Å²	140.9	84%	0.842	80%	0.797	S	S	*	*			trans	68.2	122.1	153.9	-140.7	0	0	0	0	118.3
15	I	22.7	Very low	24.2	Very low	156 Å²	156	141 Å²	141	80%	0.8	79%	0.792	S	S	*	*				166.5	140.8	103	-59.1	-136.5	0	0	0	109.7
16	Y	23.9	Very low	24.3	Very low	219 Å²	219	141.4 Å²	141.4	86%	0.859	80%	0.795	S	S	*	*			trans	-49.3	150.4	169.2	-97.6	-102.7	0	0	0	115.5
17	C	21.6	Very low	24.5	Very low	140 Å²	140	144.4 Å²	144.4	95%	0.946	80%	0.796	S	S	*	*			trans	-158.3	150.1	138.3	-103.4	0	0	0	0	112
18	R	23.7	Very low	24.7	Very low	216 Å²	216	146.3 Å²	146.3	82%	0.815	80%	0.802	S	S	*	*			trans	-113.6	166.5	-171	-159.8	-171.6	176.2	153.6	-1.3	108.3
19	D	24.6	Very low	24.9	Very low	138 Å²	138	142 Å²	142	74%	0.738	79%	0.789	S	S	*	*			trans	76.4	142.4	170.2	-50.2	-31.8	0	0	0	114.6
20	S	25.6	Very low	24.9	Very low	110 Å²	110	142.1 Å²	142.1	77%	0.769	79%	0.791	S	S	*	*			cis	-169	161.8	26.5	14.8	0	0	0	0	111
21	D	25.2	Very low	25.2	Very low	152 Å²	152	143.2 Å²	143.2	81%	0.813	79%	0.793	S	S	*	*			trans	-12.8	141.2	158.8	-58.7	-52.6	0	0	0	119.6
22	E	25.2	Very low	25.2	Very low	184 Å²	184	142 Å²	142	86%	0.86	79%	0.79	S	S	*	*				-170.4	124.2	112	-105.7	-177.4	169.6	0	0	113.2
23	S	26.5	Very low	25.2	Very low	89 Å²	89	140.8 Å²	140.8	62%	0.622	78%	0.782	S	S	*	*			trans	-51.2	148.4	156.3	47.9	0	0	0	0	113.3
24	N	25.5	Very low	25.3	Very low	150 Å²	150	147 Å²	147	80%	0.802	79%	0.793	S	S	*	*				-178.1	127	113	-91.1	-33.2	0	0	0	112.7
25	S	25.8	Very low	25.4	Very low	91 Å²	91	143.5 Å²	143.5	64%	0.636	79%	0.785	S	S	*	*			trans	-60.8	176.1	161.4	-35.6	0	0	0	0	111.1
26	P	31.9	Very low	25.6	Very low	131 Å²	131	142.8 Å²	142.8	85%	0.851	79%	0.788	S	S	*	*				-134.6	140.4	99.2	30	-15.9	0	0	0	114.4
27	H	25	Very low	25.6	Very low	171 Å²	171	136.8 Å²	136.8	79%	0.792	78%	0.784	S	S	*	*			trans	-53.3	154.4	160.8	-73.7	-58.7	0	0	0	113.8
28	Q	26.1	Very low	25.8	Very low	184 Å²	184	134.6 Å²	134.6	86%	0.86	78%	0.776	S	S	*	*				168.3	139.5	119.9	-98.1	-175.7	8.2	0	0	108.7
29	T	24.8	Very low	26	Very low	102 Å²	102	128.6 Å²	128.6	63%	0.626	77%	0.772	S	S	*	*			cis	-167.7	139.8	-8	-14.3	0	0	0	0	106
30	T	25.6	Very low	26	Very low	115 Å²	115	128.3 Å²	128.3	71%	0.706	78%	0.776	S	S	*	*			trans	33.8	126.8	139.5	55.5	0	0	0	0	120.7
31	T	26.6	Very low	25.9	Very low	143 Å²	143	129.4 Å²	129.4	88%	0.877	77%	0.772	S	S	*	*				179.3	152.3	91.7	29.3	0	0	0	0	112.6
32	I	26.2	Very low	25.8	Very low	159 Å²	159	130.6 Å²	130.6	82%	0.815	77%	0.773	S	S	*	*			trans	-89.3	145.4	-173.6	-70.1	157	0	0	0	110.5
33	S	25.3	Very low	25.7	Very low	101 Å²	101	124.7 Å²	124.7	71%	0.706	76%	0.761	S	S	*	*				157.4	113.6	129.7	56.8	0	0	0	0	110.1
34	Q	26.7	Very low	25.6	Very low	198 Å²	198	127.3 Å²	127.3	93%	0.925	77%	0.767	S	S	*	*				62.2	126.6	104.5	-74.7	-171.8	-16.9	0	0	115.6
35	G	25.9	Very low	25.5	Very low	64 Å²	64	128.1 Å²	128.1	66%	0.66	76%	0.764	S	S	*	*			trans	136	85.1	146.5	0	0	0	0	0	117.2
36	T	25.2	Very low	25.4	Very low	141 Å²	141	130 Å²	130	87%	0.865	77%	0.765	S	S	*	*				51.4	122.1	128.9	49.8	0	0	0	0	122.2
37	A	25.3	Very low	24.9	Very low	94 Å²	94	132 Å²	132	78%	0.777	76%	0.761	S	S	*	*				82.1	113.9	124.4	0	0	0	0	0	121.1
38	A	25.6	Very low	24.9	Very low	94 Å²	94	129 Å²	129	78%	0.777	75%	0.754	S	S	*	*				68.9	111	122.4	0	0	0	0	0	121
39	A	27.1	Very low	24.8	Very low	90 Å²	90	127.2 Å²	127.2	74%	0.744	75%	0.751	S	S	*	*				62.5	117.3	120.8	0	0	0	0	0	120.5
40	T	25.7	Very low	24.8	Very low	131 Å²	131	126.8 Å²	126.8	80%	0.804	76%	0.757	S	S	*	*			trans	-160.3	109	142.9	-34.9	0	0	0	0	106.8
41	L	23.5	Very low	24.9	Very low	134 Å²	134	125.7 Å²	125.7	70%	0.702	76%	0.76	S	S	*	*				71.4	127.7	79.8	-92.4	145.1	0	0	0	115.9
42	H	23	Very low	24.8	Very low	177 Å²	177	126.9 Å²	126.9	82%	0.819	76%	0.756	S	S	*	*			trans	64.6	142.7	156.2	-72.3	-64.1	0	0	0	118.2
43	G	22.4	Very low	24.7	Very low	59 Å²	59	125.4 Å²	125.4	61%	0.608	75%	0.754	S	S	*	*			cis	154	140.7	7.9	0	0	0	0	0	108.8
44	L	23.7	Very low	24.6	Very low	144 Å²	144	128.1 Å²	128.1	75%	0.754	76%	0.759	S	S	*	*			trans	51.6	131.7	143.2	-80.1	149.5	0	0	0	122.6
45	F	24.1	Very low	25.6	Very low	168 Å²	168	123.9 Å²	123.9	74%	0.737	75%	0.749	S	S	*	*			trans	109	127	130.5	-86.3	-51.8	0	0	0	121.2
46	I	23.2	Very low	25.4	Very low	129 Å²	129	126.3 Å²	126.3	66%	0.662	76%	0.756	S	S	*	*				99.2	109.7	128.6	-75.2	168.5	0	0	0	120.6
47	K	22	Very low	25.4	Very low	174 Å²	174	126.2 Å²	126.2	76%	0.757	75%	0.754	S	S	*	*				76.8	126.3	127.3	-79.2	-170.4	175.3	177.9	0	124.3
48	T	24.5	Very low	25.3	Very low	108 Å²	108	128 Å²	128	66%	0.663	75%	0.75	S	S	*	*				79.3	127.6	124.4	57.4	0	0	0	0	123.5
49	D	23.7	Very low	25.1	Very low	147 Å²	147	129.5 Å²	129.5	79%	0.786	75%	0.749	S	S	*	*			trans	75.6	109.7	130.4	-66.7	-9.9	0	0	0	122.8
50	A	26.4	Very low	24.9	Very low	92 Å²	92	135 Å²	135	76%	0.76	75%	0.752	S	S	*	*				72.9	138.3	112.7	0	0	0	0	0	123.2
51	A	26.3	Very low	24.8	Very low	92 Å²	92	136.9 Å²	136.9	76%	0.76	75%	0.752	S	S	*	*			trans	76.6	144	153	0	0	0	0	0	116.3
52	E	26.1	Very low	24.7	Very low	169 Å²	169	134.9 Å²	134.9	79%	0.79	75%	0.749	S	S	*	*			cis	-173.2	173.7	14.1	-136.4	176.2	-155.3	0	0	109.8
53	T	23.2	Very low	24.7	Very low	128 Å²	128	137.6 Å²	137.6	79%	0.785	75%	0.752	S	S	*	*			trans	100.6	129	147.7	60.6	0	0	0	0	123.3
54	I	23.7	Very low	24.8	Very low	157 Å²	157	143.3 Å²	143.3	81%	0.805	76%	0.762	S	S	*	*			trans	-102.2	-162.3	177.4	-41.4	170.2	0	0	0	106.6
55	P	47.4	Very low	24.7	Very low	109 Å²	109	142.2 Å²	142.2	71%	0.708	77%	0.767	S	S	*	*			cis	-127.2	176.7	-46.3	18.9	4.2	0	0	0	114.4
56	S	21.5	Very low	24.7	Very low	115 Å²	115	144.9 Å²	144.9	80%	0.804	77%	0.772	S	S	*	*			trans	173.6	150.5	143.1	35.7	0	0	0	0	108.9
57	V	24.2	Very low	24.7	Very low	139 Å²	139	145.7 Å²	145.7	84%	0.842	78%	0.778	S	S	*	*			cis	-165.4	161	6.4	134.5	0	0	0	0	108.8
58	I	23.4	Very low	24.8	Very low	133 Å²	133	144.1 Å²	144.1	68%	0.682	78%	0.778	S	S	*	*			trans	-87.6	151.1	-172.3	-63.3	158.7	0	0	0	113.3	Y60	I58-Y60 HydrophobicContact CG2-CD2 4.47Å
59	T	23.1	Very low	24.9	Very low	124 Å²	124	143 Å²	143	76%	0.761	77%	0.774	S	S	*	*				158.4	117.9	124.6	37.1	0	0	0	0	112.2
60	Y	22.1	Very low	25	Very low	205 Å²	205	143.6 Å²	143.6	80%	0.804	77%	0.772	S	S	*	*				72.2	132.3	86.4	-101.6	-72.8	0	0	0	113.6	I58	I58-Y60 HydrophobicContact CG2-CD2 4.47Å
61	Q	23.1	Very low	25	Very low	172 Å²	172	150 Å²	150	80%	0.804	78%	0.777	S	S	*	*			cis	-161.7	142.2	38.1	-91.1	170.6	-4.2	0	0	109.1
62	S	22.4	Very low	24.9	Very low	91 Å²	91	149.3 Å²	149.3	64%	0.636	78%	0.778	S	S	*	*				78.3	122.1	69.5	-177.9	0	0	0	0	117.7
63	R	22.6	Very low	24.9	Very low	235 Å²	235	152.9 Å²	152.9	89%	0.887	79%	0.785	S	S	*	*				169.9	107.8	124.4	-92	173.6	-179	-171.7	1.5	110.5
64	H	24	Very low	25	Very low	178 Å²	178	157.1 Å²	157.1	82%	0.824	79%	0.786	S	S	*	*				61.6	117.9	83.7	-89.4	-27.1	0	0	0	117.9
65	S	21.4	Very low	25.1	Very low	122 Å²	122	157.3 Å²	157.3	85%	0.853	78%	0.783	S	S	*	*				-161.3	140.7	119.8	-173.2	0	0	0	0	112.4
66	R	23.4	Very low	24	Very low	223 Å²	223	159.5 Å²	159.5	84%	0.842	79%	0.789	S	S	*	*			trans	-85.1	159.6	174.7	-82.1	170.7	155.2	169.7	-6.5	111.8
67	N	24.5	Very low	24.2	Very low	147 Å²	147	160 Å²	160	79%	0.786	79%	0.792	S	S	*	*			trans	165	148.1	138.9	-88.4	-7.1	0	0	0	107.4
68	N	24.3	Very low	24.2	Very low	140 Å²	140	157.4 Å²	157.4	75%	0.749	79%	0.794	S	S	*	*			cis	-162.3	159.8	-4.1	-131.8	-8.3	0	0	0	107.2
69	S	25.4	Very low	24.2	Very low	84 Å²	84	154.5 Å²	154.5	59%	0.587	80%	0.797	S	S	*	*			trans	-70.8	148.9	170.7	52.6	0	0	0	0	114.1
70	H	26.7	Very low	24.3	Very low	160 Å²	160	157.5 Å²	157.5	74%	0.741	80%	0.802	S	S	*	*				165.5	138.3	120.8	-96.7	-11.3	0	0	0	115.9
71	R	27	Very low	24.3	Very low	228 Å²	228	153 Å²	153	86%	0.86	80%	0.796	S	S	*	*			trans	43.9	118	140.3	-75.1	178.2	165	174.7	-3.6	121
72	G	24.3	Very low	24.4	Very low	77 Å²	77	154.9 Å²	154.9	79%	0.794	80%	0.796	S	S	*	*				97.9	137.9	102	0	0	0	0	0	119.5
73	R	24.9	Very low	24.6	Very low	244 Å²	244	158.9 Å²	158.9	92%	0.921	81%	0.808	S	S	*	*			trans	90.9	109.7	149.5	-113.4	178.8	177.9	179.6	-2.3	119.9
74	R	25	Very low	24.7	Very low	217 Å²	217	155.3 Å²	155.3	82%	0.819	80%	0.802	S	S	*	*				25.9	144.1	127.6	-84.5	-173.3	-178.6	-179.5	0.1	121.5
75	E	25.7	Very low	24.9	Very low	160 Å²	160	151.5 Å²	151.5	75%	0.748	80%	0.801	S	S	*	*			trans	105.3	107	139.3	-85	161.9	-148.6	0	0	119.5
76	N	24.9	Very low	25.1	Very low	155 Å²	155	154.6 Å²	154.6	83%	0.829	80%	0.802	S	S	*	*				30.6	122.1	126.5	-88.8	11.4	0	0	0	120.5
77	S	26.6	Very low	25.4	Very low	125 Å²	125	150.6 Å²	150.6	87%	0.874	80%	0.802	S	S	*	*			trans	158.1	131	130.4	44.7	0	0	0	0	105.8
78	G	23.4	Very low	25.5	Very low	85 Å²	85	152.2 Å²	152.2	88%	0.876	81%	0.805	S	S	*	*			cis	118.7	121.1	40.4	0	0	0	0	0	106
79	G	24	Very low	25.9	Very low	73 Å²	73	152.4 Å²	152.4	75%	0.753	81%	0.812	S	S	*	*			trans	130.3	87.7	166.5	0	0	0	0	0	116.8
80	H	24	Very low	26	Very low	187 Å²	187	153.6 Å²	153.6	87%	0.866	82%	0.82	S	S	*	*				40.2	123.1	118.6	-98.3	-54.4	0	0	0	120.7
81	V	23.5	Very low	26	Very low	111 Å²	111	154.8 Å²	154.8	67%	0.673	83%	0.825	S	S	*	*				129.1	131.1	124.2	173	0	0	0	0	115.8
82	R	24.9	Very low	26.3	Very low	210 Å²	210	148.6 Å²	148.6	79%	0.792	82%	0.823	S	S	*	*			trans	68.8	109.2	156.9	-81.5	163.8	-173.8	-178.4	-2.6	118.8
83	I	25	Very low	26.5	Very low	175 Å²	175	150.3 Å²	150.3	90%	0.897	82%	0.823	S	S	*	*			trans	-101.5	98.1	150.9	-60.9	176.4	0	0	0	106
84	E	25.2	Very low	26.9	Very low	161 Å²	161	145.7 Å²	145.7	75%	0.752	82%	0.821	S	S	*	*			trans	-86.9	138.7	155.8	-83.8	177.9	168.4	0	0	108.1
85	A	27.8	Very low	27.3	Very low	97 Å²	97	144.4 Å²	144.4	80%	0.802	82%	0.822	S	S	*	*			trans	-74.5	128.7	179.3	0	0	0	0	0	110.3
86	E	26.6	Very low	27.5	Very low	187 Å²	187	145.7 Å²	145.7	87%	0.874	83%	0.827	S	S	*	*			trans	-133.4	115.4	157.8	-76	-167.4	157.8	0	0	110.3
87	T	30	Very low	28.4	Very low	139 Å²	139	143.3 Å²	143.3	85%	0.853	82%	0.818	S	S	*	*			trans	-67.6	123.9	164.4	35.6	0	0	0	0	110.7
88	Q	26.6	Very low	29.1	Very low	182 Å²	182	141.9 Å²	141.9	85%	0.85	81%	0.809	S	S	*	*			trans	-141.8	117.7	151.4	-76	-168.6	-2.2	0	0	111.1
89	T	32.5	Very low	30.6	Very low	144 Å²	144	140.9 Å²	140.9	88%	0.883	79%	0.792	S	S	*	*			trans	-71.6	127.6	162.7	43.9	0	0	0	0	110.2
90	S	26.5	Very low	32.3	Very low	108 Å²	108	141.2 Å²	141.2	76%	0.755	78%	0.78	S	S	*	*			trans	-162.2	122.7	145	48.9	0	0	0	0	112.8
91	H	27.2	Very low	34.5	Very low	185 Å²	185	138.4 Å²	138.4	86%	0.856	77%	0.767	S	S	*	*			trans	32.2	125.1	147.8	-72.2	-79.3	0	0	0	123.2
92	A	33.3	Very low	36.8	Very low	98 Å²	98	134.3 Å²	134.3	81%	0.81	74%	0.74	S	S	*	*			trans	59.4	91.6	137.7	0	0	0	0	0	117.5
93	S	28.2	Very low	39.1	Very low	113 Å²	113	128.2 Å²	128.2	79%	0.79	73%	0.729	S	S	*	*			trans	-132.2	116.8	145.9	-10	0	0	0	0	107.1	K95	S93-K95 PolarHBondContact O-N 2.95Å
94	V	33.8	Very low	41.6	Very low	147 Å²	147	121.1 Å²	121.1	89%	0.891	69%	0.694	S	S	*	*			trans	-51.3	103.8	169.1	173.5	0	0	0	0	107.2	Q96	V94-Q96 PolarHBondContact O-N 3.4Å
95	K	33	Very low	44	Very low	191 Å²	191	116.6 Å²	116.6	83%	0.83	69%	0.691	S	S	*	*			trans	-68.7	103.8	170.7	-94.8	-175.1	176.2	179.3	0	106.7	S93 V97	S93-K95 PolarHBondContact O-N 2.95Å; K95-V97 PolarHBondContact O-N 3.4Å
96	Q	31.7	Very low	46.3	Very low	186 Å²	186	118.3 Å²	118.3	87%	0.869	69%	0.694	S	S	*	*			trans	-56.2	104.2	161	-161.3	169.1	8	0	0	106.7	V94 S98	V94-Q96 PolarHBondContact O-N 3.4Å; Q96-S98 PolarHBondContact O-N 3.31Å
97	V	41.8	Very low	48.9	Very low	105 Å²	105	112 Å²	112	64%	0.636	67%	0.665	S	S	*	*			trans	-63.8	104.4	179.6	-179.9	0	0	0	0	106.8	K95 A99	K95-V97 PolarHBondContact O-N 3.4Å; V97-A99 PolarHBondContact O-N 3.23Å
98	S	42.8	Very low	51.3	Low	96 Å²	96	114.4 Å²	114.4	67%	0.671	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-62.4	124.8	170.1	62.2	0	0	0	0	107.7	Q96 T100	Q96-S98 PolarHBondContact O-N 3.31Å; S98-T100 PolarHBondContact O-N 3.28Å; S98-T100 VanDerWaalsContact O-N 3.1Å
99	A	53.4	Low	53.9	Low	63 Å²	63	107.5 Å²	107.5	52%	0.521	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-49.9	119.9	176.6	0	0	0	0	0	109.7	V97	V97-A99 PolarHBondContact O-N 3.23Å
100	T	61.1	Low	56.1	Low	81 Å²	81	104.9 Å²	104.9	50%	0.497	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.6	122.4	178.3	35.7	0	0	0	0	108.5	S98 K111	S98-T100 PolarHBondContact O-N 3.28Å; S98-T100 VanDerWaalsContact O-N 3.1Å; T100-K111 WeakPolarHBondContact O-CB 3.41Å; T100-K111 PolarHBondContact O-N 3.23Å
101	E	68.8	Low	58.3	Low	127 Å²	127	101.8 Å²	101.8	59%	0.593	58%	0.584	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78	122.9	173.2	-69.3	-171.5	173.2	0	0	109.4	L109	E101-L109 WeakPolarHBondContact CA-O 3.32Å
102	E	72.6	Confident	60.8	Low	25 Å²	25	100.2 Å²	100.2	12%	0.117	58%	0.577	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.5	138.9	169.1	-75	-156.1	-168.8	0	0	110.4	L109 R242 F245	E102-L109 PolarHBondContact N-O 3.02Å; E102-L109 PolarHBondContact O-N 2.93Å; E102-R242 IonicContact OE1-CZ 3.83Å; E102-R242 IonicContact OE1-NE 2.84Å; E102-R242 PolarHBondContact OE1-NE 3.49Å; E102-R242 IonicContact OE1-NH2 2.92Å; E102-R242 PolarHBondContact OE1-NH2 3.3Å; E102-R242 IonicContact OE2-CZ 3.33Å; E102-R242 VanDerWaalsContact OE2-CZ 3.26Å; E102-R242 IonicContact OE2-NE 3.82Å; E102-R242 PolarHBondContact OE2-NE 3.16Å; E102-R242 IonicContact OE2-NH2 3.77Å; E102-R242 PolarHBondContact OE2-NH2 3.47Å; E102-F245 HydrophobicContact CB-CE1 4.46Å
103	C	74	Confident	63.2	Low	83 Å²	83	97.8 Å²	97.8	56%	0.561	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.4	130.1	177.1	-65.4	0	0	0	0	111	M107	C103-M107 CarbonylContact C-O 3.58Å; C103-M107 VanDerWaalsContact CA-O 3.3Å; C103-M107 WeakPolarHBondContact CA-O 3.46Å
104	V	78	Confident	66.2	Low	25 Å²	25	92.8 Å²	92.8	15%	0.152	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	97.8	169	-177.7	0	0	0	0	107.5	M107 L109 K246	V104-M107 PolarHBondContact N-O 3.44Å; V104-M107 WeakPolarHBondContact O-CB 3.49Å; V104-M107 PolarHBondContact O-N 3.11Å; V104-L109 HydrophobicContact CB-CD1 4.36Å; V104-L109 HydrophobicContact CG2-CD1 3.88Å; V104-K246 HydrophobicContact CG2-CG 3.93Å
105	G	75.1	Confident	69.1	Low	67 Å²	67	87.1 Å²	87.1	69%	0.691	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	-130.1	-166.1	0	0	0	0	0	110.4	M107	G105-M107 VanDerWaalsContact C-N 3.28Å; G105-M107 PolarHBondContact O-N 3.29Å
106	P	75.8	Confident	72.1	Confident	133 Å²	133	78 Å²	78	86%	0.864	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.7	176.5	33.4	-35.2	0	0	0	113.8
107	M	79.9	Confident	75.3	Confident	54 Å²	54	69.2 Å²	69.2	27%	0.266	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	128.1	-179	-62.6	176.3	66	0	0	110.4	C103 V104 G105 L109 V253	C103-M107 CarbonylContact C-O 3.58Å; C103-M107 VanDerWaalsContact CA-O 3.3Å; C103-M107 WeakPolarHBondContact CA-O 3.46Å; V104-M107 PolarHBondContact N-O 3.44Å; V104-M107 WeakPolarHBondContact O-CB 3.49Å; V104-M107 PolarHBondContact O-N 3.11Å; G105-M107 VanDerWaalsContact C-N 3.28Å; G105-M107 PolarHBondContact O-N 3.29Å; M107-L109 HydrophobicContact CE-CD2 4.16Å; M107-V253 HydrophobicContact SD-CG2 3.58Å; M107-V253 VanDerWaalsContact SD-CG2 3.58Å
108	R	81.6	Confident	77.9	Confident	189 Å²	189	64.2 Å²	64.2	71%	0.713	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	123	168.2	-64.5	-173.7	178.1	-166.8	0.1	108.9
109	L	80.9	Confident	80.5	Confident	37 Å²	37	59.7 Å²	59.7	19%	0.194	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.6	-177.8	-59	168.5	0	0	0	109.6	E101 E102 V104 M107 F245 A249	E101-L109 WeakPolarHBondContact CA-O 3.32Å; E102-L109 PolarHBondContact N-O 3.02Å; E102-L109 PolarHBondContact O-N 2.93Å; V104-L109 HydrophobicContact CB-CD1 4.36Å; V104-L109 HydrophobicContact CG2-CD1 3.88Å; M107-L109 HydrophobicContact CE-CD2 4.16Å; L109-F245 HydrophobicContact CB-CE1 4.1Å; L109-F245 HydrophobicContact CB-CZ 3.65Å; L109-F245 HydrophobicContact CD1-CE1 3.8Å; L109-F245 HydrophobicContact CD1-CZ 3.85Å; L109-F245 HydrophobicContact CG-CZ 4.38Å; L109-A249 HydrophobicContact CD1-CB 3.37Å
110	T	79.3	Confident	82.5	Confident	90 Å²	90	56.8 Å²	56.8	55%	0.552	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	122.2	173.2	49.4	0	0	0	0	109.2	E112	T110-E112 PolarHBondContact O-N 3.2Å
111	K	72.9	Confident	83.8	Confident	43 Å²	43	54 Å²	54	19%	0.187	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	117	174.3	-170.1	175.4	174.8	-174.2	0	109.5	T100 E237	T100-K111 WeakPolarHBondContact O-CB 3.41Å; T100-K111 PolarHBondContact O-N 3.23Å; K111-E237 IonicContact NZ-OE1 3.62Å; K111-E237 PolarHBondContact NZ-OE1 2.91Å
112	E	79.6	Confident	84.7	Confident	151 Å²	151	53.6 Å²	53.6	71%	0.706	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-76.6	157.2	169.8	-66.6	-167	174	0	0	110.9	T110 I114	T110-E112 PolarHBondContact O-N 3.2Å; E112-I114 PolarHBondContact O-N 2.83Å
113	P	84.1	Confident	85.6	Confident	48 Å²	48	58.9 Å²	58.9	31%	0.312	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-60.5	129.1	174.9	-19.5	31.6	0	0	0	110.9	Q115 R140	P113-Q115 PolarHBondContact O-N 3.11Å; P113-Q115 PolarHBondContact O-NE2 3.31Å; P113-R140 HydrophobicContact CB-CG 4.27Å
114	I	90.8	Very high	86.4	Confident	7 Å²	7	56.9 Å²	56.9	4%	0.036	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-58.1	131.7	-179.2	-64.4	175.8	0	0	0	110	E112 V116 F139 R140 E160 I161 E237 V241	E112-I114 PolarHBondContact O-N 2.83Å; I114-V116 HydrophobicContact CG2-CG2 4.17Å; I114-F139 HydrophobicContact CB-CD1 3.93Å; I114-F139 HydrophobicContact CB-CE1 4.2Å; I114-F139 HydrophobicContact CB-CG 4.18Å; I114-F139 HydrophobicContact CD1-CD1 4.43Å; I114-F139 HydrophobicContact CD1-CE1 3.82Å; I114-F139 HydrophobicContact CD1-CZ 3.94Å; I114-F139 HydrophobicContact CG1-CE1 4.39Å; I114-F139 HydrophobicContact CG2-CD2 4.43Å; I114-F139 HydrophobicContact CG2-CG 4.4Å; I114-R140 PolarHBondContact O-N 2.96Å; I114-E160 HydrophobicContact CG2-CB 4.31Å; I114-I161 HydrophobicContact CG2-CD1 4.04Å; I114-I161 HydrophobicContact CG2-CG1 4.31Å; I114-E237 HydrophobicContact CD1-CB 3.92Å; I114-E237 VanDerWaalsContact CD1-CD 3.49Å; I114-E237 HydrophobicContact CD1-CG 3.46Å; I114-E237 VanDerWaalsContact CD1-CG 3.46Å; I114-E237 WeakPolarHBondContact CD1-OE1 3.35Å; I114-V241 HydrophobicContact CD1-CG1 4.34Å
115	Q	93.9	Very high	87.1	Confident	29 Å²	29	59 Å²	59	14%	0.136	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.8	173.2	-55	-57.2	-62.2	0	0	109.7	P113 R140 H159 E160 I161	P113-Q115 PolarHBondContact O-N 3.11Å; P113-Q115 PolarHBondContact O-NE2 3.31Å; Q115-R140 CarbonylContact C-O 3.58Å; Q115-R140 WeakPolarHBondContact CA-O 3.45Å; Q115-R140 VanDerWaalsContact NE2-CD 3.33Å; Q115-R140 VanDerWaalsContact OE1-CB 3.24Å; Q115-H159 HydrophobicContact CB-CB 4.34Å; Q115-E160 WeakPolarHBondContact CA-OE2 3.43Å; Q115-E160 VanDerWaalsContact CB-OE2 3.31Å; Q115-E160 WeakPolarHBondContact CB-OE2 3.5Å; Q115-E160 PolarHBondContact N-OE2 2.94Å; Q115-E160 PolarHBondContact O-N 2.84Å; Q115-E160 VanDerWaalsContact O-N 3.09Å; Q115-I161 PolarHBondContact O-N 2.88Å
116	V	96.9	Very high	88	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.6	177.7	-174	0	0	0	0	109.9	I114 L118 F139 R140 C141 N142 H159 I161 V163	I114-V116 HydrophobicContact CG2-CG2 4.17Å; V116-L118 HydrophobicContact CG1-CD2 3.96Å; V116-F139 HydrophobicContact CG2-CB 3.95Å; V116-F139 HydrophobicContact CG2-CD2 3.76Å; V116-F139 HydrophobicContact CG2-CG 4.24Å; V116-R140 PolarHBondContact N-O 2.98Å; V116-C141 CarbonylContact O-C 3.58Å; V116-C141 WeakPolarHBondContact O-CA 3.16Å; V116-N142 PolarHBondContact O-N 2.95Å; V116-H159 VanDerWaalsContact C-CD2 3.48Å; V116-I161 CarbonylContact C-O 3.58Å; V116-I161 VanDerWaalsContact CA-O 3.3Å; V116-I161 WeakPolarHBondContact CA-O 3.36Å; V116-I161 HydrophobicContact CG1-CB 4.21Å; V116-I161 HydrophobicContact CG1-CG2 4.22Å; V116-I161 HydrophobicContact CG2-CB 4.13Å; V116-I161 HydrophobicContact CG2-CD1 4.31Å; V116-V163 HydrophobicContact CG1-CG2 4.5Å
117	L	97.4	Very high	88.9	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.4	171.8	-179	61.9	0	0	0	110.3	V119 N142 A144 A150 C153 F154 H159 I161 I162 V163	L117-V119 HydrophobicContact CD2-CG2 4.06Å; L117-V119 HydrophobicContact CG-CG2 3.91Å; L117-N142 CarbonylContact C-O 3.57Å; L117-N142 WeakPolarHBondContact CA-O 3.43Å; L117-N142 HydrophobicContact CD1-CB 3.99Å; L117-A144 HydrophobicContact CD1-CB 4.01Å; L117-A150 HydrophobicContact CD2-CB 4.42Å; L117-A150 WeakPolarHBondContact CD2-O 3.49Å; L117-C153 HydrophobicContact CD1-CB 4.19Å; L117-F154 HydrophobicContact CD2-CB 4.35Å; L117-H159 HydrophobicContact CB-CB 4.09Å; L117-I161 PolarHBondContact N-O 3.09Å; L117-I162 HydrophobicContact CB-CG1 4.14Å; L117-I162 HydrophobicContact CB-CG2 4.26Å; L117-I162 HydrophobicContact CD2-CD1 4.39Å; L117-I162 HydrophobicContact CD2-CG2 4.26Å; L117-I162 HydrophobicContact CG-CG2 4.38Å; L117-I162 CarbonylContact O-C 3.55Å; L117-I162 WeakPolarHBondContact O-CA 3.45Å; L117-V163 PolarHBondContact O-N 2.97Å
118	L	97.3	Very high	89.6	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.4	172.7	-56.2	-176.1	0	0	0	109.1	V116 F120 F130 W131 C141 N142 I143 A144 V163	V116-L118 HydrophobicContact CG1-CD2 3.96Å; L118-F120 HydrophobicContact CB-CD2 3.87Å; L118-F120 HydrophobicContact CB-CE2 4.04Å; L118-F120 HydrophobicContact CD2-CE2 4.38Å; L118-F130 HydrophobicContact CD1-CB 3.97Å; L118-F130 HydrophobicContact CD2-CB 3.89Å; L118-F130 HydrophobicContact CD2-CG 4.44Å; L118-W131 HydrophobicContact CD1-CB 4.15Å; L118-C141 WeakPolarHBondContact CD1-SG 3.37Å; L118-C141 VanDerWaalsContact CG-SG 3.59Å; L118-N142 PolarHBondContact N-O 2.9Å; L118-I143 HydrophobicContact CB-CG1 4.28Å; L118-I143 HydrophobicContact CD1-CG1 4.47Å; L118-I143 CarbonylContact O-C 3.44Å; L118-I143 WeakPolarHBondContact O-CA 3.1Å; L118-A144 PolarHBondContact O-N 2.94Å; L118-V163 HydrophobicContact CD2-CB 3.74Å; L118-V163 HydrophobicContact CD2-CG1 4.49Å; L118-V163 HydrophobicContact CD2-CG2 3.76Å
119	V	96.7	Very high	90.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	91.4	178.6	-170.6	0	0	0	0	108.9	L117 A144 A150 I162 V163 I164 D165 F172 V177	L117-V119 HydrophobicContact CD2-CG2 4.06Å; L117-V119 HydrophobicContact CG-CG2 3.91Å; V119-A144 WeakPolarHBondContact CA-O 3.45Å; V119-A150 HydrophobicContact CB-CB 4.48Å; V119-A150 HydrophobicContact CG1-CB 3.87Å; V119-A150 HydrophobicContact CG2-CB 3.73Å; V119-I162 HydrophobicContact CG2-CG2 3.88Å; V119-V163 PolarHBondContact N-O 2.83Å; V119-I164 HydrophobicContact CB-CG1 4.26Å; V119-I164 HydrophobicContact CB-CG2 4.46Å; V119-I164 HydrophobicContact CG2-CG1 4.3Å; V119-D165 PolarHBondContact O-N 3.13Å; V119-F172 HydrophobicContact CG1-CE1 4.46Å; V119-F172 HydrophobicContact CG1-CE2 4.28Å; V119-F172 HydrophobicContact CG1-CZ 3.84Å; V119-V177 HydrophobicContact CG1-CG1 4.42Å
120	F	95.3	Very high	91	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.013	21%	0.211	C	C	.	.			trans	-130.1	126.3	-177.9	-73.7	-102.6	0	0	0	109.6	L118 K122 Q126 F130 A144 R145 V163 D165 V195	L118-F120 HydrophobicContact CB-CD2 3.87Å; L118-F120 HydrophobicContact CB-CE2 4.04Å; L118-F120 HydrophobicContact CD2-CE2 4.38Å; F120-K122 VanDerWaalsContact C-N 3.26Å; F120-K122 PolarHBondContact O-N 3.33Å; F120-Q126 HydrophobicContact CE1-CB 4.48Å; F120-Q126 HydrophobicContact CE1-CG 4.05Å; F120-Q126 HydrophobicContact CZ-CG 4.48Å; F120-F130 AromaticContact CZ-CD2 3.89Å; F120-F130 HydrophobicContact CZ-CD2 3.89Å; F120-F130 HydrophobicContact CZ-CE2 4.39Å; F120-A144 PolarHBondContact N-O 3.42Å; F120-A144 VanDerWaalsContact N-O 3.1Å; F120-R145 WeakPolarHBondContact O-CA 3.45Å; F120-V163 HydrophobicContact CE2-CB 4.35Å; F120-V163 HydrophobicContact CE2-CG1 3.85Å; F120-V163 HydrophobicContact CZ-CG1 3.95Å; F120-D165 HydrophobicContact CD1-CB 3.57Å; F120-D165 WeakPolarHBondContact CD1-OD2 3.3Å; F120-D165 HydrophobicContact CE1-CB 3.81Å; F120-D165 HydrophobicContact CG-CB 4.02Å; F120-D165 HydrophobicContact CZ-CB 4.44Å; F120-V195 HydrophobicContact CZ-CG2 4.17Å
121	A	90.1	Very high	91.8	Very high	23 Å²	23	39.9 Å²	39.9	19%	0.19	20%	0.201	C	C	.	.	S	Bend	trans	-66	-30.1	179.8	0	0	0	0	0	112.9	Y171 F172	A121-Y171 HydrophobicContact CB-CD1 4.06Å; A121-Y171 HydrophobicContact CB-CD2 3.79Å; A121-Y171 HydrophobicContact CB-CG 3.47Å; A121-Y171 VanDerWaalsContact CB-CG 3.47Å; A121-F172 HydrophobicContact CB-CD1 4.18Å; A121-F172 HydrophobicContact CB-CE1 3.68Å
122	K	87.8	Confident	93	Very high	117 Å²	117	44.2 Å²	44.2	51%	0.509	22%	0.216	S	C	.	.	S	Bend	trans	-136.6	152.2	-179.2	-73.4	-170.1	171.1	177.1	0	110.8	F120 Y171	F120-K122 VanDerWaalsContact C-N 3.26Å; F120-K122 PolarHBondContact O-N 3.33Å; K122-Y171 HydrophobicContact CD-CE1 4.23Å; K122-Y171 HydrophobicContact CD-CE2 4.39Å; K122-Y171 WeakPolarHBondContact CD-OH 3.47Å; K122-Y171 WeakPolarHBondContact CE-OH 3.25Å; K122-Y171 HydrophobicContact CG-CE1 4.48Å; K122-Y171 PolarHBondContact NZ-OH 3.49Å
123	E	89.7	Confident	93.7	Very high	137 Å²	137	37 Å²	37	64%	0.64	18%	0.183	S	C	*	.			trans	-81.5	121	171.4	-163.8	167.6	158.7	0	0	108.7	S127 R145	E123-S127 WeakPolarHBondContact CA-OG 3.47Å; E123-R145 IonicContact OE2-NH2 3.54Å
124	D	92.1	Very high	94.3	Very high	41 Å²	41	34.8 Å²	34.8	22%	0.219	17%	0.168	C	C	.	.			trans	-148.4	-179.8	-179.6	72.9	7.6	0	0	0	111.3	Q126 S127 D128 R167	D124-Q126 PolarHBondContact O-N 3.49Å; D124-Q126 VanDerWaalsContact O-N 3.09Å; D124-Q126 WeakPolarHBondContact OD1-CA 3.31Å; D124-Q126 WeakPolarHBondContact OD1-CB 3.32Å; D124-Q126 PolarHBondContact OD1-N 3.1Å; D124-S127 PolarHBondContact N-OG 3.37Å; D124-S127 PolarHBondContact O-N 3.38Å; D124-S127 PolarHBondContact O-OG 3Å; D124-S127 PolarHBondContact OD1-N 2.98Å; D124-D128 WeakPolarHBondContact O-CB 3.5Å; D124-D128 VanDerWaalsContact O-CG 3.23Å; D124-D128 PolarHBondContact O-N 2.83Å; D124-R167 IonicContact OD1-NH1 3.59Å; D124-R167 IonicContact OD1-NH2 3.99Å; D124-R167 PolarHBondContact OD1-NH2 3.28Å; D124-R167 IonicContact OD2-CZ 3.3Å; D124-R167 VanDerWaalsContact OD2-CZ 3.24Å; D124-R167 IonicContact OD2-NH1 3.93Å; D124-R167 PolarHBondContact OD2-NH1 2.81Å; D124-R167 IonicContact OD2-NH2 3.67Å; D124-R167 PolarHBondContact OD2-NH2 2.9Å
125	S	92.4	Very high	94.5	Very high	70 Å²	70	39 Å²	39	49%	0.49	19%	0.191	S	C	.	.	H	α-helix	trans	-60	-23.6	-178.2	58.2	0	0	0	0	113.9	A129 S224	S125-A129 VanDerWaalsContact O-CB 3.25Å; S125-A129 WeakPolarHBondContact O-CB 3.32Å; S125-A129 PolarHBondContact O-N 3.33Å; S125-S224 PolarHBondContact OG-OG 3.49Å
126	Q	93.8	Very high	94.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-83.1	-43.6	177.8	-175.7	64.9	67.4	0	0	111.7	F120 D124 D128 A129 F130 R167 V195 N223 C229	F120-Q126 HydrophobicContact CE1-CB 4.48Å; F120-Q126 HydrophobicContact CE1-CG 4.05Å; F120-Q126 HydrophobicContact CZ-CG 4.48Å; D124-Q126 PolarHBondContact O-N 3.49Å; D124-Q126 VanDerWaalsContact O-N 3.09Å; D124-Q126 WeakPolarHBondContact OD1-CA 3.31Å; D124-Q126 WeakPolarHBondContact OD1-CB 3.32Å; D124-Q126 PolarHBondContact OD1-N 3.1Å; Q126-D128 VanDerWaalsContact C-N 3.28Å; Q126-D128 PolarHBondContact O-N 3.41Å; Q126-A129 PolarHBondContact O-N 2.9Å; Q126-F130 HydrophobicContact CG-CD2 4.34Å; Q126-F130 HydrophobicContact CG-CE2 4.33Å; Q126-F130 WeakPolarHBondContact O-CD2 3.32Å; Q126-F130 PolarHBondContact O-N 3.34Å; Q126-F130 VanDerWaalsContact O-N 3.13Å; Q126-R167 VanDerWaalsContact CB-CZ 3.46Å; Q126-V195 HydrophobicContact CG-CG1 4.14Å; Q126-N223 PolarHBondContact NE2-O 2.97Å; Q126-N223 VanDerWaalsContact NE2-O 3.09Å; Q126-N223 PolarHBondContact OE1-O 3.36Å; Q126-N223 VanDerWaalsContact OE1-O 3.08Å; Q126-C229 PolarHBondContact NE2-SG 2.86Å
127	S	94.4	Very high	94.1	Very high	11 Å²	11	45.8 Å²	45.8	8%	0.077	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-41.2	175.1	66.1	0	0	0	0	110.9	E123 D124 F130 W131	E123-S127 WeakPolarHBondContact CA-OG 3.47Å; D124-S127 PolarHBondContact N-OG 3.37Å; D124-S127 PolarHBondContact O-N 3.38Å; D124-S127 PolarHBondContact O-OG 3Å; D124-S127 PolarHBondContact OD1-N 2.98Å; S127-F130 PolarHBondContact O-N 3.1Å; S127-W131 WeakPolarHBondContact O-CB 3.48Å; S127-W131 PolarHBondContact O-N 2.89Å
128	D	94.7	Very high	93.8	Very high	61 Å²	61	48 Å²	48	33%	0.326	24%	0.243	S	C	.	.	H	α-helix	trans	-66	-40	177.7	-68.1	-6.6	0	0	0	111.1	D124 Q126 F130 W131 W132	D124-D128 WeakPolarHBondContact O-CB 3.5Å; D124-D128 VanDerWaalsContact O-CG 3.23Å; D124-D128 PolarHBondContact O-N 2.83Å; Q126-D128 VanDerWaalsContact C-N 3.28Å; Q126-D128 PolarHBondContact O-N 3.41Å; D128-F130 PolarHBondContact O-N 2.8Å; D128-W131 PolarHBondContact O-N 2.85Å; D128-W132 PolarHBondContact O-N 3.22Å
129	A	95.6	Very high	93.6	Very high	3 Å²	3	48.8 Å²	48.8	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-42.6	177.2	0	0	0	0	0	112.3	S125 Q126 A133 S224 V226	S125-A129 VanDerWaalsContact O-CB 3.25Å; S125-A129 WeakPolarHBondContact O-CB 3.32Å; S125-A129 PolarHBondContact O-N 3.33Å; Q126-A129 PolarHBondContact O-N 2.9Å; A129-A133 WeakPolarHBondContact O-CB 3.44Å; A129-A133 PolarHBondContact O-N 3.49Å; A129-S224 WeakPolarHBondContact CB-O 3.47Å; A129-V226 HydrophobicContact CB-CG2 4.42Å
130	F	96.9	Very high	93.5	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-39.1	173.7	-85.3	-67.9	0	0	0	112.4	L118 F120 Q126 S127 D128 A133 C134 V163 L193 V195 F220 C229 L233	L118-F130 HydrophobicContact CD1-CB 3.97Å; L118-F130 HydrophobicContact CD2-CB 3.89Å; L118-F130 HydrophobicContact CD2-CG 4.44Å; F120-F130 AromaticContact CZ-CD2 3.89Å; F120-F130 HydrophobicContact CZ-CD2 3.89Å; F120-F130 HydrophobicContact CZ-CE2 4.39Å; Q126-F130 HydrophobicContact CG-CD2 4.34Å; Q126-F130 HydrophobicContact CG-CE2 4.33Å; Q126-F130 WeakPolarHBondContact O-CD2 3.32Å; Q126-F130 PolarHBondContact O-N 3.34Å; Q126-F130 VanDerWaalsContact O-N 3.13Å; S127-F130 PolarHBondContact O-N 3.1Å; D128-F130 PolarHBondContact O-N 2.8Å; F130-A133 WeakPolarHBondContact O-CB 3.37Å; F130-A133 PolarHBondContact O-N 2.96Å; F130-C134 PolarHBondContact O-N 2.96Å; F130-C134 PolarHBondContact O-SG 3.01Å; F130-V163 HydrophobicContact CD1-CG2 4.36Å; F130-V163 HydrophobicContact CD2-CG1 4.15Å; F130-V163 HydrophobicContact CE1-CG1 4.41Å; F130-V163 HydrophobicContact CE1-CG2 4.39Å; F130-V163 HydrophobicContact CE2-CG1 3.97Å; F130-V163 HydrophobicContact CG-CG1 4.44Å; F130-V163 HydrophobicContact CZ-CG1 4.12Å; F130-L193 HydrophobicContact CE1-CD2 4.07Å; F130-L193 HydrophobicContact CZ-CD2 3.95Å; F130-V195 HydrophobicContact CE2-CG2 3.8Å; F130-V195 HydrophobicContact CZ-CG2 4.3Å; F130-F220 HydrophobicContact CE2-CD1 4.01Å; F130-F220 AromaticContact CE2-CE1 3.96Å; F130-F220 HydrophobicContact CE2-CE1 3.96Å; F130-F220 AromaticContact CZ-CD1 3.69Å; F130-F220 HydrophobicContact CZ-CD1 3.69Å; F130-F220 AromaticContact CZ-CE1 3.72Å; F130-F220 HydrophobicContact CZ-CE1 3.72Å; F130-F220 HydrophobicContact CZ-CG 4.09Å; F130-F220 HydrophobicContact CZ-CZ 4.15Å; F130-C229 HydrophobicContact CD1-CB 3.8Å; F130-C229 HydrophobicContact CE1-CB 3.89Å; F130-C229 HydrophobicContact CG-CB 4.21Å; F130-C229 HydrophobicContact CZ-CB 4.39Å; F130-L233 HydrophobicContact CD1-CD1 4.23Å; F130-L233 HydrophobicContact CD1-CD2 4.49Å; F130-L233 HydrophobicContact CD1-CG 4.34Å; F130-L233 HydrophobicContact CE1-CG 4.45Å
131	W	96.7	Very high	93.5	Very high	93 Å²	93	57.4 Å²	57.4	35%	0.352	28%	0.283	S	S	.	.	H	α-helix	trans	-62.4	-49.9	178.2	-171.2	87.2	0	0	0	112	L118 S127 D128 A133 C134 D135	L118-W131 HydrophobicContact CD1-CB 4.15Å; S127-W131 WeakPolarHBondContact O-CB 3.48Å; S127-W131 PolarHBondContact O-N 2.89Å; D128-W131 PolarHBondContact O-N 2.85Å; W131-A133 VanDerWaalsContact C-N 3.28Å; W131-A133 PolarHBondContact O-N 2.94Å; W131-C134 WeakPolarHBondContact O-CB 3.4Å; W131-C134 PolarHBondContact O-N 3.37Å; W131-D135 PolarHBondContact O-N 3.09Å
132	W	96.3	Very high	93.8	Very high	134 Å²	134	58.7 Å²	58.7	51%	0.508	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-31.9	175.4	-74.9	115.3	0	0	0	112.7	D128 R136 V226	D128-W132 PolarHBondContact O-N 3.22Å; W132-R136 VanDerWaalsContact O-CB 3.25Å; W132-R136 WeakPolarHBondContact O-CB 3.41Å; W132-R136 PolarHBondContact O-N 3.2Å; W132-V226 HydrophobicContact CB-CG1 3.89Å; W132-V226 HydrophobicContact CB-CG2 4.2Å
133	A	96	Very high	94.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-41.3	173.6	0	0	0	0	0	112	A129 F130 W131 R136 A137 V226 C229 L233	A129-A133 WeakPolarHBondContact O-CB 3.44Å; A129-A133 PolarHBondContact O-N 3.49Å; F130-A133 WeakPolarHBondContact O-CB 3.37Å; F130-A133 PolarHBondContact O-N 2.96Å; W131-A133 VanDerWaalsContact C-N 3.28Å; W131-A133 PolarHBondContact O-N 2.94Å; A133-R136 PolarHBondContact O-N 3.4Å; A133-A137 WeakPolarHBondContact O-CB 3.4Å; A133-A137 PolarHBondContact O-N 3.22Å; A133-V226 HydrophobicContact CB-CG1 4.45Å; A133-C229 HydrophobicContact CB-CB 3.78Å; A133-L233 HydrophobicContact CB-CD1 3.85Å
134	C	96.1	Very high	94.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-46.4	173.4	-69.4	0	0	0	0	111.8	F130 W131 R136 A137 G138 F139 C141	F130-C134 PolarHBondContact O-N 2.96Å; F130-C134 PolarHBondContact O-SG 3.01Å; W131-C134 WeakPolarHBondContact O-CB 3.4Å; W131-C134 PolarHBondContact O-N 3.37Å; C134-R136 VanDerWaalsContact C-N 3.35Å; C134-R136 PolarHBondContact O-N 2.89Å; C134-A137 CarbonylContact O-C 3.59Å; C134-A137 PolarHBondContact O-N 3.45Å; C134-A137 VanDerWaalsContact O-N 3.17Å; C134-G138 PolarHBondContact O-N 2.79Å; C134-F139 HydrophobicContact CB-CB 4.24Å; C134-F139 PolarHBondContact O-N 3.31Å; C134-C141 HydrophobicContact CB-CB 3.89Å
135	D	93.9	Very high	94.5	Very high	97 Å²	97	54.5 Å²	54.5	52%	0.519	26%	0.264	S	S	.	.	H	α-helix	trans	-59.2	-46.5	177.4	-177.2	67	0	0	0	111.3	W131 A137 G138	W131-D135 PolarHBondContact O-N 3.09Å; D135-A137 VanDerWaalsContact C-N 3.29Å; D135-A137 PolarHBondContact O-N 2.91Å; D135-G138 PolarHBondContact O-N 2.88Å
136	R	92.6	Very high	94.5	Very high	148 Å²	148	54.2 Å²	54.2	56%	0.558	26%	0.259	S	S	*	.	H	α-helix	trans	-61.2	-34.8	175.9	-175.1	178.6	178.5	175	-0.1	113.2	W132 A133 C134 G138 Y230	W132-R136 VanDerWaalsContact O-CB 3.25Å; W132-R136 WeakPolarHBondContact O-CB 3.41Å; W132-R136 PolarHBondContact O-N 3.2Å; A133-R136 PolarHBondContact O-N 3.4Å; C134-R136 VanDerWaalsContact C-N 3.35Å; C134-R136 PolarHBondContact O-N 2.89Å; R136-G138 VanDerWaalsContact C-N 3.29Å; R136-Y230 HydrophobicContact CB-CD2 4.03Å; R136-Y230 HydrophobicContact CB-CE2 4.22Å; R136-Y230 HydrophobicContact CG-CD2 3.85Å; R136-Y230 HydrophobicContact CG-CE2 3.76Å
137	A	90.3	Very high	94.5	Very high	23 Å²	23	55.3 Å²	55.3	19%	0.19	27%	0.266	C	S	.	.	H	α-helix	trans	-80	-9.1	176.8	0	0	0	0	0	113.3	A133 C134 D135 F139 Y230 I234	A133-A137 WeakPolarHBondContact O-CB 3.4Å; A133-A137 PolarHBondContact O-N 3.22Å; C134-A137 CarbonylContact O-C 3.59Å; C134-A137 PolarHBondContact O-N 3.45Å; C134-A137 VanDerWaalsContact O-N 3.17Å; D135-A137 VanDerWaalsContact C-N 3.29Å; D135-A137 PolarHBondContact O-N 2.91Å; A137-F139 VanDerWaalsContact C-N 3.28Å; A137-F139 HydrophobicContact CB-CD1 3.87Å; A137-F139 HydrophobicContact CB-CD2 3.88Å; A137-F139 HydrophobicContact CB-CE1 3.83Å; A137-F139 HydrophobicContact CB-CE2 3.88Å; A137-F139 HydrophobicContact CB-CG 3.88Å; A137-F139 HydrophobicContact CB-CZ 3.83Å; A137-Y230 HydrophobicContact CB-CD2 4.2Å; A137-Y230 HydrophobicContact CB-CE2 3.88Å; A137-I234 HydrophobicContact CB-CD1 4.02Å
138	G	91.2	Very high	94.4	Very high	46 Å²	46	60.7 Å²	60.7	47%	0.474	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	22.4	-173.9	0	0	0	0	0	113.4	C134 D135 R136	C134-G138 PolarHBondContact O-N 2.79Å; D135-G138 PolarHBondContact O-N 2.88Å; R136-G138 VanDerWaalsContact C-N 3.29Å
139	F	94.2	Very high	94.4	Very high	17 Å²	17	60 Å²	60	8%	0.075	29%	0.29	C	S	.	.			trans	-84.4	147.8	177.5	-62	-9.9	0	0	0	110.6	I114 V116 C134 A137 I161 L233 I234 E237	I114-F139 HydrophobicContact CB-CD1 3.93Å; I114-F139 HydrophobicContact CB-CE1 4.2Å; I114-F139 HydrophobicContact CB-CG 4.18Å; I114-F139 HydrophobicContact CD1-CD1 4.43Å; I114-F139 HydrophobicContact CD1-CE1 3.82Å; I114-F139 HydrophobicContact CD1-CZ 3.94Å; I114-F139 HydrophobicContact CG1-CE1 4.39Å; I114-F139 HydrophobicContact CG2-CD2 4.43Å; I114-F139 HydrophobicContact CG2-CG 4.4Å; V116-F139 HydrophobicContact CG2-CB 3.95Å; V116-F139 HydrophobicContact CG2-CD2 3.76Å; V116-F139 HydrophobicContact CG2-CG 4.24Å; C134-F139 HydrophobicContact CB-CB 4.24Å; C134-F139 PolarHBondContact O-N 3.31Å; A137-F139 VanDerWaalsContact C-N 3.28Å; A137-F139 HydrophobicContact CB-CD1 3.87Å; A137-F139 HydrophobicContact CB-CD2 3.88Å; A137-F139 HydrophobicContact CB-CE1 3.83Å; A137-F139 HydrophobicContact CB-CE2 3.88Å; A137-F139 HydrophobicContact CB-CG 3.88Å; A137-F139 HydrophobicContact CB-CZ 3.83Å; F139-I161 HydrophobicContact CE2-CD1 4.46Å; F139-L233 HydrophobicContact CE2-CB 4.1Å; F139-I234 HydrophobicContact CZ-CD1 4.16Å; F139-E237 WeakPolarHBondContact CE1-OE2 3.48Å; F139-E237 HydrophobicContact CZ-CB 3.99Å; F139-E237 HydrophobicContact CZ-CG 4.37Å; F139-E237 VanDerWaalsContact CZ-OE2 3.26Å; F139-E237 WeakPolarHBondContact CZ-OE2 3.42Å
140	R	94.3	Very high	94.3	Very high	151 Å²	151	59.9 Å²	59.9	57%	0.57	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	122.4	172	-62.7	-157.2	-169.4	175.2	-2.9	109.1	P113 I114 Q115 V116	P113-R140 HydrophobicContact CB-CG 4.27Å; I114-R140 PolarHBondContact O-N 2.96Å; Q115-R140 CarbonylContact C-O 3.58Å; Q115-R140 WeakPolarHBondContact CA-O 3.45Å; Q115-R140 VanDerWaalsContact NE2-CD 3.33Å; Q115-R140 VanDerWaalsContact OE1-CB 3.24Å; V116-R140 PolarHBondContact N-O 2.98Å
141	C	94.8	Very high	94.1	Very high	33 Å²	33	61 Å²	61	22%	0.223	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.8	-174.4	-173.3	0	0	0	0	111.1	V116 L118 C134	V116-C141 CarbonylContact O-C 3.58Å; V116-C141 WeakPolarHBondContact O-CA 3.16Å; L118-C141 WeakPolarHBondContact CD1-SG 3.37Å; L118-C141 VanDerWaalsContact CG-SG 3.59Å; C134-C141 HydrophobicContact CB-CB 3.89Å
142	N	95.9	Very high	94	Very high	50 Å²	50	63.3 Å²	63.3	27%	0.267	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	148.9	167.7	-62.7	114.3	0	0	0	109.6	V116 L117 L118 H159	V116-N142 PolarHBondContact O-N 2.95Å; L117-N142 CarbonylContact C-O 3.57Å; L117-N142 WeakPolarHBondContact CA-O 3.43Å; L117-N142 HydrophobicContact CD1-CB 3.99Å; L118-N142 PolarHBondContact N-O 2.9Å; N142-H159 PolarHBondContact OD1-NE2 2.92Å
143	I	95.3	Very high	93.8	Very high	74 Å²	74	58.2 Å²	58.2	38%	0.379	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.4	179.4	-57.8	166.8	0	0	0	108.6	L118 R145	L118-I143 HydrophobicContact CB-CG1 4.28Å; L118-I143 HydrophobicContact CD1-CG1 4.47Å; L118-I143 CarbonylContact O-C 3.44Å; L118-I143 WeakPolarHBondContact O-CA 3.1Å; I143-R145 HydrophobicContact CG2-CG 4.48Å
144	A	95.8	Very high	93.7	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.008	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	136.5	170.4	0	0	0	0	0	110.1	L117 L118 V119 F120 A150	L117-A144 HydrophobicContact CD1-CB 4.01Å; L118-A144 PolarHBondContact O-N 2.94Å; V119-A144 WeakPolarHBondContact CA-O 3.45Å; F120-A144 PolarHBondContact N-O 3.42Å; F120-A144 VanDerWaalsContact N-O 3.1Å; A144-A150 VanDerWaalsContact CB-CA 3.45Å; A144-A150 HydrophobicContact CB-CB 3.75Å
145	R	93.6	Very high	93.5	Very high	133 Å²	133	62.2 Å²	62.2	50%	0.502	32%	0.316	S	S	.	.	S	Bend	trans	-106	-11.1	-176.1	-63.5	-173.7	174.8	90	-4.5	114	F120 E123 I143	F120-R145 WeakPolarHBondContact O-CA 3.45Å; E123-R145 IonicContact OE2-NH2 3.54Å; I143-R145 HydrophobicContact CG2-CG 4.48Å
146	T	93	Very high	93.3	Very high	64 Å²	64	62.6 Å²	62.6	39%	0.393	32%	0.318	S	S	.	.	S	Bend	trans	-131.8	155.1	176.3	71	0	0	0	0	110.6	E148 S149 A150	T146-E148 VanDerWaalsContact C-N 3.27Å; T146-E148 WeakPolarHBondContact CB-OE2 3.5Å; T146-E148 PolarHBondContact O-N 3.2Å; T146-E148 PolarHBondContact OG1-OE2 3.36Å; T146-S149 PolarHBondContact O-N 3.04Å; T146-S149 WeakPolarHBondContact OG1-CB 3.37Å; T146-S149 PolarHBondContact OG1-N 3.31Å; T146-A150 PolarHBondContact O-N 2.96Å
147	P	92.7	Very high	93.1	Very high	23 Å²	23	60.4 Å²	60.4	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-52.3	-42.5	174.2	-30.5	38.6	0	0	0	113.7	A150 V151 F172 V177 M180	P147-A150 WeakPolarHBondContact O-CB 3.28Å; P147-A150 PolarHBondContact O-N 2.64Å; P147-V151 WeakPolarHBondContact O-CG2 3.38Å; P147-V151 PolarHBondContact O-N 2.98Å; P147-V151 VanDerWaalsContact O-N 3.11Å; P147-F172 HydrophobicContact CG-CB 3.63Å; P147-F172 HydrophobicContact CG-CD1 4.34Å; P147-F172 HydrophobicContact CG-CG 4Å; P147-V177 HydrophobicContact CB-CG2 3.86Å; P147-V177 HydrophobicContact CG-CG2 3.79Å; P147-M180 HydrophobicContact CB-SD 4.47Å
148	E	93.3	Very high	92.9	Very high	124 Å²	124	64.1 Å²	64.1	58%	0.579	33%	0.326	S	S	*	.	H	α-helix	trans	-66.6	-45.4	-178.3	-59.2	71.6	-153.5	0	0	110.7	T146 A150 V151 E152	T146-E148 VanDerWaalsContact C-N 3.27Å; T146-E148 WeakPolarHBondContact CB-OE2 3.5Å; T146-E148 PolarHBondContact O-N 3.2Å; T146-E148 PolarHBondContact OG1-OE2 3.36Å; E148-A150 VanDerWaalsContact C-N 3.28Å; E148-A150 PolarHBondContact O-N 3.31Å; E148-V151 PolarHBondContact O-N 3.48Å; E148-E152 WeakPolarHBondContact O-CB 3.46Å; E148-E152 PolarHBondContact O-N 3.26Å
149	S	94.3	Very high	93	Very high	46 Å²	46	61.9 Å²	61.9	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-63.9	-34.3	176.5	176	0	0	0	0	111.8	T146 C153	T146-S149 PolarHBondContact O-N 3.04Å; T146-S149 WeakPolarHBondContact OG1-CB 3.37Å; T146-S149 PolarHBondContact OG1-N 3.31Å; S149-C153 WeakPolarHBondContact O-CB 3.25Å; S149-C153 PolarHBondContact O-N 2.99Å
150	A	93.7	Very high	93	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-44.5	176.8	0	0	0	0	0	111.7	L117 V119 A144 T146 P147 E148 F154 V177	L117-A150 HydrophobicContact CD2-CB 4.42Å; L117-A150 WeakPolarHBondContact CD2-O 3.49Å; V119-A150 HydrophobicContact CB-CB 4.48Å; V119-A150 HydrophobicContact CG1-CB 3.87Å; V119-A150 HydrophobicContact CG2-CB 3.73Å; A144-A150 VanDerWaalsContact CB-CA 3.45Å; A144-A150 HydrophobicContact CB-CB 3.75Å; T146-A150 PolarHBondContact O-N 2.96Å; P147-A150 WeakPolarHBondContact O-CB 3.28Å; P147-A150 PolarHBondContact O-N 2.64Å; E148-A150 VanDerWaalsContact C-N 3.28Å; E148-A150 PolarHBondContact O-N 3.31Å; A150-F154 VanDerWaalsContact O-CB 3.32Å; A150-F154 WeakPolarHBondContact O-CB 3.4Å; A150-F154 PolarHBondContact O-N 3.28Å; A150-V177 HydrophobicContact CB-CG1 4.36Å
151	V	93	Very high	93	Very high	23 Å²	23	55.4 Å²	55.4	14%	0.139	28%	0.279	C	S	.	.	H	α-helix	trans	-68.7	-42.4	177.9	176.3	0	0	0	0	111.4	P147 E148 F154 L155 M180 I181	P147-V151 WeakPolarHBondContact O-CG2 3.38Å; P147-V151 PolarHBondContact O-N 2.98Å; P147-V151 VanDerWaalsContact O-N 3.11Å; E148-V151 PolarHBondContact O-N 3.48Å; V151-F154 PolarHBondContact O-N 3.34Å; V151-L155 HydrophobicContact CG1-CD1 3.99Å; V151-L155 HydrophobicContact CG1-CG 4.42Å; V151-L155 VanDerWaalsContact O-CG 3.31Å; V151-L155 WeakPolarHBondContact O-CG 3.32Å; V151-L155 PolarHBondContact O-N 2.84Å; V151-M180 HydrophobicContact CG2-CB 3.92Å; V151-M180 HydrophobicContact CG2-CE 4.12Å; V151-I181 HydrophobicContact CG2-CG1 4.07Å
152	E	93.1	Very high	93.1	Very high	143 Å²	143	53.9 Å²	53.9	67%	0.668	27%	0.269	S	S	*	.	H	α-helix	trans	-60.4	-47.1	175.9	-174.8	178.6	-168.4	0	0	111.4	E148 F154 L155 D156	E148-E152 WeakPolarHBondContact O-CB 3.46Å; E148-E152 PolarHBondContact O-N 3.26Å; E152-F154 VanDerWaalsContact C-N 3.34Å; E152-F154 PolarHBondContact O-N 3.28Å; E152-L155 PolarHBondContact O-N 3.23Å; E152-D156 PolarHBondContact O-N 3.43Å; E152-D156 VanDerWaalsContact O-N 3.11Å
153	C	93.3	Very high	93.2	Very high	26 Å²	26	51.5 Å²	51.5	18%	0.176	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-40.4	178.2	-166.8	0	0	0	0	111.8	L117 S149 D156 K157 H159	L117-C153 HydrophobicContact CD1-CB 4.19Å; S149-C153 WeakPolarHBondContact O-CB 3.25Å; S149-C153 PolarHBondContact O-N 2.99Å; C153-D156 PolarHBondContact O-N 2.87Å; C153-K157 PolarHBondContact O-N 2.83Å; C153-H159 PolarHBondContact O-CE1 3.3Å; C153-H159 VanDerWaalsContact SG-CE1 3.56Å
154	F	93.8	Very high	93.2	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-40.9	176.5	177.6	-106.4	0	0	0	112.8	L117 A150 V151 E152 D156 H158 H159 I162 I181 T184 P186 T190	L117-F154 HydrophobicContact CD2-CB 4.35Å; A150-F154 VanDerWaalsContact O-CB 3.32Å; A150-F154 WeakPolarHBondContact O-CB 3.4Å; A150-F154 PolarHBondContact O-N 3.28Å; V151-F154 PolarHBondContact O-N 3.34Å; E152-F154 VanDerWaalsContact C-N 3.34Å; E152-F154 PolarHBondContact O-N 3.28Å; F154-D156 VanDerWaalsContact C-N 3.32Å; F154-D156 PolarHBondContact O-N 2.76Å; F154-H158 WeakPolarHBondContact O-CA 3.18Å; F154-H158 PolarHBondContact O-N 2.95Å; F154-H158 PolarHBondContact O-ND1 2.99Å; F154-H159 HydrophobicContact CD2-CB 4.38Å; F154-I162 HydrophobicContact CD2-CD1 3.57Å; F154-I162 HydrophobicContact CE2-CD1 3.96Å; F154-I162 HydrophobicContact CG-CD1 4.22Å; F154-I181 HydrophobicContact CD1-CG2 3.96Å; F154-I181 HydrophobicContact CE1-CG2 4.02Å; F154-I181 HydrophobicContact CG-CG2 4.22Å; F154-I181 HydrophobicContact CZ-CG2 4.33Å; F154-T184 VanDerWaalsContact CE1-OG1 3.25Å; F154-T184 WeakPolarHBondContact CE1-OG1 3.09Å; F154-P186 HydrophobicContact CE1-CB 4.18Å; F154-P186 HydrophobicContact CZ-CB 4.12Å; F154-T190 HydrophobicContact CE2-CG2 4.11Å; F154-T190 WeakPolarHBondContact CE2-OG1 3.46Å
155	L	91.4	Very high	93.2	Very high	85 Å²	85	48.4 Å²	48.4	45%	0.445	24%	0.24	S	C	.	.	H	α-helix	trans	-70	-28	178.9	-71.3	173.7	0	0	0	113	V151 E152 H158 T184	V151-L155 HydrophobicContact CG1-CD1 3.99Å; V151-L155 HydrophobicContact CG1-CG 4.42Å; V151-L155 VanDerWaalsContact O-CG 3.31Å; V151-L155 WeakPolarHBondContact O-CG 3.32Å; V151-L155 PolarHBondContact O-N 2.84Å; E152-L155 PolarHBondContact O-N 3.23Å; L155-H158 PolarHBondContact O-CE1 2.95Å; L155-T184 HydrophobicContact CD2-CG2 3.94Å
156	D	90.9	Very high	93	Very high	105 Å²	105	43 Å²	43	56%	0.561	23%	0.226	S	C	*	.	H	α-helix	trans	-82.4	-39.6	177.3	179.4	54.6	0	0	0	113.1	E152 C153 F154	E152-D156 PolarHBondContact O-N 3.43Å; E152-D156 VanDerWaalsContact O-N 3.11Å; C153-D156 PolarHBondContact O-N 2.87Å; F154-D156 VanDerWaalsContact C-N 3.32Å; F154-D156 PolarHBondContact O-N 2.76Å
157	K	87	Confident	92.9	Very high	102 Å²	102	41 Å²	41	44%	0.443	21%	0.211	S	C	.	.	H	α-helix	trans	-112.4	-13.2	-169.7	-59.7	-58.9	-173.1	-131.2	0	115.7	C153	C153-K157 PolarHBondContact O-N 2.83Å
158	H	85.9	Confident	92.4	Very high	100 Å²	100	44 Å²	44	46%	0.463	22%	0.223	S	C	.	.			trans	53.4	55.9	176.4	-58.2	-41.4	0	0	0	114.9	F154 L155	F154-H158 WeakPolarHBondContact O-CA 3.18Å; F154-H158 PolarHBondContact O-N 2.95Å; F154-H158 PolarHBondContact O-ND1 2.99Å; L155-H158 PolarHBondContact O-CE1 2.95Å
159	H	93.8	Very high	91.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.			trans	-58.2	138.4	-177.8	-52.5	85.1	0	0	0	114	Q115 V116 L117 N142 C153 F154 I162 T190	Q115-H159 HydrophobicContact CB-CB 4.34Å; V116-H159 VanDerWaalsContact C-CD2 3.48Å; L117-H159 HydrophobicContact CB-CB 4.09Å; N142-H159 PolarHBondContact OD1-NE2 2.92Å; C153-H159 PolarHBondContact O-CE1 3.3Å; C153-H159 VanDerWaalsContact SG-CE1 3.56Å; F154-H159 HydrophobicContact CD2-CB 4.38Å; H159-I162 HydrophobicContact CB-CG1 4.24Å; H159-T190 VanDerWaalsContact O-CG2 3.27Å; H159-T190 WeakPolarHBondContact O-CG2 3.28Å; H159-T190 PolarHBondContact O-OG1 2.72Å
160	E	93.4	Very high	90.9	Very high	32 Å²	32	50.6 Å²	50.6	15%	0.15	25%	0.245	C	C	.	.	S	Bend	trans	-79.3	-31.9	173.3	-66.5	89.8	164.3	0	0	112.8	I114 Q115 V191 V241	I114-E160 HydrophobicContact CG2-CB 4.31Å; Q115-E160 WeakPolarHBondContact CA-OE2 3.43Å; Q115-E160 VanDerWaalsContact CB-OE2 3.31Å; Q115-E160 WeakPolarHBondContact CB-OE2 3.5Å; Q115-E160 PolarHBondContact N-OE2 2.94Å; Q115-E160 PolarHBondContact O-N 2.84Å; Q115-E160 VanDerWaalsContact O-N 3.09Å; E160-V191 PolarHBondContact O-N 2.87Å; E160-V241 HydrophobicContact CB-CG1 4.07Å; E160-V241 HydrophobicContact CG-CG1 4.36Å
161	I	95.8	Very high	90.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	132.7	178.6	-53.6	175.1	0	0	0	109.1	I114 Q115 V116 L117 F139 V163 V191 L233 I236 V241	I114-I161 HydrophobicContact CG2-CD1 4.04Å; I114-I161 HydrophobicContact CG2-CG1 4.31Å; Q115-I161 PolarHBondContact O-N 2.88Å; V116-I161 CarbonylContact C-O 3.58Å; V116-I161 VanDerWaalsContact CA-O 3.3Å; V116-I161 WeakPolarHBondContact CA-O 3.36Å; V116-I161 HydrophobicContact CG1-CB 4.21Å; V116-I161 HydrophobicContact CG1-CG2 4.22Å; V116-I161 HydrophobicContact CG2-CB 4.13Å; V116-I161 HydrophobicContact CG2-CD1 4.31Å; L117-I161 PolarHBondContact N-O 3.09Å; F139-I161 HydrophobicContact CE2-CD1 4.46Å; I161-V163 HydrophobicContact CG2-CG2 4.39Å; I161-V191 CarbonylContact C-O 3.48Å; I161-V191 WeakPolarHBondContact CA-O 3.32Å; I161-L233 HydrophobicContact CD1-CD2 4.46Å; I161-L233 HydrophobicContact CG2-CD2 4.28Å; I161-I236 HydrophobicContact CD1-CB 4.47Å; I161-I236 HydrophobicContact CD1-CG2 3.76Å; I161-I236 HydrophobicContact CG1-CG2 3.98Å; I161-V241 HydrophobicContact CD1-CG2 4.02Å; I161-V241 HydrophobicContact CG1-CG2 3.68Å
162	I	96.9	Very high	90.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	126	172.6	-53.3	-177.7	0	0	0	108.6	L117 V119 F154 H159 I164 I181 T190 V191 I192 L193	L117-I162 HydrophobicContact CB-CG1 4.14Å; L117-I162 HydrophobicContact CB-CG2 4.26Å; L117-I162 HydrophobicContact CD2-CD1 4.39Å; L117-I162 HydrophobicContact CD2-CG2 4.26Å; L117-I162 HydrophobicContact CG-CG2 4.38Å; L117-I162 CarbonylContact O-C 3.55Å; L117-I162 WeakPolarHBondContact O-CA 3.45Å; V119-I162 HydrophobicContact CG2-CG2 3.88Å; F154-I162 HydrophobicContact CD2-CD1 3.57Å; F154-I162 HydrophobicContact CE2-CD1 3.96Å; F154-I162 HydrophobicContact CG-CD1 4.22Å; H159-I162 HydrophobicContact CB-CG1 4.24Å; I162-I164 HydrophobicContact CG2-CD1 4.32Å; I162-I164 HydrophobicContact CG2-CG1 3.85Å; I162-I181 HydrophobicContact CD1-CD1 3.9Å; I162-I181 HydrophobicContact CD1-CG2 3.86Å; I162-I181 HydrophobicContact CG2-CD1 4.25Å; I162-T190 HydrophobicContact CD1-CG2 3.67Å; I162-T190 HydrophobicContact CG1-CG2 3.63Å; I162-V191 PolarHBondContact N-O 2.87Å; I162-I192 HydrophobicContact CB-CG1 4.38Å; I162-I192 HydrophobicContact CB-CG2 4.37Å; I162-I192 CarbonylContact O-C 3.59Å; I162-I192 WeakPolarHBondContact O-CA 3.26Å; I162-L193 PolarHBondContact O-N 3.31Å
163	V	97.1	Very high	90.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	118.6	175	-176.4	0	0	0	0	107.9	V116 L117 L118 V119 F120 F130 I161 L193 V195	V116-V163 HydrophobicContact CG1-CG2 4.5Å; L117-V163 PolarHBondContact O-N 2.97Å; L118-V163 HydrophobicContact CD2-CB 3.74Å; L118-V163 HydrophobicContact CD2-CG1 4.49Å; L118-V163 HydrophobicContact CD2-CG2 3.76Å; V119-V163 PolarHBondContact N-O 2.83Å; F120-V163 HydrophobicContact CE2-CB 4.35Å; F120-V163 HydrophobicContact CE2-CG1 3.85Å; F120-V163 HydrophobicContact CZ-CG1 3.95Å; F130-V163 HydrophobicContact CD1-CG2 4.36Å; F130-V163 HydrophobicContact CD2-CG1 4.15Å; F130-V163 HydrophobicContact CE1-CG1 4.41Å; F130-V163 HydrophobicContact CE1-CG2 4.39Å; F130-V163 HydrophobicContact CE2-CG1 3.97Å; F130-V163 HydrophobicContact CG-CG1 4.44Å; F130-V163 HydrophobicContact CZ-CG1 4.12Å; I161-V163 HydrophobicContact CG2-CG2 4.39Å; V163-L193 HydrophobicContact CG1-CD2 4.25Å; V163-L193 HydrophobicContact CG2-CB 4.34Å; V163-L193 HydrophobicContact CG2-CD2 4.11Å; V163-V195 HydrophobicContact CG1-CG2 3.47Å; V163-V195 VanDerWaalsContact CG1-CG2 3.47Å
164	I	96.4	Very high	90	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.7	-179.6	-52.1	-177.1	0	0	0	109.3	V119 I162 G166 F172 P174 V177 C178 I181 I192 L193 V195 F216	V119-I164 HydrophobicContact CB-CG1 4.26Å; V119-I164 HydrophobicContact CB-CG2 4.46Å; V119-I164 HydrophobicContact CG2-CG1 4.3Å; I162-I164 HydrophobicContact CG2-CD1 4.32Å; I162-I164 HydrophobicContact CG2-CG1 3.85Å; I164-G166 PolarHBondContact O-N 3.19Å; I164-F172 HydrophobicContact CG2-CE2 3.98Å; I164-P174 HydrophobicContact CG2-CB 3.81Å; I164-V177 HydrophobicContact CD1-CB 4.29Å; I164-V177 HydrophobicContact CD1-CG1 4.06Å; I164-C178 HydrophobicContact CD1-CB 4.18Å; I164-I181 HydrophobicContact CD1-CD1 4.31Å; I164-I192 HydrophobicContact CD1-CG2 3.59Å; I164-I192 HydrophobicContact CG1-CG2 3.95Å; I164-L193 PolarHBondContact N-O 2.87Å; I164-V195 PolarHBondContact O-N 3.08Å; I164-F216 HydrophobicContact CB-CE1 3.99Å; I164-F216 HydrophobicContact CB-CZ 4.33Å; I164-F216 HydrophobicContact CD1-CE1 3.89Å; I164-F216 HydrophobicContact CD1-CZ 4.19Å; I164-F216 HydrophobicContact CG1-CE1 4.21Å
165	D	94.6	Very high	90	Very high	10 Å²	10	55.5 Å²	55.5	5%	0.053	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	113	175.4	-167.1	4.5	0	0	0	111.3	V119 F120 R167 H168	V119-D165 PolarHBondContact O-N 3.13Å; F120-D165 HydrophobicContact CD1-CB 3.57Å; F120-D165 WeakPolarHBondContact CD1-OD2 3.3Å; F120-D165 HydrophobicContact CE1-CB 3.81Å; F120-D165 HydrophobicContact CG-CB 4.02Å; F120-D165 HydrophobicContact CZ-CB 4.44Å; D165-R167 VanDerWaalsContact OD1-CB 3.28Å; D165-R167 WeakPolarHBondContact OD1-CB 3.27Å; D165-R167 VanDerWaalsContact OD1-CG 3.32Å; D165-R167 WeakPolarHBondContact OD1-CG 3.33Å; D165-R167 IonicContact OD1-CZ 2.85Å; D165-R167 PolarHBondContact OD1-N 3.31Å; D165-R167 IonicContact OD1-NE 2.7Å; D165-R167 PolarHBondContact OD1-NE 2.97Å; D165-R167 IonicContact OD1-NH2 3.2Å; D165-R167 IonicContact OD2-CZ 3.99Å; D165-R167 IonicContact OD2-NE 2.83Å; D165-R167 IonicContact OD2-NH2 2.84Å; D165-R167 PolarHBondContact OD2-NH2 3.29Å; D165-H168 IonicContact OD2-ND1 3.61Å
166	G	89.9	Confident	90	Very high	19 Å²	19	53.1 Å²	53.1	20%	0.196	25%	0.253	C	S	.	.			trans	-108.1	9.1	173.7	0	0	0	0	0	113.9	I164 H168 V195	I164-G166 PolarHBondContact O-N 3.19Å; G166-H168 VanDerWaalsContact C-N 3.32Å; G166-V195 CarbonylContact C-O 3.54Å; G166-V195 VanDerWaalsContact C-O 3.26Å; G166-V195 WeakPolarHBondContact CA-O 3.41Å; G166-V195 PolarHBondContact N-O 3.13Å
167	R	89.8	Confident	90.1	Very high	22 Å²	22	48.2 Å²	48.2	8%	0.083	23%	0.227	C	C	.	.	S	Bend	trans	-71.1	-29.9	178.4	-61.4	173.4	-66.8	152.4	5.5	112.5	D124 Q126 D165 V195 P197 E222	D124-R167 IonicContact OD1-NH1 3.59Å; D124-R167 IonicContact OD1-NH2 3.99Å; D124-R167 PolarHBondContact OD1-NH2 3.28Å; D124-R167 IonicContact OD2-CZ 3.3Å; D124-R167 VanDerWaalsContact OD2-CZ 3.24Å; D124-R167 IonicContact OD2-NH1 3.93Å; D124-R167 PolarHBondContact OD2-NH1 2.81Å; D124-R167 IonicContact OD2-NH2 3.67Å; D124-R167 PolarHBondContact OD2-NH2 2.9Å; Q126-R167 VanDerWaalsContact CB-CZ 3.46Å; D165-R167 VanDerWaalsContact OD1-CB 3.28Å; D165-R167 WeakPolarHBondContact OD1-CB 3.27Å; D165-R167 VanDerWaalsContact OD1-CG 3.32Å; D165-R167 WeakPolarHBondContact OD1-CG 3.33Å; D165-R167 IonicContact OD1-CZ 2.85Å; D165-R167 PolarHBondContact OD1-N 3.31Å; D165-R167 IonicContact OD1-NE 2.7Å; D165-R167 PolarHBondContact OD1-NE 2.97Å; D165-R167 IonicContact OD1-NH2 3.2Å; D165-R167 IonicContact OD2-CZ 3.99Å; D165-R167 IonicContact OD2-NE 2.83Å; D165-R167 IonicContact OD2-NH2 2.84Å; D165-R167 PolarHBondContact OD2-NH2 3.29Å; R167-V195 HydrophobicContact CG-CG1 3.98Å; R167-V195 PolarHBondContact N-O 3.5Å; R167-P197 HydrophobicContact CB-CB 4.44Å; R167-P197 HydrophobicContact CG-CB 4.39Å; R167-E222 VanDerWaalsContact CD-OE1 3.26Å; R167-E222 WeakPolarHBondContact CD-OE1 3.38Å; R167-E222 IonicContact CZ-OE1 3.53Å; R167-E222 IonicContact NE-OE1 2.72Å; R167-E222 IonicContact NH1-OE1 3.24Å; R167-E222 PolarHBondContact NH1-OE1 3.4Å
168	H	82.3	Confident	90.5	Very high	88 Å²	88	43.4 Å²	43.4	41%	0.407	21%	0.206	S	C	.	.			trans	-130.1	78.1	-172.2	-58.3	100	0	0	0	112.1	D165 G166 R170 Y171	D165-H168 IonicContact OD2-ND1 3.61Å; G166-H168 VanDerWaalsContact C-N 3.32Å; H168-R170 PolarHBondContact O-N 2.99Å; H168-Y171 HydrophobicContact CB-CD2 3.63Å; H168-Y171 HydrophobicContact CB-CE2 3.81Å; H168-Y171 PolarHBondContact O-N 3.43Å
169	S	77	Confident	90.9	Very high	63 Å²	63	45.2 Å²	45.2	44%	0.441	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-15.3	177.9	61.2	0	0	0	0	114.6	Y171 E173	S169-Y171 PolarHBondContact O-N 3.35Å; S169-E173 WeakPolarHBondContact CB-OE1 3.44Å
170	R	80.6	Confident	90.8	Very high	244 Å²	244	49.2 Å²	49.2	92%	0.921	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.8	175.8	-64.4	-174.1	-176.3	-166.2	1.7	114.4	H168	H168-R170 PolarHBondContact O-N 2.99Å
171	Y	82.9	Confident	90.8	Very high	117 Å²	117	47.7 Å²	47.7	46%	0.459	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-48	179.8	-62.4	-72.1	0	0	0	111.8	A121 K122 H168 S169	A121-Y171 HydrophobicContact CB-CD1 4.06Å; A121-Y171 HydrophobicContact CB-CD2 3.79Å; A121-Y171 HydrophobicContact CB-CG 3.47Å; A121-Y171 VanDerWaalsContact CB-CG 3.47Å; K122-Y171 HydrophobicContact CD-CE1 4.23Å; K122-Y171 HydrophobicContact CD-CE2 4.39Å; K122-Y171 WeakPolarHBondContact CD-OH 3.47Å; K122-Y171 WeakPolarHBondContact CE-OH 3.25Å; K122-Y171 HydrophobicContact CG-CE1 4.48Å; K122-Y171 PolarHBondContact NZ-OH 3.49Å; H168-Y171 HydrophobicContact CB-CD2 3.63Å; H168-Y171 HydrophobicContact CB-CE2 3.81Å; H168-Y171 PolarHBondContact O-N 3.43Å; S169-Y171 PolarHBondContact O-N 3.35Å
172	F	88.8	Confident	90.7	Very high	18 Å²	18	51 Å²	51	8%	0.079	23%	0.234	C	C	.	.			trans	-157.5	154.9	170.8	53.4	-103.2	0	0	0	109.6	V119 A121 P147 I164 P174 V177	V119-F172 HydrophobicContact CG1-CE1 4.46Å; V119-F172 HydrophobicContact CG1-CE2 4.28Å; V119-F172 HydrophobicContact CG1-CZ 3.84Å; A121-F172 HydrophobicContact CB-CD1 4.18Å; A121-F172 HydrophobicContact CB-CE1 3.68Å; P147-F172 HydrophobicContact CG-CB 3.63Å; P147-F172 HydrophobicContact CG-CD1 4.34Å; P147-F172 HydrophobicContact CG-CG 4Å; I164-F172 HydrophobicContact CG2-CE2 3.98Å; F172-P174 WeakPolarHBondContact O-CD 3.31Å; F172-V177 HydrophobicContact CD2-CG2 3.68Å; F172-V177 HydrophobicContact CE2-CG2 4.22Å; F172-V177 HydrophobicContact CG-CG2 4.28Å
173	E	90.4	Very high	90.3	Very high	101 Å²	101	55.1 Å²	55.1	47%	0.472	27%	0.268	S	S	.	.			trans	-80.5	114.5	175.3	-65.9	-64	137	0	0	109.6	S169 E175 A176 V177	S169-E173 WeakPolarHBondContact CB-OE1 3.44Å; E173-E175 VanDerWaalsContact C-N 3.3Å; E173-E175 PolarHBondContact O-N 2.93Å; E173-A176 HydrophobicContact CB-CB 3.96Å; E173-A176 WeakPolarHBondContact O-CB 3.5Å; E173-A176 PolarHBondContact O-N 3.17Å; E173-V177 PolarHBondContact O-N 3.49Å
174	P	91.4	Very high	89.9	Confident	8 Å²	8	56.3 Å²	56.3	5%	0.052	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-34.4	-173	27.6	-36.2	0	0	0	112.3	I164 F172 A176 V177 C178 F216	I164-P174 HydrophobicContact CG2-CB 3.81Å; F172-P174 WeakPolarHBondContact O-CD 3.31Å; P174-A176 VanDerWaalsContact C-N 3.29Å; P174-A176 PolarHBondContact O-N 2.99Å; P174-V177 PolarHBondContact O-N 2.94Å; P174-C178 WeakPolarHBondContact O-CB 3.16Å; P174-C178 PolarHBondContact O-N 3.05Å; P174-F216 HydrophobicContact CB-CZ 4.13Å; P174-F216 WeakPolarHBondContact O-CZ 3.21Å
175	E	92.6	Very high	88.9	Confident	51 Å²	51	65.6 Å²	65.6	24%	0.238	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-31.4	175.4	-61.2	82.5	177.5	0	0	112.2	E173 R179 A214 F216	E173-E175 VanDerWaalsContact C-N 3.3Å; E173-E175 PolarHBondContact O-N 2.93Å; E175-R179 WeakPolarHBondContact O-CB 3.47Å; E175-R179 WeakPolarHBondContact O-CG 3.35Å; E175-R179 PolarHBondContact O-N 3.02Å; E175-A214 HydrophobicContact CB-CB 3.66Å; E175-A214 HydrophobicContact CG-CB 3.66Å; E175-F216 HydrophobicContact CG-CE2 4.28Å
176	A	92.1	Very high	88	Confident	36 Å²	36	67.4 Å²	67.4	30%	0.298	33%	0.328	S	S	.	.	H	α-helix	trans	-68.8	-45.5	176.1	0	0	0	0	0	110.6	E173 P174 C178 R179 M180	E173-A176 HydrophobicContact CB-CB 3.96Å; E173-A176 WeakPolarHBondContact O-CB 3.5Å; E173-A176 PolarHBondContact O-N 3.17Å; P174-A176 VanDerWaalsContact C-N 3.29Å; P174-A176 PolarHBondContact O-N 2.99Å; A176-C178 VanDerWaalsContact C-N 3.34Å; A176-C178 PolarHBondContact O-N 3.32Å; A176-R179 PolarHBondContact O-N 3.47Å; A176-M180 VanDerWaalsContact O-CG 3.28Å; A176-M180 WeakPolarHBondContact O-CG 3.32Å; A176-M180 PolarHBondContact O-N 3.46Å
177	V	93.4	Very high	87.6	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.012	32%	0.319	C	S	.	.	H	α-helix	trans	-60.6	-45.2	175.6	-173.9	0	0	0	0	110.9	V119 P147 A150 I164 F172 E173 P174 R179 M180 I181	V119-V177 HydrophobicContact CG1-CG1 4.42Å; P147-V177 HydrophobicContact CB-CG2 3.86Å; P147-V177 HydrophobicContact CG-CG2 3.79Å; A150-V177 HydrophobicContact CB-CG1 4.36Å; I164-V177 HydrophobicContact CD1-CB 4.29Å; I164-V177 HydrophobicContact CD1-CG1 4.06Å; F172-V177 HydrophobicContact CD2-CG2 3.68Å; F172-V177 HydrophobicContact CE2-CG2 4.22Å; F172-V177 HydrophobicContact CG-CG2 4.28Å; E173-V177 PolarHBondContact O-N 3.49Å; P174-V177 PolarHBondContact O-N 2.94Å; V177-R179 PolarHBondContact O-N 3.1Å; V177-M180 WeakPolarHBondContact O-CB 3.25Å; V177-M180 PolarHBondContact O-N 3Å; V177-I181 HydrophobicContact CG1-CD1 4.04Å; V177-I181 WeakPolarHBondContact O-CG1 3.4Å; V177-I181 PolarHBondContact O-N 2.7Å
