A0A096LUM8_POEFO Loading...

Ankyrin repeat domain 13C

Acts as a molecular chaperone for G protein-coupled receptors, regulating their biogenesis and exit from the ER.

AlphaFold DB , UniProt , Accession A0A096LUM8, Species POEFO (Poecilia formosa, Amazon molly), Gene ANKRD13C, Length 519 aa.

Structure Viewer

Loading PAE data...

(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	38.5	Very low	30.7	Very low	244 Å²	244	166.5 Å²	166.5	100%	1.202	83%	0.833	S	S	*	*				0	105.2	0	-84	173.5	50.4	0	0	107.8
2	T	33.6	Very low	30.4	Very low	149 Å²	149	164.3 Å²	164.3	91%	0.914	83%	0.826	S	S	*	*			trans	-96.4	156.2	-171.4	41	0	0	0	0	111.3
3	G	27.7	Very low	30.1	Very low	69 Å²	69	166.5 Å²	166.5	71%	0.711	83%	0.832	S	S	*	*			trans	138.7	93	160.4	0	0	0	0	0	111.4
4	E	30.6	Very low	29.9	Very low	153 Å²	153	171.9 Å²	171.9	72%	0.715	84%	0.838	S	S	*	*				63.6	126.2	77	-75.5	-153	135.1	0	0	115.9
5	K	32.7	Very low	30	Very low	159 Å²	159	168.6 Å²	168.6	69%	0.691	84%	0.835	S	S	*	*			trans	72.8	142.8	140.3	-73.1	170.8	-175.5	147.9	0	116.7
6	L	30.9	Very low	29.8	Very low	153 Å²	153	164.1 Å²	164.1	80%	0.801	83%	0.825	S	S	*	*			cis	-155	152.3	30	-95.5	113.1	0	0	0	113.1
7	R	28.7	Very low	29.6	Very low	222 Å²	222	165 Å²	165	84%	0.838	82%	0.823	S	S	*	*			trans	-14.9	145.8	145.5	-68.3	168.9	177.9	174.4	-0.5	117.8
8	S	30.2	Very low	29.7	Very low	125 Å²	125	163.7 Å²	163.7	87%	0.874	82%	0.819	S	S	*	*				-156.2	154.7	114.3	67.9	0	0	0	0	111.9
9	L	27.7	Very low	29.6	Very low	147 Å²	147	165.1 Å²	165.1	77%	0.77	82%	0.823	S	S	*	*			trans	-119.1	163.2	-162	-105.4	154	0	0	0	109.4
10	R	28.9	Very low	29.7	Very low	227 Å²	227	164.7 Å²	164.7	86%	0.857	82%	0.824	S	S	*	*			trans	83.9	144	162.3	-69.9	170.9	173.6	159.8	-1.4	115.5
11	K	28.3	Very low	29.5	Very low	183 Å²	183	165 Å²	165	80%	0.796	83%	0.827	S	S	*	*			cis	-161.3	158.4	25.7	-147.5	172.7	177.7	-175.9	0	111.3
12	D	26.9	Very low	29	Very low	140 Å²	140	161 Å²	161	75%	0.749	81%	0.809	S	S	*	*			trans	-44.9	143.1	176.2	-51.8	-74.6	0	0	0	116.9
13	Q	26.3	Very low	28.7	Very low	193 Å²	193	162.5 Å²	162.5	90%	0.902	81%	0.806	S	S	*	*			trans	-167.2	113.1	131.1	-109.9	163.6	-0.8	0	0	111
14	R	27.9	Very low	28.8	Very low	243 Å²	243	164.8 Å²	164.8	92%	0.917	81%	0.808	S	S	*	*			trans	-83.4	146.2	149.5	-74.6	-173.6	-169.2	177.6	3.1	107.6
15	P	31.5	Very low	28.7	Very low	122 Å²	122	165.6 Å²	165.6	79%	0.792	82%	0.818	S	S	*	*				-141.8	140.8	100.4	32.5	-15.6	0	0	0	115.2
16	S	26.4	Very low	28.5	Very low	97 Å²	97	166.9 Å²	166.9	68%	0.678	83%	0.826	S	S	*	*			trans	3.4	122.7	142.2	137.7	0	0	0	0	118.4
17	K	27.3	Very low	28.3	Very low	179 Å²	179	168.5 Å²	168.5	78%	0.778	83%	0.83	S	S	*	*				169.4	142.2	94.8	-115.8	168.7	-177.6	-170.5	0	111.4
18	D	30.8	Very low	28.2	Very low	142 Å²	142	162.7 Å²	162.7	76%	0.759	83%	0.829	S	S	*	*			trans	28.3	112.9	151.8	-53.1	-32.3	0	0	0	119.2
19	E	28	Very low	28	Very low	190 Å²	190	161.6 Å²	161.6	89%	0.888	83%	0.828	S	S	*	*			trans	-160	142	141.1	-118.4	-178.4	-161.7	0	0	112.1
20	D	31.1	Very low	27.8	Very low	157 Å²	157	161.2 Å²	161.2	84%	0.84	83%	0.832	S	S	*	*			trans	-50.4	125.3	-178.6	-71.3	-53.9	0	0	0	113.7	L22	D20-L22 PolarHBondContact O-N 3.41Å
21	L	25	Very low	27.6	Very low	172 Å²	172	154.1 Å²	154.1	90%	0.901	83%	0.829	S	S	*	*			trans	-91.6	87.4	168	-94.3	147	0	0	0	109.4	E23	L21-E23 PolarHBondContact O-N 2.76Å
22	L	28.3	Very low	27.3	Very low	158 Å²	158	151.5 Å²	151.5	83%	0.827	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-67.2	116.4	152.6	-79.3	159.5	0	0	0	108	D20	D20-L22 PolarHBondContact O-N 3.41Å
23	E	27.3	Very low	27.2	Very low	182 Å²	182	154.9 Å²	154.9	85%	0.85	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-68.9	137.6	169.8	-70.9	-161.5	156.6	0	0	110.6	L21	L21-E23 PolarHBondContact O-N 2.76Å
24	P	29.5	Very low	27.2	Very low	116 Å²	116	150.1 Å²	150.1	75%	0.753	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-82.7	134.3	177.6	31.3	-31.5	0	0	0	112.1	E26	P24-E26 PolarHBondContact O-N 3.46Å
25	D	28.7	Very low	27	Very low	170 Å²	170	144.8 Å²	144.8	91%	0.909	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-62.3	119.4	161.9	-79.6	-44.4	0	0	0	110.3
26	E	28.1	Very low	26.7	Very low	187 Å²	187	144.7 Å²	144.7	87%	0.874	82%	0.824	S	S	*	*			trans	-114.5	98.4	161	-78.1	-158.8	161.3	0	0	110.6	P24	P24-E26 PolarHBondContact O-N 3.46Å
27	E	27.7	Very low	26.6	Very low	187 Å²	187	149.7 Å²	149.7	87%	0.874	83%	0.834	S	S	*	*			trans	-107.6	112.7	149	-86.4	-172.5	172.5	0	0	107.6
28	A	25.8	Very low	26.5	Very low	99 Å²	99	146 Å²	146	82%	0.818	84%	0.837	S	S	*	*			trans	-121.2	109.9	170.3	0	0	0	0	0	110.1
29	A	26.2	Very low	26.1	Very low	103 Å²	103	146.6 Å²	146.6	85%	0.851	84%	0.84	S	S	*	*			trans	174.9	81.5	133.4	0	0	0	0	0	110.8
30	T	24.6	Very low	26	Very low	139 Å²	139	145.3 Å²	145.3	85%	0.853	84%	0.839	S	S	*	*			trans	-108.2	109.5	159.4	49.6	0	0	0	0	109.1
31	G	24.3	Very low	25.7	Very low	78 Å²	78	146.6 Å²	146.6	80%	0.804	84%	0.837	S	S	*	*			trans	-80	116.7	168.5	0	0	0	0	0	110.8
32	T	22.3	Very low	25.7	Very low	128 Å²	128	143.7 Å²	143.7	79%	0.785	83%	0.832	S	S	*	*			trans	-64.7	130.2	177.4	-44.3	0	0	0	0	112.1
33	F	25.2	Very low	25.5	Very low	210 Å²	210	147.6 Å²	147.6	92%	0.921	84%	0.835	S	S	*	*			trans	-133.4	136.1	153.2	-86.4	-79.3	0	0	0	110.9
34	A	24.6	Very low	25.4	Very low	94 Å²	94	143.5 Å²	143.5	78%	0.777	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-73.1	146.2	-161.9	0	0	0	0	0	115
35	V	23.9	Very low	25.3	Very low	131 Å²	131	143.4 Å²	143.4	79%	0.794	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-93.5	139.7	165.5	172.7	0	0	0	0	109.2
36	P	26.3	Very low	25.1	Very low	119 Å²	119	144.5 Å²	144.5	77%	0.773	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-98.5	133.4	150.2	29.7	-19.3	0	0	0	111.1
37	K	23.1	Very low	25.1	Very low	203 Å²	203	143.3 Å²	143.3	88%	0.883	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-60.2	145.8	175.3	-69.8	172.9	173.8	173.7	0	112.3
38	A	25.8	Very low	24.9	Very low	102 Å²	102	142.2 Å²	142.2	84%	0.843	82%	0.822	S	S	*	*			trans	-151.3	131	144.5	0	0	0	0	0	111.9
39	N	22.7	Very low	25	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	82%	0.823	S	S	*	*			trans	-58.2	145.8	170.9	-83.7	-28.1	0	0	0	112.8
40	N	25.9	Very low	25	Very low	164 Å²	164	144.9 Å²	144.9	88%	0.877	82%	0.818	S	S	*	*				-171.5	154.6	113.6	-104.3	-23.5	0	0	0	115.7
41	K	24.6	Very low	25.2	Very low	183 Å²	183	147.7 Å²	147.7	80%	0.796	82%	0.821	S	S	*	*			trans	-72.3	155.8	-170.4	-69.4	168.4	169.2	173.2	0	115.5
42	S	23.6	Very low	25.3	Very low	112 Å²	112	153 Å²	153	78%	0.783	82%	0.821	S	S	*	*			trans	62.5	142.8	144.7	73.6	0	0	0	0	117.8
43	R	25.7	Very low	25.5	Very low	239 Å²	239	154.8 Å²	154.8	90%	0.902	83%	0.826	S	S	*	*				-172.7	144.9	52.1	-165	176.1	-176.5	164.5	0.3	108.7
44	A	24.2	Very low	25.6	Very low	96 Å²	96	152 Å²	152	79%	0.793	82%	0.819	S	S	*	*			trans	-67	148.3	170.3	0	0	0	0	0	112.4
45	S	27.6	Very low	25.6	Very low	114 Å²	114	156.8 Å²	156.8	80%	0.797	82%	0.822	S	S	*	*			trans	-154.3	124.2	146.6	51.1	0	0	0	0	111.4
46	K	25.3	Very low	25.7	Very low	193 Å²	193	156.1 Å²	156.1	84%	0.839	82%	0.823	S	S	*	*			trans	-79	137.4	165.3	-66.9	171.2	175.7	174.9	0	107.9
47	I	26.6	Very low	26.1	Very low	162 Å²	162	156 Å²	156	83%	0.831	82%	0.822	S	S	*	*			trans	-139.3	122.5	154.3	-63.1	-175.3	0	0	0	109
48	F	24.9	Very low	26.2	Very low	165 Å²	165	151.1 Å²	151.1	72%	0.724	81%	0.814	S	S	*	*			trans	-69	152.9	169.7	-83.7	-99.1	0	0	0	111.3
49	S	28.2	Very low	26.2	Very low	121 Å²	121	153.5 Å²	153.5	85%	0.846	82%	0.818	S	S	*	*			trans	-161.2	109.8	139.8	-74.5	0	0	0	0	110.7
50	N	24.6	Very low	26.3	Very low	137 Å²	137	155.3 Å²	155.3	73%	0.733	82%	0.821	S	S	*	*			trans	-70	145.2	164.4	-75.9	-39.9	0	0	0	110
51	H	29.7	Very low	26.3	Very low	198 Å²	198	152.5 Å²	152.5	92%	0.917	82%	0.815	S	S	*	*			trans	-140.5	132.8	142.5	-101.9	-73.9	0	0	0	111.7
52	K	26.1	Very low	26.4	Very low	188 Å²	188	152 Å²	152	82%	0.817	82%	0.815	S	S	*	*			trans	-116.2	128.9	-169.5	-171.5	-176.2	-172.8	-176.8	0	105.8
53	L	27.1	Very low	26.6	Very low	167 Å²	167	152.8 Å²	152.8	87%	0.874	81%	0.811	S	S	*	*			trans	-133.4	94	168.6	-81.7	161.6	0	0	0	106
54	I	27.3	Very low	26.6	Very low	152 Å²	152	148.7 Å²	148.7	78%	0.779	81%	0.807	S	S	*	*				62.5	109.8	98.6	-59.1	175.7	0	0	0	112.8
55	K	23.9	Very low	26.6	Very low	194 Å²	194	147.1 Å²	147.1	84%	0.843	80%	0.8	S	S	*	*			trans	-89.6	164.1	170.4	-84.2	-177	173.5	-179	0	111.3
56	S	26.3	Very low	26.6	Very low	116 Å²	116	149 Å²	149	81%	0.811	80%	0.801	S	S	*	*			trans	108.1	156.9	140.2	72.6	0	0	0	0	117.1
57	P	34.7	Very low	26.7	Very low	116 Å²	116	145.1 Å²	145.1	75%	0.753	79%	0.794	S	S	*	*			cis	-131.8	177.4	-4.4	26.4	-2.3	0	0	0	116.2