178	C	94.8	Very high	87	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-58.4	-47.7	177	-171.7	0	0	0	0	111.6	I164 P174 A176 M180 I181 R182 A214 F216	I164-C178 HydrophobicContact CD1-CB 4.18Å; P174-C178 WeakPolarHBondContact O-CB 3.16Å; P174-C178 PolarHBondContact O-N 3.05Å; A176-C178 VanDerWaalsContact C-N 3.34Å; A176-C178 PolarHBondContact O-N 3.32Å; C178-M180 VanDerWaalsContact C-N 3.34Å; C178-M180 PolarHBondContact O-N 3.43Å; C178-I181 PolarHBondContact O-N 3.19Å; C178-R182 WeakPolarHBondContact O-CB 3.3Å; C178-R182 VanDerWaalsContact O-CG 3.29Å; C178-R182 WeakPolarHBondContact O-CG 3.38Å; C178-R182 PolarHBondContact O-N 3.32Å; C178-A214 PolarHBondContact SG-O 3.21Å; C178-F216 HydrophobicContact CB-CD1 4.49Å; C178-F216 HydrophobicContact CB-CD2 4.15Å; C178-F216 HydrophobicContact CB-CE1 4.02Å; C178-F216 HydrophobicContact CB-CE2 3.64Å; C178-F216 HydrophobicContact CB-CZ 3.56Å
179	R	94.1	Very high	87	Confident	139 Å²	139	70.5 Å²	70.5	53%	0.525	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-38.9	175.7	-75.8	-173.1	-65.1	-93.4	-1.2	112.9	E175 A176 V177 R182 A183	E175-R179 WeakPolarHBondContact O-CB 3.47Å; E175-R179 WeakPolarHBondContact O-CG 3.35Å; E175-R179 PolarHBondContact O-N 3.02Å; A176-R179 PolarHBondContact O-N 3.47Å; V177-R179 PolarHBondContact O-N 3.1Å; R179-R182 PolarHBondContact O-N 2.93Å; R179-A183 WeakPolarHBondContact O-CB 3.29Å; R179-A183 PolarHBondContact O-N 3.42Å
180	M	93.1	Very high	87.6	Confident	83 Å²	83	67.9 Å²	67.9	41%	0.409	32%	0.322	S	S	.	.	H	α-helix	trans	-62.7	-44.5	176.6	-71.2	170.3	73.1	0	0	111.5	P147 V151 A176 V177 C178 A183	P147-M180 HydrophobicContact CB-SD 4.47Å; V151-M180 HydrophobicContact CG2-CB 3.92Å; V151-M180 HydrophobicContact CG2-CE 4.12Å; A176-M180 VanDerWaalsContact O-CG 3.28Å; A176-M180 WeakPolarHBondContact O-CG 3.32Å; A176-M180 PolarHBondContact O-N 3.46Å; V177-M180 WeakPolarHBondContact O-CB 3.25Å; V177-M180 PolarHBondContact O-N 3Å; C178-M180 VanDerWaalsContact C-N 3.34Å; C178-M180 PolarHBondContact O-N 3.43Å; M180-A183 PolarHBondContact O-N 3.24Å
181	I	93.3	Very high	88.3	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-47	176.4	-66.3	167.6	0	0	0	110	V151 F154 I162 I164 V177 C178 A183 T184 S187 I192	V151-I181 HydrophobicContact CG2-CG1 4.07Å; F154-I181 HydrophobicContact CD1-CG2 3.96Å; F154-I181 HydrophobicContact CE1-CG2 4.02Å; F154-I181 HydrophobicContact CG-CG2 4.22Å; F154-I181 HydrophobicContact CZ-CG2 4.33Å; I162-I181 HydrophobicContact CD1-CD1 3.9Å; I162-I181 HydrophobicContact CD1-CG2 3.86Å; I162-I181 HydrophobicContact CG2-CD1 4.25Å; I164-I181 HydrophobicContact CD1-CD1 4.31Å; V177-I181 HydrophobicContact CG1-CD1 4.04Å; V177-I181 WeakPolarHBondContact O-CG1 3.4Å; V177-I181 PolarHBondContact O-N 2.7Å; C178-I181 PolarHBondContact O-N 3.19Å; I181-A183 PolarHBondContact O-N 2.85Å; I181-T184 WeakPolarHBondContact O-CB 3.46Å; I181-T184 PolarHBondContact O-N 3.29Å; I181-T184 PolarHBondContact O-OG1 3.19Å; I181-S187 WeakPolarHBondContact O-CB 3.45Å; I181-S187 PolarHBondContact O-OG 2.85Å; I181-I192 HydrophobicContact CB-CD1 4.43Å; I181-I192 HydrophobicContact CG2-CD1 4.03Å
182	R	92.6	Very high	88.9	Confident	69 Å²	69	50.9 Å²	50.9	26%	0.26	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-23.9	178.9	-70.9	-65.9	-169.7	-158.9	-3.2	114.1	C178 R179 T184 S187 T190 I192 G215 S217	C178-R182 WeakPolarHBondContact O-CB 3.3Å; C178-R182 VanDerWaalsContact O-CG 3.29Å; C178-R182 WeakPolarHBondContact O-CG 3.38Å; C178-R182 PolarHBondContact O-N 3.32Å; R179-R182 PolarHBondContact O-N 2.93Å; R182-T184 PolarHBondContact O-N 3.24Å; R182-S187 VanDerWaalsContact CA-OG 3.3Å; R182-S187 WeakPolarHBondContact CA-OG 3.36Å; R182-S187 PolarHBondContact NH1-O 3.29Å; R182-S187 PolarHBondContact O-OG 2.78Å; R182-T190 PolarHBondContact NH1-O 2.91Å; R182-T190 PolarHBondContact NH2-O 2.84Å; R182-T190 VanDerWaalsContact NH2-O 3.15Å; R182-I192 HydrophobicContact CG-CD1 4.1Å; R182-G215 VanDerWaalsContact CZ-O 3.31Å; R182-G215 PolarHBondContact NE-O 2.79Å; R182-G215 PolarHBondContact NH2-O 3.05Å; R182-S217 PolarHBondContact NH2-OG 2.96Å; R182-S217 VanDerWaalsContact NH2-OG 3.09Å
183	A	90.1	Very high	89.2	Confident	87 Å²	87	50 Å²	50	72%	0.719	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.1	173.8	0	0	0	0	0	113.3	R179 M180 I181	R179-A183 WeakPolarHBondContact O-CB 3.29Å; R179-A183 PolarHBondContact O-N 3.42Å; M180-A183 PolarHBondContact O-N 3.24Å; I181-A183 PolarHBondContact O-N 2.85Å
184	T	87.7	Confident	89.4	Confident	25 Å²	25	45.3 Å²	45.3	15%	0.153	23%	0.232	C	C	.	.	S	Bend	trans	-90.3	143.1	177.4	71.5	0	0	0	0	111.4	F154 L155 I181 R182 P186 S187	F154-T184 VanDerWaalsContact CE1-OG1 3.25Å; F154-T184 WeakPolarHBondContact CE1-OG1 3.09Å; L155-T184 HydrophobicContact CD2-CG2 3.94Å; I181-T184 WeakPolarHBondContact O-CB 3.46Å; I181-T184 PolarHBondContact O-N 3.29Å; I181-T184 PolarHBondContact O-OG1 3.19Å; R182-T184 PolarHBondContact O-N 3.24Å; T184-P186 VanDerWaalsContact C-CD 3.45Å; T184-S187 WeakPolarHBondContact O-CB 3.42Å; T184-S187 PolarHBondContact O-N 3.31Å; T184-S187 PolarHBondContact O-OG 3.13Å
185	K	75.8	Confident	89.6	Confident	196 Å²	196	44.9 Å²	44.9	85%	0.852	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-56.1	-39.7	-179	-66.3	-175.6	177.7	-177.5	0	115.1	S187	K185-S187 PolarHBondContact O-N 2.73Å
186	P	76.1	Confident	89.5	Confident	48 Å²	48	43.8 Å²	43.8	31%	0.312	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-71.3	-12.3	-177.3	-19.5	33.7	0	0	0	114.5	F154 T184 E188	F154-P186 HydrophobicContact CE1-CB 4.18Å; F154-P186 HydrophobicContact CZ-CB 4.12Å; T184-P186 VanDerWaalsContact C-CD 3.45Å; P186-E188 VanDerWaalsContact C-N 3.28Å; P186-E188 PolarHBondContact O-N 2.93Å
187	S	81	Confident	89.4	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.014	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-74.9	-11.1	-170.6	70.6	0	0	0	0	114.9	I181 R182 T184 K185 S189 T190	I181-S187 WeakPolarHBondContact O-CB 3.45Å; I181-S187 PolarHBondContact O-OG 2.85Å; R182-S187 VanDerWaalsContact CA-OG 3.3Å; R182-S187 WeakPolarHBondContact CA-OG 3.36Å; R182-S187 PolarHBondContact NH1-O 3.29Å; R182-S187 PolarHBondContact O-OG 2.78Å; T184-S187 WeakPolarHBondContact O-CB 3.42Å; T184-S187 PolarHBondContact O-N 3.31Å; T184-S187 PolarHBondContact O-OG 3.13Å; K185-S187 PolarHBondContact O-N 2.73Å; S187-S189 PolarHBondContact O-N 2.8Å; S187-T190 PolarHBondContact O-N 3.15Å; S187-T190 VanDerWaalsContact O-N 3.13Å
188	E	77.3	Confident	88.8	Confident	168 Å²	168	51.8 Å²	51.8	79%	0.785	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-58.2	-32.8	-176.4	-68.3	-177.8	175.5	0	0	112.8	P186	P186-E188 VanDerWaalsContact C-N 3.28Å; P186-E188 PolarHBondContact O-N 2.93Å
189	S	81.1	Confident	87.9	Confident	24 Å²	24	56.7 Å²	56.7	17%	0.168	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-100.4	5.4	-179.4	57.7	0	0	0	0	114.8	S187	S187-S189 PolarHBondContact O-N 2.8Å
190	T	91.1	Very high	86.4	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.043	29%	0.291	C	S	.	.			trans	-92.4	135.3	-176.8	-61.2	0	0	0	0	111.2	F154 H159 I162 R182 S187 I192	F154-T190 HydrophobicContact CE2-CG2 4.11Å; F154-T190 WeakPolarHBondContact CE2-OG1 3.46Å; H159-T190 VanDerWaalsContact O-CG2 3.27Å; H159-T190 WeakPolarHBondContact O-CG2 3.28Å; H159-T190 PolarHBondContact O-OG1 2.72Å; I162-T190 HydrophobicContact CD1-CG2 3.67Å; I162-T190 HydrophobicContact CG1-CG2 3.63Å; R182-T190 PolarHBondContact NH1-O 2.91Å; R182-T190 PolarHBondContact NH2-O 2.84Å; R182-T190 VanDerWaalsContact NH2-O 3.15Å; S187-T190 PolarHBondContact O-N 3.15Å; S187-T190 VanDerWaalsContact O-N 3.13Å; T190-I192 HydrophobicContact CG2-CG1 4.23Å
191	V	93.9	Very high	84.8	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.024	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	122.4	174.6	-175.3	0	0	0	0	108.7	E160 I161 I162 I236 E240 V241	E160-V191 PolarHBondContact O-N 2.87Å; I161-V191 CarbonylContact C-O 3.48Å; I161-V191 WeakPolarHBondContact CA-O 3.32Å; I162-V191 PolarHBondContact N-O 2.87Å; V191-I236 HydrophobicContact CB-CG2 4.15Å; V191-I236 HydrophobicContact CG1-CG2 3.81Å; V191-I236 HydrophobicContact CG2-CG2 4.34Å; V191-E240 HydrophobicContact CG2-CB 3.68Å; V191-V241 HydrophobicContact CG2-CG2 3.87Å
192	I	95.8	Very high	83	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.6	180	-49.9	-179.1	0	0	0	109.4	I162 I164 I181 R182 T190 F216 S217 R218	I162-I192 HydrophobicContact CB-CG1 4.38Å; I162-I192 HydrophobicContact CB-CG2 4.37Å; I162-I192 CarbonylContact O-C 3.59Å; I162-I192 WeakPolarHBondContact O-CA 3.26Å; I164-I192 HydrophobicContact CD1-CG2 3.59Å; I164-I192 HydrophobicContact CG1-CG2 3.95Å; I181-I192 HydrophobicContact CB-CD1 4.43Å; I181-I192 HydrophobicContact CG2-CD1 4.03Å; R182-I192 HydrophobicContact CG-CD1 4.1Å; T190-I192 HydrophobicContact CG2-CG1 4.23Å; I192-F216 HydrophobicContact CB-CD1 4.2Å; I192-F216 HydrophobicContact CG2-CD1 3.54Å; I192-F216 HydrophobicContact CG2-CE1 3.61Å; I192-S217 PolarHBondContact N-OG 3.28Å; I192-S217 PolarHBondContact O-N 2.91Å; I192-R218 PolarHBondContact O-N 3.21Å
193	L	95.8	Very high	81.5	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.7	179.6	-171.6	69.9	0	0	0	110	F130 I162 V163 I164 R218 F220 E232 I236	F130-L193 HydrophobicContact CE1-CD2 4.07Å; F130-L193 HydrophobicContact CZ-CD2 3.95Å; I162-L193 PolarHBondContact O-N 3.31Å; V163-L193 HydrophobicContact CG1-CD2 4.25Å; V163-L193 HydrophobicContact CG2-CB 4.34Å; V163-L193 HydrophobicContact CG2-CD2 4.11Å; I164-L193 PolarHBondContact N-O 2.87Å; L193-R218 HydrophobicContact CD1-CB 3.66Å; L193-R218 HydrophobicContact CD1-CG 3.79Å; L193-F220 HydrophobicContact CD1-CB 3.92Å; L193-F220 HydrophobicContact CD2-CB 3.91Å; L193-F220 HydrophobicContact CD2-CG 4.41Å; L193-F220 HydrophobicContact CG-CB 3.93Å; L193-E232 HydrophobicContact CD2-CG 4.36Å; L193-I236 HydrophobicContact CD1-CD1 4.14Å; L193-I236 HydrophobicContact CD2-CD1 4.28Å
194	A	95.1	Very high	80.1	Confident	2 Å²	2	73 Å²	73	2%	0.017	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.8	171.4	0	0	0	0	0	110.4	V196 L211 F216 R218 F220	A194-V196 HydrophobicContact CB-CG1 4.48Å; A194-L211 HydrophobicContact CB-CD1 4.18Å; A194-L211 HydrophobicContact CB-CD2 4.15Å; A194-F216 HydrophobicContact CB-CD1 3.56Å; A194-F216 HydrophobicContact CB-CD2 4.27Å; A194-F216 HydrophobicContact CB-CE1 3.68Å; A194-F216 HydrophobicContact CB-CE2 4.36Å; A194-F216 HydrophobicContact CB-CG 3.87Å; A194-F216 HydrophobicContact CB-CZ 4.08Å; A194-R218 PolarHBondContact N-O 3.09Å; A194-F220 PolarHBondContact O-N 3.37Å
195	V	94.3	Very high	79.1	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	117.9	170.2	-175.3	0	0	0	0	108.9	F120 Q126 F130 V163 I164 G166 R167 F220	F120-V195 HydrophobicContact CZ-CG2 4.17Å; Q126-V195 HydrophobicContact CG-CG1 4.14Å; F130-V195 HydrophobicContact CE2-CG2 3.8Å; F130-V195 HydrophobicContact CZ-CG2 4.3Å; V163-V195 HydrophobicContact CG1-CG2 3.47Å; V163-V195 VanDerWaalsContact CG1-CG2 3.47Å; I164-V195 PolarHBondContact O-N 3.08Å; G166-V195 CarbonylContact C-O 3.54Å; G166-V195 VanDerWaalsContact C-O 3.26Å; G166-V195 WeakPolarHBondContact CA-O 3.41Å; G166-V195 PolarHBondContact N-O 3.13Å; R167-V195 HydrophobicContact CG-CG1 3.98Å; R167-V195 PolarHBondContact N-O 3.5Å; V195-F220 CarbonylContact C-O 3.59Å; V195-F220 WeakPolarHBondContact CA-O 3.43Å; V195-F220 HydrophobicContact CG1-CD1 4.35Å; V195-F220 HydrophobicContact CG2-CD1 4.47Å
196	V	91.7	Very high	78.9	Confident	27 Å²	27	72.6 Å²	72.6	16%	0.164	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	150.3	-176.8	-59.9	0	0	0	0	111	A194 L211 R219 F220 V221 E222	A194-V196 HydrophobicContact CB-CG1 4.48Å; V196-L211 HydrophobicContact CG1-CD1 4.14Å; V196-R219 HydrophobicContact CB-CG 4.45Å; V196-R219 HydrophobicContact CG1-CG 3.94Å; V196-R219 HydrophobicContact CG2-CG 3.62Å; V196-F220 PolarHBondContact N-O 3.25Å; V196-V221 HydrophobicContact CG2-CB 4.48Å; V196-V221 HydrophobicContact CG2-CG2 4.05Å; V196-E222 WeakPolarHBondContact O-CB 3.44Å; V196-E222 PolarHBondContact O-N 2.99Å
197	P	88.7	Confident	79.1	Confident	60 Å²	60	74.2 Å²	74.2	39%	0.39	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-69.8	147.6	-177	28.3	-31.6	0	0	0	111.4	R167 K199	R167-P197 HydrophobicContact CB-CB 4.44Å; R167-P197 HydrophobicContact CG-CB 4.39Å; P197-K199 PolarHBondContact O-N 3.4Å
198	Q	82.4	Confident	79.4	Confident	146 Å²	146	77.1 Å²	77.1	68%	0.682	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-73.2	117.5	174.1	-169.9	175.5	15	0	0	109.9	V221 E222	Q198-V221 HydrophobicContact CB-CG1 4.09Å; Q198-V221 HydrophobicContact CG-CG1 4.24Å; Q198-E222 HydrophobicContact CB-CB 4.44Å
199	K	74.1	Confident	79.8	Confident	103 Å²	103	74.2 Å²	74.2	45%	0.448	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-84.9	156.7	176.4	-70.7	-169.9	177.6	-171.5	0	112.1	P197 Q203	P197-K199 PolarHBondContact O-N 3.4Å; K199-Q203 HydrophobicContact CD-CB 4.45Å
200	L	64.5	Low	80.1	Confident	130 Å²	130	76.9 Å²	76.9	68%	0.681	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-65	151	173.7	-73	161.6	0	0	0	111	D202 Q203	L200-D202 PolarHBondContact O-N 3.46Å; L200-Q203 PolarHBondContact O-N 2.86Å
201	P	58.3	Low	80	Confident	127 Å²	127	77.7 Å²	77.7	83%	0.825	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-22	-172.9	-23.7	32.6	0	0	0	116
202	D	55.2	Low	79.8	Confident	162 Å²	162	81.9 Å²	81.9	87%	0.866	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	3.2	-173.3	-69.6	-24.8	0	0	0	114.6	L200	L200-D202 PolarHBondContact O-N 3.46Å
203	Q	60.8	Low	79.5	Confident	116 Å²	116	86.8 Å²	86.8	54%	0.542	47%	0.473	S	S	.	.	S	Bend	trans	-105.5	132.9	178	-67.8	-170.9	1.3	0	0	111.5	K199 L200 E205	K199-Q203 HydrophobicContact CD-CB 4.45Å; L200-Q203 PolarHBondContact O-N 2.86Å; Q203-E205 PolarHBondContact O-N 3.47Å
204	E	62.3	Low	79.2	Confident	186 Å²	186	87.1 Å²	87.1	87%	0.869	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-54	135.4	172.6	-71.8	-176	163	0	0	111.3
205	E	66.1	Low	79	Confident	144 Å²	144	88 Å²	88	67%	0.673	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-63.9	127.9	176.9	-82.1	-139.7	170.9	0	0	110.5	Q203 R219	Q203-E205 PolarHBondContact O-N 3.47Å; E205-R219 IonicContact OE1-NH2 2.66Å; E205-R219 IonicContact OE2-CZ 3.76Å; E205-R219 IonicContact OE2-NH1 3.27Å; E205-R219 PolarHBondContact OE2-NH1 2.99Å; E205-R219 IonicContact OE2-NH2 2.92Å; E205-R219 PolarHBondContact OE2-NH2 3.12Å
206	P	70.7	Confident	79	Confident	68 Å²	68	88.3 Å²	88.3	44%	0.442	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-67.6	139.8	177.5	28.2	-32.4	0	0	0	110.4
207	S	81.1	Confident	79.1	Confident	82 Å²	82	89.4 Å²	89.4	57%	0.573	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-53.1	140.4	174.1	179.4	0	0	0	0	111.3	L209 P210	S207-L209 PolarHBondContact O-N 3.02Å; S207-L209 WeakPolarHBondContact OG-CB 3.37Å; S207-L209 PolarHBondContact OG-N 3.49Å; S207-P210 VanDerWaalsContact O-CD 3.23Å; S207-P210 WeakPolarHBondContact O-CD 3.48Å
208	V	86.8	Confident	79.2	Confident	64 Å²	64	89.8 Å²	89.8	39%	0.388	49%	0.489	S	S	.	.	S	Bend	trans	-75.9	-13.4	173.3	-63.1	0	0	0	0	112.7	P210 L211 L212	V208-P210 VanDerWaalsContact C-CD 3.47Å; V208-L211 WeakPolarHBondContact O-CB 3.33Å; V208-L211 PolarHBondContact O-N 2.98Å; V208-L212 HydrophobicContact CG2-CD1 4.08Å; V208-L212 PolarHBondContact O-N 3Å; V208-L212 VanDerWaalsContact O-N 3.08Å
209	L	86.1	Confident	79.7	Confident	106 Å²	106	86.1 Å²	86.1	56%	0.555	47%	0.469	S	S	*	.	H	α-helix	trans	-55	-42	-174.5	-172.8	64.9	0	0	0	113.8	S207 L211 L212 C213	S207-L209 PolarHBondContact O-N 3.02Å; S207-L209 WeakPolarHBondContact OG-CB 3.37Å; S207-L209 PolarHBondContact OG-N 3.49Å; L209-L211 VanDerWaalsContact C-N 3.32Å; L209-L211 PolarHBondContact O-N 2.65Å; L209-L212 PolarHBondContact O-N 3.49Å; L209-C213 WeakPolarHBondContact O-CB 3.49Å; L209-C213 PolarHBondContact O-N 2.88Å; L209-C213 PolarHBondContact O-SG 2.89Å
210	P	86.8	Confident	80.6	Confident	81 Å²	81	82 Å²	82	53%	0.526	45%	0.451	S	S	.	.	H	α-helix	trans	-61.5	-37.7	176.5	-23.4	36	0	0	0	113.5	S207 V208 C213 A214	S207-P210 VanDerWaalsContact O-CD 3.23Å; S207-P210 WeakPolarHBondContact O-CD 3.48Å; V208-P210 VanDerWaalsContact C-CD 3.47Å; P210-C213 PolarHBondContact O-N 3.21Å; P210-A214 WeakPolarHBondContact O-CB 3.11Å; P210-A214 PolarHBondContact O-N 2.98Å
211	L	89	Confident	81.9	Confident	24 Å²	24	78.4 Å²	78.4	13%	0.126	43%	0.434	C	S	.	.	H	α-helix	trans	-67.2	-43.3	176.7	-64.3	174.6	0	0	0	110.6	A194 V196 V208 L209 A214 G215 F216 R219	A194-L211 HydrophobicContact CB-CD1 4.18Å; A194-L211 HydrophobicContact CB-CD2 4.15Å; V196-L211 HydrophobicContact CG1-CD1 4.14Å; V208-L211 WeakPolarHBondContact O-CB 3.33Å; V208-L211 PolarHBondContact O-N 2.98Å; L209-L211 VanDerWaalsContact C-N 3.32Å; L209-L211 PolarHBondContact O-N 2.65Å; L211-A214 PolarHBondContact O-N 3.45Å; L211-G215 PolarHBondContact O-N 3.32Å; L211-F216 HydrophobicContact CB-CB 4.16Å; L211-F216 HydrophobicContact CB-CD2 4.07Å; L211-F216 HydrophobicContact CB-CG 4.44Å; L211-F216 HydrophobicContact CD2-CD2 3.86Å; L211-F216 HydrophobicContact CD2-CE2 4.06Å; L211-F216 WeakPolarHBondContact O-CB 3.26Å; L211-F216 WeakPolarHBondContact O-CD2 3.34Å; L211-F216 PolarHBondContact O-N 3.49Å; L211-R219 HydrophobicContact CD1-CB 4.22Å; L211-R219 HydrophobicContact CD1-CG 4.04Å
212	L	90.5	Very high	83.5	Confident	92 Å²	92	75 Å²	75	48%	0.482	41%	0.407	S	S	.	.	H	α-helix	trans	-62.7	-44.4	176.1	-63.5	177	0	0	0	111.5	V208 L209 A214 G215 F216	V208-L212 HydrophobicContact CG2-CD1 4.08Å; V208-L212 PolarHBondContact O-N 3Å; V208-L212 VanDerWaalsContact O-N 3.08Å; L209-L212 PolarHBondContact O-N 3.49Å; L212-A214 PolarHBondContact O-N 3.02Å; L212-G215 WeakPolarHBondContact O-CA 3.36Å; L212-G215 PolarHBondContact O-N 3.39Å; L212-F216 WeakPolarHBondContact CD2-O 3.5Å
213	C	89.6	Confident	85.2	Confident	102 Å²	102	70.8 Å²	70.8	69%	0.689	39%	0.385	S	S	*	.	H	α-helix	trans	-62.5	-30.2	175.4	-71	0	0	0	0	112.9	L209 P210 G215	L209-C213 WeakPolarHBondContact O-CB 3.49Å; L209-C213 PolarHBondContact O-N 2.88Å; L209-C213 PolarHBondContact O-SG 2.89Å; P210-C213 PolarHBondContact O-N 3.21Å; C213-G215 VanDerWaalsContact C-N 3.27Å
214	A	89.3	Confident	86.6	Confident	7 Å²	7	67.9 Å²	67.9	6%	0.058	38%	0.377	C	S	.	.	H	α-helix	trans	-75.6	-15	173.5	0	0	0	0	0	113.4	E175 C178 P210 L211 L212 F216	E175-A214 HydrophobicContact CB-CB 3.66Å; E175-A214 HydrophobicContact CG-CB 3.66Å; C178-A214 PolarHBondContact SG-O 3.21Å; P210-A214 WeakPolarHBondContact O-CB 3.11Å; P210-A214 PolarHBondContact O-N 2.98Å; L211-A214 PolarHBondContact O-N 3.45Å; L212-A214 PolarHBondContact O-N 3.02Å; A214-F216 HydrophobicContact CB-CD2 4.16Å; A214-F216 HydrophobicContact CB-CE2 4.4Å
215	G	90.8	Very high	88.1	Confident	20 Å²	20	61.6 Å²	61.6	21%	0.206	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.6	10.6	178.3	0	0	0	0	0	115	R182 L211 L212 C213	R182-G215 VanDerWaalsContact CZ-O 3.31Å; R182-G215 PolarHBondContact NE-O 2.79Å; R182-G215 PolarHBondContact NH2-O 3.05Å; L211-G215 PolarHBondContact O-N 3.32Å; L212-G215 WeakPolarHBondContact O-CA 3.36Å; L212-G215 PolarHBondContact O-N 3.39Å; C213-G215 VanDerWaalsContact C-N 3.27Å
216	F	94.1	Very high	89.5	Confident	7 Å²	7	57.1 Å²	57.1	3%	0.031	34%	0.337	C	S	.	.			trans	-68.9	144.4	171.2	-72.7	-78.2	0	0	0	110.9	I164 P174 E175 C178 I192 A194 L211 L212 A214	I164-F216 HydrophobicContact CB-CE1 3.99Å; I164-F216 HydrophobicContact CB-CZ 4.33Å; I164-F216 HydrophobicContact CD1-CE1 3.89Å; I164-F216 HydrophobicContact CD1-CZ 4.19Å; I164-F216 HydrophobicContact CG1-CE1 4.21Å; P174-F216 HydrophobicContact CB-CZ 4.13Å; P174-F216 WeakPolarHBondContact O-CZ 3.21Å; E175-F216 HydrophobicContact CG-CE2 4.28Å; C178-F216 HydrophobicContact CB-CD1 4.49Å; C178-F216 HydrophobicContact CB-CD2 4.15Å; C178-F216 HydrophobicContact CB-CE1 4.02Å; C178-F216 HydrophobicContact CB-CE2 3.64Å; C178-F216 HydrophobicContact CB-CZ 3.56Å; I192-F216 HydrophobicContact CB-CD1 4.2Å; I192-F216 HydrophobicContact CG2-CD1 3.54Å; I192-F216 HydrophobicContact CG2-CE1 3.61Å; A194-F216 HydrophobicContact CB-CD1 3.56Å; A194-F216 HydrophobicContact CB-CD2 4.27Å; A194-F216 HydrophobicContact CB-CE1 3.68Å; A194-F216 HydrophobicContact CB-CE2 4.36Å; A194-F216 HydrophobicContact CB-CG 3.87Å; A194-F216 HydrophobicContact CB-CZ 4.08Å; L211-F216 HydrophobicContact CB-CB 4.16Å; L211-F216 HydrophobicContact CB-CD2 4.07Å; L211-F216 HydrophobicContact CB-CG 4.44Å; L211-F216 HydrophobicContact CD2-CD2 3.86Å; L211-F216 HydrophobicContact CD2-CE2 4.06Å; L211-F216 WeakPolarHBondContact O-CB 3.26Å; L211-F216 WeakPolarHBondContact O-CD2 3.34Å; L211-F216 PolarHBondContact O-N 3.49Å; L212-F216 WeakPolarHBondContact CD2-O 3.5Å; A214-F216 HydrophobicContact CB-CD2 4.16Å; A214-F216 HydrophobicContact CB-CE2 4.4Å
217	S	93.1	Very high	90.5	Very high	50 Å²	50	56.7 Å²	56.7	35%	0.35	34%	0.335	S	S	.	.	S	Bend	trans	-89.1	-32.5	176.5	-56.4	0	0	0	0	111.8	R182 I192	R182-S217 PolarHBondContact NH2-OG 2.96Å; R182-S217 VanDerWaalsContact NH2-OG 3.09Å; I192-S217 PolarHBondContact N-OG 3.28Å; I192-S217 PolarHBondContact O-N 2.91Å
218	R	92.2	Very high	91	Very high	69 Å²	69	54 Å²	54	26%	0.26	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	152.3	-170.8	-167.6	159.3	172.9	160	-10.2	112.1	I192 L193 A194 E232 E240	I192-R218 PolarHBondContact O-N 3.21Å; L193-R218 HydrophobicContact CD1-CB 3.66Å; L193-R218 HydrophobicContact CD1-CG 3.79Å; A194-R218 PolarHBondContact N-O 3.09Å; R218-E232 WeakPolarHBondContact CD-OE1 3.44Å; R218-E232 IonicContact CZ-OE1 2.64Å; R218-E232 VanDerWaalsContact CZ-OE1 3.27Å; R218-E232 IonicContact CZ-OE2 3.23Å; R218-E232 IonicContact NE-OE1 3.57Å; R218-E232 PolarHBondContact NE-OE1 3.05Å; R218-E232 IonicContact NE-OE2 2.92Å; R218-E232 IonicContact NH2-OE1 3.89Å; R218-E232 PolarHBondContact NH2-OE1 3.26Å; R218-E232 IonicContact NH2-OE2 3.99Å; R218-E232 PolarHBondContact NH2-OE2 3.06Å; R218-E240 IonicContact NH1-OE1 3.09Å; R218-E240 PolarHBondContact NH1-OE1 3.48Å
219	R	92.4	Very high	91.3	Very high	68 Å²	68	50.9 Å²	50.9	26%	0.257	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.2	176.8	-177.4	-173.3	75.7	164.9	7.7	109.6	V196 E205 L211	V196-R219 HydrophobicContact CB-CG 4.45Å; V196-R219 HydrophobicContact CG1-CG 3.94Å; V196-R219 HydrophobicContact CG2-CG 3.62Å; E205-R219 IonicContact OE1-NH2 2.66Å; E205-R219 IonicContact OE2-CZ 3.76Å; E205-R219 IonicContact OE2-NH1 3.27Å; E205-R219 PolarHBondContact OE2-NH1 2.99Å; E205-R219 IonicContact OE2-NH2 2.92Å; E205-R219 PolarHBondContact OE2-NH2 3.12Å; L211-R219 HydrophobicContact CD1-CB 4.22Å; L211-R219 HydrophobicContact CD1-CG 4.04Å
220	F	93.8	Very high	91.8	Very high	17 Å²	17	48.6 Å²	48.6	8%	0.075	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.1	172.1	-175.7	-97.6	0	0	0	109.9	F130 L193 A194 V195 V196 N223 E232	F130-F220 HydrophobicContact CE2-CD1 4.01Å; F130-F220 AromaticContact CE2-CE1 3.96Å; F130-F220 HydrophobicContact CE2-CE1 3.96Å; F130-F220 AromaticContact CZ-CD1 3.69Å; F130-F220 HydrophobicContact CZ-CD1 3.69Å; F130-F220 AromaticContact CZ-CE1 3.72Å; F130-F220 HydrophobicContact CZ-CE1 3.72Å; F130-F220 HydrophobicContact CZ-CG 4.09Å; F130-F220 HydrophobicContact CZ-CZ 4.15Å; L193-F220 HydrophobicContact CD1-CB 3.92Å; L193-F220 HydrophobicContact CD2-CB 3.91Å; L193-F220 HydrophobicContact CD2-CG 4.41Å; L193-F220 HydrophobicContact CG-CB 3.93Å; A194-F220 PolarHBondContact O-N 3.37Å; V195-F220 CarbonylContact C-O 3.59Å; V195-F220 WeakPolarHBondContact CA-O 3.43Å; V195-F220 HydrophobicContact CG1-CD1 4.35Å; V195-F220 HydrophobicContact CG2-CD1 4.47Å; V196-F220 PolarHBondContact N-O 3.25Å; F220-N223 HydrophobicContact CE1-CB 4.2Å; F220-N223 HydrophobicContact CZ-CB 4.05Å; F220-E232 HydrophobicContact CD2-CB 4.09Å; F220-E232 HydrophobicContact CD2-CG 3.68Å; F220-E232 HydrophobicContact CE2-CB 3.91Å; F220-E232 HydrophobicContact CE2-CG 4.04Å
221	V	92.1	Very high	92.1	Very high	54 Å²	54	49 Å²	49	33%	0.327	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	135.5	175.5	-177.5	0	0	0	0	108.9	V196 Q198 N223	V196-V221 HydrophobicContact CG2-CB 4.48Å; V196-V221 HydrophobicContact CG2-CG2 4.05Å; Q198-V221 HydrophobicContact CB-CG1 4.09Å; Q198-V221 HydrophobicContact CG-CG1 4.24Å; V221-N223 PolarHBondContact O-N 3.09Å
222	E	90.4	Very high	92.4	Very high	56 Å²	56	49 Å²	49	26%	0.262	28%	0.28	S	S	.	.			trans	-43	123.3	179.7	-179.4	169.5	-149.1	0	0	112.4	R167 V196 Q198	R167-E222 VanDerWaalsContact CD-OE1 3.26Å; R167-E222 WeakPolarHBondContact CD-OE1 3.38Å; R167-E222 IonicContact CZ-OE1 3.53Å; R167-E222 IonicContact NE-OE1 2.72Å; R167-E222 IonicContact NH1-OE1 3.24Å; R167-E222 PolarHBondContact NH1-OE1 3.4Å; V196-E222 WeakPolarHBondContact O-CB 3.44Å; V196-E222 PolarHBondContact O-N 2.99Å; Q198-E222 HydrophobicContact CB-CB 4.44Å
223	N	91	Very high	92.6	Very high	73 Å²	73	44.6 Å²	44.6	39%	0.39	26%	0.257	S	S	.	.			trans	-158.3	107	179.1	-170.5	-31.7	0	0	0	109.3	Q126 F220 V221 S225 A228 C229	Q126-N223 PolarHBondContact NE2-O 2.97Å; Q126-N223 VanDerWaalsContact NE2-O 3.09Å; Q126-N223 PolarHBondContact OE1-O 3.36Å; Q126-N223 VanDerWaalsContact OE1-O 3.08Å; F220-N223 HydrophobicContact CE1-CB 4.2Å; F220-N223 HydrophobicContact CZ-CB 4.05Å; V221-N223 PolarHBondContact O-N 3.09Å; N223-S225 PolarHBondContact O-N 2.81Å; N223-S225 VanDerWaalsContact O-N 3.13Å; N223-S225 WeakPolarHBondContact OD1-CB 3.48Å; N223-S225 PolarHBondContact OD1-N 3.17Å; N223-A228 HydrophobicContact CB-CB 4.35Å; N223-C229 PolarHBondContact O-SG 2.8Å
224	S	90.4	Very high	92.8	Very high	55 Å²	55	41.7 Å²	41.7	39%	0.385	23%	0.234	S	C	.	.			trans	-75.4	7.3	-179	-51.3	0	0	0	0	114.3	S125 A129 V226	S125-S224 PolarHBondContact OG-OG 3.49Å; A129-S224 WeakPolarHBondContact CB-O 3.47Å; S224-V226 PolarHBondContact O-N 2.82Å
225	S	94.4	Very high	92.9	Very high	54 Å²	54	46.4 Å²	46.4	38%	0.378	26%	0.255	S	S	.	.			trans	-74.9	120.3	173.4	-179	0	0	0	0	110.9	N223 S227 A228 C229	N223-S225 PolarHBondContact O-N 2.81Å; N223-S225 VanDerWaalsContact O-N 3.13Å; N223-S225 WeakPolarHBondContact OD1-CB 3.48Å; N223-S225 PolarHBondContact OD1-N 3.17Å; S225-S227 PolarHBondContact O-N 2.79Å; S225-S227 PolarHBondContact OG-N 2.66Å; S225-A228 WeakPolarHBondContact O-CB 3.44Å; S225-A228 PolarHBondContact O-N 3.23Å; S225-C229 PolarHBondContact O-N 3.15Å; S225-C229 VanDerWaalsContact O-N 3.12Å
226	V	94.4	Very high	93	Very high	51 Å²	51	45.4 Å²	45.4	31%	0.309	25%	0.245	S	C	.	.	H	α-helix	trans	-54	-38.6	173.4	-178.2	0	0	0	0	111	A129 W132 A133 S224 A228 C229 Y230	A129-V226 HydrophobicContact CB-CG2 4.42Å; W132-V226 HydrophobicContact CB-CG1 3.89Å; W132-V226 HydrophobicContact CB-CG2 4.2Å; A133-V226 HydrophobicContact CB-CG1 4.45Å; S224-V226 PolarHBondContact O-N 2.82Å; V226-A228 PolarHBondContact O-N 3.09Å; V226-C229 PolarHBondContact O-N 3.03Å; V226-Y230 WeakPolarHBondContact O-CB 3.47Å; V226-Y230 PolarHBondContact O-N 2.9Å
227	S	92.2	Very high	92.9	Very high	58 Å²	58	46.3 Å²	46.3	41%	0.406	25%	0.249	S	C	.	.	H	α-helix	trans	-67.3	-34.9	179.1	-64.2	0	0	0	0	112.7	S225 N231	S225-S227 PolarHBondContact O-N 2.79Å; S225-S227 PolarHBondContact OG-N 2.66Å; S227-N231 WeakPolarHBondContact O-CB 3.38Å; S227-N231 PolarHBondContact O-N 2.92Å; S227-N231 PolarHBondContact O-ND2 3.42Å
228	A	91.5	Very high	92.6	Very high	25 Å²	25	49.5 Å²	49.5	21%	0.207	26%	0.259	C	S	.	.	H	α-helix	trans	-69.1	-46.7	176.6	0	0	0	0	0	110.9	N223 S225 V226 Y230 N231 E232	N223-A228 HydrophobicContact CB-CB 4.35Å; S225-A228 WeakPolarHBondContact O-CB 3.44Å; S225-A228 PolarHBondContact O-N 3.23Å; V226-A228 PolarHBondContact O-N 3.09Å; A228-Y230 VanDerWaalsContact C-N 3.33Å; A228-Y230 PolarHBondContact O-N 3.28Å; A228-N231 PolarHBondContact O-N 3.49Å; A228-E232 PolarHBondContact O-N 3.48Å; A228-E232 VanDerWaalsContact O-N 3.1Å
229	C	94.4	Very high	92.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-41.7	175.6	-61.3	0	0	0	0	111.7	Q126 F130 A133 N223 S225 V226 E232 L233	Q126-C229 PolarHBondContact NE2-SG 2.86Å; F130-C229 HydrophobicContact CD1-CB 3.8Å; F130-C229 HydrophobicContact CE1-CB 3.89Å; F130-C229 HydrophobicContact CG-CB 4.21Å; F130-C229 HydrophobicContact CZ-CB 4.39Å; A133-C229 HydrophobicContact CB-CB 3.78Å; N223-C229 PolarHBondContact O-SG 2.8Å; S225-C229 PolarHBondContact O-N 3.15Å; S225-C229 VanDerWaalsContact O-N 3.12Å; V226-C229 PolarHBondContact O-N 3.03Å; C229-E232 PolarHBondContact O-N 3.41Å; C229-L233 WeakPolarHBondContact O-CG 3.31Å; C229-L233 PolarHBondContact O-N 3.45Å
230	Y	95.4	Very high	92.2	Very high	58 Å²	58	47.5 Å²	47.5	23%	0.227	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-48.9	176.7	175.6	-93.8	0	0	0	112.3	R136 A137 V226 A228 E232 L233 I234	R136-Y230 HydrophobicContact CB-CD2 4.03Å; R136-Y230 HydrophobicContact CB-CE2 4.22Å; R136-Y230 HydrophobicContact CG-CD2 3.85Å; R136-Y230 HydrophobicContact CG-CE2 3.76Å; A137-Y230 HydrophobicContact CB-CD2 4.2Å; A137-Y230 HydrophobicContact CB-CE2 3.88Å; V226-Y230 WeakPolarHBondContact O-CB 3.47Å; V226-Y230 PolarHBondContact O-N 2.9Å; A228-Y230 VanDerWaalsContact C-N 3.33Å; A228-Y230 PolarHBondContact O-N 3.28Å; Y230-E232 VanDerWaalsContact C-N 3.27Å; Y230-E232 PolarHBondContact O-N 2.93Å; Y230-L233 PolarHBondContact O-N 3.26Å; Y230-I234 HydrophobicContact CD1-CG1 4.27Å; Y230-I234 HydrophobicContact CD2-CG1 4.36Å; Y230-I234 HydrophobicContact CE1-CG1 3.84Å; Y230-I234 HydrophobicContact CE2-CD1 4.15Å; Y230-I234 HydrophobicContact CE2-CG1 3.96Å; Y230-I234 WeakPolarHBondContact O-CG1 3.27Å; Y230-I234 PolarHBondContact O-N 3.47Å
231	N	93.6	Very high	92	Very high	90 Å²	90	47.2 Å²	47.2	48%	0.481	26%	0.263	S	S	.	.	H	α-helix	trans	-61.1	-39.5	179.2	-72.5	-20.8	0	0	0	111.6	S227 A228 Q235	S227-N231 WeakPolarHBondContact O-CB 3.38Å; S227-N231 PolarHBondContact O-N 2.92Å; S227-N231 PolarHBondContact O-ND2 3.42Å; A228-N231 PolarHBondContact O-N 3.49Å; N231-Q235 VanDerWaalsContact O-CG 3.29Å; N231-Q235 WeakPolarHBondContact O-CG 3.38Å; N231-Q235 PolarHBondContact O-N 3.22Å
232	E	94.7	Very high	91.7	Very high	23 Å²	23	48.6 Å²	48.6	11%	0.107	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-47.2	176.9	-174.7	69.1	177.6	0	0	111.7	L193 R218 F220 A228 C229 Y230 I234 Q235 I236	L193-E232 HydrophobicContact CD2-CG 4.36Å; R218-E232 WeakPolarHBondContact CD-OE1 3.44Å; R218-E232 IonicContact CZ-OE1 2.64Å; R218-E232 VanDerWaalsContact CZ-OE1 3.27Å; R218-E232 IonicContact CZ-OE2 3.23Å; R218-E232 IonicContact NE-OE1 3.57Å; R218-E232 PolarHBondContact NE-OE1 3.05Å; R218-E232 IonicContact NE-OE2 2.92Å; R218-E232 IonicContact NH2-OE1 3.89Å; R218-E232 PolarHBondContact NH2-OE1 3.26Å; R218-E232 IonicContact NH2-OE2 3.99Å; R218-E232 PolarHBondContact NH2-OE2 3.06Å; F220-E232 HydrophobicContact CD2-CB 4.09Å; F220-E232 HydrophobicContact CD2-CG 3.68Å; F220-E232 HydrophobicContact CE2-CB 3.91Å; F220-E232 HydrophobicContact CE2-CG 4.04Å; A228-E232 PolarHBondContact O-N 3.48Å; A228-E232 VanDerWaalsContact O-N 3.1Å; C229-E232 PolarHBondContact O-N 3.41Å; Y230-E232 VanDerWaalsContact C-N 3.27Å; Y230-E232 PolarHBondContact O-N 2.93Å; E232-I234 VanDerWaalsContact C-N 3.34Å; E232-I234 PolarHBondContact O-N 2.98Å; E232-Q235 PolarHBondContact O-N 3.21Å; E232-I236 HydrophobicContact CG-CD1 4.03Å; E232-I236 WeakPolarHBondContact O-CG1 3.39Å; E232-I236 PolarHBondContact O-N 3.3Å
233	L	94.6	Very high	91.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-40.1	178.4	-73.7	177.7	0	0	0	112.6	F130 A133 F139 I161 C229 Y230 I236 E237	F130-L233 HydrophobicContact CD1-CD1 4.23Å; F130-L233 HydrophobicContact CD1-CD2 4.49Å; F130-L233 HydrophobicContact CD1-CG 4.34Å; F130-L233 HydrophobicContact CE1-CG 4.45Å; A133-L233 HydrophobicContact CB-CD1 3.85Å; F139-L233 HydrophobicContact CE2-CB 4.1Å; I161-L233 HydrophobicContact CD1-CD2 4.46Å; I161-L233 HydrophobicContact CG2-CD2 4.28Å; C229-L233 WeakPolarHBondContact O-CG 3.31Å; C229-L233 PolarHBondContact O-N 3.45Å; Y230-L233 PolarHBondContact O-N 3.26Å; L233-I236 PolarHBondContact O-N 3.02Å; L233-E237 PolarHBondContact O-N 2.91Å
234	I	93.3	Very high	91.2	Very high	40 Å²	40	49.1 Å²	49.1	21%	0.205	27%	0.27	C	S	.	.	H	α-helix	trans	-69.1	-36.8	177.1	-65.5	-60.6	0	0	0	111.8	A137 F139 Y230 E232 E237 H238	A137-I234 HydrophobicContact CB-CD1 4.02Å; F139-I234 HydrophobicContact CZ-CD1 4.16Å; Y230-I234 HydrophobicContact CD1-CG1 4.27Å; Y230-I234 HydrophobicContact CD2-CG1 4.36Å; Y230-I234 HydrophobicContact CE1-CG1 3.84Å; Y230-I234 HydrophobicContact CE2-CD1 4.15Å; Y230-I234 HydrophobicContact CE2-CG1 3.96Å; Y230-I234 WeakPolarHBondContact O-CG1 3.27Å; Y230-I234 PolarHBondContact O-N 3.47Å; E232-I234 VanDerWaalsContact C-N 3.34Å; E232-I234 PolarHBondContact O-N 2.98Å; I234-E237 PolarHBondContact O-N 3.45Å; I234-H238 PolarHBondContact O-CD2 2.89Å; I234-H238 PolarHBondContact O-N 3.31Å
235	Q	92.3	Very high	90.9	Very high	106 Å²	106	48.5 Å²	48.5	50%	0.495	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-43.9	173.5	-75.5	178.8	11.6	0	0	111.4	N231 E232 E237 H238 G239	N231-Q235 VanDerWaalsContact O-CG 3.29Å; N231-Q235 WeakPolarHBondContact O-CG 3.38Å; N231-Q235 PolarHBondContact O-N 3.22Å; E232-Q235 PolarHBondContact O-N 3.21Å; Q235-E237 VanDerWaalsContact C-N 3.34Å; Q235-E237 PolarHBondContact O-N 3.3Å; Q235-H238 PolarHBondContact O-N 2.96Å; Q235-G239 PolarHBondContact O-N 3.45Å
236	I	93.3	Very high	90.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-40.6	176.7	-68.7	166.9	0	0	0	111.2	I161 V191 L193 E232 L233 E240 V241	I161-I236 HydrophobicContact CD1-CB 4.47Å; I161-I236 HydrophobicContact CD1-CG2 3.76Å; I161-I236 HydrophobicContact CG1-CG2 3.98Å; V191-I236 HydrophobicContact CB-CG2 4.15Å; V191-I236 HydrophobicContact CG1-CG2 3.81Å; V191-I236 HydrophobicContact CG2-CG2 4.34Å; L193-I236 HydrophobicContact CD1-CD1 4.14Å; L193-I236 HydrophobicContact CD2-CD1 4.28Å; E232-I236 HydrophobicContact CG-CD1 4.03Å; E232-I236 WeakPolarHBondContact O-CG1 3.39Å; E232-I236 PolarHBondContact O-N 3.3Å; L233-I236 PolarHBondContact O-N 3.02Å; I236-E240 WeakPolarHBondContact CA-OE2 3.33Å; I236-E240 PolarHBondContact O-N 3.34Å; I236-V241 HydrophobicContact CG2-CG2 3.82Å; I236-V241 WeakPolarHBondContact O-CG2 3.31Å; I236-V241 PolarHBondContact O-N 3.4Å
237	E	90.9	Very high	89.9	Confident	25 Å²	25	52.4 Å²	52.4	12%	0.117	27%	0.271	C	S	.	.	I	π-helix	trans	-58.1	-53.5	174	167.5	176.2	-154.4	0	0	111.4	K111 I114 F139 L233 I234 Q235 R242	K111-E237 IonicContact NZ-OE1 3.62Å; K111-E237 PolarHBondContact NZ-OE1 2.91Å; I114-E237 HydrophobicContact CD1-CB 3.92Å; I114-E237 VanDerWaalsContact CD1-CD 3.49Å; I114-E237 HydrophobicContact CD1-CG 3.46Å; I114-E237 VanDerWaalsContact CD1-CG 3.46Å; I114-E237 WeakPolarHBondContact CD1-OE1 3.35Å; F139-E237 WeakPolarHBondContact CE1-OE2 3.48Å; F139-E237 HydrophobicContact CZ-CB 3.99Å; F139-E237 HydrophobicContact CZ-CG 4.37Å; F139-E237 VanDerWaalsContact CZ-OE2 3.26Å; F139-E237 WeakPolarHBondContact CZ-OE2 3.42Å; L233-E237 PolarHBondContact O-N 2.91Å; I234-E237 PolarHBondContact O-N 3.45Å; Q235-E237 VanDerWaalsContact C-N 3.34Å; Q235-E237 PolarHBondContact O-N 3.3Å; E237-R242 WeakPolarHBondContact O-CB 3.33Å; E237-R242 PolarHBondContact O-N 3.29Å; E237-R242 VanDerWaalsContact O-N 3.12Å
238	H	87.2	Confident	89.4	Confident	118 Å²	118	54.8 Å²	54.8	55%	0.546	27%	0.271	S	S	.	.	I	π-helix	trans	-76.2	-25.5	-172.6	-86.4	-92.9	0	0	0	113.7	I234 Q235	I234-H238 PolarHBondContact O-CD2 2.89Å; I234-H238 PolarHBondContact O-N 3.31Å; Q235-H238 PolarHBondContact O-N 2.96Å
239	G	87.6	Confident	89.1	Confident	30 Å²	30	54 Å²	54	31%	0.309	27%	0.265	S	S	.	.	I	π-helix	trans	-89.1	-94.5	175.3	0	0	0	0	0	111.8	Q235 C243	Q235-G239 PolarHBondContact O-N 3.45Å; G239-C243 WeakPolarHBondContact O-CB 3.42Å; G239-C243 PolarHBondContact O-N 3.12Å; G239-C243 VanDerWaalsContact O-N 3.16Å; G239-C243 PolarHBondContact O-SG 2.92Å
240	E	88.9	Confident	88.6	Confident	65 Å²	65	56.2 Å²	56.2	30%	0.304	28%	0.28	S	S	.	.	I	π-helix	trans	-68.3	-45.9	-165	-63.4	87.7	158.8	0	0	112.7	V191 R218 I236 R242 C243 Q244	V191-E240 HydrophobicContact CG2-CB 3.68Å; R218-E240 IonicContact NH1-OE1 3.09Å; R218-E240 PolarHBondContact NH1-OE1 3.48Å; I236-E240 WeakPolarHBondContact CA-OE2 3.33Å; I236-E240 PolarHBondContact O-N 3.34Å; E240-R242 PolarHBondContact O-N 2.96Å; E240-C243 PolarHBondContact O-N 3.02Å; E240-Q244 WeakPolarHBondContact O-CG 3.49Å; E240-Q244 PolarHBondContact O-N 3.4Å
241	V	88.9	Confident	88.1	Confident	10 Å²	10	58.2 Å²	58.2	6%	0.061	30%	0.295	C	S	.	.	I	π-helix	trans	-64.8	-43.3	-177.1	175	0	0	0	0	111	I114 E160 I161 V191 I236 C243 Q244 F245	I114-V241 HydrophobicContact CD1-CG1 4.34Å; E160-V241 HydrophobicContact CB-CG1 4.07Å; E160-V241 HydrophobicContact CG-CG1 4.36Å; I161-V241 HydrophobicContact CD1-CG2 4.02Å; I161-V241 HydrophobicContact CG1-CG2 3.68Å; V191-V241 HydrophobicContact CG2-CG2 3.87Å; I236-V241 HydrophobicContact CG2-CG2 3.82Å; I236-V241 WeakPolarHBondContact O-CG2 3.31Å; I236-V241 PolarHBondContact O-N 3.4Å; V241-C243 PolarHBondContact O-N 3.25Å; V241-Q244 PolarHBondContact O-N 3.4Å; V241-F245 WeakPolarHBondContact O-CB 3.47Å; V241-F245 PolarHBondContact O-N 2.98Å
242	R	86.1	Confident	87.7	Confident	83 Å²	83	57.4 Å²	57.4	31%	0.313	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-39.2	177.5	-169.9	173.5	-169	178.1	2.3	112.3	E102 E237 E240 F245 K246	E102-R242 IonicContact OE1-CZ 3.83Å; E102-R242 IonicContact OE1-NE 2.84Å; E102-R242 PolarHBondContact OE1-NE 3.49Å; E102-R242 IonicContact OE1-NH2 2.92Å; E102-R242 PolarHBondContact OE1-NH2 3.3Å; E102-R242 IonicContact OE2-CZ 3.33Å; E102-R242 VanDerWaalsContact OE2-CZ 3.26Å; E102-R242 IonicContact OE2-NE 3.82Å; E102-R242 PolarHBondContact OE2-NE 3.16Å; E102-R242 IonicContact OE2-NH2 3.77Å; E102-R242 PolarHBondContact OE2-NH2 3.47Å; E237-R242 WeakPolarHBondContact O-CB 3.33Å; E237-R242 PolarHBondContact O-N 3.29Å; E237-R242 VanDerWaalsContact O-N 3.12Å; E240-R242 PolarHBondContact O-N 2.96Å; R242-F245 PolarHBondContact O-N 3.34Å; R242-K246 WeakPolarHBondContact O-CG 3.28Å; R242-K246 PolarHBondContact O-N 3.28Å
243	C	85.4	Confident	87.4	Confident	82 Å²	82	60.1 Å²	60.1	55%	0.554	31%	0.314	S	S	*	.	H	α-helix	trans	-61.9	-45	174	-73.7	0	0	0	0	111.5	G239 E240 V241 F245 K246 L247	G239-C243 WeakPolarHBondContact O-CB 3.42Å; G239-C243 PolarHBondContact O-N 3.12Å; G239-C243 VanDerWaalsContact O-N 3.16Å; G239-C243 PolarHBondContact O-SG 2.92Å; E240-C243 PolarHBondContact O-N 3.02Å; V241-C243 PolarHBondContact O-N 3.25Å; C243-F245 PolarHBondContact O-N 2.87Å; C243-K246 PolarHBondContact O-N 3.5Å; C243-L247 WeakPolarHBondContact O-CB 3.49Å; C243-L247 PolarHBondContact O-N 3.24Å
244	Q	85.6	Confident	87	Confident	59 Å²	59	66 Å²	66	28%	0.276	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-38.9	176.8	-69.6	-62	-16	0	0	112.6	E240 V241 L247 R248	E240-Q244 WeakPolarHBondContact O-CG 3.49Å; E240-Q244 PolarHBondContact O-N 3.4Å; V241-Q244 PolarHBondContact O-N 3.4Å; Q244-L247 PolarHBondContact O-N 3.41Å; Q244-R248 WeakPolarHBondContact O-CG 3.5Å; Q244-R248 PolarHBondContact O-N 3.39Å
245	F	84.3	Confident	86.8	Confident	42 Å²	42	67.3 Å²	67.3	18%	0.184	35%	0.35	C	S	.	.	H	α-helix	trans	-58.8	-48.1	172.8	176.3	-100.7	0	0	0	112	E102 L109 V241 R242 C243 L247 R248 A249	E102-F245 HydrophobicContact CB-CE1 4.46Å; L109-F245 HydrophobicContact CB-CE1 4.1Å; L109-F245 HydrophobicContact CB-CZ 3.65Å; L109-F245 HydrophobicContact CD1-CE1 3.8Å; L109-F245 HydrophobicContact CD1-CZ 3.85Å; L109-F245 HydrophobicContact CG-CZ 4.38Å; V241-F245 WeakPolarHBondContact O-CB 3.47Å; V241-F245 PolarHBondContact O-N 2.98Å; R242-F245 PolarHBondContact O-N 3.34Å; C243-F245 PolarHBondContact O-N 2.87Å; F245-L247 VanDerWaalsContact C-N 3.33Å; F245-L247 PolarHBondContact O-N 3.36Å; F245-R248 PolarHBondContact O-N 3.44Å; F245-A249 PolarHBondContact O-N 3.04Å
246	K	84.6	Confident	86.6	Confident	82 Å²	82	65.2 Å²	65.2	36%	0.357	35%	0.351	S	S	.	.	H	α-helix	trans	-62.2	-40.1	176.3	-69.3	178	178.5	179.7	0	112	V104 R242 C243 A249 C250	V104-K246 HydrophobicContact CG2-CG 3.93Å; R242-K246 WeakPolarHBondContact O-CG 3.28Å; R242-K246 PolarHBondContact O-N 3.28Å; C243-K246 PolarHBondContact O-N 3.5Å; K246-A249 WeakPolarHBondContact O-CB 3.44Å; K246-A249 PolarHBondContact O-N 3.44Å; K246-C250 PolarHBondContact O-N 3Å; K246-C250 PolarHBondContact O-SG 2.92Å
247	L	84	Confident	86.4	Confident	105 Å²	105	67.2 Å²	67.2	55%	0.55	36%	0.361	S	S	.	.	H	α-helix	trans	-64.6	-43.1	178	-170	66	0	0	0	111.8	C243 Q244 F245 A249 C250 N251	C243-L247 WeakPolarHBondContact O-CB 3.49Å; C243-L247 PolarHBondContact O-N 3.24Å; Q244-L247 PolarHBondContact O-N 3.41Å; F245-L247 VanDerWaalsContact C-N 3.33Å; F245-L247 PolarHBondContact O-N 3.36Å; L247-A249 VanDerWaalsContact C-N 3.32Å; L247-A249 PolarHBondContact O-N 3.1Å; L247-C250 WeakPolarHBondContact O-CB 3.34Å; L247-C250 PolarHBondContact O-N 3.03Å; L247-N251 PolarHBondContact O-N 3.27Å
248	R	81.8	Confident	86.4	Confident	107 Å²	107	68.2 Å²	68.2	40%	0.404	37%	0.366	S	S	.	.	H	α-helix	trans	-60.6	-41.2	173.8	-73.4	-171.5	-69.4	176.1	-0.2	111.8	Q244 F245 N251	Q244-R248 WeakPolarHBondContact O-CG 3.5Å; Q244-R248 PolarHBondContact O-N 3.39Å; F245-R248 PolarHBondContact O-N 3.44Å; R248-N251 WeakPolarHBondContact O-CB 3.45Å; R248-N251 PolarHBondContact O-N 3.02Å
249	A	84.1	Confident	86.5	Confident	9 Å²	9	71.6 Å²	71.6	7%	0.074	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-45.8	174.3	0	0	0	0	0	112.2	L109 F245 K246 L247 N251 S252	L109-A249 HydrophobicContact CD1-CB 3.37Å; F245-A249 PolarHBondContact O-N 3.04Å; K246-A249 WeakPolarHBondContact O-CB 3.44Å; K246-A249 PolarHBondContact O-N 3.44Å; L247-A249 VanDerWaalsContact C-N 3.32Å; L247-A249 PolarHBondContact O-N 3.1Å; A249-N251 PolarHBondContact O-N 2.93Å; A249-S252 VanDerWaalsContact O-CB 3.31Å; A249-S252 WeakPolarHBondContact O-CB 3.3Å; A249-S252 PolarHBondContact O-N 3.48Å
250	C	84.2	Confident	86.7	Confident	46 Å²	46	71.9 Å²	71.9	31%	0.311	37%	0.372	S	S	.	.	H	α-helix	trans	-59.8	-31	176.4	-70.1	0	0	0	0	112.8	K246 L247 S252 V253 F254	K246-C250 PolarHBondContact O-N 3Å; K246-C250 PolarHBondContact O-SG 2.92Å; L247-C250 WeakPolarHBondContact O-CB 3.34Å; L247-C250 PolarHBondContact O-N 3.03Å; C250-S252 PolarHBondContact O-N 3.04Å; C250-V253 WeakPolarHBondContact O-CA 3.37Å; C250-V253 WeakPolarHBondContact O-CB 3.38Å; C250-V253 PolarHBondContact O-N 2.89Å; C250-F254 HydrophobicContact CB-CD2 4.42Å; C250-F254 HydrophobicContact CB-CE2 4.13Å; C250-F254 VanDerWaalsContact O-CD2 3.28Å; C250-F254 WeakPolarHBondContact O-CD2 3.35Å; C250-F254 PolarHBondContact O-N 3.32Å
251	N	85.3	Confident	86.7	Confident	101 Å²	101	77.7 Å²	77.7	54%	0.54	40%	0.399	S	S	.	.	H	α-helix	trans	-59.1	-29.6	175.4	-164.5	37.3	0	0	0	113	L247 R248 A249 F254 T255	L247-N251 PolarHBondContact O-N 3.27Å; R248-N251 WeakPolarHBondContact O-CB 3.45Å; R248-N251 PolarHBondContact O-N 3.02Å; A249-N251 PolarHBondContact O-N 2.93Å; N251-F254 PolarHBondContact O-N 2.87Å; N251-T255 WeakPolarHBondContact O-CB 3.46Å; N251-T255 PolarHBondContact O-N 2.88Å; N251-T255 PolarHBondContact O-OG1 3.02Å
252	S	85.4	Confident	86.9	Confident	72 Å²	72	80.4 Å²	80.4	50%	0.503	41%	0.411	S	S	.	.	H	α-helix	trans	-66.7	-38.9	173.7	-56.5	0	0	0	0	111.6	A249 C250 T255 A256	A249-S252 VanDerWaalsContact O-CB 3.31Å; A249-S252 WeakPolarHBondContact O-CB 3.3Å; A249-S252 PolarHBondContact O-N 3.48Å; C250-S252 PolarHBondContact O-N 3.04Å; S252-T255 PolarHBondContact O-N 3.26Å; S252-A256 PolarHBondContact O-N 3.01Å
253	V	87.6	Confident	87.2	Confident	80 Å²	80	76.6 Å²	76.6	49%	0.485	40%	0.397	S	S	.	.	H	α-helix	trans	-69.7	-43	175.9	-178.9	0	0	0	0	110.8	M107 C250 T255 A256 L257	M107-V253 HydrophobicContact SD-CG2 3.58Å; M107-V253 VanDerWaalsContact SD-CG2 3.58Å; C250-V253 WeakPolarHBondContact O-CA 3.37Å; C250-V253 WeakPolarHBondContact O-CB 3.38Å; C250-V253 PolarHBondContact O-N 2.89Å; V253-T255 VanDerWaalsContact C-N 3.29Å; V253-T255 PolarHBondContact O-N 3.49Å; V253-A256 WeakPolarHBondContact O-CB 3.45Å; V253-A256 PolarHBondContact O-N 3.4Å; V253-A256 VanDerWaalsContact O-N 3.15Å; V253-L257 WeakPolarHBondContact O-CB 3.4Å; V253-L257 PolarHBondContact O-N 3.1Å
254	F	86.7	Confident	87.7	Confident	123 Å²	123	73 Å²	73	54%	0.539	37%	0.373	S	S	.	.	H	α-helix	trans	-60.7	-40.1	174.5	-72.1	-57	0	0	0	111.9	C250 N251 A256 L257 E258	C250-F254 HydrophobicContact CB-CD2 4.42Å; C250-F254 HydrophobicContact CB-CE2 4.13Å; C250-F254 VanDerWaalsContact O-CD2 3.28Å; C250-F254 WeakPolarHBondContact O-CD2 3.35Å; C250-F254 PolarHBondContact O-N 3.32Å; N251-F254 PolarHBondContact O-N 2.87Å; F254-A256 PolarHBondContact O-N 3.46Å; F254-L257 WeakPolarHBondContact O-CB 3.23Å; F254-L257 PolarHBondContact O-N 3.32Å; F254-E258 WeakPolarHBondContact O-CB 3.49Å; F254-E258 PolarHBondContact O-N 3.29Å
255	T	88.4	Confident	88.1	Confident	68 Å²	68	70.4 Å²	70.4	42%	0.417	36%	0.361	S	S	.	.	H	α-helix	trans	-61.9	-43.9	174	-57.5	0	0	0	0	111	N251 S252 V253 L257 E258 Y259	N251-T255 WeakPolarHBondContact O-CB 3.46Å; N251-T255 PolarHBondContact O-N 2.88Å; N251-T255 PolarHBondContact O-OG1 3.02Å; S252-T255 PolarHBondContact O-N 3.26Å; V253-T255 VanDerWaalsContact C-N 3.29Å; V253-T255 PolarHBondContact O-N 3.49Å; T255-L257 VanDerWaalsContact C-N 3.34Å; T255-L257 PolarHBondContact O-N 3.18Å; T255-E258 PolarHBondContact O-N 3.08Å; T255-Y259 HydrophobicContact CG2-CD2 3.88Å; T255-Y259 HydrophobicContact CG2-CE2 4.07Å; T255-Y259 VanDerWaalsContact O-CD2 3.27Å; T255-Y259 WeakPolarHBondContact O-CD2 3.34Å; T255-Y259 PolarHBondContact O-N 3.01Å
256	A	88.2	Confident	88.6	Confident	63 Å²	63	70 Å²	70	52%	0.521	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-39.7	176.3	0	0	0	0	0	112.6	S252 V253 F254 C260	S252-A256 PolarHBondContact O-N 3.01Å; V253-A256 WeakPolarHBondContact O-CB 3.45Å; V253-A256 PolarHBondContact O-N 3.4Å; V253-A256 VanDerWaalsContact O-N 3.15Å; F254-A256 PolarHBondContact O-N 3.46Å; A256-C260 WeakPolarHBondContact O-CB 3.42Å; A256-C260 PolarHBondContact O-N 3.13Å; A256-C260 VanDerWaalsContact O-N 3.09Å
257	L	89.4	Confident	89	Confident	41 Å²	41	66.3 Å²	66.3	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-42.7	177.3	-168.6	98.1	0	0	0	112.2	V253 F254 T255 Y259 C260 V264 I266 Y275 N277	V253-L257 WeakPolarHBondContact O-CB 3.4Å; V253-L257 PolarHBondContact O-N 3.1Å; F254-L257 WeakPolarHBondContact O-CB 3.23Å; F254-L257 PolarHBondContact O-N 3.32Å; T255-L257 VanDerWaalsContact C-N 3.34Å; T255-L257 PolarHBondContact O-N 3.18Å; L257-Y259 PolarHBondContact O-N 3.5Å; L257-C260 PolarHBondContact O-SG 3.41Å; L257-V264 HydrophobicContact CD1-CG1 3.97Å; L257-V264 HydrophobicContact CG-CG1 4.43Å; L257-I266 HydrophobicContact CD2-CD1 4.38Å; L257-Y275 HydrophobicContact CD2-CD1 3.81Å; L257-Y275 HydrophobicContact CD2-CE1 3.19Å; L257-Y275 HydrophobicContact CD2-CE2 4.38Å; L257-Y275 HydrophobicContact CG-CE1 3.97Å; L257-N277 PolarHBondContact O-ND2 2.67Å
258	E	91.1	Very high	89.4	Confident	46 Å²	46	61.9 Å²	61.9	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-38.9	180	-170.4	69.2	-165.6	0	0	111.8	F254 T255 Y275 P278	F254-E258 WeakPolarHBondContact O-CB 3.49Å; F254-E258 PolarHBondContact O-N 3.29Å; T255-E258 PolarHBondContact O-N 3.08Å; E258-Y275 WeakPolarHBondContact CA-OH 3.33Å; E258-Y275 WeakPolarHBondContact OE2-CE2 3.21Å; E258-Y275 PolarHBondContact OE2-OH 3.2Å; E258-P278 VanDerWaalsContact O-CD 3.31Å; E258-P278 WeakPolarHBondContact O-CD 3.33Å; E258-P278 WeakPolarHBondContact OE1-CD 3.27Å
259	Y	89.6	Confident	89.6	Confident	189 Å²	189	60.7 Å²	60.7	74%	0.741	32%	0.321	S	S	*	.	H	α-helix	trans	-102.2	6	-175	-65.2	-70.8	0	0	0	114.6	T255 L257	T255-Y259 HydrophobicContact CG2-CD2 3.88Å; T255-Y259 HydrophobicContact CG2-CE2 4.07Å; T255-Y259 VanDerWaalsContact O-CD2 3.27Å; T255-Y259 WeakPolarHBondContact O-CD2 3.34Å; T255-Y259 PolarHBondContact O-N 3.01Å; L257-Y259 PolarHBondContact O-N 3.5Å
260	C	91.3	Very high	89.7	Confident	37 Å²	37	65.3 Å²	65.3	25%	0.25	35%	0.345	C	S	.	.			trans	-68.5	153.1	177	77.8	0	0	0	0	111.9	A256 L257 E262 N277	A256-C260 WeakPolarHBondContact O-CB 3.42Å; A256-C260 PolarHBondContact O-N 3.13Å; A256-C260 VanDerWaalsContact O-N 3.09Å; L257-C260 PolarHBondContact O-SG 3.41Å; C260-E262 PolarHBondContact SG-O 2.92Å; C260-E262 VanDerWaalsContact SG-O 3.33Å; C260-N277 PolarHBondContact SG-ND2 2.88Å
261	Q	89.5	Confident	89.9	Confident	187 Å²	187	64.4 Å²	64.4	87%	0.874	34%	0.336	S	S	*	.	S	Bend	trans	-78.9	-21.1	-178	-67.1	-175	0.3	0	0	113.2	A279	Q261-A279 WeakPolarHBondContact O-CB 3.49Å
262	E	92	Very high	90.2	Very high	66 Å²	66	62.6 Å²	62.6	31%	0.308	33%	0.326	S	S	.	.	S	Bend	trans	-80.9	145	178.5	-56.3	-160.3	122.5	0	0	110.5	C260 V264 N277 A279 I359 R361	C260-E262 PolarHBondContact SG-O 2.92Å; C260-E262 VanDerWaalsContact SG-O 3.33Å; E262-V264 PolarHBondContact O-N 3Å; E262-N277 PolarHBondContact O-ND2 2.71Å; E262-A279 WeakPolarHBondContact O-CB 3.45Å; E262-I359 HydrophobicContact CB-CG2 3.95Å; E262-I359 WeakPolarHBondContact OE2-CG2 3.39Å; E262-R361 IonicContact OE1-CZ 3.29Å; E262-R361 IonicContact OE1-NE 2.89Å; E262-R361 PolarHBondContact OE1-NE 3.37Å; E262-R361 IonicContact OE1-NH2 3.41Å; E262-R361 PolarHBondContact OE1-NH2 3.29Å
263	A	93.5	Very high	90.5	Very high	3 Å²	3	59.1 Å²	59.1	3%	0.025	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	117.2	176.8	0	0	0	0	0	109	F280 M283 K360	A263-F280 VanDerWaalsContact CB-CA 3.5Å; A263-F280 HydrophobicContact CB-CB 3.9Å; A263-F280 HydrophobicContact CB-CD2 4.08Å; A263-F280 HydrophobicContact CB-CG 4.44Å; A263-M283 HydrophobicContact CB-CB 4.38Å; A263-M283 HydrophobicContact CB-CE 3.52Å; A263-M283 HydrophobicContact CB-SD 3.88Å; A263-K360 HydrophobicContact CB-CB 4.06Å; A263-K360 WeakPolarHBondContact CB-O 3.44Å; A263-K360 PolarHBondContact N-O 3.31Å; A263-K360 PolarHBondContact O-N 2.88Å
264	V	94.9	Very high	90.7	Very high	7 Å²	7	59.8 Å²	59.8	4%	0.042	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.5	-179.5	-177.1	0	0	0	0	109.6	L257 E262 V276 N277 V357 A358	L257-V264 HydrophobicContact CD1-CG1 3.97Å; L257-V264 HydrophobicContact CG-CG1 4.43Å; E262-V264 PolarHBondContact O-N 3Å; V264-V276 WeakPolarHBondContact O-CA 3.1Å; V264-N277 PolarHBondContact N-OD1 3.43Å; V264-N277 PolarHBondContact O-N 2.95Å; V264-N277 VanDerWaalsContact O-N 3.15Å; V264-V357 HydrophobicContact CG1-CG1 4.37Å; V264-A358 WeakPolarHBondContact CA-O 3.41Å
265	E	93.8	Very high	91	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.019	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.1	176.6	175.7	-174.8	98.2	0	0	108.8	T267 Y275 V276 F280 L296 A358 K360	E265-T267 HydrophobicContact CG-CG2 4.13Å; E265-Y275 CarbonylContact C-O 3.54Å; E265-Y275 WeakPolarHBondContact CA-O 3.29Å; E265-V276 HydrophobicContact CB-CG1 4.21Å; E265-V276 HydrophobicContact CG-CG1 4.08Å; E265-F280 HydrophobicContact CB-CD2 4.24Å; E265-F280 HydrophobicContact CB-CE2 4.2Å; E265-F280 WeakPolarHBondContact OE2-CE2 3.27Å; E265-F280 WeakPolarHBondContact OE2-CZ 3.27Å; E265-L296 WeakPolarHBondContact OE1-CD1 3.45Å; E265-A358 HydrophobicContact CB-CB 4.35Å; E265-A358 PolarHBondContact N-O 2.97Å; E265-A358 PolarHBondContact O-N 2.95Å; E265-K360 IonicContact OE1-NZ 3.73Å; E265-K360 PolarHBondContact OE1-NZ 2.59Å; E265-K360 IonicContact OE2-NZ 3.37Å; E265-K360 PolarHBondContact OE2-NZ 3.41Å
266	I	94.7	Very high	91.3	Very high	33 Å²	33	53.3 Å²	53.3	17%	0.169	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.2	174.2	-50.9	179.2	0	0	0	108.1	L257 Q274 Y275 H355 F356 V357	L257-I266 HydrophobicContact CD2-CD1 4.38Å; I266-Q274 PolarHBondContact O-N 3.27Å; I266-Y275 HydrophobicContact CD1-CD1 4.02Å; I266-Y275 HydrophobicContact CD1-CG 4.45Å; I266-Y275 HydrophobicContact CG1-CD1 4.07Å; I266-Y275 PolarHBondContact N-O 3.41Å; I266-Y275 PolarHBondContact O-N 3Å; I266-Y275 VanDerWaalsContact O-N 3.13Å; I266-H355 HydrophobicContact CG2-CB 4.01Å; I266-F356 VanDerWaalsContact CA-O 3.3Å; I266-F356 WeakPolarHBondContact CA-O 3.49Å; I266-V357 HydrophobicContact CD1-CG2 4.48Å; I266-V357 HydrophobicContact CG1-CG2 4.18Å; I266-V357 HydrophobicContact CG2-CG2 4.39Å
267	T	93.3	Very high	91.6	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.031	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	157.1	175.9	72	0	0	0	0	111.4	E265 I272 I273 H355 F356	E265-T267 HydrophobicContact CG-CG2 4.13Å; T267-I272 CarbonylContact C-O 3.59Å; T267-I272 WeakPolarHBondContact CA-O 3.48Å; T267-I272 WeakPolarHBondContact CB-O 3.5Å; T267-I273 HydrophobicContact CG2-CG1 4.23Å; T267-H355 CarbonylContact O-C 3.58Å; T267-H355 WeakPolarHBondContact O-CA 3.22Å; T267-H355 WeakPolarHBondContact O-CB 3.28Å; T267-F356 PolarHBondContact N-O 3.4Å; T267-F356 PolarHBondContact O-N 3.44Å
268	S	92	Very high	91.8	Very high	12 Å²	12	50 Å²	50	8%	0.084	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	176	167.9	69.6	0	0	0	0	112	D270 H271 I272 R354 F356	S268-D270 PolarHBondContact O-N 3.2Å; S268-D270 PolarHBondContact OG-N 2.87Å; S268-H271 PolarHBondContact O-N 3.26Å; S268-I272 PolarHBondContact N-O 3.23Å; S268-I272 WeakPolarHBondContact OG-CB 3.48Å; S268-I272 PolarHBondContact OG-N 3.31Å; S268-I272 VanDerWaalsContact OG-N 3.14Å; S268-R354 CarbonylContact C-O 3.56Å; S268-F356 WeakPolarHBondContact O-CD2 3.33Å
269	E	86.7	Confident	91.9	Very high	82 Å²	82	48.1 Å²	48.1	38%	0.383	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.8	169.6	65.9	-170.7	135.9	0	0	113.1	H271 R354	E269-H271 PolarHBondContact O-N 3.33Å; E269-R354 PolarHBondContact N-O 2.98Å; E269-R354 VanDerWaalsContact N-O 3.09Å; E269-R354 IonicContact OE1-NH1 3.74Å; E269-R354 PolarHBondContact OE1-NH1 3.13Å; E269-R354 IonicContact OE2-NH1 3.02Å
270	D	86.9	Confident	92.1	Very high	107 Å²	107	39.1 Å²	39.1	57%	0.572	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	14.5	175.5	-55.5	-52.8	0	0	0	113.4	S268 I272	S268-D270 PolarHBondContact O-N 3.2Å; S268-D270 PolarHBondContact OG-N 2.87Å; D270-I272 HydrophobicContact CB-CD1 4.29Å; D270-I272 HydrophobicContact CB-CG1 4.27Å; D270-I272 PolarHBondContact O-N 2.89Å
271	H	87	Confident	92.1	Very high	26 Å²	26	39.3 Å²	39.3	12%	0.12	19%	0.194	C	C	.	.			trans	59.5	25.1	-178.3	-54.2	-66.5	0	0	0	115	S268 E269 L296 F356	S268-H271 PolarHBondContact O-N 3.26Å; E269-H271 PolarHBondContact O-N 3.33Å; H271-L296 HydrophobicContact CB-CB 4.26Å; H271-L296 WeakPolarHBondContact O-CB 3.27Å; H271-L296 PolarHBondContact O-N 3.32Å; H271-F356 AromaticContact CE1-CD2 3.92Å; H271-F356 AromaticContact CE1-CE2 3.54Å; H271-F356 AromaticContact ND1-CD2 3.85Å; H271-F356 AromaticContact ND1-CE2 3.86Å
272	I	91.7	Very high	92.2	Very high	63 Å²	63	39.2 Å²	39.2	32%	0.323	19%	0.186	S	C	.	.	B	Isolated β-bridge	trans	-80.3	128.3	172.2	-58.6	171.3	0	0	0	108.6	T267 S268 D270 Q274 K294	T267-I272 CarbonylContact C-O 3.59Å; T267-I272 WeakPolarHBondContact CA-O 3.48Å; T267-I272 WeakPolarHBondContact CB-O 3.5Å; S268-I272 PolarHBondContact N-O 3.23Å; S268-I272 WeakPolarHBondContact OG-CB 3.48Å; S268-I272 PolarHBondContact OG-N 3.31Å; S268-I272 VanDerWaalsContact OG-N 3.14Å; D270-I272 HydrophobicContact CB-CD1 4.29Å; D270-I272 HydrophobicContact CB-CG1 4.27Å; D270-I272 PolarHBondContact O-N 2.89Å; I272-Q274 PolarHBondContact O-N 2.91Å; I272-K294 WeakPolarHBondContact CA-O 3.41Å
273	I	92.3	Very high	92.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	118	-179.4	-57.4	171.2	0	0	0	109.5	T267 V276 L291 I292 G293 K294 L296 L299	T267-I273 HydrophobicContact CG2-CG1 4.23Å; I273-V276 HydrophobicContact CG2-CG1 3.79Å; I273-L291 HydrophobicContact CD1-CB 4.28Å; I273-L291 HydrophobicContact CD1-CD2 4.36Å; I273-L291 HydrophobicContact CG2-CB 4.38Å; I273-I292 HydrophobicContact CG2-CD1 4.18Å; I273-I292 WeakPolarHBondContact O-CA 3.05Å; I273-G293 PolarHBondContact O-N 3.28Å; I273-K294 PolarHBondContact N-O 3.09Å; I273-L296 HydrophobicContact CD1-CD1 4.22Å; I273-L296 HydrophobicContact CG1-CD1 4.41Å; I273-L299 HydrophobicContact CD1-CD1 4.17Å
274	Q	91.5	Very high	91.8	Very high	93 Å²	93	37.6 Å²	37.6	44%	0.435	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-28.6	-179	-69.5	178.5	-35.6	0	0	112.5	I266 I272 I292 H355	I266-Q274 PolarHBondContact O-N 3.27Å; I272-Q274 PolarHBondContact O-N 2.91Å; Q274-I292 WeakPolarHBondContact O-CD1 3.4Å; Q274-H355 PolarHBondContact OE1-CE1 3.29Å; Q274-H355 VanDerWaalsContact OE1-CE1 3.27Å; Q274-H355 PolarHBondContact OE1-ND1 2.63Å
275	Y	94.1	Very high	91.5	Very high	50 Å²	50	39.3 Å²	39.3	20%	0.196	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	142.5	177.3	174.3	-92	0	0	0	111.5	L257 E258 E265 I266 N277	L257-Y275 HydrophobicContact CD2-CD1 3.81Å; L257-Y275 HydrophobicContact CD2-CE1 3.19Å; L257-Y275 HydrophobicContact CD2-CE2 4.38Å; L257-Y275 HydrophobicContact CG-CE1 3.97Å; E258-Y275 WeakPolarHBondContact CA-OH 3.33Å; E258-Y275 WeakPolarHBondContact OE2-CE2 3.21Å; E258-Y275 PolarHBondContact OE2-OH 3.2Å; E265-Y275 CarbonylContact C-O 3.54Å; E265-Y275 WeakPolarHBondContact CA-O 3.29Å; I266-Y275 HydrophobicContact CD1-CD1 4.02Å; I266-Y275 HydrophobicContact CD1-CG 4.45Å; I266-Y275 HydrophobicContact CG1-CD1 4.07Å; I266-Y275 PolarHBondContact N-O 3.41Å; I266-Y275 PolarHBondContact O-N 3Å; I266-Y275 VanDerWaalsContact O-N 3.13Å; Y275-N277 HydrophobicContact CE1-CB 3.89Å; Y275-N277 WeakPolarHBondContact OH-CB 3.36Å
276	V	93.6	Very high	91.2	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.03	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	141.8	166.2	-69.3	0	0	0	0	108.8	V264 E265 I273 F280 R288 L291 I292	V264-V276 WeakPolarHBondContact O-CA 3.1Å; E265-V276 HydrophobicContact CB-CG1 4.21Å; E265-V276 HydrophobicContact CG-CG1 4.08Å; I273-V276 HydrophobicContact CG2-CG1 3.79Å; V276-F280 HydrophobicContact CB-CB 4.21Å; V276-F280 HydrophobicContact CB-CD1 3.92Å; V276-F280 HydrophobicContact CB-CG 4.12Å; V276-F280 HydrophobicContact CG1-CD1 3.82Å; V276-F280 HydrophobicContact CG1-CE1 4.05Å; V276-F280 HydrophobicContact CG1-CG 4.1Å; V276-F280 HydrophobicContact CG1-CZ 4.5Å; V276-F280 HydrophobicContact CG2-CD1 4.49Å; V276-R288 HydrophobicContact CG2-CB 3.75Å; V276-L291 HydrophobicContact CG1-CD1 4.27Å; V276-L291 HydrophobicContact CG2-CD1 4.01Å; V276-I292 HydrophobicContact CG2-CD1 4.45Å
277	N	94.7	Very high	91	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.			trans	-90.3	163.8	178	76.5	-14	0	0	0	112.3	L257 C260 E262 V264 Y275 A279 F280 E281	L257-N277 PolarHBondContact O-ND2 2.67Å; C260-N277 PolarHBondContact SG-ND2 2.88Å; E262-N277 PolarHBondContact O-ND2 2.71Å; V264-N277 PolarHBondContact N-OD1 3.43Å; V264-N277 PolarHBondContact O-N 2.95Å; V264-N277 VanDerWaalsContact O-N 3.15Å; Y275-N277 HydrophobicContact CE1-CB 3.89Å; Y275-N277 WeakPolarHBondContact OH-CB 3.36Å; N277-A279 PolarHBondContact O-N 2.92Å; N277-A279 VanDerWaalsContact O-N 3.13Å; N277-A279 PolarHBondContact OD1-N 3.16Å; N277-F280 VanDerWaalsContact O-CB 3.27Å; N277-F280 WeakPolarHBondContact O-CB 3.31Å; N277-F280 PolarHBondContact O-N 3.12Å; N277-F280 PolarHBondContact OD1-N 2.79Å; N277-E281 PolarHBondContact O-N 2.95Å
278	P	94.6	Very high	90.8	Very high	34 Å²	34	50.3 Å²	50.3	22%	0.221	24%	0.241	C	C	.	.	H	α-helix	trans	-55	-28.7	176.2	-29.3	35	0	0	0	115.3	E258 F280 E281 R282	E258-P278 VanDerWaalsContact O-CD 3.31Å; E258-P278 WeakPolarHBondContact O-CD 3.33Å; E258-P278 WeakPolarHBondContact OE1-CD 3.27Å; P278-F280 VanDerWaalsContact C-N 3.35Å; P278-E281 PolarHBondContact O-N 3.48Å; P278-R282 WeakPolarHBondContact O-CG 3.37Å; P278-R282 PolarHBondContact O-N 2.76Å; P278-R282 VanDerWaalsContact O-N 3.1Å
279	A	92.5	Very high	90.6	Very high	7 Å²	7	52.6 Å²	52.6	6%	0.058	27%	0.266	C	S	.	.	H	α-helix	trans	-66.3	-37.8	174.6	0	0	0	0	0	112.1	Q261 E262 N277 R282 M283	Q261-A279 WeakPolarHBondContact O-CB 3.49Å; E262-A279 WeakPolarHBondContact O-CB 3.45Å; N277-A279 PolarHBondContact O-N 2.92Å; N277-A279 VanDerWaalsContact O-N 3.13Å; N277-A279 PolarHBondContact OD1-N 3.16Å; A279-R282 PolarHBondContact O-N 2.92Å; A279-M283 WeakPolarHBondContact O-CB 3.21Å; A279-M283 PolarHBondContact O-N 3.15Å