58	S	24.8	Very low	26.7	Very low	102 Å²	102	144 Å²	144	71%	0.713	79%	0.79	S	S	*	*			trans	-54.2	158.8	174.1	47.5	0	0	0	0	119.2
59	T	26	Very low	26.8	Very low	152 Å²	152	142.9 Å²	142.9	93%	0.933	79%	0.791	S	S	*	*			trans	-137.9	134.5	143	10.5	0	0	0	0	110.7
60	Q	25.3	Very low	26.8	Very low	190 Å²	190	142.7 Å²	142.7	89%	0.888	79%	0.785	S	S	*	*			trans	-94.7	153.8	179.7	-75.1	172.5	-28.4	0	0	111.6
61	S	25.6	Very low	27	Very low	105 Å²	105	142.8 Å²	142.8	73%	0.734	79%	0.785	S	S	*	*			trans	-169.4	104.5	147.3	169.2	0	0	0	0	107
62	Q	27.7	Very low	26.9	Very low	174 Å²	174	138.5 Å²	138.5	81%	0.813	78%	0.784	S	S	*	*				57.1	135.3	94.7	-82.5	-169.2	2.2	0	0	113.9
63	N	26.6	Very low	27.2	Very low	128 Å²	128	134.9 Å²	134.9	68%	0.684	78%	0.778	S	S	*	*			cis	-173.7	166.3	-0	-148	6.3	0	0	0	109.5
64	N	27.1	Very low	27.3	Very low	152 Å²	152	132.6 Å²	132.6	81%	0.813	78%	0.775	S	S	*	*			trans	70.4	138.1	160.5	-69	-4.5	0	0	0	120.1
65	G	24.1	Very low	27.3	Very low	64 Å²	64	132.3 Å²	132.3	66%	0.66	78%	0.775	S	S	*	*			cis	147.5	125.6	3	0	0	0	0	0	111.1
66	N	26.6	Very low	27.6	Very low	152 Å²	152	130.2 Å²	130.2	81%	0.813	78%	0.778	S	S	*	*			trans	148.2	107.2	151.8	-82.1	-5.8	0	0	0	110.8
67	T	26.5	Very low	27.8	Very low	112 Å²	112	131.3 Å²	131.3	69%	0.687	77%	0.774	S	S	*	*				58.9	131.2	76.7	64.3	0	0	0	0	113
68	N	27.5	Very low	27.7	Very low	140 Å²	140	133.3 Å²	133.3	75%	0.749	78%	0.778	S	S	*	*			cis	-168.5	168.5	14.3	-104.2	-9.5	0	0	0	111.7
69	N	27.3	Very low	28.4	Very low	141 Å²	141	134.8 Å²	134.8	75%	0.754	78%	0.778	S	S	*	*			trans	107.9	94.3	159.6	-63.9	-5.9	0	0	0	116
70	T	28.8	Very low	28.9	Very low	117 Å²	117	134.8 Å²	134.8	72%	0.718	77%	0.772	S	S	*	*				58.2	134.6	63.8	71	0	0	0	0	114
71	L	27.5	Very low	29.9	Very low	139 Å²	139	133 Å²	133	73%	0.728	77%	0.769	S	S	*	*			cis	-167.2	152.8	2	-142.5	89.3	0	0	0	107.9
72	A	28.1	Very low	30.7	Very low	108 Å²	108	137 Å²	137	89%	0.893	77%	0.773	S	S	*	*			trans	-168	89.7	133.7	0	0	0	0	0	110
73	T	32	Very low	30.8	Very low	112 Å²	112	136.1 Å²	136.1	69%	0.687	77%	0.774	S	S	*	*			trans	-82.9	140.8	169.9	43.9	0	0	0	0	110.7
74	S	30.5	Very low	31.3	Very low	118 Å²	118	134.9 Å²	134.9	83%	0.825	77%	0.773	S	S	*	*			trans	-131.7	83.3	153.6	62.5	0	0	0	0	108.9
75	D	26.9	Very low	31.6	Very low	147 Å²	147	134.7 Å²	134.7	79%	0.786	77%	0.77	S	S	*	*			trans	-131.5	115.5	165.6	-80.6	-39.7	0	0	0	107.6
76	V	29.1	Very low	32.3	Very low	149 Å²	149	138.9 Å²	138.9	90%	0.903	78%	0.776	S	S	*	*			trans	-127.6	116.6	154.4	178.1	0	0	0	0	105.7
77	I	31.1	Very low	33.1	Very low	140 Å²	140	138.9 Å²	138.9	72%	0.718	77%	0.768	S	S	*	*			trans	-88.6	126.8	175.6	-63.3	167.6	0	0	0	107
78	D	31.7	Very low	33.8	Very low	158 Å²	158	139.3 Å²	139.3	85%	0.845	77%	0.773	S	S	*	*			trans	-95.7	130.8	152.4	-162.4	10.4	0	0	0	107.7	N80	D78-N80 PolarHBondContact O-N 2.83Å
79	D	41.1	Very low	35	Very low	132 Å²	132	136 Å²	136	71%	0.706	77%	0.772	S	S	*	*			trans	-88.2	104.8	-158.6	-158.8	7	0	0	0	109.5
80	N	35.1	Very low	36.6	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	77%	0.767	S	S	*	*			trans	-157.2	81.7	163.8	-93.6	-41	0	0	0	112.2	D78 K82	D78-N80 PolarHBondContact O-N 2.83Å; N80-K82 PolarHBondContact O-N 3.05Å
81	N	47.4	Very low	39.2	Very low	151 Å²	151	135.2 Å²	135.2	81%	0.807	76%	0.763	S	S	*	*	S	Bend	trans	39.8	69.1	141.2	-157	19.2	0	0	0	117.9
82	K	42.3	Very low	42.3	Very low	191 Å²	191	129 Å²	129	83%	0.83	73%	0.73	S	S	*	*			trans	-145.2	89.7	143.8	-80.6	-174.7	-178.2	173	0	106.9	N80 P84	N80-K82 PolarHBondContact O-N 3.05Å; K82-P84 WeakPolarHBondContact O-CD 3.37Å
83	N	29.5	Very low	45.4	Very low	155 Å²	155	124.5 Å²	124.5	83%	0.829	69%	0.692	S	S	*	*			trans	-58.6	114.9	168.5	-96.3	-3.9	0	0	0	108	I85	N83-I85 PolarHBondContact O-N 3.03Å
84	P	36.5	Very low	48.5	Very low	101 Å²	101	119.4 Å²	119.4	66%	0.656	66%	0.66	S	S	*	*			trans	-63.9	124.5	156	-1.4	19.7	0	0	0	104.5	K82 I86	K82-P84 WeakPolarHBondContact O-CD 3.37Å; P84-I86 PolarHBondContact O-N 3.17Å
85	I	34.8	Very low	51.6	Low	148 Å²	148	113.9 Å²	113.9	76%	0.759	62%	0.621	S	S	*	*			trans	-64	95	167.2	-60.4	170.6	0	0	0	105.2	N83 K87	N83-I85 PolarHBondContact O-N 3.03Å; I85-K87 HydrophobicContact CG2-CG 4.21Å; I85-K87 PolarHBondContact O-N 3.11Å
86	I	37.9	Very low	54.9	Low	152 Å²	152	108.3 Å²	108.3	78%	0.779	59%	0.591	S	S	*	*			trans	-67	88.9	166.4	-58.6	174.5	0	0	0	104.7	P84	P84-I86 PolarHBondContact O-N 3.17Å
87	K	42.5	Very low	58.1	Low	152 Å²	152	101.2 Å²	101.2	66%	0.661	55%	0.548	S	S	*	.			trans	-57.4	135.4	162.5	-70.3	179.3	-179.2	172.2	0	105.7	I85 G89	I85-K87 HydrophobicContact CG2-CG 4.21Å; I85-K87 PolarHBondContact O-N 3.11Å; K87-G89 PolarHBondContact O-N 3.18Å
88	P	41.3	Very low	61.2	Low	122 Å²	122	94.6 Å²	94.6	79%	0.792	51%	0.513	S	S	*	.			trans	-58.1	106.4	173.2	25.1	-30.6	0	0	0	106.6	L90	P88-L90 PolarHBondContact O-N 3.14Å
89	G	53.9	Low	64.3	Low	69 Å²	69	87.5 Å²	87.5	71%	0.711	48%	0.475	S	S	*	.			trans	-63.2	111.1	-169.2	0	0	0	0	0	109.1	K87 D91	K87-G89 PolarHBondContact O-N 3.18Å; G89-D91 VanDerWaalsContact C-N 3.31Å; G89-D91 PolarHBondContact O-N 2.8Å
90	L	59.4	Low	66.8	Low	126 Å²	126	86.5 Å²	86.5	66%	0.66	47%	0.465	S	S	*	.			trans	-61.8	103.5	156.7	-78.7	147.6	0	0	0	105.3	P88 F92	P88-L90 PolarHBondContact O-N 3.14Å; L90-F92 HydrophobicContact CB-CD2 4.39Å; L90-F92 HydrophobicContact CB-CE2 3.53Å; L90-F92 HydrophobicContact CB-CZ 3.61Å; L90-F92 HydrophobicContact CG-CZ 4.48Å; L90-F92 WeakPolarHBondContact O-CD2 3.21Å; L90-F92 WeakPolarHBondContact O-CE2 3.42Å
91	D	84.4	Confident	69.7	Low	116 Å²	116	80.6 Å²	80.6	62%	0.62	44%	0.439	S	S	*	.			trans	-74.5	129	178.6	-168.2	9.8	0	0	0	108.9	G89 P93	G89-D91 VanDerWaalsContact C-N 3.31Å; G89-D91 PolarHBondContact O-N 2.8Å; D91-P93 WeakPolarHBondContact O-CD 3.42Å
92	F	93.1	Very high	72	Confident	9 Å²	9	76.4 Å²	76.4	4%	0.039	42%	0.417	C	S	.	.			trans	-121.8	63.2	178.7	-59.6	-79.1	0	0	0	109.8	L90 V94 H95 E96 Q117 K118 D119 V120 W400 I404	L90-F92 HydrophobicContact CB-CD2 4.39Å; L90-F92 HydrophobicContact CB-CE2 3.53Å; L90-F92 HydrophobicContact CB-CZ 3.61Å; L90-F92 HydrophobicContact CG-CZ 4.48Å; L90-F92 WeakPolarHBondContact O-CD2 3.21Å; L90-F92 WeakPolarHBondContact O-CE2 3.42Å; F92-V94 VanDerWaalsContact C-N 3.27Å; F92-V94 PolarHBondContact O-N 2.65Å; F92-H95 HydrophobicContact CB-CB 3.84Å; F92-H95 AromaticContact CD1-ND1 3.97Å; F92-H95 PolarHBondContact O-N 3.32Å; F92-H95 VanDerWaalsContact O-N 3.12Å; F92-E96 PolarHBondContact O-N 3.48Å; F92-Q117 HydrophobicContact CD1-CG 4.28Å; F92-Q117 HydrophobicContact CE1-CG 4.19Å; F92-K118 VanDerWaalsContact CE1-O 3.29Å; F92-K118 WeakPolarHBondContact CE1-O 3.43Å; F92-D119 HydrophobicContact CD1-CB 4.18Å; F92-D119 VanDerWaalsContact CE1-CA 3.48Å; F92-D119 HydrophobicContact CE1-CB 4.21Å; F92-D119 HydrophobicContact CG-CB 4.36Å; F92-D119 HydrophobicContact CZ-CB 4.38Å; F92-V120 HydrophobicContact CE2-CG1 3.76Å; F92-V120 HydrophobicContact CZ-CG1 4.11Å; F92-W400 HydrophobicContact CB-CH2 4.03Å; F92-W400 HydrophobicContact CB-CZ2 3.98Å; F92-I404 HydrophobicContact CD2-CD1 3.64Å; F92-I404 HydrophobicContact CD2-CG1 4.18Å; F92-I404 HydrophobicContact CE2-CD1 3.92Å
93	P	93.5	Very high	74.6	Confident	14 Å²	14	69.8 Å²	69.8	9%	0.091	39%	0.393	C	S	.	.	H	α-helix	trans	-66.7	-29.7	-169.4	27.6	-36.3	0	0	0	112.6	D91 C97 L109	D91-P93 WeakPolarHBondContact O-CD 3.42Å; P93-C97 PolarHBondContact O-N 3.19Å; P93-C97 VanDerWaalsContact O-N 3.16Å; P93-C97 PolarHBondContact O-SG 3.09Å; P93-C97 VanDerWaalsContact O-SG 3.4Å; P93-L109 HydrophobicContact CB-CD1 4.01Å
94	V	96.3	Very high	77.8	Confident	4 Å²	4	73 Å²	73	2%	0.024	39%	0.393	C	S	.	.	H	α-helix	trans	-70.3	-44.7	174.3	-175.3	0	0	0	0	110.6	F92 C97 V98 L106 L109 Q113 I115 P125	F92-V94 VanDerWaalsContact C-N 3.27Å; F92-V94 PolarHBondContact O-N 2.65Å; V94-C97 PolarHBondContact O-N 2.83Å; V94-C97 PolarHBondContact O-SG 3.25Å; V94-V98 WeakPolarHBondContact O-CB 3.43Å; V94-V98 VanDerWaalsContact O-CG2 3.27Å; V94-V98 WeakPolarHBondContact O-CG2 3.46Å; V94-V98 PolarHBondContact O-N 3.28Å; V94-V98 VanDerWaalsContact O-N 3.08Å; V94-L106 HydrophobicContact CG1-CD1 3.73Å; V94-L109 HydrophobicContact CG2-CB 4.23Å; V94-Q113 HydrophobicContact CG2-CB 3.39Å; V94-Q113 HydrophobicContact CG2-CG 4.02Å; V94-I115 HydrophobicContact CG1-CG2 4.46Å; V94-P125 HydrophobicContact CB-CG 4.15Å; V94-P125 HydrophobicContact CG1-CB 3.82Å; V94-P125 HydrophobicContact CG1-CG 3.57Å