280	F	93	Very high	90.6	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-61.8	-46.2	172.1	-175.2	-83.2	0	0	0	111.9	A263 E265 V276 N277 P278 R282 M283 M284 L291 K360	A263-F280 VanDerWaalsContact CB-CA 3.5Å; A263-F280 HydrophobicContact CB-CB 3.9Å; A263-F280 HydrophobicContact CB-CD2 4.08Å; A263-F280 HydrophobicContact CB-CG 4.44Å; E265-F280 HydrophobicContact CB-CD2 4.24Å; E265-F280 HydrophobicContact CB-CE2 4.2Å; E265-F280 WeakPolarHBondContact OE2-CE2 3.27Å; E265-F280 WeakPolarHBondContact OE2-CZ 3.27Å; V276-F280 HydrophobicContact CB-CB 4.21Å; V276-F280 HydrophobicContact CB-CD1 3.92Å; V276-F280 HydrophobicContact CB-CG 4.12Å; V276-F280 HydrophobicContact CG1-CD1 3.82Å; V276-F280 HydrophobicContact CG1-CE1 4.05Å; V276-F280 HydrophobicContact CG1-CG 4.1Å; V276-F280 HydrophobicContact CG1-CZ 4.5Å; V276-F280 HydrophobicContact CG2-CD1 4.49Å; N277-F280 VanDerWaalsContact O-CB 3.27Å; N277-F280 WeakPolarHBondContact O-CB 3.31Å; N277-F280 PolarHBondContact O-N 3.12Å; N277-F280 PolarHBondContact OD1-N 2.79Å; P278-F280 VanDerWaalsContact C-N 3.35Å; F280-R282 VanDerWaalsContact C-N 3.33Å; F280-R282 PolarHBondContact O-N 2.89Å; F280-M283 PolarHBondContact O-N 2.98Å; F280-M283 VanDerWaalsContact O-N 3.16Å; F280-M284 HydrophobicContact CD1-CB 4.42Å; F280-M284 HydrophobicContact CD1-CG 4.37Å; F280-M284 HydrophobicContact CD2-CG 4.39Å; F280-M284 HydrophobicContact CE1-CB 4.01Å; F280-M284 HydrophobicContact CE1-CG 3.93Å; F280-M284 HydrophobicContact CE2-CG 3.96Å; F280-M284 HydrophobicContact CZ-CB 4.28Å; F280-M284 HydrophobicContact CZ-CG 3.73Å; F280-M284 PolarHBondContact O-N 3.47Å; F280-L291 HydrophobicContact CD1-CD1 4.01Å; F280-L291 HydrophobicContact CE1-CD1 3.55Å; F280-K360 HydrophobicContact CD2-CD 4.28Å; F280-K360 HydrophobicContact CE2-CD 3.91Å
281	E	92.2	Very high	90.6	Very high	40 Å²	40	47.2 Å²	47.2	19%	0.187	24%	0.238	C	C	.	.	H	α-helix	trans	-57.6	-45.6	177.9	-61.4	-175.9	128.7	0	0	111.5	N277 P278 M283 G285 Y286 H287 R288	N277-E281 PolarHBondContact O-N 2.95Å; P278-E281 PolarHBondContact O-N 3.48Å; E281-M283 PolarHBondContact O-N 2.99Å; E281-G285 WeakPolarHBondContact O-CA 3.29Å; E281-G285 PolarHBondContact O-N 3.37Å; E281-Y286 VanDerWaalsContact CA-O 3.27Å; E281-Y286 WeakPolarHBondContact CA-O 3.38Å; E281-Y286 VanDerWaalsContact CB-O 3.27Å; E281-Y286 WeakPolarHBondContact CB-O 3.47Å; E281-Y286 WeakPolarHBondContact CG-O 3.44Å; E281-H287 WeakPolarHBondContact OE1-CA 3.43Å; E281-H287 IonicContact OE1-CD2 2.65Å; E281-H287 IonicContact OE1-CG 3.32Å; E281-R288 VanDerWaalsContact OE1-CB 3.29Å; E281-R288 WeakPolarHBondContact OE1-CB 3.22Å; E281-R288 WeakPolarHBondContact OE1-CG 3.45Å; E281-R288 PolarHBondContact OE1-N 2.69Å
282	R	90.7	Very high	90.8	Very high	186 Å²	186	49.8 Å²	49.8	70%	0.702	25%	0.252	S	S	*	.	H	α-helix	trans	-64.3	-38.6	176.5	-71.3	-174.4	-64.1	-130.8	-1.1	112.9	P278 A279 F280	P278-R282 WeakPolarHBondContact O-CG 3.37Å; P278-R282 PolarHBondContact O-N 2.76Å; P278-R282 VanDerWaalsContact O-N 3.1Å; A279-R282 PolarHBondContact O-N 2.92Å; F280-R282 VanDerWaalsContact C-N 3.33Å; F280-R282 PolarHBondContact O-N 2.89Å
283	M	89.4	Confident	90.5	Very high	23 Å²	23	49.4 Å²	49.4	11%	0.113	26%	0.263	C	S	.	.	H	α-helix	trans	-71.3	-45.6	-177.6	-172.9	-179.7	71.8	0	0	112	A263 A279 F280 E281 K331 I337 K360 A362	A263-M283 HydrophobicContact CB-CB 4.38Å; A263-M283 HydrophobicContact CB-CE 3.52Å; A263-M283 HydrophobicContact CB-SD 3.88Å; A279-M283 WeakPolarHBondContact O-CB 3.21Å; A279-M283 PolarHBondContact O-N 3.15Å; F280-M283 PolarHBondContact O-N 2.98Å; F280-M283 VanDerWaalsContact O-N 3.16Å; E281-M283 PolarHBondContact O-N 2.99Å; M283-K331 VanDerWaalsContact O-CE 3.22Å; M283-K331 WeakPolarHBondContact O-CE 3.31Å; M283-I337 HydrophobicContact CG-CD1 4.36Å; M283-K360 HydrophobicContact CE-CB 3.73Å; M283-K360 HydrophobicContact CE-CD 4.27Å; M283-K360 HydrophobicContact SD-CB 4.49Å; M283-A362 HydrophobicContact SD-CB 4.38Å
284	M	88.6	Confident	90.3	Very high	11 Å²	11	53.8 Å²	53.8	5%	0.054	28%	0.282	C	S	.	.	H	α-helix	trans	-97.3	-19.9	-171.7	-66.2	-61.1	-67.6	0	0	113.8	F280 Y286 A329 R330 K331 K332 I337	F280-M284 HydrophobicContact CD1-CB 4.42Å; F280-M284 HydrophobicContact CD1-CG 4.37Å; F280-M284 HydrophobicContact CD2-CG 4.39Å; F280-M284 HydrophobicContact CE1-CB 4.01Å; F280-M284 HydrophobicContact CE1-CG 3.93Å; F280-M284 HydrophobicContact CE2-CG 3.96Å; F280-M284 HydrophobicContact CZ-CB 4.28Å; F280-M284 HydrophobicContact CZ-CG 3.73Å; F280-M284 PolarHBondContact O-N 3.47Å; M284-Y286 HydrophobicContact CB-CD2 3.93Å; M284-A329 HydrophobicContact CE-CB 3.79Å; M284-A329 HydrophobicContact SD-CB 4.28Å; M284-R330 VanDerWaalsContact CE-O 3.31Å; M284-R330 WeakPolarHBondContact CE-O 3.46Å; M284-K331 WeakPolarHBondContact O-CA 3.41Å; M284-K332 PolarHBondContact O-N 3.09Å; M284-I337 HydrophobicContact SD-CG2 4.26Å
285	G	87.4	Confident	89.9	Confident	44 Å²	44	53.2 Å²	53.2	45%	0.454	28%	0.28	S	S	.	.			trans	81.6	8.8	178.5	0	0	0	0	0	115	E281 K332	E281-G285 WeakPolarHBondContact O-CA 3.29Å; E281-G285 PolarHBondContact O-N 3.37Å; G285-K332 WeakPolarHBondContact O-CD 3.22Å
286	Y	88.4	Confident	89.3	Confident	32 Å²	32	53.6 Å²	53.6	13%	0.125	29%	0.285	C	S	.	.			trans	-96.8	146.7	175.7	-67.5	-84.7	0	0	0	110.4	E281 M284 L291 L299 K332	E281-Y286 VanDerWaalsContact CA-O 3.27Å; E281-Y286 WeakPolarHBondContact CA-O 3.38Å; E281-Y286 VanDerWaalsContact CB-O 3.27Å; E281-Y286 WeakPolarHBondContact CB-O 3.47Å; E281-Y286 WeakPolarHBondContact CG-O 3.44Å; M284-Y286 HydrophobicContact CB-CD2 3.93Å; Y286-L291 HydrophobicContact CD1-CD2 4.22Å; Y286-L291 HydrophobicContact CG-CD2 3.97Å; Y286-L291 HydrophobicContact CG-CG 4.47Å; Y286-L299 HydrophobicContact CE1-CD2 4.22Å; Y286-L299 HydrophobicContact CE2-CD2 4.33Å; Y286-K332 HydrophobicContact CD1-CB 4.11Å; Y286-K332 HydrophobicContact CD1-CD 3.93Å; Y286-K332 HydrophobicContact CD1-CG 4.07Å; Y286-K332 HydrophobicContact CD2-CB 4.15Å; Y286-K332 HydrophobicContact CE1-CB 3.9Å; Y286-K332 HydrophobicContact CE1-CD 4.21Å; Y286-K332 HydrophobicContact CE1-CG 3.84Å; Y286-K332 HydrophobicContact CE2-CB 3.95Å; Y286-K332 HydrophobicContact CG-CB 4.23Å; Y286-K332 HydrophobicContact CG-CD 4.43Å
287	H	90.6	Very high	88.3	Confident	108 Å²	108	56.6 Å²	56.6	50%	0.5	30%	0.303	S	S	.	.			trans	-89.5	145.9	172.3	-172.6	-93.9	0	0	0	110.2	E281 G289 E290	E281-H287 WeakPolarHBondContact OE1-CA 3.43Å; E281-H287 IonicContact OE1-CD2 2.65Å; E281-H287 IonicContact OE1-CG 3.32Å; H287-G289 VanDerWaalsContact C-N 3.29Å; H287-G289 PolarHBondContact ND1-N 2.74Å; H287-G289 PolarHBondContact O-N 2.83Å; H287-E290 HydrophobicContact CB-CG 4.23Å; H287-E290 PolarHBondContact N-OE2 2.84Å; H287-E290 VanDerWaalsContact O-CB 3.31Å; H287-E290 WeakPolarHBondContact O-CB 3.1Å; H287-E290 PolarHBondContact O-N 2.84Å
288	R	89.1	Confident	87.3	Confident	132 Å²	132	62.5 Å²	62.5	50%	0.498	33%	0.331	S	S	.	.	H	α-helix	trans	-52.8	-44.6	-174.8	64.4	-174.3	-173.7	179.6	1.2	112.3	V276 E281 E290 L291 I292	V276-R288 HydrophobicContact CG2-CB 3.75Å; E281-R288 VanDerWaalsContact OE1-CB 3.29Å; E281-R288 WeakPolarHBondContact OE1-CB 3.22Å; E281-R288 WeakPolarHBondContact OE1-CG 3.45Å; E281-R288 PolarHBondContact OE1-N 2.69Å; R288-E290 PolarHBondContact O-N 3.23Å; R288-E290 VanDerWaalsContact O-N 3.12Å; R288-L291 PolarHBondContact O-N 3.24Å; R288-I292 WeakPolarHBondContact O-CG1 3.44Å; R288-I292 PolarHBondContact O-N 2.74Å
289	G	86.6	Confident	86.4	Confident	60 Å²	60	62.5 Å²	62.5	62%	0.619	33%	0.329	S	S	*	.	H	α-helix	trans	-63.7	-17.2	179	0	0	0	0	0	114.5	H287	H287-G289 VanDerWaalsContact C-N 3.29Å; H287-G289 PolarHBondContact ND1-N 2.74Å; H287-G289 PolarHBondContact O-N 2.83Å
290	E	87.8	Confident	85.3	Confident	75 Å²	75	65.2 Å²	65.2	35%	0.35	35%	0.346	S	S	.	.	H	α-helix	trans	-86.8	-16	174.4	-55.7	178.1	125.6	0	0	112.8	H287 R288 K294 K332	H287-E290 HydrophobicContact CB-CG 4.23Å; H287-E290 PolarHBondContact N-OE2 2.84Å; H287-E290 VanDerWaalsContact O-CB 3.31Å; H287-E290 WeakPolarHBondContact O-CB 3.1Å; H287-E290 PolarHBondContact O-N 2.84Å; R288-E290 PolarHBondContact O-N 3.23Å; R288-E290 VanDerWaalsContact O-N 3.12Å; E290-K294 VanDerWaalsContact O-CD 3.22Å; E290-K294 WeakPolarHBondContact O-CD 3.46Å; E290-K294 WeakPolarHBondContact O-CE 3.19Å; E290-K294 PolarHBondContact O-NZ 2.95Å; E290-K332 IonicContact OE1-NZ 2.64Å; E290-K332 PolarHBondContact OE1-NZ 2.97Å; E290-K332 IonicContact OE2-NZ 2.87Å; E290-K332 PolarHBondContact OE2-NZ 2.94Å
291	L	86.9	Confident	84.4	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-107.6	-39.6	-172.5	-64.7	171.5	0	0	0	112.5	I273 V276 F280 Y286 R288 G293 K294 L299	I273-L291 HydrophobicContact CD1-CB 4.28Å; I273-L291 HydrophobicContact CD1-CD2 4.36Å; I273-L291 HydrophobicContact CG2-CB 4.38Å; V276-L291 HydrophobicContact CG1-CD1 4.27Å; V276-L291 HydrophobicContact CG2-CD1 4.01Å; F280-L291 HydrophobicContact CD1-CD1 4.01Å; F280-L291 HydrophobicContact CE1-CD1 3.55Å; Y286-L291 HydrophobicContact CD1-CD2 4.22Å; Y286-L291 HydrophobicContact CG-CD2 3.97Å; Y286-L291 HydrophobicContact CG-CG 4.47Å; R288-L291 PolarHBondContact O-N 3.24Å; L291-G293 PolarHBondContact O-N 2.87Å; L291-K294 PolarHBondContact O-N 2.83Å; L291-K294 VanDerWaalsContact O-N 3.09Å; L291-L299 HydrophobicContact CD2-CD1 4.18Å; L291-L299 HydrophobicContact CD2-CD2 3.77Å
292	I	90.4	Very high	83.6	Confident	81 Å²	81	69.1 Å²	69.1	42%	0.415	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	128.6	-178.5	-61.5	-45.2	0	0	0	109.9	I273 Q274 V276 R288	I273-I292 HydrophobicContact CG2-CD1 4.18Å; I273-I292 WeakPolarHBondContact O-CA 3.05Å; Q274-I292 WeakPolarHBondContact O-CD1 3.4Å; V276-I292 HydrophobicContact CG2-CD1 4.45Å; R288-I292 WeakPolarHBondContact O-CG1 3.44Å; R288-I292 PolarHBondContact O-N 2.74Å
293	G	85.3	Confident	82.8	Confident	54 Å²	54	66.9 Å²	66.9	56%	0.557	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-3	179.5	0	0	0	0	0	115.2	I273 L291	I273-G293 PolarHBondContact O-N 3.28Å; L291-G293 PolarHBondContact O-N 2.87Å
294	K	87.9	Confident	82.1	Confident	92 Å²	92	72.5 Å²	72.5	40%	0.4	39%	0.389	S	S	.	.	S	Bend	trans	-91.5	150.5	174.1	-66.7	-170.7	179.7	162.5	0	112.3	I272 I273 E290 L291	I272-K294 WeakPolarHBondContact CA-O 3.41Å; I273-K294 PolarHBondContact N-O 3.09Å; E290-K294 VanDerWaalsContact O-CD 3.22Å; E290-K294 WeakPolarHBondContact O-CD 3.46Å; E290-K294 WeakPolarHBondContact O-CE 3.19Å; E290-K294 PolarHBondContact O-NZ 2.95Å; L291-K294 PolarHBondContact O-N 2.83Å; L291-K294 VanDerWaalsContact O-N 3.09Å
295	E	84.6	Confident	81.8	Confident	82 Å²	82	73.6 Å²	73.6	38%	0.383	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-73.3	137.6	172.2	-159.2	-171.5	139.9	0	0	110.3	T297 E298	E295-T297 WeakPolarHBondContact CG-OG1 3.32Å; E295-T297 PolarHBondContact O-N 2.8Å; E295-T297 VanDerWaalsContact OE1-CG2 3.3Å; E295-T297 WeakPolarHBondContact OE1-CG2 3.23Å; E295-T297 PolarHBondContact OE1-OG1 2.62Å; E295-E298 HydrophobicContact CB-CG 4.27Å; E295-E298 WeakPolarHBondContact O-CB 3.38Å; E295-E298 PolarHBondContact O-N 2.85Å
296	L	80.3	Confident	81.3	Confident	57 Å²	57	80.2 Å²	80.2	30%	0.298	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-57.9	-25.3	-179.4	-172	65.4	0	0	0	113	E265 H271 I273 E298 L299	E265-L296 WeakPolarHBondContact OE1-CD1 3.45Å; H271-L296 HydrophobicContact CB-CB 4.26Å; H271-L296 WeakPolarHBondContact O-CB 3.27Å; H271-L296 PolarHBondContact O-N 3.32Å; I273-L296 HydrophobicContact CD1-CD1 4.22Å; I273-L296 HydrophobicContact CG1-CD1 4.41Å; L296-E298 VanDerWaalsContact C-N 3.31Å; L296-E298 PolarHBondContact O-N 2.84Å; L296-L299 HydrophobicContact CD1-CD1 4.18Å; L296-L299 PolarHBondContact O-N 3.13Å
297	T	74.4	Confident	80.5	Confident	69 Å²	69	83.6 Å²	83.6	42%	0.423	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-72	-20.7	178.7	57.8	0	0	0	0	113.8	E295 L299	E295-T297 WeakPolarHBondContact CG-OG1 3.32Å; E295-T297 PolarHBondContact O-N 2.8Å; E295-T297 VanDerWaalsContact OE1-CG2 3.3Å; E295-T297 WeakPolarHBondContact OE1-CG2 3.23Å; E295-T297 PolarHBondContact OE1-OG1 2.62Å; T297-L299 VanDerWaalsContact C-N 3.26Å; T297-L299 PolarHBondContact O-N 2.85Å
298	E	73.5	Confident	79.9	Confident	123 Å²	123	81.7 Å²	81.7	58%	0.575	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-72.9	-19.5	176.9	-65.5	179.7	-162.6	0	0	112.6	E295 L296	E295-E298 HydrophobicContact CB-CG 4.27Å; E295-E298 WeakPolarHBondContact O-CB 3.38Å; E295-E298 PolarHBondContact O-N 2.85Å; L296-E298 VanDerWaalsContact C-N 3.31Å; L296-E298 PolarHBondContact O-N 2.84Å
299	L	74.8	Confident	79.4	Confident	34 Å²	34	77 Å²	77	18%	0.178	42%	0.419	C	S	.	.	S	Bend	trans	-72.2	132.2	174.5	-66.7	179.4	0	0	0	110	I273 Y286 L291 L296 T297 K301	I273-L299 HydrophobicContact CD1-CD1 4.17Å; Y286-L299 HydrophobicContact CE1-CD2 4.22Å; Y286-L299 HydrophobicContact CE2-CD2 4.33Å; L291-L299 HydrophobicContact CD2-CD1 4.18Å; L291-L299 HydrophobicContact CD2-CD2 3.77Å; L296-L299 HydrophobicContact CD1-CD1 4.18Å; L296-L299 PolarHBondContact O-N 3.13Å; T297-L299 VanDerWaalsContact C-N 3.26Å; T297-L299 PolarHBondContact O-N 2.85Å; L299-K301 PolarHBondContact O-N 3.25Å
300	P	70.3	Confident	79.1	Confident	65 Å²	65	77 Å²	77	42%	0.422	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-64.2	128.8	-173.3	24.7	-32.7	0	0	0	110.8	R330	P300-R330 VanDerWaalsContact O-CB 3.23Å; P300-R330 WeakPolarHBondContact O-CB 3.45Å
301	K	72.9	Confident	78.8	Confident	117 Å²	117	78.4 Å²	78.4	51%	0.509	42%	0.415	S	S	.	.	B	Isolated β-bridge	trans	-78.2	154.7	-177.5	-63.3	173	-177.9	177.2	0	110.1	L299 L310 R330	L299-K301 PolarHBondContact O-N 3.25Å; K301-L310 HydrophobicContact CD-CD1 3.65Å; K301-L310 HydrophobicContact CG-CD1 4.33Å; K301-R330 PolarHBondContact O-NE 3.38Å
302	S	74.9	Confident	78.6	Confident	6 Å²	6	82 Å²	82	4%	0.042	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-91.7	126.8	173.2	179.5	0	0	0	0	109.7	K304 N305 F328 S336	S302-K304 PolarHBondContact O-N 2.78Å; S302-K304 VanDerWaalsContact O-N 3.09Å; S302-N305 PolarHBondContact O-N 3.27Å; S302-N305 PolarHBondContact O-ND2 2.9Å; S302-F328 VanDerWaalsContact CB-O 3.28Å; S302-F328 WeakPolarHBondContact CB-O 3.3Å; S302-F328 WeakPolarHBondContact OG-CB 3.41Å; S302-S336 WeakPolarHBondContact OG-CB 3.39Å; S302-S336 PolarHBondContact OG-OG 3.14Å
303	D	74.1	Confident	78.4	Confident	139 Å²	139	78.4 Å²	78.4	74%	0.743	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-5.4	179.9	-47.5	-52.7	0	0	0	113	N305 R330	D303-N305 VanDerWaalsContact C-N 3.31Å; D303-R330 IonicContact OD2-NH2 3.41Å; D303-R330 PolarHBondContact OD2-NH2 2.84Å
304	K	76	Confident	78.3	Confident	140 Å²	140	78.5 Å²	78.5	61%	0.609	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-9.2	177	-62.8	-173	177.6	-177.2	0	114.2	S302 F328	S302-K304 PolarHBondContact O-N 2.78Å; S302-K304 VanDerWaalsContact O-N 3.09Å; K304-F328 HydrophobicContact CB-CB 4.12Å; K304-F328 HydrophobicContact CB-CD1 4.39Å; K304-F328 HydrophobicContact CB-CD2 3.74Å; K304-F328 HydrophobicContact CB-CE2 4.25Å; K304-F328 HydrophobicContact CB-CG 3.82Å; K304-F328 HydrophobicContact CD-CD1 3.98Å; K304-F328 HydrophobicContact CD-CE1 4.12Å; K304-F328 HydrophobicContact CD-CG 4.26Å
305	N	80.8	Confident	78.2	Confident	35 Å²	35	77.6 Å²	77.6	19%	0.187	41%	0.408	C	S	.	.	S	Bend	trans	-87	153.5	178.2	-64.1	-41.2	0	0	0	111.1	S302 D303 L309 F328	S302-N305 PolarHBondContact O-N 3.27Å; S302-N305 PolarHBondContact O-ND2 2.9Å; D303-N305 VanDerWaalsContact C-N 3.31Å; N305-L309 HydrophobicContact CB-CD2 4.01Å; N305-F328 PolarHBondContact ND2-O 3.38Å; N305-F328 PolarHBondContact OD1-N 3.13Å
306	R	76.9	Confident	78.2	Confident	182 Å²	182	75.1 Å²	75.1	69%	0.687	40%	0.4	S	S	*	.			trans	-64.7	144.4	168.2	-59.4	171.4	54.5	116.3	-2.3	109.9	D308 L309	R306-D308 WeakPolarHBondContact CB-OD1 3.36Å; R306-D308 IonicContact CZ-OD1 3.68Å; R306-D308 IonicContact CZ-OD2 2.84Å; R306-D308 IonicContact NE-OD1 3.66Å; R306-D308 PolarHBondContact NE-OD1 3.18Å; R306-D308 IonicContact NE-OD2 2.95Å; R306-D308 IonicContact NH2-OD1 3.63Å; R306-D308 IonicContact NH2-OD2 3.44Å; R306-D308 PolarHBondContact NH2-OD2 2.94Å; R306-D308 PolarHBondContact O-N 2.86Å; R306-L309 HydrophobicContact CB-CB 4.49Å; R306-L309 WeakPolarHBondContact O-CB 3.34Å; R306-L309 PolarHBondContact O-N 2.92Å
307	A	72.1	Confident	78.6	Confident	104 Å²	104	72.6 Å²	72.6	86%	0.86	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.4	-177.8	0	0	0	0	0	113.2
308	D	78.2	Confident	78.9	Confident	68 Å²	68	76 Å²	76	36%	0.364	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-8.7	-178.3	58.2	-11.1	0	0	0	114.3	R306 T312	R306-D308 WeakPolarHBondContact CB-OD1 3.36Å; R306-D308 IonicContact CZ-OD1 3.68Å; R306-D308 IonicContact CZ-OD2 2.84Å; R306-D308 IonicContact NE-OD1 3.66Å; R306-D308 PolarHBondContact NE-OD1 3.18Å; R306-D308 IonicContact NE-OD2 2.95Å; R306-D308 IonicContact NH2-OD1 3.63Å; R306-D308 IonicContact NH2-OD2 3.44Å; R306-D308 PolarHBondContact NH2-OD2 2.94Å; R306-D308 PolarHBondContact O-N 2.86Å; D308-T312 WeakPolarHBondContact O-CB 3.38Å; D308-T312 PolarHBondContact O-N 3.23Å; D308-T312 PolarHBondContact O-OG1 2.79Å
309	L	79.7	Confident	79.4	Confident	34 Å²	34	77.2 Å²	77.2	18%	0.178	40%	0.399	C	S	.	.	H	α-helix	trans	-68.2	-44.6	-168.1	-177.1	60.5	0	0	0	113	N305 R306 T312 I313 W323	N305-L309 HydrophobicContact CB-CD2 4.01Å; R306-L309 HydrophobicContact CB-CB 4.49Å; R306-L309 WeakPolarHBondContact O-CB 3.34Å; R306-L309 PolarHBondContact O-N 2.92Å; L309-T312 WeakPolarHBondContact O-CB 3.41Å; L309-T312 PolarHBondContact O-N 3.29Å; L309-I313 HydrophobicContact CD1-CD1 4.44Å; L309-I313 HydrophobicContact CG-CD1 4.14Å; L309-I313 VanDerWaalsContact O-CG1 3.27Å; L309-I313 WeakPolarHBondContact O-CG1 3.47Å; L309-I313 PolarHBondContact O-N 3.01Å; L309-W323 HydrophobicContact CD1-CZ2 4.24Å
310	L	78.8	Confident	79.7	Confident	60 Å²	60	77.2 Å²	77.2	31%	0.314	41%	0.407	S	S	.	.	H	α-helix	trans	-68.2	-37.6	-179.5	-68.6	174.2	0	0	0	111.7	K301 T312 I313 N314	K301-L310 HydrophobicContact CD-CD1 3.65Å; K301-L310 HydrophobicContact CG-CD1 4.33Å; L310-T312 VanDerWaalsContact C-N 3.32Å; L310-I313 HydrophobicContact CD2-CD1 4.33Å; L310-I313 PolarHBondContact O-N 2.87Å; L310-N314 WeakPolarHBondContact O-CB 3.37Å; L310-N314 PolarHBondContact O-N 2.8Å; L310-N314 PolarHBondContact O-ND2 2.76Å
311	D	81.1	Confident	80.5	Confident	104 Å²	104	80.7 Å²	80.7	56%	0.556	42%	0.415	S	S	*	.	H	α-helix	trans	-66.7	-37.3	175.8	-65	-24.9	0	0	0	111.4	N314 T315	D311-N314 PolarHBondContact O-N 2.82Å; D311-T315 VanDerWaalsContact O-CB 3.24Å; D311-T315 WeakPolarHBondContact O-CB 3.5Å; D311-T315 PolarHBondContact O-N 3.09Å; D311-T315 PolarHBondContact O-OG1 3.39Å
312	T	83.6	Confident	81.3	Confident	75 Å²	75	80.1 Å²	80.1	46%	0.46	41%	0.414	S	S	.	.	H	α-helix	trans	-63.5	-44.1	173.4	-56.5	0	0	0	0	111.2	D308 L309 L310 C316	D308-T312 WeakPolarHBondContact O-CB 3.38Å; D308-T312 PolarHBondContact O-N 3.23Å; D308-T312 PolarHBondContact O-OG1 2.79Å; L309-T312 WeakPolarHBondContact O-CB 3.41Å; L309-T312 PolarHBondContact O-N 3.29Å; L310-T312 VanDerWaalsContact C-N 3.32Å; T312-C316 WeakPolarHBondContact O-CB 3.43Å; T312-C316 PolarHBondContact O-N 3.2Å
313	I	85.7	Confident	82.1	Confident	7 Å²	7	81.2 Å²	81.2	4%	0.036	42%	0.418	C	S	.	.	H	α-helix	trans	-60.3	-54	175.8	-69.2	162.2	0	0	0	110	L309 L310 T315 C316 I317 W323 Y327 I343	L309-I313 HydrophobicContact CD1-CD1 4.44Å; L309-I313 HydrophobicContact CG-CD1 4.14Å; L309-I313 VanDerWaalsContact O-CG1 3.27Å; L309-I313 WeakPolarHBondContact O-CG1 3.47Å; L309-I313 PolarHBondContact O-N 3.01Å; L310-I313 HydrophobicContact CD2-CD1 4.33Å; L310-I313 PolarHBondContact O-N 2.87Å; I313-T315 VanDerWaalsContact C-N 3.32Å; I313-T315 PolarHBondContact O-N 3.01Å; I313-C316 WeakPolarHBondContact O-CB 3.42Å; I313-C316 PolarHBondContact O-N 2.84Å; I313-C316 VanDerWaalsContact O-N 3.07Å; I313-I317 HydrophobicContact CG2-CD1 4.21Å; I313-I317 HydrophobicContact CG2-CG2 4.5Å; I313-I317 WeakPolarHBondContact O-CG1 2.95Å; I313-I317 PolarHBondContact O-N 2.82Å; I313-W323 HydrophobicContact CB-CD2 4.48Å; I313-W323 HydrophobicContact CD1-CD2 4.46Å; I313-W323 HydrophobicContact CD1-CE3 4.41Å; I313-W323 HydrophobicContact CD1-CH2 3.7Å; I313-W323 HydrophobicContact CD1-CZ2 3.75Å; I313-W323 HydrophobicContact CD1-CZ3 4.04Å; I313-W323 HydrophobicContact CG1-CD2 3.66Å; I313-W323 HydrophobicContact CG1-CE3 4.04Å; I313-W323 HydrophobicContact CG1-CG 4.23Å; I313-W323 HydrophobicContact CG1-CH2 3.89Å; I313-W323 HydrophobicContact CG1-CZ2 3.51Å; I313-W323 HydrophobicContact CG1-CZ3 4.14Å; I313-W323 HydrophobicContact CG2-CD2 4.41Å; I313-Y327 HydrophobicContact CD1-CD1 4.45Å; I313-I343 HydrophobicContact CG2-CD1 3.67Å
314	N	83.9	Confident	83	Confident	55 Å²	55	80.3 Å²	80.3	29%	0.294	41%	0.409	S	S	.	.	H	α-helix	trans	-60.5	-41.2	-178	-75.8	-21.5	0	0	0	112	L310 D311 C316 K318	L310-N314 WeakPolarHBondContact O-CB 3.37Å; L310-N314 PolarHBondContact O-N 2.8Å; L310-N314 PolarHBondContact O-ND2 2.76Å; D311-N314 PolarHBondContact O-N 2.82Å; N314-C316 VanDerWaalsContact C-N 3.33Å; N314-C316 PolarHBondContact O-N 2.83Å; N314-K318 WeakPolarHBondContact O-CB 3.38Å; N314-K318 WeakPolarHBondContact O-CG 3.07Å; N314-K318 PolarHBondContact O-N 2.88Å
315	T	85.4	Confident	83.6	Confident	74 Å²	74	74.6 Å²	74.6	45%	0.454	39%	0.389	S	S	.	.	H	α-helix	trans	-65.7	-37.1	176.1	-58.4	0	0	0	0	111.7	D311 I313 K319	D311-T315 VanDerWaalsContact O-CB 3.24Å; D311-T315 WeakPolarHBondContact O-CB 3.5Å; D311-T315 PolarHBondContact O-N 3.09Å; D311-T315 PolarHBondContact O-OG1 3.39Å; I313-T315 VanDerWaalsContact C-N 3.32Å; I313-T315 PolarHBondContact O-N 3.01Å; T315-K319 HydrophobicContact CG2-CD 4.33Å; T315-K319 WeakPolarHBondContact O-CD 3.47Å; T315-K319 VanDerWaalsContact O-CG 3.22Å; T315-K319 WeakPolarHBondContact O-CG 3.32Å; T315-K319 PolarHBondContact O-N 3.17Å
316	C	85.8	Confident	84	Confident	30 Å²	30	76.6 Å²	76.6	20%	0.203	40%	0.4	C	S	.	.	H	α-helix	trans	-67.8	-52.1	178.2	-166.3	0	0	0	0	111.2	T312 I313 N314 K319 K321 W323	T312-C316 WeakPolarHBondContact O-CB 3.43Å; T312-C316 PolarHBondContact O-N 3.2Å; I313-C316 WeakPolarHBondContact O-CB 3.42Å; I313-C316 PolarHBondContact O-N 2.84Å; I313-C316 VanDerWaalsContact O-N 3.07Å; N314-C316 VanDerWaalsContact C-N 3.33Å; N314-C316 PolarHBondContact O-N 2.83Å; C316-K319 PolarHBondContact O-N 2.87Å; C316-K321 PolarHBondContact O-N 3.39Å; C316-W323 HydrophobicContact CB-CB 4.25Å; C316-W323 HydrophobicContact CB-CG 4.48Å
317	I	86.8	Confident	84.5	Confident	4 Å²	4	69.3 Å²	69.3	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-71.9	-33.6	-175.2	68.5	-174.6	0	0	0	112.2	I313 K319 G320 W323 I343 I353 F356	I313-I317 HydrophobicContact CG2-CD1 4.21Å; I313-I317 HydrophobicContact CG2-CG2 4.5Å; I313-I317 WeakPolarHBondContact O-CG1 2.95Å; I313-I317 PolarHBondContact O-N 2.82Å; I317-K319 PolarHBondContact O-N 3.3Å; I317-G320 PolarHBondContact O-N 2.83Å; I317-W323 HydrophobicContact CG2-CB 3.89Å; I317-I343 HydrophobicContact CD1-CG2 4.31Å; I317-I343 HydrophobicContact CG2-CB 4.07Å; I317-I343 HydrophobicContact CG2-CG2 3.84Å; I317-I353 WeakPolarHBondContact O-CD1 3.34Å; I317-F356 HydrophobicContact CB-CD1 3.94Å; I317-F356 HydrophobicContact CB-CE1 3.68Å; I317-F356 HydrophobicContact CD1-CD1 3.96Å; I317-F356 HydrophobicContact CD1-CE1 3.95Å; I317-F356 HydrophobicContact CD1-CG 4.37Å; I317-F356 HydrophobicContact CD1-CZ 4.35Å; I317-F356 HydrophobicContact CG1-CD1 4.09Å; I317-F356 HydrophobicContact CG1-CE1 3.67Å; I317-F356 HydrophobicContact CG1-CZ 4.18Å
318	K	82.2	Confident	85.3	Confident	141 Å²	141	67 Å²	67	61%	0.613	34%	0.343	S	S	*	.	H	α-helix	trans	-65.2	-24.6	172.7	-75.9	-177.4	176.5	-172.7	0	113.3	N314 G320	N314-K318 WeakPolarHBondContact O-CB 3.38Å; N314-K318 WeakPolarHBondContact O-CG 3.07Å; N314-K318 PolarHBondContact O-N 2.88Å; K318-G320 PolarHBondContact O-N 3.39Å
319	K	83.1	Confident	85.7	Confident	148 Å²	148	64.3 Å²	64.3	64%	0.643	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	8.7	173.1	-71.3	175.3	-178.9	-178.1	0	112.9	T315 C316 I317 K321	T315-K319 HydrophobicContact CG2-CD 4.33Å; T315-K319 WeakPolarHBondContact O-CD 3.47Å; T315-K319 VanDerWaalsContact O-CG 3.22Å; T315-K319 WeakPolarHBondContact O-CG 3.32Å; T315-K319 PolarHBondContact O-N 3.17Å; C316-K319 PolarHBondContact O-N 2.87Å; I317-K319 PolarHBondContact O-N 3.3Å; K319-K321 HydrophobicContact CB-CG 4.5Å; K319-K321 PolarHBondContact O-N 3.29Å
320	G	81.8	Confident	86	Confident	34 Å²	34	66 Å²	66	35%	0.351	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	12.6	-178.3	0	0	0	0	0	114	I317 K318 P345	I317-G320 PolarHBondContact O-N 2.83Å; K318-G320 PolarHBondContact O-N 3.39Å; G320-P345 VanDerWaalsContact C-CG 3.45Å; G320-P345 WeakPolarHBondContact O-CG 3.5Å
321	K	86.1	Confident	86.4	Confident	137 Å²	137	66.2 Å²	66.2	60%	0.596	33%	0.332	S	S	*	.			trans	-94.1	143.8	179.3	-62.7	-171.4	179.3	-172.2	0	110.7	C316 K319	C316-K321 PolarHBondContact O-N 3.39Å; K319-K321 HydrophobicContact CB-CG 4.5Å; K319-K321 PolarHBondContact O-N 3.29Å
322	E	89.6	Confident	86.7	Confident	105 Å²	105	66.1 Å²	66.1	49%	0.491	33%	0.327	S	S	.	.			trans	-66.3	141.4	168.9	66.4	172.3	-160.8	0	0	110.3	K342 I343 L344	E322-K342 IonicContact OE1-NZ 3.26Å; E322-K342 WeakPolarHBondContact OE2-CE 3.12Å; E322-K342 IonicContact OE2-NZ 3.32Å; E322-K342 PolarHBondContact OE2-NZ 2.81Å; E322-I343 WeakPolarHBondContact CA-O 3.28Å; E322-L344 HydrophobicContact CB-CD2 3.79Å; E322-L344 WeakPolarHBondContact OE2-CD2 3.44Å
323	W	92.5	Very high	86.6	Confident	29 Å²	29	66.5 Å²	66.5	11%	0.11	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.2	172.3	-177.5	89	0	0	0	109.8	L309 I313 C316 I317 G325 Y327 V341 K342 I343	L309-W323 HydrophobicContact CD1-CZ2 4.24Å; I313-W323 HydrophobicContact CB-CD2 4.48Å; I313-W323 HydrophobicContact CD1-CD2 4.46Å; I313-W323 HydrophobicContact CD1-CE3 4.41Å; I313-W323 HydrophobicContact CD1-CH2 3.7Å; I313-W323 HydrophobicContact CD1-CZ2 3.75Å; I313-W323 HydrophobicContact CD1-CZ3 4.04Å; I313-W323 HydrophobicContact CG1-CD2 3.66Å; I313-W323 HydrophobicContact CG1-CE3 4.04Å; I313-W323 HydrophobicContact CG1-CG 4.23Å; I313-W323 HydrophobicContact CG1-CH2 3.89Å; I313-W323 HydrophobicContact CG1-CZ2 3.51Å; I313-W323 HydrophobicContact CG1-CZ3 4.14Å; I313-W323 HydrophobicContact CG2-CD2 4.41Å; C316-W323 HydrophobicContact CB-CB 4.25Å; C316-W323 HydrophobicContact CB-CG 4.48Å; I317-W323 HydrophobicContact CG2-CB 3.89Å; W323-G325 VanDerWaalsContact CH2-CA 3.49Å; W323-Y327 AromaticContact CH2-CD1 3.85Å; W323-Y327 HydrophobicContact CH2-CD1 3.85Å; W323-Y327 HydrophobicContact CH2-CE1 4.39Å; W323-Y327 HydrophobicContact CZ3-CD1 4.09Å; W323-Y327 HydrophobicContact CZ3-CE1 4.19Å; W323-V341 HydrophobicContact CZ3-CB 4.17Å; W323-V341 HydrophobicContact CZ3-CG1 4.44Å; W323-K342 CarbonylContact O-C 3.59Å; W323-K342 WeakPolarHBondContact O-CA 3.4Å; W323-I343 HydrophobicContact CE3-CD1 4.02Å; W323-I343 HydrophobicContact CE3-CG1 4.12Å; W323-I343 HydrophobicContact CZ3-CD1 4.46Å; W323-I343 PolarHBondContact N-O 3.47Å; W323-I343 PolarHBondContact O-N 2.89Å
324	Q	92.6	Very high	86.3	Confident	121 Å²	121	67.6 Å²	67.6	57%	0.565	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.1	174.7	-171	177.4	26.2	0	0	109.5	V341 K342	Q324-V341 WeakPolarHBondContact CA-O 3.47Å; Q324-K342 HydrophobicContact CG-CB 4.48Å
325	G	89.3	Confident	86.3	Confident	19 Å²	19	69.9 Å²	69.9	20%	0.196	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.9	-178.5	178.5	0	0	0	0	0	113.2	W323 V341	W323-G325 VanDerWaalsContact CH2-CA 3.49Å; G325-V341 PolarHBondContact N-O 2.75Å; G325-V341 PolarHBondContact O-N 3.39Å
326	I	89.2	Confident	86.3	Confident	78 Å²	78	68.3 Å²	68.3	40%	0.4	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.6	178.3	-59	171.4	0	0	0	107.8	Q338 Q339 Q340	I326-Q338 HydrophobicContact CG2-CG 3.44Å; I326-Q338 VanDerWaalsContact CG2-CG 3.44Å; I326-Q339 WeakPolarHBondContact CA-O 3.31Å; I326-Q340 HydrophobicContact CG1-CB 4.19Å; I326-Q340 HydrophobicContact CG1-CG 4.2Å
327	Y	87.8	Confident	86.4	Confident	28 Å²	28	68.1 Å²	68.1	11%	0.11	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	161.9	174.5	73.3	-94.6	0	0	0	111.5	I313 W323 A329 Q339 V341	I313-Y327 HydrophobicContact CD1-CD1 4.45Å; W323-Y327 AromaticContact CH2-CD1 3.85Å; W323-Y327 HydrophobicContact CH2-CD1 3.85Å; W323-Y327 HydrophobicContact CH2-CE1 4.39Å; W323-Y327 HydrophobicContact CZ3-CD1 4.09Å; W323-Y327 HydrophobicContact CZ3-CE1 4.19Å; Y327-A329 HydrophobicContact CE2-CB 4.26Å; Y327-Q339 PolarHBondContact N-O 3.24Å; Y327-Q339 VanDerWaalsContact O-CG 3.23Å; Y327-Q339 WeakPolarHBondContact O-CG 3.34Å; Y327-Q339 PolarHBondContact O-N 2.92Å; Y327-Q339 PolarHBondContact OH-NE2 2.9Å; Y327-V341 HydrophobicContact CD1-CB 4.25Å; Y327-V341 HydrophobicContact CD1-CG2 4.02Å; Y327-V341 HydrophobicContact CE1-CB 3.68Å; Y327-V341 HydrophobicContact CE1-CG1 4.01Å; Y327-V341 HydrophobicContact CE1-CG2 3.43Å; Y327-V341 VanDerWaalsContact CE1-CG2 3.43Å
328	F	88.1	Confident	86.5	Confident	55 Å²	55	70.4 Å²	70.4	24%	0.241	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	129.1	177.3	-66.7	-90.4	0	0	0	110.6	S302 K304 N305 I337 Q338	S302-F328 VanDerWaalsContact CB-O 3.28Å; S302-F328 WeakPolarHBondContact CB-O 3.3Å; S302-F328 WeakPolarHBondContact OG-CB 3.41Å; K304-F328 HydrophobicContact CB-CB 4.12Å; K304-F328 HydrophobicContact CB-CD1 4.39Å; K304-F328 HydrophobicContact CB-CD2 3.74Å; K304-F328 HydrophobicContact CB-CE2 4.25Å; K304-F328 HydrophobicContact CB-CG 3.82Å; K304-F328 HydrophobicContact CD-CD1 3.98Å; K304-F328 HydrophobicContact CD-CE1 4.12Å; K304-F328 HydrophobicContact CD-CG 4.26Å; N305-F328 PolarHBondContact ND2-O 3.38Å; N305-F328 PolarHBondContact OD1-N 3.13Å; F328-I337 CarbonylContact C-O 3.54Å; F328-I337 VanDerWaalsContact CA-O 3.27Å; F328-I337 WeakPolarHBondContact CA-O 3.42Å; F328-Q338 HydrophobicContact CD1-CB 3.95Å; F328-Q338 HydrophobicContact CD1-CG 4.45Å; F328-Q338 HydrophobicContact CE1-CB 3.67Å; F328-Q338 HydrophobicContact CE1-CG 4.06Å; F328-Q338 HydrophobicContact CZ-CB 4.25Å; F328-Q338 HydrophobicContact CZ-CG 4.13Å
329	A	86.4	Confident	86.9	Confident	12 Å²	12	63.8 Å²	63.8	10%	0.099	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	156.2	167.6	0	0	0	0	0	110.8	M284 Y327 S336 I337 Q339	M284-A329 HydrophobicContact CE-CB 3.79Å; M284-A329 HydrophobicContact SD-CB 4.28Å; Y327-A329 HydrophobicContact CE2-CB 4.26Å; A329-S336 CarbonylContact O-C 3.53Å; A329-S336 VanDerWaalsContact O-CA 3.31Å; A329-S336 WeakPolarHBondContact O-CA 3.49Å; A329-I337 PolarHBondContact N-O 3.26Å; A329-I337 PolarHBondContact O-N 2.95Å; A329-Q339 HydrophobicContact CB-CG 4.39Å
330	R	86.5	Confident	87.2	Confident	70 Å²	70	60.1 Å²	60.1	26%	0.264	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.2	177.6	-163.3	-179.8	-77.4	-101.7	10.3	109.8	M284 P300 K301 D303 G334	M284-R330 VanDerWaalsContact CE-O 3.31Å; M284-R330 WeakPolarHBondContact CE-O 3.46Å; P300-R330 VanDerWaalsContact O-CB 3.23Å; P300-R330 WeakPolarHBondContact O-CB 3.45Å; K301-R330 PolarHBondContact O-NE 3.38Å; D303-R330 IonicContact OD2-NH2 3.41Å; D303-R330 PolarHBondContact OD2-NH2 2.84Å; R330-G334 WeakPolarHBondContact CG-O 3.23Å; R330-G334 PolarHBondContact NH1-O 2.84Å
331	K	87.4	Confident	87.8	Confident	64 Å²	64	58.6 Å²	58.6	28%	0.278	30%	0.298	S	S	.	.			trans	-72.2	165.2	173.6	-65.4	-170.7	179.3	-170.7	0	111	M283 M284 S333 G334 D335 I337	M283-K331 VanDerWaalsContact O-CE 3.22Å; M283-K331 WeakPolarHBondContact O-CE 3.31Å; M284-K331 WeakPolarHBondContact O-CA 3.41Å; K331-S333 PolarHBondContact O-N 2.91Å; K331-G334 PolarHBondContact O-N 2.88Å; K331-D335 PolarHBondContact N-O 3.45Å; K331-I337 VanDerWaalsContact CE-CD1 3.47Å; K331-I337 HydrophobicContact CG-CB 4.39Å; K331-I337 HydrophobicContact CG-CG2 3.89Å
332	K	86.3	Confident	88.2	Confident	102 Å²	102	55 Å²	55	44%	0.443	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.2	170.9	-167.4	176.7	-172.8	173.4	0	113	M284 G285 Y286 E290 G334	M284-K332 PolarHBondContact O-N 3.09Å; G285-K332 WeakPolarHBondContact O-CD 3.22Å; Y286-K332 HydrophobicContact CD1-CB 4.11Å; Y286-K332 HydrophobicContact CD1-CD 3.93Å; Y286-K332 HydrophobicContact CD1-CG 4.07Å; Y286-K332 HydrophobicContact CD2-CB 4.15Å; Y286-K332 HydrophobicContact CE1-CB 3.9Å; Y286-K332 HydrophobicContact CE1-CD 4.21Å; Y286-K332 HydrophobicContact CE1-CG 3.84Å; Y286-K332 HydrophobicContact CE2-CB 3.95Å; Y286-K332 HydrophobicContact CG-CB 4.23Å; Y286-K332 HydrophobicContact CG-CD 4.43Å; E290-K332 IonicContact OE1-NZ 2.64Å; E290-K332 PolarHBondContact OE1-NZ 2.97Å; E290-K332 IonicContact OE2-NZ 2.87Å; E290-K332 PolarHBondContact OE2-NZ 2.94Å; K332-G334 PolarHBondContact O-N 3.07Å
333	S	83.3	Confident	88.4	Confident	84 Å²	84	50.8 Å²	50.8	59%	0.587	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-12.5	174.5	62.5	0	0	0	0	114	K331 D335	K331-S333 PolarHBondContact O-N 2.91Å; S333-D335 PolarHBondContact OG-OD2 3.2Å
334	G	78.2	Confident	88.4	Confident	30 Å²	30	52 Å²	52	31%	0.309	27%	0.271	S	S	.	.	S	Bend	trans	95.5	-12.3	-174.9	0	0	0	0	0	114.3	R330 K331 K332	R330-G334 WeakPolarHBondContact CG-O 3.23Å; R330-G334 PolarHBondContact NH1-O 2.84Å; K331-G334 PolarHBondContact O-N 2.88Å; K332-G334 PolarHBondContact O-N 3.07Å
335	D	84.3	Confident	88.4	Confident	103 Å²	103	47.3 Å²	47.3	55%	0.551	25%	0.251	S	S	*	.			trans	-74.2	141.9	-180	-57.5	-52.9	0	0	0	112.5	K331 S333	K331-D335 PolarHBondContact N-O 3.45Å; S333-D335 PolarHBondContact OG-OD2 3.2Å
336	S	86	Confident	88.4	Confident	40 Å²	40	49.2 Å²	49.2	28%	0.28	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	124.1	171.8	-61.3	0	0	0	0	111.1	S302 A329	S302-S336 WeakPolarHBondContact OG-CB 3.39Å; S302-S336 PolarHBondContact OG-OG 3.14Å; A329-S336 CarbonylContact O-C 3.53Å; A329-S336 VanDerWaalsContact O-CA 3.31Å; A329-S336 WeakPolarHBondContact O-CA 3.49Å
337	I	86.9	Confident	88.1	Confident	27 Å²	27	50.3 Å²	50.3	14%	0.138	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	134.9	172	-176.2	164.1	0	0	0	110.6	M283 M284 F328 A329 K331 A362	M283-I337 HydrophobicContact CG-CD1 4.36Å; M284-I337 HydrophobicContact SD-CG2 4.26Å; F328-I337 CarbonylContact C-O 3.54Å; F328-I337 VanDerWaalsContact CA-O 3.27Å; F328-I337 WeakPolarHBondContact CA-O 3.42Å; A329-I337 PolarHBondContact N-O 3.26Å; A329-I337 PolarHBondContact O-N 2.95Å; K331-I337 VanDerWaalsContact CE-CD1 3.47Å; K331-I337 HydrophobicContact CG-CB 4.39Å; K331-I337 HydrophobicContact CG-CG2 3.89Å; I337-A362 HydrophobicContact CD1-CB 3.92Å
338	Q	88.8	Confident	87.4	Confident	52 Å²	52	50.4 Å²	50.4	24%	0.243	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.1	169.4	-167	179.6	13.9	0	0	109	I326 F328 H363	I326-Q338 HydrophobicContact CG2-CG 3.44Å; I326-Q338 VanDerWaalsContact CG2-CG 3.44Å; F328-Q338 HydrophobicContact CD1-CB 3.95Å; F328-Q338 HydrophobicContact CD1-CG 4.45Å; F328-Q338 HydrophobicContact CE1-CB 3.67Å; F328-Q338 HydrophobicContact CE1-CG 4.06Å; F328-Q338 HydrophobicContact CZ-CB 4.25Å; F328-Q338 HydrophobicContact CZ-CG 4.13Å; Q338-H363 HydrophobicContact CB-CB 4.16Å; Q338-H363 HydrophobicContact CG-CB 3.97Å; Q338-H363 PolarHBondContact O-N 3.46Å; Q338-H363 PolarHBondContact OE1-ND1 3.26Å
339	Q	90.3	Very high	86.2	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.009	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	137.5	179.7	52.4	174.7	4.8	0	0	110.9	I326 Y327 A329 V341 R361	I326-Q339 WeakPolarHBondContact CA-O 3.31Å; Y327-Q339 PolarHBondContact N-O 3.24Å; Y327-Q339 VanDerWaalsContact O-CG 3.23Å; Y327-Q339 WeakPolarHBondContact O-CG 3.34Å; Y327-Q339 PolarHBondContact O-N 2.92Å; Y327-Q339 PolarHBondContact OH-NE2 2.9Å; A329-Q339 HydrophobicContact CB-CG 4.39Å; Q339-V341 HydrophobicContact CB-CG2 4.13Å; Q339-V341 HydrophobicContact CG-CG2 3.72Å; Q339-R361 CarbonylContact C-O 3.26Å; Q339-R361 WeakPolarHBondContact CA-O 3.47Å
340	Q	91.1	Very high	84.8	Confident	71 Å²	71	58.7 Å²	58.7	33%	0.332	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	124.7	166.9	-174.5	178.2	8.2	0	0	107.8	I326 K360 R361	I326-Q340 HydrophobicContact CG1-CB 4.19Å; I326-Q340 HydrophobicContact CG1-CG 4.2Å; Q340-K360 WeakPolarHBondContact O-CA 3.42Å; Q340-R361 PolarHBondContact N-O 3.49Å; Q340-R361 PolarHBondContact O-N 2.78Å
341	V	93.1	Very high	84.2	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	135	-172.4	-179.5	0	0	0	0	110	W323 Q324 G325 Y327 Q339 I343 I359 K360	W323-V341 HydrophobicContact CZ3-CB 4.17Å; W323-V341 HydrophobicContact CZ3-CG1 4.44Å; Q324-V341 WeakPolarHBondContact CA-O 3.47Å; G325-V341 PolarHBondContact N-O 2.75Å; G325-V341 PolarHBondContact O-N 3.39Å; Y327-V341 HydrophobicContact CD1-CB 4.25Å; Y327-V341 HydrophobicContact CD1-CG2 4.02Å; Y327-V341 HydrophobicContact CE1-CB 3.68Å; Y327-V341 HydrophobicContact CE1-CG1 4.01Å; Y327-V341 HydrophobicContact CE1-CG2 3.43Å; Y327-V341 VanDerWaalsContact CE1-CG2 3.43Å; Q339-V341 HydrophobicContact CB-CG2 4.13Å; Q339-V341 HydrophobicContact CG-CG2 3.72Å; V341-I343 HydrophobicContact CG1-CD1 4.15Å; V341-I343 HydrophobicContact CG1-CG1 3.66Å; V341-I359 WeakPolarHBondContact CA-O 3.23Å; V341-K360 HydrophobicContact CB-CG 4.44Å; V341-K360 HydrophobicContact CG1-CG 3.98Å; V341-K360 HydrophobicContact CG2-CB 4.1Å; V341-K360 HydrophobicContact CG2-CD 4.34Å; V341-K360 HydrophobicContact CG2-CG 3.84Å
342	K	94.5	Very high	83.7	Confident	63 Å²	63	59.6 Å²	59.6	27%	0.274	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.2	168.1	-174.7	171.7	-179	170.7	0	108.5	E322 W323 Q324 L344 A358 I359	E322-K342 IonicContact OE1-NZ 3.26Å; E322-K342 WeakPolarHBondContact OE2-CE 3.12Å; E322-K342 IonicContact OE2-NZ 3.32Å; E322-K342 PolarHBondContact OE2-NZ 2.81Å; W323-K342 CarbonylContact O-C 3.59Å; W323-K342 WeakPolarHBondContact O-CA 3.4Å; Q324-K342 HydrophobicContact CG-CB 4.48Å; K342-L344 HydrophobicContact CG-CG 4.42Å; K342-A358 CarbonylContact O-C 3.58Å; K342-A358 WeakPolarHBondContact O-CA 3.22Å; K342-I359 PolarHBondContact N-O 2.77Å; K342-I359 PolarHBondContact O-N 3.07Å
343	I	93.8	Very high	83.7	Confident	16 Å²	16	56.1 Å²	56.1	8%	0.082	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.8	-179.4	-49.6	178.6	0	0	0	108.7	I313 I317 E322 W323 V341 F356 V357 A358	I313-I343 HydrophobicContact CG2-CD1 3.67Å; I317-I343 HydrophobicContact CD1-CG2 4.31Å; I317-I343 HydrophobicContact CG2-CB 4.07Å; I317-I343 HydrophobicContact CG2-CG2 3.84Å; E322-I343 WeakPolarHBondContact CA-O 3.28Å; W323-I343 HydrophobicContact CE3-CD1 4.02Å; W323-I343 HydrophobicContact CE3-CG1 4.12Å; W323-I343 HydrophobicContact CZ3-CD1 4.46Å; W323-I343 PolarHBondContact N-O 3.47Å; W323-I343 PolarHBondContact O-N 2.89Å; V341-I343 HydrophobicContact CG1-CD1 4.15Å; V341-I343 HydrophobicContact CG1-CG1 3.66Å; I343-F356 HydrophobicContact CG2-CB 4.2Å; I343-V357 WeakPolarHBondContact CA-O 3.48Å; I343-A358 HydrophobicContact CG1-CB 4.12Å
344	L	93.8	Very high	83.9	Confident	55 Å²	55	55.5 Å²	55.5	29%	0.288	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.6	-174.9	-71.6	157.9	0	0	0	109	E322 K342 F356 V357	E322-L344 HydrophobicContact CB-CD2 3.79Å; E322-L344 WeakPolarHBondContact OE2-CD2 3.44Å; K342-L344 HydrophobicContact CG-CG 4.42Å; L344-F356 WeakPolarHBondContact O-CA 3.47Å; L344-V357 HydrophobicContact CB-CB 4.46Å; L344-V357 PolarHBondContact N-O 3.07Å; L344-V357 PolarHBondContact O-N 2.98Å
345	P	92.4	Very high	84.5	Confident	22 Å²	22	57.3 Å²	57.3	14%	0.143	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	131.4	169.5	27.4	-29.4	0	0	0	110	G320 I353 F356	G320-P345 VanDerWaalsContact C-CG 3.45Å; G320-P345 WeakPolarHBondContact O-CG 3.5Å; P345-I353 HydrophobicContact CB-CB 4.49Å; P345-I353 HydrophobicContact CB-CD1 3.81Å; P345-I353 HydrophobicContact CB-CG1 4.02Å; P345-I353 HydrophobicContact CB-CG2 3.68Å; P345-F356 HydrophobicContact CB-CD1 4.02Å; P345-F356 HydrophobicContact CB-CE1 4.01Å
346	V	89.4	Confident	85	Confident	58 Å²	58	52.9 Å²	52.9	35%	0.352	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	113.4	174.7	-178.9	0	0	0	0	108.2	I353 R354 H355 V357	V346-I353 WeakPolarHBondContact O-CA 3.34Å; V346-R354 PolarHBondContact O-N 3.09Å; V346-H355 HydrophobicContact CB-CB 4.11Å; V346-H355 HydrophobicContact CG2-CB 4.43Å; V346-H355 PolarHBondContact N-O 3.39Å; V346-H355 PolarHBondContact O-N 3.04Å; V346-V357 HydrophobicContact CG2-CB 4.44Å; V346-V357 HydrophobicContact CG2-CG2 3.49Å; V346-V357 VanDerWaalsContact CG2-CG2 3.49Å
347	I	81.8	Confident	85.4	Confident	102 Å²	102	52.4 Å²	52.4	52%	0.523	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.9	179.8	-58	176.4	0	0	0	108.2	G351 K352	I347-G351 VanDerWaalsContact CG2-C 3.42Å; I347-G351 VanDerWaalsContact CG2-CA 3.46Å; I347-G351 WeakPolarHBondContact CG2-O 3.13Å; I347-K352 CarbonylContact C-O 3.51Å; I347-K352 WeakPolarHBondContact CA-O 3.29Å
348	G	72.6	Confident	85.7	Confident	29 Å²	29	51.3 Å²	51.3	30%	0.299	29%	0.285	S	S	.	.			trans	-89.8	-163.6	173.5	0	0	0	0	0	112.2	G350 G351 K352	G348-G350 PolarHBondContact O-N 2.95Å; G348-G351 PolarHBondContact O-N 2.99Å; G348-K352 PolarHBondContact N-O 3.33Å
349	Q	63.8	Low	86	Confident	179 Å²	179	51.3 Å²	51.3	84%	0.836	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-58.2	137	177.9	-171.9	175.2	-8.4	0	0	111.4
350	G	57.3	Low	86.1	Confident	62 Å²	62	51.6 Å²	51.6	64%	0.639	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	74.6	23.4	-179.8	0	0	0	0	0	114.7	G348 K352	G348-G350 PolarHBondContact O-N 2.95Å; G350-K352 PolarHBondContact O-N 3.12Å; G350-K352 VanDerWaalsContact O-N 3.08Å
351	G	72.9	Confident	86.1	Confident	49 Å²	49	55 Å²	55	51%	0.505	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	74	-0.1	173.8	0	0	0	0	0	115.2	I347 G348	I347-G351 VanDerWaalsContact CG2-C 3.42Å; I347-G351 VanDerWaalsContact CG2-CA 3.46Å; I347-G351 WeakPolarHBondContact CG2-O 3.13Å; G348-G351 PolarHBondContact O-N 2.99Å
352	K	78.1	Confident	85.7	Confident	105 Å²	105	57.1 Å²	57.1	46%	0.457	31%	0.314	S	S	.	.			trans	-79.9	140.3	179.6	-67.2	-178.7	-179.2	173.4	0	111.3	I347 G348 G350 R354	I347-K352 CarbonylContact C-O 3.51Å; I347-K352 WeakPolarHBondContact CA-O 3.29Å; G348-K352 PolarHBondContact N-O 3.33Å; G350-K352 PolarHBondContact O-N 3.12Å; G350-K352 VanDerWaalsContact O-N 3.08Å; K352-R354 PolarHBondContact O-N 3.39Å
353	I	85.5	Confident	84.9	Confident	28 Å²	28	57.2 Å²	57.2	14%	0.144	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	118.2	173.3	-55.1	170.3	0	0	0	108.1	I317 P345 V346 H355 F356	I317-I353 WeakPolarHBondContact O-CD1 3.34Å; P345-I353 HydrophobicContact CB-CB 4.49Å; P345-I353 HydrophobicContact CB-CD1 3.81Å; P345-I353 HydrophobicContact CB-CG1 4.02Å; P345-I353 HydrophobicContact CB-CG2 3.68Å; V346-I353 WeakPolarHBondContact O-CA 3.34Å; I353-H355 WeakPolarHBondContact CG2-O 3.47Å; I353-F356 HydrophobicContact CD1-CE1 4.38Å; I353-F356 HydrophobicContact CG2-CD1 4.12Å; I353-F356 HydrophobicContact CG2-CE1 3.62Å; I353-F356 HydrophobicContact CG2-CE2 4.42Å; I353-F356 HydrophobicContact CG2-CZ 3.79Å
354	R	87.4	Confident	83.5	Confident	71 Å²	71	62 Å²	62	27%	0.268	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-30.5	179.7	-70.3	-58.8	-169.2	174.9	3.2	113.2	S268 E269 V346 K352	S268-R354 CarbonylContact C-O 3.56Å; E269-R354 PolarHBondContact N-O 2.98Å; E269-R354 VanDerWaalsContact N-O 3.09Å; E269-R354 IonicContact OE1-NH1 3.74Å; E269-R354 PolarHBondContact OE1-NH1 3.13Å; E269-R354 IonicContact OE2-NH1 3.02Å; V346-R354 PolarHBondContact O-N 3.09Å; K352-R354 PolarHBondContact O-N 3.39Å
355	H	91.9	Very high	81.3	Confident	69 Å²	69	65.3 Å²	65.3	32%	0.319	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	157.4	-178.8	-49.9	-79.8	0	0	0	110.7	I266 T267 Q274 V346 I353	I266-H355 HydrophobicContact CG2-CB 4.01Å; T267-H355 CarbonylContact O-C 3.58Å; T267-H355 WeakPolarHBondContact O-CA 3.22Å; T267-H355 WeakPolarHBondContact O-CB 3.28Å; Q274-H355 PolarHBondContact OE1-CE1 3.29Å; Q274-H355 VanDerWaalsContact OE1-CE1 3.27Å; Q274-H355 PolarHBondContact OE1-ND1 2.63Å; V346-H355 HydrophobicContact CB-CB 4.11Å; V346-H355 HydrophobicContact CG2-CB 4.43Å; V346-H355 PolarHBondContact N-O 3.39Å; V346-H355 PolarHBondContact O-N 3.04Å; I353-H355 WeakPolarHBondContact CG2-O 3.47Å
356	F	93.1	Very high	78.9	Confident	10 Å²	10	69.6 Å²	69.6	4%	0.044	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.5	164.9	-58.2	-79.6	0	0	0	108.8	I266 T267 S268 H271 I317 I343 L344 P345 I353	I266-F356 VanDerWaalsContact CA-O 3.3Å; I266-F356 WeakPolarHBondContact CA-O 3.49Å; T267-F356 PolarHBondContact N-O 3.4Å; T267-F356 PolarHBondContact O-N 3.44Å; S268-F356 WeakPolarHBondContact O-CD2 3.33Å; H271-F356 AromaticContact CE1-CD2 3.92Å; H271-F356 AromaticContact CE1-CE2 3.54Å; H271-F356 AromaticContact ND1-CD2 3.85Å; H271-F356 AromaticContact ND1-CE2 3.86Å; I317-F356 HydrophobicContact CB-CD1 3.94Å; I317-F356 HydrophobicContact CB-CE1 3.68Å; I317-F356 HydrophobicContact CD1-CD1 3.96Å; I317-F356 HydrophobicContact CD1-CE1 3.95Å; I317-F356 HydrophobicContact CD1-CG 4.37Å; I317-F356 HydrophobicContact CD1-CZ 4.35Å; I317-F356 HydrophobicContact CG1-CD1 4.09Å; I317-F356 HydrophobicContact CG1-CE1 3.67Å; I317-F356 HydrophobicContact CG1-CZ 4.18Å; I343-F356 HydrophobicContact CG2-CB 4.2Å; L344-F356 WeakPolarHBondContact O-CA 3.47Å; P345-F356 HydrophobicContact CB-CD1 4.02Å; P345-F356 HydrophobicContact CB-CE1 4.01Å; I353-F356 HydrophobicContact CD1-CE1 4.38Å; I353-F356 HydrophobicContact CG2-CD1 4.12Å; I353-F356 HydrophobicContact CG2-CE1 3.62Å; I353-F356 HydrophobicContact CG2-CE2 4.42Å; I353-F356 HydrophobicContact CG2-CZ 3.79Å
357	V	95	Very high	76.5	Confident	29 Å²	29	73.8 Å²	73.8	18%	0.176	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	114.4	174.6	178.3	0	0	0	0	108.1	V264 I266 I343 L344 V346 I359	V264-V357 HydrophobicContact CG1-CG1 4.37Å; I266-V357 HydrophobicContact CD1-CG2 4.48Å; I266-V357 HydrophobicContact CG1-CG2 4.18Å; I266-V357 HydrophobicContact CG2-CG2 4.39Å; I343-V357 WeakPolarHBondContact CA-O 3.48Å; L344-V357 HydrophobicContact CB-CB 4.46Å; L344-V357 PolarHBondContact N-O 3.07Å; L344-V357 PolarHBondContact O-N 2.98Å; V346-V357 HydrophobicContact CG2-CB 4.44Å; V346-V357 HydrophobicContact CG2-CG2 3.49Å; V346-V357 VanDerWaalsContact CG2-CG2 3.49Å; V357-I359 HydrophobicContact CG1-CG1 4.41Å
358	A	93.8	Very high	74.4	Confident	5 Å²	5	75.8 Å²	75.8	4%	0.041	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.7	176	0	0	0	0	0	110.4	V264 E265 K342 I343	V264-A358 WeakPolarHBondContact CA-O 3.41Å; E265-A358 HydrophobicContact CB-CB 4.35Å; E265-A358 PolarHBondContact N-O 2.97Å; E265-A358 PolarHBondContact O-N 2.95Å; K342-A358 CarbonylContact O-C 3.58Å; K342-A358 WeakPolarHBondContact O-CA 3.22Å; I343-A358 HydrophobicContact CG1-CB 4.12Å
359	I	94.7	Very high	72.6	Confident	51 Å²	51	82.4 Å²	82.4	26%	0.262	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.8	173	-55.1	175.7	0	0	0	107.7	E262 V341 K342 V357	E262-I359 HydrophobicContact CB-CG2 3.95Å; E262-I359 WeakPolarHBondContact OE2-CG2 3.39Å; V341-I359 WeakPolarHBondContact CA-O 3.23Å; K342-I359 PolarHBondContact N-O 2.77Å; K342-I359 PolarHBondContact O-N 3.07Å; V357-I359 HydrophobicContact CG1-CG1 4.41Å
360	K	93.1	Very high	71.1	Confident	9 Å²	9	78.8 Å²	78.8	4%	0.039	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134.7	-170.2	-48.4	-178	-173.4	-179	0	109.9	A263 E265 F280 M283 Q340 V341	A263-K360 HydrophobicContact CB-CB 4.06Å; A263-K360 WeakPolarHBondContact CB-O 3.44Å; A263-K360 PolarHBondContact N-O 3.31Å; A263-K360 PolarHBondContact O-N 2.88Å; E265-K360 IonicContact OE1-NZ 3.73Å; E265-K360 PolarHBondContact OE1-NZ 2.59Å; E265-K360 IonicContact OE2-NZ 3.37Å; E265-K360 PolarHBondContact OE2-NZ 3.41Å; F280-K360 HydrophobicContact CD2-CD 4.28Å; F280-K360 HydrophobicContact CE2-CD 3.91Å; M283-K360 HydrophobicContact CE-CB 3.73Å; M283-K360 HydrophobicContact CE-CD 4.27Å; M283-K360 HydrophobicContact SD-CB 4.49Å; Q340-K360 WeakPolarHBondContact O-CA 3.42Å; V341-K360 HydrophobicContact CB-CG 4.44Å; V341-K360 HydrophobicContact CG1-CG 3.98Å; V341-K360 HydrophobicContact CG2-CB 4.1Å; V341-K360 HydrophobicContact CG2-CD 4.34Å; V341-K360 HydrophobicContact CG2-CG 3.84Å
361	R	90.9	Very high	70	Confident	142 Å²	142	83.3 Å²	83.3	54%	0.536	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.8	175.4	-167.6	-176	-67.1	172.1	-5.5	109.5	E262 Q339 Q340 H363	E262-R361 IonicContact OE1-CZ 3.29Å; E262-R361 IonicContact OE1-NE 2.89Å; E262-R361 PolarHBondContact OE1-NE 3.37Å; E262-R361 IonicContact OE1-NH2 3.41Å; E262-R361 PolarHBondContact OE1-NH2 3.29Å; Q339-R361 CarbonylContact C-O 3.26Å; Q339-R361 WeakPolarHBondContact CA-O 3.47Å; Q340-R361 PolarHBondContact N-O 3.49Å; Q340-R361 PolarHBondContact O-N 2.78Å; R361-H363 PolarHBondContact O-N 3.08Å
362	A	84.9	Confident	68.1	Low	45 Å²	45	90.5 Å²	90.5	37%	0.372	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	128.8	173.5	0	0	0	0	0	110.1	M283 I337 T364	M283-A362 HydrophobicContact SD-CB 4.38Å; I337-A362 HydrophobicContact CD1-CB 3.92Å; A362-T364 PolarHBondContact O-N 3.04Å
363	H	77.4	Confident	65.8	Low	66 Å²	66	93.3 Å²	93.3	31%	0.306	47%	0.473	S	S	.	.			trans	-90.3	101.8	175.6	-171.5	-85	0	0	0	109	Q338 R361 D365	Q338-H363 HydrophobicContact CB-CB 4.16Å; Q338-H363 HydrophobicContact CG-CB 3.97Å; Q338-H363 PolarHBondContact O-N 3.46Å; Q338-H363 PolarHBondContact OE1-ND1 3.26Å; R361-H363 PolarHBondContact O-N 3.08Å; H363-D365 IonicContact CE1-OD1 3.37Å; H363-D365 PolarHBondContact CE1-OD1 3.44Å; H363-D365 VanDerWaalsContact CE1-OD1 3.29Å; H363-D365 IonicContact ND1-OD1 2.54Å
364	T	63.9	Low	63.1	Low	115 Å²	115	99 Å²	99	71%	0.706	50%	0.504	S	S	*	.			trans	-92.7	116.4	168.9	21.5	0	0	0	0	109.3	A362 N366	A362-T364 PolarHBondContact O-N 3.04Å; T364-N366 PolarHBondContact O-N 2.95Å
365	D	48.5	Very low	60.5	Low	126 Å²	126	105 Å²	105	67%	0.674	53%	0.532	S	S	*	.			trans	-60.8	105.4	167.8	-83.6	-23.4	0	0	0	108.9	H363 N367	H363-D365 IonicContact CE1-OD1 3.37Å; H363-D365 PolarHBondContact CE1-OD1 3.44Å; H363-D365 VanDerWaalsContact CE1-OD1 3.29Å; H363-D365 IonicContact ND1-OD1 2.54Å; D365-N367 PolarHBondContact O-N 3.01Å
366	N	40.5	Very low	57.6	Low	112 Å²	112	110 Å²	110	60%	0.599	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	43	-175.4	-131.6	16	0	0	0	112.2	T364	T364-N366 PolarHBondContact O-N 2.95Å
367	N	39.3	Very low	54.5	Low	146 Å²	146	116.9 Å²	116.9	78%	0.781	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	3.1	176	-110.4	12.5	0	0	0	114.3	D365	D365-N367 PolarHBondContact O-N 3.01Å
368	N	37.5	Very low	51.4	Low	144 Å²	144	127 Å²	127	77%	0.77	63%	0.628	S	S	*	*	S	Bend	trans	-130.2	11.4	180	-88.5	-16.8	0	0	0	116.2
369	Q	34.8	Very low	48.2	Very low	168 Å²	168	132.2 Å²	132.2	79%	0.785	66%	0.663	S	S	*	*	S	Bend	trans	-115.3	9.3	173.2	-80.2	-171.8	18.3	0	0	115.3
370	V	33.7	Very low	45	Very low	102 Å²	102	135.4 Å²	135.4	62%	0.618	69%	0.69	S	S	*	*	S	Bend	trans	-96.6	-4.5	174	-178.4	0	0	0	0	112.8	K372	V370-K372 PolarHBondContact O-N 3.42Å
371	L	33.8	Very low	41.8	Very low	157 Å²	157	138.6 Å²	138.6	82%	0.822	73%	0.725	S	S	*	*	S	Bend	trans	-89.5	11.4	-178.6	-80.8	163.3	0	0	0	115.5
372	K	33.3	Very low	38.8	Very low	201 Å²	201	138.2 Å²	138.2	87%	0.874	73%	0.734	S	S	*	*	S	Bend	trans	-127.1	-1.8	178	-104.7	-175.8	179.9	-179.3	0	117.3	V370	V370-K372 PolarHBondContact O-N 3.42Å
373	M	29.7	Very low	36	Very low	164 Å²	164	143.5 Å²	143.5	81%	0.808	75%	0.75	S	S	*	*	S	Bend	trans	-140.2	84.5	173.9	-68.9	-177.6	82.4	0	0	108.6
374	N	28.1	Very low	33.6	Very low	147 Å²	147	145.2 Å²	145.2	79%	0.786	77%	0.77	S	S	*	*			trans	-178.2	63.7	157.2	-86.8	-18.7	0	0	0	108.5
375	K	33	Very low	31.9	Very low	197 Å²	197	148.6 Å²	148.6	86%	0.857	78%	0.777	S	S	*	*			trans	-110.2	133.5	144.8	-97.6	-177	174.4	179	0	104.2
376	E	31	Very low	30.8	Very low	173 Å²	173	148 Å²	148	81%	0.808	78%	0.783	S	S	*	*	S	Bend	trans	82	115	-169.4	-53.4	165.6	-170.7	0	0	109.9
377	D	28.5	Very low	30	Very low	155 Å²	155	150.7 Å²	150.7	83%	0.829	79%	0.792	S	S	*	*			cis	-151.7	148.2	21.4	-93.8	-37.1	0	0	0	111.8
378	R	28.2	Very low	29.3	Very low	241 Å²	241	147.9 Å²	147.9	91%	0.909	78%	0.783	S	S	*	*			trans	-83.7	136	160.7	-67.4	177.1	-179.9	-171	-0.8	108
379	C	26.8	Very low	28.7	Very low	116 Å²	116	148.8 Å²	148.8	78%	0.784	78%	0.782	S	S	*	*				-178.7	128.7	123.9	-108.8	0	0	0	0	113.1
380	S	27.3	Very low	28.4	Very low	118 Å²	118	145.9 Å²	145.9	83%	0.825	78%	0.78	S	S	*	*			trans	50.8	127.3	134	-37.5	0	0	0	0	119.3
381	G	26.7	Very low	28	Very low	75 Å²	75	149.6 Å²	149.6	77%	0.773	80%	0.796	S	S	*	*			cis	172.5	155.6	8.9	0	0	0	0	0	111.2
382	D	26.8	Very low	27.7	Very low	135 Å²	135	153.5 Å²	153.5	72%	0.722	80%	0.8	S	S	*	*			trans	54.8	127.6	150.9	-82.6	-20.5	0	0	0	127.5
383	H	27.9	Very low	27.3	Very low	156 Å²	156	153.4 Å²	153.4	72%	0.722	80%	0.802	S	S	*	*			trans	76.5	133.2	135.7	-65	-16	0	0	0	118.7
384	S	27.2	Very low	27.1	Very low	102 Å²	102	155.8 Å²	155.8	71%	0.713	80%	0.802	S	S	*	*			cis	-162.6	132.5	19.2	48.9	0	0	0	0	112.9
385	Q	28.1	Very low	27	Very low	185 Å²	185	154.2 Å²	154.2	86%	0.864	79%	0.793	S	S	*	*			trans	38.6	144.1	131.2	-65.8	178.9	-9	0	0	120.3
386	S	25.2	Very low	26.8	Very low	114 Å²	114	155.1 Å²	155.1	80%	0.797	79%	0.792	S	S	*	*			cis	-166	146.3	32.6	-177.1	0	0	0	0	111.6
387	E	23.8	Very low	26.7	Very low	168 Å²	168	157.7 Å²	157.7	79%	0.785	79%	0.794	S	S	*	*			trans	-65.1	175	160.6	-56.8	169.8	139.8	0	0	110.9
388	C	23.8	Very low	26.7	Very low	87 Å²	87	160.2 Å²	160.2	59%	0.588	80%	0.797	S	S	*	*				174.1	150.9	61	-125	0	0	0	0	113.9
389	H	24.4	Very low	26.5	Very low	164 Å²	164	155.5 Å²	155.5	76%	0.759	79%	0.79	S	S	*	*			trans	59.1	121	141.7	-65.9	-44.8	0	0	0	126.6
390	S	29.1	Very low	26.5	Very low	106 Å²	106	155.8 Å²	155.8	74%	0.741	79%	0.793	S	S	*	*				18.1	140.3	124.6	-54	0	0	0	0	121.6
391	L	25.2	Very low	26.6	Very low	181 Å²	181	156.9 Å²	156.9	95%	0.948	79%	0.789	S	S	*	*			trans	-159.4	144	135.8	-99.6	169.3	0	0	0	112
392	R	28	Very low	26.6	Very low	239 Å²	239	160.6 Å²	160.6	90%	0.902	79%	0.791	S	S	*	*			trans	-88	151.6	176.9	-71.7	173.1	167.1	174.6	-3.5	111.4
393	H	25.1	Very low	26.6	Very low	198 Å²	198	157.9 Å²	157.9	92%	0.917	79%	0.787	S	S	*	*			trans	-160.2	154.7	136.9	-140.7	-83.4	0	0	0	113.4
394	R	24.6	Very low	26.5	Very low	215 Å²	215	162 Å²	162	81%	0.811	80%	0.796	S	S	*	*			trans	-111.4	172.7	-167.2	-135	-168.2	-167.7	-173.3	2.9	113
395	D	26.4	Very low	26.4	Very low	113 Å²	113	163 Å²	163	60%	0.604	80%	0.803	S	S	*	*			trans	81.5	146	160.8	-79.5	4.9	0	0	0	117.7
396	R	28.7	Very low	26.4	Very low	217 Å²	217	161.4 Å²	161.4	82%	0.819	81%	0.806	S	S	*	*			cis	-166.1	158.8	9.5	-124.2	165.6	177.4	167.8	-1.9	111.3
397	R	29.8	Very low	26.4	Very low	226 Å²	226	159.4 Å²	159.4	85%	0.853	80%	0.803	S	S	*	*			trans	-28.1	155.1	170.3	-58.9	173.3	-172.1	172.7	0	120.8
398	K	27.2	Very low	26.5	Very low	208 Å²	208	157.2 Å²	157.2	90%	0.904	81%	0.806	S	S	*	*				-165.2	139.7	118.2	-134.4	173.3	-178.8	179.3	0	114.2
399	D	24.6	Very low	26.9	Very low	143 Å²	143	164.7 Å²	164.7	77%	0.765	82%	0.822	S	S	*	*			trans	-74.7	160.5	178.6	-56.6	-68	0	0	0	114.9
400	S	27.4	Very low	26.9	Very low	121 Å²	121	160.5 Å²	160.5	85%	0.846	82%	0.824	S	S	*	*				-165	147.6	127.8	64.1	0	0	0	0	113.7
401	I	27.8	Very low	27	Very low	142 Å²	142	160.8 Å²	160.8	73%	0.728	83%	0.826	S	S	*	*			trans	-102.9	150	-168.6	-52.9	160.9	0	0	0	108.8
402	D	28.2	Very low	27	Very low	152 Å²	152	160.2 Å²	160.2	81%	0.813	82%	0.823	S	S	*	*				133.5	156.2	115	-101.9	-30	0	0	0	107.9
403	A	26.5	Very low	27.3	Very low	79 Å²	79	153.5 Å²	153.5	65%	0.653	82%	0.819	S	S	*	*			cis	-167.2	157.1	-1.5	0	0	0	0	0	109.6
404	R	25.8	Very low	27.6	Very low	242 Å²	242	150.2 Å²	150.2	91%	0.913	82%	0.816	S	S	*	*			trans	19	140.7	147.7	-66.3	180	174.3	163	-0.8	120.3
405	S	26	Very low	27.6	Very low	123 Å²	123	145.2 Å²	145.2	86%	0.86	81%	0.813	S	S	*	*				-172.3	171.5	83.1	50.1	0	0	0	0	115.6
406	V	26.9	Very low	27.9	Very low	152 Å²	152	147.7 Å²	147.7	92%	0.921	83%	0.826	S	S	*	*			trans	-113.8	154.3	-160.7	167.9	0	0	0	0	111.6
407	G	25.1	Very low	27.9	Very low	71 Å²	71	145.9 Å²	145.9	73%	0.732	83%	0.826	S	S	*	*			trans	108.6	145.5	156.5	0	0	0	0	0	113.8
408	S	25.7	Very low	27.7	Very low	122 Å²	122	142.2 Å²	142.2	85%	0.853	82%	0.824	S	S	*	*			cis	-166.2	160.4	17.1	164.1	0	0	0	0	109.8
409	R	32.2	Very low	27.9	Very low	244 Å²	244	142.2 Å²	142.2	92%	0.921	82%	0.818	S	S	*	*			trans	-48.1	152.2	171.2	-71.2	169.4	153.9	-178.5	-7.7	115.4
410	G	25.7	Very low	28.2	Very low	77 Å²	77	146.9 Å²	146.9	79%	0.794	83%	0.825	S	S	*	*			trans	-169.2	105.6	157.5	0	0	0	0	0	110.9
411	S	29.5	Very low	28.2	Very low	112 Å²	112	151.2 Å²	151.2	78%	0.783	82%	0.824	S	S	*	*			trans	-70.2	133.8	167.8	46.3	0	0	0	0	110.4
412	D	27.1	Very low	28.7	Very low	168 Å²	168	146 Å²	146	90%	0.898	80%	0.8	S	S	*	*			trans	-160.8	129.9	150.4	-88	-33.2	0	0	0	110.2
413	A	33.7	Very low	29	Very low	98 Å²	98	142 Å²	142	81%	0.81	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76	143.9	176.2	0	0	0	0	0	110.9
414	P	30.1	Very low	29.4	Very low	130 Å²	130	140.5 Å²	140.5	84%	0.844	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-94.7	133	175.1	30.8	-22.1	0	0	0	112.3
415	S	26.3	Very low	29.8	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-73.7	163.4	173.9	49.9	0	0	0	0	113.7	Q417	S415-Q417 PolarHBondContact O-N 3.48Å
416	L	32	Very low	30.5	Very low	165 Å²	165	132.5 Å²	132.5	86%	0.864	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	17.7	-159.9	-93.4	153.3	0	0	0	119.3
417	Q	28.6	Very low	31	Very low	179 Å²	179	127.8 Å²	127.8	84%	0.836	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	0.1	-168.3	-123.3	109.4	19.2	0	0	118.5	S415	S415-Q417 PolarHBondContact O-N 3.48Å
418	N	26	Very low	31.5	Very low	150 Å²	150	129.9 Å²	129.9	80%	0.802	69%	0.69	S	S	*	*			trans	-106	15.2	-174.4	-97.9	-3.9	0	0	0	116.7	R420	N418-R420 PolarHBondContact O-N 3.24Å
419	R	31	Very low	31.9	Very low	207 Å²	207	127.6 Å²	127.6	78%	0.781	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-72	-14.4	-171.6	-91.7	-172.7	-178.3	-168.9	0.4	116.8	Y421 S422	R419-Y421 VanDerWaalsContact C-N 3.33Å; R419-Y421 PolarHBondContact O-N 3.2Å; R419-S422 PolarHBondContact O-N 3.18Å
420	R	30.2	Very low	32.1	Very low	242 Å²	242	119.2 Å²	119.2	91%	0.913	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-76.1	-14.4	-178.3	-75.3	-173.7	-175	164.4	1.9	115.3	N418	N418-R420 PolarHBondContact O-N 3.24Å
421	Y	27.8	Very low	32.6	Very low	211 Å²	211	121.4 Å²	121.4	83%	0.827	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-104	2.1	173.1	-87.5	-87.7	0	0	0	113.2	R419 A425	R419-Y421 VanDerWaalsContact C-N 3.33Å; R419-Y421 PolarHBondContact O-N 3.2Å; Y421-A425 WeakPolarHBondContact O-CB 3.45Å
422	S	37.8	Very low	33	Very low	32 Å²	32	120.3 Å²	120.3	22%	0.224	63%	0.629	C	S	.	*	H	α-helix	trans	-84.4	-23.2	-172.3	175.6	0	0	0	0	114.4	R419 R426	R419-S422 PolarHBondContact O-N 3.18Å; S422-R426 WeakPolarHBondContact O-CB 3.11Å; S422-R426 PolarHBondContact O-N 3.4Å; S422-R426 VanDerWaalsContact O-N 3.12Å; S422-R426 PolarHBondContact OG-NE 2.81Å; S422-R426 PolarHBondContact OG-NH2 2.77Å
423	S	35.3	Very low	33.6	Very low	69 Å²	69	116 Å²	116	48%	0.483	60%	0.604	S	S	.	*	H	α-helix	trans	-75	-45.1	-178	35.4	0	0	0	0	111.4	R426 I427	S423-R426 PolarHBondContact O-N 3.3Å; S423-I427 VanDerWaalsContact O-CG1 3.29Å; S423-I427 WeakPolarHBondContact O-CG1 3.3Å; S423-I427 PolarHBondContact O-N 3.47Å
424	V	35	Very low	34.1	Very low	48 Å²	48	112.9 Å²	112.9	29%	0.291	58%	0.578	S	S	.	*	H	α-helix	trans	-68.9	-41.1	177.2	-172.4	0	0	0	0	111.8	R426 I427 H428 E735	V424-R426 VanDerWaalsContact C-N 3.26Å; V424-R426 PolarHBondContact O-N 3Å; V424-I427 PolarHBondContact O-N 2.87Å; V424-I427 VanDerWaalsContact O-N 3.16Å; V424-H428 PolarHBondContact O-CD2 3.01Å; V424-H428 PolarHBondContact O-N 3.5Å; V424-H428 VanDerWaalsContact O-N 3.1Å; V424-E735 HydrophobicContact CG1-CG 4.47Å
425	A	33.4	Very low	34.8	Very low	59 Å²	59	111.6 Å²	111.6	49%	0.488	57%	0.57	S	S	.	*	H	α-helix	trans	-65.8	-27	174.5	0	0	0	0	0	112.9	Y421 S429	Y421-A425 WeakPolarHBondContact O-CB 3.45Å; A425-S429 VanDerWaalsContact O-CB 3.29Å; A425-S429 WeakPolarHBondContact O-CB 3.29Å; A425-S429 PolarHBondContact O-N 3.07Å; A425-S429 PolarHBondContact O-OG 3.01Å
426	R	41.1	Very low	35.7	Very low	137 Å²	137	108.1 Å²	108.1	52%	0.517	54%	0.542	S	S	.	.	H	α-helix	trans	-78.1	-34.3	169.9	-105.7	180	-94.8	166.9	-3.5	113	S422 S423 V424 H428 S429 M430	S422-R426 WeakPolarHBondContact O-CB 3.11Å; S422-R426 PolarHBondContact O-N 3.4Å; S422-R426 VanDerWaalsContact O-N 3.12Å; S422-R426 PolarHBondContact OG-NE 2.81Å; S422-R426 PolarHBondContact OG-NH2 2.77Å; S423-R426 PolarHBondContact O-N 3.3Å; V424-R426 VanDerWaalsContact C-N 3.26Å; V424-R426 PolarHBondContact O-N 3Å; R426-H428 PolarHBondContact O-N 3.3Å; R426-S429 WeakPolarHBondContact CA-OG 3.27Å; R426-S429 CarbonylContact O-C 3.56Å; R426-S429 PolarHBondContact O-N 3.5Å; R426-M430 WeakPolarHBondContact O-CA 3.38Å; R426-M430 VanDerWaalsContact O-CB 3.3Å; R426-M430 WeakPolarHBondContact O-CB 3.26Å; R426-M430 WeakPolarHBondContact O-CG 3.28Å; R426-M430 PolarHBondContact O-N 3.23Å