95	H	96.4	Very high	80.7	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.009	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-44	176.6	-62.3	70.1	0	0	0	111.6	F92 V98 F99 Q117 D119 N123 P125 L128 W400	F92-H95 HydrophobicContact CB-CB 3.84Å; F92-H95 AromaticContact CD1-ND1 3.97Å; F92-H95 PolarHBondContact O-N 3.32Å; F92-H95 VanDerWaalsContact O-N 3.12Å; H95-V98 PolarHBondContact O-N 3.37Å; H95-F99 VanDerWaalsContact O-CB 3.24Å; H95-F99 WeakPolarHBondContact O-CB 3.33Å; H95-F99 PolarHBondContact O-N 3.09Å; H95-Q117 PolarHBondContact CE1-O 3.44Å; H95-Q117 PolarHBondContact NE2-O 2.98Å; H95-Q117 VanDerWaalsContact NE2-O 3.14Å; H95-D119 IonicContact CD2-OD2 2.77Å; H95-D119 PolarHBondContact NE2-N 3.07Å; H95-N123 PolarHBondContact CD2-O 2.95Å; H95-N123 PolarHBondContact NE2-O 2.87Å; H95-P125 WeakPolarHBondContact NE2-CD 3.39Å; H95-L128 HydrophobicContact CB-CD1 3.71Å; H95-W400 HydrophobicContact CB-CH2 3.45Å; H95-W400 VanDerWaalsContact CB-CH2 3.45Å; H95-W400 HydrophobicContact CB-CZ2 4.43Å; H95-W400 HydrophobicContact CB-CZ3 3.84Å
96	E	95.5	Very high	83.6	Confident	31 Å²	31	65.5 Å²	65.5	15%	0.145	34%	0.342	C	S	.	.	H	α-helix	trans	-59.6	-48.8	178.5	-175.5	-165.2	-170.7	0	0	111.6	F92 V98 F99 K100 R105 W400	F92-E96 PolarHBondContact O-N 3.48Å; E96-V98 VanDerWaalsContact C-N 3.32Å; E96-V98 PolarHBondContact O-N 3.36Å; E96-F99 WeakPolarHBondContact O-CB 3.45Å; E96-F99 PolarHBondContact O-N 3.05Å; E96-K100 HydrophobicContact CG-CD 4.12Å; E96-K100 WeakPolarHBondContact O-CG 3.49Å; E96-K100 PolarHBondContact O-N 3.47Å; E96-K100 IonicContact OE1-NZ 3.56Å; E96-K100 PolarHBondContact OE1-NZ 2.91Å; E96-R105 IonicContact OE1-NH1 2.97Å; E96-R105 IonicContact OE2-CZ 3.15Å; E96-R105 VanDerWaalsContact OE2-CZ 3.3Å; E96-R105 IonicContact OE2-NH1 2.82Å; E96-R105 PolarHBondContact OE2-NH1 3.08Å; E96-R105 IonicContact OE2-NH2 2.7Å; E96-R105 PolarHBondContact OE2-NH2 3.26Å; E96-W400 HydrophobicContact CB-CD2 3.98Å; E96-W400 HydrophobicContact CB-CE3 4.49Å; E96-W400 HydrophobicContact CB-CG 4.36Å; E96-W400 HydrophobicContact CB-CZ2 4Å; E96-W400 HydrophobicContact CG-CD2 3.99Å; E96-W400 HydrophobicContact CG-CG 3.83Å
97	C	95.4	Very high	86.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.7	-38.8	-179.9	69.4	0	0	0	0	111.7	P93 V94 K100 G101 D102 R105	P93-C97 PolarHBondContact O-N 3.19Å; P93-C97 VanDerWaalsContact O-N 3.16Å; P93-C97 PolarHBondContact O-SG 3.09Å; P93-C97 VanDerWaalsContact O-SG 3.4Å; V94-C97 PolarHBondContact O-N 2.83Å; V94-C97 PolarHBondContact O-SG 3.25Å; C97-K100 CarbonylContact O-C 3.55Å; C97-K100 PolarHBondContact O-N 3.01Å; C97-G101 PolarHBondContact O-N 2.79Å; C97-D102 HydrophobicContact CB-CB 4.27Å; C97-D102 PolarHBondContact O-N 3.14Å; C97-R105 HydrophobicContact CB-CB 4.12Å; C97-R105 HydrophobicContact CB-CG 4.01Å
98	V	97.2	Very high	88.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-43.4	174	171	0	0	0	0	111.3	V94 H95 E96 K100 G101 L106 P125 L128 A129 H134 C137 L141	V94-V98 WeakPolarHBondContact O-CB 3.43Å; V94-V98 VanDerWaalsContact O-CG2 3.27Å; V94-V98 WeakPolarHBondContact O-CG2 3.46Å; V94-V98 PolarHBondContact O-N 3.28Å; V94-V98 VanDerWaalsContact O-N 3.08Å; H95-V98 PolarHBondContact O-N 3.37Å; E96-V98 VanDerWaalsContact C-N 3.32Å; E96-V98 PolarHBondContact O-N 3.36Å; V98-K100 PolarHBondContact O-N 3.08Å; V98-G101 PolarHBondContact O-N 2.85Å; V98-L106 HydrophobicContact CG2-CD1 3.89Å; V98-L106 HydrophobicContact CG2-CD2 3.82Å; V98-L106 HydrophobicContact CG2-CG 4.4Å; V98-P125 WeakPolarHBondContact CG1-O 2.96Å; V98-P125 HydrophobicContact CG2-CB 4.04Å; V98-L128 HydrophobicContact CG1-CB 4.01Å; V98-A129 HydrophobicContact CG1-CB 3.56Å; V98-H134 PolarHBondContact O-ND1 2.87Å; V98-C137 HydrophobicContact CG1-CB 4.31Å; V98-C137 HydrophobicContact CG2-CB 4.36Å; V98-L141 HydrophobicContact CG2-CD1 4.07Å
99	F	95.6	Very high	91.4	Very high	10 Å²	10	53 Å²	53	4%	0.044	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-36.6	177.1	-170.8	-78.6	0	0	0	111.4	H95 E96 M132 H134 I398 W400 Y403 L414	H95-F99 VanDerWaalsContact O-CB 3.24Å; H95-F99 WeakPolarHBondContact O-CB 3.33Å; H95-F99 PolarHBondContact O-N 3.09Å; E96-F99 WeakPolarHBondContact O-CB 3.45Å; E96-F99 PolarHBondContact O-N 3.05Å; F99-M132 HydrophobicContact CE1-CE 4.32Å; F99-M132 HydrophobicContact CE2-SD 4.39Å; F99-M132 HydrophobicContact CZ-CE 4.41Å; F99-H134 PolarHBondContact O-CE1 2.85Å; F99-H134 VanDerWaalsContact O-CE1 3.23Å; F99-I398 VanDerWaalsContact CE1-O 3.29Å; F99-I398 