427	I	37.4	Very low	36.4	Very low	53 Å²	53	102.2 Å²	102.2	27%	0.272	51%	0.513	S	S	.	.	H	α-helix	trans	-60.9	-35.8	172	-67.9	162.6	0	0	0	111.3	S423 V424 A731 A839	S423-I427 VanDerWaalsContact O-CG1 3.29Å; S423-I427 WeakPolarHBondContact O-CG1 3.3Å; S423-I427 PolarHBondContact O-N 3.47Å; V424-I427 PolarHBondContact O-N 2.87Å; V424-I427 VanDerWaalsContact O-N 3.16Å; I427-A731 HydrophobicContact CG2-CB 4.16Å; I427-A839 HydrophobicContact CD1-CB 4.46Å
428	H	35.8	Very low	37.4	Very low	115 Å²	115	99.1 Å²	99.1	53%	0.532	50%	0.496	S	S	.	.	H	α-helix	trans	-83.1	-22.9	173.9	-78.6	-76.2	0	0	0	115.3	V424 R426 E735	V424-H428 PolarHBondContact O-CD2 3.01Å; V424-H428 PolarHBondContact O-N 3.5Å; V424-H428 VanDerWaalsContact O-N 3.1Å; R426-H428 PolarHBondContact O-N 3.3Å; H428-E735 IonicContact CD2-OE1 3.11Å; H428-E735 PolarHBondContact CD2-OE1 2.78Å; H428-E735 IonicContact CE1-OE1 3.76Å; H428-E735 IonicContact CE1-OE2 3.15Å; H428-E735 PolarHBondContact CE1-OE2 3.43Å; H428-E735 IonicContact NE2-OE1 3.04Å; H428-E735 PolarHBondContact NE2-OE1 2.9Å; H428-E735 IonicContact NE2-OE2 3.03Å; H428-E735 PolarHBondContact NE2-OE2 3.33Å
429	S	34.8	Very low	38.7	Very low	74 Å²	74	95 Å²	95	52%	0.517	48%	0.476	S	S	.	.	H	α-helix	trans	-98.8	-1.4	174.3	59.4	0	0	0	0	114.1	A425 R426 T431	A425-S429 VanDerWaalsContact O-CB 3.29Å; A425-S429 WeakPolarHBondContact O-CB 3.29Å; A425-S429 PolarHBondContact O-N 3.07Å; A425-S429 PolarHBondContact O-OG 3.01Å; R426-S429 WeakPolarHBondContact CA-OG 3.27Å; R426-S429 CarbonylContact O-C 3.56Å; R426-S429 PolarHBondContact O-N 3.5Å; S429-T431 PolarHBondContact O-N 3.12Å
430	M	34.9	Very low	40	Very low	69 Å²	69	86.5 Å²	86.5	34%	0.34	45%	0.447	S	S	.	.			trans	-63.8	83.4	157.3	-83.8	-178.1	117.7	0	0	106.1	R426 I432	R426-M430 WeakPolarHBondContact O-CA 3.38Å; R426-M430 VanDerWaalsContact O-CB 3.3Å; R426-M430 WeakPolarHBondContact O-CB 3.26Å; R426-M430 WeakPolarHBondContact O-CG 3.28Å; R426-M430 PolarHBondContact O-N 3.23Å; M430-I432 HydrophobicContact CB-CG1 4.46Å; M430-I432 HydrophobicContact CE-CD1 3.76Å; M430-I432 PolarHBondContact O-N 3.34Å
431	T	35.9	Very low	41.3	Very low	123 Å²	123	78.8 Å²	78.8	76%	0.755	42%	0.423	S	S	*	.			trans	-71.9	52.9	161.8	41.2	0	0	0	0	109.1	S429 E433	S429-T431 PolarHBondContact O-N 3.12Å; T431-E433 PolarHBondContact O-N 2.98Å
432	I	39.2	Very low	43.2	Very low	88 Å²	88	74.3 Å²	74.3	45%	0.451	41%	0.412	S	S	.	.			trans	-77.9	54.8	147.2	-45.8	179	0	0	0	106.3	M430 A434	M430-I432 HydrophobicContact CB-CG1 4.46Å; M430-I432 HydrophobicContact CE-CD1 3.76Å; M430-I432 PolarHBondContact O-N 3.34Å; I432-A434 PolarHBondContact O-N 3.2Å; I432-A434 VanDerWaalsContact O-N 3.16Å
433	E	39.1	Very low	44.7	Very low	78 Å²	78	74 Å²	74	36%	0.364	41%	0.408	S	S	.	.			trans	-80.1	89.2	155	-83.8	-167.4	136.5	0	0	105.2	T431 K438	T431-E433 PolarHBondContact O-N 2.98Å; E433-K438 HydrophobicContact CB-CG 4.38Å; E433-K438 WeakPolarHBondContact OE2-CE 3.38Å; E433-K438 WeakPolarHBondContact OE2-CG 3.49Å; E433-K438 IonicContact OE2-NZ 2.7Å
434	A	44.9	Very low	46.2	Very low	32 Å²	32	72.9 Å²	72.9	26%	0.264	40%	0.397	S	S	.	.			trans	-45.3	135.2	155.5	0	0	0	0	0	106.9	I432 I436 T437	I432-A434 PolarHBondContact O-N 3.2Å; I432-A434 VanDerWaalsContact O-N 3.16Å; A434-I436 HydrophobicContact CB-CG2 3.86Å; A434-I436 PolarHBondContact O-N 3.19Å; A434-T437 WeakPolarHBondContact O-CB 3.29Å; A434-T437 PolarHBondContact O-N 3.41Å; A434-T437 PolarHBondContact O-OG1 2.89Å
435	P	43.4	Very low	47.9	Very low	104 Å²	104	74.9 Å²	74.9	68%	0.675	41%	0.409	S	S	*	.	H	α-helix	trans	-48.3	-28.3	179.9	-30.3	35	0	0	0	112.8	T437 K438 V439	P435-T437 PolarHBondContact O-N 2.91Å; P435-K438 PolarHBondContact O-N 3.23Å; P435-V439 VanDerWaalsContact O-CG2 3.26Å; P435-V439 WeakPolarHBondContact O-CG2 3.41Å; P435-V439 PolarHBondContact O-N 3.17Å
436	I	45.4	Very low	49.6	Very low	35 Å²	35	74 Å²	74	18%	0.179	40%	0.401	C	S	.	.	H	α-helix	trans	-61.7	-35	174.4	-151.7	74.9	0	0	0	114.1	A434 V439 I440 L465 L470	A434-I436 HydrophobicContact CB-CG2 3.86Å; A434-I436 PolarHBondContact O-N 3.19Å; I436-V439 CarbonylContact O-C 3.59Å; I436-V439 PolarHBondContact O-N 3.4Å; I436-I440 HydrophobicContact CG1-CD1 4.12Å; I436-I440 HydrophobicContact CG1-CG1 4.43Å; I436-I440 VanDerWaalsContact O-CB 3.29Å; I436-I440 WeakPolarHBondContact O-CB 3.43Å; I436-I440 WeakPolarHBondContact O-CG1 3.22Å; I436-I440 PolarHBondContact O-N 3.46Å; I436-L465 HydrophobicContact CD1-CD1 4.08Å; I436-L465 HydrophobicContact CD1-CD2 3.57Å; I436-L465 HydrophobicContact CD1-CG 4.26Å; I436-L465 HydrophobicContact CG1-CD2 4.39Å; I436-L470 HydrophobicContact CD1-CD1 4.35Å; I436-L470 HydrophobicContact CD1-CD2 3.91Å; I436-L470 HydrophobicContact CG1-CD1 4.26Å; I436-L470 HydrophobicContact CG1-CD2 4.34Å
437	T	47.3	Very low	51.1	Low	41 Å²	41	69.2 Å²	69.2	25%	0.252	39%	0.385	S	S	.	.	H	α-helix	trans	-69.3	-37.5	178.3	-42	0	0	0	0	111.2	A434 P435 N441	A434-T437 WeakPolarHBondContact O-CB 3.29Å; A434-T437 PolarHBondContact O-N 3.41Å; A434-T437 PolarHBondContact O-OG1 2.89Å; P435-T437 PolarHBondContact O-N 2.91Å; T437-N441 WeakPolarHBondContact O-CB 3.4Å; T437-N441 PolarHBondContact O-N 3.16Å
438	K	49.8	Very low	52.6	Low	114 Å²	114	74.9 Å²	74.9	50%	0.496	41%	0.41	S	S	.	.	H	α-helix	trans	-66.9	-41.1	171	-72.4	-175.9	-178.6	177.7	0	111.8	E433 P435 N441 I442	E433-K438 HydrophobicContact CB-CG 4.38Å; E433-K438 WeakPolarHBondContact OE2-CE 3.38Å; E433-K438 WeakPolarHBondContact OE2-CG 3.49Å; E433-K438 IonicContact OE2-NZ 2.7Å; P435-K438 PolarHBondContact O-N 3.23Å; K438-N441 PolarHBondContact O-N 3.37Å; K438-I442 WeakPolarHBondContact O-CB 3.42Å; K438-I442 WeakPolarHBondContact O-CD1 3.17Å; K438-I442 WeakPolarHBondContact O-CG1 3.39Å; K438-I442 PolarHBondContact O-N 2.89Å
439	V	52.3	Low	54.1	Low	63 Å²	63	74.1 Å²	74.1	38%	0.382	42%	0.418	S	S	.	.	H	α-helix	trans	-65.2	-42.3	176.3	170.1	0	0	0	0	111	P435 I436 I442 I443	P435-V439 VanDerWaalsContact O-CG2 3.26Å; P435-V439 WeakPolarHBondContact O-CG2 3.41Å; P435-V439 PolarHBondContact O-N 3.17Å; I436-V439 CarbonylContact O-C 3.59Å; I436-V439 PolarHBondContact O-N 3.4Å; V439-I442 PolarHBondContact O-N 2.63Å; V439-I443 HydrophobicContact CG1-CD1 3.61Å; V439-I443 HydrophobicContact CG1-CG1 4.34Å; V439-I443 VanDerWaalsContact O-CB 3.3Å; V439-I443 WeakPolarHBondContact O-CB 3.46Å; V439-I443 WeakPolarHBondContact O-CG1 3.3Å; V439-I443 PolarHBondContact O-N 3.16Å
440	I	59.8	Low	55.8	Low	30 Å²	30	72.6 Å²	72.6	15%	0.154	41%	0.407	C	S	.	.	H	α-helix	trans	-62.1	-44.2	174.3	-73.6	167.3	0	0	0	110.3	I436 I443 N444 L462 L465	I436-I440 HydrophobicContact CG1-CD1 4.12Å; I436-I440 HydrophobicContact CG1-CG1 4.43Å; I436-I440 VanDerWaalsContact O-CB 3.29Å; I436-I440 WeakPolarHBondContact O-CB 3.43Å; I436-I440 WeakPolarHBondContact O-CG1 3.22Å; I436-I440 PolarHBondContact O-N 3.46Å; I440-I443 PolarHBondContact O-N 3.14Å; I440-N444 WeakPolarHBondContact O-CB 3.36Å; I440-N444 PolarHBondContact O-N 3.32Å; I440-N444 PolarHBondContact O-ND2 3.05Å; I440-L462 HydrophobicContact CB-CD2 4.09Å; I440-L462 HydrophobicContact CG1-CD2 3.87Å; I440-L462 HydrophobicContact CG2-CD2 3.75Å; I440-L465 HydrophobicContact CG1-CD1 4.46Å
441	N	56.6	Low	58.1	Low	79 Å²	79	73.5 Å²	73.5	42%	0.422	42%	0.418	S	S	.	.	H	α-helix	trans	-64.2	-43.7	176.4	-78.6	-17.4	0	0	0	112	T437 K438 I443 N444 T445	T437-N441 WeakPolarHBondContact O-CB 3.4Å; T437-N441 PolarHBondContact O-N 3.16Å; K438-N441 PolarHBondContact O-N 3.37Å; N441-I443 VanDerWaalsContact C-N 3.32Å; N441-I443 PolarHBondContact O-N 2.99Å; N441-N444 PolarHBondContact O-N 3.26Å; N441-T445 PolarHBondContact O-N 3.24Å; N441-T445 PolarHBondContact O-OG1 3.46Å
442	I	67.3	Low	59.6	Low	117 Å²	117	72.8 Å²	72.8	60%	0.6	41%	0.414	S	S	*	.	H	α-helix	trans	-63.2	-39.6	175.3	-68.5	164	0	0	0	111.1	K438 V439 T445 A446	K438-I442 WeakPolarHBondContact O-CB 3.42Å; K438-I442 WeakPolarHBondContact O-CD1 3.17Å; K438-I442 WeakPolarHBondContact O-CG1 3.39Å; K438-I442 PolarHBondContact O-N 2.89Å; V439-I442 PolarHBondContact O-N 2.63Å; I442-T445 PolarHBondContact O-N 2.77Å; I442-A446 VanDerWaalsContact O-CB 3.24Å; I442-A446 WeakPolarHBondContact O-CB 3.5Å; I442-A446 PolarHBondContact O-N 3.45Å
443	I	70.8	Confident	60.6	Low	26 Å²	26	73.7 Å²	73.7	13%	0.133	42%	0.423	C	S	.	.	H	α-helix	trans	-66.6	-42.6	176.5	-73.1	168.4	0	0	0	110.7	V439 I440 N441 A446 Q447 L458 V461 L462 L465	V439-I443 HydrophobicContact CG1-CD1 3.61Å; V439-I443 HydrophobicContact CG1-CG1 4.34Å; V439-I443 VanDerWaalsContact O-CB 3.3Å; V439-I443 WeakPolarHBondContact O-CB 3.46Å; V439-I443 WeakPolarHBondContact O-CG1 3.3Å; V439-I443 PolarHBondContact O-N 3.16Å; I440-I443 PolarHBondContact O-N 3.14Å; N441-I443 VanDerWaalsContact C-N 3.32Å; N441-I443 PolarHBondContact O-N 2.99Å; I443-A446 CarbonylContact O-C 3.59Å; I443-A446 PolarHBondContact O-N 3.03Å; I443-Q447 VanDerWaalsContact O-CB 3.3Å; I443-Q447 WeakPolarHBondContact O-CB 3.28Å; I443-Q447 PolarHBondContact O-N 3.36Å; I443-L458 HydrophobicContact CG2-CB 4.07Å; I443-L458 HydrophobicContact CG2-CD2 4.04Å; I443-L458 HydrophobicContact CG2-CG 4.47Å; I443-V461 HydrophobicContact CD1-CG1 4.17Å; I443-L462 HydrophobicContact CB-CD2 4.29Å; I443-L462 HydrophobicContact CG2-CD1 4.01Å; I443-L462 HydrophobicContact CG2-CD2 3.82Å; I443-L462 HydrophobicContact CG2-CG 3.77Å; I443-L465 HydrophobicContact CD1-CD1 4.14Å
444	N	65.8	Low	61.8	Low	46 Å²	46	73 Å²	73	25%	0.246	42%	0.424	C	S	.	.	H	α-helix	trans	-62.4	-43.8	175.3	-71.4	-22.8	0	0	0	111.1	I440 N441 A446 Q447 E448 L462	I440-N444 WeakPolarHBondContact O-CB 3.36Å; I440-N444 PolarHBondContact O-N 3.32Å; I440-N444 PolarHBondContact O-ND2 3.05Å; N441-N444 PolarHBondContact O-N 3.26Å; N444-A446 VanDerWaalsContact C-N 3.35Å; N444-A446 PolarHBondContact O-N 3.49Å; N444-Q447 WeakPolarHBondContact O-CB 3.33Å; N444-Q447 PolarHBondContact O-N 3Å; N444-E448 PolarHBondContact O-N 3.42Å; N444-E448 VanDerWaalsContact O-N 3.11Å; N444-L462 WeakPolarHBondContact OD1-CD1 3.27Å
445	T	71.6	Confident	62.9	Low	90 Å²	90	72.3 Å²	72.3	55%	0.552	42%	0.418	S	S	*	.	H	α-helix	trans	-66.7	-35.8	175.9	-47	0	0	0	0	112.2	N441 I442 Q447 S449	N441-T445 PolarHBondContact O-N 3.24Å; N441-T445 PolarHBondContact O-OG1 3.46Å; I442-T445 PolarHBondContact O-N 2.77Å; T445-Q447 VanDerWaalsContact C-N 3.34Å; T445-S449 PolarHBondContact O-OG 2.99Å
446	A	67.6	Low	63.9	Low	39 Å²	39	72.6 Å²	72.6	32%	0.322	41%	0.411	S	S	.	.	H	α-helix	trans	-70.5	-30.9	173.9	0	0	0	0	0	112.2	I442 I443 N444 S449 S450	I442-A446 VanDerWaalsContact O-CB 3.24Å; I442-A446 WeakPolarHBondContact O-CB 3.5Å; I442-A446 PolarHBondContact O-N 3.45Å; I443-A446 CarbonylContact O-C 3.59Å; I443-A446 PolarHBondContact O-N 3.03Å; N444-A446 VanDerWaalsContact C-N 3.35Å; N444-A446 PolarHBondContact O-N 3.49Å; A446-S449 PolarHBondContact O-OG 2.7Å; A446-S450 WeakPolarHBondContact O-CB 3.41Å; A446-S450 PolarHBondContact O-N 3.06Å; A446-S450 PolarHBondContact O-OG 3.09Å
447	Q	74.2	Confident	64.3	Low	38 Å²	38	72.9 Å²	72.9	18%	0.178	42%	0.418	C	S	.	.	H	α-helix	trans	-68.3	-45.2	177.1	-173.1	-177.9	24.9	0	0	111.7	I443 N444 T445 S449 S450 A455 L458 D459	I443-Q447 VanDerWaalsContact O-CB 3.3Å; I443-Q447 WeakPolarHBondContact O-CB 3.28Å; I443-Q447 PolarHBondContact O-N 3.36Å; N444-Q447 WeakPolarHBondContact O-CB 3.33Å; N444-Q447 PolarHBondContact O-N 3Å; T445-Q447 VanDerWaalsContact C-N 3.34Å; Q447-S449 PolarHBondContact O-N 3.13Å; Q447-S449 VanDerWaalsContact O-N 3.14Å; Q447-S450 PolarHBondContact O-N 3.35Å; Q447-S450 VanDerWaalsContact O-N 3.16Å; Q447-A455 HydrophobicContact CG-CB 3.8Å; Q447-A455 PolarHBondContact NE2-O 2.94Å; Q447-L458 HydrophobicContact CB-CD1 3.99Å; Q447-L458 HydrophobicContact CG-CB 4.49Å; Q447-D459 PolarHBondContact NE2-OD1 3.3Å; Q447-D459 PolarHBondContact NE2-OD2 2.95Å; Q447-D459 VanDerWaalsContact NE2-OD2 3.16Å
448	E	68.1	Low	65.3	Low	172 Å²	172	72.6 Å²	72.6	80%	0.804	42%	0.415	S	S	*	.	H	α-helix	trans	-61.1	-22.4	178.5	-72.9	178.6	175.6	0	0	113.5	N444	N444-E448 PolarHBondContact O-N 3.42Å; N444-E448 VanDerWaalsContact O-N 3.11Å
449	S	66.7	Low	65.9	Low	98 Å²	98	71 Å²	71	69%	0.685	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	4.7	-178.7	52.1	0	0	0	0	114.2	T445 A446 Q447	T445-S449 PolarHBondContact O-OG 2.99Å; A446-S449 PolarHBondContact O-OG 2.7Å; Q447-S449 PolarHBondContact O-N 3.13Å; Q447-S449 VanDerWaalsContact O-N 3.14Å
450	S	71.8	Confident	65.9	Low	43 Å²	43	75.5 Å²	75.5	30%	0.301	42%	0.422	S	S	.	.	S	Bend	trans	-109.5	154.4	-173.4	-72.3	0	0	0	0	114.3	A446 Q447	A446-S450 WeakPolarHBondContact O-CB 3.41Å; A446-S450 PolarHBondContact O-N 3.06Å; A446-S450 PolarHBondContact O-OG 3.09Å; Q447-S450 PolarHBondContact O-N 3.35Å; Q447-S450 VanDerWaalsContact O-N 3.16Å
451	P	82.3	Confident	65.7	Low	88 Å²	88	77 Å²	77	57%	0.571	43%	0.433	S	S	*	.			trans	-60.8	151.1	173.8	-20.3	31.6	0	0	0	112.9	T453 V454 A455	P451-T453 VanDerWaalsContact C-N 3.27Å; P451-T453 PolarHBondContact O-N 3.44Å; P451-T453 VanDerWaalsContact O-N 3.07Å; P451-V454 WeakPolarHBondContact O-CA 3.28Å; P451-V454 WeakPolarHBondContact O-CB 3.46Å; P451-V454 PolarHBondContact O-N 3.38Å; P451-A455 PolarHBondContact O-N 3.33Å
452	V	68.3	Low	65.8	Low	108 Å²	108	73.4 Å²	73.4	66%	0.655	41%	0.413	S	S	*	.	H	α-helix	trans	-50.2	-40.4	-172.1	179.8	0	0	0	0	113.9	V454 A455 E456	V452-V454 VanDerWaalsContact C-N 3.3Å; V452-V454 PolarHBondContact O-N 3.02Å; V452-A455 PolarHBondContact O-N 3.15Å; V452-E456 WeakPolarHBondContact O-CG 3.43Å; V452-E456 PolarHBondContact O-N 2.91Å; V452-E456 VanDerWaalsContact O-N 3.09Å
453	T	60	Low	65.2	Low	107 Å²	107	74.2 Å²	74.2	66%	0.656	42%	0.415	S	S	*	.	H	α-helix	trans	-69	-26.3	179.2	55.1	0	0	0	0	113.9	P451	P451-T453 VanDerWaalsContact C-N 3.27Å; P451-T453 PolarHBondContact O-N 3.44Å; P451-T453 VanDerWaalsContact O-N 3.07Å
454	V	63.8	Low	64.2	Low	63 Å²	63	78.6 Å²	78.6	38%	0.382	44%	0.437	S	S	.	.	H	α-helix	trans	-83.5	-37.3	175.7	178.8	0	0	0	0	109.8	P451 V452 E456 A457 L458	P451-V454 WeakPolarHBondContact O-CA 3.28Å; P451-V454 WeakPolarHBondContact O-CB 3.46Å; P451-V454 PolarHBondContact O-N 3.38Å; V452-V454 VanDerWaalsContact C-N 3.3Å; V452-V454 PolarHBondContact O-N 3.02Å; V454-E456 VanDerWaalsContact C-N 3.35Å; V454-E456 PolarHBondContact O-N 3.46Å; V454-A457 WeakPolarHBondContact O-CB 3.33Å; V454-A457 PolarHBondContact O-N 3.46Å; V454-A457 VanDerWaalsContact O-N 3.13Å; V454-L458 HydrophobicContact CG1-CD1 4.21Å; V454-L458 HydrophobicContact CG1-CG 4.46Å; V454-L458 WeakPolarHBondContact O-CG 3.49Å; V454-L458 PolarHBondContact O-N 2.73Å
455	A	68.6	Low	63.6	Low	17 Å²	17	78.3 Å²	78.3	14%	0.14	44%	0.435	C	S	.	.	H	α-helix	trans	-60.7	-41.2	174.4	0	0	0	0	0	112.4	Q447 P451 V452 A457 L458 D459	Q447-A455 HydrophobicContact CG-CB 3.8Å; Q447-A455 PolarHBondContact NE2-O 2.94Å; P451-A455 PolarHBondContact O-N 3.33Å; V452-A455 PolarHBondContact O-N 3.15Å; A455-A457 VanDerWaalsContact C-N 3.29Å; A455-A457 PolarHBondContact O-N 2.95Å; A455-L458 PolarHBondContact O-N 3.19Å; A455-D459 PolarHBondContact O-N 3.09Å
456	E	63	Low	62.6	Low	110 Å²	110	82.5 Å²	82.5	51%	0.514	44%	0.441	S	S	.	.	H	α-helix	trans	-66.3	-26.7	174.5	-72.1	175.9	172.4	0	0	113.7	V452 V454 R460	V452-E456 WeakPolarHBondContact O-CG 3.43Å; V452-E456 PolarHBondContact O-N 2.91Å; V452-E456 VanDerWaalsContact O-N 3.09Å; V454-E456 VanDerWaalsContact C-N 3.35Å; V454-E456 PolarHBondContact O-N 3.46Å; E456-R460 PolarHBondContact O-NE 2.84Å
457	A	55.1	Low	61.4	Low	41 Å²	41	84.9 Å²	84.9	34%	0.339	45%	0.452	S	S	.	.	H	α-helix	trans	-76.2	-38.8	172.6	0	0	0	0	0	111.3	V454 A455 R460 V461	V454-A457 WeakPolarHBondContact O-CB 3.33Å; V454-A457 PolarHBondContact O-N 3.46Å; V454-A457 VanDerWaalsContact O-N 3.13Å; A455-A457 VanDerWaalsContact C-N 3.29Å; A455-A457 PolarHBondContact O-N 2.95Å; A457-R460 PolarHBondContact O-N 2.83Å; A457-V461 WeakPolarHBondContact O-CG2 3.42Å; A457-V461 PolarHBondContact O-N 3.05Å
458	L	67.1	Low	59.9	Low	35 Å²	35	87.3 Å²	87.3	18%	0.183	47%	0.469	C	S	.	.	H	α-helix	trans	-68.4	-35.4	176.2	-65.8	173.1	0	0	0	112.1	I443 Q447 V454 A455 R460 V461 L462	I443-L458 HydrophobicContact CG2-CB 4.07Å; I443-L458 HydrophobicContact CG2-CD2 4.04Å; I443-L458 HydrophobicContact CG2-CG 4.47Å; Q447-L458 HydrophobicContact CB-CD1 3.99Å; Q447-L458 HydrophobicContact CG-CB 4.49Å; V454-L458 HydrophobicContact CG1-CD1 4.21Å; V454-L458 HydrophobicContact CG1-CG 4.46Å; V454-L458 WeakPolarHBondContact O-CG 3.49Å; V454-L458 PolarHBondContact O-N 2.73Å; A455-L458 PolarHBondContact O-N 3.19Å; L458-R460 PolarHBondContact O-N 3.19Å; L458-V461 WeakPolarHBondContact O-CB 3.33Å; L458-V461 PolarHBondContact O-N 3.3Å; L458-V461 VanDerWaalsContact O-N 3.17Å; L458-L462 WeakPolarHBondContact O-CG 3.28Å; L458-L462 PolarHBondContact O-N 3.29Å
459	D	62.8	Low	58.8	Low	80 Å²	80	87.3 Å²	87.3	43%	0.428	47%	0.469	S	S	.	.	H	α-helix	trans	-59.7	-44	172.5	-88	-31.4	0	0	0	112.2	Q447 A455 V461 L462 E463	Q447-D459 PolarHBondContact NE2-OD1 3.3Å; Q447-D459 PolarHBondContact NE2-OD2 2.95Å; Q447-D459 VanDerWaalsContact NE2-OD2 3.16Å; A455-D459 PolarHBondContact O-N 3.09Å; D459-V461 VanDerWaalsContact C-N 3.3Å; D459-V461 PolarHBondContact O-N 3.01Å; D459-L462 PolarHBondContact O-N 3.35Å; D459-E463 WeakPolarHBondContact O-CB 3.47Å; D459-E463 PolarHBondContact O-N 3.49Å
460	R	53.1	Low	57.4	Low	158 Å²	158	85.9 Å²	85.9	60%	0.596	45%	0.454	S	S	*	.	H	α-helix	trans	-64.8	-34.5	176	-73.5	-177.1	-73.1	-162.4	-1.9	112.4	E456 A457 L458 I464	E456-R460 PolarHBondContact O-NE 2.84Å; A457-R460 PolarHBondContact O-N 2.83Å; L458-R460 PolarHBondContact O-N 3.19Å; R460-I464 VanDerWaalsContact O-CD1 3.32Å; R460-I464 WeakPolarHBondContact O-CD1 3.41Å; R460-I464 WeakPolarHBondContact O-CG1 3.37Å; R460-I464 PolarHBondContact O-N 3.39Å
461	V	54.5	Low	55.8	Low	62 Å²	62	88.5 Å²	88.5	38%	0.376	46%	0.457	S	S	.	.	H	α-helix	trans	-67.3	-44	173.6	174.5	0	0	0	0	110.7	I443 A457 L458 D459 E463 I464 L465	I443-V461 HydrophobicContact CD1-CG1 4.17Å; A457-V461 WeakPolarHBondContact O-CG2 3.42Å; A457-V461 PolarHBondContact O-N 3.05Å; L458-V461 WeakPolarHBondContact O-CB 3.33Å; L458-V461 PolarHBondContact O-N 3.3Å; L458-V461 VanDerWaalsContact O-N 3.17Å; D459-V461 VanDerWaalsContact C-N 3.3Å; D459-V461 PolarHBondContact O-N 3.01Å; V461-E463 VanDerWaalsContact C-N 3.3Å; V461-E463 PolarHBondContact O-N 3.47Å; V461-I464 PolarHBondContact O-N 3.47Å; V461-L465 HydrophobicContact CG1-CD1 3.87Å; V461-L465 HydrophobicContact CG1-CG 4.26Å; V461-L465 WeakPolarHBondContact O-CB 3.31Å; V461-L465 WeakPolarHBondContact O-CG 3.34Å; V461-L465 PolarHBondContact O-N 2.99Å
462	L	59.2	Low	53.5	Low	3 Å²	3	89.3 Å²	89.3	2%	0.016	47%	0.466	C	S	.	.	H	α-helix	trans	-63.2	-35.8	176.5	-71.9	169.1	0	0	0	112.5	I440 I443 N444 L458 D459 L465 R466	I440-L462 HydrophobicContact CB-CD2 4.09Å; I440-L462 HydrophobicContact CG1-CD2 3.87Å; I440-L462 HydrophobicContact CG2-CD2 3.75Å; I443-L462 HydrophobicContact CB-CD2 4.29Å; I443-L462 HydrophobicContact CG2-CD1 4.01Å; I443-L462 HydrophobicContact CG2-CD2 3.82Å; I443-L462 HydrophobicContact CG2-CG 3.77Å; N444-L462 WeakPolarHBondContact OD1-CD1 3.27Å; L458-L462 WeakPolarHBondContact O-CG 3.28Å; L458-L462 PolarHBondContact O-N 3.29Å; D459-L462 PolarHBondContact O-N 3.35Å; L462-L465 PolarHBondContact O-N 2.93Å; L462-R466 VanDerWaalsContact O-CG 3.29Å; L462-R466 WeakPolarHBondContact O-CG 3.45Å; L462-R466 PolarHBondContact O-N 2.95Å; L462-R466 VanDerWaalsContact O-N 3.11Å
463	E	55.8	Low	51.8	Low	135 Å²	135	88 Å²	88	63%	0.631	46%	0.459	S	S	*	.	H	α-helix	trans	-71	-38	177.2	-165.5	157.4	-171.2	0	0	112.1	D459 V461 R466	D459-E463 WeakPolarHBondContact O-CB 3.47Å; D459-E463 PolarHBondContact O-N 3.49Å; V461-E463 VanDerWaalsContact C-N 3.3Å; V461-E463 PolarHBondContact O-N 3.47Å; E463-R466 PolarHBondContact O-N 2.88Å
464	I	48.3	Very low	50.2	Low	117 Å²	117	92.1 Å²	92.1	60%	0.6	47%	0.471	S	S	*	.	H	α-helix	trans	-65.7	-44.2	171.9	-67.7	163.6	0	0	0	110.7	R460 V461 R466 T467	R460-I464 VanDerWaalsContact O-CD1 3.32Å; R460-I464 WeakPolarHBondContact O-CD1 3.41Å; R460-I464 WeakPolarHBondContact O-CG1 3.37Å; R460-I464 PolarHBondContact O-N 3.39Å; V461-I464 PolarHBondContact O-N 3.47Å; I464-R466 PolarHBondContact O-N 3.37Å; I464-T467 PolarHBondContact O-N 3.07Å; I464-T467 VanDerWaalsContact O-N 3.12Å; I464-T467 PolarHBondContact O-OG1 3.32Å
465	L	53.1	Low	48.5	Very low	40 Å²	40	96.6 Å²	96.6	21%	0.209	49%	0.492	C	S	.	.	H	α-helix	trans	-68.8	-12.3	178.2	-68.9	177.5	0	0	0	114	I436 I440 I443 V461 L462 L470	I436-L465 HydrophobicContact CD1-CD1 4.08Å; I436-L465 HydrophobicContact CD1-CD2 3.57Å; I436-L465 HydrophobicContact CD1-CG 4.26Å; I436-L465 HydrophobicContact CG1-CD2 4.39Å; I440-L465 HydrophobicContact CG1-CD1 4.46Å; I443-L465 HydrophobicContact CD1-CD1 4.14Å; V461-L465 HydrophobicContact CG1-CD1 3.87Å; V461-L465 HydrophobicContact CG1-CG 4.26Å; V461-L465 WeakPolarHBondContact O-CB 3.31Å; V461-L465 WeakPolarHBondContact O-CG 3.34Å; V461-L465 PolarHBondContact O-N 2.99Å; L462-L465 PolarHBondContact O-N 2.93Å; L465-L470 HydrophobicContact CB-CD1 4.32Å; L465-L470 HydrophobicContact CD2-CD1 4.05Å; L465-L470 WeakPolarHBondContact O-CD1 3.39Å
466	R	51.1	Low	46.5	Very low	178 Å²	178	100.5 Å²	100.5	67%	0.672	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-6.8	172.9	-80.9	173.5	174.5	138.1	-1.2	113.5	L462 E463 I464	L462-R466 VanDerWaalsContact O-CG 3.29Å; L462-R466 WeakPolarHBondContact O-CG 3.45Å; L462-R466 PolarHBondContact O-N 2.95Å; L462-R466 VanDerWaalsContact O-N 3.11Å; E463-R466 PolarHBondContact O-N 2.88Å; I464-R466 PolarHBondContact O-N 3.37Å
467	T	43.3	Very low	45.2	Very low	89 Å²	89	100.6 Å²	100.6	55%	0.546	54%	0.537	S	S	.	.	S	Bend	trans	-95.9	160.2	-179.5	60.1	0	0	0	0	113.7	I464 E469	I464-T467 PolarHBondContact O-N 3.07Å; I464-T467 VanDerWaalsContact O-N 3.12Å; I464-T467 PolarHBondContact O-OG1 3.32Å; T467-E469 PolarHBondContact O-N 3.02Å
468	T	42	Very low	44.2	Very low	90 Å²	90	108 Å²	108	55%	0.552	56%	0.561	S	S	*	*	S	Bend	trans	-78.6	33	-141.3	41.8	0	0	0	0	119.4
469	E	44.6	Very low	42.8	Very low	171 Å²	171	113.7 Å²	113.7	80%	0.799	59%	0.592	S	S	*	*			trans	-132	43.3	178.1	-68.9	-170.2	176.3	0	0	114.2	T467	T467-E469 PolarHBondContact O-N 3.02Å
470	L	37.1	Very low	42.1	Very low	69 Å²	69	116.8 Å²	116.8	36%	0.361	61%	0.609	S	S	.	*			trans	-116.4	6.7	-174.7	-89	160.6	0	0	0	116.2	I436 L465	I436-L470 HydrophobicContact CD1-CD1 4.35Å; I436-L470 HydrophobicContact CD1-CD2 3.91Å; I436-L470 HydrophobicContact CG1-CD1 4.26Å; I436-L470 HydrophobicContact CG1-CD2 4.34Å; L465-L470 HydrophobicContact CB-CD1 4.32Å; L465-L470 HydrophobicContact CD2-CD1 4.05Å; L465-L470 WeakPolarHBondContact O-CD1 3.39Å
471	Y	38.9	Very low	42.6	Very low	97 Å²	97	110.5 Å²	110.5	38%	0.38	59%	0.587	S	S	.	*			trans	-115.4	68.6	-172.5	-58.3	-75.9	0	0	0	112.8	N724	Y471-N724 PolarHBondContact OH-ND2 3.45Å
472	S	33.1	Very low	43.4	Very low	106 Å²	106	110.8 Å²	110.8	74%	0.741	59%	0.59	S	S	*	*			trans	-115.7	117.1	155.2	-174.2	0	0	0	0	107.6	Q474	S472-Q474 PolarHBondContact O-N 3.36Å
473	P	32.4	Very low	43.9	Very low	80 Å²	80	111.5 Å²	111.5	52%	0.519	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-69.9	131.3	-177.5	26.2	-29.7	0	0	0	110.5
474	Q	26.9	Very low	44.6	Very low	194 Å²	194	106.2 Å²	106.2	91%	0.907	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-91.8	125.6	162.9	-76.2	-172.7	-14.3	0	0	109.5	S472 A476	S472-Q474 PolarHBondContact O-N 3.36Å; Q474-A476 PolarHBondContact O-N 3.08Å
475	L	29.6	Very low	45.6	Very low	157 Å²	157	105.2 Å²	105.2	82%	0.822	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-46.7	124.7	-179.5	-67.2	151.3	0	0	0	113.2
476	A	26.6	Very low	46.5	Very low	98 Å²	98	104.1 Å²	104.1	81%	0.81	56%	0.56	S	S	*	*			trans	-95	112.4	147	0	0	0	0	0	106.7	Q474 K478	Q474-A476 PolarHBondContact O-N 3.08Å; A476-K478 PolarHBondContact O-N 2.74Å
477	S	34.4	Very low	47.4	Very low	113 Å²	113	95.9 Å²	95.9	79%	0.79	53%	0.53	S	S	*	.			trans	-50.2	109.8	-178.6	55.5	0	0	0	0	112.7
478	K	34.5	Very low	48.4	Very low	196 Å²	196	93.5 Å²	93.5	85%	0.852	52%	0.515	S	S	*	.	S	Bend	trans	-135.6	99.2	140.1	-78.5	-168.5	177.1	177.2	0	107.2	A476	A476-K478 PolarHBondContact O-N 2.74Å
479	D	37.7	Very low	49.1	Very low	154 Å²	154	90 Å²	90	82%	0.824	50%	0.497	S	S	*	.			trans	61.1	115.8	174.3	-57.7	-30.2	0	0	0	117.7	D481	D479-D481 VanDerWaalsContact C-N 3.25Å; D479-D481 PolarHBondContact O-N 2.9Å
480	D	47.3	Very low	49.8	Very low	146 Å²	146	82 Å²	82	78%	0.781	46%	0.46	S	S	*	.			trans	-64.3	81.1	165.6	-74.5	-45	0	0	0	109.4	P482	D480-P482 WeakPolarHBondContact O-CD 3.16Å
481	D	64.2	Low	51.1	Low	26 Å²	26	80.1 Å²	80.1	14%	0.139	45%	0.45	C	S	.	.			trans	-83.1	119.8	178.7	-176.7	53.9	0	0	0	111.9	D479 H483 T484 N485 K820 S824	D479-D481 VanDerWaalsContact C-N 3.25Å; D479-D481 PolarHBondContact O-N 2.9Å; D481-H483 VanDerWaalsContact C-N 3.29Å; D481-H483 PolarHBondContact O-N 2.93Å; D481-H483 IonicContact OD1-CD2 3.89Å; D481-H483 WeakPolarHBondContact OD2-CB 3.48Å; D481-H483 IonicContact OD2-CD2 3.81Å; D481-H483 IonicContact OD2-CG 3.84Å; D481-H483 PolarHBondContact OD2-N 2.83Å; D481-T484 PolarHBondContact O-N 3.23Å; D481-T484 PolarHBondContact OD2-N 3.31Å; D481-T484 PolarHBondContact OD2-OG1 2.64Å; D481-N485 PolarHBondContact O-N 3.31Å; D481-K820 WeakPolarHBondContact OD1-CE 3.12Å; D481-K820 IonicContact OD1-NZ 3.65Å; D481-K820 PolarHBondContact OD1-NZ 3.36Å; D481-S824 PolarHBondContact OD2-OG 3.46Å
482	P	72.1	Confident	52	Low	68 Å²	68	77.4 Å²	77.4	44%	0.442	44%	0.442	S	S	.	.	H	α-helix	trans	-60.4	-31.6	-179.4	-25.5	35.2	0	0	0	114.5	D480 T484 N485 D486 V810	D480-P482 WeakPolarHBondContact O-CD 3.16Å; P482-T484 VanDerWaalsContact C-N 3.34Å; P482-N485 PolarHBondContact O-N 2.83Å; P482-D486 PolarHBondContact O-N 2.99Å; P482-V810 HydrophobicContact CB-CG2 3.87Å
483	H	69.9	Low	52.8	Low	17 Å²	17	76 Å²	76	8%	0.079	43%	0.429	C	S	.	.	H	α-helix	trans	-67.3	-38	-179.7	-61.2	-95.8	0	0	0	111.5	D481 D486 L487 V810 S821	D481-H483 VanDerWaalsContact C-N 3.29Å; D481-H483 PolarHBondContact O-N 2.93Å; D481-H483 IonicContact OD1-CD2 3.89Å; D481-H483 WeakPolarHBondContact OD2-CB 3.48Å; D481-H483 IonicContact OD2-CD2 3.81Å; D481-H483 IonicContact OD2-CG 3.84Å; D481-H483 PolarHBondContact OD2-N 2.83Å; H483-D486 PolarHBondContact O-N 3.2Å; H483-L487 WeakPolarHBondContact O-CG 3.25Å; H483-L487 PolarHBondContact O-N 3.42Å; H483-V810 HydrophobicContact CB-CG1 4.43Å; H483-V810 WeakPolarHBondContact CE1-CG1 2.97Å; H483-V810 WeakPolarHBondContact ND1-CG1 3.38Å; H483-S821 PolarHBondContact ND1-OG 3Å
484	T	70.2	Confident	53.1	Low	24 Å²	24	76 Å²	76	15%	0.147	42%	0.424	C	S	.	.	H	α-helix	trans	-63.2	-46.9	174.7	-53.5	0	0	0	0	111.6	D481 P482 D486 L487 V488 S824 Y828	D481-T484 PolarHBondContact O-N 3.23Å; D481-T484 PolarHBondContact OD2-N 3.31Å; D481-T484 PolarHBondContact OD2-OG1 2.64Å; P482-T484 VanDerWaalsContact C-N 3.34Å; T484-D486 PolarHBondContact O-N 3.44Å; T484-L487 PolarHBondContact O-N 3.47Å; T484-V488 HydrophobicContact CG2-CG2 4.45Å; T484-V488 WeakPolarHBondContact O-CB 3.37Å; T484-V488 VanDerWaalsContact O-CG2 3.26Å; T484-V488 WeakPolarHBondContact O-CG2 3.41Å; T484-V488 PolarHBondContact O-N 2.98Å; T484-S824 WeakPolarHBondContact OG1-CB 3.38Å; T484-Y828 HydrophobicContact CG2-CD1 4.46Å; T484-Y828 HydrophobicContact CG2-CD2 3.35Å; T484-Y828 HydrophobicContact CG2-CE2 3.77Å; T484-Y828 HydrophobicContact CG2-CG 3.74Å
485	N	69.6	Low	53.5	Low	97 Å²	97	67.3 Å²	67.3	52%	0.519	39%	0.387	S	S	.	.	H	α-helix	trans	-60.1	-34.2	179.8	-73.1	-27.3	0	0	0	112.5	D481 P482 G489	D481-N485 PolarHBondContact O-N 3.31Å; P482-N485 PolarHBondContact O-N 2.83Å; N485-G489 PolarHBondContact O-N 3.26Å
486	D	70.8	Confident	53.6	Low	16 Å²	16	63.9 Å²	63.9	9%	0.086	37%	0.369	C	S	.	.	H	α-helix	trans	-76.2	-40.3	177.6	-94.4	43.3	0	0	0	114.1	P482 H483 T484 V488 G489 G490 M808 P809 V810 F811	P482-D486 PolarHBondContact O-N 2.99Å; H483-D486 PolarHBondContact O-N 3.2Å; T484-D486 PolarHBondContact O-N 3.44Å; D486-V488 VanDerWaalsContact C-N 3.27Å; D486-V488 PolarHBondContact O-N 2.84Å; D486-G489 PolarHBondContact O-N 2.93Å; D486-G490 PolarHBondContact O-N 3.39Å; D486-M808 WeakPolarHBondContact OD2-CA 3.35Å; D486-P809 WeakPolarHBondContact OD1-CD 3.12Å; D486-P809 WeakPolarHBondContact OD1-CG 3.21Å; D486-P809 WeakPolarHBondContact OD2-CD 3.43Å; D486-P809 WeakPolarHBondContact OD2-CG 3.23Å; D486-V810 HydrophobicContact CB-CB 4.07Å; D486-V810 HydrophobicContact CB-CG2 4.19Å; D486-V810 VanDerWaalsContact CG-CG2 3.42Å; D486-V810 WeakPolarHBondContact OD2-CA 3.24Å; D486-V810 WeakPolarHBondContact OD2-CB 3.22Å; D486-V810 WeakPolarHBondContact OD2-CG2 3.42Å; D486-V810 PolarHBondContact OD2-N 3.3Å; D486-F811 HydrophobicContact CB-CD2 4.16Å; D486-F811 HydrophobicContact CB-CE2 4.15Å
487	L	69.5	Low	53.8	Low	6 Å²	6	68.7 Å²	68.7	3%	0.031	37%	0.366	C	S	.	.	H	α-helix	trans	-60.3	-43	170.9	-75.8	167.8	0	0	0	110.1	H483 T484 L491 F811 F825 F829	H483-L487 WeakPolarHBondContact O-CG 3.25Å; H483-L487 PolarHBondContact O-N 3.42Å; T484-L487 PolarHBondContact O-N 3.47Å; L487-L491 HydrophobicContact CD2-CD1 4.23Å; L487-L491 WeakPolarHBondContact O-CB 3.42Å; L487-L491 VanDerWaalsContact O-CG 3.24Å; L487-L491 WeakPolarHBondContact O-CG 3.44Å; L487-L491 PolarHBondContact O-N 3.01Å; L487-F811 HydrophobicContact CD1-CZ 4.37Å; L487-F811 HydrophobicContact CD2-CE1 4.5Å; L487-F811 HydrophobicContact CD2-CE2 3.67Å; L487-F811 HydrophobicContact CD2-CZ 3.41Å; L487-F811 VanDerWaalsContact CD2-CZ 3.41Å; L487-F811 HydrophobicContact CG-CE2 3.72Å; L487-F811 HydrophobicContact CG-CZ 3.69Å; L487-F825 HydrophobicContact CD1-CB 3.75Å; L487-F825 HydrophobicContact CD1-CD2 4.25Å; L487-F825 HydrophobicContact CD1-CG 4.5Å; L487-F825 HydrophobicContact CD2-CD2 4.41Å; L487-F829 HydrophobicContact CB-CE2 4.24Å
488	V	66.2	Low	53.5	Low	38 Å²	38	75.4 Å²	75.4	23%	0.23	37%	0.374	C	S	.	.	H	α-helix	trans	-65.4	-42.2	174.1	175	0	0	0	0	110.9	T484 D486 M492 Y828 F829	T484-V488 HydrophobicContact CG2-CG2 4.45Å; T484-V488 WeakPolarHBondContact O-CB 3.37Å; T484-V488 VanDerWaalsContact O-CG2 3.26Å; T484-V488 WeakPolarHBondContact O-CG2 3.41Å; T484-V488 PolarHBondContact O-N 2.98Å; D486-V488 VanDerWaalsContact C-N 3.27Å; D486-V488 PolarHBondContact O-N 2.84Å; V488-M492 HydrophobicContact CB-SD 4.33Å; V488-M492 HydrophobicContact CG1-CB 4.06Å; V488-M492 HydrophobicContact CG1-CG 4.26Å; V488-M492 HydrophobicContact CG1-SD 3.96Å; V488-M492 HydrophobicContact CG2-SD 4.02Å; V488-M492 VanDerWaalsContact O-CA 3.25Å; V488-M492 WeakPolarHBondContact O-CA 3.32Å; V488-M492 WeakPolarHBondContact O-CB 3.45Å; V488-M492 PolarHBondContact O-N 2.64Å; V488-Y828 HydrophobicContact CG2-CD1 4.15Å; V488-Y828 HydrophobicContact CG2-CE1 3.43Å; V488-Y828 VanDerWaalsContact CG2-CE1 3.43Å; V488-Y828 HydrophobicContact CG2-CE2 4.42Å; V488-F829 HydrophobicContact CG2-CZ 4.38Å
489	G	56	Low	53.1	Low	18 Å²	18	73.3 Å²	73.3	19%	0.186	37%	0.371	C	S	.	.	H	α-helix	trans	-64.2	-43.3	178	0	0	0	0	0	113.5	N485 D486 T493	N485-G489 PolarHBondContact O-N 3.26Å; D486-G489 PolarHBondContact O-N 2.93Å; G489-T493 VanDerWaalsContact C-OG1 3.26Å; G489-T493 VanDerWaalsContact CA-OG1 3.26Å; G489-T493 WeakPolarHBondContact CA-OG1 3.33Å; G489-T493 WeakPolarHBondContact O-CB 3.34Å; G489-T493 PolarHBondContact O-OG1 3.47Å
490	G	59.5	Low	52.6	Low	1 Å²	1	71.8 Å²	71.8	1%	0.01	37%	0.373	C	S	.	.	H	α-helix	trans	-72.2	-41.4	178.4	0	0	0	0	0	113.3	D486 S648	D486-G490 PolarHBondContact O-N 3.39Å; G490-S648 PolarHBondContact O-OG 3.04Å
491	L	64.9	Low	51.5	Low	31 Å²	31	67.8 Å²	67.8	16%	0.162	37%	0.366	C	S	.	.	H	α-helix	trans	-101.2	-21.4	-169.1	-58	173.6	0	0	0	114.7	L487 M712	L487-L491 HydrophobicContact CD2-CD1 4.23Å; L487-L491 WeakPolarHBondContact O-CB 3.42Å; L487-L491 VanDerWaalsContact O-CG 3.24Å; L487-L491 WeakPolarHBondContact O-CG 3.44Å; L487-L491 PolarHBondContact O-N 3.01Å; L491-M712 HydrophobicContact CB-CB 4.01Å
492	M	57.1	Low	49.6	Very low	40 Å²	40	74.7 Å²	74.7	20%	0.197	40%	0.402	C	S	.	.	H	α-helix	trans	-121.2	-1.6	-171.1	-47.2	-170.7	82.3	0	0	114.4	V488 D494 F716 Y828 F829	V488-M492 HydrophobicContact CB-SD 4.33Å; V488-M492 HydrophobicContact CG1-CB 4.06Å; V488-M492 HydrophobicContact CG1-CG 4.26Å; V488-M492 HydrophobicContact CG1-SD 3.96Å; V488-M492 HydrophobicContact CG2-SD 4.02Å; V488-M492 VanDerWaalsContact O-CA 3.25Å; V488-M492 WeakPolarHBondContact O-CA 3.32Å; V488-M492 WeakPolarHBondContact O-CB 3.45Å; V488-M492 PolarHBondContact O-N 2.64Å; M492-D494 PolarHBondContact O-N 2.73Å; M492-F716 HydrophobicContact CE-CD2 3.57Å; M492-F716 HydrophobicContact CE-CE2 3.5Å; M492-F716 VanDerWaalsContact CE-CE2 3.5Å; M492-F716 HydrophobicContact SD-CE2 4.05Å; M492-Y828 HydrophobicContact SD-CE1 4.21Å; M492-F829 HydrophobicContact CE-CE1 4.24Å; M492-F829 HydrophobicContact CG-CE1 4.48Å; M492-F829 HydrophobicContact CG-CZ 4.32Å; M492-F829 HydrophobicContact SD-CE1 3.67Å; M492-F829 HydrophobicContact SD-CZ 3.75Å
493	T	49.4	Very low	47.3	Very low	76 Å²	76	78.4 Å²	78.4	47%	0.466	41%	0.414	S	S	.	.			trans	-86.4	116.3	178.8	-36	0	0	0	0	111.2	G489 G495 S648	G489-T493 VanDerWaalsContact C-OG1 3.26Å; G489-T493 VanDerWaalsContact CA-OG1 3.26Å; G489-T493 WeakPolarHBondContact CA-OG1 3.33Å; G489-T493 WeakPolarHBondContact O-CB 3.34Å; G489-T493 PolarHBondContact O-OG1 3.47Å; T493-G495 PolarHBondContact O-N 3.03Å; T493-S648 PolarHBondContact O-OG 2.66Å
494	D	38.3	Very low	45.1	Very low	81 Å²	81	87.1 Å²	87.1	43%	0.433	45%	0.448	S	S	.	.			trans	-66.1	123.6	169.6	-163.3	15	0	0	0	109	M492 L496	M492-D494 PolarHBondContact O-N 2.73Å; D494-L496 PolarHBondContact O-N 3.36Å
495	G	36.3	Very low	42.8	Very low	11 Å²	11	91.9 Å²	91.9	11%	0.113	48%	0.477	C	S	.	.			trans	-67.6	37.1	-165.6	0	0	0	0	0	116.3	T493 R497	T493-G495 PolarHBondContact O-N 3.03Å; G495-R497 PolarHBondContact O-N 3.01Å; G495-R497 VanDerWaalsContact O-N 3.15Å
496	L	31.8	Very low	40.7	Very low	85 Å²	85	96.8 Å²	96.8	45%	0.445	49%	0.493	S	S	.	.			trans	-89	76.7	-178.8	-69	170.4	0	0	0	111.5	D494	D494-L496 PolarHBondContact O-N 3.36Å
497	R	31.1	Very low	38.3	Very low	198 Å²	198	101.6 Å²	101.6	75%	0.747	53%	0.528	S	S	*	.			trans	-131.9	107.9	153.5	-82.6	-167	175.1	-168.8	0.2	110.2	G495 L499	G495-R497 PolarHBondContact O-N 3.01Å; G495-R497 VanDerWaalsContact O-N 3.15Å; R497-L499 PolarHBondContact O-N 2.93Å
498	R	27.1	Very low	36.2	Very low	254 Å²	254	110.6 Å²	110.6	96%	0.958	57%	0.567	S	S	*	*			trans	-70.5	117.2	163.1	-84.9	-174.8	175.2	-167.5	-1.8	108.9
499	L	26.8	Very low	34.1	Very low	152 Å²	152	120.1 Å²	120.1	80%	0.796	60%	0.599	S	S	*	*			trans	-106.5	129.2	155.2	-75.8	172.6	0	0	0	109.5	R497	R497-L499 PolarHBondContact O-N 2.93Å
500	S	26.4	Very low	32.5	Very low	123 Å²	123	124.9 Å²	124.9	86%	0.86	63%	0.625	S	S	*	*			trans	-88.8	124.9	178.2	158.8	0	0	0	0	109.8
501	G	25.1	Very low	30.8	Very low	61 Å²	61	135.9 Å²	135.9	63%	0.629	67%	0.668	S	S	*	*			trans	74.4	107.1	146.8	0	0	0	0	0	118.5
502	N	23.6	Very low	28.9	Very low	171 Å²	171	142.8 Å²	142.8	91%	0.914	70%	0.701	S	S	*	*				-177.5	158.9	114.7	-95.2	-1.5	0	0	0	112.7
503	E	24.3	Very low	27.2	Very low	147 Å²	147	145.4 Å²	145.4	69%	0.687	72%	0.724	S	S	*	*			trans	-80.5	164.9	-160.5	-57	175.7	119	0	0	117.7
504	Y	22.9	Very low	26.2	Very low	199 Å²	199	151 Å²	151	78%	0.78	74%	0.744	S	S	*	*			trans	76.8	141.8	159.9	-58.4	-74.9	0	0	0	116.6
505	V	22.8	Very low	25.5	Very low	125 Å²	125	152.5 Å²	152.5	76%	0.758	76%	0.761	S	S	*	*			cis	-152.1	138	32.8	169.7	0	0	0	0	110
506	F	24.1	Very low	25.1	Very low	199 Å²	199	161.1 Å²	161.1	87%	0.873	80%	0.798	S	S	*	*			trans	-57	130.8	168	-98.5	-99.1	0	0	0	112.8
507	S	21.4	Very low	25.1	Very low	117 Å²	117	164 Å²	164	82%	0.818	81%	0.814	S	S	*	*			trans	-127.2	99.9	156.5	-79.7	0	0	0	0	110.6	R509	S507-R509 PolarHBondContact O-N 3.2Å
508	K	25.2	Very low	25.1	Very low	196 Å²	196	159 Å²	159	85%	0.852	81%	0.814	S	S	*	*			trans	-57.7	119.3	163.9	-121.5	175.2	178.8	175.6	0	109.4
509	R	22.2	Very low	25.8	Very low	238 Å²	238	154.3 Å²	154.3	90%	0.898	81%	0.806	S	S	*	*			trans	-136.6	95.5	149.7	-84.6	-173.2	-177	173.7	2	107.6	S507	S507-R509 PolarHBondContact O-N 3.2Å
510	T	22.4	Very low	26.4	Very low	117 Å²	117	151.5 Å²	151.5	72%	0.718	80%	0.798	S	S	*	*				62.2	98.5	97	-37.1	0	0	0	0	111.7	M512	T510-M512 PolarHBondContact O-N 3.39Å; T510-M512 VanDerWaalsContact O-N 3.16Å
511	Y	24.6	Very low	27.2	Very low	233 Å²	233	148.3 Å²	148.3	91%	0.914	77%	0.773	S	S	*	*			trans	-41.9	114.8	161.9	-72.7	-91.2	0	0	0	110.4
512	M	23.2	Very low	28.5	Very low	175 Å²	175	147.8 Å²	147.8	86%	0.862	76%	0.757	S	S	*	*			trans	-85.8	130.6	162.1	-71.7	-115.7	74.3	0	0	108.3	T510	T510-M512 PolarHBondContact O-N 3.39Å; T510-M512 VanDerWaalsContact O-N 3.16Å
513	S	23.1	Very low	30	Very low	96 Å²	96	142.6 Å²	142.6	67%	0.671	73%	0.729	S	S	*	*			trans	-57.5	148.2	-173.7	58.7	0	0	0	0	113.5	S515	S513-S515 PolarHBondContact O-N 2.89Å
514	Q	26.8	Very low	31.2	Very low	194 Å²	194	140.7 Å²	140.7	91%	0.907	73%	0.732	S	S	*	*			trans	-39.3	107.2	161.3	-75.5	168.8	-33.7	0	0	111.9
515	S	25	Very low	33.2	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-76.1	120.1	161.5	-51.6	0	0	0	0	107.8	S513 L517	S513-S515 PolarHBondContact O-N 2.89Å; S515-L517 PolarHBondContact O-N 3.28Å
516	Q	27.3	Very low	35.7	Very low	191 Å²	191	130.7 Å²	130.7	89%	0.893	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-55.1	119.7	179	-68.6	172.9	-30.5	0	0	110.7	A518	Q516-A518 PolarHBondContact O-N 2.92Å
517	L	32.2	Very low	38.5	Very low	147 Å²	147	123.7 Å²	123.7	77%	0.77	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-62.2	117.6	168.2	-81.3	158.6	0	0	0	108.8	S515	S515-L517 PolarHBondContact O-N 3.28Å
518	A	31.8	Very low	41.4	Very low	91 Å²	91	122.9 Å²	122.9	75%	0.752	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-66.7	153.1	173.6	0	0	0	0	0	111.7	Q516	Q516-A518 PolarHBondContact O-N 2.92Å
519	I	39.7	Very low	44.3	Very low	156 Å²	156	117 Å²	117	80%	0.8	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-47.9	148.8	-172.4	-64.4	166.3	0	0	0	113.7
520	P	39.9	Very low	47.4	Very low	94 Å²	94	105.9 Å²	105.9	61%	0.61	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-79	133.5	-170.3	1.5	16.2	0	0	0	112.8
521	V	43.2	Very low	50.5	Low	56 Å²	56	102.1 Å²	102.1	34%	0.339	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-99.3	122.7	173.7	176.2	0	0	0	0	108.3	D525 R581	V521-D525 HydrophobicContact CB-CB 4.37Å; V521-D525 VanDerWaalsContact CG1-C 3.44Å; V521-D525 HydrophobicContact CG1-CB 3.51Å; V521-D525 WeakPolarHBondContact CG1-O 3.44Å; V521-R581 WeakPolarHBondContact O-CD 3.5Å; V521-R581 PolarHBondContact O-NE 2.78Å; V521-R581 PolarHBondContact O-NH1 3.46Å; V521-R581 PolarHBondContact O-NH2 3.48Å
522	T	52.5	Low	53.6	Low	49 Å²	49	97.3 Å²	97.3	30%	0.301	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-72.8	164.9	173.4	66.4	0	0	0	0	113	S524 D525 V526 R581	T522-S524 WeakPolarHBondContact CB-OG 3.38Å; T522-S524 PolarHBondContact O-N 2.99Å; T522-S524 WeakPolarHBondContact OG1-CB 3.39Å; T522-S524 PolarHBondContact OG1-OG 3.03Å; T522-D525 WeakPolarHBondContact CB-OD2 3.49Å; T522-D525 PolarHBondContact N-OD2 3.18Å; T522-D525 CarbonylContact O-C 3.52Å; T522-D525 WeakPolarHBondContact O-CA 3.16Å; T522-D525 PolarHBondContact O-N 3.04Å; T522-D525 PolarHBondContact OG1-N 2.93Å; T522-D525 PolarHBondContact OG1-OD2 3.17Å; T522-V526 PolarHBondContact O-N 2.7Å; T522-R581 VanDerWaalsContact CA-NH2 3.32Å
523	L	54.5	Low	56.8	Low	63 Å²	63	91.6 Å²	91.6	33%	0.33	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-57.1	-32.2	171.5	-159.1	86.1	0	0	0	110.5	D525 V526 L561 E577 R581	L523-D525 PolarHBondContact O-N 3.49Å; L523-V526 WeakPolarHBondContact O-CG2 3.35Å; L523-V526 PolarHBondContact O-N 3.05Å; L523-L561 HydrophobicContact CD1-CB 3.92Å; L523-E577 PolarHBondContact N-OE1 3.05Å; L523-R581 VanDerWaalsContact N-NH2 3.2Å
524	S	51.4	Low	60.1	Low	107 Å²	107	87.4 Å²	87.4	75%	0.748	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-65.5	-17	169.9	14.9	0	0	0	0	115.1	T522	T522-S524 WeakPolarHBondContact CB-OG 3.38Å; T522-S524 PolarHBondContact O-N 2.99Å; T522-S524 WeakPolarHBondContact OG1-CB 3.39Å; T522-S524 PolarHBondContact OG1-OG 3.03Å
525	D	64.4	Low	63.1	Low	93 Å²	93	83.3 Å²	83.3	50%	0.497	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-108.6	6.8	-180	-54.7	-45.5	0	0	0	112.5	V521 T522 L523 P527	V521-D525 HydrophobicContact CB-CB 4.37Å; V521-D525 VanDerWaalsContact CG1-C 3.44Å; V521-D525 HydrophobicContact CG1-CB 3.51Å; V521-D525 WeakPolarHBondContact CG1-O 3.44Å; T522-D525 WeakPolarHBondContact CB-OD2 3.49Å; T522-D525 PolarHBondContact N-OD2 3.18Å; T522-D525 CarbonylContact O-C 3.52Å; T522-D525 WeakPolarHBondContact O-CA 3.16Å; T522-D525 PolarHBondContact O-N 3.04Å; T522-D525 PolarHBondContact OG1-N 2.93Å; T522-D525 PolarHBondContact OG1-OD2 3.17Å; L523-D525 PolarHBondContact O-N 3.49Å; D525-P527 WeakPolarHBondContact O-CD 3.28Å
526	V	75.4	Confident	66.2	Low	20 Å²	20	81.6 Å²	81.6	12%	0.121	47%	0.472	C	S	.	.	S	Bend	trans	-60.9	127.3	174	175.7	0	0	0	0	108.1	T522 L523 I530 A531 Y558	T522-V526 PolarHBondContact O-N 2.7Å; L523-V526 WeakPolarHBondContact O-CG2 3.35Å; L523-V526 PolarHBondContact O-N 3.05Å; V526-I530 HydrophobicContact CG1-CB 3.68Å; V526-I530 HydrophobicContact CG1-CG2 3.64Å; V526-A531 HydrophobicContact CG1-CB 4.16Å; V526-Y558 HydrophobicContact CG1-CD1 4.11Å; V526-Y558 HydrophobicContact CG1-CE1 4.32Å; V526-Y558 HydrophobicContact CG2-CD1 4.11Å; V526-Y558 HydrophobicContact CG2-CE1 4.29Å
527	P	82.7	Confident	69.3	Low	52 Å²	52	72.6 Å²	72.6	34%	0.338	43%	0.43	S	S	.	.			trans	-48.4	134.3	176	-29.7	34.9	0	0	0	111.1	D525 S529 I530 A531	D525-P527 WeakPolarHBondContact O-CD 3.28Å; P527-S529 PolarHBondContact O-N 3.31Å; P527-I530 HydrophobicContact CB-CD1 4.2Å; P527-I530 HydrophobicContact CB-CG1 4.33Å; P527-I530 HydrophobicContact CG-CD1 3.95Å; P527-I530 PolarHBondContact O-N 3.37Å; P527-A531 PolarHBondContact O-N 3.11Å
528	P	81.6	Confident	72.3	Confident	101 Å²	101	71.4 Å²	71.4	66%	0.656	42%	0.42	S	S	*	.	H	α-helix	trans	-51.8	-36.7	-174.8	-29.6	34.4	0	0	0	113.7	I530 A531 E532	P528-I530 PolarHBondContact O-N 3.47Å; P528-A531 PolarHBondContact O-N 3.2Å; P528-E532 WeakPolarHBondContact O-CG 3.3Å; P528-E532 PolarHBondContact O-N 2.9Å
529	S	85.6	Confident	75.4	Confident	71 Å²	71	74.3 Å²	74.3	50%	0.497	41%	0.412	S	S	.	.	H	α-helix	trans	-60.1	-42.4	175.2	53.6	0	0	0	0	113.5	P527 M533	P527-S529 PolarHBondContact O-N 3.31Å; S529-M533 WeakPolarHBondContact O-CG 3.32Å; S529-M533 PolarHBondContact O-N 3.09Å
530	I	88.6	Confident	78.1	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-72.4	-39	178.3	-61.9	174.1	0	0	0	110	V526 P527 P528 E532 M533 L534 L547 A550 T551 Y558	V526-I530 HydrophobicContact CG1-CB 3.68Å; V526-I530 HydrophobicContact CG1-CG2 3.64Å; P527-I530 HydrophobicContact CB-CD1 4.2Å; P527-I530 HydrophobicContact CB-CG1 4.33Å; P527-I530 HydrophobicContact CG-CD1 3.95Å; P527-I530 PolarHBondContact O-N 3.37Å; P528-I530 PolarHBondContact O-N 3.47Å; I530-E532 VanDerWaalsContact C-N 3.34Å; I530-E532 PolarHBondContact O-N 3.1Å; I530-M533 PolarHBondContact O-N 3.05Å; I530-L534 HydrophobicContact CG2-CD1 4.07Å; I530-L534 HydrophobicContact CG2-CG 4.42Å; I530-L534 WeakPolarHBondContact O-CG 3.39Å; I530-L534 PolarHBondContact O-N 3.44Å; I530-L547 HydrophobicContact CG2-CD1 3.97Å; I530-A550 HydrophobicContact CG1-CB 3.99Å; I530-T551 HydrophobicContact CD1-CG2 4.08Å; I530-T551 HydrophobicContact CG2-CG2 4.31Å; I530-Y558 HydrophobicContact CD1-CE1 4.27Å; I530-Y558 HydrophobicContact CG2-CD1 3.93Å; I530-Y558 HydrophobicContact CG2-CG 4.37Å
531	A	87.5	Confident	80.7	Confident	38 Å²	38	66.7 Å²	66.7	31%	0.314	36%	0.364	S	S	.	.	H	α-helix	trans	-62.6	-40.8	177.3	0	0	0	0	0	112.1	V526 P527 P528 L534 N535	V526-A531 HydrophobicContact CG1-CB 4.16Å; P527-A531 PolarHBondContact O-N 3.11Å; P528-A531 PolarHBondContact O-N 3.2Å; A531-L534 PolarHBondContact O-N 2.8Å; A531-N535 PolarHBondContact O-N 2.66Å; A531-N535 PolarHBondContact O-OD1 2.71Å
532	E	88.3	Confident	83.2	Confident	133 Å²	133	64.6 Å²	64.6	62%	0.621	35%	0.351	S	S	*	.	H	α-helix	trans	-60.4	-44	174.3	-77.9	175.7	-172.7	0	0	111.9	P528 I530 L534 N535	P528-E532 WeakPolarHBondContact O-CG 3.3Å; P528-E532 PolarHBondContact O-N 2.9Å; I530-E532 VanDerWaalsContact C-N 3.34Å; I530-E532 PolarHBondContact O-N 3.1Å; E532-L534 VanDerWaalsContact C-N 3.34Å; E532-L534 PolarHBondContact O-N 3.21Å; E532-N535 WeakPolarHBondContact O-CB 3.3Å; E532-N535 PolarHBondContact O-N 2.85Å; E532-N535 PolarHBondContact O-ND2 2.72Å
533	M	90.6	Very high	85.3	Confident	55 Å²	55	64.9 Å²	64.9	27%	0.271	35%	0.35	S	S	.	.	H	α-helix	trans	-62.5	-40.9	177.8	-65.5	167.7	70.9	0	0	112.1	S529 I530 N535 F542 D546 L547 A550	S529-M533 WeakPolarHBondContact O-CG 3.32Å; S529-M533 PolarHBondContact O-N 3.09Å; I530-M533 PolarHBondContact O-N 3.05Å; M533-N535 PolarHBondContact O-N 3.2Å; M533-F542 WeakPolarHBondContact O-CE2 2.99Å; M533-D546 HydrophobicContact CE-CB 3.34Å; M533-D546 WeakPolarHBondContact CE-O 3.34Å; M533-L547 HydrophobicContact CE-CB 4.44Å; M533-A550 HydrophobicContact CE-CB 4.18Å; M533-A550 HydrophobicContact SD-CB 3.84Å
534	L	92.8	Very high	87.3	Confident	8 Å²	8	61.9 Å²	61.9	4%	0.042	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-70.1	-6.3	179.8	-68.3	172.6	0	0	0	114.2	I530 A531 E532 D536 E537 F542 L547 L559 K562	I530-L534 HydrophobicContact CG2-CD1 4.07Å; I530-L534 HydrophobicContact CG2-CG 4.42Å; I530-L534 WeakPolarHBondContact O-CG 3.39Å; I530-L534 PolarHBondContact O-N 3.44Å; A531-L534 PolarHBondContact O-N 2.8Å; E532-L534 VanDerWaalsContact C-N 3.34Å; E532-L534 PolarHBondContact O-N 3.21Å; L534-D536 VanDerWaalsContact C-N 3.32Å; L534-E537 WeakPolarHBondContact O-CG 3.34Å; L534-F542 HydrophobicContact CD2-CZ 4.41Å; L534-L547 HydrophobicContact CD2-CD1 4.09Å; L534-L547 HydrophobicContact CD2-CD2 4.14Å; L534-L547 HydrophobicContact CG-CD1 4.45Å; L534-L559 HydrophobicContact CD2-CB 4.44Å; L534-L559 HydrophobicContact CD2-CD1 3.79Å; L534-K562 HydrophobicContact CB-CG 4.39Å; L534-K562 HydrophobicContact CD1-CB 4.43Å
535	N	89.7	Confident	89.4	Confident	107 Å²	107	58.3 Å²	58.3	57%	0.572	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-71.4	-28.1	177.7	-71.5	-31.9	0	0	0	112.9	A531 E532 M533	A531-N535 PolarHBondContact O-N 2.66Å; A531-N535 PolarHBondContact O-OD1 2.71Å; E532-N535 WeakPolarHBondContact O-CB 3.3Å; E532-N535 PolarHBondContact O-N 2.85Å; E532-N535 PolarHBondContact O-ND2 2.72Å; M533-N535 PolarHBondContact O-N 3.2Å
536	D	89.6	Confident	90.9	Very high	77 Å²	77	58 Å²	58	41%	0.412	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-96.7	14	-179.9	-74.6	-53.6	0	0	0	113	L534 E538 R539	L534-D536 VanDerWaalsContact C-N 3.32Å; D536-E538 PolarHBondContact O-N 3.11Å; D536-E538 VanDerWaalsContact O-N 3.07Å; D536-R539 HydrophobicContact CB-CG 4.5Å; D536-R539 WeakPolarHBondContact O-CB 3.43Å; D536-R539 PolarHBondContact O-N 3.27Å; D536-R539 IonicContact OD1-CZ 3.63Å; D536-R539 IonicContact OD1-NE 2.77Å; D536-R539 PolarHBondContact OD1-NE 3.31Å; D536-R539 IonicContact OD1-NH2 3.87Å; D536-R539 PolarHBondContact OD1-NH2 3.28Å
537	E	94	Very high	91.9	Very high	2 Å²	2	57 Å²	57	1%	0.009	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-19	-179.5	69.8	90.7	172.6	0	0	114.1	L534 R539 F542 L559 K562 H608 R615	L534-E537 WeakPolarHBondContact O-CG 3.34Å; E537-R539 PolarHBondContact O-N 2.87Å; E537-F542 HydrophobicContact CB-CD2 4.39Å; E537-F542 HydrophobicContact CB-CE2 4.39Å; E537-L559 HydrophobicContact CB-CD1 4.04Å; E537-K562 HydrophobicContact CG-CG 4.04Å; E537-H608 PolarHBondContact O-CD2 3.28Å; E537-H608 PolarHBondContact O-NE2 2.88Å; E537-R615 IonicContact OE1-CZ 2.7Å; E537-R615 IonicContact OE1-NH1 3.4Å; E537-R615 IonicContact OE1-NH2 3.5Å; E537-R615 PolarHBondContact OE1-NH2 3.48Å; E537-R615 IonicContact OE2-CZ 2.83Å; E537-R615 IonicContact OE2-NH1 2.75Å; E537-R615 PolarHBondContact OE2-NH1 3.3Å; E537-R615 IonicContact OE2-NH2 3.27Å; E537-R615 PolarHBondContact OE2-NH2 3Å
538	E	94.6	Very high	92.6	Very high	122 Å²	122	55.7 Å²	55.7	57%	0.57	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-15	176.7	-58.9	-173.1	172.7	0	0	113	D536 Y612	D536-E538 PolarHBondContact O-N 3.11Å; D536-E538 VanDerWaalsContact O-N 3.07Å; E538-Y612 WeakPolarHBondContact O-CD2 3.15Å
539	R	95.9	Very high	93.2	Very high	151 Å²	151	54.2 Å²	54.2	57%	0.57	29%	0.285	S	S	*	.	S	Bend	trans	-87.2	142	-177.4	-58.8	-173.3	-170.3	-132.8	2.8	111.2	D536 E537 E541 F542 H608	D536-R539 HydrophobicContact CB-CG 4.5Å; D536-R539 WeakPolarHBondContact O-CB 3.43Å; D536-R539 PolarHBondContact O-N 3.27Å; D536-R539 IonicContact OD1-CZ 3.63Å; D536-R539 IonicContact OD1-NE 2.77Å; D536-R539 PolarHBondContact OD1-NE 3.31Å; D536-R539 IonicContact OD1-NH2 3.87Å; D536-R539 PolarHBondContact OD1-NH2 3.28Å; E537-R539 PolarHBondContact O-N 2.87Å; R539-E541 PolarHBondContact O-N 3.03Å; R539-F542 WeakPolarHBondContact O-CB 3.37Å; R539-F542 PolarHBondContact O-N 3.4Å; R539-H608 PolarHBondContact O-CE1 3.36Å; R539-H608 VanDerWaalsContact O-CE1 3.28Å; R539-H608 PolarHBondContact O-NE2 2.75Å
540	W	96.9	Very high	93.7	Very high	1 Å²	1	52.5 Å²	52.5	0%	0.004	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-30.1	177.7	-176.1	-108.2	0	0	0	112.8	F542 A609 Y612 F613 A772 C775 R776 L846 H849	W540-F542 PolarHBondContact O-N 3.16Å; W540-A609 HydrophobicContact CH2-CB 3.91Å; W540-A609 HydrophobicContact CZ3-CB 3.8Å; W540-Y612 HydrophobicContact CB-CD2 4.33Å; W540-Y612 HydrophobicContact CB-CE2 3.84Å; W540-Y612 HydrophobicContact CD2-CE1 4.48Å; W540-Y612 AromaticContact CE3-CD1 3.51Å; W540-Y612 HydrophobicContact CE3-CD1 3.51Å; W540-Y612 HydrophobicContact CE3-CD2 4.22Å; W540-Y612 AromaticContact CE3-CE1 3.89Å; W540-Y612 HydrophobicContact CE3-CE1 3.89Å; W540-Y612 AromaticContact CE3-CG 3.7Å; W540-Y612 HydrophobicContact CE3-CG 3.7Å; W540-Y612 AromaticContact CZ3-CD1 3.92Å; W540-Y612 HydrophobicContact CZ3-CD1 3.92Å; W540-Y612 HydrophobicContact CZ3-CG 4.24Å; W540-F613 HydrophobicContact CH2-CZ 4.2Å; W540-F613 HydrophobicContact CZ3-CE1 4.24Å; W540-F613 HydrophobicContact CZ3-CZ 4.26Å; W540-A772 HydrophobicContact CH2-CB 3.77Å; W540-A772 HydrophobicContact CZ2-CB 4.11Å; W540-C775 HydrophobicContact CZ2-CB 4.16Å; W540-C775 PolarHBondContact NE1-O 3.06Å; W540-R776 PolarHBondContact O-NH1 2.82Å; W540-R776 VanDerWaalsContact O-NH1 3.12Å; W540-L846 HydrophobicContact CB-CD1 4.46Å; W540-L846 HydrophobicContact CD2-CD1 3.65Å; W540-L846 HydrophobicContact CD2-CD2 4.24Å; W540-L846 HydrophobicContact CD2-CG 3.9Å; W540-L846 HydrophobicContact CE3-CD1 4.14Å; W540-L846 HydrophobicContact CE3-CD2 4.32Å; W540-L846 HydrophobicContact CE3-CG 4.44Å; W540-L846 HydrophobicContact CG-CD1 3.76Å; W540-L846 HydrophobicContact CG-CG 4.32Å; W540-L846 HydrophobicContact CH2-CD2 3.69Å; W540-L846 HydrophobicContact CH2-CG 4.28Å; W540-L846 HydrophobicContact CZ2-CD1 4.41Å; W540-L846 HydrophobicContact CZ2-CD2 3.61Å; W540-L846 HydrophobicContact CZ2-CG 3.73Å; W540-L846 HydrophobicContact CZ3-CD2 4.05Å; W540-H849 AromaticContact CD1-CD2 3.92Å
541	E	95.2	Very high	93.9	Very high	89 Å²	89	52.5 Å²	52.5	42%	0.416	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	7.1	-178.6	-55.8	77.7	-172.2	0	0	113.5	R539 N543 P777	R539-E541 PolarHBondContact O-N 3.03Å; E541-N543 PolarHBondContact O-N 3.03Å; E541-P777 HydrophobicContact CB-CG 4.14Å; E541-P777 HydrophobicContact CG-CG 4.17Å
542	F	96.3	Very high	94.2	Very high	12 Å²	12	58.6 Å²	58.6	5%	0.053	30%	0.297	C	S	.	.			trans	-54.2	125.5	176.7	-179.6	-103.4	0	0	0	111.7	M533 L534 E537 R539 W540 I544 L547 L559 H608	M533-F542 WeakPolarHBondContact O-CE2 2.99Å; L534-F542 HydrophobicContact CD2-CZ 4.41Å; E537-F542 HydrophobicContact CB-CD2 4.39Å; E537-F542 HydrophobicContact CB-CE2 4.39Å; R539-F542 WeakPolarHBondContact O-CB 3.37Å; R539-F542 PolarHBondContact O-N 3.4Å; W540-F542 PolarHBondContact O-N 3.16Å; F542-I544 HydrophobicContact CE1-CD1 3.9Å; F542-I544 PolarHBondContact O-N 3.33Å; F542-L547 HydrophobicContact CE1-CD2 4.24Å; F542-L547 HydrophobicContact CZ-CB 4.24Å; F542-L547 HydrophobicContact CZ-CD2 4.03Å; F542-L559 HydrophobicContact CE1-CD1 4.28Å; F542-L559 HydrophobicContact CE1-CD2 4.14Å; F542-L559 HydrophobicContact CZ-CD1 4.3Å; F542-H608 WeakPolarHBondContact CB-NE2 3.3Å
543	N	95	Very high	94.4	Very high	55 Å²	55	57.7 Å²	57.7	29%	0.294	29%	0.291	S	S	.	.			trans	-87.4	94.4	-178.5	-170.2	-11.8	0	0	0	111.3	E541 L545 D546 L547 L780	E541-N543 PolarHBondContact O-N 3.03Å; N543-L545 PolarHBondContact O-N 3.38Å; N543-L545 WeakPolarHBondContact OD1-CB 3.34Å; N543-L545 PolarHBondContact OD1-N 3.18Å; N543-D546 HydrophobicContact CB-CB 4.31Å; N543-D546 VanDerWaalsContact CG-CG 3.44Å; N543-D546 VanDerWaalsContact CG-OD2 3.29Å; N543-D546 PolarHBondContact ND2-OD1 3.03Å; N543-D546 VanDerWaalsContact ND2-OD1 3.14Å; N543-D546 PolarHBondContact ND2-OD2 3.29Å; N543-D546 PolarHBondContact O-N 3.19Å; N543-D546 PolarHBondContact OD1-N 2.97Å; N543-L547 PolarHBondContact O-N 3.1Å; N543-L780 WeakPolarHBondContact OD1-CD2 3.33Å
544	I	97.3	Very high	94.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.5	-25.3	178.8	-166.1	62.2	0	0	0	113.4	F542 L547 E548 P555 L559 T601 A604 D605 L780 W784	F542-I544 HydrophobicContact CE1-CD1 3.9Å; F542-I544 PolarHBondContact O-N 3.33Å; I544-L547 HydrophobicContact CD1-CD2 4.13Å; I544-L547 PolarHBondContact O-N 2.86Å; I544-E548 PolarHBondContact O-N 3.26Å; I544-P555 HydrophobicContact CD1-CB 4.32Å; I544-L559 HydrophobicContact CD1-CD2 3.71Å; I544-T601 HydrophobicContact CG1-CG2 3.97Å; I544-A604 HydrophobicContact CD1-CB 3.82Å; I544-A604 HydrophobicContact CG1-CB 4.47Å; I544-D605 HydrophobicContact CG1-CB 4.2Å; I544-D605 HydrophobicContact CG2-CB 4.32Å; I544-L780 HydrophobicContact CG2-CD2 4.47Å; I544-W784 HydrophobicContact CG2-CZ2 3.82Å
545	L	96.3	Very high	94.9	Very high	33 Å²	33	58.8 Å²	58.8	17%	0.173	29%	0.292	C	S	.	.	H	α-helix	trans	-74.8	-36.5	-179.7	-54.5	175.6	0	0	0	111.9	N543 L547 E548 A549 L780 E783	N543-L545 PolarHBondContact O-N 3.38Å; N543-L545 WeakPolarHBondContact OD1-CB 3.34Å; N543-L545 PolarHBondContact OD1-N 3.18Å; L545-L547 VanDerWaalsContact C-N 3.26Å; L545-L547 PolarHBondContact O-N 3.01Å; L545-E548 WeakPolarHBondContact O-CB 3.42Å; L545-E548 PolarHBondContact O-N 3.05Å; L545-A549 PolarHBondContact O-N 3.23Å; L545-L780 HydrophobicContact CB-CD2 4.5Å; L545-L780 HydrophobicContact CD1-CD2 3.51Å; L545-L780 HydrophobicContact CG-CD2 3.61Å; L545-E783 HydrophobicContact CD1-CB 3.8Å; L545-E783 HydrophobicContact CD1-CG 3.59Å; L545-E783 HydrophobicContact CD2-CG 3.98Å; L545-E783 HydrophobicContact CG-CG 4.44Å
546	D	95.8	Very high	95.3	Very high	86 Å²	86	53.7 Å²	53.7	46%	0.46	27%	0.265	S	S	.	.	H	α-helix	trans	-62.7	-41.6	172.8	-66.1	-18.9	0	0	0	109.2	M533 N543 A549 A550	M533-D546 HydrophobicContact CE-CB 3.34Å; M533-D546 WeakPolarHBondContact CE-O 3.34Å; N543-D546 HydrophobicContact CB-CB 4.31Å; N543-D546 VanDerWaalsContact CG-CG 3.44Å; N543-D546 VanDerWaalsContact CG-OD2 3.29Å; N543-D546 PolarHBondContact ND2-OD1 3.03Å; N543-D546 VanDerWaalsContact ND2-OD1 3.14Å; N543-D546 PolarHBondContact ND2-OD2 3.29Å; N543-D546 PolarHBondContact O-N 3.19Å; N543-D546 PolarHBondContact OD1-N 2.97Å; D546-A549 PolarHBondContact O-N 3.31Å; D546-A550 WeakPolarHBondContact O-CB 3.46Å; D546-A550 PolarHBondContact O-N 3.16Å
547	L	96.2	Very high	95.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-42.5	176.3	-174.8	69.1	0	0	0	111.5	I530 M533 L534 F542 N543 I544 L545 A549 A550 T551 P555 L559	I530-L547 HydrophobicContact CG2-CD1 3.97Å; M533-L547 HydrophobicContact CE-CB 4.44Å; L534-L547 HydrophobicContact CD2-CD1 4.09Å; L534-L547 HydrophobicContact CD2-CD2 4.14Å; L534-L547 HydrophobicContact CG-CD1 4.45Å; F542-L547 HydrophobicContact CE1-CD2 4.24Å; F542-L547 HydrophobicContact CZ-CB 4.24Å; F542-L547 HydrophobicContact CZ-CD2 4.03Å; N543-L547 PolarHBondContact O-N 3.1Å; I544-L547 HydrophobicContact CD1-CD2 4.13Å; I544-L547 PolarHBondContact O-N 2.86Å; L545-L547 VanDerWaalsContact C-N 3.26Å; L545-L547 PolarHBondContact O-N 3.01Å; L547-A549 VanDerWaalsContact C-N 3.31Å; L547-A549 PolarHBondContact O-N 2.7Å; L547-A550 PolarHBondContact O-N 3.11Å; L547-T551 HydrophobicContact CD1-CG2 3.71Å; L547-T551 HydrophobicContact CG-CG2 4.03Å; L547-T551 VanDerWaalsContact O-CB 3.3Å; L547-T551 WeakPolarHBondContact O-CB 3.47Å; L547-T551 VanDerWaalsContact O-CG2 3.22Å; L547-T551 WeakPolarHBondContact O-CG2 3.43Å; L547-T551 PolarHBondContact O-N 2.77Å; L547-T551 PolarHBondContact O-OG1 3.23Å; L547-P555 HydrophobicContact CB-CB 4.49Å; L547-P555 HydrophobicContact CD2-CB 3.8Å; L547-P555 HydrophobicContact CG-CB 3.94Å; L547-L559 HydrophobicContact CD2-CB 3.82Å; L547-L559 HydrophobicContact CD2-CD2 4.26Å; L547-L559 HydrophobicContact CD2-CG 4.47Å
548	E	96.7	Very high	95.7	Very high	24 Å²	24	52 Å²	52	11%	0.112	25%	0.253	C	S	.	.	H	α-helix	trans	-54.8	-47.2	173.2	177.3	-173.9	-115	0	0	111.2	I544 L545 T551 H552 K553 P555 T601 R787	I544-E548 PolarHBondContact O-N 3.26Å; L545-E548 WeakPolarHBondContact O-CB 3.42Å; L545-E548 PolarHBondContact O-N 3.05Å; E548-T551 PolarHBondContact O-OG1 3.45Å; E548-H552 PolarHBondContact O-N 3.13Å; E548-K553 HydrophobicContact CG-CG 4.25Å; E548-K553 PolarHBondContact O-N 3.49Å; E548-P555 HydrophobicContact CB-CG 4.42Å; E548-T601 HydrophobicContact CB-CG2 3.93Å; E548-T601 VanDerWaalsContact CD-OG1 3.31Å; E548-T601 HydrophobicContact CG-CG2 4.22Å; E548-T601 WeakPolarHBondContact CG-OG1 3.33Å; E548-T601 WeakPolarHBondContact OE1-CB 3.16Å; E548-T601 PolarHBondContact OE1-OG1 3.05Å; E548-R787 IonicContact OE1-CZ 3.99Å; E548-R787 IonicContact OE1-NH1 2.85Å; E548-R787 PolarHBondContact OE1-NH1 3.18Å; E548-R787 IonicContact OE1-NH2 3.74Å; E548-R787 IonicContact OE2-CZ 3.66Å; E548-R787 IonicContact OE2-NH1 2.9Å; E548-R787 PolarHBondContact OE2-NH1 3.01Å; E548-R787 IonicContact OE2-NH2 3.15Å; E548-R787 PolarHBondContact OE2-NH2 3.33Å
549	A	95.4	Very high	95.9	Very high	69 Å²	69	46.2 Å²	46.2	57%	0.57	23%	0.226	S	C	*	.	H	α-helix	trans	-65	-47.5	179.4	0	0	0	0	0	112	L545 D546 L547 T551 H552	L545-A549 PolarHBondContact O-N 3.23Å; D546-A549 PolarHBondContact O-N 3.31Å; L547-A549 VanDerWaalsContact C-N 3.31Å; L547-A549 PolarHBondContact O-N 2.7Å; A549-T551 VanDerWaalsContact C-N 3.31Å; A549-T551 PolarHBondContact O-N 3.18Å; A549-H552 PolarHBondContact O-N 3.41Å
550	A	94.6	Very high	96	Very high	35 Å²	35	39 Å²	39	29%	0.289	20%	0.199	S	C	.	.	H	α-helix	trans	-67.4	-30.8	-177.7	0	0	0	0	0	113.1	I530 M533 D546 L547	I530-A550 HydrophobicContact CG1-CB 3.99Å; M533-A550 HydrophobicContact CE-CB 4.18Å; M533-A550 HydrophobicContact SD-CB 3.84Å; D546-A550 WeakPolarHBondContact O-CB 3.46Å; D546-A550 PolarHBondContact O-N 3.16Å; L547-A550 PolarHBondContact O-N 3.11Å
551	T	94.3	Very high	95.9	Very high	6 Å²	6	39.2 Å²	39.2	4%	0.037	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	0.5	179.7	61.1	0	0	0	0	113.4	I530 L547 E548 A549 R554 P555 Y558	I530-T551 HydrophobicContact CD1-CG2 4.08Å; I530-T551 HydrophobicContact CG2-CG2 4.31Å; L547-T551 HydrophobicContact CD1-CG2 3.71Å; L547-T551 HydrophobicContact CG-CG2 4.03Å; L547-T551 VanDerWaalsContact O-CB 3.3Å; L547-T551 WeakPolarHBondContact O-CB 3.47Å; L547-T551 VanDerWaalsContact O-CG2 3.22Å; L547-T551 WeakPolarHBondContact O-CG2 3.43Å; L547-T551 PolarHBondContact O-N 2.77Å; L547-T551 PolarHBondContact O-OG1 3.23Å; E548-T551 PolarHBondContact O-OG1 3.45Å; A549-T551 VanDerWaalsContact C-N 3.31Å; A549-T551 PolarHBondContact O-N 3.18Å; T551-R554 WeakPolarHBondContact O-CB 3.39Å; T551-R554 PolarHBondContact O-N 3.21Å; T551-R554 PolarHBondContact OG1-N 2.9Å; T551-R554 VanDerWaalsContact OG1-N 3.15Å; T551-P555 VanDerWaalsContact OG1-N 3.16Å; T551-Y558 HydrophobicContact CG2-CD2 3.51Å; T551-Y558 HydrophobicContact CG2-CE2 3.92Å; T551-Y558 HydrophobicContact CG2-CG 3.84Å
552	H	93.3	Very high	96	Very high	165 Å²	165	38.2 Å²	38.2	76%	0.764	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	55.5	-174.1	-55.6	-64.8	0	0	0	112.9	E548 A549 R554	E548-H552 PolarHBondContact O-N 3.13Å; A549-H552 PolarHBondContact O-N 3.41Å; H552-R554 VanDerWaalsContact C-N 3.33Å
553	K	92.8	Very high	96	Very high	114 Å²	114	37.6 Å²	37.6	50%	0.496	19%	0.192	S	C	.	.	S	Bend	trans	62.3	35.1	-176.2	-58.9	-172.4	168.2	-165.1	0	113.8	E548 S593	E548-K553 HydrophobicContact CG-CG 4.25Å; E548-K553 PolarHBondContact O-N 3.49Å; K553-S593 PolarHBondContact NZ-O 3.26Å
554	R	95.8	Very high	96.2	Very high	87 Å²	87	35 Å²	35	33%	0.328	18%	0.178	S	C	.	.			trans	-124.8	43.1	174.6	-58.5	-170.7	67.2	177.3	4.5	113.8	T551 H552 L556 Y558 E588	T551-R554 WeakPolarHBondContact O-CB 3.39Å; T551-R554 PolarHBondContact O-N 3.21Å; T551-R554 PolarHBondContact OG1-N 2.9Å; T551-R554 VanDerWaalsContact OG1-N 3.15Å; H552-R554 VanDerWaalsContact C-N 3.33Å; R554-L556 VanDerWaalsContact C-N 3.33Å; R554-L556 PolarHBondContact O-N 3.46Å; R554-Y558 HydrophobicContact CB-CE2 4.33Å; R554-Y558 WeakPolarHBondContact O-CD2 3.48Å; R554-E588 WeakPolarHBondContact CA-OE1 3.21Å; R554-E588 WeakPolarHBondContact CB-OE2 3.29Å; R554-E588 IonicContact CZ-OE2 3.14Å; R554-E588 IonicContact NE-OE2 3.89Å; R554-E588 PolarHBondContact NE-OE2 3.08Å; R554-E588 VanDerWaalsContact NE-OE2 3.09Å; R554-E588 IonicContact NH2-OE2 2.84Å; R554-E588 VanDerWaalsContact O-OE1 3.08Å
555	P	97.2	Very high	96.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.4	-31	-173	29	-35.6	0	0	0	113.1	I544 L547 E548 T551 T557 Y558 L559 T601 A604	I544-P555 HydrophobicContact CD1-CB 4.32Å; L547-P555 HydrophobicContact CB-CB 4.49Å; L547-P555 HydrophobicContact CD2-CB 3.8Å; L547-P555 HydrophobicContact CG-CB 3.94Å; E548-P555 HydrophobicContact CB-CG 4.42Å; T551-P555 VanDerWaalsContact OG1-N 3.16Å; P555-T557 PolarHBondContact O-N 2.8Å; P555-Y558 PolarHBondContact O-N 2.9Å; P555-L559 VanDerWaalsContact O-CB 3.26Å; P555-L559 WeakPolarHBondContact O-CB 3.16Å; P555-L559 PolarHBondContact O-N 3.38Å; P555-T601 HydrophobicContact CG-CG2 4.17Å; P555-T601 WeakPolarHBondContact CG-OG1 3.23Å; P555-A604 HydrophobicContact CB-CB 4.05Å; P555-A604 HydrophobicContact CG-CB 4.09Å
556	L	98.2	Very high	96.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-41.2	-173.1	-176.2	62.4	0	0	0	111.9	R554 G560 E588 Y591 A603 A604 L607 T636	R554-L556 VanDerWaalsContact C-N 3.33Å; R554-L556 PolarHBondContact O-N 3.46Å; L556-G560 VanDerWaalsContact O-CA 3.3Å; L556-G560 WeakPolarHBondContact O-CA 3.12Å; L556-G560 PolarHBondContact O-N 3.39Å; L556-E588 HydrophobicContact CB-CB 4.39Å; L556-E588 HydrophobicContact CB-CG 4.33Å; L556-E588 WeakPolarHBondContact CB-OE1 3.2Å; L556-E588 HydrophobicContact CD2-CB 4.27Å; L556-E588 PolarHBondContact N-OE1 3.35Å; L556-Y591 HydrophobicContact CD2-CD2 4.19Å; L556-Y591 HydrophobicContact CD2-CE2 4.05Å; L556-A603 HydrophobicContact CD1-CB 4.25Å; L556-A603 HydrophobicContact CD2-CB 4.14Å; L556-A604 HydrophobicContact CB-CB 4.2Å; L556-A604 HydrophobicContact CD1-CB 4.16Å; L556-L607 HydrophobicContact CD1-CD2 4.11Å; L556-T636 HydrophobicContact CD1-CG2 4.18Å; L556-T636 HydrophobicContact CD2-CG2 4.22Å; L556-T636 HydrophobicContact CG-CG2 4.4Å
557	T	96.6	Very high	96.1	Very high	4 Å²	4	37 Å²	37	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-63.4	-47	178.4	-64.2	0	0	0	0	111.7	P555 L561 L584 Q585 E588	P555-T557 PolarHBondContact O-N 2.8Å; T557-L561 HydrophobicContact CG2-CD1 4.25Å; T557-L561 WeakPolarHBondContact O-CB 3.3Å; T557-L561 VanDerWaalsContact O-CG 3.28Å; T557-L561 WeakPolarHBondContact O-CG 3.29Å; T557-L561 PolarHBondContact O-N 2.97Å; T557-L584 HydrophobicContact CG2-CB 4.39Å; T557-Q585 HydrophobicContact CG2-CG 3.72Å; T557-E588 WeakPolarHBondContact CB-OE2 3.47Å; T557-E588 PolarHBondContact N-OE1 3.47Å; T557-E588 VanDerWaalsContact OG1-CD 3.26Å; T557-E588 PolarHBondContact OG1-OE2 3.29Å
558	Y	96	Very high	96.2	Very high	40 Å²	40	37.9 Å²	37.9	16%	0.157	20%	0.204	C	C	.	.	H	α-helix	trans	-73.1	-46.9	-174.3	-70.8	-98	0	0	0	111.6	V526 I530 T551 R554 P555 L561 K562	V526-Y558 HydrophobicContact CG1-CD1 4.11Å; V526-Y558 HydrophobicContact CG1-CE1 4.32Å; V526-Y558 HydrophobicContact CG2-CD1 4.11Å; V526-Y558 HydrophobicContact CG2-CE1 4.29Å; I530-Y558 HydrophobicContact CD1-CE1 4.27Å; I530-Y558 HydrophobicContact CG2-CD1 3.93Å; I530-Y558 HydrophobicContact CG2-CG 4.37Å; T551-Y558 HydrophobicContact CG2-CD2 3.51Å; T551-Y558 HydrophobicContact CG2-CE2 3.92Å; T551-Y558 HydrophobicContact CG2-CG 3.84Å; R554-Y558 HydrophobicContact CB-CE2 4.33Å; R554-Y558 WeakPolarHBondContact O-CD2 3.48Å; P555-Y558 PolarHBondContact O-N 2.9Å; Y558-L561 PolarHBondContact O-N 3.33Å; Y558-K562 PolarHBondContact O-N 2.96Å
559	L	97.9	Very high	96.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67	-41	177.8	-171.3	57.2	0	0	0	111.4	L534 E537 F542 I544 L547 P555 L561 K562 I563 A604 H608	L534-L559 HydrophobicContact CD2-CB 4.44Å; L534-L559 HydrophobicContact CD2-CD1 3.79Å; E537-L559 HydrophobicContact CB-CD1 4.04Å; F542-L559 HydrophobicContact CE1-CD1 4.28Å; F542-L559 HydrophobicContact CE1-CD2 4.14Å; F542-L559 HydrophobicContact CZ-CD1 4.3Å; I544-L559 HydrophobicContact CD1-CD2 3.71Å; L547-L559 HydrophobicContact CD2-CB 3.82Å; L547-L559 HydrophobicContact CD2-CD2 4.26Å; L547-L559 HydrophobicContact CD2-CG 4.47Å; P555-L559 VanDerWaalsContact O-CB 3.26Å; P555-L559 WeakPolarHBondContact O-CB 3.16Å; P555-L559 PolarHBondContact O-N 3.38Å; L559-L561 PolarHBondContact O-N 2.88Å; L559-K562 PolarHBondContact O-N 2.72Å; L559-I563 HydrophobicContact CD1-CD1 3.87Å; L559-I563 HydrophobicContact CD1-CG1 4.2Å; L559-I563 HydrophobicContact CD2-CD1 4.44Å; L559-I563 HydrophobicContact CG-CD1 3.75Å; L559-I563 HydrophobicContact CG-CG1 4.4Å; L559-I563 WeakPolarHBondContact O-CB 3.19Å; L559-I563 WeakPolarHBondContact O-CG1 3.2Å; L559-I563 PolarHBondContact O-N 3.32Å; L559-A604 HydrophobicContact CD2-CB 4.2Å; L559-A604 WeakPolarHBondContact CD2-O 3.38Å; L559-H608 HydrophobicContact CD2-CB 4.07Å
560	G	97.6	Very high	96.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.8	-46.3	175.1	0	0	0	0	0	112.4	L556 K562 I563 F564	L556-G560 VanDerWaalsContact O-CA 3.3Å; L556-G560 WeakPolarHBondContact O-CA 3.12Å; L556-G560 PolarHBondContact O-N 3.39Å; G560-K562 PolarHBondContact O-N 3.46Å; G560-I563 PolarHBondContact O-N 3.27Å; G560-F564 WeakPolarHBondContact O-CB 3.22Å; G560-F564 WeakPolarHBondContact O-CD2 3.24Å; G560-F564 WeakPolarHBondContact O-CG 3.4Å; G560-F564 PolarHBondContact O-N 3.15Å
561	L	95.9	Very high	96.3	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-44.5	176.4	-78	170.1	0	0	0	112.2	L523 T557 Y558 L559 T565 E577 L580 R581 L584	L523-L561 HydrophobicContact CD1-CB 3.92Å; T557-L561 HydrophobicContact CG2-CD1 4.25Å; T557-L561 WeakPolarHBondContact O-CB 3.3Å; T557-L561 VanDerWaalsContact O-CG 3.28Å; T557-L561 WeakPolarHBondContact O-CG 3.29Å; T557-L561 PolarHBondContact O-N 2.97Å; Y558-L561 PolarHBondContact O-N 3.33Å; L559-L561 PolarHBondContact O-N 2.88Å; L561-T565 VanDerWaalsContact O-CB 3.27Å; L561-T565 WeakPolarHBondContact O-CB 3.24Å; L561-T565 PolarHBondContact O-N 3.46Å; L561-T565 VanDerWaalsContact O-N 3.11Å; L561-T565 PolarHBondContact O-OG1 3.13Å; L561-E577 HydrophobicContact CD2-CG 4.24Å; L561-L580 HydrophobicContact CD2-CD2 4.22Å; L561-L580 HydrophobicContact CD2-CG 4.28Å; L561-R581 HydrophobicContact CD1-CB 4.42Å; L561-R581 HydrophobicContact CD1-CG 4.24Å; L561-R581 HydrophobicContact CD2-CB 4.05Å; L561-L584 HydrophobicContact CB-CD1 4.47Å; L561-L584 HydrophobicContact CD2-CD1 4.02Å; L561-L584 HydrophobicContact CG-CD1 3.79Å
562	K	95.9	Very high	96.5	Very high	67 Å²	67	40.8 Å²	40.8	29%	0.291	21%	0.205	S	C	.	.	H	α-helix	trans	-63	-52	178.7	177.9	67.6	176.1	-169.3	0	111.4	L534 E537 Y558 L559 G560 T565 S566	L534-K562 HydrophobicContact CB-CG 4.39Å; L534-K562 HydrophobicContact CD1-CB 4.43Å; E537-K562 HydrophobicContact CG-CG 4.04Å; Y558-K562 PolarHBondContact O-N 2.96Å; L559-K562 PolarHBondContact O-N 2.72Å; G560-K562 PolarHBondContact O-N 3.46Å; K562-T565 PolarHBondContact O-N 3.01Å; K562-S566 PolarHBondContact O-N 2.73Å
563	I	98.1	Very high	96.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-50.4	-177.7	-71.1	175.5	0	0	0	110.5	L559 G560 T565 S566 F567 L607 A611 L632	L559-I563 HydrophobicContact CD1-CD1 3.87Å; L559-I563 HydrophobicContact CD1-CG1 4.2Å; L559-I563 HydrophobicContact CD2-CD1 4.44Å; L559-I563 HydrophobicContact CG-CD1 3.75Å; L559-I563 HydrophobicContact CG-CG1 4.4Å; L559-I563 WeakPolarHBondContact O-CB 3.19Å; L559-I563 WeakPolarHBondContact O-CG1 3.2Å; L559-I563 PolarHBondContact O-N 3.32Å; G560-I563 PolarHBondContact O-N 3.27Å; I563-T565 PolarHBondContact O-N 2.76Å; I563-S566 PolarHBondContact O-N 2.87Å; I563-S566 PolarHBondContact O-OG 2.78Å; I563-F567 HydrophobicContact CG2-CD2 3.93Å; I563-F567 HydrophobicContact CG2-CE2 4.14Å; I563-F567 WeakPolarHBondContact O-CD2 3.3Å; I563-F567 PolarHBondContact O-N 3.05Å; I563-L607 HydrophobicContact CD1-CD2 4.39Å; I563-L607 HydrophobicContact CD1-CG 3.99Å; I563-L607 HydrophobicContact CG2-CD1 4.39Å; I563-A611 HydrophobicContact CD1-CB 3.95Å; I563-A611 HydrophobicContact CG1-CB 4.37Å; I563-A611 HydrophobicContact CG2-CB 3.81Å; I563-L632 HydrophobicContact CG2-CD1 4.27Å; I563-L632 HydrophobicContact CG2-CD2 3.71Å
564	F	98.1	Very high	96.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-32.7	-178.1	-81.5	-129.4	0	0	0	112.1	G560 G568 V569 L580 W583 L607 L632 I633	G560-F564 WeakPolarHBondContact O-CB 3.22Å; G560-F564 WeakPolarHBondContact O-CD2 3.24Å; G560-F564 WeakPolarHBondContact O-CG 3.4Å; G560-F564 PolarHBondContact O-N 3.15Å; F564-G568 PolarHBondContact O-N 2.9Å; F564-V569 HydrophobicContact CB-CB 3.99Å; F564-V569 HydrophobicContact CB-CG2 3.94Å; F564-V569 HydrophobicContact CD1-CB 3.7Å; F564-V569 HydrophobicContact CD1-CG1 3.48Å; F564-V569 VanDerWaalsContact CD1-CG1 3.48Å; F564-V569 HydrophobicContact CD1-CG2 3.81Å; F564-V569 HydrophobicContact CE1-CG1 3.94Å; F564-V569 HydrophobicContact CG-CB 4.12Å; F564-V569 HydrophobicContact CG-CG1 4.38Å; F564-V569 HydrophobicContact CG-CG2 3.9Å; F564-V569 WeakPolarHBondContact O-CG2 3.36Å; F564-V569 PolarHBondContact O-N 3.35Å; F564-L580 HydrophobicContact CB-CD2 3.56Å; F564-L580 HydrophobicContact CD1-CD1 3.42Å; F564-L580 VanDerWaalsContact CD1-CD1 3.42Å; F564-L580 HydrophobicContact CD1-CD2 3.98Å; F564-L580 HydrophobicContact CD1-CG 4.33Å; F564-L580 HydrophobicContact CE1-CD1 3.84Å; F564-L580 HydrophobicContact CG-CD1 4.2Å; F564-L580 HydrophobicContact CG-CD2 4.12Å; F564-W583 AromaticContact CE1-CZ3 3.96Å; F564-W583 HydrophobicContact CE1-CZ3 3.96Å; F564-W583 HydrophobicContact CZ-CH2 4.48Å; F564-W583 AromaticContact CZ-CZ3 3.98Å; F564-W583 HydrophobicContact CZ-CZ3 3.98Å; F564-L607 HydrophobicContact CE2-CD1 3.97Å; F564-L607 HydrophobicContact CE2-CD2 4.21Å; F564-L632 HydrophobicContact CE2-CB 3.94Å; F564-L632 HydrophobicContact CZ-CB 4.11Å; F564-I633 HydrophobicContact CE1-CG1 3.99Å; F564-I633 HydrophobicContact CZ-CG1 4.14Å
565	T	95.1	Very high	96.9	Very high	70 Å²	70	29 Å²	29	43%	0.429	16%	0.16	S	C	.	.	H	α-helix	trans	-66.2	-45.5	171.6	-58	0	0	0	0	111.1	L561 K562 I563 F567 G568	L561-T565 VanDerWaalsContact O-CB 3.27Å; L561-T565 WeakPolarHBondContact O-CB 3.24Å; L561-T565 PolarHBondContact O-N 3.46Å; L561-T565 VanDerWaalsContact O-N 3.11Å; L561-T565 PolarHBondContact O-OG1 3.13Å; K562-T565 PolarHBondContact O-N 3.01Å; I563-T565 PolarHBondContact O-N 2.76Å; T565-F567 VanDerWaalsContact C-N 3.26Å; T565-F567 PolarHBondContact O-N 3.49Å; T565-G568 PolarHBondContact O-N 2.94Å; T565-G568 VanDerWaalsContact O-N 3.1Å
566	S	95.5	Very high	96.8	Very high	64 Å²	64	32 Å²	32	45%	0.448	18%	0.182	S	C	.	.	H	α-helix	trans	-63	-30.7	179.7	77.2	0	0	0	0	113.6	K562 I563 R615	K562-S566 PolarHBondContact O-N 2.73Å; I563-S566 PolarHBondContact O-N 2.87Å; I563-S566 PolarHBondContact O-OG 2.78Å; S566-R615 PolarHBondContact OG-NH2 3.2Å
567	F	97.4	Very high	96.6	Very high	28 Å²	28	35.5 Å²	35.5	12%	0.123	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	2.2	177.3	-79.7	-95.3	0	0	0	113.5	I563 T565 V569 A611 L614 R615 E628 L632	I563-F567 HydrophobicContact CG2-CD2 3.93Å; I563-F567 HydrophobicContact CG2-CE2 4.14Å; I563-F567 WeakPolarHBondContact O-CD2 3.3Å; I563-F567 PolarHBondContact O-N 3.05Å; T565-F567 VanDerWaalsContact C-N 3.26Å; T565-F567 PolarHBondContact O-N 3.49Å; F567-V569 VanDerWaalsContact C-N 3.29Å; F567-V569 HydrophobicContact CB-CG2 4.08Å; F567-V569 PolarHBondContact O-N 2.87Å; F567-A611 HydrophobicContact CE2-CB 3.9Å; F567-A611 HydrophobicContact CZ-CB 4.3Å; F567-L614 HydrophobicContact CE1-CB 3.72Å; F567-L614 HydrophobicContact CE1-CD1 3.97Å; F567-L614 HydrophobicContact CZ-CB 3.85Å; F567-L614 HydrophobicContact CZ-CD1 4.27Å; F567-R615 HydrophobicContact CZ-CG 4.02Å; F567-E628 HydrophobicContact CD1-CB 4.47Å; F567-L632 HydrophobicContact CB-CD1 3.68Å; F567-L632 HydrophobicContact CD1-CD1 4.08Å; F567-L632 HydrophobicContact CD2-CD1 3.89Å; F567-L632 HydrophobicContact CG-CD1 3.62Å
568	G	97.1	Very high	96.4	Very high	18 Å²	18	38.1 Å²	38.1	19%	0.186	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	31.7	178.7	0	0	0	0	0	113.9	F564 T565 C570 D571 F572	F564-G568 PolarHBondContact O-N 2.9Å; T565-G568 PolarHBondContact O-N 2.94Å; T565-G568 VanDerWaalsContact O-N 3.1Å; G568-C570 VanDerWaalsContact C-N 3.35Å; G568-C570 PolarHBondContact O-N 3.35Å; G568-D571 PolarHBondContact O-N 3.18Å; G568-F572 PolarHBondContact O-N 3.1Å
569	V	97.6	Very high	96.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-40.5	-174.8	178.6	0	0	0	0	111.6	F564 F567 D571 F572 L573 V629 L632	F564-V569 HydrophobicContact CB-CB 3.99Å; F564-V569 HydrophobicContact CB-CG2 3.94Å; F564-V569 HydrophobicContact CD1-CB 3.7Å; F564-V569 HydrophobicContact CD1-CG1 3.48Å; F564-V569 VanDerWaalsContact CD1-CG1 3.48Å; F564-V569 HydrophobicContact CD1-CG2 3.81Å; F564-V569 HydrophobicContact CE1-CG1 3.94Å; F564-V569 HydrophobicContact CG-CB 4.12Å; F564-V569 HydrophobicContact CG-CG1 4.38Å; F564-V569 HydrophobicContact CG-CG2 3.9Å; F564-V569 WeakPolarHBondContact O-CG2 3.36Å; F564-V569 PolarHBondContact O-N 3.35Å; F567-V569 VanDerWaalsContact C-N 3.29Å; F567-V569 HydrophobicContact CB-CG2 4.08Å; F567-V569 PolarHBondContact O-N 2.87Å; V569-D571 VanDerWaalsContact C-N 3.33Å; V569-D571 PolarHBondContact O-N 2.87Å; V569-F572 PolarHBondContact O-N 2.97Å; V569-L573 HydrophobicContact CG1-CD1 3.7Å; V569-L573 HydrophobicContact CG1-CG 4.17Å; V569-L573 WeakPolarHBondContact O-CB 3.27Å; V569-L573 WeakPolarHBondContact O-CG 3.39Å; V569-L573 PolarHBondContact O-N 3.26Å; V569-V629 HydrophobicContact CG1-CG1 4.01Å; V569-V629 HydrophobicContact CG1-CG2 4.38Å; V569-V629 HydrophobicContact CG2-CG2 4.2Å; V569-L632 HydrophobicContact CG2-CD1 3.94Å
570	C	96.2	Very high	96.3	Very high	18 Å²	18	37.4 Å²	37.4	12%	0.122	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-42.4	176.9	-75.7	0	0	0	0	112.3	G568 L573 N574 C575 L580	G568-C570 VanDerWaalsContact C-N 3.35Å; G568-C570 PolarHBondContact O-N 3.35Å; C570-L573 PolarHBondContact O-N 2.86Å; C570-N574 WeakPolarHBondContact O-CA 3.3Å; C570-N574 PolarHBondContact O-N 3.29Å; C570-C575 WeakPolarHBondContact CB-O 3.45Å; C570-C575 PolarHBondContact O-N 3.25Å; C570-L580 WeakPolarHBondContact SG-CD2 3.42Å
571	D	96.6	Very high	96.1	Very high	141 Å²	141	38.2 Å²	38.2	75%	0.754	22%	0.223	S	C	*	.	H	α-helix	trans	-67.4	-41.5	179.5	-63.2	-28	0	0	0	110.6	G568 V569 N574	G568-D571 PolarHBondContact O-N 3.18Å; V569-D571 VanDerWaalsContact C-N 3.33Å; V569-D571 PolarHBondContact O-N 2.87Å; D571-N574 PolarHBondContact O-N 2.92Å
572	F	97.6	Very high	96.1	Very high	35 Å²	35	39.9 Å²	39.9	15%	0.154	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-41.7	176.3	-178.6	-93.6	0	0	0	112.9	G568 V569 N574 Q625 L626 V629 Q695	G568-F572 PolarHBondContact O-N 3.1Å; V569-F572 PolarHBondContact O-N 2.97Å; F572-N574 VanDerWaalsContact C-N 3.32Å; F572-Q625 HydrophobicContact CD2-CB 4.21Å; F572-Q625 HydrophobicContact CD2-CG 3.67Å; F572-Q625 HydrophobicContact CE2-CB 4.17Å; F572-Q625 HydrophobicContact CE2-CG 4.11Å; F572-Q625 HydrophobicContact CG-CG 4.31Å; F572-L626 HydrophobicContact CE2-CB 4.41Å; F572-L626 HydrophobicContact CZ-CB 3.74Å; F572-L626 HydrophobicContact CZ-CD1 4.4Å; F572-L626 HydrophobicContact CZ-CG 4.1Å; F572-V629 HydrophobicContact CB-CG2 4.16Å; F572-V629 HydrophobicContact CD1-CB 4.1Å; F572-V629 HydrophobicContact CD1-CG1 4Å; F572-V629 HydrophobicContact CD1-CG2 3.66Å; F572-V629 HydrophobicContact CE1-CB 4.22Å; F572-V629 HydrophobicContact CE1-CG1 4.24Å; F572-V629 HydrophobicContact CE1-CG2 4.18Å; F572-V629 HydrophobicContact CG-CG2 3.91Å; F572-Q695 HydrophobicContact CZ-CG 4.5Å
573	L	97.1	Very high	96.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-86.1	-3.5	-179.7	-63.3	-179.7	0	0	0	113.8	V569 C570 C575 V629 I633 I687 F688 I691 L699	V569-L573 HydrophobicContact CG1-CD1 3.7Å; V569-L573 HydrophobicContact CG1-CG 4.17Å; V569-L573 WeakPolarHBondContact O-CB 3.27Å; V569-L573 WeakPolarHBondContact O-CG 3.39Å; V569-L573 PolarHBondContact O-N 3.26Å; C570-L573 PolarHBondContact O-N 2.86Å; L573-C575 PolarHBondContact O-N 3.35Å; L573-V629 HydrophobicContact CD1-CG1 4.35Å; L573-V629 HydrophobicContact CD2-CG1 4.13Å; L573-V629 HydrophobicContact CG-CG1 4.28Å; L573-I633 HydrophobicContact CD1-CD1 4.21Å; L573-I687 HydrophobicContact CD1-CB 4.23Å; L573-I687 HydrophobicContact CD1-CD1 4.09Å; L573-I687 HydrophobicContact CD1-CG1 4.41Å; L573-F688 HydrophobicContact CD1-CE1 4.44Å; L573-F688 HydrophobicContact CD2-CD1 4.25Å; L573-F688 HydrophobicContact CD2-CE1 4.48Å; L573-I691 HydrophobicContact CB-CG2 4.28Å; L573-I691 HydrophobicContact CD2-CD1 4.34Å; L573-I691 HydrophobicContact CD2-CG2 4.06Å; L573-I691 VanDerWaalsContact O-CG2 3.28Å; L573-I691 WeakPolarHBondContact O-CG2 3.42Å; L573-L699 HydrophobicContact CD2-CD2 3.58Å
574	N	96.3	Very high	96.2	Very high	105 Å²	105	36.7 Å²	36.7	56%	0.561	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	41	-173.8	-169.9	24.7	0	0	0	112.3	C570 D571 F572 N690	C570-N574 WeakPolarHBondContact O-CA 3.3Å; C570-N574 PolarHBondContact O-N 3.29Å; D571-N574 PolarHBondContact O-N 2.92Å; F572-N574 VanDerWaalsContact C-N 3.32Å; N574-N690 HydrophobicContact CB-CB 3.94Å; N574-N690 VanDerWaalsContact O-CB 3.29Å; N574-N690 WeakPolarHBondContact O-CB 3.43Å; N574-N690 PolarHBondContact O-ND2 3.02Å
575	C	95.8	Very high	96.2	Very high	14 Å²	14	38.8 Å²	38.8	10%	0.095	23%	0.231	C	C	.	.			trans	-115.9	151	179.6	73.5	0	0	0	0	111.6	C570 L573 T579	C570-C575 WeakPolarHBondContact CB-O 3.45Å; C570-C575 PolarHBondContact O-N 3.25Å; L573-C575 PolarHBondContact O-N 3.35Å; C575-T579 HydrophobicContact CB-CG2 4.44Å
576	S	95.4	Very high	96.3	Very high	64 Å²	64	37 Å²	37	45%	0.448	22%	0.219	S	C	.	.			trans	-76.1	152	176.7	64.7	0	0	0	0	111.8	A578 T579 L580	S576-A578 PolarHBondContact O-N 3.45Å; S576-A578 VanDerWaalsContact O-N 3.15Å; S576-T579 WeakPolarHBondContact O-CA 3.19Å; S576-T579 WeakPolarHBondContact O-CB 3.49Å; S576-T579 PolarHBondContact O-N 2.82Å; S576-T579 PolarHBondContact OG-N 3.46Å; S576-T579 PolarHBondContact OG-OG1 3.3Å; S576-L580 PolarHBondContact O-N 3.2Å
577	E	94	Very high	96.4	Very high	73 Å²	73	34 Å²	34	34%	0.341	20%	0.197	S	C	.	.	H	α-helix	trans	-53.8	-34.7	172.6	-171.7	-166.9	125.4	0	0	112	L523 L561 T579 L580 R581	L523-E577 PolarHBondContact N-OE1 3.05Å; L561-E577 HydrophobicContact CD2-CG 4.24Å; E577-T579 VanDerWaalsContact C-N 3.33Å; E577-T579 PolarHBondContact O-N 2.89Å; E577-L580 PolarHBondContact O-N 3.37Å; E577-R581 WeakPolarHBondContact O-CB 3.24Å; E577-R581 PolarHBondContact O-N 3.39Å; E577-R581 IonicContact OE1-CZ 3.52Å; E577-R581 IonicContact OE1-NH2 2.66Å; E577-R581 PolarHBondContact OE1-NH2 2.8Å
578	A	93.3	Very high	96.4	Very high	58 Å²	58	33.1 Å²	33.1	48%	0.479	19%	0.194	S	C	.	.	H	α-helix	trans	-63.9	-36.5	175.1	0	0	0	0	0	113	S576 S582	S576-A578 PolarHBondContact O-N 3.45Å; S576-A578 VanDerWaalsContact O-N 3.15Å; A578-S582 WeakPolarHBondContact O-CB 3.41Å; A578-S582 PolarHBondContact O-N 3.15Å; A578-S582 PolarHBondContact O-OG 3.26Å
579	T	95.9	Very high	96.4	Very high	26 Å²	26	35.9 Å²	35.9	16%	0.16	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-46.5	175.1	-53.7	0	0	0	0	109.9	C575 S576 E577 R581 S582 W583 K684 I687	C575-T579 HydrophobicContact CB-CG2 4.44Å; S576-T579 WeakPolarHBondContact O-CA 3.19Å; S576-T579 WeakPolarHBondContact O-CB 3.49Å; S576-T579 PolarHBondContact O-N 2.82Å; S576-T579 PolarHBondContact OG-N 3.46Å; S576-T579 PolarHBondContact OG-OG1 3.3Å; E577-T579 VanDerWaalsContact C-N 3.33Å; E577-T579 PolarHBondContact O-N 2.89Å; T579-R581 PolarHBondContact O-N 3.47Å; T579-S582 PolarHBondContact O-N 3.23Å; T579-W583 WeakPolarHBondContact O-CB 3.35Å; T579-W583 PolarHBondContact O-N 3.06Å; T579-K684 WeakPolarHBondContact CA-O 3.36Å; T579-K684 WeakPolarHBondContact CG2-O 3.33Å; T579-I687 HydrophobicContact CG2-CG2 4.15Å
580	L	96.6	Very high	96.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.2	-44.9	176.2	175.1	63.1	0	0	0	111.8	L561 F564 C570 S576 E577 W583 L584 I687	L561-L580 HydrophobicContact CD2-CD2 4.22Å; L561-L580 HydrophobicContact CD2-CG 4.28Å; F564-L580 HydrophobicContact CB-CD2 3.56Å; F564-L580 HydrophobicContact CD1-CD1 3.42Å; F564-L580 VanDerWaalsContact CD1-CD1 3.42Å; F564-L580 HydrophobicContact CD1-CD2 3.98Å; F564-L580 HydrophobicContact CD1-CG 4.33Å; F564-L580 HydrophobicContact CE1-CD1 3.84Å; F564-L580 HydrophobicContact CG-CD1 4.2Å; F564-L580 HydrophobicContact CG-CD2 4.12Å; C570-L580 WeakPolarHBondContact SG-CD2 3.42Å; S576-L580 PolarHBondContact O-N 3.2Å; E577-L580 PolarHBondContact O-N 3.37Å; L580-W583 HydrophobicContact CD1-CE3 4.02Å; L580-W583 HydrophobicContact CD1-CZ3 4.5Å; L580-W583 WeakPolarHBondContact O-CB 3.4Å; L580-W583 PolarHBondContact O-N 3.3Å; L580-L584 HydrophobicContact CD1-CD1 4.14Å; L580-L584 HydrophobicContact CD1-CG 4.19Å; L580-L584 HydrophobicContact CG-CD1 4.03Å; L580-L584 WeakPolarHBondContact O-CG 3.15Å; L580-L584 PolarHBondContact O-N 2.84Å; L580-I687 HydrophobicContact CD1-CG2 4.38Å
581	R	93.1	Very high	96.5	Very high	16 Å²	16	37.4 Å²	37.4	6%	0.06	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-49	175.3	-179.4	177.1	-59.9	128	16.6	111.6	V521 T522 L523 L561 E577 T579 W583 L584 Q585	V521-R581 WeakPolarHBondContact O-CD 3.5Å; V521-R581 PolarHBondContact O-NE 2.78Å; V521-R581 PolarHBondContact O-NH1 3.46Å; V521-R581 PolarHBondContact O-NH2 3.48Å; T522-R581 VanDerWaalsContact CA-NH2 3.32Å; L523-R581 VanDerWaalsContact N-NH2 3.2Å; L561-R581 HydrophobicContact CD1-CB 4.42Å; L561-R581 HydrophobicContact CD1-CG 4.24Å; L561-R581 HydrophobicContact CD2-CB 4.05Å; E577-R581 WeakPolarHBondContact O-CB 3.24Å; E577-R581 PolarHBondContact O-N 3.39Å; E577-R581 IonicContact OE1-CZ 3.52Å; E577-R581 IonicContact OE1-NH2 2.66Å; E577-R581 PolarHBondContact OE1-NH2 2.8Å; T579-R581 PolarHBondContact O-N 3.47Å; R581-W583 PolarHBondContact O-N 3.37Å; R581-L584 PolarHBondContact O-N 3.17Å; R581-Q585 HydrophobicContact CG-CG 4.23Å; R581-Q585 WeakPolarHBondContact O-CB 3.31Å; R581-Q585 VanDerWaalsContact O-CG 3.25Å; R581-Q585 WeakPolarHBondContact O-CG 3.45Å; R581-Q585 PolarHBondContact O-N 3.48Å
582	S	95.8	Very high	96.6	Very high	40 Å²	40	33.8 Å²	33.8	28%	0.28	20%	0.199	S	C	.	.	H	α-helix	trans	-59.5	-40.1	-179.6	-57.6	0	0	0	0	110.7	A578 T579 L586	A578-S582 WeakPolarHBondContact O-CB 3.41Å; A578-S582 PolarHBondContact O-N 3.15Å; A578-S582 PolarHBondContact O-OG 3.26Å; T579-S582 PolarHBondContact O-N 3.23Å; S582-L586 VanDerWaalsContact O-CB 3.31Å; S582-L586 WeakPolarHBondContact O-CB 2.99Å; S582-L586 PolarHBondContact O-N 3.04Å
583	W	98.3	Very high	96.5	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-49	174.8	-178.4	78.1	0	0	0	113.2	F564 T579 L580 R581 Q585 L586 M587 I633 T636 V637 T679 S685 I687	F564-W583 AromaticContact CE1-CZ3 3.96Å; F564-W583 HydrophobicContact CE1-CZ3 3.96Å; F564-W583 HydrophobicContact CZ-CH2 4.48Å; F564-W583 AromaticContact CZ-CZ3 3.98Å; F564-W583 HydrophobicContact CZ-CZ3 3.98Å; T579-W583 WeakPolarHBondContact O-CB 3.35Å; T579-W583 PolarHBondContact O-N 3.06Å; L580-W583 HydrophobicContact CD1-CE3 4.02Å; L580-W583 HydrophobicContact CD1-CZ3 4.5Å; L580-W583 WeakPolarHBondContact O-CB 3.4Å; L580-W583 PolarHBondContact O-N 3.3Å; R581-W583 PolarHBondContact O-N 3.37Å; W583-Q585 VanDerWaalsContact C-N 3.33Å; W583-Q585 PolarHBondContact O-N 3.35Å; W583-L586 WeakPolarHBondContact O-CB 3.44Å; W583-L586 PolarHBondContact O-N 3.15Å; W583-L586 VanDerWaalsContact O-N 3.13Å; W583-M587 HydrophobicContact CD2-CG 4.1Å; W583-M587 HydrophobicContact CE3-CG 4.49Å; W583-M587 HydrophobicContact CH2-CG 4.24Å; W583-M587 HydrophobicContact CZ2-CG 3.83Å; W583-M587 HydrophobicContact CZ2-SD 4.2Å; W583-M587 WeakPolarHBondContact O-CG 3.24Å; W583-M587 PolarHBondContact O-N 3.24Å; W583-I633 HydrophobicContact CH2-CG1 4.39Å; W583-I633 HydrophobicContact CH2-CG2 4.01Å; W583-I633 HydrophobicContact CZ2-CG2 4.08Å; W583-T636 HydrophobicContact CH2-CG2 3.66Å; W583-T636 HydrophobicContact CZ3-CG2 3.74Å; W583-V637 HydrophobicContact CH2-CG1 3.93Å; W583-V637 HydrophobicContact CZ2-CG1 3.69Å; W583-T679 PolarHBondContact NE1-OG1 2.58Å; W583-S685 WeakPolarHBondContact CB-O 3.41Å; W583-I687 HydrophobicContact CB-CG2 3.6Å; W583-I687 HydrophobicContact CD2-CD1 3.69Å; W583-I687 HydrophobicContact CD2-CG1 4.23Å; W583-I687 HydrophobicContact CD2-CG2 4.2Å; W583-I687 HydrophobicContact CE3-CD1 3.99Å; W583-I687 HydrophobicContact CG-CD1 4.17Å; W583-I687 HydrophobicContact CG-CG1 4.19Å; W583-I687 HydrophobicContact CG-CG2 3.76Å; W583-I687 HydrophobicContact CH2-CD1 4.22Å; W583-I687 HydrophobicContact CZ2-CD1 3.92Å; W583-I687 HydrophobicContact CZ3-CD1 4.24Å
584	L	98.2	Very high	96.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-42.8	177.3	-75.8	168.1	0	0	0	111.9	T557 L561 L580 R581 L586 M587 E588 T636	T557-L584 HydrophobicContact CG2-CB 4.39Å; L561-L584 HydrophobicContact CB-CD1 4.47Å; L561-L584 HydrophobicContact CD2-CD1 4.02Å; L561-L584 HydrophobicContact CG-CD1 3.79Å; L580-L584 HydrophobicContact CD1-CD1 4.14Å; L580-L584 HydrophobicContact CD1-CG 4.19Å; L580-L584 HydrophobicContact CG-CD1 4.03Å; L580-L584 WeakPolarHBondContact O-CG 3.15Å; L580-L584 PolarHBondContact O-N 2.84Å; R581-L584 PolarHBondContact O-N 3.17Å; L584-L586 VanDerWaalsContact C-N 3.31Å; L584-L586 PolarHBondContact O-N 3.11Å; L584-M587 PolarHBondContact O-N 3.17Å; L584-E588 VanDerWaalsContact O-CB 3.27Å; L584-E588 WeakPolarHBondContact O-CB 3.41Å; L584-E588 PolarHBondContact O-N 3.36Å; L584-T636 HydrophobicContact CD2-CG2 3.86Å
585	Q	96.5	Very high	96.6	Very high	43 Å²	43	36.4 Å²	36.4	20%	0.201	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-37.5	175.8	-69.8	-179.9	-21.3	0	0	112	T557 R581 W583 A589	T557-Q585 HydrophobicContact CG2-CG 3.72Å; R581-Q585 HydrophobicContact CG-CG 4.23Å; R581-Q585 WeakPolarHBondContact O-CB 3.31Å; R581-Q585 VanDerWaalsContact O-CG 3.25Å; R581-Q585 WeakPolarHBondContact O-CG 3.45Å; R581-Q585 PolarHBondContact O-N 3.48Å; W583-Q585 VanDerWaalsContact C-N 3.33Å; W583-Q585 PolarHBondContact O-N 3.35Å; Q585-A589 WeakPolarHBondContact O-CB 3.21Å; Q585-A589 PolarHBondContact O-N 3.47Å
586	L	97.4	Very high	96.7	Very high	34 Å²	34	37.8 Å²	37.8	18%	0.178	24%	0.238	C	C	.	.	H	α-helix	trans	-66.1	-44.8	175.3	-179.3	62.7	0	0	0	111.3	S582 W583 L584 N590 L678	S582-L586 VanDerWaalsContact O-CB 3.31Å; S582-L586 WeakPolarHBondContact O-CB 2.99Å; S582-L586 PolarHBondContact O-N 3.04Å; W583-L586 WeakPolarHBondContact O-CB 3.44Å; W583-L586 PolarHBondContact O-N 3.15Å; W583-L586 VanDerWaalsContact O-N 3.13Å; L584-L586 VanDerWaalsContact C-N 3.31Å; L584-L586 PolarHBondContact O-N 3.11Å; L586-N590 PolarHBondContact O-N 3.25Å; L586-N590 PolarHBondContact O-ND2 2.86Å; L586-L678 HydrophobicContact CD1-CD2 4.4Å; L586-L678 HydrophobicContact CD2-CB 3.93Å; L586-L678 WeakPolarHBondContact CD2-O 3.33Å; L586-L678 HydrophobicContact CG-CB 4.29Å
587	M	98.2	Very high	96.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-51.5	176.4	-64.1	-54.9	102.7	0	0	110.7	W583 L584 A589 N590 Y591 V637 A675 L678	W583-M587 HydrophobicContact CD2-CG 4.1Å; W583-M587 HydrophobicContact CE3-CG 4.49Å; W583-M587 HydrophobicContact CH2-CG 4.24Å; W583-M587 HydrophobicContact CZ2-CG 3.83Å; W583-M587 HydrophobicContact CZ2-SD 4.2Å; W583-M587 WeakPolarHBondContact O-CG 3.24Å; W583-M587 PolarHBondContact O-N 3.24Å; L584-M587 PolarHBondContact O-N 3.17Å; M587-A589 VanDerWaalsContact C-N 3.28Å; M587-A589 PolarHBondContact O-N 3.36Å; M587-N590 PolarHBondContact O-N 2.87Å; M587-Y591 WeakPolarHBondContact O-CD2 3.38Å; M587-Y591 PolarHBondContact O-N 3.42Å; M587-V637 HydrophobicContact CG-CG1 4.11Å; M587-V637 HydrophobicContact SD-CG1 3.82Å; M587-A675 HydrophobicContact SD-CB 4.35Å; M587-L678 HydrophobicContact CE-CB 3.69Å; M587-L678 HydrophobicContact CE-CD1 4.03Å
588	E	98.2	Very high	97.1	Very high	10 Å²	10	33.1 Å²	33.1	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-58.1	-37.8	179.6	-178.6	173.5	-105.8	0	0	112.7	R554 L556 T557 L584 N590 Y591	R554-E588 WeakPolarHBondContact CA-OE1 3.21Å; R554-E588 WeakPolarHBondContact CB-OE2 3.29Å; R554-E588 IonicContact CZ-OE2 3.14Å; R554-E588 IonicContact NE-OE2 3.89Å; R554-E588 PolarHBondContact NE-OE2 3.08Å; R554-E588 VanDerWaalsContact NE-OE2 3.09Å; R554-E588 IonicContact NH2-OE2 2.84Å; R554-E588 VanDerWaalsContact O-OE1 3.08Å; L556-E588 HydrophobicContact CB-CB 4.39Å; L556-E588 HydrophobicContact CB-CG 4.33Å; L556-E588 WeakPolarHBondContact CB-OE1 3.2Å; L556-E588 HydrophobicContact CD2-CB 4.27Å; L556-E588 PolarHBondContact N-OE1 3.35Å; T557-E588 WeakPolarHBondContact CB-OE2 3.47Å; T557-E588 PolarHBondContact N-OE1 3.47Å; T557-E588 VanDerWaalsContact OG1-CD 3.26Å; T557-E588 PolarHBondContact OG1-OE2 3.29Å; L584-E588 VanDerWaalsContact O-CB 3.27Å; L584-E588 WeakPolarHBondContact O-CB 3.41Å; L584-E588 PolarHBondContact O-N 3.36Å; E588-N590 PolarHBondContact O-N 3.46Å; E588-Y591 PolarHBondContact O-N 3.33Å; E588-Y591 VanDerWaalsContact O-N 3.12Å
589	A	96.8	Very high	97.3	Very high	75 Å²	75	30.8 Å²	30.8	62%	0.62	19%	0.188	S	C	*	.	H	α-helix	trans	-67.3	-20	177.2	0	0	0	0	0	113.9	Q585 M587	Q585-A589 WeakPolarHBondContact O-CB 3.21Å; Q585-A589 PolarHBondContact O-N 3.47Å; M587-A589 VanDerWaalsContact C-N 3.28Å; M587-A589 PolarHBondContact O-N 3.36Å
590	N	98.1	Very high	97.4	Very high	42 Å²	42	29.8 Å²	29.8	23%	0.225	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	4.9	175.4	-70.6	-94.7	0	0	0	112.1	L586 M587 E588 V640 D641 L678	L586-N590 PolarHBondContact O-N 3.25Å; L586-N590 PolarHBondContact O-ND2 2.86Å; M587-N590 PolarHBondContact O-N 2.87Å; E588-N590 PolarHBondContact O-N 3.46Å; N590-V640 HydrophobicContact CB-CG2 3.66Å; N590-D641 WeakPolarHBondContact O-CA 3.39Å; N590-D641 PolarHBondContact O-N 3.32Å; N590-L678 HydrophobicContact CB-CD1 4.09Å; N590-L678 WeakPolarHBondContact ND2-CD1 3.49Å
591	Y	98.6	Very high	97.5	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.035	18%	0.182	C	C	.	.	S	Bend	trans	-86.8	129.9	162.9	-85.2	-86.9	0	0	0	110	L556 M587 E588 S593 A603 T636 D639 V640	L556-Y591 HydrophobicContact CD2-CD2 4.19Å; L556-Y591 HydrophobicContact CD2-CE2 4.05Å; M587-Y591 WeakPolarHBondContact O-CD2 3.38Å; M587-Y591 PolarHBondContact O-N 3.42Å; E588-Y591 PolarHBondContact O-N 3.33Å; E588-Y591 VanDerWaalsContact O-N 3.12Å; Y591-S593 PolarHBondContact O-N 3.45Å; Y591-S593 VanDerWaalsContact O-N 3.08Å; Y591-A603 HydrophobicContact CE1-CB 3.77Å; Y591-A603 HydrophobicContact CE2-CB 3.89Å; Y591-A603 VanDerWaalsContact CZ-CB 3.42Å; Y591-A603 WeakPolarHBondContact OH-CB 3.4Å; Y591-T636 PolarHBondContact OH-O 2.94Å; Y591-D639 HydrophobicContact CE1-CB 3.66Å; Y591-D639 WeakPolarHBondContact CE1-O 3.43Å; Y591-D639 PolarHBondContact OH-N 3.44Å; Y591-V640 HydrophobicContact CD2-CG2 4.36Å; Y591-V640 HydrophobicContact CE2-CB 3.97Å; Y591-V640 HydrophobicContact CE2-CG2 4.23Å; Y591-V640 PolarHBondContact OH-N 2.93Å
592	H	97.9	Very high	97.8	Very high	65 Å²	65	29 Å²	29	30%	0.301	18%	0.18	S	C	.	.			trans	-74.8	102.6	-178.1	-64.4	144	0	0	0	111.6	S594 N595 N599 D641 H642	H592-S594 PolarHBondContact O-N 3.34Å; H592-N595 WeakPolarHBondContact O-CB 3.43Å; H592-N595 PolarHBondContact O-N 3.04Å; H592-N599 WeakPolarHBondContact O-CB 3.46Å; H592-D641 IonicContact CE1-OD1 2.72Å; H592-D641 PolarHBondContact CE1-OD1 3.48Å; H592-D641 IonicContact NE2-OD1 2.79Å; H592-D641 PolarHBondContact NE2-OD1 3.16Å; H592-D641 VanDerWaalsContact NE2-OD1 3.16Å; H592-H642 PolarHBondContact ND1-O 2.75Å
593	S	96.3	Very high	97.9	Very high	74 Å²	74	27.1 Å²	27.1	52%	0.517	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.7	176.1	63.8	0	0	0	0	114.9	K553 Y591	K553-S593 PolarHBondContact NZ-O 3.26Å; Y591-S593 PolarHBondContact O-N 3.45Å; Y591-S593 VanDerWaalsContact O-N 3.08Å
594	S	96.4	Very high	98	Very high	102 Å²	102	27 Å²	27	71%	0.713	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-21.1	171.8	52.9	0	0	0	0	113.8	H592	H592-S594 PolarHBondContact O-N 3.34Å
595	N	98.1	Very high	98	Very high	19 Å²	19	27 Å²	27	10%	0.102	17%	0.166	C	C	.	.	S	Bend	trans	-70.1	139.4	176	-68.8	-4.4	0	0	0	109.6	H592 H598 N599 H642 G644	H592-N595 WeakPolarHBondContact O-CB 3.43Å; H592-N595 PolarHBondContact O-N 3.04Å; N595-H598 WeakPolarHBondContact CB-O 3.45Å; N595-H598 PolarHBondContact ND2-O 3.38Å; N595-N599 HydrophobicContact CB-CB 4.47Å; N595-N599 PolarHBondContact O-ND2 3.47Å; N595-H642 PolarHBondContact ND2-O 3.11Å; N595-G644 PolarHBondContact ND2-N 2.67Å
596	S	97.7	Very high	98.1	Very high	42 Å²	42	25 Å²	25	29%	0.294	16%	0.156	S	C	.	.	S	Bend	trans	-70.5	-41.4	179.2	-61.8	0	0	0	0	111.1	N599 R787 E791	S596-N599 PolarHBondContact O-ND2 3.16Å; S596-R787 VanDerWaalsContact CB-O 3.25Å; S596-R787 WeakPolarHBondContact CB-O 3.41Å; S596-R787 WeakPolarHBondContact O-CB 3.22Å; S596-R787 WeakPolarHBondContact O-CD 3.41Å; S596-R787 WeakPolarHBondContact O-CG 3.5Å; S596-E791 PolarHBondContact N-OE2 2.87Å
597	Y	98.6	Very high	98.2	Very high	13 Å²	13	23.4 Å²	23.4	5%	0.051	15%	0.148	C	C	.	.	S	Bend	trans	-112	-60.8	-176.7	-176.2	-88.6	0	0	0	112.3	N599 H602 N773 W784 R787 I788 E791	Y597-N599 PolarHBondContact O-N 2.99Å; Y597-H602 HydrophobicContact CE1-CB 4.5Å; Y597-H602 AromaticContact CE1-CD2 3.91Å; Y597-H602 AromaticContact CE1-CE1 3.62Å; Y597-H602 AromaticContact CE1-CG 3.72Å; Y597-H602 AromaticContact CE1-ND1 3.54Å; Y597-H602 AromaticContact CE1-NE2 3.84Å; Y597-H602 AromaticContact CZ-CE1 3.72Å; Y597-H602 AromaticContact CZ-ND1 3.49Å; Y597-H602 VanDerWaalsContact O-CB 3.22Å; Y597-H602 WeakPolarHBondContact O-CB 3.47Å; Y597-H602 PolarHBondContact OH-CE1 2.78Å; Y597-H602 VanDerWaalsContact OH-CE1 3.24Å; Y597-H602 PolarHBondContact OH-ND1 3.02Å; Y597-N773 VanDerWaalsContact CE2-ND2 3.33Å; Y597-N773 WeakPolarHBondContact CE2-ND2 3.34Å; Y597-N773 PolarHBondContact OH-ND2 3.33Å; Y597-W784 AromaticContact CD2-CE3 3.69Å; Y597-W784 HydrophobicContact CD2-CE3 3.69Å; Y597-W784 HydrophobicContact CD2-CZ3 4.14Å; Y597-W784 HydrophobicContact CE2-CB 4.49Å; Y597-W784 HydrophobicContact CE2-CD2 4.35Å; Y597-W784 AromaticContact CE2-CE3 3.62Å; Y597-W784 HydrophobicContact CE2-CE3 3.62Å; Y597-W784 HydrophobicContact CE2-CZ3 4.25Å; Y597-R787 HydrophobicContact CD2-CB 4.1Å; Y597-I788 HydrophobicContact CD1-CD1 3.75Å; Y597-I788 HydrophobicContact CD2-CB 3.6Å; Y597-I788 HydrophobicContact CD2-CD1 4.17Å; Y597-I788 HydrophobicContact CD2-CG1 4.36Å; Y597-I788 HydrophobicContact CE1-CD1 4.25Å; Y597-I788 HydrophobicContact CE2-CB 4.07Å; Y597-I788 HydrophobicContact CG-CB 3.97Å; Y597-I788 HydrophobicContact CG-CD1 3.7Å; Y597-I788 HydrophobicContact CG-CG1 4.37Å; Y597-E791 WeakPolarHBondContact CA-OE2 3.33Å; Y597-E791 PolarHBondContact N-OE2 3.1Å
598	H	98.7	Very high	98.2	Very high	26 Å²	26	23.4 Å²	23.4	12%	0.12	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	64.4	-173.3	-62.1	99	0	0	0	111.8	N595 D639 H642 E791	N595-H598 WeakPolarHBondContact CB-O 3.45Å; N595-H598 PolarHBondContact ND2-O 3.38Å; H598-D639 IonicContact CD2-OD2 3.51Å; H598-D639 PolarHBondContact CD2-OD2 3.42Å; H598-H642 HydrophobicContact CB-CB 3.85Å; H598-H642 VanDerWaalsContact CB-ND1 3.3Å; H598-H642 WeakPolarHBondContact CB-ND1 3.41Å; H598-H642 AromaticContact CE1-CE1 3.77Å; H598-H642 AromaticContact CG-CE1 3.56Å; H598-H642 AromaticContact CG-CG 3.79Å; H598-H642 AromaticContact CG-ND1 3.43Å; H598-H642 AromaticContact CG-NE2 3.96Å; H598-H642 AromaticContact ND1-CE1 3.32Å; H598-H642 PolarHBondContact ND1-CE1 3.11Å; H598-H642 VanDerWaalsContact ND1-CE1 3.32Å; H598-H642 AromaticContact ND1-ND1 3.59Å; H598-H642 AromaticContact ND1-NE2 3.91Å; H598-E791 IonicContact CE1-OE1 3.19Å; H598-E791 IonicContact CG-OE1 3.65Å; H598-E791 PolarHBondContact N-OE2 2.97Å; H598-E791 VanDerWaalsContact N-OE2 3.12Å; H598-E791 IonicContact ND1-OE1 2.79Å; H598-E791 PolarHBondContact ND1-OE1 2.96Å; H598-E791 IonicContact ND1-OE2 3.45Å
599	N	98.4	Very high	98.2	Very high	9 Å²	9	22.9 Å²	22.9	5%	0.048	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-178.5	174.4	60.9	51.1	0	0	0	110.1	H592 N595 S596 Y597 T601 H602 A603	H592-N599 WeakPolarHBondContact O-CB 3.46Å; N595-N599 HydrophobicContact CB-CB 4.47Å; N595-N599 PolarHBondContact O-ND2 3.47Å; S596-N599 PolarHBondContact O-ND2 3.16Å; Y597-N599 PolarHBondContact O-N 2.99Å; N599-T601 PolarHBondContact O-N 3.3Å; N599-T601 VanDerWaalsContact O-N 3.15Å; N599-T601 WeakPolarHBondContact OD1-CB 3.28Å; N599-T601 PolarHBondContact OD1-N 3.11Å; N599-T601 PolarHBondContact OD1-OG1 3.03Å; N599-H602 PolarHBondContact O-N 2.99Å; N599-H602 VanDerWaalsContact O-N 3.13Å; N599-A603 PolarHBondContact O-N 2.93Å
600	S	98.6	Very high	98.3	Very high	5 Å²	5	19.3 Å²	19.3	4%	0.035	12%	0.116	C	C	.	.	H	α-helix	trans	-63.8	-21.1	-175.3	56.3	0	0	0	0	114	A604	S600-A604 WeakPolarHBondContact O-CB 3.42Å; S600-A604 PolarHBondContact O-N 3.5Å
601	T	98.8	Very high	98.4	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-69.9	-39.1	175.5	-51.1	0	0	0	0	111.6	I544 E548 P555 N599 A604 D605 W784	I544-T601 HydrophobicContact CG1-CG2 3.97Å; E548-T601 HydrophobicContact CB-CG2 3.93Å; E548-T601 VanDerWaalsContact CD-OG1 3.31Å; E548-T601 HydrophobicContact CG-CG2 4.22Å; E548-T601 WeakPolarHBondContact CG-OG1 3.33Å; E548-T601 WeakPolarHBondContact OE1-CB 3.16Å; E548-T601 PolarHBondContact OE1-OG1 3.05Å; P555-T601 HydrophobicContact CG-CG2 4.17Å; P555-T601 WeakPolarHBondContact CG-OG1 3.23Å; N599-T601 PolarHBondContact O-N 3.3Å; N599-T601 VanDerWaalsContact O-N 3.15Å; N599-T601 WeakPolarHBondContact OD1-CB 3.28Å; N599-T601 PolarHBondContact OD1-N 3.11Å; N599-T601 PolarHBondContact OD1-OG1 3.03Å; T601-A604 PolarHBondContact O-N 3.47Å; T601-D605 PolarHBondContact O-N 3.47Å; T601-W784 HydrophobicContact CG2-CH2 3.88Å; T601-W784 HydrophobicContact CG2-CZ2 4.25Å
602	H	98.8	Very high	98.4	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.7	-50.4	172.5	170.2	57.8	0	0	0	110.4	Y597 N599 A604 D605 V606 H638 D639 D770 W784	Y597-H602 HydrophobicContact CE1-CB 4.5Å; Y597-H602 AromaticContact CE1-CD2 3.91Å; Y597-H602 AromaticContact CE1-CE1 3.62Å; Y597-H602 AromaticContact CE1-CG 3.72Å; Y597-H602 AromaticContact CE1-ND1 3.54Å; Y597-H602 AromaticContact CE1-NE2 3.84Å; Y597-H602 AromaticContact CZ-CE1 3.72Å; Y597-H602 AromaticContact CZ-ND1 3.49Å; Y597-H602 VanDerWaalsContact O-CB 3.22Å; Y597-H602 WeakPolarHBondContact O-CB 3.47Å; Y597-H602 PolarHBondContact OH-CE1 2.78Å; Y597-H602 VanDerWaalsContact OH-CE1 3.24Å; Y597-H602 PolarHBondContact OH-ND1 3.02Å; N599-H602 PolarHBondContact O-N 2.99Å; N599-H602 VanDerWaalsContact O-N 3.13Å; H602-A604 PolarHBondContact O-N 2.74Å; H602-D605 WeakPolarHBondContact O-CA 3.44Å; H602-D605 WeakPolarHBondContact O-CB 3.48Å; H602-D605 PolarHBondContact O-N 3.28Å; H602-V606 WeakPolarHBondContact CE1-CG2 3.48Å; H602-V606 WeakPolarHBondContact O-CG2 3.28Å; H602-V606 PolarHBondContact O-N 3.33Å; H602-H638 AromaticContact CD2-NE2 3.91Å; H602-H638 AromaticContact NE2-CE1 3.77Å; H602-H638 AromaticContact NE2-NE2 3.26Å; H602-H638 PolarHBondContact NE2-NE2 2.84Å; H602-D639 IonicContact CD2-OD2 3.08Å; H602-D639 PolarHBondContact CD2-OD2 2.67Å; H602-D639 IonicContact NE2-OD2 2.72Å; H602-D639 PolarHBondContact NE2-OD2 2.89Å; H602-D639 VanDerWaalsContact NE2-OD2 3.1Å; H602-D770 IonicContact CE1-OD1 2.73Å; H602-D770 PolarHBondContact CE1-OD1 3.01Å; H602-D770 IonicContact NE2-OD1 3.47Å; H602-D770 PolarHBondContact NE2-OD1 3.45Å; H602-W784 HydrophobicContact CB-CH2 4.16Å; H602-W784 HydrophobicContact CB-CZ3 4.17Å
603	A	98.8	Very high	98.4	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57.1	-37.7	176.4	0	0	0	0	0	113.1	L556 Y591 N599 L607	L556-A603 HydrophobicContact CD1-CB 4.25Å; L556-A603 HydrophobicContact CD2-CB 4.14Å; Y591-A603 HydrophobicContact CE1-CB 3.77Å; Y591-A603 HydrophobicContact CE2-CB 3.89Å; Y591-A603 VanDerWaalsContact CZ-CB 3.42Å; Y591-A603 WeakPolarHBondContact OH-CB 3.4Å; N599-A603 PolarHBondContact O-N 2.93Å; A603-L607 VanDerWaalsContact O-CB 3.32Å; A603-L607 WeakPolarHBondContact O-CB 3.47Å; A603-L607 PolarHBondContact O-N 3.3Å
604	A	98.8	Very high	98.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-68	-37.6	175.2	0	0	0	0	0	112.3	I544 P555 L556 L559 S600 T601 H602 L607 H608	I544-A604 HydrophobicContact CD1-CB 3.82Å; I544-A604 HydrophobicContact CG1-CB 4.47Å; P555-A604 HydrophobicContact CB-CB 4.05Å; P555-A604 HydrophobicContact CG-CB 4.09Å; L556-A604 HydrophobicContact CB-CB 4.2Å; L556-A604 HydrophobicContact CD1-CB 4.16Å; L559-A604 HydrophobicContact CD2-CB 4.2Å; L559-A604 WeakPolarHBondContact CD2-O 3.38Å; S600-A604 WeakPolarHBondContact O-CB 3.42Å; S600-A604 PolarHBondContact O-N 3.5Å; T601-A604 PolarHBondContact O-N 3.47Å; H602-A604 PolarHBondContact O-N 2.74Å; A604-L607 PolarHBondContact O-N 2.82Å; A604-H608 WeakPolarHBondContact O-CB 3.49Å; A604-H608 PolarHBondContact O-N 3.38Å
605	D	98.8	Very high	98.5	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-67	-41.2	174.9	-163.8	57.3	0	0	0	112.3	I544 T601 H602 H608 A609 R776 W784	I544-D605 HydrophobicContact CG1-CB 4.2Å; I544-D605 HydrophobicContact CG2-CB 4.32Å; T601-D605 PolarHBondContact O-N 3.47Å; H602-D605 WeakPolarHBondContact O-CA 3.44Å; H602-D605 WeakPolarHBondContact O-CB 3.48Å; H602-D605 PolarHBondContact O-N 3.28Å; D605-H608 WeakPolarHBondContact O-CB 3.48Å; D605-H608 PolarHBondContact O-N 2.92Å; D605-A609 PolarHBondContact O-N 2.85Å; D605-R776 PolarHBondContact O-NH2 3.43Å; D605-R776 VanDerWaalsContact O-NH2 3.12Å; D605-R776 IonicContact OD1-CZ 3.54Å; D605-R776 IonicContact OD1-NE 3.16Å; D605-R776 PolarHBondContact OD1-NE 2.91Å; D605-R776 IonicContact OD1-NH2 2.7Å; D605-R776 PolarHBondContact OD1-NH2 2.87Å; D605-R776 IonicContact OD2-CZ 3.51Å; D605-R776 IonicContact OD2-NE 3.8Å; D605-R776 PolarHBondContact OD2-NE 3.22Å; D605-R776 VanDerWaalsContact OD2-NE 3.08Å; D605-R776 IonicContact OD2-NH2 2.72Å; D605-R776 PolarHBondContact OD2-NH2 3.12Å; D605-W784 HydrophobicContact CB-CZ2 3.91Å
606	V	98.9	Very high	98.5	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-65.5	-40	175.3	179.5	0	0	0	0	110.9	H602 A609 T610 A635 I766 A769	H602-V606 WeakPolarHBondContact CE1-CG2 3.48Å; H602-V606 WeakPolarHBondContact O-CG2 3.28Å; H602-V606 PolarHBondContact O-N 3.33Å; V606-A609 PolarHBondContact O-N 2.9Å; V606-T610 VanDerWaalsContact O-CB 3.25Å; V606-T610 WeakPolarHBondContact O-CB 3.33Å; V606-T610 PolarHBondContact O-N 3.12Å; V606-T610 PolarHBondContact O-OG1 3.45Å; V606-A635 HydrophobicContact CG1-CB 4.07Å; V606-I766 HydrophobicContact CG1-CD1 3.98Å; V606-A769 HydrophobicContact CG1-CB 3.99Å
607	L	98.9	Very high	98.2	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.2	-43.9	173.6	176.1	61.6	0	0	0	111.7	L556 I563 F564 A603 A604 T610 A611 L632 A635	L556-L607 HydrophobicContact CD1-CD2 4.11Å; I563-L607 HydrophobicContact CD1-CD2 4.39Å; I563-L607 HydrophobicContact CD1-CG 3.99Å; I563-L607 HydrophobicContact CG2-CD1 4.39Å; F564-L607 HydrophobicContact CE2-CD1 3.97Å; F564-L607 HydrophobicContact CE2-CD2 4.21Å; A603-L607 VanDerWaalsContact O-CB 3.32Å; A603-L607 WeakPolarHBondContact O-CB 3.47Å; A603-L607 PolarHBondContact O-N 3.3Å; A604-L607 PolarHBondContact O-N 2.82Å; L607-T610 WeakPolarHBondContact O-CB 3.37Å; L607-T610 PolarHBondContact O-N 3.34Å; L607-A611 WeakPolarHBondContact O-CB 3.26Å; L607-A611 PolarHBondContact O-N 3.37Å; L607-L632 HydrophobicContact CD1-CB 4.14Å; L607-L632 HydrophobicContact CD1-CD2 3.69Å; L607-A635 HydrophobicContact CB-CB 4.36Å; L607-A635 HydrophobicContact CD1-CB 4.32Å
608	H	98.8	Very high	97.8	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.9	-48.6	175.4	170.3	-111.6	0	0	0	112.2	E537 R539 F542 L559 A604 D605 T610 A611 Y612 R776	E537-H608 PolarHBondContact O-CD2 3.28Å; E537-H608 PolarHBondContact O-NE2 2.88Å; R539-H608 PolarHBondContact O-CE1 3.36Å; R539-H608 VanDerWaalsContact O-CE1 3.28Å; R539-H608 PolarHBondContact O-NE2 2.75Å; F542-H608 WeakPolarHBondContact CB-NE2 3.3Å; L559-H608 HydrophobicContact CD2-CB 4.07Å; A604-H608 WeakPolarHBondContact O-CB 3.49Å; A604-H608 PolarHBondContact O-N 3.38Å; D605-H608 WeakPolarHBondContact O-CB 3.48Å; D605-H608 PolarHBondContact O-N 2.92Å; H608-T610 VanDerWaalsContact C-N 3.31Å; H608-T610 PolarHBondContact O-N 3.28Å; H608-A611 PolarHBondContact O-N 3.46Å; H608-Y612 PolarHBondContact O-N 2.81Å; H608-R776 PolarHBondContact CE1-NH1 3.34Å; H608-R776 PolarHBondContact ND1-NH1 2.86Å; H608-R776 VanDerWaalsContact ND1-NH1 3.13Å; H608-R776 PolarHBondContact ND1-NH2 3.24Å; H608-R776 VanDerWaalsContact ND1-NH2 3.14Å
609	A	98.8	Very high	97.6	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.1	-40.8	177.1	0	0	0	0	0	112.1	W540 D605 V606 Y612 F613 A769 A772	W540-A609 HydrophobicContact CH2-CB 3.91Å; W540-A609 HydrophobicContact CZ3-CB 3.8Å; D605-A609 PolarHBondContact O-N 2.85Å; V606-A609 PolarHBondContact O-N 2.9Å; A609-Y612 WeakPolarHBondContact O-CB 3.42Å; A609-Y612 PolarHBondContact O-N 3.41Å; A609-F613 HydrophobicContact CB-CE2 4.47Å; A609-F613 VanDerWaalsContact O-CD2 3.3Å; A609-F613 WeakPolarHBondContact O-CD2 3.39Å; A609-F613 VanDerWaalsContact O-CG 3.31Å; A609-F613 WeakPolarHBondContact O-CG 3.42Å; A609-F613 PolarHBondContact O-N 2.91Å; A609-A769 HydrophobicContact CB-CB 3.81Å; A609-A772 HydrophobicContact CB-CB 4.42Å
610	T	98.9	Very high	97.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.5	-50.3	174.4	-63.7	0	0	0	0	110.7	V606 L607 H608 Y612 F613 L614 A631 L632 A635 L765 A769	V606-T610 VanDerWaalsContact O-CB 3.25Å; V606-T610 WeakPolarHBondContact O-CB 3.33Å; V606-T610 PolarHBondContact O-N 3.12Å; V606-T610 PolarHBondContact O-OG1 3.45Å; L607-T610 WeakPolarHBondContact O-CB 3.37Å; L607-T610 PolarHBondContact O-N 3.34Å; H608-T610 VanDerWaalsContact C-N 3.31Å; H608-T610 PolarHBondContact O-N 3.28Å; T610-Y612 VanDerWaalsContact C-N 3.35Å; T610-Y612 PolarHBondContact O-N 3.47Å; T610-F613 PolarHBondContact O-N 3.39Å; T610-L614 HydrophobicContact CG2-CD1 4.19Å; T610-L614 WeakPolarHBondContact O-CG 3.21Å; T610-L614 PolarHBondContact O-N 2.77Å; T610-A631 HydrophobicContact CG2-CB 3.97Å; T610-L632 HydrophobicContact CG2-CD2 4.18Å; T610-A635 HydrophobicContact CG2-CB 4.15Å; T610-A635 WeakPolarHBondContact OG1-CB 3.28Å; T610-L765 HydrophobicContact CG2-CD2 3.67Å; T610-A769 WeakPolarHBondContact OG1-CB 3.21Å
611	A	98.7	Very high	96.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.6	-42.1	177.4	0	0	0	0	0	112.3	I563 F567 L607 H608 F613 L614 R615 L632	I563-A611 HydrophobicContact CD1-CB 3.95Å; I563-A611 HydrophobicContact CG1-CB 4.37Å; I563-A611 HydrophobicContact CG2-CB 3.81Å; F567-A611 HydrophobicContact CE2-CB 3.9Å; F567-A611 HydrophobicContact CZ-CB 4.3Å; L607-A611 WeakPolarHBondContact O-CB 3.26Å; L607-A611 PolarHBondContact O-N 3.37Å; H608-A611 PolarHBondContact O-N 3.46Å; A611-F613 VanDerWaalsContact C-N 3.34Å; A611-F613 PolarHBondContact O-N 2.96Å; A611-L614 PolarHBondContact O-N 3.03Å; A611-R615 WeakPolarHBondContact O-CG 3.29Å; A611-R615 PolarHBondContact O-N 2.86Å; A611-R615 VanDerWaalsContact O-N 3.16Å; A611-L632 HydrophobicContact CB-CD2 4.15Å
612	Y	98.6	Very high	96.6	Very high	24 Å²	24	27.9 Å²	27.9	9%	0.094	13%	0.128	C	C	.	.	H	α-helix	trans	-59.2	-43.5	175	-177.7	-93.9	0	0	0	112.2	E538 W540 H608 A609 T610 R615 K616 L843 L846	E538-Y612 WeakPolarHBondContact O-CD2 3.15Å; W540-Y612 HydrophobicContact CB-CD2 4.33Å; W540-Y612 HydrophobicContact CB-CE2 3.84Å; W540-Y612 HydrophobicContact CD2-CE1 4.48Å; W540-Y612 AromaticContact CE3-CD1 3.51Å; W540-Y612 HydrophobicContact CE3-CD1 3.51Å; W540-Y612 HydrophobicContact CE3-CD2 4.22Å; W540-Y612 AromaticContact CE3-CE1 3.89Å; W540-Y612 HydrophobicContact CE3-CE1 3.89Å; W540-Y612 AromaticContact CE3-CG 3.7Å; W540-Y612 HydrophobicContact CE3-CG 3.7Å; W540-Y612 AromaticContact CZ3-CD1 3.92Å; W540-Y612 HydrophobicContact CZ3-CD1 3.92Å; W540-Y612 HydrophobicContact CZ3-CG 4.24Å; H608-Y612 PolarHBondContact O-N 2.81Å; A609-Y612 WeakPolarHBondContact O-CB 3.42Å; A609-Y612 PolarHBondContact O-N 3.41Å; T610-Y612 VanDerWaalsContact C-N 3.35Å; T610-Y612 PolarHBondContact O-N 3.47Å; Y612-R615 PolarHBondContact O-N 2.91Å; Y612-K616 VanDerWaalsContact CZ-CE 3.42Å; Y612-K616 VanDerWaalsContact CZ-NZ 3.33Å; Y612-K616 PolarHBondContact OH-NZ 3.32Å; Y612-L843 HydrophobicContact CE1-CD2 4.04Å; Y612-L846 HydrophobicContact CE1-CD1 3.84Å
613	F	98.6	Very high	96.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67.8	-42.1	177	-65.1	-31	0	0	0	112.9	W540 A609 T610 A611 R615 K616 V619 L765 C768 A769 F834 W837 L843 L846	W540-F613 HydrophobicContact CH2-CZ 4.2Å; W540-F613 HydrophobicContact CZ3-CE1 4.24Å; W540-F613 HydrophobicContact CZ3-CZ 4.26Å; A609-F613 HydrophobicContact CB-CE2 4.47Å; A609-F613 VanDerWaalsContact O-CD2 3.3Å; A609-F613 WeakPolarHBondContact O-CD2 3.39Å; A609-F613 VanDerWaalsContact O-CG 3.31Å; A609-F613 WeakPolarHBondContact O-CG 3.42Å; A609-F613 PolarHBondContact O-N 2.91Å; T610-F613 PolarHBondContact O-N 3.39Å; A611-F613 VanDerWaalsContact C-N 3.34Å; A611-F613 PolarHBondContact O-N 2.96Å; F613-R615 PolarHBondContact O-N 3.38Å; F613-K616 VanDerWaalsContact O-CB 3.3Å; F613-K616 WeakPolarHBondContact O-CB 3.36Å; F613-K616 PolarHBondContact O-N 3.26Å; F613-V619 VanDerWaalsContact O-CB 3.22Å; F613-V619 WeakPolarHBondContact O-CB 3.25Å; F613-V619 WeakPolarHBondContact O-CG2 3.2Å; F613-L765 HydrophobicContact CB-CD1 4.02Å; F613-L765 HydrophobicContact CB-CD2 4.49Å; F613-L765 HydrophobicContact CB-CG 3.95Å; F613-L765 HydrophobicContact CD2-CD2 4.49Å; F613-L765 HydrophobicContact CD2-CG 4.2Å; F613-C768 HydrophobicContact CE2-CB 3.84Å; F613-C768 HydrophobicContact CZ-CB 4.31Å; F613-A769 HydrophobicContact CD2-CB 4.26Å; F613-A769 HydrophobicContact CE2-CB 4.02Å; F613-F834 HydrophobicContact CZ-CE1 4.45Å; F613-W837 HydrophobicContact CB-CZ2 4.18Å; F613-W837 AromaticContact CD1-NE1 3.57Å; F613-W837 HydrophobicContact CD2-CZ2 4.45Å; F613-W837 AromaticContact CD2-NE1 3.74Å; F613-W837 AromaticContact CE1-NE1 3.6Å; F613-W837 AromaticContact CE2-NE1 3.75Å; F613-W837 HydrophobicContact CG-CZ2 4.24Å; F613-W837 AromaticContact CG-NE1 3.66Å; F613-W837 AromaticContact CZ-NE1 3.7Å; F613-L843 HydrophobicContact CD1-CD1 4.22Å; F613-L843 HydrophobicContact CD1-CD2 4.09Å; F613-L843 HydrophobicContact CE1-CD1 3.78Å; F613-L843 HydrophobicContact CE1-CD2 4.07Å; F613-L846 HydrophobicContact CE1-CD2 3.67Å; F613-L846 HydrophobicContact CZ-CD2 3.97Å
614	L	98.3	Very high	96.2	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-59.9	-29.6	176.8	-68.2	174.1	0	0	0	112.4	F567 T610 A611 K616 V619 L623 E628 A631 L632 L765	F567-L614 HydrophobicContact CE1-CB 3.72Å; F567-L614 HydrophobicContact CE1-CD1 3.97Å; F567-L614 HydrophobicContact CZ-CB 3.85Å; F567-L614 HydrophobicContact CZ-CD1 4.27Å; T610-L614 HydrophobicContact CG2-CD1 4.19Å; T610-L614 WeakPolarHBondContact O-CG 3.21Å; T610-L614 PolarHBondContact O-N 2.77Å; A611-L614 PolarHBondContact O-N 3.03Å; L614-K616 VanDerWaalsContact C-N 3.28Å; L614-K616 PolarHBondContact O-N 3.25Å; L614-V619 HydrophobicContact CD2-CG1 4.11Å; L614-L623 HydrophobicContact CD2-CD1 3.78Å; L614-E628 HydrophobicContact CD1-CB 4.31Å; L614-E628 HydrophobicContact CD2-CG 4.2Å; L614-A631 HydrophobicContact CD1-CB 4.2Å; L614-A631 HydrophobicContact CD2-CB 4.34Å; L614-L632 HydrophobicContact CD1-CD2 3.91Å; L614-L632 HydrophobicContact CD1-CG 3.92Å; L614-L765 HydrophobicContact CD2-CD1 3.64Å; L614-L765 HydrophobicContact CG-CD1 4.18Å
615	R	96.9	Very high	96	Very high	69 Å²	69	35.9 Å²	35.9	26%	0.26	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-12.5	175.9	-70.2	169.9	-178.7	138.6	-4.7	113.9	E537 S566 F567 A611 Y612 F613	E537-R615 IonicContact OE1-CZ 2.7Å; E537-R615 IonicContact OE1-NH1 3.4Å; E537-R615 IonicContact OE1-NH2 3.5Å; E537-R615 PolarHBondContact OE1-NH2 3.48Å; E537-R615 IonicContact OE2-CZ 2.83Å; E537-R615 IonicContact OE2-NH1 2.75Å; E537-R615 PolarHBondContact OE2-NH1 3.3Å; E537-R615 IonicContact OE2-NH2 3.27Å; E537-R615 PolarHBondContact OE2-NH2 3Å; S566-R615 PolarHBondContact OG-NH2 3.2Å; F567-R615 HydrophobicContact CZ-CG 4.02Å; A611-R615 WeakPolarHBondContact O-CG 3.29Å; A611-R615 PolarHBondContact O-N 2.86Å; A611-R615 VanDerWaalsContact O-N 3.16Å; Y612-R615 PolarHBondContact O-N 2.91Å; F613-R615 PolarHBondContact O-N 3.38Å
616	K	96.6	Very high	95.9	Very high	42 Å²	42	37.1 Å²	37.1	18%	0.183	17%	0.174	C	C	.	.	S	Bend	trans	-69.9	134.7	178	-63.6	-69.7	168.9	171.5	0	110.6	Y612 F613 L614 R618 V619 K620 L843	Y612-K616 VanDerWaalsContact CZ-CE 3.42Å; Y612-K616 VanDerWaalsContact CZ-NZ 3.33Å; Y612-K616 PolarHBondContact OH-NZ 3.32Å; F613-K616 VanDerWaalsContact O-CB 3.3Å; F613-K616 WeakPolarHBondContact O-CB 3.36Å; F613-K616 PolarHBondContact O-N 3.26Å; L614-K616 VanDerWaalsContact C-N 3.28Å; L614-K616 PolarHBondContact O-N 3.25Å; K616-R618 VanDerWaalsContact C-N 3.29Å; K616-R618 PolarHBondContact O-N 3.42Å; K616-R618 VanDerWaalsContact O-N 3.16Å; K616-V619 HydrophobicContact CB-CB 4.34Å; K616-V619 HydrophobicContact CB-CG2 4.03Å; K616-V619 WeakPolarHBondContact O-CA 3.48Å; K616-V619 PolarHBondContact O-N 2.88Å; K616-K620 WeakPolarHBondContact O-CB 3.45Å; K616-K620 PolarHBondContact O-N 2.86Å; K616-L843 HydrophobicContact CD-CD2 3.91Å; K616-L843 VanDerWaalsContact CE-CD2 3.48Å; K616-L843 HydrophobicContact CG-CD2 4.02Å
617	E	92	Very high	95.9	Very high	169 Å²	169	37.1 Å²	37.1	79%	0.79	17%	0.174	S	C	*	.	H	α-helix	trans	-52.5	-44.2	-172.2	-173.2	178	-174.2	0	0	113.1	S621	E617-S621 WeakPolarHBondContact O-CB 3.38Å; E617-S621 PolarHBondContact O-N 2.88Å; E617-S621 PolarHBondContact O-OG 3.15Å
618	R	89.6	Confident	95.9	Very high	76 Å²	76	38.6 Å²	38.6	29%	0.287	18%	0.181	S	C	.	.	H	α-helix	trans	-72.8	-25.3	178.1	-71.8	179.2	171.4	-171.2	-6.2	113.6	K616 S622 E734 R752 A839 F840	K616-R618 VanDerWaalsContact C-N 3.29Å; K616-R618 PolarHBondContact O-N 3.42Å; K616-R618 VanDerWaalsContact O-N 3.16Å; R618-S622 PolarHBondContact O-OG 3.23Å; R618-E734 IonicContact NH2-OE1 3.37Å; R618-E734 PolarHBondContact NH2-OE1 3.16Å; R618-R752 PolarHBondContact O-NH2 3.49Å; R618-A839 PolarHBondContact NH1-O 3.48Å; R618-F840 WeakPolarHBondContact CD-O 3.46Å; R618-F840 PolarHBondContact NH1-O 3.02Å
619	V	94.2	Very high	95.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-78.8	-51	173.9	-179.2	0	0	0	0	109.3	F613 L614 K616 S621 S622 L623 L765 W837 F840 A841	F613-V619 VanDerWaalsContact O-CB 3.22Å; F613-V619 WeakPolarHBondContact O-CB 3.25Å; F613-V619 WeakPolarHBondContact O-CG2 3.2Å; L614-V619 HydrophobicContact CD2-CG1 4.11Å; K616-V619 HydrophobicContact CB-CB 4.34Å; K616-V619 HydrophobicContact CB-CG2 4.03Å; K616-V619 WeakPolarHBondContact O-CA 3.48Å; K616-V619 PolarHBondContact O-N 2.88Å; V619-S621 PolarHBondContact O-N 3.33Å; V619-S622 WeakPolarHBondContact O-CB 3.45Å; V619-S622 PolarHBondContact O-N 2.98Å; V619-L623 HydrophobicContact CG1-CD1 3.73Å; V619-L623 HydrophobicContact CG1-CG 4.32Å; V619-L623 PolarHBondContact O-N 3.24Å; V619-L623 VanDerWaalsContact O-N 3.12Å; V619-L765 HydrophobicContact CG1-CD1 3.69Å; V619-W837 HydrophobicContact CG2-CH2 4.02Å; V619-W837 HydrophobicContact CG2-CZ2 4.01Å; V619-F840 HydrophobicContact CG2-CE1 4.06Å; V619-A841 HydrophobicContact CG2-CB 4.04Å
620	K	92.7	Very high	95.8	Very high	137 Å²	137	38.6 Å²	38.6	60%	0.596	18%	0.181	S	C	*	.	H	α-helix	trans	-55	-36.4	178.2	-172.3	173.9	-178.8	174.1	0	113.5	K616	K616-K620 WeakPolarHBondContact O-CB 3.45Å; K616-K620 PolarHBondContact O-N 2.86Å
621	S	91.1	Very high	95.8	Very high	64 Å²	64	38.6 Å²	38.6	45%	0.448	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.8	177.3	51.7	0	0	0	0	114.4	E617 V619 R752	E617-S621 WeakPolarHBondContact O-CB 3.38Å; E617-S621 PolarHBondContact O-N 2.88Å; E617-S621 PolarHBondContact O-OG 3.15Å; V619-S621 PolarHBondContact O-N 3.33Å; S621-R752 PolarHBondContact O-NH2 3.24Å; S621-R752 PolarHBondContact OG-NH2 2.54Å
622	S	92.3	Very high	95.9	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.028	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-32.1	176.6	-54.9	0	0	0	0	113.5	R618 V619 R752 R758	R618-S622 PolarHBondContact O-OG 3.23Å; V619-S622 WeakPolarHBondContact O-CB 3.45Å; V619-S622 PolarHBondContact O-N 2.98Å; S622-R752 VanDerWaalsContact N-NH2 3.15Å; S622-R752 PolarHBondContact OG-NE 3.02Å; S622-R752 PolarHBondContact OG-NH2 2.89Å; S622-R758 WeakPolarHBondContact O-CG 3.35Å
623	L	94.8	Very high	95.9	Very high	12 Å²	12	37.6 Å²	37.6	6%	0.063	18%	0.178	C	C	.	.			trans	-105	144.8	-170.6	-60.5	-174.7	0	0	0	109.9	L614 V619 D627 R758 I761 K762 L765	L614-L623 HydrophobicContact CD2-CD1 3.78Å; V619-L623 HydrophobicContact CG1-CD1 3.73Å; V619-L623 HydrophobicContact CG1-CG 4.32Å; V619-L623 PolarHBondContact O-N 3.24Å; V619-L623 VanDerWaalsContact O-N 3.12Å; L623-D627 HydrophobicContact CB-CB 3.84Å; L623-D627 HydrophobicContact CD1-CB 4.44Å; L623-D627 HydrophobicContact CD2-CB 4.18Å; L623-D627 WeakPolarHBondContact CD2-OD2 3.36Å; L623-D627 HydrophobicContact CG-CB 4.36Å; L623-R758 HydrophobicContact CD2-CB 4.33Å; L623-R758 HydrophobicContact CD2-CG 4.36Å; L623-I761 HydrophobicContact CD1-CG2 4.33Å; L623-I761 HydrophobicContact CD2-CB 4.34Å; L623-I761 HydrophobicContact CD2-CG2 4Å; L623-I761 HydrophobicContact CG-CG2 4.32Å; L623-K762 HydrophobicContact CD1-CG 4.33Å; L623-K762 HydrophobicContact CD2-CG 4.07Å; L623-L765 HydrophobicContact CD1-CD1 4.26Å
624	D	94.1	Very high	95.9	Very high	63 Å²	63	37.6 Å²	37.6	34%	0.337	18%	0.178	S	C	.	.			trans	-92	174	171.9	67	16	0	0	0	111.6	L626 D627 E628 R758	D624-L626 PolarHBondContact O-N 3.43Å; D624-L626 WeakPolarHBondContact OD1-CB 3.44Å; D624-L626 PolarHBondContact OD1-N 3.09Å; D624-L626 VanDerWaalsContact OD1-N 3.17Å; D624-D627 WeakPolarHBondContact O-CB 3.32Å; D624-D627 PolarHBondContact O-N 3.03Å; D624-D627 PolarHBondContact OD1-N 3.43Å; D624-E628 PolarHBondContact O-N 2.84Å; D624-R758 VanDerWaalsContact CG-CZ 3.48Å; D624-R758 IonicContact OD1-CZ 2.85Å; D624-R758 IonicContact OD1-NH2 2.76Å; D624-R758 PolarHBondContact OD1-NH2 3.34Å; D624-R758 IonicContact OD2-CZ 2.62Å; D624-R758 IonicContact OD2-NH1 3.72Å; D624-R758 PolarHBondContact OD2-NH1 2.87Å; D624-R758 IonicContact OD2-NH2 3.72Å; D624-R758 PolarHBondContact OD2-NH2 3Å
625	Q	95.6	Very high	95.9	Very high	93 Å²	93	37.6 Å²	37.6	44%	0.435	18%	0.177	S	C	.	.	H	α-helix	trans	-60	-30	-178.8	-165.8	176.3	17.1	0	0	112.9	F572 V629	F572-Q625 HydrophobicContact CD2-CB 4.21Å; F572-Q625 HydrophobicContact CD2-CG 3.67Å; F572-Q625 HydrophobicContact CE2-CB 4.17Å; F572-Q625 HydrophobicContact CE2-CG 4.11Å; F572-Q625 HydrophobicContact CG-CG 4.31Å; Q625-V629 WeakPolarHBondContact O-CB 3.46Å; Q625-V629 WeakPolarHBondContact O-CG2 3.41Å; Q625-V629 PolarHBondContact O-N 2.77Å
626	L	96.8	Very high	96	Very high	25 Å²	25	34.3 Å²	34.3	13%	0.131	17%	0.165	C	C	.	.	H	α-helix	trans	-66.2	-43	175.6	-174.5	152.6	0	0	0	110.7	F572 D624 V629 A630 Q695 T698 L699	F572-L626 HydrophobicContact CE2-CB 4.41Å; F572-L626 HydrophobicContact CZ-CB 3.74Å; F572-L626 HydrophobicContact CZ-CD1 4.4Å; F572-L626 HydrophobicContact CZ-CG 4.1Å; D624-L626 PolarHBondContact O-N 3.43Å; D624-L626 WeakPolarHBondContact OD1-CB 3.44Å; D624-L626 PolarHBondContact OD1-N 3.09Å; D624-L626 VanDerWaalsContact OD1-N 3.17Å; L626-V629 PolarHBondContact O-N 3.29Å; L626-A630 VanDerWaalsContact O-CB 3.3Å; L626-A630 WeakPolarHBondContact O-CB 3.44Å; L626-A630 PolarHBondContact O-N 3.08Å; L626-Q695 HydrophobicContact CD1-CG 4.36Å; L626-T698 HydrophobicContact CD1-CG2 3.91Å; L626-T698 HydrophobicContact CD2-CG2 4.06Å; L626-L699 HydrophobicContact CD2-CD1 4.4Å; L626-L699 HydrophobicContact CG-CD1 4.37Å