WeakPolarHBondContact CE1-O 3.38Å; F99-I398 HydrophobicContact CZ-CG2 4.34Å; F99-I398 WeakPolarHBondContact CZ-O 3.38Å; F99-W400 HydrophobicContact CB-CE3 3.67Å; F99-W400 HydrophobicContact CB-CZ3 4.14Å; F99-W400 HydrophobicContact CD1-CB 3.97Å; F99-W400 HydrophobicContact CD1-CE3 4.28Å; F99-W400 AromaticContact CD2-CE3 3.79Å; F99-W400 HydrophobicContact CD2-CE3 3.79Å; F99-W400 HydrophobicContact CD2-CZ3 4.25Å; F99-W400 HydrophobicContact CE1-CB 4.23Å; F99-W400 HydrophobicContact CG-CB 4.5Å; F99-W400 AromaticContact CG-CE3 3.66Å; F99-W400 HydrophobicContact CG-CE3 3.66Å; F99-W400 HydrophobicContact CG-CZ3 4.37Å; F99-Y403 HydrophobicContact CD2-CD1 4.23Å; F99-Y403 HydrophobicContact CD2-CG 4.34Å; F99-Y403 HydrophobicContact CE2-CD1 4.08Å; F99-Y403 HydrophobicContact CE2-CD2 4.22Å; F99-Y403 AromaticContact CE2-CG 3.74Å; F99-Y403 HydrophobicContact CE2-CG 3.74Å; F99-L414 HydrophobicContact CD2-CD1 4.43Å; F99-L414 HydrophobicContact CE2-CD1 3.93Å; F99-L414 HydrophobicContact CE2-CD2 3.74Å; F99-L414 HydrophobicContact CZ-CD2 4.09Å
100	K	94.4	Very high	93.3	Very high	111 Å²	111	50.2 Å²	50.2	48%	0.483	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-5.4	177.1	-67.1	177.7	178.6	176.3	0	113.9	E96 C97 V98 D102	E96-K100 HydrophobicContact CG-CD 4.12Å; E96-K100 WeakPolarHBondContact O-CG 3.49Å; E96-K100 PolarHBondContact O-N 3.47Å; E96-K100 IonicContact OE1-NZ 3.56Å; E96-K100 PolarHBondContact OE1-NZ 2.91Å; C97-K100 CarbonylContact O-C 3.55Å; C97-K100 PolarHBondContact O-N 3.01Å; V98-K100 PolarHBondContact O-N 3.08Å; K100-D102 VanDerWaalsContact C-N 3.27Å; K100-D102 PolarHBondContact O-N 3.23Å
101	G	95.7	Very high	94.8	Very high	28 Å²	28	53.8 Å²	53.8	29%	0.289	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	19.2	-176.1	0	0	0	0	0	114.3	C97 V98 V103 H134	C97-G101 PolarHBondContact O-N 2.79Å; V98-G101 PolarHBondContact O-N 2.85Å; G101-V103 PolarHBondContact O-N 2.91Å; G101-H134 VanDerWaalsContact CA-ND1 3.33Å; G101-H134 WeakPolarHBondContact CA-ND1 3.28Å; G101-H134 PolarHBondContact N-CE1 3.19Å; G101-H134 PolarHBondContact N-ND1 2.88Å
102	D	96.8	Very high	95	Very high	64 Å²	64	53.6 Å²	53.6	34%	0.342	26%	0.264	S	S	.	.			trans	-81.8	81.7	-178.5	-173.4	-8.5	0	0	0	111.4	C97 K100 R104 R105 L106	C97-D102 HydrophobicContact CB-CB 4.27Å; C97-D102 PolarHBondContact O-N 3.14Å; K100-D102 VanDerWaalsContact C-N 3.27Å; K100-D102 PolarHBondContact O-N 3.23Å; D102-R104 PolarHBondContact O-N 3.03Å; D102-R104 PolarHBondContact OD1-N 3.05Å; D102-R105 HydrophobicContact CB-CB 4.22Å; D102-R105 PolarHBondContact O-N 3.16Å; D102-R105 PolarHBondContact OD1-N 3.37Å; D102-R105 WeakPolarHBondContact OD2-CB 3.28Å; D102-L106 WeakPolarHBondContact O-CB 3.4Å; D102-L106 PolarHBondContact O-N 3.49Å
103	V	97.3	Very high	95	Very high	51 Å²	51	57 Å²	57	31%	0.309	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-33.2	179.3	-175.9	0	0	0	0	112	G101 S107 E136 L140	G101-V103 PolarHBondContact O-N 2.91Å; V103-S107 WeakPolarHBondContact O-CB 3.27Å; V103-S107 PolarHBondContact O-N 3.17Å; V103-E136 HydrophobicContact CG1-CB 4.44Å; V103-E136 HydrophobicContact CG2-CB 3.66Å; V103-L140 HydrophobicContact CG1-CD2 4.26Å
104	R	96.6	Very high	95	Very high	224 Å²	224	60.8 Å²	60.8	85%	0.845	30%	0.3	S	S	*	.	H	α-helix	trans	-69.9	-48.9	-177.7	-67.2	-177.1	-175.2	174.1	2.6	110.6	D102 L106 S107 S108	D102-R104 PolarHBondContact O-N 3.03Å; D102-R104 PolarHBondContact OD1-N 3.05Å; R104-L106 VanDerWaalsContact C-N 3.32Å; R104-S107 PolarHBondContact O-N 2.74Å; R104-S108 PolarHBondContact O-N 3.47Å
105	R	96	Very high	94.9	Very high	90 Å²	90	61.7 Å²	61.7	34%	0.34	30%	0.304	S	S	.	.	H	α-helix	trans	-63.6	-40.1	175.3	-175.9	175.9	168.6	-156.5	-7.2	111	E96 C97 D102 S107 S108 L109	E96-R105 IonicContact OE1-NH1 2.97Å; E96-R105 IonicContact OE2-CZ 3.15Å; E96-R105 VanDerWaalsContact OE2-CZ 3.3Å; E96-R105 IonicContact OE2-NH1 2.82Å; E96-R105 PolarHBondContact OE2-NH1 3.08Å; E96-R105 IonicContact OE2-NH2 2.7Å; E96-R105 PolarHBondContact OE2-NH2 3.26Å; C97-R105 HydrophobicContact CB-CB 4.12Å; C97-R105 HydrophobicContact CB-CG 4.01Å; D102-R105 HydrophobicContact CB-CB 4.22Å; D102-R105 PolarHBondContact O-N 3.16Å; D102-R105 PolarHBondContact OD1-N 3.37Å; D102-R105 WeakPolarHBondContact OD2-CB 3.28Å; R105-S107 PolarHBondContact O-N 3Å; R105-S108 PolarHBondContact O-N 2.89Å; R105-L109 HydrophobicContact CG-CD1 3.89Å; R105-L109 HydrophobicContact CG-CG 4.37Å; R105-L109 WeakPolarHBondContact O-CG 3.3Å; R105-L109 PolarHBondContact O-N 3.19Å