627	D	97.5	Very high	96.1	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-42	176.2	-72.7	-19.9	0	0	0	112.7	L623 D624 A630 A631 R758 K762	L623-D627 HydrophobicContact CB-CB 3.84Å; L623-D627 HydrophobicContact CD1-CB 4.44Å; L623-D627 HydrophobicContact CD2-CB 4.18Å; L623-D627 WeakPolarHBondContact CD2-OD2 3.36Å; L623-D627 HydrophobicContact CG-CB 4.36Å; D624-D627 WeakPolarHBondContact O-CB 3.32Å; D624-D627 PolarHBondContact O-N 3.03Å; D624-D627 PolarHBondContact OD1-N 3.43Å; D627-A630 PolarHBondContact O-N 2.88Å; D627-A631 WeakPolarHBondContact O-CB 3.18Å; D627-A631 PolarHBondContact O-N 3.29Å; D627-R758 IonicContact OD1-NH2 3.87Å; D627-R758 PolarHBondContact OD1-NH2 3.29Å; D627-R758 IonicContact OD2-CZ 2.74Å; D627-R758 IonicContact OD2-NE 2.99Å; D627-R758 PolarHBondContact OD2-NE 3.36Å; D627-R758 IonicContact OD2-NH2 3.29Å; D627-R758 PolarHBondContact OD2-NH2 3.38Å; D627-K762 HydrophobicContact CB-CD 3.84Å; D627-K762 HydrophobicContact CB-CG 4.39Å; D627-K762 WeakPolarHBondContact OD1-CD 3.45Å; D627-K762 WeakPolarHBondContact OD1-CE 3.23Å; D627-K762 IonicContact OD1-NZ 2.69Å; D627-K762 PolarHBondContact OD1-NZ 3.3Å
628	E	98.4	Very high	96.4	Very high	30 Å²	30	24.3 Å²	24.3	14%	0.14	12%	0.119	C	C	.	.	H	α-helix	trans	-59.6	-49	176.1	-67.4	178.9	147.4	0	0	110.5	F567 L614 D624 A630 A631 L632	F567-E628 HydrophobicContact CD1-CB 4.47Å; L614-E628 HydrophobicContact CD1-CB 4.31Å; L614-E628 HydrophobicContact CD2-CG 4.2Å; D624-E628 PolarHBondContact O-N 2.84Å; E628-A630 VanDerWaalsContact C-N 3.35Å; E628-A630 PolarHBondContact O-N 2.97Å; E628-A631 PolarHBondContact O-N 3.46Å; E628-L632 WeakPolarHBondContact O-CG 3.41Å; E628-L632 PolarHBondContact O-N 3.22Å
629	V	98.6	Very high	96.9	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-62.9	-41.6	177.2	172.7	0	0	0	0	111.2	V569 F572 L573 Q625 L626 A631 I633 L699	V569-V629 HydrophobicContact CG1-CG1 4.01Å; V569-V629 HydrophobicContact CG1-CG2 4.38Å; V569-V629 HydrophobicContact CG2-CG2 4.2Å; F572-V629 HydrophobicContact CB-CG2 4.16Å; F572-V629 HydrophobicContact CD1-CB 4.1Å; F572-V629 HydrophobicContact CD1-CG1 4Å; F572-V629 HydrophobicContact CD1-CG2 3.66Å; F572-V629 HydrophobicContact CE1-CB 4.22Å; F572-V629 HydrophobicContact CE1-CG1 4.24Å; F572-V629 HydrophobicContact CE1-CG2 4.18Å; F572-V629 HydrophobicContact CG-CG2 3.91Å; L573-V629 HydrophobicContact CD1-CG1 4.35Å; L573-V629 HydrophobicContact CD2-CG1 4.13Å; L573-V629 HydrophobicContact CG-CG1 4.28Å; Q625-V629 WeakPolarHBondContact O-CB 3.46Å; Q625-V629 WeakPolarHBondContact O-CG2 3.41Å; Q625-V629 PolarHBondContact O-N 2.77Å; L626-V629 PolarHBondContact O-N 3.29Å; V629-A631 VanDerWaalsContact C-N 3.34Å; V629-A631 PolarHBondContact O-N 2.56Å; V629-I633 HydrophobicContact CG1-CD1 3.73Å; V629-I633 WeakPolarHBondContact O-CB 3.26Å; V629-I633 VanDerWaalsContact O-CG1 3.28Å; V629-I633 WeakPolarHBondContact O-CG1 3.26Å; V629-I633 PolarHBondContact O-N 3.32Å; V629-I633 VanDerWaalsContact O-N 3.08Å; V629-L699 HydrophobicContact CG1-CD1 4.12Å; V629-L699 HydrophobicContact CG1-CD2 4.33Å
630	A	98.7	Very high	97.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.4	-44	176	0	0	0	0	0	111.7	L626 D627 E628 I633 A634 L699 A702 I703 M706	L626-A630 VanDerWaalsContact O-CB 3.3Å; L626-A630 WeakPolarHBondContact O-CB 3.44Å; L626-A630 PolarHBondContact O-N 3.08Å; D627-A630 PolarHBondContact O-N 2.88Å; E628-A630 VanDerWaalsContact C-N 3.35Å; E628-A630 PolarHBondContact O-N 2.97Å; A630-I633 PolarHBondContact O-N 3.09Å; A630-A634 VanDerWaalsContact O-CB 3.23Å; A630-A634 WeakPolarHBondContact O-CB 3.35Å; A630-A634 PolarHBondContact O-N 3.28Å; A630-L699 HydrophobicContact CB-CD1 3.72Å; A630-A702 HydrophobicContact CB-CB 3.73Å; A630-I703 HydrophobicContact CB-CG1 4.14Å; A630-M706 HydrophobicContact CB-SD 4.47Å
631	A	98.8	Very high	97.3	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.9	-45.1	-178.1	0	0	0	0	0	112.4	T610 L614 D627 E628 V629 A634 A635 M706	T610-A631 HydrophobicContact CG2-CB 3.97Å; L614-A631 HydrophobicContact CD1-CB 4.2Å; L614-A631 HydrophobicContact CD2-CB 4.34Å; D627-A631 WeakPolarHBondContact O-CB 3.18Å; D627-A631 PolarHBondContact O-N 3.29Å; E628-A631 PolarHBondContact O-N 3.46Å; V629-A631 VanDerWaalsContact C-N 3.34Å; V629-A631 PolarHBondContact O-N 2.56Å; A631-A634 PolarHBondContact O-N 2.98Å; A631-A635 WeakPolarHBondContact O-CB 3.13Å; A631-A635 PolarHBondContact O-N 2.91Å; A631-M706 VanDerWaalsContact CA-CE 3.45Å; A631-M706 HydrophobicContact CB-CE 3.55Å; A631-M706 HydrophobicContact CB-SD 4.07Å
632	L	98.9	Very high	97.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.1	-41.4	177.4	-65.3	173.9	0	0	0	111.8	I563 F564 F567 V569 L607 T610 A611 L614 E628 T636	I563-L632 HydrophobicContact CG2-CD1 4.27Å; I563-L632 HydrophobicContact CG2-CD2 3.71Å; F564-L632 HydrophobicContact CE2-CB 3.94Å; F564-L632 HydrophobicContact CZ-CB 4.11Å; F567-L632 HydrophobicContact CB-CD1 3.68Å; F567-L632 HydrophobicContact CD1-CD1 4.08Å; F567-L632 HydrophobicContact CD2-CD1 3.89Å; F567-L632 HydrophobicContact CG-CD1 3.62Å; V569-L632 HydrophobicContact CG2-CD1 3.94Å; L607-L632 HydrophobicContact CD1-CB 4.14Å; L607-L632 HydrophobicContact CD1-CD2 3.69Å; T610-L632 HydrophobicContact CG2-CD2 4.18Å; A611-L632 HydrophobicContact CB-CD2 4.15Å; L614-L632 HydrophobicContact CD1-CD2 3.91Å; L614-L632 HydrophobicContact CD1-CG 3.92Å; E628-L632 WeakPolarHBondContact O-CG 3.41Å; E628-L632 PolarHBondContact O-N 3.22Å; L632-T636 WeakPolarHBondContact O-CB 3.44Å; L632-T636 PolarHBondContact O-N 3.42Å; L632-T636 VanDerWaalsContact O-N 3.11Å; L632-T636 PolarHBondContact O-OG1 2.67Å
633	I	98.9	Very high	97.9	Very high	3 Å²	3	16 Å²	16	2%	0.015	8%	0.084	C	C	.	.	H	α-helix	trans	-67.2	-45	176.1	-66.7	170.1	0	0	0	110.6	F564 L573 W583 V629 A630 A635 T636 V637 I687 F688 I703	F564-I633 HydrophobicContact CE1-CG1 3.99Å; F564-I633 HydrophobicContact CZ-CG1 4.14Å; L573-I633 HydrophobicContact CD1-CD1 4.21Å; W583-I633 HydrophobicContact CH2-CG1 4.39Å; W583-I633 HydrophobicContact CH2-CG2 4.01Å; W583-I633 HydrophobicContact CZ2-CG2 4.08Å; V629-I633 HydrophobicContact CG1-CD1 3.73Å; V629-I633 WeakPolarHBondContact O-CB 3.26Å; V629-I633 VanDerWaalsContact O-CG1 3.28Å; V629-I633 WeakPolarHBondContact O-CG1 3.26Å; V629-I633 PolarHBondContact O-N 3.32Å; V629-I633 VanDerWaalsContact O-N 3.08Å; A630-I633 PolarHBondContact O-N 3.09Å; I633-A635 PolarHBondContact O-N 3.39Å; I633-T636 WeakPolarHBondContact O-CB 3.2Å; I633-T636 PolarHBondContact O-N 3.12Å; I633-V637 WeakPolarHBondContact O-CG2 3.27Å; I633-V637 PolarHBondContact O-N 2.78Å; I633-I687 HydrophobicContact CD1-CD1 4.08Å; I633-F688 HydrophobicContact CD1-CE1 3.79Å; I633-F688 HydrophobicContact CD1-CZ 4.05Å; I633-F688 HydrophobicContact CG2-CZ 4.41Å; I633-I703 HydrophobicContact CB-CD1 4.01Å; I633-I703 HydrophobicContact CB-CG1 4.22Å; I633-I703 HydrophobicContact CD1-CD1 4.14Å; I633-I703 HydrophobicContact CG2-CD1 3.62Å; I633-I703 HydrophobicContact CG2-CG1 4.08Å; I633-I703 HydrophobicContact CG2-CG2 4.2Å
634	A	98.9	Very high	98	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.4	-49.5	177.5	0	0	0	0	0	111.2	A630 A631 T636 V637 H638 I703 M706 V707	A630-A634 VanDerWaalsContact O-CB 3.23Å; A630-A634 WeakPolarHBondContact O-CB 3.35Å; A630-A634 PolarHBondContact O-N 3.28Å; A631-A634 PolarHBondContact O-N 2.98Å; A634-T636 VanDerWaalsContact C-N 3.27Å; A634-T636 PolarHBondContact O-N 2.87Å; A634-V637 PolarHBondContact O-N 3.1Å; A634-V637 VanDerWaalsContact O-N 3.1Å; A634-H638 WeakPolarHBondContact O-CA 3.25Å; A634-H638 WeakPolarHBondContact O-CB 3.3Å; A634-H638 PolarHBondContact O-N 3.26Å; A634-I703 HydrophobicContact CB-CG2 4.41Å; A634-M706 HydrophobicContact CB-CB 3.65Å; A634-M706 HydrophobicContact CB-CE 4.28Å; A634-M706 HydrophobicContact CB-SD 4.22Å; A634-V707 HydrophobicContact CB-CG2 4.19Å
635	A	98.9	Very high	98.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-57.1	-40	176.3	0	0	0	0	0	112.9	V606 L607 T610 A631 I633 V637 H638 I766	V606-A635 HydrophobicContact CG1-CB 4.07Å; L607-A635 HydrophobicContact CB-CB 4.36Å; L607-A635 HydrophobicContact CD1-CB 4.32Å; T610-A635 HydrophobicContact CG2-CB 4.15Å; T610-A635 WeakPolarHBondContact OG1-CB 3.28Å; A631-A635 WeakPolarHBondContact O-CB 3.13Å; A631-A635 PolarHBondContact O-N 2.91Å; I633-A635 PolarHBondContact O-N 3.39Å; A635-V637 VanDerWaalsContact C-N 3.28Å; A635-V637 PolarHBondContact O-N 3.15Å; A635-H638 PolarHBondContact O-ND1 3.31Å; A635-I766 HydrophobicContact CB-CD1 3.81Å
636	T	98.9	Very high	98.2	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65.6	-28.7	179.3	-58.4	0	0	0	0	113.1	L556 W583 L584 Y591 L632 I633 A634	L556-T636 HydrophobicContact CD1-CG2 4.18Å; L556-T636 HydrophobicContact CD2-CG2 4.22Å; L556-T636 HydrophobicContact CG-CG2 4.4Å; W583-T636 HydrophobicContact CH2-CG2 3.66Å; W583-T636 HydrophobicContact CZ3-CG2 3.74Å; L584-T636 HydrophobicContact CD2-CG2 3.86Å; Y591-T636 PolarHBondContact OH-O 2.94Å; L632-T636 WeakPolarHBondContact O-CB 3.44Å; L632-T636 PolarHBondContact O-N 3.42Å; L632-T636 VanDerWaalsContact O-N 3.11Å; L632-T636 PolarHBondContact O-OG1 2.67Å; I633-T636 WeakPolarHBondContact O-CB 3.2Å; I633-T636 PolarHBondContact O-N 3.12Å; A634-T636 VanDerWaalsContact C-N 3.27Å; A634-T636 PolarHBondContact O-N 2.87Å
637	V	98.8	Very high	97.9	Very high	2 Å²	2	11.1 Å²	11.1	1%	0.012	6%	0.058	C	C	.	.	H	α-helix	trans	-117.6	-4.3	-170.5	-51.6	0	0	0	0	114.7	W583 M587 I633 A634 A635 D639 V640 A675 I703 V707	W583-V637 HydrophobicContact CH2-CG1 3.93Å; W583-V637 HydrophobicContact CZ2-CG1 3.69Å; M587-V637 HydrophobicContact CG-CG1 4.11Å; M587-V637 HydrophobicContact SD-CG1 3.82Å; I633-V637 WeakPolarHBondContact O-CG2 3.27Å; I633-V637 PolarHBondContact O-N 2.78Å; A634-V637 PolarHBondContact O-N 3.1Å; A634-V637 VanDerWaalsContact O-N 3.1Å; A635-V637 VanDerWaalsContact C-N 3.28Å; A635-V637 PolarHBondContact O-N 3.15Å; V637-D639 PolarHBondContact O-N 3.18Å; V637-V640 WeakPolarHBondContact O-CG1 3.15Å; V637-V640 PolarHBondContact O-N 3.08Å; V637-V640 VanDerWaalsContact O-N 3.15Å; V637-A675 HydrophobicContact CB-CB 3.72Å; V637-A675 HydrophobicContact CG1-CB 3.98Å; V637-A675 HydrophobicContact CG2-CB 3.94Å; V637-I703 HydrophobicContact CG2-CG2 4.48Å; V637-V707 HydrophobicContact CG2-CG2 4.13Å
638	H	98.8	Very high	97.5	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.7	-167.4	75.1	-72.1	0	0	0	114.8	H602 A634 A635 H671 V707 T710 D770	H602-H638 AromaticContact CD2-NE2 3.91Å; H602-H638 AromaticContact NE2-CE1 3.77Å; H602-H638 AromaticContact NE2-NE2 3.26Å; H602-H638 PolarHBondContact NE2-NE2 2.84Å; A634-H638 WeakPolarHBondContact O-CA 3.25Å; A634-H638 WeakPolarHBondContact O-CB 3.3Å; A634-H638 PolarHBondContact O-N 3.26Å; A635-H638 PolarHBondContact O-ND1 3.31Å; H638-H671 WeakPolarHBondContact O-CB 3.22Å; H638-H671 PolarHBondContact O-CD2 3.05Å; H638-V707 HydrophobicContact CB-CG2 4.32Å; H638-T710 HydrophobicContact CB-CG2 4.28Å; H638-D770 IonicContact CD2-OD1 3.47Å; H638-D770 IonicContact NE2-OD1 2.64Å; H638-D770 PolarHBondContact NE2-OD1 3.33Å
639	D	98.8	Very high	97.2	Very high	11 Å²	11	10.6 Å²	10.6	6%	0.059	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.5	18.7	-177.3	-81.6	-21.8	0	0	0	113.2	Y591 H598 H602 V637 D641 H642 H671	Y591-D639 HydrophobicContact CE1-CB 3.66Å; Y591-D639 WeakPolarHBondContact CE1-O 3.43Å; Y591-D639 PolarHBondContact OH-N 3.44Å; H598-D639 IonicContact CD2-OD2 3.51Å; H598-D639 PolarHBondContact CD2-OD2 3.42Å; H602-D639 IonicContact CD2-OD2 3.08Å; H602-D639 PolarHBondContact CD2-OD2 2.67Å; H602-D639 IonicContact NE2-OD2 2.72Å; H602-D639 PolarHBondContact NE2-OD2 2.89Å; H602-D639 VanDerWaalsContact NE2-OD2 3.1Å; V637-D639 PolarHBondContact O-N 3.18Å; D639-D641 PolarHBondContact O-N 3.39Å; D639-H642 HydrophobicContact CB-CB 4.41Å; D639-H642 VanDerWaalsContact O-CB 3.28Å; D639-H642 WeakPolarHBondContact O-CB 3.48Å; D639-H642 PolarHBondContact O-N 2.92Å; D639-H642 VanDerWaalsContact O-N 3.09Å; D639-H671 IonicContact OD1-CD2 3.81Å; D639-H671 IonicContact OD1-NE2 3.93Å
640	V	98.4	Very high	96.8	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	131.6	-177.4	68.3	0	0	0	0	110.6	N590 Y591 V637 H642 H671 A675	N590-V640 HydrophobicContact CB-CG2 3.66Å; Y591-V640 HydrophobicContact CD2-CG2 4.36Å; Y591-V640 HydrophobicContact CE2-CB 3.97Å; Y591-V640 HydrophobicContact CE2-CG2 4.23Å; Y591-V640 PolarHBondContact OH-N 2.93Å; V637-V640 WeakPolarHBondContact O-CG1 3.15Å; V637-V640 PolarHBondContact O-N 3.08Å; V637-V640 VanDerWaalsContact O-N 3.15Å; V640-H642 VanDerWaalsContact C-N 3.3Å; V640-H642 PolarHBondContact O-N 3.47Å; V640-H671 HydrophobicContact CG1-CB 4.34Å; V640-H671 WeakPolarHBondContact CG1-O 3.25Å; V640-H671 PolarHBondContact O-ND1 2.73Å; V640-A675 HydrophobicContact CG1-CB 4.12Å
641	D	98.5	Very high	96.2	Very high	41 Å²	41	11.7 Å²	11.7	22%	0.219	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	25.8	-174.9	-162.9	44.6	0	0	0	114.9	N590 H592 D639 H670 L674	N590-D641 WeakPolarHBondContact O-CA 3.39Å; N590-D641 PolarHBondContact O-N 3.32Å; H592-D641 IonicContact CE1-OD1 2.72Å; H592-D641 PolarHBondContact CE1-OD1 3.48Å; H592-D641 IonicContact NE2-OD1 2.79Å; H592-D641 PolarHBondContact NE2-OD1 3.16Å; H592-D641 VanDerWaalsContact NE2-OD1 3.16Å; D639-D641 PolarHBondContact O-N 3.39Å; D641-H670 IonicContact OD2-CD2 3.15Å; D641-H670 IonicContact OD2-CE1 3.6Å; D641-H670 IonicContact OD2-NE2 3.5Å; D641-H670 PolarHBondContact OD2-NE2 3.37Å; D641-L674 HydrophobicContact CB-CD2 3.22Å
642	H	98.6	Very high	95.5	Very high	11 Å²	11	13.5 Å²	13.5	5%	0.051	7%	0.073	C	C	.	.			trans	-59.6	127.3	171.7	-167.7	-82.4	0	0	0	111.2	H592 N595 H598 D639 V640 G644 H671 E791	H592-H642 PolarHBondContact ND1-O 2.75Å; N595-H642 PolarHBondContact ND2-O 3.11Å; H598-H642 HydrophobicContact CB-CB 3.85Å; H598-H642 VanDerWaalsContact CB-ND1 3.3Å; H598-H642 WeakPolarHBondContact CB-ND1 3.41Å; H598-H642 AromaticContact CE1-CE1 3.77Å; H598-H642 AromaticContact CG-CE1 3.56Å; H598-H642 AromaticContact CG-CG 3.79Å; H598-H642 AromaticContact CG-ND1 3.43Å; H598-H642 AromaticContact CG-NE2 3.96Å; H598-H642 AromaticContact ND1-CE1 3.32Å; H598-H642 PolarHBondContact ND1-CE1 3.11Å; H598-H642 VanDerWaalsContact ND1-CE1 3.32Å; H598-H642 AromaticContact ND1-ND1 3.59Å; H598-H642 AromaticContact ND1-NE2 3.91Å; D639-H642 HydrophobicContact CB-CB 4.41Å; D639-H642 VanDerWaalsContact O-CB 3.28Å; D639-H642 WeakPolarHBondContact O-CB 3.48Å; D639-H642 PolarHBondContact O-N 2.92Å; D639-H642 VanDerWaalsContact O-N 3.09Å; V640-H642 VanDerWaalsContact C-N 3.3Å; V640-H642 PolarHBondContact O-N 3.47Å; H642-G644 WeakPolarHBondContact ND1-CA 3.33Å; H642-G644 PolarHBondContact ND1-N 3.45Å; H642-G644 PolarHBondContact O-N 3.45Å; H642-H671 AromaticContact CD2-CE1 3.97Å; H642-H671 AromaticContact CD2-NE2 3.7Å; H642-E791 IonicContact CE1-OE1 2.75Å; H642-E791 IonicContact ND1-OE1 3.74Å
643	P	97.3	Very high	94.9	Very high	44 Å²	44	15.4 Å²	15.4	29%	0.286	9%	0.088	S	C	.	.			trans	-83.1	3	-174.2	33.5	-36	0	0	0	113.8	R645 L650 L667	P643-R645 VanDerWaalsContact C-N 3.33Å; P643-R645 HydrophobicContact CG-CB 4.35Å; P643-L650 HydrophobicContact CG-CD1 4.25Å; P643-L650 HydrophobicContact CG-CD2 4.24Å; P643-L667 HydrophobicContact CG-CD2 3.91Å
644	G	97	Very high	94.2	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.01	11%	0.109	C	C	.	.	S	Bend	trans	74.5	24.4	-175.3	0	0	0	0	0	113.3	N595 H642 E791	N595-G644 PolarHBondContact ND2-N 2.67Å; H642-G644 WeakPolarHBondContact ND1-CA 3.33Å; H642-G644 PolarHBondContact ND1-N 3.45Å; H642-G644 PolarHBondContact O-N 3.45Å; G644-E791 WeakPolarHBondContact CA-OE1 3.48Å
645	R	96.9	Very high	93.8	Very high	43 Å²	43	18.6 Å²	18.6	16%	0.162	12%	0.118	C	C	.	.	S	Bend	trans	-138.2	147.5	-177.2	-62.5	-67.7	176.9	-93	0.3	109.4	P643 F649 L667 A794 Q795 E798	P643-R645 VanDerWaalsContact C-N 3.33Å; P643-R645 HydrophobicContact CG-CB 4.35Å; R645-F649 HydrophobicContact CB-CB 4.18Å; R645-F649 HydrophobicContact CB-CD1 3.5Å; R645-F649 HydrophobicContact CB-CE1 4.11Å; R645-F649 HydrophobicContact CB-CG 3.95Å; R645-F649 HydrophobicContact CG-CD1 3.62Å; R645-F649 HydrophobicContact CG-CE1 3.69Å; R645-F649 HydrophobicContact CG-CG 4.18Å; R645-F649 HydrophobicContact CG-CZ 4.3Å; R645-L667 VanDerWaalsContact O-CD1 3.26Å; R645-L667 WeakPolarHBondContact O-CD1 3.44Å; R645-A794 PolarHBondContact NH2-O 3.14Å; R645-Q795 VanDerWaalsContact CA-OE1 3.26Å; R645-E798 IonicContact CZ-OE2 3.33Å; R645-E798 IonicContact NE-OE2 3.21Å; R645-E798 PolarHBondContact NE-OE2 2.89Å; R645-E798 IonicContact NH2-OE2 3.46Å; R645-E798 PolarHBondContact NH2-OE2 3.38Å
646	T	95.1	Very high	93.3	Very high	16 Å²	16	27 Å²	27	10%	0.098	16%	0.157	C	C	.	.			trans	-74.9	161.3	179.4	67.2	0	0	0	0	112.6	S648 F649 L650 Y792 Q795 M808	T646-S648 PolarHBondContact O-N 3.43Å; T646-F649 WeakPolarHBondContact O-CB 3.41Å; T646-F649 PolarHBondContact O-N 3.15Å; T646-F649 VanDerWaalsContact O-N 3.09Å; T646-F649 PolarHBondContact OG1-N 3.41Å; T646-L650 PolarHBondContact O-N 2.99Å; T646-L650 VanDerWaalsContact O-N 3.13Å; T646-Y792 HydrophobicContact CG2-CE1 4.32Å; T646-Q795 PolarHBondContact OG1-NE2 2.97Å; T646-Q795 VanDerWaalsContact OG1-NE2 3.09Å; T646-M808 HydrophobicContact CG2-SD 4.46Å
647	N	90.9	Very high	92.6	Very high	29 Å²	29	28.8 Å²	28.8	16%	0.155	17%	0.167	C	C	.	.	H	α-helix	trans	-50.4	-45.6	170.8	-78.5	-29.1	0	0	0	111.6	F649 L650 C651 V666 L667 E668	N647-F649 VanDerWaalsContact C-N 3.31Å; N647-F649 PolarHBondContact O-N 3.46Å; N647-L650 PolarHBondContact O-N 3.45Å; N647-L650 VanDerWaalsContact O-N 3.1Å; N647-C651 PolarHBondContact O-N 3.05Å; N647-C651 PolarHBondContact O-SG 2.99Å; N647-V666 WeakPolarHBondContact OD1-CB 3.35Å; N647-L667 VanDerWaalsContact OD1-CB 3.24Å; N647-L667 WeakPolarHBondContact OD1-CB 3.2Å; N647-L667 WeakPolarHBondContact OD1-CD1 3.47Å; N647-L667 WeakPolarHBondContact OD1-CG 3.4Å; N647-L667 PolarHBondContact OD1-N 3.38Å; N647-E668 PolarHBondContact ND2-OE1 2.86Å; N647-E668 PolarHBondContact ND2-OE2 3.46Å
648	S	89.1	Confident	91.9	Very high	6 Å²	6	28.7 Å²	28.7	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-56.8	-41	178.2	-54.1	0	0	0	0	113.1	G490 T493 T646 N652	G490-S648 PolarHBondContact O-OG 3.04Å; T493-S648 PolarHBondContact O-OG 2.66Å; T646-S648 PolarHBondContact O-N 3.43Å; S648-N652 WeakPolarHBondContact O-CB 3.44Å; S648-N652 VanDerWaalsContact O-CG 3.22Å; S648-N652 PolarHBondContact O-N 3.04Å; S648-N652 PolarHBondContact O-ND2 3.46Å
649	F	93.4	Very high	90.8	Very high	14 Å²	14	34.3 Å²	34.3	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-48.1	174.8	174.8	-86.3	0	0	0	111.4	R645 T646 N647 C651 N652 A653 Q795 E798 E799 L804	R645-F649 HydrophobicContact CB-CB 4.18Å; R645-F649 HydrophobicContact CB-CD1 3.5Å; R645-F649 HydrophobicContact CB-CE1 4.11Å; R645-F649 HydrophobicContact CB-CG 3.95Å; R645-F649 HydrophobicContact CG-CD1 3.62Å; R645-F649 HydrophobicContact CG-CE1 3.69Å; R645-F649 HydrophobicContact CG-CG 4.18Å; R645-F649 HydrophobicContact CG-CZ 4.3Å; T646-F649 WeakPolarHBondContact O-CB 3.41Å; T646-F649 PolarHBondContact O-N 3.15Å; T646-F649 VanDerWaalsContact O-N 3.09Å; T646-F649 PolarHBondContact OG1-N 3.41Å; N647-F649 VanDerWaalsContact C-N 3.31Å; N647-F649 PolarHBondContact O-N 3.46Å; F649-C651 VanDerWaalsContact C-N 3.31Å; F649-C651 PolarHBondContact O-N 3.21Å; F649-N652 PolarHBondContact O-N 3.06Å; F649-A653 HydrophobicContact CE1-CB 4.31Å; F649-A653 VanDerWaalsContact O-CB 3.27Å; F649-A653 WeakPolarHBondContact O-CB 3.16Å; F649-A653 PolarHBondContact O-N 3.25Å; F649-Q795 HydrophobicContact CB-CG 4.3Å; F649-Q795 HydrophobicContact CD2-CG 3.75Å; F649-Q795 HydrophobicContact CE2-CG 4.42Å; F649-Q795 HydrophobicContact CG-CG 4.23Å; F649-E798 HydrophobicContact CE2-CB 4.42Å; F649-E798 HydrophobicContact CE2-CG 3.95Å; F649-E798 HydrophobicContact CZ-CG 3.86Å; F649-E799 HydrophobicContact CD2-CG 3.49Å; F649-E799 VanDerWaalsContact CD2-CG 3.49Å; F649-E799 HydrophobicContact CE2-CG 3.74Å; F649-L804 HydrophobicContact CD2-CD1 4.45Å; F649-L804 HydrophobicContact CE2-CD1 3.91Å; F649-L804 HydrophobicContact CZ-CD1 4.24Å
650	L	90.2	Very high	90	Very high	12 Å²	12	39 Å²	39	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-39.7	-178.3	-68	-177.2	0	0	0	112.4	P643 T646 N647 G654 S655 A658 V666 L667	P643-L650 HydrophobicContact CG-CD1 4.25Å; P643-L650 HydrophobicContact CG-CD2 4.24Å; T646-L650 PolarHBondContact O-N 2.99Å; T646-L650 VanDerWaalsContact O-N 3.13Å; N647-L650 PolarHBondContact O-N 3.45Å; N647-L650 VanDerWaalsContact O-N 3.1Å; L650-G654 PolarHBondContact O-N 3.2Å; L650-S655 WeakPolarHBondContact CB-OG 3.27Å; L650-S655 WeakPolarHBondContact O-CB 3.45Å; L650-S655 PolarHBondContact O-N 3.02Å; L650-S655 PolarHBondContact O-OG 3.28Å; L650-A658 HydrophobicContact CB-CB 4.36Å; L650-A658 WeakPolarHBondContact O-CB 3.22Å; L650-V666 HydrophobicContact CD1-CG1 4.06Å; L650-L667 HydrophobicContact CD1-CD1 4.11Å; L650-L667 HydrophobicContact CD1-CD2 3.62Å; L650-L667 HydrophobicContact CD1-CG 3.72Å
651	C	86.3	Confident	89.4	Confident	13 Å²	13	41.1 Å²	41.1	9%	0.088	23%	0.228	C	C	.	.	H	α-helix	trans	-68.1	-48.1	175.6	-57.9	0	0	0	0	111.2	N647 F649 A653 G654 D663	N647-C651 PolarHBondContact O-N 3.05Å; N647-C651 PolarHBondContact O-SG 2.99Å; F649-C651 VanDerWaalsContact C-N 3.31Å; F649-C651 PolarHBondContact O-N 3.21Å; C651-A653 VanDerWaalsContact C-N 3.28Å; C651-A653 PolarHBondContact O-N 3.42Å; C651-G654 PolarHBondContact O-N 2.73Å; C651-D663 HydrophobicContact CB-CB 4.41Å
652	N	82.4	Confident	88.7	Confident	38 Å²	38	45 Å²	45	20%	0.203	25%	0.248	C	C	.	.	H	α-helix	trans	-62.8	-34.4	179.2	-75.1	-24.3	0	0	0	113	S648 F649 G654 V807	S648-N652 WeakPolarHBondContact O-CB 3.44Å; S648-N652 VanDerWaalsContact O-CG 3.22Å; S648-N652 PolarHBondContact O-N 3.04Å; S648-N652 PolarHBondContact O-ND2 3.46Å; F649-N652 PolarHBondContact O-N 3.06Å; N652-G654 VanDerWaalsContact C-N 3.27Å; N652-V807 WeakPolarHBondContact ND2-CG1 3.36Å
653	A	87.6	Confident	87.7	Confident	39 Å²	39	46.9 Å²	46.9	32%	0.322	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-9.4	176.4	0	0	0	0	0	113.4	F649 C651 S655 L804	F649-A653 HydrophobicContact CE1-CB 4.31Å; F649-A653 VanDerWaalsContact O-CB 3.27Å; F649-A653 WeakPolarHBondContact O-CB 3.16Å; F649-A653 PolarHBondContact O-N 3.25Å; C651-A653 VanDerWaalsContact C-N 3.28Å; C651-A653 PolarHBondContact O-N 3.42Å; A653-S655 VanDerWaalsContact C-N 3.28Å; A653-S655 PolarHBondContact O-N 2.74Å; A653-L804 HydrophobicContact CB-CD1 3.88Å
654	G	83.4	Confident	87.1	Confident	44 Å²	44	48.1 Å²	48.1	45%	0.454	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	37.5	-173.8	0	0	0	0	0	112.7	L650 C651 N652	L650-G654 PolarHBondContact O-N 3.2Å; C651-G654 PolarHBondContact O-N 2.73Å; N652-G654 VanDerWaalsContact C-N 3.27Å
655	S	90.6	Very high	86.7	Confident	27 Å²	27	48.4 Å²	48.4	19%	0.189	27%	0.267	C	S	.	.			trans	-61.4	157.8	-177.5	70	0	0	0	0	112.8	L650 A653 L657 A658 I659	L650-S655 WeakPolarHBondContact CB-OG 3.27Å; L650-S655 WeakPolarHBondContact O-CB 3.45Å; L650-S655 PolarHBondContact O-N 3.02Å; L650-S655 PolarHBondContact O-OG 3.28Å; A653-S655 VanDerWaalsContact C-N 3.28Å; A653-S655 PolarHBondContact O-N 2.74Å; S655-L657 VanDerWaalsContact C-N 3.27Å; S655-L657 PolarHBondContact O-N 3.46Å; S655-A658 PolarHBondContact O-N 2.93Å; S655-A658 VanDerWaalsContact O-N 3.13Å; S655-A658 VanDerWaalsContact OG-CB 3.3Å; S655-A658 WeakPolarHBondContact OG-CB 3.19Å; S655-A658 PolarHBondContact OG-N 3Å; S655-I659 WeakPolarHBondContact O-CG1 3.35Å; S655-I659 PolarHBondContact O-N 2.91Å
656	E	88.8	Confident	86.4	Confident	175 Å²	175	46.4 Å²	46.4	82%	0.818	26%	0.26	S	S	*	.	H	α-helix	trans	-58.2	-39.2	177.6	-64.8	-176.1	176.7	0	0	112.5	I659 L660	E656-I659 PolarHBondContact O-N 3.3Å; E656-L660 VanDerWaalsContact O-CB 3.28Å; E656-L660 WeakPolarHBondContact O-CB 3.49Å; E656-L660 PolarHBondContact O-N 3.31Å
657	L	84.5	Confident	86.6	Confident	39 Å²	39	45.8 Å²	45.8	20%	0.204	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-43.4	176.5	-64.7	-178.1	0	0	0	111.5	S655 I659 L660 Y661 V666 H670	S655-L657 VanDerWaalsContact C-N 3.27Å; S655-L657 PolarHBondContact O-N 3.46Å; L657-I659 VanDerWaalsContact C-N 3.34Å; L657-I659 PolarHBondContact O-N 3.35Å; L657-L660 PolarHBondContact O-N 3.46Å; L657-Y661 HydrophobicContact CD2-CE2 4.28Å; L657-Y661 VanDerWaalsContact O-CD2 3.28Å; L657-Y661 WeakPolarHBondContact O-CD2 3.42Å; L657-Y661 PolarHBondContact O-N 2.76Å; L657-V666 VanDerWaalsContact C-CG1 3.5Å; L657-V666 HydrophobicContact CB-CG1 3.71Å; L657-H670 WeakPolarHBondContact CD2-ND1 3.47Å
658	A	83.4	Confident	86.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-41.7	178	0	0	0	0	0	111.8	L650 S655 N662 D663 V666	L650-A658 HydrophobicContact CB-CB 4.36Å; L650-A658 WeakPolarHBondContact O-CB 3.22Å; S655-A658 PolarHBondContact O-N 2.93Å; S655-A658 VanDerWaalsContact O-N 3.13Å; S655-A658 VanDerWaalsContact OG-CB 3.3Å; S655-A658 WeakPolarHBondContact OG-CB 3.19Å; S655-A658 PolarHBondContact OG-N 3Å; A658-N662 WeakPolarHBondContact O-CA 3.46Å; A658-N662 PolarHBondContact O-N 3.32Å; A658-D663 WeakPolarHBondContact CB-OD1 3.43Å; A658-D663 PolarHBondContact O-N 2.85Å; A658-V666 HydrophobicContact CB-CG1 4.46Å; A658-V666 HydrophobicContact CB-CG2 4.4Å
659	I	76.4	Confident	87.2	Confident	117 Å²	117	46.6 Å²	46.6	60%	0.6	26%	0.262	S	S	*	.	H	α-helix	trans	-63.7	-45.3	174.1	-64.3	168.1	0	0	0	111	S655 E656 L657 Y661 N662	S655-I659 WeakPolarHBondContact O-CG1 3.35Å; S655-I659 PolarHBondContact O-N 2.91Å; E656-I659 PolarHBondContact O-N 3.3Å; L657-I659 VanDerWaalsContact C-N 3.34Å; L657-I659 PolarHBondContact O-N 3.35Å; I659-Y661 PolarHBondContact O-N 2.86Å; I659-N662 PolarHBondContact O-N 3.1Å
660	L	82.3	Confident	87.5	Confident	110 Å²	110	46.8 Å²	46.8	58%	0.576	26%	0.263	S	S	*	.	H	α-helix	trans	-61.5	-42.6	-179.1	179.1	62.3	0	0	0	112.1	E656 L657	E656-L660 VanDerWaalsContact O-CB 3.28Å; E656-L660 WeakPolarHBondContact O-CB 3.49Å; E656-L660 PolarHBondContact O-N 3.31Å; L657-L660 PolarHBondContact O-N 3.46Å
661	Y	84.1	Confident	87.9	Confident	45 Å²	45	46.2 Å²	46.2	18%	0.176	26%	0.26	C	S	.	.	H	α-helix	trans	-97.6	10	-177.6	-63.7	-66.4	0	0	0	113.9	L657 I659 D663 T664 V666 S669 H670 A673	L657-Y661 HydrophobicContact CD2-CE2 4.28Å; L657-Y661 VanDerWaalsContact O-CD2 3.28Å; L657-Y661 WeakPolarHBondContact O-CD2 3.42Å; L657-Y661 PolarHBondContact O-N 2.76Å; I659-Y661 PolarHBondContact O-N 2.86Å; Y661-D663 VanDerWaalsContact C-N 3.3Å; Y661-D663 PolarHBondContact O-N 3.35Å; Y661-T664 PolarHBondContact O-N 2.98Å; Y661-T664 VanDerWaalsContact O-N 3.12Å; Y661-V666 HydrophobicContact CD2-CG1 4.21Å; Y661-V666 WeakPolarHBondContact CD2-O 3.48Å; Y661-S669 VanDerWaalsContact CD1-CB 3.44Å; Y661-H670 HydrophobicContact CD2-CB 4.42Å; Y661-H670 HydrophobicContact CE2-CB 3.64Å; Y661-H670 WeakPolarHBondContact OH-CA 3.46Å; Y661-A673 WeakPolarHBondContact OH-CB 3.48Å
662	N	83.6	Confident	88.4	Confident	122 Å²	122	46 Å²	46	65%	0.652	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	46.9	176.1	-50.6	-87.6	0	0	0	112.5	A658 I659 T664	A658-N662 WeakPolarHBondContact O-CA 3.46Å; A658-N662 PolarHBondContact O-N 3.32Å; I659-N662 PolarHBondContact O-N 3.1Å; N662-T664 PolarHBondContact O-N 3.37Å; N662-T664 PolarHBondContact O-OG1 3.16Å
663	D	79.4	Confident	89.1	Confident	50 Å²	50	45.5 Å²	45.5	27%	0.267	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	13.4	-179.2	-54.1	-35.5	0	0	0	115	C651 A658 Y661	C651-D663 HydrophobicContact CB-CB 4.41Å; A658-D663 WeakPolarHBondContact CB-OD1 3.43Å; A658-D663 PolarHBondContact O-N 2.85Å; Y661-D663 VanDerWaalsContact C-N 3.3Å; Y661-D663 PolarHBondContact O-N 3.35Å
664	T	83.4	Confident	89.6	Confident	71 Å²	71	44.7 Å²	44.7	44%	0.436	25%	0.25	S	C	.	.	S	Bend	trans	-112	115.5	-173.4	-55.2	0	0	0	0	110.7	Y661 N662 V666	Y661-T664 PolarHBondContact O-N 2.98Å; Y661-T664 VanDerWaalsContact O-N 3.12Å; N662-T664 PolarHBondContact O-N 3.37Å; N662-T664 PolarHBondContact O-OG1 3.16Å; T664-V666 PolarHBondContact O-N 2.98Å
665	A	89.3	Confident	90.3	Very high	6 Å²	6	42.8 Å²	42.8	5%	0.05	23%	0.23	C	C	.	.	S	Bend	trans	44.2	49.4	-179.7	0	0	0	0	0	112	L667 S669 L708	A665-L667 PolarHBondContact O-N 3.44Å; A665-S669 WeakPolarHBondContact O-CB 3.41Å; A665-S669 PolarHBondContact O-N 2.84Å; A665-S669 PolarHBondContact O-OG 2.88Å; A665-L708 HydrophobicContact CB-CD2 4.49Å
666	V	90.9	Very high	90.7	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-58.7	-52.9	-163.5	174.2	0	0	0	0	111	N647 L650 L657 A658 Y661 T664 H670	N647-V666 WeakPolarHBondContact OD1-CB 3.35Å; L650-V666 HydrophobicContact CD1-CG1 4.06Å; L657-V666 VanDerWaalsContact C-CG1 3.5Å; L657-V666 HydrophobicContact CB-CG1 3.71Å; A658-V666 HydrophobicContact CB-CG1 4.46Å; A658-V666 HydrophobicContact CB-CG2 4.4Å; Y661-V666 HydrophobicContact CD2-CG1 4.21Å; Y661-V666 WeakPolarHBondContact CD2-O 3.48Å; T664-V666 PolarHBondContact O-N 2.98Å; V666-H670 WeakPolarHBondContact O-CB 3.32Å; V666-H670 PolarHBondContact O-N 2.84Å; V666-H670 VanDerWaalsContact O-N 3.09Å
667	L	97.6	Very high	91.1	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-71.1	-47.6	-178.1	-75.5	170.6	0	0	0	111.9	P643 R645 N647 L650 A665 S669 H670 H671	P643-L667 HydrophobicContact CG-CD2 3.91Å; R645-L667 VanDerWaalsContact O-CD1 3.26Å; R645-L667 WeakPolarHBondContact O-CD1 3.44Å; N647-L667 VanDerWaalsContact OD1-CB 3.24Å; N647-L667 WeakPolarHBondContact OD1-CB 3.2Å; N647-L667 WeakPolarHBondContact OD1-CD1 3.47Å; N647-L667 WeakPolarHBondContact OD1-CG 3.4Å; N647-L667 PolarHBondContact OD1-N 3.38Å; L650-L667 HydrophobicContact CD1-CD1 4.11Å; L650-L667 HydrophobicContact CD1-CD2 3.62Å; L650-L667 HydrophobicContact CD1-CG 3.72Å; A665-L667 PolarHBondContact O-N 3.44Å; L667-S669 VanDerWaalsContact C-N 3.27Å; L667-S669 PolarHBondContact O-N 3.48Å; L667-H670 CarbonylContact O-C 3.54Å; L667-H670 WeakPolarHBondContact O-CA 3.25Å; L667-H670 VanDerWaalsContact O-CB 3.28Å; L667-H670 WeakPolarHBondContact O-CB 3.49Å; L667-H670 PolarHBondContact O-N 2.97Å; L667-H671 WeakPolarHBondContact CB-NE2 3.48Å; L667-H671 PolarHBondContact O-CD2 2.88Å; L667-H671 PolarHBondContact O-N 3.32Å; L667-H671 PolarHBondContact O-NE2 2.73Å
668	E	98.2	Very high	91.6	Very high	22 Å²	22	38.1 Å²	38.1	10%	0.103	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-37.5	-177.9	-59.8	79.5	-175.3	0	0	111.5	N647 A672 V707 L708 E711	N647-E668 PolarHBondContact ND2-OE1 2.86Å; N647-E668 PolarHBondContact ND2-OE2 3.46Å; E668-A672 PolarHBondContact O-N 2.89Å; E668-V707 WeakPolarHBondContact O-CG1 3.13Å; E668-L708 HydrophobicContact CB-CD2 3.99Å; E668-E711 HydrophobicContact CG-CB 3.95Å; E668-E711 WeakPolarHBondContact OE1-CA 3.37Å
669	S	96.1	Very high	92.1	Very high	30 Å²	30	38.2 Å²	38.2	21%	0.21	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-41	171.8	-60.7	0	0	0	0	111.7	Y661 A665 L667 A673	Y661-S669 VanDerWaalsContact CD1-CB 3.44Å; A665-S669 WeakPolarHBondContact O-CB 3.41Å; A665-S669 PolarHBondContact O-N 2.84Å; A665-S669 PolarHBondContact O-OG 2.88Å; L667-S669 VanDerWaalsContact C-N 3.27Å; L667-S669 PolarHBondContact O-N 3.48Å; S669-A673 WeakPolarHBondContact O-CB 3.45Å; S669-A673 PolarHBondContact O-N 3.21Å
670	H	98.4	Very high	92.8	Very high	17 Å²	17	37 Å²	37	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-49.6	177.1	-176.1	58.1	0	0	0	112.6	D641 L657 Y661 V666 L667 A672 A673 L674	D641-H670 IonicContact OD2-CD2 3.15Å; D641-H670 IonicContact OD2-CE1 3.6Å; D641-H670 IonicContact OD2-NE2 3.5Å; D641-H670 PolarHBondContact OD2-NE2 3.37Å; L657-H670 WeakPolarHBondContact CD2-ND1 3.47Å; Y661-H670 HydrophobicContact CD2-CB 4.42Å; Y661-H670 HydrophobicContact CE2-CB 3.64Å; Y661-H670 WeakPolarHBondContact OH-CA 3.46Å; V666-H670 WeakPolarHBondContact O-CB 3.32Å; V666-H670 PolarHBondContact O-N 2.84Å; V666-H670 VanDerWaalsContact O-N 3.09Å; L667-H670 CarbonylContact O-C 3.54Å; L667-H670 WeakPolarHBondContact O-CA 3.25Å; L667-H670 VanDerWaalsContact O-CB 3.28Å; L667-H670 WeakPolarHBondContact O-CB 3.49Å; L667-H670 PolarHBondContact O-N 2.97Å; H670-A672 VanDerWaalsContact C-N 3.34Å; H670-A672 PolarHBondContact O-N 3.49Å; H670-A673 PolarHBondContact O-N 2.91Å; H670-L674 VanDerWaalsContact O-CB 3.31Å; H670-L674 WeakPolarHBondContact O-CB 3.41Å; H670-L674 PolarHBondContact O-N 2.64Å
671	H	98.6	Very high	93.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-55.6	-49.9	178.9	-57.5	-35.4	0	0	0	110.9	H638 D639 V640 H642 L667 A675 V707	H638-H671 WeakPolarHBondContact O-CB 3.22Å; H638-H671 PolarHBondContact O-CD2 3.05Å; D639-H671 IonicContact OD1-CD2 3.81Å; D639-H671 IonicContact OD1-NE2 3.93Å; V640-H671 HydrophobicContact CG1-CB 4.34Å; V640-H671 WeakPolarHBondContact CG1-O 3.25Å; V640-H671 PolarHBondContact O-ND1 2.73Å; H642-H671 AromaticContact CD2-CE1 3.97Å; H642-H671 AromaticContact CD2-NE2 3.7Å; L667-H671 WeakPolarHBondContact CB-NE2 3.48Å; L667-H671 PolarHBondContact O-CD2 2.88Å; L667-H671 PolarHBondContact O-N 3.32Å; L667-H671 PolarHBondContact O-NE2 2.73Å; H671-A675 WeakPolarHBondContact O-CB 3.45Å; H671-A675 PolarHBondContact O-N 3.01Å; H671-V707 HydrophobicContact CB-CG1 4.12Å
672	A	98.2	Very high	93.1	Very high	7 Å²	7	42 Å²	42	6%	0.058	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-48.3	176.6	0	0	0	0	0	112	E668 H670 F676 I704 V707	E668-A672 PolarHBondContact O-N 2.89Å; H670-A672 VanDerWaalsContact C-N 3.34Å; H670-A672 PolarHBondContact O-N 3.49Å; A672-F676 VanDerWaalsContact O-CD2 3.25Å; A672-F676 WeakPolarHBondContact O-CD2 3.22Å; A672-F676 PolarHBondContact O-N 2.75Å; A672-I704 HydrophobicContact CB-CG1 4.46Å; A672-V707 HydrophobicContact CB-CB 4.38Å; A672-V707 HydrophobicContact CB-CG1 4.07Å
673	A	97.1	Very high	93.2	Very high	28 Å²	28	38.3 Å²	38.3	23%	0.231	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-50.8	-177.9	0	0	0	0	0	111.9	Y661 S669 H670 F676 Q677	Y661-A673 WeakPolarHBondContact OH-CB 3.48Å; S669-A673 WeakPolarHBondContact O-CB 3.45Å; S669-A673 PolarHBondContact O-N 3.21Å; H670-A673 PolarHBondContact O-N 2.91Å; A673-F676 PolarHBondContact O-N 2.84Å; A673-Q677 VanDerWaalsContact O-CG 3.29Å; A673-Q677 WeakPolarHBondContact O-CG 3.45Å; A673-Q677 PolarHBondContact O-N 2.68Å
674	L	97.8	Very high	93.7	Very high	22 Å²	22	43.2 Å²	43.2	12%	0.115	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-43.9	-177.5	-178.1	64.1	0	0	0	111.7	D641 H670 F676 Q677 L678	D641-L674 HydrophobicContact CB-CD2 3.22Å; H670-L674 VanDerWaalsContact O-CB 3.31Å; H670-L674 WeakPolarHBondContact O-CB 3.41Å; H670-L674 PolarHBondContact O-N 2.64Å; L674-F676 VanDerWaalsContact C-N 3.3Å; L674-F676 PolarHBondContact O-N 3.02Å; L674-Q677 PolarHBondContact O-N 3.35Å; L674-Q677 VanDerWaalsContact O-N 3.13Å; L674-L678 HydrophobicContact CD1-CD1 4.12Å; L674-L678 HydrophobicContact CD1-CD2 4.35Å; L674-L678 HydrophobicContact CD1-CG 3.9Å; L674-L678 HydrophobicContact CD2-CD1 4.36Å; L674-L678 HydrophobicContact CG-CD1 3.84Å; L674-L678 HydrophobicContact CG-CG 4.09Å; L674-L678 WeakPolarHBondContact O-CB 3.41Å; L674-L678 WeakPolarHBondContact O-CG 3.49Å; L674-L678 PolarHBondContact O-N 3.29Å
675	A	98.1	Very high	94.1	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.033	21%	0.206	C	C	.	.	H	α-helix	trans	-53.2	-48.2	177.5	0	0	0	0	0	111.8	M587 V637 V640 H671 T679	M587-A675 HydrophobicContact SD-CB 4.35Å; V637-A675 HydrophobicContact CB-CB 3.72Å; V637-A675 HydrophobicContact CG1-CB 3.98Å; V637-A675 HydrophobicContact CG2-CB 3.94Å; V640-A675 HydrophobicContact CG1-CB 4.12Å; H671-A675 WeakPolarHBondContact O-CB 3.45Å; H671-A675 PolarHBondContact O-N 3.01Å; A675-T679 WeakPolarHBondContact O-CB 3.4Å; A675-T679 PolarHBondContact O-N 2.73Å; A675-T679 PolarHBondContact O-OG1 3.49Å
676	F	98.1	Very high	94.4	Very high	9 Å²	9	41.1 Å²	41.1	4%	0.039	21%	0.21	C	C	.	.	H	α-helix	trans	-71.8	-35.8	178.5	-78.6	-75.9	0	0	0	113.3	A672 A673 L674 T679 I680 F688 F696 R700 I703 I704	A672-F676 VanDerWaalsContact O-CD2 3.25Å; A672-F676 WeakPolarHBondContact O-CD2 3.22Å; A672-F676 PolarHBondContact O-N 2.75Å; A673-F676 PolarHBondContact O-N 2.84Å; L674-F676 VanDerWaalsContact C-N 3.3Å; L674-F676 PolarHBondContact O-N 3.02Å; F676-T679 PolarHBondContact O-N 3.25Å; F676-I680 WeakPolarHBondContact O-CG1 3.2Å; F676-I680 PolarHBondContact O-N 3.49Å; F676-I680 VanDerWaalsContact O-N 3.08Å; F676-F688 HydrophobicContact CD1-CE2 4.06Å; F676-F688 HydrophobicContact CE1-CD2 4.39Å; F676-F688 AromaticContact CE1-CE2 3.73Å; F676-F688 HydrophobicContact CE1-CE2 3.73Å; F676-F688 HydrophobicContact CE1-CZ 4.16Å; F676-F696 HydrophobicContact CE1-CE2 4.15Å; F676-F696 HydrophobicContact CE1-CZ 4.46Å; F676-R700 HydrophobicContact CE1-CB 4.11Å; F676-R700 HydrophobicContact CE1-CG 3.89Å; F676-R700 HydrophobicContact CE2-CG 4.11Å; F676-R700 HydrophobicContact CZ-CB 4Å; F676-R700 HydrophobicContact CZ-CG 3.66Å; F676-I703 HydrophobicContact CE2-CB 4.43Å; F676-I703 HydrophobicContact CE2-CG2 4.01Å; F676-I703 HydrophobicContact CZ-CB 4.13Å; F676-I703 HydrophobicContact CZ-CD1 4.04Å; F676-I703 HydrophobicContact CZ-CG2 4.03Å; F676-I704 HydrophobicContact CD2-CG1 4.43Å; F676-I704 HydrophobicContact CE2-CD1 4.27Å; F676-I704 HydrophobicContact CE2-CG1 3.8Å
677	Q	96.8	Very high	94.7	Very high	128 Å²	128	41 Å²	41	60%	0.598	21%	0.21	S	C	*	.	H	α-helix	trans	-60.2	-50.6	173.8	-75	176	4.3	0	0	111.1	A673 L674 T679 I680 R681	A673-Q677 VanDerWaalsContact O-CG 3.29Å; A673-Q677 WeakPolarHBondContact O-CG 3.45Å; A673-Q677 PolarHBondContact O-N 2.68Å; L674-Q677 PolarHBondContact O-N 3.35Å; L674-Q677 VanDerWaalsContact O-N 3.13Å; Q677-T679 VanDerWaalsContact C-N 3.34Å; Q677-T679 PolarHBondContact O-N 3.43Å; Q677-I680 PolarHBondContact O-N 3.01Å; Q677-R681 VanDerWaalsContact O-CB 3.28Å; Q677-R681 WeakPolarHBondContact O-CB 3.49Å; Q677-R681 PolarHBondContact O-N 3.28Å
678	L	94.9	Very high	94.7	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-59.8	-44	178.2	-71.7	177.2	0	0	0	111.7	L586 M587 N590 L674 I680	L586-L678 HydrophobicContact CD1-CD2 4.4Å; L586-L678 HydrophobicContact CD2-CB 3.93Å; L586-L678 WeakPolarHBondContact CD2-O 3.33Å; L586-L678 HydrophobicContact CG-CB 4.29Å; M587-L678 HydrophobicContact CE-CB 3.69Å; M587-L678 HydrophobicContact CE-CD1 4.03Å; N590-L678 HydrophobicContact CB-CD1 4.09Å; N590-L678 WeakPolarHBondContact ND2-CD1 3.49Å; L674-L678 HydrophobicContact CD1-CD1 4.12Å; L674-L678 HydrophobicContact CD1-CD2 4.35Å; L674-L678 HydrophobicContact CD1-CG 3.9Å; L674-L678 HydrophobicContact CD2-CD1 4.36Å; L674-L678 HydrophobicContact CG-CD1 3.84Å; L674-L678 HydrophobicContact CG-CG 4.09Å; L674-L678 WeakPolarHBondContact O-CB 3.41Å; L674-L678 WeakPolarHBondContact O-CG 3.49Å; L674-L678 PolarHBondContact O-N 3.29Å; L678-I680 PolarHBondContact O-N 3.18Å
679	T	95.4	Very high	94.6	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-43.1	-179.2	-55.5	0	0	0	0	112.3	W583 A675 F676 Q677 N686 I687 F688	W583-T679 PolarHBondContact NE1-OG1 2.58Å; A675-T679 WeakPolarHBondContact O-CB 3.4Å; A675-T679 PolarHBondContact O-N 2.73Å; A675-T679 PolarHBondContact O-OG1 3.49Å; F676-T679 PolarHBondContact O-N 3.25Å; Q677-T679 VanDerWaalsContact C-N 3.34Å; Q677-T679 PolarHBondContact O-N 3.43Å; T679-N686 WeakPolarHBondContact O-CA 3.41Å; T679-N686 VanDerWaalsContact O-CB 3.23Å; T679-N686 WeakPolarHBondContact O-CB 3.41Å; T679-N686 PolarHBondContact O-N 3.03Å; T679-I687 HydrophobicContact CG2-CG1 4.11Å; T679-F688 HydrophobicContact CG2-CD2 3.6Å; T679-F688 HydrophobicContact CG2-CE2 3.7Å
680	I	90.4	Very high	94.5	Very high	90 Å²	90	49.5 Å²	49.5	46%	0.462	25%	0.246	S	C	.	.	H	α-helix	trans	-83.3	-24.7	-174.2	-63	167.2	0	0	0	111.8	F676 Q677 L678 D682 F696	F676-I680 WeakPolarHBondContact O-CG1 3.2Å; F676-I680 PolarHBondContact O-N 3.49Å; F676-I680 VanDerWaalsContact O-N 3.08Å; Q677-I680 PolarHBondContact O-N 3.01Å; L678-I680 PolarHBondContact O-N 3.18Å; I680-D682 PolarHBondContact O-N 3.21Å; I680-F696 HydrophobicContact CD1-CZ 4.46Å
681	R	88.3	Confident	94.4	Very high	194 Å²	194	49.7 Å²	49.7	73%	0.732	25%	0.248	S	C	*	.	H	α-helix	trans	-62	-37.7	-175.9	-170.3	178.9	76.1	-179.4	2	113.6	Q677	Q677-R681 VanDerWaalsContact O-CB 3.28Å; Q677-R681 WeakPolarHBondContact O-CB 3.49Å; Q677-R681 PolarHBondContact O-N 3.28Å
682	D	84.8	Confident	94.1	Very high	68 Å²	68	53.7 Å²	53.7	36%	0.364	27%	0.269	S	S	.	.			trans	-118.1	120.3	179.7	-177.9	5.7	0	0	0	111.1	I680 K684 S685 N686	I680-D682 PolarHBondContact O-N 3.21Å; D682-K684 PolarHBondContact O-N 3.39Å; D682-K684 VanDerWaalsContact O-N 3.07Å; D682-K684 PolarHBondContact OD1-N 3.19Å; D682-S685 PolarHBondContact O-N 3.48Å; D682-N686 PolarHBondContact O-N 2.87Å; D682-N686 VanDerWaalsContact O-N 3.07Å
683	G	84.6	Confident	93.8	Very high	44 Å²	44	63.8 Å²	63.8	45%	0.454	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.2	177.8	0	0	0	0	0	114.6
684	K	89.8	Confident	93.6	Very high	153 Å²	153	68.1 Å²	68.1	67%	0.665	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.1	173.9	-62.7	-179.5	-178	177.3	0	113.9	T579 D682	T579-K684 WeakPolarHBondContact CA-O 3.36Å; T579-K684 WeakPolarHBondContact CG2-O 3.33Å; D682-K684 PolarHBondContact O-N 3.39Å; D682-K684 VanDerWaalsContact O-N 3.07Å; D682-K684 PolarHBondContact OD1-N 3.19Å
685	S	91.9	Very high	93.3	Very high	7 Å²	7	69.4 Å²	69.4	5%	0.049	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-3.2	179.4	-56.4	0	0	0	0	112.1	W583 D682 I687	W583-S685 WeakPolarHBondContact CB-O 3.41Å; D682-S685 PolarHBondContact O-N 3.48Å; S685-I687 PolarHBondContact O-N 2.98Å
686	N	96.9	Very high	93.2	Very high	25 Å²	25	71.6 Å²	71.6	13%	0.134	34%	0.339	C	S	.	.			trans	-78.4	87.2	-179.5	-169.3	-9.7	0	0	0	111.7	T679 D682 F688 K689	T679-N686 WeakPolarHBondContact O-CA 3.41Å; T679-N686 VanDerWaalsContact O-CB 3.23Å; T679-N686 WeakPolarHBondContact O-CB 3.41Å; T679-N686 PolarHBondContact O-N 3.03Å; D682-N686 PolarHBondContact O-N 2.87Å; D682-N686 VanDerWaalsContact O-N 3.07Å; N686-F688 PolarHBondContact O-N 3.06Å; N686-F688 WeakPolarHBondContact OD1-CA 3.24Å; N686-F688 PolarHBondContact OD1-N 3.42Å; N686-K689 HydrophobicContact CB-CB 4.25Å; N686-K689 VanDerWaalsContact O-CB 3.3Å; N686-K689 WeakPolarHBondContact O-CB 3.23Å; N686-K689 PolarHBondContact O-N 2.83Å; N686-K689 PolarHBondContact OD1-N 3.09Å
687	I	97.8	Very high	93	Very high	0 Å²	0	80.1 Å²	80.1	0%	0	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.3	175	57.8	167.4	0	0	0	113.3	L573 T579 L580 W583 I633 T679 S685	L573-I687 HydrophobicContact CD1-CB 4.23Å; L573-I687 HydrophobicContact CD1-CD1 4.09Å; L573-I687 HydrophobicContact CD1-CG1 4.41Å; T579-I687 HydrophobicContact CG2-CG2 4.15Å; L580-I687 HydrophobicContact CD1-CG2 4.38Å; W583-I687 HydrophobicContact CB-CG2 3.6Å; W583-I687 HydrophobicContact CD2-CD1 3.69Å; W583-I687 HydrophobicContact CD2-CG1 4.23Å; W583-I687 HydrophobicContact CD2-CG2 4.2Å; W583-I687 HydrophobicContact CE3-CD1 3.99Å; W583-I687 HydrophobicContact CG-CD1 4.17Å; W583-I687 HydrophobicContact CG-CG1 4.19Å; W583-I687 HydrophobicContact CG-CG2 3.76Å; W583-I687 HydrophobicContact CH2-CD1 4.22Å; W583-I687 HydrophobicContact CZ2-CD1 3.92Å; W583-I687 HydrophobicContact CZ3-CD1 4.24Å; I633-I687 HydrophobicContact CD1-CD1 4.08Å; T679-I687 HydrophobicContact CG2-CG1 4.11Å; S685-I687 PolarHBondContact O-N 2.98Å
688	F	97.3	Very high	92.9	Very high	13 Å²	13	77.8 Å²	77.8	6%	0.057	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	6.2	179.3	-50.5	-59.8	0	0	0	113.5	L573 I633 F676 T679 N686 N690 I691 F696 L699 I703	L573-F688 HydrophobicContact CD1-CE1 4.44Å; L573-F688 HydrophobicContact CD2-CD1 4.25Å; L573-F688 HydrophobicContact CD2-CE1 4.48Å; I633-F688 HydrophobicContact CD1-CE1 3.79Å; I633-F688 HydrophobicContact CD1-CZ 4.05Å; I633-F688 HydrophobicContact CG2-CZ 4.41Å; F676-F688 HydrophobicContact CD1-CE2 4.06Å; F676-F688 HydrophobicContact CE1-CD2 4.39Å; F676-F688 AromaticContact CE1-CE2 3.73Å; F676-F688 HydrophobicContact CE1-CE2 3.73Å; F676-F688 HydrophobicContact CE1-CZ 4.16Å; T679-F688 HydrophobicContact CG2-CD2 3.6Å; T679-F688 HydrophobicContact CG2-CE2 3.7Å; N686-F688 PolarHBondContact O-N 3.06Å; N686-F688 WeakPolarHBondContact OD1-CA 3.24Å; N686-F688 PolarHBondContact OD1-N 3.42Å; F688-N690 VanDerWaalsContact C-N 3.27Å; F688-N690 PolarHBondContact O-N 3.46Å; F688-I691 HydrophobicContact CB-CD1 4.13Å; F688-I691 HydrophobicContact CB-CG1 4.3Å; F688-I691 HydrophobicContact CD1-CD1 4.08Å; F688-I691 VanDerWaalsContact O-CG1 3.29Å; F688-I691 WeakPolarHBondContact O-CG1 3.45Å; F688-F696 HydrophobicContact CB-CD2 3.75Å; F688-F696 HydrophobicContact CB-CE2 3.8Å; F688-F696 HydrophobicContact CD1-CD2 4.27Å; F688-F696 HydrophobicContact CD1-CE2 4.39Å; F688-F696 HydrophobicContact CD2-CD2 4.41Å; F688-F696 AromaticContact CD2-CE2 3.77Å; F688-F696 HydrophobicContact CD2-CE2 3.77Å; F688-F696 HydrophobicContact CE2-CE2 4.46Å; F688-F696 AromaticContact CG-CD2 3.9Å; F688-F696 HydrophobicContact CG-CD2 3.9Å; F688-F696 AromaticContact CG-CE2 3.73Å; F688-F696 HydrophobicContact CG-CE2 3.73Å; F688-L699 HydrophobicContact CD1-CD2 4.02Å; F688-L699 HydrophobicContact CE1-CD2 3.74Å; F688-I703 HydrophobicContact CE1-CD1 4.43Å; F688-I703 HydrophobicContact CZ-CD1 4.15Å
689	K	95.2	Very high	93	Very high	136 Å²	136	77.5 Å²	77.5	59%	0.591	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-34.3	-171.4	-176	-178.5	177.1	-177	0	113.7	N686	N686-K689 HydrophobicContact CB-CB 4.25Å; N686-K689 VanDerWaalsContact O-CB 3.3Å; N686-K689 WeakPolarHBondContact O-CB 3.23Å; N686-K689 PolarHBondContact O-N 2.83Å; N686-K689 PolarHBondContact OD1-N 3.09Å
690	N	94.8	Very high	93.1	Very high	84 Å²	84	81.5 Å²	81.5	45%	0.449	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	8.1	-166.6	-60.1	-29	0	0	0	113.9	N574 F688	N574-N690 HydrophobicContact CB-CB 3.94Å; N574-N690 VanDerWaalsContact O-CB 3.29Å; N574-N690 WeakPolarHBondContact O-CB 3.43Å; N574-N690 PolarHBondContact O-ND2 3.02Å; F688-N690 VanDerWaalsContact C-N 3.27Å; F688-N690 PolarHBondContact O-N 3.46Å
691	I	94.8	Very high	93.4	Very high	22 Å²	22	82.9 Å²	82.9	11%	0.113	38%	0.383	C	S	.	.	S	Bend	trans	-91.5	156.1	173.8	59.5	171.5	0	0	0	111.2	L573 F688 F696 L699	L573-I691 HydrophobicContact CB-CG2 4.28Å; L573-I691 HydrophobicContact CD2-CD1 4.34Å; L573-I691 HydrophobicContact CD2-CG2 4.06Å; L573-I691 VanDerWaalsContact O-CG2 3.28Å; L573-I691 WeakPolarHBondContact O-CG2 3.42Å; F688-I691 HydrophobicContact CB-CD1 4.13Å; F688-I691 HydrophobicContact CB-CG1 4.3Å; F688-I691 HydrophobicContact CD1-CD1 4.08Å; F688-I691 VanDerWaalsContact O-CG1 3.29Å; F688-I691 WeakPolarHBondContact O-CG1 3.45Å; I691-F696 HydrophobicContact CD1-CB 3.59Å; I691-F696 HydrophobicContact CD1-CD2 3.96Å; I691-F696 HydrophobicContact CD1-CG 4.25Å; I691-F696 HydrophobicContact CG1-CB 3.97Å; I691-L699 HydrophobicContact CD1-CD2 4.25Å
692	D	93.3	Very high	93.9	Very high	84 Å²	84	73.9 Å²	73.9	45%	0.449	35%	0.351	S	S	.	.			trans	-71.2	158.7	178	79.1	83.7	0	0	0	112	N694 Q695 F696	D692-N694 VanDerWaalsContact C-N 3.29Å; D692-N694 PolarHBondContact O-N 3.26Å; D692-N694 WeakPolarHBondContact OD1-CA 3.49Å; D692-N694 WeakPolarHBondContact OD1-CB 3.33Å; D692-N694 PolarHBondContact OD1-N 3.32Å; D692-Q695 PolarHBondContact O-N 3.49Å; D692-Q695 PolarHBondContact OD1-N 2.85Å; D692-Q695 WeakPolarHBondContact OD2-CB 3Å; D692-Q695 PolarHBondContact OD2-OE1 2.91Å; D692-F696 WeakPolarHBondContact O-CB 3.4Å; D692-F696 PolarHBondContact O-N 3.17Å
693	R	91.7	Very high	94.5	Very high	220 Å²	220	70.7 Å²	70.7	83%	0.83	33%	0.334	S	S	*	.	H	α-helix	trans	-63.4	-32.8	-174.4	-173.3	176.5	177.6	179.5	-0.2	113.3	R697	R693-R697 WeakPolarHBondContact O-CB 3.12Å; R693-R697 PolarHBondContact O-N 3.39Å; R693-R697 VanDerWaalsContact O-N 3.09Å
694	N	92	Very high	95.2	Very high	118 Å²	118	70.2 Å²	70.2	63%	0.631	32%	0.32	S	S	*	.	H	α-helix	trans	-77	-44.7	-179.1	-66.5	-31.9	0	0	0	110.2	D692 R697 T698	D692-N694 VanDerWaalsContact C-N 3.29Å; D692-N694 PolarHBondContact O-N 3.26Å; D692-N694 WeakPolarHBondContact OD1-CA 3.49Å; D692-N694 WeakPolarHBondContact OD1-CB 3.33Å; D692-N694 PolarHBondContact OD1-N 3.32Å; N694-R697 WeakPolarHBondContact O-CB 3.48Å; N694-R697 PolarHBondContact O-N 3.05Å; N694-T698 PolarHBondContact O-N 3.45Å; N694-T698 PolarHBondContact O-OG1 2.7Å
695	Q	92.4	Very high	95.6	Very high	49 Å²	49	64 Å²	64	23%	0.229	29%	0.294	C	S	.	.	H	α-helix	trans	-60.2	-45.2	173.8	-172.8	-176.8	26.6	0	0	111.2	F572 L626 D692 R697 T698 L699	F572-Q695 HydrophobicContact CZ-CG 4.5Å; L626-Q695 HydrophobicContact CD1-CG 4.36Å; D692-Q695 PolarHBondContact O-N 3.49Å; D692-Q695 PolarHBondContact OD1-N 2.85Å; D692-Q695 WeakPolarHBondContact OD2-CB 3Å; D692-Q695 PolarHBondContact OD2-OE1 2.91Å; Q695-R697 VanDerWaalsContact C-N 3.32Å; Q695-R697 PolarHBondContact O-N 3.27Å; Q695-T698 PolarHBondContact O-N 3.05Å; Q695-L699 VanDerWaalsContact O-CB 3.26Å; Q695-L699 WeakPolarHBondContact O-CB 3.49Å; Q695-L699 PolarHBondContact O-N 3.29Å
696	F	95.8	Very high	95.9	Very high	50 Å²	50	63.7 Å²	63.7	22%	0.219	29%	0.292	C	S	.	.	H	α-helix	trans	-58.5	-43.2	174.2	175.9	-116.8	0	0	0	112.1	F676 I680 F688 I691 D692 T698 L699 R700	F676-F696 HydrophobicContact CE1-CE2 4.15Å; F676-F696 HydrophobicContact CE1-CZ 4.46Å; I680-F696 HydrophobicContact CD1-CZ 4.46Å; F688-F696 HydrophobicContact CB-CD2 3.75Å; F688-F696 HydrophobicContact CB-CE2 3.8Å; F688-F696 HydrophobicContact CD1-CD2 4.27Å; F688-F696 HydrophobicContact CD1-CE2 4.39Å; F688-F696 HydrophobicContact CD2-CD2 4.41Å; F688-F696 AromaticContact CD2-CE2 3.77Å; F688-F696 HydrophobicContact CD2-CE2 3.77Å; F688-F696 HydrophobicContact CE2-CE2 4.46Å; F688-F696 AromaticContact CG-CD2 3.9Å; F688-F696 HydrophobicContact CG-CD2 3.9Å; F688-F696 AromaticContact CG-CE2 3.73Å; F688-F696 HydrophobicContact CG-CE2 3.73Å; I691-F696 HydrophobicContact CD1-CB 3.59Å; I691-F696 HydrophobicContact CD1-CD2 3.96Å; I691-F696 HydrophobicContact CD1-CG 4.25Å; I691-F696 HydrophobicContact CG1-CB 3.97Å; D692-F696 WeakPolarHBondContact O-CB 3.4Å; D692-F696 PolarHBondContact O-N 3.17Å; F696-T698 PolarHBondContact O-N 3.09Å; F696-L699 PolarHBondContact O-N 3.12Å; F696-R700 HydrophobicContact CE2-CB 4.36Å; F696-R700 HydrophobicContact CZ-CB 4.45Å; F696-R700 WeakPolarHBondContact O-CB 3.19Å; F696-R700 PolarHBondContact O-N 2.64Å
697	R	94.7	Very high	96	Very high	189 Å²	189	62.5 Å²	62.5	71%	0.713	29%	0.286	S	S	*	.	H	α-helix	trans	-61.6	-45.9	179.1	-175.5	-179.3	179.7	-179.3	-0.4	111.5	R693 N694 Q695 Q701	R693-R697 WeakPolarHBondContact O-CB 3.12Å; R693-R697 PolarHBondContact O-N 3.39Å; R693-R697 VanDerWaalsContact O-N 3.09Å; N694-R697 WeakPolarHBondContact O-CB 3.48Å; N694-R697 PolarHBondContact O-N 3.05Å; Q695-R697 VanDerWaalsContact C-N 3.32Å; Q695-R697 PolarHBondContact O-N 3.27Å; R697-Q701 WeakPolarHBondContact O-CB 3.46Å; R697-Q701 PolarHBondContact O-N 2.76Å
698	T	94.4	Very high	96	Very high	79 Å²	79	65.2 Å²	65.2	49%	0.485	30%	0.3	S	S	.	.	H	α-helix	trans	-66.4	-46	178.9	-56.3	0	0	0	0	111.4	L626 N694 Q695 F696 Q701 A702	L626-T698 HydrophobicContact CD1-CG2 3.91Å; L626-T698 HydrophobicContact CD2-CG2 4.06Å; N694-T698 PolarHBondContact O-N 3.45Å; N694-T698 PolarHBondContact O-OG1 2.7Å; Q695-T698 PolarHBondContact O-N 3.05Å; F696-T698 PolarHBondContact O-N 3.09Å; T698-Q701 PolarHBondContact O-N 3.24Å; T698-A702 PolarHBondContact O-N 2.82Å
699	L	96.9	Very high	96	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-47.3	178	-179.5	61.4	0	0	0	111.5	L573 L626 V629 A630 F688 I691 Q695 F696 Q701 A702 I703	L573-L699 HydrophobicContact CD2-CD2 3.58Å; L626-L699 HydrophobicContact CD2-CD1 4.4Å; L626-L699 HydrophobicContact CG-CD1 4.37Å; V629-L699 HydrophobicContact CG1-CD1 4.12Å; V629-L699 HydrophobicContact CG1-CD2 4.33Å; A630-L699 HydrophobicContact CB-CD1 3.72Å; F688-L699 HydrophobicContact CD1-CD2 4.02Å; F688-L699 HydrophobicContact CE1-CD2 3.74Å; I691-L699 HydrophobicContact CD1-CD2 4.25Å; Q695-L699 VanDerWaalsContact O-CB 3.26Å; Q695-L699 WeakPolarHBondContact O-CB 3.49Å; Q695-L699 PolarHBondContact O-N 3.29Å; F696-L699 PolarHBondContact O-N 3.12Å; L699-Q701 VanDerWaalsContact C-N 3.32Å; L699-Q701 PolarHBondContact O-N 3.48Å; L699-A702 PolarHBondContact O-N 2.96Å; L699-I703 HydrophobicContact CD1-CD1 4.03Å; L699-I703 HydrophobicContact CD1-CG1 4.37Å; L699-I703 HydrophobicContact CG-CD1 3.81Å; L699-I703 VanDerWaalsContact O-CG1 3.32Å; L699-I703 WeakPolarHBondContact O-CG1 3.4Å; L699-I703 PolarHBondContact O-N 3.33Å
700	R	97.7	Very high	96.1	Very high	86 Å²	86	58.4 Å²	58.4	33%	0.325	27%	0.271	S	S	.	.	H	α-helix	trans	-57.8	-44.9	175.7	174.3	177.8	173.6	84	4.1	111.5	F676 F696 A702 I703 I704	F676-R700 HydrophobicContact CE1-CB 4.11Å; F676-R700 HydrophobicContact CE1-CG 3.89Å; F676-R700 HydrophobicContact CE2-CG 4.11Å; F676-R700 HydrophobicContact CZ-CB 4Å; F676-R700 HydrophobicContact CZ-CG 3.66Å; F696-R700 HydrophobicContact CE2-CB 4.36Å; F696-R700 HydrophobicContact CZ-CB 4.45Å; F696-R700 WeakPolarHBondContact O-CB 3.19Å; F696-R700 PolarHBondContact O-N 2.64Å; R700-A702 VanDerWaalsContact C-N 3.33Å; R700-A702 PolarHBondContact O-N 2.88Å; R700-I703 PolarHBondContact O-N 2.96Å; R700-I704 HydrophobicContact CG-CD1 3.7Å; R700-I704 HydrophobicContact CG-CG1 4.41Å; R700-I704 VanDerWaalsContact O-CG1 3.27Å; R700-I704 WeakPolarHBondContact O-CG1 3.22Å; R700-I704 PolarHBondContact O-N 3.03Å
701	Q	96.9	Very high	95.9	Very high	119 Å²	119	55 Å²	55	56%	0.556	25%	0.252	S	S	*	.	H	α-helix	trans	-62.1	-42	178.6	-175.4	62.2	63	0	0	111.5	R697 T698 L699 D705	R697-Q701 WeakPolarHBondContact O-CB 3.46Å; R697-Q701 PolarHBondContact O-N 2.76Å; T698-Q701 PolarHBondContact O-N 3.24Å; L699-Q701 VanDerWaalsContact C-N 3.32Å; L699-Q701 PolarHBondContact O-N 3.48Å; Q701-D705 VanDerWaalsContact O-CB 3.28Å; Q701-D705 WeakPolarHBondContact O-CB 3.48Å; Q701-D705 PolarHBondContact O-N 3.05Å
702	A	97.6	Very high	95.4	Very high	6 Å²	6	55.1 Å²	55.1	5%	0.05	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-44	177.7	0	0	0	0	0	112.3	A630 T698 L699 R700 D705 M706	A630-A702 HydrophobicContact CB-CB 3.73Å; T698-A702 PolarHBondContact O-N 2.82Å; L699-A702 PolarHBondContact O-N 2.96Å; R700-A702 VanDerWaalsContact C-N 3.33Å; R700-A702 PolarHBondContact O-N 2.88Å; A702-D705 PolarHBondContact O-N 2.99Å; A702-M706 VanDerWaalsContact O-CG 3.3Å; A702-M706 WeakPolarHBondContact O-CG 3.39Å; A702-M706 PolarHBondContact O-N 3.4Å
703	I	98.7	Very high	94.7	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-49.3	177.7	-66.6	159.8	0	0	0	110.6	A630 I633 A634 V637 F676 F688 L699 R700 D705 M706 V707	A630-I703 HydrophobicContact CB-CG1 4.14Å; I633-I703 HydrophobicContact CB-CD1 4.01Å; I633-I703 HydrophobicContact CB-CG1 4.22Å; I633-I703 HydrophobicContact CD1-CD1 4.14Å; I633-I703 HydrophobicContact CG2-CD1 3.62Å; I633-I703 HydrophobicContact CG2-CG1 4.08Å; I633-I703 HydrophobicContact CG2-CG2 4.2Å; A634-I703 HydrophobicContact CB-CG2 4.41Å; V637-I703 HydrophobicContact CG2-CG2 4.48Å; F676-I703 HydrophobicContact CE2-CB 4.43Å; F676-I703 HydrophobicContact CE2-CG2 4.01Å; F676-I703 HydrophobicContact CZ-CB 4.13Å; F676-I703 HydrophobicContact CZ-CD1 4.04Å; F676-I703 HydrophobicContact CZ-CG2 4.03Å; F688-I703 HydrophobicContact CE1-CD1 4.43Å; F688-I703 HydrophobicContact CZ-CD1 4.15Å; L699-I703 HydrophobicContact CD1-CD1 4.03Å; L699-I703 HydrophobicContact CD1-CG1 4.37Å; L699-I703 HydrophobicContact CG-CD1 3.81Å; L699-I703 VanDerWaalsContact O-CG1 3.32Å; L699-I703 WeakPolarHBondContact O-CG1 3.4Å; L699-I703 PolarHBondContact O-N 3.33Å; R700-I703 PolarHBondContact O-N 2.96Å; I703-D705 VanDerWaalsContact C-N 3.29Å; I703-D705 PolarHBondContact O-N 3.39Å; I703-M706 PolarHBondContact O-N 3.13Å; I703-V707 HydrophobicContact CG2-CG2 4.44Å; I703-V707 WeakPolarHBondContact O-CG2 3.45Å; I703-V707 PolarHBondContact O-N 3.15Å
704	I	98.3	Very high	94.2	Very high	34 Å²	34	48 Å²	48	17%	0.174	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-42.8	179.3	-68.2	169.9	0	0	0	110.7	A672 F676 R700 M706 V707 L708	A672-I704 HydrophobicContact CB-CG1 4.46Å; F676-I704 HydrophobicContact CD2-CG1 4.43Å; F676-I704 HydrophobicContact CE2-CD1 4.27Å; F676-I704 HydrophobicContact CE2-CG1 3.8Å; R700-I704 HydrophobicContact CG-CD1 3.7Å; R700-I704 HydrophobicContact CG-CG1 4.41Å; R700-I704 VanDerWaalsContact O-CG1 3.27Å; R700-I704 WeakPolarHBondContact O-CG1 3.22Å; R700-I704 PolarHBondContact O-N 3.03Å; I704-M706 VanDerWaalsContact C-N 3.34Å; I704-M706 PolarHBondContact O-N 2.77Å; I704-V707 PolarHBondContact O-N 3.02Å; I704-L708 HydrophobicContact CG2-CD1 3.78Å; I704-L708 HydrophobicContact CG2-CG 4.25Å; I704-L708 WeakPolarHBondContact O-CB 3.38Å; I704-L708 WeakPolarHBondContact O-CG 3.26Å; I704-L708 PolarHBondContact O-N 3.09Å
705	D	98.3	Very high	93.9	Very high	23 Å²	23	42.5 Å²	42.5	12%	0.123	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-42.7	179	-172.6	-90.6	0	0	0	112.5	Q701 A702 I703 A709 L759 R763	Q701-D705 VanDerWaalsContact O-CB 3.28Å; Q701-D705 WeakPolarHBondContact O-CB 3.48Å; Q701-D705 PolarHBondContact O-N 3.05Å; A702-D705 PolarHBondContact O-N 2.99Å; I703-D705 VanDerWaalsContact C-N 3.29Å; I703-D705 PolarHBondContact O-N 3.39Å; D705-A709 WeakPolarHBondContact O-CB 3.36Å; D705-A709 PolarHBondContact O-N 2.92Å; D705-L759 HydrophobicContact CB-CD1 4.24Å; D705-L759 WeakPolarHBondContact OD1-CD1 3.09Å; D705-R763 WeakPolarHBondContact OD1-CG 3.39Å; D705-R763 IonicContact OD1-CZ 3.15Å; D705-R763 IonicContact OD1-NE 2.71Å; D705-R763 PolarHBondContact OD1-NE 3.15Å; D705-R763 IonicContact OD1-NH2 3.78Å; D705-R763 IonicContact OD2-CZ 2.91Å; D705-R763 IonicContact OD2-NE 3.35Å; D705-R763 PolarHBondContact OD2-NE 3.46Å; D705-R763 IonicContact OD2-NH2 2.63Å; D705-R763 PolarHBondContact OD2-NH2 2.85Å
706	M	98.7	Very high	93.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67.9	-42.4	178.4	-70.4	-177.8	69.9	0	0	112.3	A630 A631 A634 A702 I703 I704 A709 K762 I766	A630-M706 HydrophobicContact CB-SD 4.47Å; A631-M706 VanDerWaalsContact CA-CE 3.45Å; A631-M706 HydrophobicContact CB-CE 3.55Å; A631-M706 HydrophobicContact CB-SD 4.07Å; A634-M706 HydrophobicContact CB-CB 3.65Å; A634-M706 HydrophobicContact CB-CE 4.28Å; A634-M706 HydrophobicContact CB-SD 4.22Å; A702-M706 VanDerWaalsContact O-CG 3.3Å; A702-M706 WeakPolarHBondContact O-CG 3.39Å; A702-M706 PolarHBondContact O-N 3.4Å; I703-M706 PolarHBondContact O-N 3.13Å; I704-M706 VanDerWaalsContact C-N 3.34Å; I704-M706 PolarHBondContact O-N 2.77Å; M706-A709 PolarHBondContact O-N 3.29Å; M706-K762 HydrophobicContact CE-CB 4.17Å; M706-K762 WeakPolarHBondContact CE-O 3.22Å; M706-K762 HydrophobicContact CG-CB 4.08Å; M706-K762 HydrophobicContact SD-CB 3.87Å; M706-K762 HydrophobicContact SD-CD 3.96Å; M706-K762 HydrophobicContact SD-CG 4.14Å; M706-I766 HydrophobicContact CB-CG2 4.13Å; M706-I766 HydrophobicContact CE-CB 3.7Å; M706-I766 HydrophobicContact CE-CG1 4.43Å; M706-I766 HydrophobicContact CE-CG2 4.05Å
707	V	98.8	Very high	92.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-45.2	176.5	175.3	0	0	0	0	110.7	A634 V637 H638 E668 H671 A672 I703 I704 A709 T710	A634-V707 HydrophobicContact CB-CG2 4.19Å; V637-V707 HydrophobicContact CG2-CG2 4.13Å; H638-V707 HydrophobicContact CB-CG2 4.32Å; E668-V707 WeakPolarHBondContact O-CG1 3.13Å; H671-V707 HydrophobicContact CB-CG1 4.12Å; A672-V707 HydrophobicContact CB-CB 4.38Å; A672-V707 HydrophobicContact CB-CG1 4.07Å; I703-V707 HydrophobicContact CG2-CG2 4.44Å; I703-V707 WeakPolarHBondContact O-CG2 3.45Å; I703-V707 PolarHBondContact O-N 3.15Å; I704-V707 PolarHBondContact O-N 3.02Å; V707-A709 PolarHBondContact O-N 3.24Å; V707-T710 PolarHBondContact O-N 3.31Å; V707-T710 VanDerWaalsContact O-N 3.15Å; V707-T710 PolarHBondContact O-OG1 2.92Å
708	L	97.5	Very high	92.5	Very high	56 Å²	56	33.7 Å²	33.7	29%	0.293	16%	0.163	S	C	.	.	H	α-helix	trans	-65.3	-24.2	176.6	-69.2	176.2	0	0	0	113.2	A665 E668 I704 T710 E711	A665-L708 HydrophobicContact CB-CD2 4.49Å; E668-L708 HydrophobicContact CB-CD2 3.99Å; I704-L708 HydrophobicContact CG2-CD1 3.78Å; I704-L708 HydrophobicContact CG2-CG 4.25Å; I704-L708 WeakPolarHBondContact O-CB 3.38Å; I704-L708 WeakPolarHBondContact O-CG 3.26Å; I704-L708 PolarHBondContact O-N 3.09Å; L708-T710 VanDerWaalsContact C-N 3.28Å; L708-T710 PolarHBondContact O-N 2.77Å; L708-E711 WeakPolarHBondContact O-CB 3.33Å; L708-E711 PolarHBondContact O-N 2.97Å
709	A	97.1	Very high	92.2	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-14.2	177.5	0	0	0	0	0	113.4	D705 M706 V707 E711 R763 K767	D705-A709 WeakPolarHBondContact O-CB 3.36Å; D705-A709 PolarHBondContact O-N 2.92Å; M706-A709 PolarHBondContact O-N 3.29Å; V707-A709 PolarHBondContact O-N 3.24Å; A709-E711 PolarHBondContact O-N 3.2Å; A709-R763 HydrophobicContact CB-CB 4.01Å; A709-R763 HydrophobicContact CB-CG 3.71Å; A709-K767 WeakPolarHBondContact O-CD 3.24Å; A709-K767 WeakPolarHBondContact O-CE 3.13Å; A709-K767 VanDerWaalsContact O-CG 3.28Å; A709-K767 WeakPolarHBondContact O-CG 3.47Å; A709-K767 PolarHBondContact O-NZ 3.41Å
710	T	97.6	Very high	91.5	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.031	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.8	174.8	64.7	0	0	0	0	111.6	H638 V707 L708 M712 I766 K767	H638-T710 HydrophobicContact CB-CG2 4.28Å; V707-T710 PolarHBondContact O-N 3.31Å; V707-T710 VanDerWaalsContact O-N 3.15Å; V707-T710 PolarHBondContact O-OG1 2.92Å; L708-T710 VanDerWaalsContact C-N 3.28Å; L708-T710 PolarHBondContact O-N 2.77Å; T710-M712 PolarHBondContact O-N 2.95Å; T710-M712 VanDerWaalsContact O-N 3.16Å; T710-I766 HydrophobicContact CG2-CG1 3.94Å; T710-K767 PolarHBondContact O-NZ 3Å
711	E	90.9	Very high	90.9	Very high	12 Å²	12	30 Å²	30	6%	0.056	15%	0.147	C	C	.	.			trans	-48.1	121.1	175.5	-167.6	-173.6	-165.7	0	0	111.6	E668 L708 A709 T713 R714 K767	E668-E711 HydrophobicContact CG-CB 3.95Å; E668-E711 WeakPolarHBondContact OE1-CA 3.37Å; L708-E711 WeakPolarHBondContact O-CB 3.33Å; L708-E711 PolarHBondContact O-N 2.97Å; A709-E711 PolarHBondContact O-N 3.2Å; E711-T713 VanDerWaalsContact C-N 3.35Å; E711-T713 HydrophobicContact CG-CG2 4.33Å; E711-T713 VanDerWaalsContact CG-OG1 3.29Å; E711-T713 WeakPolarHBondContact CG-OG1 3.5Å; E711-T713 PolarHBondContact O-N 3.34Å; E711-T713 PolarHBondContact OE1-OG1 3.45Å; E711-T713 PolarHBondContact OE2-OG1 2.85Å; E711-R714 PolarHBondContact O-N 2.97Å; E711-R714 WeakPolarHBondContact OE2-CD 3.42Å; E711-R714 IonicContact OE2-CZ 3.41Å; E711-R714 IonicContact OE2-NE 3.86Å; E711-R714 PolarHBondContact OE2-NE 2.9Å; E711-R714 IonicContact OE2-NH2 3.75Å; E711-K767 PolarHBondContact O-NZ 3.38Å
712	M	83.9	Confident	90.7	Very high	25 Å²	25	24.4 Å²	24.4	12%	0.123	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-74.8	-22.9	-174.1	-73.9	-61.2	-70.4	0	0	113.4	L491 T710 R714 H715 F829	L491-M712 HydrophobicContact CB-CB 4.01Å; T710-M712 PolarHBondContact O-N 2.95Å; T710-M712 VanDerWaalsContact O-N 3.16Å; M712-R714 PolarHBondContact O-N 3.38Å; M712-H715 HydrophobicContact CE-CB 4.42Å; M712-H715 WeakPolarHBondContact O-CB 3.49Å; M712-H715 PolarHBondContact O-N 3.42Å; M712-H715 VanDerWaalsContact O-N 3.08Å; M712-F829 HydrophobicContact CE-CD1 3.8Å; M712-F829 HydrophobicContact CE-CE1 3.99Å; M712-F829 HydrophobicContact CE-CG 4.15Å; M712-F829 HydrophobicContact CE-CZ 4.49Å
713	T	79.4	Confident	90.2	Very high	50 Å²	50	25.4 Å²	25.4	31%	0.307	13%	0.126	S	C	.	.	G	3₁₀ helix	trans	-59.6	-28.9	174.2	67.2	0	0	0	0	111.9	E711	E711-T713 VanDerWaalsContact C-N 3.35Å; E711-T713 HydrophobicContact CG-CG2 4.33Å; E711-T713 VanDerWaalsContact CG-OG1 3.29Å; E711-T713 WeakPolarHBondContact CG-OG1 3.5Å; E711-T713 PolarHBondContact O-N 3.34Å; E711-T713 PolarHBondContact OE1-OG1 3.45Å; E711-T713 PolarHBondContact OE2-OG1 2.85Å
714	R	80.6	Confident	89.5	Confident	104 Å²	104	28 Å²	28	39%	0.392	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-98.6	8.6	179.5	-56.1	-174.1	-167.4	-152.9	-5.9	114	E711 M712 F716 E717 H718	E711-R714 PolarHBondContact O-N 2.97Å; E711-R714 WeakPolarHBondContact OE2-CD 3.42Å; E711-R714 IonicContact OE2-CZ 3.41Å; E711-R714 IonicContact OE2-NE 3.86Å; E711-R714 PolarHBondContact OE2-NE 2.9Å; E711-R714 IonicContact OE2-NH2 3.75Å; M712-R714 PolarHBondContact O-N 3.38Å; R714-F716 PolarHBondContact O-N 3.07Å; R714-E717 WeakPolarHBondContact O-CB 3.34Å; R714-E717 PolarHBondContact O-N 3.39Å; R714-H718 PolarHBondContact O-CD2 2.59Å; R714-H718 PolarHBondContact O-N 3.22Å; R714-H718 VanDerWaalsContact O-N 3.11Å
715	H	86.3	Confident	89	Confident	4 Å²	4	28.5 Å²	28.5	2%	0.019	15%	0.146	C	C	.	.	H	α-helix	trans	-50.3	-56.7	-175.8	173.4	91.1	0	0	0	112.6	M712 E717 H718 V719 F829 M833	M712-H715 HydrophobicContact CE-CB 4.42Å; M712-H715 WeakPolarHBondContact O-CB 3.49Å; M712-H715 PolarHBondContact O-N 3.42Å; M712-H715 VanDerWaalsContact O-N 3.08Å; H715-E717 VanDerWaalsContact C-N 3.31Å; H715-E717 PolarHBondContact O-N 2.69Å; H715-H718 PolarHBondContact O-N 3.32Å; H715-V719 WeakPolarHBondContact O-CG2 3.48Å; H715-V719 PolarHBondContact O-N 2.82Å; H715-F829 AromaticContact CD2-CD1 3.79Å; H715-F829 AromaticContact NE2-CD1 3.99Å; H715-F829 PolarHBondContact NE2-O 2.86Å; H715-M833 VanDerWaalsContact CE1-SD 3.54Å
716	F	82.5	Confident	88.6	Confident	41 Å²	41	27.4 Å²	27.4	18%	0.18	14%	0.141	C	C	.	.	H	α-helix	trans	-67.5	-30.1	-177.1	-64.3	-63.6	0	0	0	113.4	M492 R714 S720 Y828 F829	M492-F716 HydrophobicContact CE-CD2 3.57Å; M492-F716 HydrophobicContact CE-CE2 3.5Å; M492-F716 VanDerWaalsContact CE-CE2 3.5Å; M492-F716 HydrophobicContact SD-CE2 4.05Å; R714-F716 PolarHBondContact O-N 3.07Å; F716-S720 WeakPolarHBondContact O-CB 3.41Å; F716-S720 PolarHBondContact O-N 3.41Å; F716-S720 PolarHBondContact O-OG 2.74Å; F716-Y828 AromaticContact CE2-CE1 3.74Å; F716-Y828 HydrophobicContact CE2-CE1 3.74Å; F716-Y828 AromaticContact CZ-CD1 3.98Å; F716-Y828 HydrophobicContact CZ-CD1 3.98Å; F716-Y828 AromaticContact CZ-CE1 3.49Å; F716-Y828 HydrophobicContact CZ-CE1 3.49Å; F716-Y828 VanDerWaalsContact CZ-CE1 3.49Å; F716-Y828 AromaticContact CZ-CZ 3.98Å; F716-F829 HydrophobicContact CE2-CE1 4.34Å; F716-F829 HydrophobicContact CZ-CD1 4.31Å; F716-F829 HydrophobicContact CZ-CE1 4.27Å
717	E	82.9	Confident	88.1	Confident	53 Å²	53	28.2 Å²	28.2	25%	0.248	15%	0.145	C	C	.	.	H	α-helix	trans	-61.8	-48.2	174.8	-172.5	-162	138.8	0	0	110.2	R714 H715 K721	R714-E717 WeakPolarHBondContact O-CB 3.34Å; R714-E717 PolarHBondContact O-N 3.39Å; H715-E717 VanDerWaalsContact C-N 3.31Å; H715-E717 PolarHBondContact O-N 2.69Å; E717-K721 HydrophobicContact CG-CD 4.26Å; E717-K721 WeakPolarHBondContact O-CB 3.42Å; E717-K721 VanDerWaalsContact O-CG 3.3Å; E717-K721 WeakPolarHBondContact O-CG 3.44Å; E717-K721 PolarHBondContact O-N 3.41Å; E717-K721 WeakPolarHBondContact OE1-CE 3.3Å; E717-K721 IonicContact OE1-NZ 3.83Å; E717-K721 PolarHBondContact OE1-NZ 3.29Å
718	H	88.4	Confident	87.4	Confident	9 Å²	9	32.3 Å²	32.3	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-47.1	-179.5	-66.9	-37.7	0	0	0	112.3	R714 H715 S720 K721 F722 K767	R714-H718 PolarHBondContact O-CD2 2.59Å; R714-H718 PolarHBondContact O-N 3.22Å; R714-H718 VanDerWaalsContact O-N 3.11Å; H715-H718 PolarHBondContact O-N 3.32Å; H718-S720 PolarHBondContact O-N 2.87Å; H718-K721 PolarHBondContact O-N 2.97Å; H718-F722 WeakPolarHBondContact O-CB 3.26Å; H718-F722 PolarHBondContact O-N 3.5Å; H718-K767 HydrophobicContact CB-CD 3.88Å
719	V	87.5	Confident	86.7	Confident	13 Å²	13	31.7 Å²	31.7	8%	0.079	16%	0.162	C	C	.	.	H	α-helix	trans	-60.7	-45.2	177.5	176.2	0	0	0	0	110.9	H715 K721 F722 V723 M764 M833	H715-V719 WeakPolarHBondContact O-CG2 3.48Å; H715-V719 PolarHBondContact O-N 2.82Å; V719-K721 PolarHBondContact O-N 3.29Å; V719-F722 PolarHBondContact O-N 3.43Å; V719-V723 HydrophobicContact CG1-CG2 4.36Å; V719-V723 WeakPolarHBondContact O-CG2 3.28Å; V719-V723 PolarHBondContact O-N 2.9Å; V719-M764 HydrophobicContact CG2-CE 4.39Å; V719-M764 HydrophobicContact CG2-SD 4.26Å; V719-M833 HydrophobicContact CG2-CB 4.21Å; V719-M833 HydrophobicContact CG2-CG 3.92Å
720	S	81.8	Confident	85.9	Confident	28 Å²	28	32 Å²	32	20%	0.196	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-42.8	-179.8	-62.7	0	0	0	0	112.5	F716 H718 F722 V723 N724	F716-S720 WeakPolarHBondContact O-CB 3.41Å; F716-S720 PolarHBondContact O-N 3.41Å; F716-S720 PolarHBondContact O-OG 2.74Å; H718-S720 PolarHBondContact O-N 2.87Å; S720-F722 VanDerWaalsContact C-N 3.33Å; S720-F722 PolarHBondContact O-N 3.45Å; S720-V723 PolarHBondContact O-N 3.23Å; S720-N724 WeakPolarHBondContact O-CB 3.31Å; S720-N724 PolarHBondContact O-N 3.49Å; S720-N724 PolarHBondContact O-ND2 2.89Å
721	K	85.3	Confident	85.1	Confident	47 Å²	47	32.3 Å²	32.3	20%	0.204	17%	0.166	C	C	.	.	H	α-helix	trans	-62.3	-42	176.2	-77.1	176.2	177.4	176	0	111.3	E717 H718 V719 S725 L760	E717-K721 HydrophobicContact CG-CD 4.26Å; E717-K721 WeakPolarHBondContact O-CB 3.42Å; E717-K721 VanDerWaalsContact O-CG 3.3Å; E717-K721 WeakPolarHBondContact O-CG 3.44Å; E717-K721 PolarHBondContact O-N 3.41Å; E717-K721 WeakPolarHBondContact OE1-CE 3.3Å; E717-K721 IonicContact OE1-NZ 3.83Å; E717-K721 PolarHBondContact OE1-NZ 3.29Å; H718-K721 PolarHBondContact O-N 2.97Å; V719-K721 PolarHBondContact O-N 3.29Å; K721-S725 WeakPolarHBondContact O-CB 3.32Å; K721-S725 PolarHBondContact O-N 3.42Å; K721-S725 PolarHBondContact O-OG 3.31Å; K721-L760 HydrophobicContact CB-CD1 4.37Å; K721-L760 HydrophobicContact CB-CD2 3.81Å; K721-L760 HydrophobicContact CD-CD2 4.4Å
722	F	92.1	Very high	84.5	Confident	1 Å²	1	34.2 Å²	34.2	0%	0.004	18%	0.184	C	C	.	.	H	α-helix	trans	-61.8	-51.4	175.9	-177.5	-95.7	0	0	0	111.6	H718 V719 S720 N724 S725 I726 N727 I761 M764 A836 W837 F840	H718-F722 WeakPolarHBondContact O-CB 3.26Å; H718-F722 PolarHBondContact O-N 3.5Å; V719-F722 PolarHBondContact O-N 3.43Å; S720-F722 VanDerWaalsContact C-N 3.33Å; S720-F722 PolarHBondContact O-N 3.45Å; F722-N724 PolarHBondContact O-N 3.5Å; F722-S725 PolarHBondContact O-N 2.96Å; F722-I726 HydrophobicContact CD2-CB 4.32Å; F722-I726 HydrophobicContact CD2-CG1 3.84Å; F722-I726 HydrophobicContact CE2-CB 4.19Å; F722-I726 HydrophobicContact CE2-CG1 3.97Å; F722-I726 HydrophobicContact CE2-CG2 4.2Å; F722-I726 HydrophobicContact CG-CG1 4.43Å; F722-I726 HydrophobicContact CZ-CB 4.4Å; F722-I726 HydrophobicContact CZ-CG2 4.21Å; F722-I726 WeakPolarHBondContact O-CA 3.17Å; F722-I726 WeakPolarHBondContact O-CB 3.46Å; F722-I726 WeakPolarHBondContact O-CG1 3.46Å; F722-I726 PolarHBondContact O-N 2.94Å; F722-N727 PolarHBondContact O-N 2.89Å; F722-I761 HydrophobicContact CE2-CG1 4.06Å; F722-M764 HydrophobicContact CB-CB 4.49Å; F722-M764 HydrophobicContact CB-CG 4.46Å; F722-M764 HydrophobicContact CB-SD 4.22Å; F722-M764 HydrophobicContact CD1-CE 4.23Å; F722-M764 HydrophobicContact CD1-CG 3.94Å; F722-M764 HydrophobicContact CD1-SD 4.16Å; F722-M764 HydrophobicContact CD2-CB 3.59Å; F722-M764 HydrophobicContact CD2-CG 3.85Å; F722-M764 HydrophobicContact CE1-CG 4.11Å; F722-M764 HydrophobicContact CE2-CB 3.88Å; F722-M764 HydrophobicContact CE2-CG 4.02Å; F722-M764 HydrophobicContact CG-CB 3.97Å; F722-M764 HydrophobicContact CG-CG 3.81Å; F722-M764 HydrophobicContact CG-SD 4.1Å; F722-M764 HydrophobicContact CZ-CB 4.49Å; F722-M764 HydrophobicContact CZ-CG 4.14Å; F722-A836 HydrophobicContact CD1-CB 4.45Å; F722-W837 HydrophobicContact CE1-CE3 4.25Å; F722-W837 HydrophobicContact CE2-CE3 4.21Å; F722-W837 AromaticContact CE2-CZ3 3.92Å; F722-W837 HydrophobicContact CE2-CZ3 3.92Å; F722-W837 AromaticContact CZ-CE3 3.7Å; F722-W837 HydrophobicContact CZ-CE3 3.7Å; F722-W837 AromaticContact CZ-CZ3 3.79Å; F722-W837 HydrophobicContact CZ-CZ3 3.79Å; F722-F840 HydrophobicContact CE1-CB 4.09Å; F722-F840 HydrophobicContact CE2-CD1 4.5Å; F722-F840 HydrophobicContact CZ-CB 3.68Å; F722-F840 AromaticContact CZ-CD1 3.91Å; F722-F840 HydrophobicContact CZ-CD1 3.91Å; F722-F840 HydrophobicContact CZ-CD2 4.31Å; F722-F840 AromaticContact CZ-CG 3.71Å; F722-F840 HydrophobicContact CZ-CG 3.71Å
723	V	87.9	Confident	84	Confident	26 Å²	26	35.1 Å²	35.1	16%	0.158	19%	0.189	C	C	.	.	I	π-helix	trans	-59.9	-45.2	-179.7	170.3	0	0	0	0	111.9	V719 S720 N727 K728 A836	V719-V723 HydrophobicContact CG1-CG2 4.36Å; V719-V723 WeakPolarHBondContact O-CG2 3.28Å; V719-V723 PolarHBondContact O-N 2.9Å; S720-V723 PolarHBondContact O-N 3.23Å; V723-N727 PolarHBondContact O-N 3.22Å; V723-K728 HydrophobicContact CG1-CG 4.46Å; V723-K728 PolarHBondContact O-N 3.41Å; V723-A836 HydrophobicContact CG2-CB 3.69Å
724	N	84.8	Confident	83.5	Confident	57 Å²	57	36 Å²	36	31%	0.305	19%	0.19	S	C	.	.	I	π-helix	trans	-76.5	-30	-175	-68.4	-40	0	0	0	113.6	Y471 S720 F722 K728 P729	Y471-N724 PolarHBondContact OH-ND2 3.45Å; S720-N724 WeakPolarHBondContact O-CB 3.31Å; S720-N724 PolarHBondContact O-N 3.49Å; S720-N724 PolarHBondContact O-ND2 2.89Å; F722-N724 PolarHBondContact O-N 3.5Å; N724-K728 WeakPolarHBondContact OD1-CE 3.25Å; N724-K728 PolarHBondContact OD1-NZ 3.4Å; N724-P729 VanDerWaalsContact O-CD 3.32Å; N724-P729 WeakPolarHBondContact O-CD 3.38Å
725	S	86.5	Confident	82.8	Confident	44 Å²	44	35 Å²	35	31%	0.308	19%	0.189	S	C	.	.	I	π-helix	trans	-99.8	-21	-174.8	-41.6	0	0	0	0	113.2	K721 F722	K721-S725 WeakPolarHBondContact O-CB 3.32Å; K721-S725 PolarHBondContact O-N 3.42Å; K721-S725 PolarHBondContact O-OG 3.31Å; F722-S725 PolarHBondContact O-N 2.96Å
726	I	89.2	Confident	81.5	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	I	π-helix	trans	-114	-67.6	-178	-48.6	-62.2	0	0	0	110.4	F722 K728 P729 M730 N757 I761 F840	F722-I726 HydrophobicContact CD2-CB 4.32Å; F722-I726 HydrophobicContact CD2-CG1 3.84Å; F722-I726 HydrophobicContact CE2-CB 4.19Å; F722-I726 HydrophobicContact CE2-CG1 3.97Å; F722-I726 HydrophobicContact CE2-CG2 4.2Å; F722-I726 HydrophobicContact CG-CG1 4.43Å; F722-I726 HydrophobicContact CZ-CB 4.4Å; F722-I726 HydrophobicContact CZ-CG2 4.21Å; F722-I726 WeakPolarHBondContact O-CA 3.17Å; F722-I726 WeakPolarHBondContact O-CB 3.46Å; F722-I726 WeakPolarHBondContact O-CG1 3.46Å; F722-I726 PolarHBondContact O-N 2.94Å; I726-K728 PolarHBondContact O-N 3.05Å; I726-P729 WeakPolarHBondContact O-CD 3.29Å; I726-M730 HydrophobicContact CG2-SD 3.69Å; I726-M730 WeakPolarHBondContact O-CB 3.45Å; I726-M730 WeakPolarHBondContact O-CG 3.45Å; I726-M730 PolarHBondContact O-N 3.23Å; I726-N757 HydrophobicContact CD1-CB 3.41Å; I726-N757 VanDerWaalsContact CD1-CB 3.41Å; I726-I761 HydrophobicContact CD1-CD1 4.49Å; I726-I761 HydrophobicContact CD1-CG1 4.35Å; I726-F840 HydrophobicContact CG2-CD2 3.74Å; I726-F840 HydrophobicContact CG2-CE2 3.89Å
727	N	88.2	Confident	80.1	Confident	17 Å²	17	39.8 Å²	39.8	9%	0.091	22%	0.223	C	C	.	.	I	π-helix	trans	-64.3	-48.4	-169.4	-73.2	-4.3	0	0	0	113.2	F722 V723 M730 A731 A836	F722-N727 PolarHBondContact O-N 2.89Å; V723-N727 PolarHBondContact O-N 3.22Å; N727-M730 PolarHBondContact O-N 2.93Å; N727-A731 WeakPolarHBondContact O-CB 3.48Å; N727-A731 PolarHBondContact O-N 2.9Å; N727-A836 WeakPolarHBondContact ND2-CA 3.46Å; N727-A836 PolarHBondContact ND2-O 2.94Å
728	K	85.2	Confident	78.6	Confident	86 Å²	86	43.4 Å²	43.4	37%	0.374	25%	0.25	S	C	.	.	H	α-helix	trans	-63.6	-48.9	-178.7	-74.4	-179.4	-178.3	169.7	0	112.9	V723 N724 I726 M730 A731 A732	V723-K728 HydrophobicContact CG1-CG 4.46Å; V723-K728 PolarHBondContact O-N 3.41Å; N724-K728 WeakPolarHBondContact OD1-CE 3.25Å; N724-K728 PolarHBondContact OD1-NZ 3.4Å; I726-K728 PolarHBondContact O-N 3.05Å; K728-M730 VanDerWaalsContact C-N 3.32Å; K728-M730 PolarHBondContact O-N 3.42Å; K728-A731 PolarHBondContact O-N 2.96Å; K728-A732 PolarHBondContact O-N 3.16Å
729	P	83.3	Confident	76.6	Confident	42 Å²	42	48 Å²	48	27%	0.273	28%	0.283	S	S	.	.	H	α-helix	trans	-60.3	-39.2	174.8	-27.4	37	0	0	0	113.3	N724 I726 A732 I733 I751	N724-P729 VanDerWaalsContact O-CD 3.32Å; N724-P729 WeakPolarHBondContact O-CD 3.38Å; I726-P729 WeakPolarHBondContact O-CD 3.29Å; P729-A732 PolarHBondContact O-N 3.24Å; P729-I733 WeakPolarHBondContact O-CG1 3.27Å; P729-I733 PolarHBondContact O-N 3.36Å; P729-I751 HydrophobicContact CB-CD1 4.28Å
730	M	79.9	Confident	74.4	Confident	9 Å²	9	50.4 Å²	50.4	4%	0.044	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-45.6	176.8	-74.8	-179	61.2	0	0	112	I726 N727 K728 A732 I733 E734 R752 F840	I726-M730 HydrophobicContact CG2-SD 3.69Å; I726-M730 WeakPolarHBondContact O-CB 3.45Å; I726-M730 WeakPolarHBondContact O-CG 3.45Å; I726-M730 PolarHBondContact O-N 3.23Å; N727-M730 PolarHBondContact O-N 2.93Å; K728-M730 VanDerWaalsContact C-N 3.32Å; K728-M730 PolarHBondContact O-N 3.42Å; M730-A732 PolarHBondContact O-N 3.06Å; M730-I733 PolarHBondContact O-N 2.95Å; M730-E734 WeakPolarHBondContact O-CG 3.35Å; M730-E734 PolarHBondContact O-N 3.45Å; M730-R752 HydrophobicContact SD-CG 4.11Å; M730-F840 HydrophobicContact CE-CD2 4.21Å; M730-F840 HydrophobicContact CE-CE2 4.4Å; M730-F840 HydrophobicContact SD-CD2 3.89Å; M730-F840 HydrophobicContact SD-CE2 4Å
731	A	80.5	Confident	72.6	Confident	10 Å²	10	55.1 Å²	55.1	8%	0.083	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-42	177.7	0	0	0	0	0	112.2	I427 N727 K728 I733 E734 E735	I427-A731 HydrophobicContact CG2-CB 4.16Å; N727-A731 WeakPolarHBondContact O-CB 3.48Å; N727-A731 PolarHBondContact O-N 2.9Å; K728-A731 PolarHBondContact O-N 2.96Å; A731-I733 VanDerWaalsContact C-N 3.29Å; A731-I733 PolarHBondContact O-N 3.21Å; A731-E734 PolarHBondContact O-N 3.39Å; A731-E735 WeakPolarHBondContact O-CG 3.37Å; A731-E735 PolarHBondContact O-N 3.44Å
732	A	77.5	Confident	70.4	Confident	52 Å²	52	60.6 Å²	60.6	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-61.6	-37	177.6	0	0	0	0	0	112.6	K728 P729 M730 T736	K728-A732 PolarHBondContact O-N 3.16Å; P729-A732 PolarHBondContact O-N 3.24Å; M730-A732 PolarHBondContact O-N 3.06Å; A732-T736 PolarHBondContact O-N 2.81Å; A732-T736 PolarHBondContact O-OG1 3.42Å
733	I	73.6	Confident	68.2	Low	45 Å²	45	64.6 Å²	64.6	23%	0.231	39%	0.387	C	S	.	.	H	α-helix	trans	-70.1	-45.2	175.6	-67	166.9	0	0	0	110.3	P729 M730 A731 E735 T736 S737 Q748 I751	P729-I733 WeakPolarHBondContact O-CG1 3.27Å; P729-I733 PolarHBondContact O-N 3.36Å; M730-I733 PolarHBondContact O-N 2.95Å; A731-I733 VanDerWaalsContact C-N 3.29Å; A731-I733 PolarHBondContact O-N 3.21Å; I733-E735 VanDerWaalsContact C-N 3.26Å; I733-E735 PolarHBondContact O-N 2.89Å; I733-T736 PolarHBondContact O-N 3.35Å; I733-S737 WeakPolarHBondContact O-CB 3.3Å; I733-S737 PolarHBondContact O-N 2.74Å; I733-S737 PolarHBondContact O-OG 3.44Å; I733-Q748 HydrophobicContact CG2-CG 3.83Å; I733-I751 HydrophobicContact CD1-CD1 3.23Å
734	E	70.3	Confident	66.3	Low	69 Å²	69	66.2 Å²	66.2	32%	0.322	40%	0.395	S	S	.	.	H	α-helix	trans	-57	-37.3	177.2	-74.6	-178.2	174.2	0	0	112.4	R618 M730 A731 S737	R618-E734 IonicContact NH2-OE1 3.37Å; R618-E734 PolarHBondContact NH2-OE1 3.16Å; M730-E734 WeakPolarHBondContact O-CG 3.35Å; M730-E734 PolarHBondContact O-N 3.45Å; A731-E734 PolarHBondContact O-N 3.39Å; E734-S737 PolarHBondContact O-N 3.25Å
735	E	64.1	Low	64.7	Low	83 Å²	83	68.8 Å²	68.8	39%	0.388	42%	0.416	S	S	.	.	H	α-helix	trans	-70.8	-40.1	177.3	-70.3	-169.9	151.1	0	0	113.6	V424 H428 A731 I733 S737 T738	V424-E735 HydrophobicContact CG1-CG 4.47Å; H428-E735 IonicContact CD2-OE1 3.11Å; H428-E735 PolarHBondContact CD2-OE1 2.78Å; H428-E735 IonicContact CE1-OE1 3.76Å; H428-E735 IonicContact CE1-OE2 3.15Å; H428-E735 PolarHBondContact CE1-OE2 3.43Å; H428-E735 IonicContact NE2-OE1 3.04Å; H428-E735 PolarHBondContact NE2-OE1 2.9Å; H428-E735 IonicContact NE2-OE2 3.03Å; H428-E735 PolarHBondContact NE2-OE2 3.33Å; A731-E735 WeakPolarHBondContact O-CG 3.37Å; A731-E735 PolarHBondContact O-N 3.44Å; I733-E735 VanDerWaalsContact C-N 3.26Å; I733-E735 PolarHBondContact O-N 2.89Å; E735-S737 PolarHBondContact O-N 2.98Å; E735-T738 PolarHBondContact O-OG1 3.22Å
736	T	59.2	Low	63	Low	109 Å²	109	73.6 Å²	73.6	67%	0.669	43%	0.434	S	S	*	.	H	α-helix	trans	-69.4	-22	177.2	-42.1	0	0	0	0	111.8	A732 I733 T738 S739	A732-T736 PolarHBondContact O-N 2.81Å; A732-T736 PolarHBondContact O-OG1 3.42Å; I733-T736 PolarHBondContact O-N 3.35Å; T736-T738 PolarHBondContact O-N 2.89Å; T736-S739 PolarHBondContact O-OG 3.16Å
737	S	54	Low	61.5	Low	35 Å²	35	75.3 Å²	75.3	25%	0.245	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-82.5	-5.7	-176	-54.1	0	0	0	0	114.7	I733 E734 E735 S739	I733-S737 WeakPolarHBondContact O-CB 3.3Å; I733-S737 PolarHBondContact O-N 2.74Å; I733-S737 PolarHBondContact O-OG 3.44Å; E734-S737 PolarHBondContact O-N 3.25Å; E735-S737 PolarHBondContact O-N 2.98Å; S737-S739 PolarHBondContact O-N 2.9Å
738	T	51.2	Low	60.1	Low	130 Å²	130	76.9 Å²	76.9	80%	0.798	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-67.7	-2.2	-180	50.5	0	0	0	0	114	E735 T736	E735-T738 PolarHBondContact O-OG1 3.22Å; T736-T738 PolarHBondContact O-N 2.89Å
739	S	47.4	Very low	59	Low	106 Å²	106	74.6 Å²	74.6	74%	0.741	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-120	-0.6	-178.4	45.9	0	0	0	0	117.5	T736 S737	T736-S739 PolarHBondContact O-OG 3.16Å; S737-S739 PolarHBondContact O-N 2.9Å
740	S	41	Very low	58.2	Low	62 Å²	62	78 Å²	78	43%	0.434	47%	0.469	S	S	.	.			trans	-146.6	117.6	178.8	44.6	0	0	0	0	113.5
741	T	43.5	Very low	57.8	Low	128 Å²	128	79.6 Å²	79.6	79%	0.785	48%	0.477	S	S	*	.			trans	-79.1	129.7	176.4	42.7	0	0	0	0	112.1
742	N	39.7	Very low	57.5	Low	161 Å²	161	80.3 Å²	80.3	86%	0.861	48%	0.478	S	S	*	.	S	Bend	trans	88.8	11.3	150.3	-58.4	-13.1	0	0	0	120.9
743	S	44.2	Very low	57.5	Low	85 Å²	85	81.3 Å²	81.3	59%	0.594	48%	0.476	S	S	*	.	S	Bend	trans	-109.5	-9.3	170.3	59.6	0	0	0	0	116.3
744	D	48.8	Very low	58.1	Low	61 Å²	61	80.6 Å²	80.6	33%	0.326	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	4.9	-156.7	-57.4	-23.2	0	0	0	115.6	E746 G747	D744-E746 PolarHBondContact O-N 2.92Å; D744-G747 PolarHBondContact O-N 2.64Å
745	C	50.8	Low	58.9	Low	110 Å²	110	81.7 Å²	81.7	74%	0.743	49%	0.488	S	S	*	.	H	α-helix	trans	-62.2	-24.6	173.5	-69.6	0	0	0	0	113	S749	C745-S749 WeakPolarHBondContact O-CB 3.31Å; C745-S749 PolarHBondContact O-N 3.37Å; C745-S749 PolarHBondContact O-OG 3.03Å
746	E	52.1	Low	60	Low	146 Å²	146	83.8 Å²	83.8	68%	0.682	50%	0.498	S	S	*	.	H	α-helix	trans	-72.2	-34.3	176.5	-69.8	-171	167.1	0	0	112.2	D744 S749 N750	D744-E746 PolarHBondContact O-N 2.92Å; E746-S749 WeakPolarHBondContact CA-OG 3.49Å; E746-S749 PolarHBondContact O-OG 3.36Å; E746-N750 VanDerWaalsContact O-CB 3.24Å; E746-N750 WeakPolarHBondContact O-CB 3.46Å; E746-N750 PolarHBondContact O-N 3.23Å; E746-N750 PolarHBondContact O-ND2 3.37Å
747	G	56.2	Low	61.5	Low	35 Å²	35	79.6 Å²	79.6	36%	0.361	47%	0.471	S	S	.	.	H	α-helix	trans	-67.6	-45.2	-178.9	0	0	0	0	0	113.2	D744 I751	D744-G747 PolarHBondContact O-N 2.64Å; G747-I751 PolarHBondContact O-N 3.41Å
748	Q	59.4	Low	63.4	Low	50 Å²	50	80.4 Å²	80.4	23%	0.234	47%	0.469	C	S	.	.	H	α-helix	trans	-70.2	-37.1	178.6	-66.6	-175.2	0.8	0	0	112.7	I733 R752	I733-Q748 HydrophobicContact CG2-CG 3.83Å; Q748-R752 WeakPolarHBondContact O-CD 3.06Å; Q748-R752 WeakPolarHBondContact O-CG 3.32Å; Q748-R752 PolarHBondContact O-N 3.35Å
749	S	62.5	Low	65.4	Low	38 Å²	38	76.6 Å²	76.6	27%	0.266	44%	0.443	S	S	.	.	H	α-helix	trans	-69.1	-38.8	175.7	53.2	0	0	0	0	111.7	C745 E746 I751 R752 N753	C745-S749 WeakPolarHBondContact O-CB 3.31Å; C745-S749 PolarHBondContact O-N 3.37Å; C745-S749 PolarHBondContact O-OG 3.03Å; E746-S749 WeakPolarHBondContact CA-OG 3.49Å; E746-S749 PolarHBondContact O-OG 3.36Å; S749-I751 VanDerWaalsContact C-N 3.35Å; S749-I751 PolarHBondContact O-N 2.97Å; S749-R752 PolarHBondContact O-N 3.5Å; S749-N753 WeakPolarHBondContact O-CB 3.45Å; S749-N753 PolarHBondContact O-N 2.79Å; S749-N753 PolarHBondContact O-ND2 3.31Å; S749-N753 PolarHBondContact O-OD1 2.89Å
750	N	65.6	Low	67.6	Low	113 Å²	113	72.4 Å²	72.4	60%	0.604	41%	0.412	S	S	*	.	H	α-helix	trans	-62.4	-37	177	-77.5	-26.7	0	0	0	113.5	E746	E746-N750 VanDerWaalsContact O-CB 3.24Å; E746-N750 WeakPolarHBondContact O-CB 3.46Å; E746-N750 PolarHBondContact O-N 3.23Å; E746-N750 PolarHBondContact O-ND2 3.37Å
751	I	72	Confident	70.3	Confident	43 Å²	43	69.4 Å²	69.4	22%	0.221	39%	0.392	C	S	.	.	H	α-helix	trans	-65.7	-49.8	175.2	-69.7	173.4	0	0	0	110.3	P729 I733 G747 S749 N753 S754 N757	P729-I751 HydrophobicContact CB-CD1 4.28Å; I733-I751 HydrophobicContact CD1-CD1 3.23Å; G747-I751 PolarHBondContact O-N 3.41Å; S749-I751 VanDerWaalsContact C-N 3.35Å; S749-I751 PolarHBondContact O-N 2.97Å; I751-N753 VanDerWaalsContact C-N 3.32Å; I751-N753 PolarHBondContact O-N 2.72Å; I751-S754 PolarHBondContact O-OG 2.99Å; I751-S754 VanDerWaalsContact O-OG 3.05Å; I751-N757 WeakPolarHBondContact O-CB 3.43Å; I751-N757 PolarHBondContact O-ND2 3.13Å
752	R	75.4	Confident	72.9	Confident	25 Å²	25	64 Å²	64	9%	0.094	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-34.8	-176.1	-70.7	167.4	51.1	-149.1	-18.7	112.7	R618 S621 S622 M730 Q748 S749 S754 F840	R618-R752 PolarHBondContact O-NH2 3.49Å; S621-R752 PolarHBondContact O-NH2 3.24Å; S621-R752 PolarHBondContact OG-NH2 2.54Å; S622-R752 VanDerWaalsContact N-NH2 3.15Å; S622-R752 PolarHBondContact OG-NE 3.02Å; S622-R752 PolarHBondContact OG-NH2 2.89Å; M730-R752 HydrophobicContact SD-CG 4.11Å; Q748-R752 WeakPolarHBondContact O-CD 3.06Å; Q748-R752 WeakPolarHBondContact O-CG 3.32Å; Q748-R752 PolarHBondContact O-N 3.35Å; S749-R752 PolarHBondContact O-N 3.5Å; R752-S754 VanDerWaalsContact C-N 3.32Å; R752-S754 PolarHBondContact O-N 3.49Å; R752-F840 HydrophobicContact CG-CE2 4.45Å
753	N	76.6	Confident	75.7	Confident	73 Å²	73	58.4 Å²	58.4	39%	0.39	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-4.4	-173	-65.1	-8.4	0	0	0	114	S749 I751	S749-N753 WeakPolarHBondContact O-CB 3.45Å; S749-N753 PolarHBondContact O-N 2.79Å; S749-N753 PolarHBondContact O-ND2 3.31Å; S749-N753 PolarHBondContact O-OD1 2.89Å; I751-N753 VanDerWaalsContact C-N 3.32Å; I751-N753 PolarHBondContact O-N 2.72Å
754	S	86.4	Confident	78.3	Confident	30 Å²	30	54.5 Å²	54.5	21%	0.21	30%	0.296	C	S	.	.	S	Bend	trans	-62.6	140.1	173.9	62.9	0	0	0	0	110.9	I751 R752 E756 N757 R758	I751-S754 PolarHBondContact O-OG 2.99Å; I751-S754 VanDerWaalsContact O-OG 3.05Å; R752-S754 VanDerWaalsContact C-N 3.32Å; R752-S754 PolarHBondContact O-N 3.49Å; S754-E756 PolarHBondContact O-N 2.61Å; S754-N757 PolarHBondContact O-N 3.45Å; S754-N757 VanDerWaalsContact O-N 3.1Å; S754-N757 WeakPolarHBondContact OG-CB 3.35Å; S754-N757 VanDerWaalsContact OG-CG 3.22Å; S754-N757 PolarHBondContact OG-N 2.76Å; S754-N757 PolarHBondContact OG-ND2 3.19Å; S754-R758 WeakPolarHBondContact O-CG 3.3Å; S754-R758 PolarHBondContact O-N 3.49Å
755	P	86.2	Confident	80.7	Confident	92 Å²	92	51.6 Å²	51.6	60%	0.597	28%	0.281	S	S	*	.	H	α-helix	trans	-55.2	-36.5	-178.7	-26.7	35	0	0	0	113.7	L759	P755-L759 PolarHBondContact O-N 3.26Å; P755-L759 VanDerWaalsContact O-N 3.09Å
756	E	88.1	Confident	83	Confident	128 Å²	128	46.3 Å²	46.3	60%	0.598	25%	0.245	S	C	*	.	H	α-helix	trans	-66.9	-43.6	178.3	-61.3	72.2	-156	0	0	111.1	S754 L759 L760	S754-E756 PolarHBondContact O-N 2.61Å; E756-L759 WeakPolarHBondContact O-CB 2.71Å; E756-L759 PolarHBondContact O-N 3.18Å; E756-L760 WeakPolarHBondContact O-CG 3.47Å; E756-L760 PolarHBondContact O-N 3.39Å; E756-L760 VanDerWaalsContact O-N 3.11Å
757	N	90.6	Very high	85.2	Confident	21 Å²	21	39.6 Å²	39.6	11%	0.112	21%	0.214	C	C	.	.	H	α-helix	trans	-73.2	-36.3	179.3	-74.5	-12.9	0	0	0	112.2	I726 I751 S754 L759 L760 I761	I726-N757 HydrophobicContact CD1-CB 3.41Å; I726-N757 VanDerWaalsContact CD1-CB 3.41Å; I751-N757 WeakPolarHBondContact O-CB 3.43Å; I751-N757 PolarHBondContact O-ND2 3.13Å; S754-N757 PolarHBondContact O-N 3.45Å; S754-N757 VanDerWaalsContact O-N 3.1Å; S754-N757 WeakPolarHBondContact OG-CB 3.35Å; S754-N757 VanDerWaalsContact OG-CG 3.22Å; S754-N757 PolarHBondContact OG-N 2.76Å; S754-N757 PolarHBondContact OG-ND2 3.19Å; N757-L759 PolarHBondContact O-N 2.86Å; N757-L760 PolarHBondContact O-N 3.17Å; N757-L760 VanDerWaalsContact O-N 3.16Å; N757-I761 VanDerWaalsContact O-CG1 3.25Å; N757-I761 WeakPolarHBondContact O-CG1 3.31Å; N757-I761 PolarHBondContact O-N 3.42Å
758	R	93.4	Very high	87.2	Confident	52 Å²	52	37.9 Å²	37.9	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-57.9	-39.4	170.1	-75.1	177.4	48.8	-168.8	-14.2	111.7	S622 L623 D624 D627 S754 I761 K762	S622-R758 WeakPolarHBondContact O-CG 3.35Å; L623-R758 HydrophobicContact CD2-CB 4.33Å; L623-R758 HydrophobicContact CD2-CG 4.36Å; D624-R758 VanDerWaalsContact CG-CZ 3.48Å; D624-R758 IonicContact OD1-CZ 2.85Å; D624-R758 IonicContact OD1-NH2 2.76Å; D624-R758 PolarHBondContact OD1-NH2 3.34Å; D624-R758 IonicContact OD2-CZ 2.62Å; D624-R758 IonicContact OD2-NH1 3.72Å; D624-R758 PolarHBondContact OD2-NH1 2.87Å; D624-R758 IonicContact OD2-NH2 3.72Å; D624-R758 PolarHBondContact OD2-NH2 3Å; D627-R758 IonicContact OD1-NH2 3.87Å; D627-R758 PolarHBondContact OD1-NH2 3.29Å; D627-R758 IonicContact OD2-CZ 2.74Å; D627-R758 IonicContact OD2-NE 2.99Å; D627-R758 PolarHBondContact OD2-NE 3.36Å; D627-R758 IonicContact OD2-NH2 3.29Å; D627-R758 PolarHBondContact OD2-NH2 3.38Å; S754-R758 WeakPolarHBondContact O-CG 3.3Å; S754-R758 PolarHBondContact O-N 3.49Å; R758-I761 PolarHBondContact O-N 3Å; R758-K762 WeakPolarHBondContact O-CE 3.41Å; R758-K762 WeakPolarHBondContact O-CG 3.44Å; R758-K762 PolarHBondContact O-N 3.44Å
759	L	93.3	Very high	89.1	Confident	49 Å²	49	35.5 Å²	35.5	26%	0.257	19%	0.185	S	C	.	.	H	α-helix	trans	-62.3	-47.1	173.9	-168.7	66.6	0	0	0	111.8	D705 P755 E756 N757 I761 K762 R763	D705-L759 HydrophobicContact CB-CD1 4.24Å; D705-L759 WeakPolarHBondContact OD1-CD1 3.09Å; P755-L759 PolarHBondContact O-N 3.26Å; P755-L759 VanDerWaalsContact O-N 3.09Å; E756-L759 WeakPolarHBondContact O-CB 2.71Å; E756-L759 PolarHBondContact O-N 3.18Å; N757-L759 PolarHBondContact O-N 2.86Å; L759-I761 PolarHBondContact O-N 3.45Å; L759-K762 PolarHBondContact O-N 2.84Å; L759-R763 WeakPolarHBondContact O-CG 3.37Å; L759-R763 PolarHBondContact O-N 3.44Å
760	L	94.8	Very high	90.8	Very high	18 Å²	18	34.5 Å²	34.5	9%	0.094	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-40.6	177.6	-65	178.8	0	0	0	112.4	K721 E756 N757 R763 M764	K721-L760 HydrophobicContact CB-CD1 4.37Å; K721-L760 HydrophobicContact CB-CD2 3.81Å; K721-L760 HydrophobicContact CD-CD2 4.4Å; E756-L760 WeakPolarHBondContact O-CG 3.47Å; E756-L760 PolarHBondContact O-N 3.39Å; E756-L760 VanDerWaalsContact O-N 3.11Å; N757-L760 PolarHBondContact O-N 3.17Å; N757-L760 VanDerWaalsContact O-N 3.16Å; L760-R763 PolarHBondContact O-N 2.61Å; L760-M764 WeakPolarHBondContact O-CB 2.78Å; L760-M764 PolarHBondContact O-N 3.25Å
761	I	97.4	Very high	92.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62	-45.9	176	-67.7	162.3	0	0	0	110.1	L623 F722 I726 N757 R758 L759 M764 L765 W837 F840	L623-I761 HydrophobicContact CD1-CG2 4.33Å; L623-I761 HydrophobicContact CD2-CB 4.34Å; L623-I761 HydrophobicContact CD2-CG2 4Å; L623-I761 HydrophobicContact CG-CG2 4.32Å; F722-I761 HydrophobicContact CE2-CG1 4.06Å; I726-I761 HydrophobicContact CD1-CD1 4.49Å; I726-I761 HydrophobicContact CD1-CG1 4.35Å; N757-I761 VanDerWaalsContact O-CG1 3.25Å; N757-I761 WeakPolarHBondContact O-CG1 3.31Å; N757-I761 PolarHBondContact O-N 3.42Å; R758-I761 PolarHBondContact O-N 3Å; L759-I761 PolarHBondContact O-N 3.45Å; I761-M764 PolarHBondContact O-N 3.36Å; I761-L765 VanDerWaalsContact O-CB 3.25Å; I761-L765 WeakPolarHBondContact O-CB 3.44Å; I761-L765 PolarHBondContact O-N 3.2Å; I761-W837 HydrophobicContact CG2-CH2 4.21Å; I761-W837 HydrophobicContact CG2-CZ3 4.42Å; I761-F840 HydrophobicContact CD1-CE2 4.41Å; I761-F840 HydrophobicContact CD1-CZ 3.85Å; I761-F840 HydrophobicContact CG1-CE1 4.35Å; I761-F840 HydrophobicContact CG1-CZ 4.04Å; I761-F840 HydrophobicContact CG2-CE1 3.99Å; I761-F840 HydrophobicContact CG2-CZ 4.27Å
762	K	98.1	Very high	93.6	Very high	15 Å²	15	28 Å²	28	7%	0.065	14%	0.143	C	C	.	.	H	α-helix	trans	-60.6	-45.9	176.7	-78.5	-176.3	-67.6	-169.3	0	112.8	L623 D627 M706 R758 L759 L765 I766	L623-K762 HydrophobicContact CD1-CG 4.33Å; L623-K762 HydrophobicContact CD2-CG 4.07Å; D627-K762 HydrophobicContact CB-CD 3.84Å; D627-K762 HydrophobicContact CB-CG 4.39Å; D627-K762 WeakPolarHBondContact OD1-CD 3.45Å; D627-K762 WeakPolarHBondContact OD1-CE 3.23Å; D627-K762 IonicContact OD1-NZ 2.69Å; D627-K762 PolarHBondContact OD1-NZ 3.3Å; M706-K762 HydrophobicContact CE-CB 4.17Å; M706-K762 WeakPolarHBondContact CE-O 3.22Å; M706-K762 HydrophobicContact CG-CB 4.08Å; M706-K762 HydrophobicContact SD-CB 3.87Å; M706-K762 HydrophobicContact SD-CD 3.96Å; M706-K762 HydrophobicContact SD-CG 4.14Å; R758-K762 WeakPolarHBondContact O-CE 3.41Å; R758-K762 WeakPolarHBondContact O-CG 3.44Å; R758-K762 PolarHBondContact O-N 3.44Å; L759-K762 PolarHBondContact O-N 2.84Å; K762-L765 PolarHBondContact O-N 3.29Å; K762-I766 WeakPolarHBondContact O-CG2 3.36Å; K762-I766 PolarHBondContact O-N 3.37Å
763	R	98.2	Very high	94.7	Very high	43 Å²	43	27.6 Å²	27.6	16%	0.162	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-45.5	176.5	-69.9	178.9	179.7	172.6	-5.4	111.5	D705 A709 L759 L760 L765 I766 K767	D705-R763 WeakPolarHBondContact OD1-CG 3.39Å; D705-R763 IonicContact OD1-CZ 3.15Å; D705-R763 IonicContact OD1-NE 2.71Å; D705-R763 PolarHBondContact OD1-NE 3.15Å; D705-R763 IonicContact OD1-NH2 3.78Å; D705-R763 IonicContact OD2-CZ 2.91Å; D705-R763 IonicContact OD2-NE 3.35Å; D705-R763 PolarHBondContact OD2-NE 3.46Å; D705-R763 IonicContact OD2-NH2 2.63Å; D705-R763 PolarHBondContact OD2-NH2 2.85Å; A709-R763 HydrophobicContact CB-CB 4.01Å; A709-R763 HydrophobicContact CB-CG 3.71Å; L759-R763 WeakPolarHBondContact O-CG 3.37Å; L759-R763 PolarHBondContact O-N 3.44Å; L760-R763 PolarHBondContact O-N 2.61Å; R763-L765 VanDerWaalsContact C-N 3.34Å; R763-I766 WeakPolarHBondContact O-CG2 3.4Å; R763-K767 WeakPolarHBondContact O-CB 3.18Å; R763-K767 VanDerWaalsContact O-CG 3.22Å; R763-K767 WeakPolarHBondContact O-CG 2.98Å; R763-K767 PolarHBondContact O-N 3.26Å; R763-K767 VanDerWaalsContact O-N 3.15Å
764	M	98.4	Very high	95.7	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-63.6	-42	177.3	-167.3	68	178.9	0	0	111.4	V719 F722 L760 I761 K767 C768 M833 A836 W837	V719-M764 HydrophobicContact CG2-CE 4.39Å; V719-M764 HydrophobicContact CG2-SD 4.26Å; F722-M764 HydrophobicContact CB-CB 4.49Å; F722-M764 HydrophobicContact CB-CG 4.46Å; F722-M764 HydrophobicContact CB-SD 4.22Å; F722-M764 HydrophobicContact CD1-CE 4.23Å; F722-M764 HydrophobicContact CD1-CG 3.94Å; F722-M764 HydrophobicContact CD1-SD 4.16Å; F722-M764 HydrophobicContact CD2-CB 3.59Å; F722-M764 HydrophobicContact CD2-CG 3.85Å; F722-M764 HydrophobicContact CE1-CG 4.11Å; F722-M764 HydrophobicContact CE2-CB 3.88Å; F722-M764 HydrophobicContact CE2-CG 4.02Å; F722-M764 HydrophobicContact CG-CB 3.97Å; F722-M764 HydrophobicContact CG-CG 3.81Å; F722-M764 HydrophobicContact CG-SD 4.1Å; F722-M764 HydrophobicContact CZ-CB 4.49Å; F722-M764 HydrophobicContact CZ-CG 4.14Å; L760-M764 WeakPolarHBondContact O-CB 2.78Å; L760-M764 PolarHBondContact O-N 3.25Å; I761-M764 PolarHBondContact O-N 3.36Å; M764-K767 PolarHBondContact O-N 3.27Å; M764-C768 WeakPolarHBondContact O-CB 3.46Å; M764-C768 PolarHBondContact O-N 2.75Å; M764-C768 PolarHBondContact O-SG 2.67Å; M764-M833 HydrophobicContact CE-CB 4.34Å; M764-M833 HydrophobicContact CE-CG 3.44Å; M764-M833 VanDerWaalsContact CE-CG 3.44Å; M764-M833 WeakPolarHBondContact CE-O 3.25Å; M764-M833 HydrophobicContact SD-CG 4.27Å; M764-A836 HydrophobicContact CE-CB 4.11Å; M764-W837 HydrophobicContact CB-CE3 4.11Å; M764-W837 HydrophobicContact CB-CZ3 4.03Å; M764-W837 HydrophobicContact CE-CB 4.1Å; M764-W837 HydrophobicContact CG-CD2 4.25Å; M764-W837 HydrophobicContact CG-CE3 3.51Å; M764-W837 HydrophobicContact CG-CZ3 3.95Å
765	L	98.7	Very high	96.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.5	-52.2	179.4	-173.7	156.9	0	0	0	112	T610 F613 L614 V619 L623 I761 K762 R763 C768 A769 W837	T610-L765 HydrophobicContact CG2-CD2 3.67Å; F613-L765 HydrophobicContact CB-CD1 4.02Å; F613-L765 HydrophobicContact CB-CD2 4.49Å; F613-L765 HydrophobicContact CB-CG 3.95Å; F613-L765 HydrophobicContact CD2-CD2 4.49Å; F613-L765 HydrophobicContact CD2-CG 4.2Å; L614-L765 HydrophobicContact CD2-CD1 3.64Å; L614-L765 HydrophobicContact CG-CD1 4.18Å; V619-L765 HydrophobicContact CG1-CD1 3.69Å; L623-L765 HydrophobicContact CD1-CD1 4.26Å; I761-L765 VanDerWaalsContact O-CB 3.25Å; I761-L765 WeakPolarHBondContact O-CB 3.44Å; I761-L765 PolarHBondContact O-N 3.2Å; K762-L765 PolarHBondContact O-N 3.29Å; R763-L765 VanDerWaalsContact C-N 3.34Å; L765-C768 PolarHBondContact O-N 3.41Å; L765-A769 WeakPolarHBondContact O-CB 3.39Å; L765-A769 PolarHBondContact O-N 2.93Å; L765-W837 HydrophobicContact CB-CH2 3.81Å; L765-W837 HydrophobicContact CB-CZ2 3.92Å; L765-W837 HydrophobicContact CD1-CH2 4.37Å; L765-W837 HydrophobicContact CD1-CZ2 4.28Å; L765-W837 HydrophobicContact CG-CH2 4.29Å; L765-W837 HydrophobicContact CG-CZ2 4.01Å
766	I	98.7	Very high	96.9	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-67.1	-38.8	-178.7	-171.1	62.8	0	0	0	111.7	V606 A635 M706 T710 K762 R763 A769 D770	V606-I766 HydrophobicContact CG1-CD1 3.98Å; A635-I766 HydrophobicContact CB-CD1 3.81Å; M706-I766 HydrophobicContact CB-CG2 4.13Å; M706-I766 HydrophobicContact CE-CB 3.7Å; M706-I766 HydrophobicContact CE-CG1 4.43Å; M706-I766 HydrophobicContact CE-CG2 4.05Å; T710-I766 HydrophobicContact CG2-CG1 3.94Å; K762-I766 WeakPolarHBondContact O-CG2 3.36Å; K762-I766 PolarHBondContact O-N 3.37Å; R763-I766 WeakPolarHBondContact O-CG2 3.4Å; I766-A769 PolarHBondContact O-N 3.27Å; I766-D770 VanDerWaalsContact O-CB 3.31Å; I766-D770 WeakPolarHBondContact O-CB 3.12Å; I766-D770 PolarHBondContact O-N 2.99Å
767	K	98.4	Very high	97.3	Very high	4 Å²	4	13.6 Å²	13.6	2%	0.017	7%	0.067	C	C	.	.	H	α-helix	trans	-64.6	-43.6	176.8	-69.9	-175.7	78.4	58.6	0	112.3	A709 T710 E711 H718 R763 M764 A769 D770 V771 M833	A709-K767 WeakPolarHBondContact O-CD 3.24Å; A709-K767 WeakPolarHBondContact O-CE 3.13Å; A709-K767 VanDerWaalsContact O-CG 3.28Å; A709-K767 WeakPolarHBondContact O-CG 3.47Å; A709-K767 PolarHBondContact O-NZ 3.41Å; T710-K767 PolarHBondContact O-NZ 3Å; E711-K767 PolarHBondContact O-NZ 3.38Å; H718-K767 HydrophobicContact CB-CD 3.88Å; R763-K767 WeakPolarHBondContact O-CB 3.18Å; R763-K767 VanDerWaalsContact O-CG 3.22Å; R763-K767 WeakPolarHBondContact O-CG 2.98Å; R763-K767 PolarHBondContact O-N 3.26Å; R763-K767 VanDerWaalsContact O-N 3.15Å; M764-K767 PolarHBondContact O-N 3.27Å; K767-A769 VanDerWaalsContact C-N 3.28Å; K767-A769 PolarHBondContact O-N 2.95Å; K767-D770 PolarHBondContact O-N 3.01Å; K767-V771 WeakPolarHBondContact O-CG2 3.42Å; K767-V771 PolarHBondContact O-N 3.47Å; K767-M833 HydrophobicContact CB-SD 4.33Å
768	C	98.7	Very high	97.7	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62	-38.9	174.2	-73	0	0	0	0	111.5	F613 M764 L765 A772 F834 W837	F613-C768 HydrophobicContact CE2-CB 3.84Å; F613-C768 HydrophobicContact CZ-CB 4.31Å; M764-C768 WeakPolarHBondContact O-CB 3.46Å; M764-C768 PolarHBondContact O-N 2.75Å; M764-C768 PolarHBondContact O-SG 2.67Å; L765-C768 PolarHBondContact O-N 3.41Å; C768-A772 WeakPolarHBondContact O-CB 3.28Å; C768-A772 PolarHBondContact O-N 3.3Å; C768-F834 HydrophobicContact CB-CE1 4.44Å; C768-F834 HydrophobicContact CB-CZ 4.27Å; C768-F834 VanDerWaalsContact O-CZ 3.29Å; C768-F834 WeakPolarHBondContact O-CZ 3.25Å; C768-W837 HydrophobicContact CB-CG 4.19Å; C768-W837 VanDerWaalsContact SG-CB 3.58Å; C768-W837 VanDerWaalsContact SG-CG 3.51Å
769	A	98.8	Very high	97.8	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-67.7	-41.7	179.4	0	0	0	0	0	112	V606 A609 T610 F613 L765 I766 K767 V771 A772	V606-A769 HydrophobicContact CG1-CB 3.99Å; A609-A769 HydrophobicContact CB-CB 3.81Å; T610-A769 WeakPolarHBondContact OG1-CB 3.21Å; F613-A769 HydrophobicContact CD2-CB 4.26Å; F613-A769 HydrophobicContact CE2-CB 4.02Å; L765-A769 WeakPolarHBondContact O-CB 3.39Å; L765-A769 PolarHBondContact O-N 2.93Å; I766-A769 PolarHBondContact O-N 3.27Å; K767-A769 VanDerWaalsContact C-N 3.28Å; K767-A769 PolarHBondContact O-N 2.95Å; A769-V771 PolarHBondContact O-N 3.32Å; A769-A772 WeakPolarHBondContact O-CB 3.32Å; A769-A772 PolarHBondContact O-N 3.42Å
770	D	98.8	Very high	98	Very high	17 Å²	17	16 Å²	16	9%	0.091	8%	0.08	C	C	.	.	H	α-helix	trans	-62	-42.4	-177.6	-174.3	18.2	0	0	0	112.9	H602 H638 I766 K767	H602-D770 IonicContact CE1-OD1 2.73Å; H602-D770 PolarHBondContact CE1-OD1 3.01Å; H602-D770 IonicContact NE2-OD1 3.47Å; H602-D770 PolarHBondContact NE2-OD1 3.45Å; H638-D770 IonicContact CD2-OD1 3.47Å; H638-D770 IonicContact NE2-OD1 2.64Å; H638-D770 PolarHBondContact NE2-OD1 3.33Å; I766-D770 VanDerWaalsContact O-CB 3.31Å; I766-D770 WeakPolarHBondContact O-CB 3.12Å; I766-D770 PolarHBondContact O-N 2.99Å; K767-D770 PolarHBondContact O-N 3.01Å
771	V	98.1	Very high	98.1	Very high	19 Å²	19	15.2 Å²	15.2	12%	0.115	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	32.7	178.9	-56.6	0	0	0	0	113.3	K767 A769 N773 P774 F825 I830 M833	K767-V771 WeakPolarHBondContact O-CG2 3.42Å; K767-V771 PolarHBondContact O-N 3.47Å; A769-V771 PolarHBondContact O-N 3.32Å; V771-N773 VanDerWaalsContact C-N 3.27Å; V771-N773 PolarHBondContact O-N 2.72Å; V771-P774 VanDerWaalsContact O-CD 3.27Å; V771-P774 WeakPolarHBondContact O-CD 3.4Å; V771-F825 HydrophobicContact CB-CZ 4.21Å; V771-F825 HydrophobicContact CG1-CZ 4.24Å; V771-I830 HydrophobicContact CB-CD1 3.95Å; V771-I830 HydrophobicContact CG2-CD1 3.6Å; V771-M833 HydrophobicContact CG2-CE 3.26Å; V771-M833 HydrophobicContact CG2-SD 4.31Å
772	A	98.3	Very high	98.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.077	C	C	.	.			trans	-74.8	-7.5	-177.8	0	0	0	0	0	115.5	W540 A609 C768 A769 P774 C775 R776 F834	W540-A772 HydrophobicContact CH2-CB 3.77Å; W540-A772 HydrophobicContact CZ2-CB 4.11Å; A609-A772 HydrophobicContact CB-CB 4.42Å; C768-A772 WeakPolarHBondContact O-CB 3.28Å; C768-A772 PolarHBondContact O-N 3.3Å; A769-A772 WeakPolarHBondContact O-CB 3.32Å; A769-A772 PolarHBondContact O-N 3.42Å; A772-P774 VanDerWaalsContact C-CD 3.44Å; A772-P774 VanDerWaalsContact C-N 3.34Å; A772-C775 WeakPolarHBondContact O-CA 3.35Å; A772-C775 WeakPolarHBondContact O-CB 3.34Å; A772-C775 PolarHBondContact O-N 3.01Å; A772-R776 PolarHBondContact O-N 3.14Å; A772-F834 HydrophobicContact CB-CZ 4.21Å
773	N	98.3	Very high	98.1	Very high	17 Å²	17	18.1 Å²	18.1	9%	0.091	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-52.7	-41.5	-173.7	-52.6	-25.2	0	0	0	114.3	Y597 V771 C775 R776 W784	Y597-N773 VanDerWaalsContact CE2-ND2 3.33Å; Y597-N773 WeakPolarHBondContact CE2-ND2 3.34Å; Y597-N773 PolarHBondContact OH-ND2 3.33Å; V771-N773 VanDerWaalsContact C-N 3.27Å; V771-N773 PolarHBondContact O-N 2.72Å; N773-C775 PolarHBondContact O-N 3.12Å; N773-R776 WeakPolarHBondContact O-CB 3.32Å; N773-R776 PolarHBondContact O-N 3.08Å; N773-R776 VanDerWaalsContact O-N 3.12Å; N773-W784 HydrophobicContact CB-CB 3.74Å; N773-W784 HydrophobicContact CB-CG 4.06Å
774	P	98.5	Very high	98.2	Very high	2 Å²	2	16.1 Å²	16.1	1%	0.013	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-65.6	-16.9	177.1	-23.2	37.6	0	0	0	114.2	V771 A772 F825 I826 I830 L850 N853	V771-P774 VanDerWaalsContact O-CD 3.27Å; V771-P774 WeakPolarHBondContact O-CD 3.4Å; A772-P774 VanDerWaalsContact C-CD 3.44Å; A772-P774 VanDerWaalsContact C-N 3.34Å; P774-F825 HydrophobicContact CG-CD1 4.37Å; P774-F825 HydrophobicContact CG-CE1 4.24Å; P774-I826 HydrophobicContact CB-CD1 4.06Å; P774-I826 HydrophobicContact CB-CG1 3.89Å; P774-I826 HydrophobicContact CG-CG1 4.19Å; P774-I830 HydrophobicContact CB-CG2 4.25Å; P774-I830 HydrophobicContact CG-CD1 4.41Å; P774-I830 HydrophobicContact CG-CG1 4.18Å; P774-I830 HydrophobicContact CG-CG2 4.35Å; P774-L850 HydrophobicContact CB-CD1 3.73Å; P774-L850 WeakPolarHBondContact O-CA 3.04Å; P774-N853 PolarHBondContact O-ND2 2.9Å
775	C	98.4	Very high	98.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-96.2	-1.6	176.9	-61.3	0	0	0	0	113.1	W540 A772 N773 F834 L846 H849	W540-C775 HydrophobicContact CZ2-CB 4.16Å; W540-C775 PolarHBondContact NE1-O 3.06Å; A772-C775 WeakPolarHBondContact O-CA 3.35Å; A772-C775 WeakPolarHBondContact O-CB 3.34Å; A772-C775 PolarHBondContact O-N 3.01Å; N773-C775 PolarHBondContact O-N 3.12Å; C775-F834 HydrophobicContact CB-CE1 4.32Å; C775-L846 HydrophobicContact CB-CB 4.01Å; C775-L846 HydrophobicContact CB-CD2 4.39Å; C775-L846 HydrophobicContact CB-CG 4.18Å; C775-H849 VanDerWaalsContact O-CB 3.25Å; C775-H849 WeakPolarHBondContact O-CB 3.45Å
776	R	98.3	Very high	98	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	-76.8	162.2	175.8	-66	-66.3	-168.9	-172.5	1.5	111.4	W540 D605 H608 A772 N773 L780 N853	W540-R776 PolarHBondContact O-NH1 2.82Å; W540-R776 VanDerWaalsContact O-NH1 3.12Å; D605-R776 PolarHBondContact O-NH2 3.43Å; D605-R776 VanDerWaalsContact O-NH2 3.12Å; D605-R776 IonicContact OD1-CZ 3.54Å; D605-R776 IonicContact OD1-NE 3.16Å; D605-R776 PolarHBondContact OD1-NE 2.91Å; D605-R776 IonicContact OD1-NH2 2.7Å; D605-R776 PolarHBondContact OD1-NH2 2.87Å; D605-R776 IonicContact OD2-CZ 3.51Å; D605-R776 IonicContact OD2-NE 3.8Å; D605-R776 PolarHBondContact OD2-NE 3.22Å; D605-R776 VanDerWaalsContact OD2-NE 3.08Å; D605-R776 IonicContact OD2-NH2 2.72Å; D605-R776 PolarHBondContact OD2-NH2 3.12Å; H608-R776 PolarHBondContact CE1-NH1 3.34Å; H608-R776 PolarHBondContact ND1-NH1 2.86Å; H608-R776 VanDerWaalsContact ND1-NH1 3.13Å; H608-R776 PolarHBondContact ND1-NH2 3.24Å; H608-R776 VanDerWaalsContact ND1-NH2 3.14Å; A772-R776 PolarHBondContact O-N 3.14Å; N773-R776 WeakPolarHBondContact O-CB 3.32Å; N773-R776 PolarHBondContact O-N 3.08Å; N773-R776 VanDerWaalsContact O-N 3.12Å; R776-L780 HydrophobicContact CB-CB 3.85Å; R776-L780 HydrophobicContact CB-CD1 4.38Å; R776-N853 PolarHBondContact O-ND2 3.1Å
777	P	98.1	Very high	98	Very high	27 Å²	27	18.4 Å²	18.4	18%	0.175	10%	0.096	C	C	.	.			trans	-47.8	145.2	165.8	-28.5	34.1	0	0	0	112.3	E541 E779 L780 C781	E541-P777 HydrophobicContact CB-CG 4.14Å; E541-P777 HydrophobicContact CG-CG 4.17Å; P777-E779 VanDerWaalsContact C-N 3.31Å; P777-E779 PolarHBondContact O-N 3.06Å; P777-E779 VanDerWaalsContact O-N 3.12Å; P777-L780 WeakPolarHBondContact O-CB 3.22Å; P777-L780 PolarHBondContact O-N 2.94Å; P777-C781 PolarHBondContact O-N 3.07Å
778	L	97.3	Very high	98	Very high	55 Å²	55	19.2 Å²	19.2	29%	0.288	10%	0.1	S	C	.	.	H	α-helix	trans	-51.2	-43.4	-167.5	178.9	62	0	0	0	114.2	L780 C781 I782 N853 Y856	L778-L780 VanDerWaalsContact C-N 3.33Å; L778-L780 PolarHBondContact O-N 3.13Å; L778-C781 WeakPolarHBondContact O-CB 3.44Å; L778-C781 PolarHBondContact O-N 3.19Å; L778-I782 HydrophobicContact CD1-CD1 3.85Å; L778-I782 HydrophobicContact CD1-CG1 4.01Å; L778-I782 HydrophobicContact CD2-CD1 4.44Å; L778-I782 HydrophobicContact CG-CD1 3.76Å; L778-I782 HydrophobicContact CG-CG1 4.36Å; L778-I782 VanDerWaalsContact O-CG1 3.28Å; L778-I782 WeakPolarHBondContact O-CG1 3.3Å; L778-I782 PolarHBondContact O-N 2.79Å; L778-N853 WeakPolarHBondContact CA-OD1 3.27Å; L778-N853 VanDerWaalsContact CD1-OD1 3.27Å; L778-N853 WeakPolarHBondContact CD1-OD1 3.44Å; L778-Y856 HydrophobicContact CD1-CD1 3.77Å; L778-Y856 HydrophobicContact CD1-CD2 4.03Å; L778-Y856 HydrophobicContact CD1-CE1 4.31Å; L778-Y856 HydrophobicContact CD1-CG 3.61Å; L778-Y856 HydrophobicContact CD2-CD2 3.85Å; L778-Y856 HydrophobicContact CD2-CE2 4.2Å; L778-Y856 HydrophobicContact CD2-CG 4.26Å
779	E	96.3	Very high	97.9	Very high	109 Å²	109	19.3 Å²	19.3	51%	0.509	10%	0.101	S	C	.	.	H	α-helix	trans	-62.1	-39.6	-179.9	-66.5	-59.8	134.7	0	0	112.5	P777 E783 R869	P777-E779 VanDerWaalsContact C-N 3.31Å; P777-E779 PolarHBondContact O-N 3.06Å; P777-E779 VanDerWaalsContact O-N 3.12Å; E779-E783 PolarHBondContact O-N 3.42Å; E779-R869 IonicContact OE2-CZ 3.89Å; E779-R869 IonicContact OE2-NH1 3.85Å; E779-R869 IonicContact OE2-NH2 2.67Å; E779-R869 PolarHBondContact OE2-NH2 3.14Å
780	L	97.3	Very high	97.8	Very high	8 Å²	8	22.7 Å²	22.7	4%	0.042	12%	0.117	C	C	.	.	H	α-helix	trans	-69.3	-41.8	174.6	-64.6	-177.5	0	0	0	111.1	N543 I544 L545 R776 P777 L778 I782 E783 W784	N543-L780 WeakPolarHBondContact OD1-CD2 3.33Å; I544-L780 HydrophobicContact CG2-CD2 4.47Å; L545-L780 HydrophobicContact CB-CD2 4.5Å; L545-L780 HydrophobicContact CD1-CD2 3.51Å; L545-L780 HydrophobicContact CG-CD2 3.61Å; R776-L780 HydrophobicContact CB-CB 3.85Å; R776-L780 HydrophobicContact CB-CD1 4.38Å; P777-L780 WeakPolarHBondContact O-CB 3.22Å; P777-L780 PolarHBondContact O-N 2.94Å; L778-L780 VanDerWaalsContact C-N 3.33Å; L778-L780 PolarHBondContact O-N 3.13Å; L780-I782 VanDerWaalsContact C-N 3.3Å; L780-I782 PolarHBondContact O-N 3.28Å; L780-E783 PolarHBondContact O-N 3.07Å; L780-W784 WeakPolarHBondContact O-CB 3.33Å; L780-W784 PolarHBondContact O-N 3.46Å
781	C	98.2	Very high	97.8	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.014	11%	0.114	C	C	.	.	H	α-helix	trans	-57.1	-45.1	176	177.5	0	0	0	0	111.3	P777 L778 A785	P777-C781 PolarHBondContact O-N 3.07Å; L778-C781 WeakPolarHBondContact O-CB 3.44Å; L778-C781 PolarHBondContact O-N 3.19Å; C781-A785 VanDerWaalsContact O-CB 3.27Å; C781-A785 WeakPolarHBondContact O-CB 3.22Å; C781-A785 PolarHBondContact O-N 2.75Å
782	I	97.6	Very high	97.7	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-64.8	-46.2	178	-66.9	165.8	0	0	0	111.2	L778 L780 A785 G786 Y856 W857 L868 R869	L778-I782 HydrophobicContact CD1-CD1 3.85Å; L778-I782 HydrophobicContact CD1-CG1 4.01Å; L778-I782 HydrophobicContact CD2-CD1 4.44Å; L778-I782 HydrophobicContact CG-CD1 3.76Å; L778-I782 HydrophobicContact CG-CG1 4.36Å; L778-I782 VanDerWaalsContact O-CG1 3.28Å; L778-I782 WeakPolarHBondContact O-CG1 3.3Å; L778-I782 PolarHBondContact O-N 2.79Å; L780-I782 VanDerWaalsContact C-N 3.3Å; L780-I782 PolarHBondContact O-N 3.28Å; I782-A785 PolarHBondContact O-N 3.5Å; I782-G786 PolarHBondContact O-N 3.31Å; I782-Y856 HydrophobicContact CD1-CD1 4.46Å; I782-Y856 HydrophobicContact CD1-CE1 3.69Å; I782-Y856 HydrophobicContact CD1-CE2 4.26Å; I782-Y856 WeakPolarHBondContact CD1-OH 3.45Å; I782-Y856 HydrophobicContact CG1-CD1 4.44Å; I782-Y856 HydrophobicContact CG1-CE1 3.79Å; I782-W857 HydrophobicContact CB-CH2 4.42Å; I782-W857 HydrophobicContact CG1-CH2 3.97Å; I782-W857 HydrophobicContact CG1-CZ2 4.11Å; I782-W857 HydrophobicContact CG2-CH2 4.49Å; I782-L868 HydrophobicContact CG2-CB 4.06Å; I782-R869 HydrophobicContact CG2-CG 4.35Å
783	E	97.9	Very high	97.6	Very high	72 Å²	72	23.6 Å²	23.6	34%	0.336	12%	0.118	S	C	.	.	H	α-helix	trans	-62	-48.2	179.4	178.5	66.1	-169.5	0	0	111.2	L545 E779 L780 A785 G786 R787	L545-E783 HydrophobicContact CD1-CB 3.8Å; L545-E783 HydrophobicContact CD1-CG 3.59Å; L545-E783 HydrophobicContact CD2-CG 3.98Å; L545-E783 HydrophobicContact CG-CG 4.44Å; E779-E783 PolarHBondContact O-N 3.42Å; L780-E783 PolarHBondContact O-N 3.07Å; E783-A785 VanDerWaalsContact C-N 3.34Å; E783-A785 PolarHBondContact O-N 2.75Å; E783-G786 WeakPolarHBondContact O-CA 3.49Å; E783-G786 PolarHBondContact O-N 2.79Å; E783-R787 HydrophobicContact CG-CG 4.44Å; E783-R787 WeakPolarHBondContact O-CG 3.41Å; E783-R787 PolarHBondContact O-N 2.69Å; E783-R787 IonicContact OE1-CZ 2.88Å; E783-R787 IonicContact OE1-NE 3.1Å; E783-R787 PolarHBondContact OE1-NE 2.65Å; E783-R787 IonicContact OE1-NH2 2.86Å; E783-R787 PolarHBondContact OE1-NH2 2.88Å
784	W	98.5	Very high	97.5	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-41.5	178.7	-75.1	128.9	0	0	0	112.3	I544 Y597 T601 H602 D605 N773 L780 G786 R787 I788	I544-W784 HydrophobicContact CG2-CZ2 3.82Å; Y597-W784 AromaticContact CD2-CE3 3.69Å; Y597-W784 HydrophobicContact CD2-CE3 3.69Å; Y597-W784 HydrophobicContact CD2-CZ3 4.14Å; Y597-W784 HydrophobicContact CE2-CB 4.49Å; Y597-W784 HydrophobicContact CE2-CD2 4.35Å; Y597-W784 AromaticContact CE2-CE3 3.62Å; Y597-W784 HydrophobicContact CE2-CE3 3.62Å; Y597-W784 HydrophobicContact CE2-CZ3 4.25Å; T601-W784 HydrophobicContact CG2-CH2 3.88Å; T601-W784 HydrophobicContact CG2-CZ2 4.25Å; H602-W784 HydrophobicContact CB-CH2 4.16Å; H602-W784 HydrophobicContact CB-CZ3 4.17Å; D605-W784 HydrophobicContact CB-CZ2 3.91Å; N773-W784 HydrophobicContact CB-CB 3.74Å; N773-W784 HydrophobicContact CB-CG 4.06Å; L780-W784 WeakPolarHBondContact O-CB 3.33Å; L780-W784 PolarHBondContact O-N 3.46Å; W784-G786 VanDerWaalsContact C-N 3.26Å; W784-G786 PolarHBondContact O-N 3.02Å; W784-R787 HydrophobicContact CE3-CB 4.39Å; W784-R787 PolarHBondContact O-N 2.81Å; W784-I788 WeakPolarHBondContact O-CG2 3.18Å; W784-I788 PolarHBondContact O-N 3.1Å
785	A	97.8	Very high	97.5	Very high	3 Å²	3	24.1 Å²	24.1	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-59.2	-37.7	172.7	0	0	0	0	0	111.9	C781 I782 E783 I788 S789 V818 Q822 W857 L868	C781-A785 VanDerWaalsContact O-CB 3.27Å; C781-A785 WeakPolarHBondContact O-CB 3.22Å; C781-A785 PolarHBondContact O-N 2.75Å; I782-A785 PolarHBondContact O-N 3.5Å; E783-A785 VanDerWaalsContact C-N 3.34Å; E783-A785 PolarHBondContact O-N 2.75Å; A785-I788 WeakPolarHBondContact O-CG2 3.27Å; A785-S789 VanDerWaalsContact O-CB 3.24Å; A785-S789 WeakPolarHBondContact O-CB 3.46Å; A785-S789 PolarHBondContact O-N 2.65Å; A785-S789 VanDerWaalsContact O-N 3.14Å; A785-S789 PolarHBondContact O-OG 3.16Å; A785-V818 HydrophobicContact CB-CG1 4.48Å; A785-Q822 HydrophobicContact CB-CG 3.89Å; A785-W857 HydrophobicContact CB-CH2 4.1Å; A785-W857 HydrophobicContact CB-CZ2 3.81Å; A785-L868 HydrophobicContact CB-CD2 4.01Å
786	G	96.6	Very high	97.3	Very high	14 Å²	14	24.1 Å²	24.1	14%	0.144	12%	0.124	C	C	.	.	H	α-helix	trans	-68.2	-47	175.3	0	0	0	0	0	113.3	I782 E783 W784 S789 E790	I782-G786 PolarHBondContact O-N 3.31Å; E783-G786 WeakPolarHBondContact O-CA 3.49Å; E783-G786 PolarHBondContact O-N 2.79Å; W784-G786 VanDerWaalsContact C-N 3.26Å; W784-G786 PolarHBondContact O-N 3.02Å; G786-S789 PolarHBondContact O-N 2.93Å; G786-E790 PolarHBondContact O-N 3.26Å
787	R	98.3	Very high	97.2	Very high	33 Å²	33	26.7 Å²	26.7	13%	0.125	14%	0.138	C	C	.	.	H	α-helix	trans	-58.5	-49.6	178.4	-74.8	-178.6	-176	-146	-1.4	112.1	E548 S596 Y597 E783 W784 S789 E790 E791	E548-R787 IonicContact OE1-CZ 3.99Å; E548-R787 IonicContact OE1-NH1 2.85Å; E548-R787 PolarHBondContact OE1-NH1 3.18Å; E548-R787 IonicContact OE1-NH2 3.74Å; E548-R787 IonicContact OE2-CZ 3.66Å; E548-R787 IonicContact OE2-NH1 2.9Å; E548-R787 PolarHBondContact OE2-NH1 3.01Å; E548-R787 IonicContact OE2-NH2 3.15Å; E548-R787 PolarHBondContact OE2-NH2 3.33Å; S596-R787 VanDerWaalsContact CB-O 3.25Å; S596-R787 WeakPolarHBondContact CB-O 3.41Å; S596-R787 WeakPolarHBondContact O-CB 3.22Å; S596-R787 WeakPolarHBondContact O-CD 3.41Å; S596-R787 WeakPolarHBondContact O-CG 3.5Å; Y597-R787 HydrophobicContact CD2-CB 4.1Å; E783-R787 HydrophobicContact CG-CG 4.44Å; E783-R787 WeakPolarHBondContact O-CG 3.41Å; E783-R787 PolarHBondContact O-N 2.69Å; E783-R787 IonicContact OE1-CZ 2.88Å; E783-R787 IonicContact OE1-NE 3.1Å; E783-R787 PolarHBondContact OE1-NE 2.65Å; E783-R787 IonicContact OE1-NH2 2.86Å; E783-R787 PolarHBondContact OE1-NH2 2.88Å; W784-R787 HydrophobicContact CE3-CB 4.39Å; W784-R787 PolarHBondContact O-N 2.81Å; R787-S789 VanDerWaalsContact C-N 3.34Å; R787-E790 PolarHBondContact O-N 3.14Å; R787-E791 PolarHBondContact O-N 3.45Å
788	I	97.6	Very high	97.2	Very high	20 Å²	20	27 Å²	27	10%	0.103	14%	0.137	C	C	.	.	H	α-helix	trans	-67.7	-36.9	179.7	-167.9	60.7	0	0	0	111.6	Y597 W784 A785 E791 Y792	Y597-I788 HydrophobicContact CD1-CD1 3.75Å; Y597-I788 HydrophobicContact CD2-CB 3.6Å; Y597-I788 HydrophobicContact CD2-CD1 4.17Å; Y597-I788 HydrophobicContact CD2-CG1 4.36Å; Y597-I788 HydrophobicContact CE1-CD1 4.25Å; Y597-I788 HydrophobicContact CE2-CB 4.07Å; Y597-I788 HydrophobicContact CG-CB 3.97Å; Y597-I788 HydrophobicContact CG-CD1 3.7Å; Y597-I788 HydrophobicContact CG-CG1 4.37Å; W784-I788 WeakPolarHBondContact O-CG2 3.18Å; W784-I788 PolarHBondContact O-N 3.1Å; A785-I788 WeakPolarHBondContact O-CG2 3.27Å; I788-E791 PolarHBondContact O-N 2.82Å; I788-Y792 HydrophobicContact CD1-CD1 4.43Å; I788-Y792 HydrophobicContact CD1-CE1 3.85Å; I788-Y792 HydrophobicContact CD1-CE2 4.18Å; I788-Y792 HydrophobicContact CG1-CD2 4.16Å; I788-Y792 HydrophobicContact CG1-CE1 4.23Å; I788-Y792 HydrophobicContact CG1-CE2 3.63Å; I788-Y792 PolarHBondContact O-N 2.82Å
789	S	96.3	Very high	97.1	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-62.3	-46	177	-62.6	0	0	0	0	111.5	A785 G786 R787 E791 Y792 F793 V818	A785-S789 VanDerWaalsContact O-CB 3.24Å; A785-S789 WeakPolarHBondContact O-CB 3.46Å; A785-S789 PolarHBondContact O-N 2.65Å; A785-S789 VanDerWaalsContact O-N 3.14Å; A785-S789 PolarHBondContact O-OG 3.16Å; G786-S789 PolarHBondContact O-N 2.93Å; R787-S789 VanDerWaalsContact C-N 3.34Å; S789-E791 VanDerWaalsContact C-N 3.27Å; S789-E791 PolarHBondContact O-N 2.87Å; S789-Y792 PolarHBondContact O-N 2.96Å; S789-F793 WeakPolarHBondContact O-CB 3.32Å; S789-F793 VanDerWaalsContact O-CD1 3.28Å; S789-F793 WeakPolarHBondContact O-CD1 3.41Å; S789-F793 WeakPolarHBondContact O-CD2 3.37Å; S789-F793 WeakPolarHBondContact O-CG 3.47Å; S789-F793 PolarHBondContact O-N 2.99Å; S789-V818 WeakPolarHBondContact OG-CG1 3.44Å
790	E	97.6	Very high	97	Very high	71 Å²	71	23.5 Å²	23.5	33%	0.332	12%	0.118	S	C	.	.	H	α-helix	trans	-62.9	-35.5	177.2	-178.1	57.1	-146.9	0	0	112	G786 R787 F793 A794 R813	G786-E790 PolarHBondContact O-N 3.26Å; R787-E790 PolarHBondContact O-N 3.14Å; E790-F793 PolarHBondContact O-N 3.44Å; E790-A794 WeakPolarHBondContact O-CB 3.28Å; E790-A794 PolarHBondContact O-N 3.45Å; E790-R813 IonicContact OE1-CZ 3.51Å; E790-R813 IonicContact OE1-NH1 3.66Å; E790-R813 PolarHBondContact OE1-NH1 3.3Å; E790-R813 IonicContact OE1-NH2 3.05Å; E790-R813 PolarHBondContact OE1-NH2 3.47Å; E790-R813 IonicContact OE2-CZ 3.71Å; E790-R813 IonicContact OE2-NH1 2.9Å; E790-R813 PolarHBondContact OE2-NH1 2.87Å; E790-R813 VanDerWaalsContact OE2-NH1 3.1Å
791	E	97.9	Very high	97	Very high	7 Å²	7	31.9 Å²	31.9	3%	0.033	15%	0.149	C	C	.	.	H	α-helix	trans	-67.8	-43.5	177.6	-158.6	166.8	118	0	0	112.5	S596 Y597 H598 H642 G644 R787 I788 S789 F793 A794 Q795	S596-E791 PolarHBondContact N-OE2 2.87Å; Y597-E791 WeakPolarHBondContact CA-OE2 3.33Å; Y597-E791 PolarHBondContact N-OE2 3.1Å; H598-E791 IonicContact CE1-OE1 3.19Å; H598-E791 IonicContact CG-OE1 3.65Å; H598-E791 PolarHBondContact N-OE2 2.97Å; H598-E791 VanDerWaalsContact N-OE2 3.12Å; H598-E791 IonicContact ND1-OE1 2.79Å; H598-E791 PolarHBondContact ND1-OE1 2.96Å; H598-E791 IonicContact ND1-OE2 3.45Å; H642-E791 IonicContact CE1-OE1 2.75Å; H642-E791 IonicContact ND1-OE1 3.74Å; G644-E791 WeakPolarHBondContact CA-OE1 3.48Å; R787-E791 PolarHBondContact O-N 3.45Å; I788-E791 PolarHBondContact O-N 2.82Å; S789-E791 VanDerWaalsContact C-N 3.27Å; S789-E791 PolarHBondContact O-N 2.87Å; E791-F793 VanDerWaalsContact C-N 3.33Å; E791-F793 PolarHBondContact O-N 2.82Å; E791-A794 PolarHBondContact O-N 2.75Å; E791-Q795 PolarHBondContact O-N 3.31Å
792	Y	96.5	Very high	96.8	Very high	27 Å²	27	36.6 Å²	36.6	11%	0.106	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-38.7	171.7	-66.7	-23.5	0	0	0	112.2	T646 I788 S789 A794 Q795 T796 M808 F811	T646-Y792 HydrophobicContact CG2-CE1 4.32Å; I788-Y792 HydrophobicContact CD1-CD1 4.43Å; I788-Y792 HydrophobicContact CD1-CE1 3.85Å; I788-Y792 HydrophobicContact CD1-CE2 4.18Å; I788-Y792 HydrophobicContact CG1-CD2 4.16Å; I788-Y792 HydrophobicContact CG1-CE1 4.23Å; I788-Y792 HydrophobicContact CG1-CE2 3.63Å; I788-Y792 PolarHBondContact O-N 2.82Å; S789-Y792 PolarHBondContact O-N 2.96Å; Y792-A794 PolarHBondContact O-N 2.64Å; Y792-Q795 WeakPolarHBondContact O-CB 3.19Å; Y792-Q795 PolarHBondContact O-N 2.87Å; Y792-T796 PolarHBondContact O-N 3.37Å; Y792-T796 PolarHBondContact O-OG1 2.83Å; Y792-T796 VanDerWaalsContact O-OG1 3.13Å; Y792-M808 HydrophobicContact CD1-CE 3.96Å; Y792-M808 HydrophobicContact CD1-SD 4.02Å; Y792-M808 HydrophobicContact CD2-CE 3.47Å; Y792-M808 VanDerWaalsContact CD2-CE 3.47Å; Y792-M808 HydrophobicContact CE1-CE 4.07Å; Y792-M808 HydrophobicContact CE1-SD 4.25Å; Y792-M808 HydrophobicContact CE2-CE 3.59Å; Y792-M808 HydrophobicContact CG-CE 3.67Å; Y792-M808 HydrophobicContact CG-SD 4.18Å; Y792-F811 AromaticContact CD2-CD1 3.78Å; Y792-F811 HydrophobicContact CD2-CD1 3.78Å; Y792-F811 AromaticContact CD2-CE1 3.92Å; Y792-F811 HydrophobicContact CD2-CE1 3.92Å; Y792-F811 HydrophobicContact CD2-CG 4.17Å; Y792-F811 HydrophobicContact CD2-CZ 4.42Å; Y792-F811 HydrophobicContact CE2-CE1 4.45Å; Y792-F811 HydrophobicContact CG-CD1 4.48Å
793	F	96.9	Very high	96.5	Very high	21 Å²	21	39.6 Å²	39.6	9%	0.092	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-44.4	174.9	-61.1	-22.1	0	0	0	111.8	S789 E790 E791 Q795 T796 D797 F811 R813 C816 V818	S789-F793 WeakPolarHBondContact O-CB 3.32Å; S789-F793 VanDerWaalsContact O-CD1 3.28Å; S789-F793 WeakPolarHBondContact O-CD1 3.41Å; S789-F793 WeakPolarHBondContact O-CD2 3.37Å; S789-F793 WeakPolarHBondContact O-CG 3.47Å; S789-F793 PolarHBondContact O-N 2.99Å; E790-F793 PolarHBondContact O-N 3.44Å; E791-F793 VanDerWaalsContact C-N 3.33Å; E791-F793 PolarHBondContact O-N 2.82Å; F793-Q795 VanDerWaalsContact C-N 3.28Å; F793-Q795 PolarHBondContact O-N 3.32Å; F793-T796 PolarHBondContact O-N 3.44Å; F793-D797 WeakPolarHBondContact O-CB 3.3Å; F793-D797 PolarHBondContact O-N 3.27Å; F793-F811 HydrophobicContact CD1-CB 4.47Å; F793-F811 WeakPolarHBondContact CD1-O 3.5Å; F793-F811 HydrophobicContact CE1-CB 4.46Å; F793-R813 HydrophobicContact CB-CB 3.97Å; F793-R813 HydrophobicContact CD1-CB 4.19Å; F793-R813 HydrophobicContact CD2-CB 3.65Å; F793-R813 HydrophobicContact CE2-CB 4.17Å; F793-R813 HydrophobicContact CG-CB 3.67Å; F793-C816 HydrophobicContact CE1-CB 3.56Å; F793-C816 HydrophobicContact CZ-CB 3.83Å; F793-V818 HydrophobicContact CZ-CG2 4.21Å