106	L	97.2	Very high	94.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-57	-47.8	173.8	177.6	59.2	0	0	0	112	V94 V98 D102 R104 S108 L109 I110 C137 L140 L141	V94-L106 HydrophobicContact CG1-CD1 3.73Å; V98-L106 HydrophobicContact CG2-CD1 3.89Å; V98-L106 HydrophobicContact CG2-CD2 3.82Å; V98-L106 HydrophobicContact CG2-CG 4.4Å; D102-L106 WeakPolarHBondContact O-CB 3.4Å; D102-L106 PolarHBondContact O-N 3.49Å; R104-L106 VanDerWaalsContact C-N 3.32Å; L106-S108 PolarHBondContact O-N 3.07Å; L106-L109 PolarHBondContact O-N 2.99Å; L106-L109 VanDerWaalsContact O-N 3.1Å; L106-I110 WeakPolarHBondContact O-CB 3.43Å; L106-I110 PolarHBondContact O-N 2.87Å; L106-C137 HydrophobicContact CD2-CB 3.73Å; L106-L140 HydrophobicContact CB-CD2 4.4Å; L106-L140 HydrophobicContact CD2-CB 4.48Å; L106-L140 HydrophobicContact CD2-CD2 3.94Å; L106-L140 HydrophobicContact CD2-CG 4.48Å; L106-L140 HydrophobicContact CG-CD2 3.86Å; L106-L141 HydrophobicContact CD1-CD2 4.21Å; L106-L141 HydrophobicContact CD2-CG 4.34Å
107	S	96.4	Very high	94.8	Very high	47 Å²	47	65 Å²	65	33%	0.329	33%	0.327	S	S	.	.	H	α-helix	trans	-59.8	-31.5	178.6	-172.9	0	0	0	0	113.3	V103 R104 R105 I110	V103-S107 WeakPolarHBondContact O-CB 3.27Å; V103-S107 PolarHBondContact O-N 3.17Å; R104-S107 PolarHBondContact O-N 2.74Å; R105-S107 PolarHBondContact O-N 3Å; S107-I110 WeakPolarHBondContact O-CG2 3.22Å
108	S	94.6	Very high	94.8	Very high	85 Å²	85	69.6 Å²	69.6	59%	0.594	35%	0.347	S	S	*	.	H	α-helix	trans	-74.2	-43.8	173.1	-171.2	0	0	0	0	112.3	R104 R105 L106	R104-S108 PolarHBondContact O-N 3.47Å; R105-S108 PolarHBondContact O-N 2.89Å; L106-S108 PolarHBondContact O-N 3.07Å
109	L	93.8	Very high	94.6	Very high	31 Å²	31	70 Å²	70	16%	0.162	35%	0.35	C	S	.	.	H	α-helix	trans	-77.4	-30.7	-172.9	-69.2	175.8	0	0	0	113.3	P93 V94 R105 L106 R111 T112 Q113	P93-L109 HydrophobicContact CB-CD1 4.01Å; V94-L109 HydrophobicContact CG2-CB 4.23Å; R105-L109 HydrophobicContact CG-CD1 3.89Å; R105-L109 HydrophobicContact CG-CG 4.37Å; R105-L109 WeakPolarHBondContact O-CG 3.3Å; R105-L109 PolarHBondContact O-N 3.19Å; L106-L109 PolarHBondContact O-N 2.99Å; L106-L109 VanDerWaalsContact O-N 3.1Å; L109-R111 PolarHBondContact O-N 3.34Å; L109-T112 PolarHBondContact O-N 3.39Å; L109-T112 PolarHBondContact O-OG1 3.26Å; L109-Q113 HydrophobicContact CB-CG 4.21Å; L109-Q113 HydrophobicContact CD2-CG 4.19Å; L109-Q113 WeakPolarHBondContact O-CB 3.49Å; L109-Q113 PolarHBondContact O-N 3.4Å
110	I	93.9	Very high	94.5	Very high	11 Å²	11	72.1 Å²	72.1	6%	0.056	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.3	-173.8	-164.4	152	0	0	0	113.9	L106 S107 I115 L140 L141 H144	L106-I110 WeakPolarHBondContact O-CB 3.43Å; L106-I110 PolarHBondContact O-N 2.87Å; S107-I110 WeakPolarHBondContact O-CG2 3.22Å; I110-I115 HydrophobicContact CD1-CG2 4Å; I110-I115 HydrophobicContact CG1-CG2 3.63Å; I110-L140 HydrophobicContact CD1-CG 4.27Å; I110-L141 HydrophobicContact CD1-CD2 3.94Å; I110-H144 HydrophobicContact CD1-CB 3.61Å; I110-H144 HydrophobicContact CG1-CB 3.9Å
111	R	90.1	Very high	94.3	Very high	202 Å²	202	66.8 Å²	66.8	76%	0.762	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-23.2	178.9	-63.8	-179.2	-179.1	164.4	0.6	113.7	L109	L109-R111 PolarHBondContact O-N 3.34Å
112	T	90.2	Very high	94.2	Very high	111 Å²	111	66 Å²	66	68%	0.681	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	-21.7	-172.2	57.4	0	0	0	0	113.2	L109	L109-T112 PolarHBondContact O-N 3.39Å; L109-T112 PolarHBondContact O-OG1 3.26Å
113	Q	92.3	Very high	94.2	Very high	80 Å²	80	63.1 Å²	63.1	37%	0.374	32%	0.316	S	S	.	.	S	Bend	trans	-105	153.6	-174.7	-62.6	-62.2	-25.4	0	0	112	V94 L109 I115	V94-Q113 HydrophobicContact CG2-CB 3.39Å; V94-Q113 HydrophobicContact CG2-CG 4.02Å; L109-Q113 HydrophobicContact CB-CG 4.21Å; L109-Q113 HydrophobicContact CD2-CG 4.19Å; L109-Q113 WeakPolarHBondContact O-CB 3.49Å; L109-Q113 PolarHBondContact O-N 3.4Å; Q113-I115 PolarHBondContact O-N 3.02Å