794	A	96.7	Very high	96	Very high	28 Å²	28	37.7 Å²	37.7	23%	0.231	20%	0.195	C	C	.	.	H	α-helix	trans	-61.3	-37.6	176.9	0	0	0	0	0	112.1	R645 E790 E791 Y792 E798	R645-A794 PolarHBondContact NH2-O 3.14Å; E790-A794 WeakPolarHBondContact O-CB 3.28Å; E790-A794 PolarHBondContact O-N 3.45Å; E791-A794 PolarHBondContact O-N 2.75Å; Y792-A794 PolarHBondContact O-N 2.64Å; A794-E798 WeakPolarHBondContact O-CB 3.34Å; A794-E798 PolarHBondContact O-N 3.28Å; A794-E798 VanDerWaalsContact O-N 3.17Å
795	Q	97.3	Very high	95.4	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-52.8	171.9	177.4	170.2	-44	0	0	111.7	R645 T646 F649 E791 Y792 F793 D797 E798 E799 V807	R645-Q795 VanDerWaalsContact CA-OE1 3.26Å; T646-Q795 PolarHBondContact OG1-NE2 2.97Å; T646-Q795 VanDerWaalsContact OG1-NE2 3.09Å; F649-Q795 HydrophobicContact CB-CG 4.3Å; F649-Q795 HydrophobicContact CD2-CG 3.75Å; F649-Q795 HydrophobicContact CE2-CG 4.42Å; F649-Q795 HydrophobicContact CG-CG 4.23Å; E791-Q795 PolarHBondContact O-N 3.31Å; Y792-Q795 WeakPolarHBondContact O-CB 3.19Å; Y792-Q795 PolarHBondContact O-N 2.87Å; F793-Q795 VanDerWaalsContact C-N 3.28Å; F793-Q795 PolarHBondContact O-N 3.32Å; Q795-D797 VanDerWaalsContact C-N 3.29Å; Q795-D797 PolarHBondContact O-N 3.06Å; Q795-E798 CarbonylContact O-C 3.44Å; Q795-E798 WeakPolarHBondContact O-CA 3.47Å; Q795-E798 WeakPolarHBondContact O-CB 3.43Å; Q795-E798 PolarHBondContact O-N 3.42Å; Q795-E799 HydrophobicContact CG-CG 4.23Å; Q795-E799 PolarHBondContact NE2-OE1 2.98Å; Q795-E799 WeakPolarHBondContact O-CG 3.28Å; Q795-E799 PolarHBondContact O-N 2.7Å; Q795-V807 VanDerWaalsContact NE2-CG2 3.25Å
796	T	95.1	Very high	95	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.8	-40.3	-178.9	-63.3	0	0	0	0	112.1	Y792 F793 E798 E799 K800 V806 M808 F811 D812	Y792-T796 PolarHBondContact O-N 3.37Å; Y792-T796 PolarHBondContact O-OG1 2.83Å; Y792-T796 VanDerWaalsContact O-OG1 3.13Å; F793-T796 PolarHBondContact O-N 3.44Å; T796-E798 VanDerWaalsContact C-N 3.31Å; T796-E798 PolarHBondContact O-N 3.3Å; T796-E799 PolarHBondContact O-N 2.87Å; T796-K800 HydrophobicContact CG2-CD 4.34Å; T796-K800 VanDerWaalsContact O-CG 3.31Å; T796-K800 WeakPolarHBondContact O-CG 3.28Å; T796-K800 PolarHBondContact O-N 3.42Å; T796-K800 VanDerWaalsContact O-N 3.09Å; T796-V806 HydrophobicContact CG2-CG1 4Å; T796-M808 PolarHBondContact OG1-O 3.05Å; T796-F811 VanDerWaalsContact CB-O 3.23Å; T796-F811 WeakPolarHBondContact CB-O 3.16Å; T796-F811 PolarHBondContact OG1-O 3.37Å; T796-D812 HydrophobicContact CG2-CB 4.08Å
797	D	96.3	Very high	94.2	Very high	53 Å²	53	42.7 Å²	42.7	28%	0.283	22%	0.223	S	C	.	.	H	α-helix	trans	-62.6	-40.7	175.2	-69.2	-28.4	0	0	0	111.5	F793 Q795 R801 R813	F793-D797 WeakPolarHBondContact O-CB 3.3Å; F793-D797 PolarHBondContact O-N 3.27Å; Q795-D797 VanDerWaalsContact C-N 3.29Å; Q795-D797 PolarHBondContact O-N 3.06Å; D797-R801 VanDerWaalsContact O-CB 3.24Å; D797-R801 WeakPolarHBondContact O-CB 3.29Å; D797-R801 PolarHBondContact O-N 3.3Å; D797-R813 IonicContact OD1-NE 2.87Å; D797-R813 IonicContact OD2-CZ 3.1Å; D797-R813 IonicContact OD2-NE 3.87Å; D797-R813 PolarHBondContact OD2-NE 2.75Å; D797-R813 IonicContact OD2-NH2 2.97Å; D797-R813 PolarHBondContact OD2-NH2 2.96Å
798	E	96.6	Very high	93.5	Very high	33 Å²	33	41.2 Å²	41.2	15%	0.154	22%	0.217	C	C	.	.	H	α-helix	trans	-69	-43.4	177.4	177.6	154.2	-133.5	0	0	112.7	R645 F649 A794 Q795 T796 K800 R801 Q802	R645-E798 IonicContact CZ-OE2 3.33Å; R645-E798 IonicContact NE-OE2 3.21Å; R645-E798 PolarHBondContact NE-OE2 2.89Å; R645-E798 IonicContact NH2-OE2 3.46Å; R645-E798 PolarHBondContact NH2-OE2 3.38Å; F649-E798 HydrophobicContact CE2-CB 4.42Å; F649-E798 HydrophobicContact CE2-CG 3.95Å; F649-E798 HydrophobicContact CZ-CG 3.86Å; A794-E798 WeakPolarHBondContact O-CB 3.34Å; A794-E798 PolarHBondContact O-N 3.28Å; A794-E798 VanDerWaalsContact O-N 3.17Å; Q795-E798 CarbonylContact O-C 3.44Å; Q795-E798 WeakPolarHBondContact O-CA 3.47Å; Q795-E798 WeakPolarHBondContact O-CB 3.43Å; Q795-E798 PolarHBondContact O-N 3.42Å; T796-E798 VanDerWaalsContact C-N 3.31Å; T796-E798 PolarHBondContact O-N 3.3Å; E798-K800 VanDerWaalsContact C-N 3.32Å; E798-K800 PolarHBondContact O-N 3.36Å; E798-R801 PolarHBondContact O-N 2.92Å; E798-R801 IonicContact OE1-NH2 3.01Å; E798-R801 PolarHBondContact OE1-NH2 3.46Å; E798-Q802 HydrophobicContact CG-CG 4.19Å; E798-Q802 WeakPolarHBondContact O-CB 3.33Å; E798-Q802 WeakPolarHBondContact O-CG 3.29Å; E798-Q802 PolarHBondContact O-N 2.92Å; E798-Q802 PolarHBondContact OE1-NE2 3.44Å
799	E	95.9	Very high	92.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56	-48.6	175.6	-72	173.8	163.6	0	0	110.5	F649 Q795 T796 R801 Q802 G803 L804 V806 V807	F649-E799 HydrophobicContact CD2-CG 3.49Å; F649-E799 VanDerWaalsContact CD2-CG 3.49Å; F649-E799 HydrophobicContact CE2-CG 3.74Å; Q795-E799 HydrophobicContact CG-CG 4.23Å; Q795-E799 PolarHBondContact NE2-OE1 2.98Å; Q795-E799 WeakPolarHBondContact O-CG 3.28Å; Q795-E799 PolarHBondContact O-N 2.7Å; T796-E799 PolarHBondContact O-N 2.87Å; E799-R801 PolarHBondContact O-N 3.1Å; E799-Q802 PolarHBondContact O-N 2.65Å; E799-G803 PolarHBondContact O-N 3.16Å; E799-L804 HydrophobicContact CB-CB 4.34Å; E799-L804 HydrophobicContact CG-CB 4.48Å; E799-L804 PolarHBondContact O-N 3.43Å; E799-V806 HydrophobicContact CB-CG2 4.07Å; E799-V806 VanDerWaalsContact OE2-CA 3.23Å; E799-V806 WeakPolarHBondContact OE2-CA 3.43Å; E799-V807 WeakPolarHBondContact OE1-CG2 3.18Å; E799-V807 PolarHBondContact OE2-N 3.3Å
800	K	95	Very high	92.2	Very high	92 Å²	92	44.6 Å²	44.6	40%	0.4	24%	0.24	S	C	.	.	H	α-helix	trans	-62.5	-43	176.5	-70.8	173.8	-176.7	177.9	0	112.7	T796 E798 Q802 G803 V806 D812	T796-K800 HydrophobicContact CG2-CD 4.34Å; T796-K800 VanDerWaalsContact O-CG 3.31Å; T796-K800 WeakPolarHBondContact O-CG 3.28Å; T796-K800 PolarHBondContact O-N 3.42Å; T796-K800 VanDerWaalsContact O-N 3.09Å; E798-K800 VanDerWaalsContact C-N 3.32Å; E798-K800 PolarHBondContact O-N 3.36Å; K800-Q802 VanDerWaalsContact C-N 3.35Å; K800-G803 PolarHBondContact O-N 2.98Å; K800-V806 HydrophobicContact CG-CG2 3.73Å; K800-D812 IonicContact NZ-OD1 2.71Å; K800-D812 IonicContact NZ-OD2 2.66Å; K800-D812 PolarHBondContact NZ-OD2 3.43Å
801	R	97.1	Very high	91.9	Very high	184 Å²	184	41.4 Å²	41.4	69%	0.694	23%	0.225	S	C	*	.	H	α-helix	trans	-64.5	-39.2	179.9	179	-177.5	62.8	-179.4	-1.6	112.1	D797 E798 E799 G803	D797-R801 VanDerWaalsContact O-CB 3.24Å; D797-R801 WeakPolarHBondContact O-CB 3.29Å; D797-R801 PolarHBondContact O-N 3.3Å; E798-R801 PolarHBondContact O-N 2.92Å; E798-R801 IonicContact OE1-NH2 3.01Å; E798-R801 PolarHBondContact OE1-NH2 3.46Å; E799-R801 PolarHBondContact O-N 3.1Å; R801-G803 VanDerWaalsContact C-N 3.34Å
802	Q	93.6	Very high	91.6	Very high	100 Å²	100	41.9 Å²	41.9	47%	0.467	23%	0.228	S	C	.	.	H	α-helix	trans	-86.4	-5.6	179.9	-64.2	-167.3	21.9	0	0	113	E798 E799 K800 L804	E798-Q802 HydrophobicContact CG-CG 4.19Å; E798-Q802 WeakPolarHBondContact O-CB 3.33Å; E798-Q802 WeakPolarHBondContact O-CG 3.29Å; E798-Q802 PolarHBondContact O-N 2.92Å; E798-Q802 PolarHBondContact OE1-NE2 3.44Å; E799-Q802 PolarHBondContact O-N 2.65Å; K800-Q802 VanDerWaalsContact C-N 3.35Å; Q802-L804 HydrophobicContact CB-CD1 4.12Å; Q802-L804 HydrophobicContact CB-CG 3.88Å; Q802-L804 PolarHBondContact O-N 2.9Å
803	G	91.3	Very high	91.4	Very high	68 Å²	68	45.5 Å²	45.5	70%	0.701	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.3	21.9	-174.9	0	0	0	0	0	113.4	E799 K800 R801	E799-G803 PolarHBondContact O-N 3.16Å; K800-G803 PolarHBondContact O-N 2.98Å; R801-G803 VanDerWaalsContact C-N 3.34Å
804	L	86.6	Confident	91	Very high	32 Å²	32	50.3 Å²	50.3	17%	0.168	27%	0.268	C	S	.	.			trans	-74.8	156.7	174.7	-63.6	175.3	0	0	0	110.4	F649 A653 E799 Q802 V806	F649-L804 HydrophobicContact CD2-CD1 4.45Å; F649-L804 HydrophobicContact CE2-CD1 3.91Å; F649-L804 HydrophobicContact CZ-CD1 4.24Å; A653-L804 HydrophobicContact CB-CD1 3.88Å; E799-L804 HydrophobicContact CB-CB 4.34Å; E799-L804 HydrophobicContact CG-CB 4.48Å; E799-L804 PolarHBondContact O-N 3.43Å; Q802-L804 HydrophobicContact CB-CD1 4.12Å; Q802-L804 HydrophobicContact CB-CG 3.88Å; Q802-L804 PolarHBondContact O-N 2.9Å; L804-V806 PolarHBondContact O-N 3.3Å; L804-V806 VanDerWaalsContact O-N 3.15Å
805	P	86.8	Confident	90.7	Very high	51 Å²	51	52.6 Å²	52.6	33%	0.331	28%	0.279	S	S	.	.			trans	-57.6	119.6	169.6	-20.5	32.1	0	0	0	110.2	V807	P805-V807 PolarHBondContact O-N 3.41Å
806	V	88.8	Confident	90.4	Very high	49 Å²	49	52.9 Å²	52.9	30%	0.297	28%	0.282	S	S	.	.			trans	-71.8	113.7	177.4	-179.8	0	0	0	0	108.8	T796 E799 K800 L804 P809	T796-V806 HydrophobicContact CG2-CG1 4Å; E799-V806 HydrophobicContact CB-CG2 4.07Å; E799-V806 VanDerWaalsContact OE2-CA 3.23Å; E799-V806 WeakPolarHBondContact OE2-CA 3.43Å; K800-V806 HydrophobicContact CG-CG2 3.73Å; L804-V806 PolarHBondContact O-N 3.3Å; L804-V806 VanDerWaalsContact O-N 3.15Å; V806-P809 HydrophobicContact CG1-CB 4.24Å
807	V	80.8	Confident	90.2	Very high	23 Å²	23	53.6 Å²	53.6	14%	0.139	29%	0.287	C	S	.	.	S	Bend	trans	-85.1	-20.1	-174.1	-56.2	0	0	0	0	112.7	N652 Q795 E799 P805	N652-V807 WeakPolarHBondContact ND2-CG1 3.36Å; Q795-V807 VanDerWaalsContact NE2-CG2 3.25Å; E799-V807 WeakPolarHBondContact OE1-CG2 3.18Å; E799-V807 PolarHBondContact OE2-N 3.3Å; P805-V807 PolarHBondContact O-N 3.41Å
808	M	83	Confident	90.1	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.276	C	S	.	.			trans	-132.2	62.8	-178.6	-65.3	176	77.7	0	0	111.4	D486 T646 Y792 T796 V810 F811	D486-M808 WeakPolarHBondContact OD2-CA 3.35Å; T646-M808 HydrophobicContact CG2-SD 4.46Å; Y792-M808 HydrophobicContact CD1-CE 3.96Å; Y792-M808 HydrophobicContact CD1-SD 4.02Å; Y792-M808 HydrophobicContact CD2-CE 3.47Å; Y792-M808 VanDerWaalsContact CD2-CE 3.47Å; Y792-M808 HydrophobicContact CE1-CE 4.07Å; Y792-M808 HydrophobicContact CE1-SD 4.25Å; Y792-M808 HydrophobicContact CE2-CE 3.59Å; Y792-M808 HydrophobicContact CG-CE 3.67Å; Y792-M808 HydrophobicContact CG-SD 4.18Å; T796-M808 PolarHBondContact OG1-O 3.05Å; M808-V810 VanDerWaalsContact C-N 3.29Å; M808-V810 PolarHBondContact O-N 2.91Å; M808-F811 HydrophobicContact CB-CB 4.02Å; M808-F811 HydrophobicContact CB-CD2 3.96Å; M808-F811 HydrophobicContact CB-CG 4.43Å; M808-F811 HydrophobicContact CE-CB 4.34Å; M808-F811 HydrophobicContact CE-CD1 4.45Å; M808-F811 HydrophobicContact CE-CD2 3.26Å; M808-F811 HydrophobicContact CE-CE2 3.51Å; M808-F811 HydrophobicContact CE-CG 3.77Å; M808-F811 HydrophobicContact CE-CZ 4.23Å; M808-F811 HydrophobicContact CG-CD2 4.43Å; M808-F811 PolarHBondContact O-N 3.44Å
809	P	80.8	Confident	89.9	Confident	69 Å²	69	50 Å²	50	45%	0.448	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-29.9	-173.9	23.6	-35.7	0	0	0	116.8	D486 V806	D486-P809 WeakPolarHBondContact OD1-CD 3.12Å; D486-P809 WeakPolarHBondContact OD1-CG 3.21Å; D486-P809 WeakPolarHBondContact OD2-CD 3.43Å; D486-P809 WeakPolarHBondContact OD2-CG 3.23Å; V806-P809 HydrophobicContact CG1-CB 4.24Å
810	V	86.2	Confident	89.7	Confident	26 Å²	26	53 Å²	53	16%	0.158	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-30.7	175.5	-177.7	0	0	0	0	111.5	P482 H483 D486 M808 D812 C816	P482-V810 HydrophobicContact CB-CG2 3.87Å; H483-V810 HydrophobicContact CB-CG1 4.43Å; H483-V810 WeakPolarHBondContact CE1-CG1 2.97Å; H483-V810 WeakPolarHBondContact ND1-CG1 3.38Å; D486-V810 HydrophobicContact CB-CB 4.07Å; D486-V810 HydrophobicContact CB-CG2 4.19Å; D486-V810 VanDerWaalsContact CG-CG2 3.42Å; D486-V810 WeakPolarHBondContact OD2-CA 3.24Å; D486-V810 WeakPolarHBondContact OD2-CB 3.22Å; D486-V810 WeakPolarHBondContact OD2-CG2 3.42Å; D486-V810 PolarHBondContact OD2-N 3.3Å; M808-V810 VanDerWaalsContact C-N 3.29Å; M808-V810 PolarHBondContact O-N 2.91Å; V810-D812 PolarHBondContact O-N 3.37Å; V810-C816 WeakPolarHBondContact O-CA 3.46Å; V810-C816 WeakPolarHBondContact O-CB 3.45Å
811	F	91.1	Very high	89.6	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.018	26%	0.263	C	S	.	.			trans	-81.1	54.1	171.2	-67.4	-86.2	0	0	0	111.4	D486 L487 Y792 F793 T796 M808	D486-F811 HydrophobicContact CB-CD2 4.16Å; D486-F811 HydrophobicContact CB-CE2 4.15Å; L487-F811 HydrophobicContact CD1-CZ 4.37Å; L487-F811 HydrophobicContact CD2-CE1 4.5Å; L487-F811 HydrophobicContact CD2-CE2 3.67Å; L487-F811 HydrophobicContact CD2-CZ 3.41Å; L487-F811 VanDerWaalsContact CD2-CZ 3.41Å; L487-F811 HydrophobicContact CG-CE2 3.72Å; L487-F811 HydrophobicContact CG-CZ 3.69Å; Y792-F811 AromaticContact CD2-CD1 3.78Å; Y792-F811 HydrophobicContact CD2-CD1 3.78Å; Y792-F811 AromaticContact CD2-CE1 3.92Å; Y792-F811 HydrophobicContact CD2-CE1 3.92Å; Y792-F811 HydrophobicContact CD2-CG 4.17Å; Y792-F811 HydrophobicContact CD2-CZ 4.42Å; Y792-F811 HydrophobicContact CE2-CE1 4.45Å; Y792-F811 HydrophobicContact CG-CD1 4.48Å; F793-F811 HydrophobicContact CD1-CB 4.47Å; F793-F811 WeakPolarHBondContact CD1-O 3.5Å; F793-F811 HydrophobicContact CE1-CB 4.46Å; T796-F811 VanDerWaalsContact CB-O 3.23Å; T796-F811 WeakPolarHBondContact CB-O 3.16Å; T796-F811 PolarHBondContact OG1-O 3.37Å; M808-F811 HydrophobicContact CB-CB 4.02Å; M808-F811 HydrophobicContact CB-CD2 3.96Å; M808-F811 HydrophobicContact CB-CG 4.43Å; M808-F811 HydrophobicContact CE-CB 4.34Å; M808-F811 HydrophobicContact CE-CD1 4.45Å; M808-F811 HydrophobicContact CE-CD2 3.26Å; M808-F811 HydrophobicContact CE-CE2 3.51Å; M808-F811 HydrophobicContact CE-CG 3.77Å; M808-F811 HydrophobicContact CE-CZ 4.23Å; M808-F811 HydrophobicContact CG-CD2 4.43Å; M808-F811 PolarHBondContact O-N 3.44Å
812	D	90.4	Very high	89.4	Confident	17 Å²	17	40.8 Å²	40.8	9%	0.091	23%	0.234	C	C	.	.			trans	-102.9	127.7	166.3	169.6	-4.6	0	0	0	108.1	T796 K800 V810 N814 T815 C816	T796-D812 HydrophobicContact CG2-CB 4.08Å; K800-D812 IonicContact NZ-OD1 2.71Å; K800-D812 IonicContact NZ-OD2 2.66Å; K800-D812 PolarHBondContact NZ-OD2 3.43Å; V810-D812 PolarHBondContact O-N 3.37Å; D812-N814 PolarHBondContact O-N 3.27Å; D812-N814 WeakPolarHBondContact OD1-CB 3.38Å; D812-N814 PolarHBondContact OD1-N 3.05Å; D812-N814 PolarHBondContact OD1-ND2 3.06Å; D812-T815 WeakPolarHBondContact CB-OG1 3.34Å; D812-T815 PolarHBondContact O-N 3.15Å; D812-C816 WeakPolarHBondContact O-CB 3.4Å; D812-C816 PolarHBondContact O-N 2.91Å
813	R	92.7	Very high	89.3	Confident	102 Å²	102	36.2 Å²	36.2	39%	0.385	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-23	-179.2	64	174.9	76.4	-127.3	1.7	113.8	E790 F793 D797	E790-R813 IonicContact OE1-CZ 3.51Å; E790-R813 IonicContact OE1-NH1 3.66Å; E790-R813 PolarHBondContact OE1-NH1 3.3Å; E790-R813 IonicContact OE1-NH2 3.05Å; E790-R813 PolarHBondContact OE1-NH2 3.47Å; E790-R813 IonicContact OE2-CZ 3.71Å; E790-R813 IonicContact OE2-NH1 2.9Å; E790-R813 PolarHBondContact OE2-NH1 2.87Å; E790-R813 VanDerWaalsContact OE2-NH1 3.1Å; F793-R813 HydrophobicContact CB-CB 3.97Å; F793-R813 HydrophobicContact CD1-CB 4.19Å; F793-R813 HydrophobicContact CD2-CB 3.65Å; F793-R813 HydrophobicContact CE2-CB 4.17Å; F793-R813 HydrophobicContact CG-CB 3.67Å; D797-R813 IonicContact OD1-NE 2.87Å; D797-R813 IonicContact OD2-CZ 3.1Å; D797-R813 IonicContact OD2-NE 3.87Å; D797-R813 PolarHBondContact OD2-NE 2.75Å; D797-R813 IonicContact OD2-NH2 2.97Å; D797-R813 PolarHBondContact OD2-NH2 2.96Å
814	N	89.8	Confident	89.2	Confident	122 Å²	122	33.4 Å²	33.4	65%	0.652	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-23.2	-179.7	-56.3	-64.5	0	0	0	113.3	D812	D812-N814 PolarHBondContact O-N 3.27Å; D812-N814 WeakPolarHBondContact OD1-CB 3.38Å; D812-N814 PolarHBondContact OD1-N 3.05Å; D812-N814 PolarHBondContact OD1-ND2 3.06Å
815	T	89.4	Confident	89.4	Confident	76 Å²	76	33.2 Å²	33.2	47%	0.466	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-28.9	-171.2	55.2	0	0	0	0	113.8	D812	D812-T815 WeakPolarHBondContact CB-OG1 3.34Å; D812-T815 PolarHBondContact O-N 3.15Å
816	C	90.6	Very high	89.7	Confident	9 Å²	9	30.9 Å²	30.9	6%	0.061	17%	0.165	C	C	.	.			trans	-57.4	137.9	-174.2	-171.4	0	0	0	0	112.2	F793 V810 D812 S821	F793-C816 HydrophobicContact CE1-CB 3.56Å; F793-C816 HydrophobicContact CZ-CB 3.83Å; V810-C816 WeakPolarHBondContact O-CA 3.46Å; V810-C816 WeakPolarHBondContact O-CB 3.45Å; D812-C816 WeakPolarHBondContact O-CB 3.4Å; D812-C816 PolarHBondContact O-N 2.91Å; C816-S821 PolarHBondContact SG-OG 3.27Å
817	S	92.6	Very high	89.5	Confident	14 Å²	14	32.3 Å²	32.3	10%	0.098	17%	0.171	C	C	.	.			trans	-102.2	109.5	162.3	176.3	0	0	0	0	107.4	K820 S821	S817-K820 PolarHBondContact O-N 3.39Å; S817-K820 WeakPolarHBondContact OG-CB 3.42Å; S817-K820 PolarHBondContact OG-N 2.87Å; S817-S821 WeakPolarHBondContact O-CB 3.27Å; S817-S821 PolarHBondContact O-N 3.38Å; S817-S821 PolarHBondContact O-OG 3.23Å
818	V	92.5	Very high	89.6	Confident	10 Å²	10	34.6 Å²	34.6	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-64.7	-45.5	179.7	-177.5	0	0	0	0	111.4	A785 S789 F793 K820 S821 Q822 K866 L868	A785-V818 HydrophobicContact CB-CG1 4.48Å; S789-V818 WeakPolarHBondContact OG-CG1 3.44Å; F793-V818 HydrophobicContact CZ-CG2 4.21Å; V818-K820 VanDerWaalsContact C-N 3.31Å; V818-K820 PolarHBondContact O-N 3.19Å; V818-S821 PolarHBondContact O-N 3.06Å; V818-S821 VanDerWaalsContact O-N 3.16Å; V818-Q822 HydrophobicContact CG1-CG 4.21Å; V818-Q822 WeakPolarHBondContact O-CG 3.46Å; V818-Q822 PolarHBondContact O-N 3.5Å; V818-K866 PolarHBondContact N-O 2.92Å; V818-L868 HydrophobicContact CB-CD2 4.26Å; V818-L868 HydrophobicContact CG1-CD2 3.52Å; V818-L868 HydrophobicContact CG1-CG 4.4Å
819	P	93.5	Very high	89.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-55.8	-44.9	176.7	-28.2	37.6	0	0	0	113.1	Q822 I823 W857 L860	P819-Q822 PolarHBondContact O-N 3.48Å; P819-I823 WeakPolarHBondContact O-CD1 3.38Å; P819-I823 WeakPolarHBondContact O-CG1 3.49Å; P819-I823 PolarHBondContact O-N 3.12Å; P819-W857 HydrophobicContact CB-CB 4.5Å; P819-W857 HydrophobicContact CB-CE3 3.78Å; P819-W857 HydrophobicContact CB-CZ3 4.49Å; P819-W857 HydrophobicContact CG-CE3 3.93Å; P819-W857 HydrophobicContact CG-CZ3 4.17Å; P819-L860 HydrophobicContact CB-CB 3.89Å; P819-L860 HydrophobicContact CG-CB 3.79Å; P819-L860 HydrophobicContact CG-CD1 4.01Å
820	K	91.2	Very high	90.4	Very high	63 Å²	63	31.3 Å²	31.3	27%	0.274	16%	0.156	S	C	.	.	H	α-helix	trans	-64.8	-42.5	178.4	-165.9	170.7	176.2	-150.1	0	112.1	D481 S817 V818 Q822 I823 S824	D481-K820 WeakPolarHBondContact OD1-CE 3.12Å; D481-K820 IonicContact OD1-NZ 3.65Å; D481-K820 PolarHBondContact OD1-NZ 3.36Å; S817-K820 PolarHBondContact O-N 3.39Å; S817-K820 WeakPolarHBondContact OG-CB 3.42Å; S817-K820 PolarHBondContact OG-N 2.87Å; V818-K820 VanDerWaalsContact C-N 3.31Å; V818-K820 PolarHBondContact O-N 3.19Å; K820-Q822 VanDerWaalsContact C-N 3.32Å; K820-Q822 PolarHBondContact O-N 3.24Å; K820-I823 WeakPolarHBondContact O-CB 3.37Å; K820-I823 PolarHBondContact O-N 3.29Å; K820-S824 PolarHBondContact O-N 3.45Å; K820-S824 PolarHBondContact O-OG 3.31Å; K820-S824 VanDerWaalsContact O-OG 3.1Å
821	S	92	Very high	90.7	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-39.2	176.4	-52.8	0	0	0	0	112.2	H483 C816 S817 V818 S824 F825	H483-S821 PolarHBondContact ND1-OG 3Å; C816-S821 PolarHBondContact SG-OG 3.27Å; S817-S821 WeakPolarHBondContact O-CB 3.27Å; S817-S821 PolarHBondContact O-N 3.38Å; S817-S821 PolarHBondContact O-OG 3.23Å; V818-S821 PolarHBondContact O-N 3.06Å; V818-S821 VanDerWaalsContact O-N 3.16Å; S821-S824 PolarHBondContact O-N 3.35Å; S821-F825 WeakPolarHBondContact O-CB 3.39Å; S821-F825 PolarHBondContact O-N 3.18Å
822	Q	93.8	Very high	90.5	Very high	19 Å²	19	35.4 Å²	35.4	9%	0.089	18%	0.179	C	C	.	.	H	α-helix	trans	-66.9	-42	176.5	-69.7	-60.8	-53.3	0	0	112	A785 V818 P819 K820 F825 I826 W857	A785-Q822 HydrophobicContact CB-CG 3.89Å; V818-Q822 HydrophobicContact CG1-CG 4.21Å; V818-Q822 WeakPolarHBondContact O-CG 3.46Å; V818-Q822 PolarHBondContact O-N 3.5Å; P819-Q822 PolarHBondContact O-N 3.48Å; K820-Q822 VanDerWaalsContact C-N 3.32Å; K820-Q822 PolarHBondContact O-N 3.24Å; Q822-F825 PolarHBondContact O-N 2.84Å; Q822-I826 WeakPolarHBondContact O-CB 3.45Å; Q822-I826 WeakPolarHBondContact O-CD1 3.46Å; Q822-I826 VanDerWaalsContact O-CG1 3.23Å; Q822-I826 WeakPolarHBondContact O-CG1 3.21Å; Q822-I826 PolarHBondContact O-N 3.25Å; Q822-W857 HydrophobicContact CB-CD2 4Å; Q822-W857 HydrophobicContact CB-CG 3.92Å; Q822-W857 HydrophobicContact CG-CD2 4.26Å; Q822-W857 HydrophobicContact CG-CZ2 4.11Å
823	I	92.4	Very high	90.8	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-56.9	-51.7	172.6	-69.5	159.7	0	0	0	110.2	P819 K820 F825 I826 D827 Y854 W857 K858 D861	P819-I823 WeakPolarHBondContact O-CD1 3.38Å; P819-I823 WeakPolarHBondContact O-CG1 3.49Å; P819-I823 PolarHBondContact O-N 3.12Å; K820-I823 WeakPolarHBondContact O-CB 3.37Å; K820-I823 PolarHBondContact O-N 3.29Å; I823-F825 VanDerWaalsContact C-N 3.31Å; I823-F825 PolarHBondContact O-N 3.02Å; I823-I826 PolarHBondContact O-N 3.21Å; I823-I826 VanDerWaalsContact O-N 3.15Å; I823-D827 WeakPolarHBondContact CG2-OD2 3.23Å; I823-D827 WeakPolarHBondContact O-CB 3.49Å; I823-D827 PolarHBondContact O-N 2.93Å; I823-Y854 HydrophobicContact CB-CE2 4.44Å; I823-Y854 HydrophobicContact CG2-CE2 3.89Å; I823-W857 HydrophobicContact CD1-CB 4.16Å; I823-W857 HydrophobicContact CG1-CB 3.75Å; I823-K858 HydrophobicContact CD1-CD 3.73Å; I823-K858 HydrophobicContact CD1-CG 4Å; I823-K858 HydrophobicContact CG1-CD 4.31Å; I823-K858 HydrophobicContact CG1-CG 4.26Å; I823-K858 HydrophobicContact CG2-CD 4.49Å; I823-K858 VanDerWaalsContact CG2-CE 3.46Å; I823-D861 HydrophobicContact CD1-CB 3.91Å
824	S	88.6	Confident	91	Very high	9 Å²	9	29.8 Å²	29.8	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-61.3	-40.2	-178.7	-60	0	0	0	0	112	D481 T484 K820 S821 Y828	D481-S824 PolarHBondContact OD2-OG 3.46Å; T484-S824 WeakPolarHBondContact OG1-CB 3.38Å; K820-S824 PolarHBondContact O-N 3.45Å; K820-S824 PolarHBondContact O-OG 3.31Å; K820-S824 VanDerWaalsContact O-OG 3.1Å; S821-S824 PolarHBondContact O-N 3.35Å; S824-Y828 WeakPolarHBondContact O-CB 3.37Å; S824-Y828 PolarHBondContact O-N 3.48Å
825	F	90.1	Very high	91.2	Very high	27 Å²	27	26.5 Å²	26.5	12%	0.118	14%	0.139	C	C	.	.	H	α-helix	trans	-63.1	-44.6	174.1	-177.6	-112.6	0	0	0	112.2	L487 V771 P774 S821 Q822 I823 Y828 F829 I830	L487-F825 HydrophobicContact CD1-CB 3.75Å; L487-F825 HydrophobicContact CD1-CD2 4.25Å; L487-F825 HydrophobicContact CD1-CG 4.5Å; L487-F825 HydrophobicContact CD2-CD2 4.41Å; V771-F825 HydrophobicContact CB-CZ 4.21Å; V771-F825 HydrophobicContact CG1-CZ 4.24Å; P774-F825 HydrophobicContact CG-CD1 4.37Å; P774-F825 HydrophobicContact CG-CE1 4.24Å; S821-F825 WeakPolarHBondContact O-CB 3.39Å; S821-F825 PolarHBondContact O-N 3.18Å; Q822-F825 PolarHBondContact O-N 2.84Å; I823-F825 VanDerWaalsContact C-N 3.31Å; I823-F825 PolarHBondContact O-N 3.02Å; F825-Y828 PolarHBondContact O-N 2.77Å; F825-F829 AromaticContact CD2-CD2 3.51Å; F825-F829 HydrophobicContact CD2-CD2 3.51Å; F825-F829 HydrophobicContact CD2-CE2 4.14Å; F825-F829 HydrophobicContact CD2-CG 4.39Å; F825-F829 HydrophobicContact CE2-CB 4.27Å; F825-F829 AromaticContact CE2-CD2 3.71Å; F825-F829 HydrophobicContact CE2-CD2 3.71Å; F825-F829 HydrophobicContact CE2-CE2 4.39Å; F825-F829 HydrophobicContact CE2-CG 4.24Å; F825-F829 PolarHBondContact O-N 2.8Å; F825-I830 HydrophobicContact CD1-CD1 4.1Å; F825-I830 HydrophobicContact CD1-CG1 3.76Å; F825-I830 HydrophobicContact CE1-CD1 3.37Å; F825-I830 HydrophobicContact CE1-CG1 3.58Å; F825-I830 HydrophobicContact CG-CG1 4.49Å; F825-I830 HydrophobicContact CZ-CD1 3.65Å; F825-I830 HydrophobicContact CZ-CG1 4.17Å
826	I	92.8	Very high	91.4	Very high	2 Å²	2	23 Å²	23	1%	0.01	12%	0.118	C	C	.	.	I	π-helix	trans	-64.6	-45.8	179.6	-69.1	164	0	0	0	111.2	P774 Q822 I823 I830 T831 L850 Y854	P774-I826 HydrophobicContact CB-CD1 4.06Å; P774-I826 HydrophobicContact CB-CG1 3.89Å; P774-I826 HydrophobicContact CG-CG1 4.19Å; Q822-I826 WeakPolarHBondContact O-CB 3.45Å; Q822-I826 WeakPolarHBondContact O-CD1 3.46Å; Q822-I826 VanDerWaalsContact O-CG1 3.23Å; Q822-I826 WeakPolarHBondContact O-CG1 3.21Å; Q822-I826 PolarHBondContact O-N 3.25Å; I823-I826 PolarHBondContact O-N 3.21Å; I823-I826 VanDerWaalsContact O-N 3.15Å; I826-I830 HydrophobicContact CB-CB 4.5Å; I826-I830 HydrophobicContact CG2-CB 4.44Å; I826-I830 PolarHBondContact O-N 3.3Å; I826-T831 PolarHBondContact O-N 3.44Å; I826-T831 PolarHBondContact O-OG1 3.24Å; I826-L850 HydrophobicContact CD1-CD1 4.47Å; I826-L850 HydrophobicContact CG1-CD1 4.35Å; I826-L850 HydrophobicContact CG2-CD1 3.87Å; I826-Y854 HydrophobicContact CB-CD2 4.05Å; I826-Y854 HydrophobicContact CB-CE2 4.42Å; I826-Y854 HydrophobicContact CD1-CD2 4.18Å; I826-Y854 HydrophobicContact CG2-CD2 3.63Å; I826-Y854 HydrophobicContact CG2-CE2 4.16Å
827	D	86.3	Confident	91.7	Very high	79 Å²	79	22.6 Å²	22.6	42%	0.422	12%	0.116	S	C	.	.	I	π-helix	trans	-66.1	-38.3	-179.4	-75.1	-25	0	0	0	111.5	I823 Y854	I823-D827 WeakPolarHBondContact CG2-OD2 3.23Å; I823-D827 WeakPolarHBondContact O-CB 3.49Å; I823-D827 PolarHBondContact O-N 2.93Å; D827-Y854 WeakPolarHBondContact OD1-CE2 3.39Å; D827-Y854 PolarHBondContact OD1-OH 3Å; D827-Y854 PolarHBondContact OD2-OH 3.4Å
828	Y	80.9	Confident	91.9	Very high	71 Å²	71	24 Å²	24	28%	0.278	12%	0.122	S	C	.	.	I	π-helix	trans	-87	-36.1	-172.2	-164.3	-94.2	0	0	0	114.6	T484 V488 M492 F716 S824 F825	T484-Y828 HydrophobicContact CG2-CD1 4.46Å; T484-Y828 HydrophobicContact CG2-CD2 3.35Å; T484-Y828 HydrophobicContact CG2-CE2 3.77Å; T484-Y828 HydrophobicContact CG2-CG 3.74Å; V488-Y828 HydrophobicContact CG2-CD1 4.15Å; V488-Y828 HydrophobicContact CG2-CE1 3.43Å; V488-Y828 VanDerWaalsContact CG2-CE1 3.43Å; V488-Y828 HydrophobicContact CG2-CE2 4.42Å; M492-Y828 HydrophobicContact SD-CE1 4.21Å; F716-Y828 AromaticContact CE2-CE1 3.74Å; F716-Y828 HydrophobicContact CE2-CE1 3.74Å; F716-Y828 AromaticContact CZ-CD1 3.98Å; F716-Y828 HydrophobicContact CZ-CD1 3.98Å; F716-Y828 AromaticContact CZ-CE1 3.49Å; F716-Y828 HydrophobicContact CZ-CE1 3.49Å; F716-Y828 VanDerWaalsContact CZ-CE1 3.49Å; F716-Y828 AromaticContact CZ-CZ 3.98Å; S824-Y828 WeakPolarHBondContact O-CB 3.37Å; S824-Y828 PolarHBondContact O-N 3.48Å; F825-Y828 PolarHBondContact O-N 2.77Å
829	F	86.7	Confident	91.9	Very high	1 Å²	1	25.2 Å²	25.2	0%	0.004	13%	0.133	C	C	.	.	I	π-helix	trans	-117.2	-41.5	-174.9	-63.5	-75.3	0	0	0	113.6	L487 V488 M492 M712 H715 F716 F825 M833	L487-F829 HydrophobicContact CB-CE2 4.24Å; V488-F829 HydrophobicContact CG2-CZ 4.38Å; M492-F829 HydrophobicContact CE-CE1 4.24Å; M492-F829 HydrophobicContact CG-CE1 4.48Å; M492-F829 HydrophobicContact CG-CZ 4.32Å; M492-F829 HydrophobicContact SD-CE1 3.67Å; M492-F829 HydrophobicContact SD-CZ 3.75Å; M712-F829 HydrophobicContact CE-CD1 3.8Å; M712-F829 HydrophobicContact CE-CE1 3.99Å; M712-F829 HydrophobicContact CE-CG 4.15Å; M712-F829 HydrophobicContact CE-CZ 4.49Å; H715-F829 AromaticContact CD2-CD1 3.79Å; H715-F829 AromaticContact NE2-CD1 3.99Å; H715-F829 PolarHBondContact NE2-O 2.86Å; F716-F829 HydrophobicContact CE2-CE1 4.34Å; F716-F829 HydrophobicContact CZ-CD1 4.31Å; F716-F829 HydrophobicContact CZ-CE1 4.27Å; F825-F829 AromaticContact CD2-CD2 3.51Å; F825-F829 HydrophobicContact CD2-CD2 3.51Å; F825-F829 HydrophobicContact CD2-CE2 4.14Å; F825-F829 HydrophobicContact CD2-CG 4.39Å; F825-F829 HydrophobicContact CE2-CB 4.27Å; F825-F829 AromaticContact CE2-CD2 3.71Å; F825-F829 HydrophobicContact CE2-CD2 3.71Å; F825-F829 HydrophobicContact CE2-CE2 4.39Å; F825-F829 HydrophobicContact CE2-CG 4.24Å; F825-F829 PolarHBondContact O-N 2.8Å; F829-M833 VanDerWaalsContact O-CB 3.27Å; F829-M833 WeakPolarHBondContact O-CB 3.4Å
830	I	95	Very high	92	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	I	π-helix	trans	-84.9	-42.7	-162	-53	-65.6	0	0	0	111.4	V771 P774 F825 I826 M833 F834 L850	V771-I830 HydrophobicContact CB-CD1 3.95Å; V771-I830 HydrophobicContact CG2-CD1 3.6Å; P774-I830 HydrophobicContact CB-CG2 4.25Å; P774-I830 HydrophobicContact CG-CD1 4.41Å; P774-I830 HydrophobicContact CG-CG1 4.18Å; P774-I830 HydrophobicContact CG-CG2 4.35Å; F825-I830 HydrophobicContact CD1-CD1 4.1Å; F825-I830 HydrophobicContact CD1-CG1 3.76Å; F825-I830 HydrophobicContact CE1-CD1 3.37Å; F825-I830 HydrophobicContact CE1-CG1 3.58Å; F825-I830 HydrophobicContact CG-CG1 4.49Å; F825-I830 HydrophobicContact CZ-CD1 3.65Å; F825-I830 HydrophobicContact CZ-CG1 4.17Å; I826-I830 HydrophobicContact CB-CB 4.5Å; I826-I830 HydrophobicContact CG2-CB 4.44Å; I826-I830 PolarHBondContact O-N 3.3Å; I830-M833 HydrophobicContact CD1-CE 4.46Å; I830-M833 PolarHBondContact O-N 3.26Å; I830-F834 HydrophobicContact CB-CD2 4.47Å; I830-F834 HydrophobicContact CG2-CD2 3.44Å; I830-F834 VanDerWaalsContact CG2-CD2 3.44Å; I830-F834 HydrophobicContact CG2-CE2 3.85Å; I830-F834 HydrophobicContact CG2-CG 4.36Å; I830-F834 WeakPolarHBondContact O-CB 3.09Å; I830-F834 WeakPolarHBondContact O-CD2 3.02Å; I830-F834 PolarHBondContact O-N 3.44Å; I830-L850 HydrophobicContact CG2-CD1 3.81Å; I830-L850 HydrophobicContact CG2-CD2 4.23Å
831	T	91.4	Very high	92.1	Very high	43 Å²	43	22.4 Å²	22.4	26%	0.264	12%	0.122	S	C	.	.	H	α-helix	trans	-58.2	-56.9	-172.5	-60	0	0	0	0	111.8	I826 M833 F834 D835	I826-T831 PolarHBondContact O-N 3.44Å; I826-T831 PolarHBondContact O-OG1 3.24Å; T831-M833 VanDerWaalsContact C-N 3.34Å; T831-M833 PolarHBondContact O-N 3.45Å; T831-F834 PolarHBondContact O-N 3.05Å; T831-D835 VanDerWaalsContact O-CB 3.28Å; T831-D835 WeakPolarHBondContact O-CB 3.36Å; T831-D835 PolarHBondContact O-N 2.87Å
832	D	88.3	Confident	92.2	Very high	74 Å²	74	25.9 Å²	25.9	40%	0.396	15%	0.146	S	C	.	.	H	α-helix	trans	-66	-36.7	-178.7	-74.2	-19.4	0	0	0	112.5	A836	D832-A836 VanDerWaalsContact O-CB 3.32Å; D832-A836 WeakPolarHBondContact O-CB 3.47Å; D832-A836 PolarHBondContact O-N 3.17Å
833	M	95.8	Very high	92.3	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.3	-48.1	179.4	-172.6	-177.3	68.6	0	0	111.3	H715 V719 M764 K767 V771 F829 I830 T831 A836 W837	H715-M833 VanDerWaalsContact CE1-SD 3.54Å; V719-M833 HydrophobicContact CG2-CB 4.21Å; V719-M833 HydrophobicContact CG2-CG 3.92Å; M764-M833 HydrophobicContact CE-CB 4.34Å; M764-M833 HydrophobicContact CE-CG 3.44Å; M764-M833 VanDerWaalsContact CE-CG 3.44Å; M764-M833 WeakPolarHBondContact CE-O 3.25Å; M764-M833 HydrophobicContact SD-CG 4.27Å; K767-M833 HydrophobicContact CB-SD 4.33Å; V771-M833 HydrophobicContact CG2-CE 3.26Å; V771-M833 HydrophobicContact CG2-SD 4.31Å; F829-M833 VanDerWaalsContact O-CB 3.27Å; F829-M833 WeakPolarHBondContact O-CB 3.4Å; I830-M833 HydrophobicContact CD1-CE 4.46Å; I830-M833 PolarHBondContact O-N 3.26Å; T831-M833 VanDerWaalsContact C-N 3.34Å; T831-M833 PolarHBondContact O-N 3.45Å; M833-A836 PolarHBondContact O-N 3.12Å; M833-W837 WeakPolarHBondContact O-CB 3.36Å; M833-W837 PolarHBondContact O-N 3.34Å
834	F	97.4	Very high	92.3	Very high	1 Å²	1	28.3 Å²	28.3	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-75.1	-31.8	179.8	-85.9	-88.2	0	0	0	113	F613 C768 A772 C775 I830 T831 A836 W837 D838 L846 M847 L850	F613-F834 HydrophobicContact CZ-CE1 4.45Å; C768-F834 HydrophobicContact CB-CE1 4.44Å; C768-F834 HydrophobicContact CB-CZ 4.27Å; C768-F834 VanDerWaalsContact O-CZ 3.29Å; C768-F834 WeakPolarHBondContact O-CZ 3.25Å; A772-F834 HydrophobicContact CB-CZ 4.21Å; C775-F834 HydrophobicContact CB-CE1 4.32Å; I830-F834 HydrophobicContact CB-CD2 4.47Å; I830-F834 HydrophobicContact CG2-CD2 3.44Å; I830-F834 VanDerWaalsContact CG2-CD2 3.44Å; I830-F834 HydrophobicContact CG2-CE2 3.85Å; I830-F834 HydrophobicContact CG2-CG 4.36Å; I830-F834 WeakPolarHBondContact O-CB 3.09Å; I830-F834 WeakPolarHBondContact O-CD2 3.02Å; I830-F834 PolarHBondContact O-N 3.44Å; T831-F834 PolarHBondContact O-N 3.05Å; F834-A836 VanDerWaalsContact C-N 3.33Å; F834-A836 PolarHBondContact O-N 2.91Å; F834-W837 PolarHBondContact O-N 3.36Å; F834-D838 WeakPolarHBondContact O-CB 3.4Å; F834-D838 PolarHBondContact O-N 3.41Å; F834-L846 HydrophobicContact CE1-CD2 4.15Å; F834-M847 HydrophobicContact CB-CE 4.4Å; F834-M847 HydrophobicContact CB-SD 3.9Å; F834-L850 HydrophobicContact CB-CD2 4.33Å
835	D	93.8	Very high	92.5	Very high	52 Å²	52	31.2 Å²	31.2	28%	0.278	18%	0.178	S	C	.	.	H	α-helix	trans	-60.5	-44.7	169.7	-85.1	-13.8	0	0	0	110.7	T831 A839 M847	T831-D835 VanDerWaalsContact O-CB 3.28Å; T831-D835 WeakPolarHBondContact O-CB 3.36Å; T831-D835 PolarHBondContact O-N 2.87Å; D835-A839 WeakPolarHBondContact O-CB 3.35Å; D835-A839 PolarHBondContact O-N 3.46Å; D835-M847 WeakPolarHBondContact OD1-CE 3.28Å
836	A	93.4	Very high	92.9	Very high	4 Å²	4	30 Å²	30	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-65	-40	176.4	0	0	0	0	0	112.2	F722 V723 N727 M764 D832 M833 F834 F840	F722-A836 HydrophobicContact CD1-CB 4.45Å; V723-A836 HydrophobicContact CG2-CB 3.69Å; N727-A836 WeakPolarHBondContact ND2-CA 3.46Å; N727-A836 PolarHBondContact ND2-O 2.94Å; M764-A836 HydrophobicContact CE-CB 4.11Å; D832-A836 VanDerWaalsContact O-CB 3.32Å; D832-A836 WeakPolarHBondContact O-CB 3.47Å; D832-A836 PolarHBondContact O-N 3.17Å; M833-A836 PolarHBondContact O-N 3.12Å; F834-A836 VanDerWaalsContact C-N 3.33Å; F834-A836 PolarHBondContact O-N 2.91Å; A836-F840 PolarHBondContact O-N 3.37Å
837	W	97.7	Very high	93.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-73.5	-37.8	179.3	-169.3	-127.7	0	0	0	112.9	F613 V619 F722 I761 M764 L765 C768 M833 F834 F840 A841 L843	F613-W837 HydrophobicContact CB-CZ2 4.18Å; F613-W837 AromaticContact CD1-NE1 3.57Å; F613-W837 HydrophobicContact CD2-CZ2 4.45Å; F613-W837 AromaticContact CD2-NE1 3.74Å; F613-W837 AromaticContact CE1-NE1 3.6Å; F613-W837 AromaticContact CE2-NE1 3.75Å; F613-W837 HydrophobicContact CG-CZ2 4.24Å; F613-W837 AromaticContact CG-NE1 3.66Å; F613-W837 AromaticContact CZ-NE1 3.7Å; V619-W837 HydrophobicContact CG2-CH2 4.02Å; V619-W837 HydrophobicContact CG2-CZ2 4.01Å; F722-W837 HydrophobicContact CE1-CE3 4.25Å; F722-W837 HydrophobicContact CE2-CE3 4.21Å; F722-W837 AromaticContact CE2-CZ3 3.92Å; F722-W837 HydrophobicContact CE2-CZ3 3.92Å; F722-W837 AromaticContact CZ-CE3 3.7Å; F722-W837 HydrophobicContact CZ-CE3 3.7Å; F722-W837 AromaticContact CZ-CZ3 3.79Å; F722-W837 HydrophobicContact CZ-CZ3 3.79Å; I761-W837 HydrophobicContact CG2-CH2 4.21Å; I761-W837 HydrophobicContact CG2-CZ3 4.42Å; M764-W837 HydrophobicContact CB-CE3 4.11Å; M764-W837 HydrophobicContact CB-CZ3 4.03Å; M764-W837 HydrophobicContact CE-CB 4.1Å; M764-W837 HydrophobicContact CG-CD2 4.25Å; M764-W837 HydrophobicContact CG-CE3 3.51Å; M764-W837 HydrophobicContact CG-CZ3 3.95Å; L765-W837 HydrophobicContact CB-CH2 3.81Å; L765-W837 HydrophobicContact CB-CZ2 3.92Å; L765-W837 HydrophobicContact CD1-CH2 4.37Å; L765-W837 HydrophobicContact CD1-CZ2 4.28Å; L765-W837 HydrophobicContact CG-CH2 4.29Å; L765-W837 HydrophobicContact CG-CZ2 4.01Å; C768-W837 HydrophobicContact CB-CG 4.19Å; C768-W837 VanDerWaalsContact SG-CB 3.58Å; C768-W837 VanDerWaalsContact SG-CG 3.51Å; M833-W837 WeakPolarHBondContact O-CB 3.36Å; M833-W837 PolarHBondContact O-N 3.34Å; F834-W837 PolarHBondContact O-N 3.36Å; W837-F840 AromaticContact CE3-CD1 3.87Å; W837-F840 HydrophobicContact CE3-CD1 3.87Å; W837-F840 AromaticContact CH2-CD1 3.94Å; W837-F840 HydrophobicContact CH2-CD1 3.94Å; W837-F840 HydrophobicContact CH2-CE1 4.01Å; W837-F840 AromaticContact CZ3-CD1 3.45Å; W837-F840 HydrophobicContact CZ3-CD1 3.45Å; W837-F840 VanDerWaalsContact CZ3-CD1 3.45Å; W837-F840 AromaticContact CZ3-CE1 3.83Å; W837-F840 HydrophobicContact CZ3-CE1 3.83Å; W837-F840 HydrophobicContact CZ3-CG 4.48Å; W837-F840 CarbonylContact O-C 3.58Å; W837-F840 PolarHBondContact O-N 3Å; W837-A841 HydrophobicContact CD2-CB 4.33Å; W837-A841 HydrophobicContact CZ2-CB 4.25Å; W837-A841 WeakPolarHBondContact O-CB 3.46Å; W837-A841 PolarHBondContact O-N 3.06Å; W837-L843 HydrophobicContact CG-CD1 4Å
838	D	96.9	Very high	93.6	Very high	43 Å²	43	33.2 Å²	33.2	23%	0.23	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-45.5	173.3	176.2	59.1	0	0	0	111.2	F834 F840 A841 S842 L843 M847	F834-D838 WeakPolarHBondContact O-CB 3.4Å; F834-D838 PolarHBondContact O-N 3.41Å; D838-F840 PolarHBondContact O-N 3.32Å; D838-F840 VanDerWaalsContact O-N 3.16Å; D838-A841 PolarHBondContact O-N 2.9Å; D838-S842 VanDerWaalsContact O-CA 3.28Å; D838-S842 WeakPolarHBondContact O-CA 3.5Å; D838-S842 PolarHBondContact O-N 2.77Å; D838-L843 HydrophobicContact CB-CB 4.4Å; D838-L843 VanDerWaalsContact OD1-CA 3.28Å; D838-L843 WeakPolarHBondContact OD1-CA 3.34Å; D838-L843 PolarHBondContact OD1-N 3.14Å; D838-M847 HydrophobicContact CB-CG 3.86Å; D838-M847 HydrophobicContact CB-SD 4.01Å
839	A	92.7	Very high	94.4	Very high	36 Å²	36	31.3 Å²	31.3	30%	0.298	18%	0.18	S	C	.	.	H	α-helix	trans	-56.5	-34	175.8	0	0	0	0	0	112.3	I427 R618 D835	I427-A839 HydrophobicContact CD1-CB 4.46Å; R618-A839 PolarHBondContact NH1-O 3.48Å; D835-A839 WeakPolarHBondContact O-CB 3.35Å; D835-A839 PolarHBondContact O-N 3.46Å
840	F	94.2	Very high	94.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-82.2	-57.9	174.8	177.7	-108.9	0	0	0	112.8	R618 V619 F722 I726 M730 R752 I761 A836 W837 D838	R618-F840 WeakPolarHBondContact CD-O 3.46Å; R618-F840 PolarHBondContact NH1-O 3.02Å; V619-F840 HydrophobicContact CG2-CE1 4.06Å; F722-F840 HydrophobicContact CE1-CB 4.09Å; F722-F840 HydrophobicContact CE2-CD1 4.5Å; F722-F840 HydrophobicContact CZ-CB 3.68Å; F722-F840 AromaticContact CZ-CD1 3.91Å; F722-F840 HydrophobicContact CZ-CD1 3.91Å; F722-F840 HydrophobicContact CZ-CD2 4.31Å; F722-F840 AromaticContact CZ-CG 3.71Å; F722-F840 HydrophobicContact CZ-CG 3.71Å; I726-F840 HydrophobicContact CG2-CD2 3.74Å; I726-F840 HydrophobicContact CG2-CE2 3.89Å; M730-F840 HydrophobicContact CE-CD2 4.21Å; M730-F840 HydrophobicContact CE-CE2 4.4Å; M730-F840 HydrophobicContact SD-CD2 3.89Å; M730-F840 HydrophobicContact SD-CE2 4Å; R752-F840 HydrophobicContact CG-CE2 4.45Å; I761-F840 HydrophobicContact CD1-CE2 4.41Å; I761-F840 HydrophobicContact CD1-CZ 3.85Å; I761-F840 HydrophobicContact CG1-CE1 4.35Å; I761-F840 HydrophobicContact CG1-CZ 4.04Å; I761-F840 HydrophobicContact CG2-CE1 3.99Å; I761-F840 HydrophobicContact CG2-CZ 4.27Å; A836-F840 PolarHBondContact O-N 3.37Å; W837-F840 AromaticContact CE3-CD1 3.87Å; W837-F840 HydrophobicContact CE3-CD1 3.87Å; W837-F840 AromaticContact CH2-CD1 3.94Å; W837-F840 HydrophobicContact CH2-CD1 3.94Å; W837-F840 HydrophobicContact CH2-CE1 4.01Å; W837-F840 AromaticContact CZ3-CD1 3.45Å; W837-F840 HydrophobicContact CZ3-CD1 3.45Å; W837-F840 VanDerWaalsContact CZ3-CD1 3.45Å; W837-F840 AromaticContact CZ3-CE1 3.83Å; W837-F840 HydrophobicContact CZ3-CE1 3.83Å; W837-F840 HydrophobicContact CZ3-CG 4.48Å; W837-F840 CarbonylContact O-C 3.58Å; W837-F840 PolarHBondContact O-N 3Å; D838-F840 PolarHBondContact O-N 3.32Å; D838-F840 VanDerWaalsContact O-N 3.16Å
841	A	93.9	Very high	95	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.033	20%	0.199	C	C	.	.	H	α-helix	trans	-94.7	-8.5	-166.2	0	0	0	0	0	115	V619 W837 D838 L843	V619-A841 HydrophobicContact CG2-CB 4.04Å; W837-A841 HydrophobicContact CD2-CB 4.33Å; W837-A841 HydrophobicContact CZ2-CB 4.25Å; W837-A841 WeakPolarHBondContact O-CB 3.46Å; W837-A841 PolarHBondContact O-N 3.06Å; D838-A841 PolarHBondContact O-N 2.9Å; A841-L843 HydrophobicContact CB-CD1 4.05Å; A841-L843 HydrophobicContact CB-CD2 4.39Å; A841-L843 HydrophobicContact CB-CG 4.05Å
842	S	93.9	Very high	95.3	Very high	73 Å²	73	36.7 Å²	36.7	51%	0.51	21%	0.208	S	C	.	.			trans	56.3	89.8	-175.8	-167.9	0	0	0	0	113	D838	D838-S842 VanDerWaalsContact O-CA 3.28Å; D838-S842 WeakPolarHBondContact O-CA 3.5Å; D838-S842 PolarHBondContact O-N 2.77Å
843	L	95.2	Very high	95.8	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	19%	0.189	C	C	.	.			trans	-128.6	50.2	-169.9	-59.1	172.7	0	0	0	112.2	Y612 F613 K616 W837 D838 A841 N845 L846 M847	Y612-L843 HydrophobicContact CE1-CD2 4.04Å; F613-L843 HydrophobicContact CD1-CD1 4.22Å; F613-L843 HydrophobicContact CD1-CD2 4.09Å; F613-L843 HydrophobicContact CE1-CD1 3.78Å; F613-L843 HydrophobicContact CE1-CD2 4.07Å; K616-L843 HydrophobicContact CD-CD2 3.91Å; K616-L843 VanDerWaalsContact CE-CD2 3.48Å; K616-L843 HydrophobicContact CG-CD2 4.02Å; W837-L843 HydrophobicContact CG-CD1 4Å; D838-L843 HydrophobicContact CB-CB 4.4Å; D838-L843 VanDerWaalsContact OD1-CA 3.28Å; D838-L843 WeakPolarHBondContact OD1-CA 3.34Å; D838-L843 PolarHBondContact OD1-N 3.14Å; A841-L843 HydrophobicContact CB-CD1 4.05Å; A841-L843 HydrophobicContact CB-CD2 4.39Å; A841-L843 HydrophobicContact CB-CG 4.05Å; L843-N845 VanDerWaalsContact C-N 3.28Å; L843-N845 PolarHBondContact O-N 2.94Å; L843-N845 VanDerWaalsContact O-N 3.17Å; L843-L846 HydrophobicContact CB-CB 4.26Å; L843-L846 HydrophobicContact CB-CD1 4.42Å; L843-L846 HydrophobicContact CB-CD2 4.41Å; L843-L846 HydrophobicContact CD1-CD2 4.29Å; L843-L846 PolarHBondContact O-N 3.36Å; L843-M847 PolarHBondContact O-N 3.2Å
844	P	93.1	Very high	95.8	Very high	75 Å²	75	36 Å²	36	49%	0.487	20%	0.2	S	C	.	.	H	α-helix	trans	-59	-36.5	-172.6	24	-34.9	0	0	0	113.5	L846 M847 E848	P844-L846 VanDerWaalsContact C-N 3.33Å; P844-L846 PolarHBondContact O-N 3.47Å; P844-M847 PolarHBondContact O-N 3.45Å; P844-E848 PolarHBondContact O-N 3.2Å
845	N	93.1	Very high	95.8	Very high	70 Å²	70	41.7 Å²	41.7	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-63.4	-38.4	178.9	-61.9	14.9	0	0	0	112	L843 E848 H849	L843-N845 VanDerWaalsContact C-N 3.28Å; L843-N845 PolarHBondContact O-N 2.94Å; L843-N845 VanDerWaalsContact O-N 3.17Å; N845-E848 PolarHBondContact O-N 3.02Å; N845-H849 PolarHBondContact O-CD2 3.12Å; N845-H849 PolarHBondContact O-N 3.39Å; N845-H849 VanDerWaalsContact O-N 3.11Å
846	L	97.4	Very high	95.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.9	-39.4	178.8	-80.4	68.8	0	0	0	110.7	W540 Y612 F613 C775 F834 L843 P844 E848 H849 L850	W540-L846 HydrophobicContact CB-CD1 4.46Å; W540-L846 HydrophobicContact CD2-CD1 3.65Å; W540-L846 HydrophobicContact CD2-CD2 4.24Å; W540-L846 HydrophobicContact CD2-CG 3.9Å; W540-L846 HydrophobicContact CE3-CD1 4.14Å; W540-L846 HydrophobicContact CE3-CD2 4.32Å; W540-L846 HydrophobicContact CE3-CG 4.44Å; W540-L846 HydrophobicContact CG-CD1 3.76Å; W540-L846 HydrophobicContact CG-CG 4.32Å; W540-L846 HydrophobicContact CH2-CD2 3.69Å; W540-L846 HydrophobicContact CH2-CG 4.28Å; W540-L846 HydrophobicContact CZ2-CD1 4.41Å; W540-L846 HydrophobicContact CZ2-CD2 3.61Å; W540-L846 HydrophobicContact CZ2-CG 3.73Å; W540-L846 HydrophobicContact CZ3-CD2 4.05Å; Y612-L846 HydrophobicContact CE1-CD1 3.84Å; F613-L846 HydrophobicContact CE1-CD2 3.67Å; F613-L846 HydrophobicContact CZ-CD2 3.97Å; C775-L846 HydrophobicContact CB-CB 4.01Å; C775-L846 HydrophobicContact CB-CD2 4.39Å; C775-L846 HydrophobicContact CB-CG 4.18Å; F834-L846 HydrophobicContact CE1-CD2 4.15Å; L843-L846 HydrophobicContact CB-CB 4.26Å; L843-L846 HydrophobicContact CB-CD1 4.42Å; L843-L846 HydrophobicContact CB-CD2 4.41Å; L843-L846 HydrophobicContact CD1-CD2 4.29Å; L843-L846 PolarHBondContact O-N 3.36Å; P844-L846 VanDerWaalsContact C-N 3.33Å; P844-L846 PolarHBondContact O-N 3.47Å; L846-E848 VanDerWaalsContact C-N 3.31Å; L846-H849 PolarHBondContact O-N 3Å; L846-L850 WeakPolarHBondContact O-CB 3.45Å; L846-L850 PolarHBondContact O-N 2.92Å
847	M	97.4	Very high	96.1	Very high	35 Å²	35	41.1 Å²	41.1	17%	0.172	22%	0.218	C	C	.	.	H	α-helix	trans	-68.8	-31.8	177.5	-59	-50.7	-68.6	0	0	112.2	F834 D835 D838 L843 P844 L850 S851	F834-M847 HydrophobicContact CB-CE 4.4Å; F834-M847 HydrophobicContact CB-SD 3.9Å; D835-M847 WeakPolarHBondContact OD1-CE 3.28Å; D838-M847 HydrophobicContact CB-CG 3.86Å; D838-M847 HydrophobicContact CB-SD 4.01Å; L843-M847 PolarHBondContact O-N 3.2Å; P844-M847 PolarHBondContact O-N 3.45Å; M847-L850 HydrophobicContact CE-CD2 4.11Å; M847-L850 HydrophobicContact SD-CD2 4.42Å; M847-S851 WeakPolarHBondContact O-CB 3.42Å; M847-S851 PolarHBondContact O-N 2.91Å; M847-S851 VanDerWaalsContact O-N 3.1Å
848	E	97	Very high	95.8	Very high	115 Å²	115	44.4 Å²	44.4	54%	0.537	23%	0.232	S	C	.	.	H	α-helix	trans	-64.3	-53.3	171.7	-176.7	164.9	-147	0	0	111.1	P844 N845 L846 L850 S851 E852	P844-E848 PolarHBondContact O-N 3.2Å; N845-E848 PolarHBondContact O-N 3.02Å; L846-E848 VanDerWaalsContact C-N 3.31Å; E848-L850 VanDerWaalsContact C-N 3.34Å; E848-L850 PolarHBondContact O-N 2.81Å; E848-S851 PolarHBondContact O-N 3.19Å; E848-S851 VanDerWaalsContact O-N 3.15Å; E848-E852 WeakPolarHBondContact O-CG 3.36Å; E848-E852 PolarHBondContact O-N 3.23Å
849	H	97.8	Very high	95.7	Very high	31 Å²	31	47 Å²	47	14%	0.144	25%	0.246	C	C	.	.	H	α-helix	trans	-57.8	-43.5	175.1	-74.2	-39.3	0	0	0	112.7	W540 C775 N845 L846 S851 E852 N853	W540-H849 AromaticContact CD1-CD2 3.92Å; C775-H849 VanDerWaalsContact O-CB 3.25Å; C775-H849 WeakPolarHBondContact O-CB 3.45Å; N845-H849 PolarHBondContact O-CD2 3.12Å; N845-H849 PolarHBondContact O-N 3.39Å; N845-H849 VanDerWaalsContact O-N 3.11Å; L846-H849 PolarHBondContact O-N 3Å; H849-S851 VanDerWaalsContact C-N 3.3Å; H849-S851 PolarHBondContact O-N 2.96Å; H849-E852 IonicContact ND1-OE2 3.31Å; H849-E852 PolarHBondContact O-N 2.8Å; H849-N853 VanDerWaalsContact O-CB 3.27Å; H849-N853 WeakPolarHBondContact O-CB 3.27Å; H849-N853 PolarHBondContact O-N 3.39Å; H849-N853 PolarHBondContact O-ND2 3.15Å
850	L	98.1	Very high	95.6	Very high	10 Å²	10	45.6 Å²	45.6	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-56.4	-46	176.5	-178.3	60.8	0	0	0	111.5	P774 I826 I830 F834 L846 M847 E848 Y854	P774-L850 HydrophobicContact CB-CD1 3.73Å; P774-L850 WeakPolarHBondContact O-CA 3.04Å; I826-L850 HydrophobicContact CD1-CD1 4.47Å; I826-L850 HydrophobicContact CG1-CD1 4.35Å; I826-L850 HydrophobicContact CG2-CD1 3.87Å; I830-L850 HydrophobicContact CG2-CD1 3.81Å; I830-L850 HydrophobicContact CG2-CD2 4.23Å; F834-L850 HydrophobicContact CB-CD2 4.33Å; L846-L850 WeakPolarHBondContact O-CB 3.45Å; L846-L850 PolarHBondContact O-N 2.92Å; M847-L850 HydrophobicContact CE-CD2 4.11Å; M847-L850 HydrophobicContact SD-CD2 4.42Å; E848-L850 VanDerWaalsContact C-N 3.34Å; E848-L850 PolarHBondContact O-N 2.81Å; L850-Y854 VanDerWaalsContact O-CB 3.27Å; L850-Y854 WeakPolarHBondContact O-CB 3.27Å; L850-Y854 PolarHBondContact O-N 3.11Å
851	S	97.3	Very high	95.4	Very high	51 Å²	51	47.7 Å²	47.7	36%	0.357	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-41.7	177.2	151.3	0	0	0	0	112.3	M847 E848 H849 K855	M847-S851 WeakPolarHBondContact O-CB 3.42Å; M847-S851 PolarHBondContact O-N 2.91Å; M847-S851 VanDerWaalsContact O-N 3.1Å; E848-S851 PolarHBondContact O-N 3.19Å; E848-S851 VanDerWaalsContact O-N 3.15Å; H849-S851 VanDerWaalsContact C-N 3.3Å; H849-S851 PolarHBondContact O-N 2.96Å; S851-K855 VanDerWaalsContact O-CG 3.29Å; S851-K855 WeakPolarHBondContact O-CG 3.48Å; S851-K855 PolarHBondContact O-N 3.14Å; S851-K855 VanDerWaalsContact O-N 3.14Å
852	E	97.6	Very high	95.2	Very high	96 Å²	96	53.3 Å²	53.3	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-65.6	-46.3	177.6	-70.9	-179	154.3	0	0	112.1	E848 H849 K855 Y856	E848-E852 WeakPolarHBondContact O-CG 3.36Å; E848-E852 PolarHBondContact O-N 3.23Å; H849-E852 IonicContact ND1-OE2 3.31Å; H849-E852 PolarHBondContact O-N 2.8Å; E852-K855 WeakPolarHBondContact O-CB 3.3Å; E852-K855 PolarHBondContact O-N 3.17Å; E852-Y856 PolarHBondContact O-N 3.23Å
853	N	97.9	Very high	94.9	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-65.4	-39.8	178.6	-65.7	-20	0	0	0	111.2	P774 R776 L778 H849 K855 Y856 W857	P774-N853 PolarHBondContact O-ND2 2.9Å; R776-N853 PolarHBondContact O-ND2 3.1Å; L778-N853 WeakPolarHBondContact CA-OD1 3.27Å; L778-N853 VanDerWaalsContact CD1-OD1 3.27Å; L778-N853 WeakPolarHBondContact CD1-OD1 3.44Å; H849-N853 VanDerWaalsContact O-CB 3.27Å; H849-N853 WeakPolarHBondContact O-CB 3.27Å; H849-N853 PolarHBondContact O-N 3.39Å; H849-N853 PolarHBondContact O-ND2 3.15Å; N853-K855 VanDerWaalsContact C-N 3.34Å; N853-K855 PolarHBondContact O-N 2.88Å; N853-Y856 WeakPolarHBondContact O-CB 3.38Å; N853-Y856 PolarHBondContact O-N 3.36Å; N853-W857 PolarHBondContact O-N 3.47Å
854	Y	96.6	Very high	94.5	Very high	57 Å²	57	64.5 Å²	64.5	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-59.7	-44.5	173.4	-172.4	-91.3	0	0	0	111.9	I823 I826 D827 L850 Y856 W857 K858	I823-Y854 HydrophobicContact CB-CE2 4.44Å; I823-Y854 HydrophobicContact CG2-CE2 3.89Å; I826-Y854 HydrophobicContact CB-CD2 4.05Å; I826-Y854 HydrophobicContact CB-CE2 4.42Å; I826-Y854 HydrophobicContact CD1-CD2 4.18Å; I826-Y854 HydrophobicContact CG2-CD2 3.63Å; I826-Y854 HydrophobicContact CG2-CE2 4.16Å; D827-Y854 WeakPolarHBondContact OD1-CE2 3.39Å; D827-Y854 PolarHBondContact OD1-OH 3Å; D827-Y854 PolarHBondContact OD2-OH 3.4Å; L850-Y854 VanDerWaalsContact O-CB 3.27Å; L850-Y854 WeakPolarHBondContact O-CB 3.27Å; L850-Y854 PolarHBondContact O-N 3.11Å; Y854-Y856 VanDerWaalsContact C-N 3.33Å; Y854-Y856 PolarHBondContact O-N 3.39Å; Y854-W857 PolarHBondContact O-N 2.96Å; Y854-K858 HydrophobicContact CD1-CG 3.92Å; Y854-K858 HydrophobicContact CE1-CD 4.19Å; Y854-K858 HydrophobicContact CE1-CG 3.6Å; Y854-K858 VanDerWaalsContact CZ-CE 3.41Å; Y854-K858 WeakPolarHBondContact O-CB 3.29Å; Y854-K858 WeakPolarHBondContact O-CG 3.43Å; Y854-K858 PolarHBondContact O-N 3.28Å; Y854-K858 WeakPolarHBondContact OH-CE 3.46Å
855	K	96.7	Very high	94	Very high	122 Å²	122	61.7 Å²	61.7	53%	0.53	30%	0.299	S	S	.	.	H	α-helix	trans	-62.9	-39.6	175.1	-71.2	169.2	-170.9	171.6	0	111.8	S851 E852 N853 K858 N859	S851-K855 VanDerWaalsContact O-CG 3.29Å; S851-K855 WeakPolarHBondContact O-CG 3.48Å; S851-K855 PolarHBondContact O-N 3.14Å; S851-K855 VanDerWaalsContact O-N 3.14Å; E852-K855 WeakPolarHBondContact O-CB 3.3Å; E852-K855 PolarHBondContact O-N 3.17Å; N853-K855 VanDerWaalsContact C-N 3.34Å; N853-K855 PolarHBondContact O-N 2.88Å; K855-K858 PolarHBondContact O-N 3.23Å; K855-N859 WeakPolarHBondContact O-CB 3.3Å; K855-N859 PolarHBondContact O-N 2.82Å; K855-N859 PolarHBondContact O-ND2 2.88Å
856	Y	96.9	Very high	93.4	Very high	44 Å²	44	64.2 Å²	64.2	17%	0.173	31%	0.307	C	S	.	.	H	α-helix	trans	-57.7	-50.8	175.4	175.8	-95.2	0	0	0	111.4	L778 I782 E852 N853 Y854 K858 N859 L860 L868	L778-Y856 HydrophobicContact CD1-CD1 3.77Å; L778-Y856 HydrophobicContact CD1-CD2 4.03Å; L778-Y856 HydrophobicContact CD1-CE1 4.31Å; L778-Y856 HydrophobicContact CD1-CG 3.61Å; L778-Y856 HydrophobicContact CD2-CD2 3.85Å; L778-Y856 HydrophobicContact CD2-CE2 4.2Å; L778-Y856 HydrophobicContact CD2-CG 4.26Å; I782-Y856 HydrophobicContact CD1-CD1 4.46Å; I782-Y856 HydrophobicContact CD1-CE1 3.69Å; I782-Y856 HydrophobicContact CD1-CE2 4.26Å; I782-Y856 WeakPolarHBondContact CD1-OH 3.45Å; I782-Y856 HydrophobicContact CG1-CD1 4.44Å; I782-Y856 HydrophobicContact CG1-CE1 3.79Å; E852-Y856 PolarHBondContact O-N 3.23Å; N853-Y856 WeakPolarHBondContact O-CB 3.38Å; N853-Y856 PolarHBondContact O-N 3.36Å; Y854-Y856 VanDerWaalsContact C-N 3.33Å; Y854-Y856 PolarHBondContact O-N 3.39Å; Y856-K858 PolarHBondContact O-N 2.87Å; Y856-N859 PolarHBondContact O-N 3.34Å; Y856-L860 HydrophobicContact CD1-CD1 4.19Å; Y856-L860 HydrophobicContact CE1-CD1 3.46Å; Y856-L860 VanDerWaalsContact CE1-CD1 3.46Å; Y856-L860 HydrophobicContact CE1-CG 4.3Å; Y856-L860 PolarHBondContact O-N 2.94Å; Y856-L860 VanDerWaalsContact O-N 3.14Å; Y856-L868 PolarHBondContact OH-O 3.23Å
857	W	96.1	Very high	92.6	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.3	-40.5	178.5	-63.3	125.7	0	0	0	112.5	I782 A785 P819 Q822 I823 N853 Y854 N859 L860 D861 L868	I782-W857 HydrophobicContact CB-CH2 4.42Å; I782-W857 HydrophobicContact CG1-CH2 3.97Å; I782-W857 HydrophobicContact CG1-CZ2 4.11Å; I782-W857 HydrophobicContact CG2-CH2 4.49Å; A785-W857 HydrophobicContact CB-CH2 4.1Å; A785-W857 HydrophobicContact CB-CZ2 3.81Å; P819-W857 HydrophobicContact CB-CB 4.5Å; P819-W857 HydrophobicContact CB-CE3 3.78Å; P819-W857 HydrophobicContact CB-CZ3 4.49Å; P819-W857 HydrophobicContact CG-CE3 3.93Å; P819-W857 HydrophobicContact CG-CZ3 4.17Å; Q822-W857 HydrophobicContact CB-CD2 4Å; Q822-W857 HydrophobicContact CB-CG 3.92Å; Q822-W857 HydrophobicContact CG-CD2 4.26Å; Q822-W857 HydrophobicContact CG-CZ2 4.11Å; I823-W857 HydrophobicContact CD1-CB 4.16Å; I823-W857 HydrophobicContact CG1-CB 3.75Å; N853-W857 PolarHBondContact O-N 3.47Å; Y854-W857 PolarHBondContact O-N 2.96Å; W857-N859 PolarHBondContact O-N 2.85Å; W857-L860 HydrophobicContact CE3-CD1 3.95Å; W857-L860 HydrophobicContact CZ3-CD1 3.94Å; W857-L860 PolarHBondContact O-N 3.22Å; W857-D861 PolarHBondContact O-N 3.38Å; W857-L868 HydrophobicContact CH2-CD2 3.87Å; W857-L868 HydrophobicContact CZ3-CD2 4.38Å
858	K	92.6	Very high	91.8	Very high	68 Å²	68	67.9 Å²	67.9	30%	0.296	33%	0.332	S	S	.	.	H	α-helix	trans	-59.5	-45	174.8	-78.8	-73.9	176.3	-171.6	0	112.4	I823 Y854 K855 Y856 L860 D861 D862	I823-K858 HydrophobicContact CD1-CD 3.73Å; I823-K858 HydrophobicContact CD1-CG 4Å; I823-K858 HydrophobicContact CG1-CD 4.31Å; I823-K858 HydrophobicContact CG1-CG 4.26Å; I823-K858 HydrophobicContact CG2-CD 4.49Å; I823-K858 VanDerWaalsContact CG2-CE 3.46Å; Y854-K858 HydrophobicContact CD1-CG 3.92Å; Y854-K858 HydrophobicContact CE1-CD 4.19Å; Y854-K858 HydrophobicContact CE1-CG 3.6Å; Y854-K858 VanDerWaalsContact CZ-CE 3.41Å; Y854-K858 WeakPolarHBondContact O-CB 3.29Å; Y854-K858 WeakPolarHBondContact O-CG 3.43Å; Y854-K858 PolarHBondContact O-N 3.28Å; Y854-K858 WeakPolarHBondContact OH-CE 3.46Å; K855-K858 PolarHBondContact O-N 3.23Å; Y856-K858 PolarHBondContact O-N 2.87Å; K858-L860 VanDerWaalsContact C-N 3.3Å; K858-L860 PolarHBondContact O-N 3.25Å; K858-D861 PolarHBondContact O-N 3.14Å; K858-D862 WeakPolarHBondContact O-CB 3.45Å; K858-D862 VanDerWaalsContact O-CG 3.3Å; K858-D862 PolarHBondContact O-N 2.77Å
859	N	93.9	Very high	91.2	Very high	98 Å²	98	68.7 Å²	68.7	52%	0.524	33%	0.33	S	S	.	.	H	α-helix	trans	-61.1	-39.5	177.2	-69.1	-22.1	0	0	0	111.8	K855 Y856 W857 M863	K855-N859 WeakPolarHBondContact O-CB 3.3Å; K855-N859 PolarHBondContact O-N 2.82Å; K855-N859 PolarHBondContact O-ND2 2.88Å; Y856-N859 PolarHBondContact O-N 3.34Å; W857-N859 PolarHBondContact O-N 2.85Å; N859-M863 VanDerWaalsContact O-CG 3.28Å; N859-M863 WeakPolarHBondContact O-CG 3.46Å; N859-M863 PolarHBondContact O-N 2.93Å; N859-M863 VanDerWaalsContact O-N 3.14Å
860	L	91.9	Very high	90.1	Very high	6 Å²	6	70.3 Å²	70.3	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-67.8	-40.3	175.9	-72.1	-175.5	0	0	0	112.7	P819 Y856 W857 K858 M863 K864 C865 P870	P819-L860 HydrophobicContact CB-CB 3.89Å; P819-L860 HydrophobicContact CG-CB 3.79Å; P819-L860 HydrophobicContact CG-CD1 4.01Å; Y856-L860 HydrophobicContact CD1-CD1 4.19Å; Y856-L860 HydrophobicContact CE1-CD1 3.46Å; Y856-L860 VanDerWaalsContact CE1-CD1 3.46Å; Y856-L860 HydrophobicContact CE1-CG 4.3Å; Y856-L860 PolarHBondContact O-N 2.94Å; Y856-L860 VanDerWaalsContact O-N 3.14Å; W857-L860 HydrophobicContact CE3-CD1 3.95Å; W857-L860 HydrophobicContact CZ3-CD1 3.94Å; W857-L860 PolarHBondContact O-N 3.22Å; K858-L860 VanDerWaalsContact C-N 3.3Å; K858-L860 PolarHBondContact O-N 3.25Å; L860-M863 CarbonylContact O-C 3.54Å; L860-M863 PolarHBondContact O-N 3.31Å; L860-K864 PolarHBondContact O-N 3.23Å; L860-C865 HydrophobicContact CB-CB 4.21Å; L860-C865 HydrophobicContact CD2-CB 4.13Å; L860-C865 VanDerWaalsContact O-CB 3.3Å; L860-C865 WeakPolarHBondContact O-CB 3.28Å; L860-C865 PolarHBondContact O-N 3.39Å; L860-P870 HydrophobicContact CD2-CB 4.02Å; L860-P870 HydrophobicContact CD2-CG 4.41Å
861	D	90.1	Very high	88.7	Confident	44 Å²	44	74.2 Å²	74.2	24%	0.235	37%	0.369	C	S	.	.	H	α-helix	trans	-66	-40.8	176.5	-168.9	55.1	0	0	0	111.8	I823 W857 K858 M863 K864	I823-D861 HydrophobicContact CD1-CB 3.91Å; W857-D861 PolarHBondContact O-N 3.38Å; K858-D861 PolarHBondContact O-N 3.14Å; D861-M863 VanDerWaalsContact C-N 3.26Å; D861-M863 PolarHBondContact O-N 3.48Å; D861-K864 VanDerWaalsContact O-CA 3.3Å; D861-K864 WeakPolarHBondContact O-CA 3.4Å; D861-K864 PolarHBondContact O-N 3.02Å
862	D	89.1	Confident	87.1	Confident	122 Å²	122	77.2 Å²	77.2	65%	0.652	39%	0.387	S	S	*	.	H	α-helix	trans	-61.3	-35.5	174.4	-74	-20.1	0	0	0	111.8	K858 K864	K858-D862 WeakPolarHBondContact O-CB 3.45Å; K858-D862 VanDerWaalsContact O-CG 3.3Å; K858-D862 PolarHBondContact O-N 2.77Å; D862-K864 PolarHBondContact O-N 3.32Å
863	M	87.9	Confident	85.3	Confident	127 Å²	127	79 Å²	79	63%	0.626	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-1.4	171.7	-69	178.7	69	0	0	113.5	N859 L860 D861 C865	N859-M863 VanDerWaalsContact O-CG 3.28Å; N859-M863 WeakPolarHBondContact O-CG 3.46Å; N859-M863 PolarHBondContact O-N 2.93Å; N859-M863 VanDerWaalsContact O-N 3.14Å; L860-M863 CarbonylContact O-C 3.54Å; L860-M863 PolarHBondContact O-N 3.31Å; D861-M863 VanDerWaalsContact C-N 3.26Å; D861-M863 PolarHBondContact O-N 3.48Å; M863-C865 PolarHBondContact O-N 3.48Å
864	K	85.9	Confident	82.5	Confident	183 Å²	183	88 Å²	88	80%	0.796	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	29.1	-172.2	-57	-176.9	179.5	-179.4	0	113.1	L860 D861 D862	L860-K864 PolarHBondContact O-N 3.23Å; D861-K864 VanDerWaalsContact O-CA 3.3Å; D861-K864 WeakPolarHBondContact O-CA 3.4Å; D861-K864 PolarHBondContact O-N 3.02Å; D862-K864 PolarHBondContact O-N 3.32Å
865	C	83.2	Confident	81.8	Confident	15 Å²	15	89.6 Å²	89.6	10%	0.101	48%	0.483	C	S	.	.			trans	-75.3	125	175.5	-166.9	0	0	0	0	109.1	L860 M863 S867	L860-C865 HydrophobicContact CB-CB 4.21Å; L860-C865 HydrophobicContact CD2-CB 4.13Å; L860-C865 VanDerWaalsContact O-CB 3.3Å; L860-C865 WeakPolarHBondContact O-CB 3.28Å; L860-C865 PolarHBondContact O-N 3.39Å; M863-C865 PolarHBondContact O-N 3.48Å; C865-S867 PolarHBondContact SG-OG 3.26Å
866	K	80.8	Confident	81	Confident	123 Å²	123	87.9 Å²	87.9	54%	0.535	48%	0.481	S	S	.	.			trans	-89.2	-20.1	175.8	-64.7	-170.9	177.3	-165.6	0	113.1	V818	V818-K866 PolarHBondContact N-O 2.92Å
867	S	80.3	Confident	80.1	Confident	64 Å²	64	90.3 Å²	90.3	45%	0.448	50%	0.498	S	S	.	.	S	Bend	trans	-85.1	161.1	-177.2	51	0	0	0	0	112.7	C865 R869	C865-S867 PolarHBondContact SG-OG 3.26Å; S867-R869 PolarHBondContact O-N 3.02Å; S867-R869 PolarHBondContact OG-O 3.35Å
868	L	81	Confident	79.2	Confident	49 Å²	49	95.6 Å²	95.6	26%	0.257	53%	0.527	S	S	.	.	S	Bend	trans	-61.3	-23.8	178.3	-71.1	163.6	0	0	0	114.4	I782 A785 V818 Y856 W857	I782-L868 HydrophobicContact CG2-CB 4.06Å; A785-L868 HydrophobicContact CB-CD2 4.01Å; V818-L868 HydrophobicContact CB-CD2 4.26Å; V818-L868 HydrophobicContact CG1-CD2 3.52Å; V818-L868 HydrophobicContact CG1-CG 4.4Å; Y856-L868 PolarHBondContact OH-O 3.23Å; W857-L868 HydrophobicContact CH2-CD2 3.87Å; W857-L868 HydrophobicContact CZ3-CD2 4.38Å
869	R	83.6	Confident	78.3	Confident	132 Å²	132	97.4 Å²	97.4	50%	0.498	54%	0.541	S	S	.	.	S	Bend	trans	-132.2	151.4	-177.9	-66.1	-175.5	-176.9	-143.5	-9.8	109.8	E779 I782 S867	E779-R869 IonicContact OE2-CZ 3.89Å; E779-R869 IonicContact OE2-NH1 3.85Å; E779-R869 IonicContact OE2-NH2 2.67Å; E779-R869 PolarHBondContact OE2-NH2 3.14Å; I782-R869 HydrophobicContact CG2-CG 4.35Å; S867-R869 PolarHBondContact O-N 3.02Å; S867-R869 PolarHBondContact OG-O 3.35Å
870	P	75.7	Confident	77.3	Confident	65 Å²	65	97.3 Å²	97.3	42%	0.422	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-63.9	151.6	172.1	27.8	-31.8	0	0	0	110.1	L860	L860-P870 HydrophobicContact CD2-CB 4.02Å; L860-P870 HydrophobicContact CD2-CG 4.41Å
871	P	68.1	Low	76.2	Confident	91 Å²	91	103.9 Å²	103.9	59%	0.591	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-58.7	145.6	173	24.5	-31.8	0	0	0	110
872	P	63.5	Low	75.2	Confident	114 Å²	114	108.5 Å²	108.5	74%	0.74	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-56.3	144.3	177	23.3	-31.8	0	0	0	109.9	S874	P872-S874 PolarHBondContact O-N 3.18Å
873	P	59.1	Low	74	Confident	135 Å²	135	107.3 Å²	107.3	88%	0.877	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-57.6	125.6	177.6	23.2	-31.2	0	0	0	109
874	S	39.3	Very low	72.8	Confident	190 Å²	190	105.5 Å²	105.5	100%	1.329	60%	0.599	S	S	*	*			trans	-65.2	0	179.1	55.3	0	0	0	0	112.9	P872	P872-S874 PolarHBondContact O-N 3.18Å

Retrieved 874 of 874 residues in 515.3 ms (Link to these results)

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