114	N	92.6	Very high	94.2	Very high	94 Å²	94	60.7 Å²	60.7	50%	0.503	30%	0.302	S	S	.	.			trans	-80.6	106.4	-178.6	-177.3	2.7	0	0	0	112	A116 Q117	N114-A116 PolarHBondContact O-N 3.21Å; N114-A116 WeakPolarHBondContact OD1-CA 3.09Å; N114-A116 WeakPolarHBondContact OD1-CB 3.42Å; N114-A116 PolarHBondContact OD1-N 2.87Å; N114-Q117 HydrophobicContact CB-CB 4.38Å; N114-Q117 VanDerWaalsContact O-CB 3.32Å; N114-Q117 WeakPolarHBondContact O-CB 3.43Å; N114-Q117 PolarHBondContact O-N 3.15Å
115	I	94.8	Very high	94.2	Very high	23 Å²	23	50 Å²	50	12%	0.118	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-8	176.4	62.6	179.3	0	0	0	115	V94 I110 Q113 P125 L141 H144 A146	V94-I115 HydrophobicContact CG1-CG2 4.46Å; I110-I115 HydrophobicContact CD1-CG2 4Å; I110-I115 HydrophobicContact CG1-CG2 3.63Å; Q113-I115 PolarHBondContact O-N 3.02Å; I115-P125 WeakPolarHBondContact O-CD 3.31Å; I115-L141 HydrophobicContact CB-CD2 4.13Å; I115-L141 HydrophobicContact CG2-CD2 3.88Å; I115-H144 HydrophobicContact CD1-CB 4.02Å; I115-H144 VanDerWaalsContact CD1-O 3.23Å; I115-H144 WeakPolarHBondContact CD1-O 3.48Å; I115-A146 HydrophobicContact CD1-CB 3.98Å
116	A	95.5	Very high	94.3	Very high	45 Å²	45	45.7 Å²	45.7	37%	0.372	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-5	173.1	0	0	0	0	0	112.7	N114 K118 P147	N114-A116 PolarHBondContact O-N 3.21Å; N114-A116 WeakPolarHBondContact OD1-CA 3.09Å; N114-A116 WeakPolarHBondContact OD1-CB 3.42Å; N114-A116 PolarHBondContact OD1-N 2.87Å; A116-K118 PolarHBondContact O-N 2.98Å; A116-P147 HydrophobicContact CB-CG 3.83Å
117	Q	94.9	Very high	94.3	Very high	57 Å²	57	45.7 Å²	45.7	27%	0.266	25%	0.245	S	C	.	.			trans	-60.4	136.4	177.9	-178.5	175.6	-8.9	0	0	110.3	F92 H95 N114	F92-Q117 HydrophobicContact CD1-CG 4.28Å; F92-Q117 HydrophobicContact CE1-CG 4.19Å; H95-Q117 PolarHBondContact CE1-O 3.44Å; H95-Q117 PolarHBondContact NE2-O 2.98Å; H95-Q117 VanDerWaalsContact NE2-O 3.14Å; N114-Q117 HydrophobicContact CB-CB 4.38Å; N114-Q117 VanDerWaalsContact O-CB 3.32Å; N114-Q117 WeakPolarHBondContact O-CB 3.43Å; N114-Q117 PolarHBondContact O-N 3.15Å
118	K	95.1	Very high	94.3	Very high	97 Å²	97	43.5 Å²	43.5	42%	0.422	23%	0.23	S	C	.	.			trans	-95.3	138.7	172.7	-66.9	-174.9	179.7	-169.7	0	109.8	F92 A116 G122 N123 T124 K151	F92-K118 VanDerWaalsContact CE1-O 3.29Å; F92-K118 WeakPolarHBondContact CE1-O 3.43Å; A116-K118 PolarHBondContact O-N 2.98Å; K118-G122 WeakPolarHBondContact CD-O 3.42Å; K118-G122 WeakPolarHBondContact CG-O 3.45Å; K118-N123 CarbonylContact C-O 3.58Å; K118-N123 WeakPolarHBondContact CA-O 3.23Å; K118-T124 HydrophobicContact CG-CG2 4.03Å; K118-K151 PolarHBondContact NZ-O 2.84Å
119	D	93.8	Very high	94.4	Very high	10 Å²	10	39.4 Å²	39.4	5%	0.053	20%	0.201	C	C	.	.			trans	-75.2	-174.3	170.8	68.2	16.4	0	0	0	112.2	F92 H95 H121 G122 N123 Y403 I404	F92-D119 HydrophobicContact CD1-CB 4.18Å; F92-D119 VanDerWaalsContact CE1-CA 3.48Å; F92-D119 HydrophobicContact CE1-CB 4.21Å; F92-D119 HydrophobicContact CG-CB 4.36Å; F92-D119 HydrophobicContact CZ-CB 4.38Å; H95-D119 IonicContact CD2-OD2 2.77Å; H95-D119 PolarHBondContact NE2-N 3.07Å; D119-H121 PolarHBondContact O-N 2.85Å; D119-H121 VanDerWaalsContact O-N 3.15Å; D119-H121 WeakPolarHBondContact OD1-CA 2.91Å; D119-H121 PolarHBondContact OD1-N 2.94Å; D119-G122 PolarHBondContact O-N 2.96Å; D119-G122 PolarHBondContact OD1-N 3.14Å; D119-G122 VanDerWaalsContact OD1-N 3.08Å; D119-N123 PolarHBondContact N-O 3.29Å; D119-N123 PolarHBondContact OD1-N 2.84Å; D119-Y403 VanDerWaalsContact OD2-CE1 3.24Å; D119-Y403 WeakPolarHBondContact OD2-CE1 3.33Å; D119-Y403 PolarHBondContact OD2-OH 3.25Å; D119-I404 HydrophobicContact CB-CD1 4.26Å
120	V	91.8	Very high	94.6	Very high	53 Å²	53	38.2 Å²	38.2	32%	0.321	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.1	179.7	-54.4	0	0	0	0	113.6	F92 I404 N408	F92-V120 HydrophobicContact CE2-CG1 3.76Å; F92-V120 HydrophobicContact CZ-CG1 4.11Å; V120-I404 HydrophobicContact CG1-CD1 4.06Å; V120-I404 HydrophobicContact CG2-CD1 3.82Å; V120-N408 PolarHBondContact O-OD1 2.67Å
121	H	92.1	Very high	94.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	8	178.2	-58.6	-59.8	0	0	0	112.2	D119 N123 A153 Y403 A406 A411	D119-H121 PolarHBondContact O-N 2.85Å; D119-H121 VanDerWaalsContact O-N 3.15Å; D119-H121 WeakPolarHBondContact OD1-CA 2.91Å; D119-H121 PolarHBondContact OD1-N 2.94Å; H121-N123 PolarHBondContact O-N 3.07Å; H121-A153 WeakPolarHBondContact O-CB 3.4Å; H121-A153 PolarHBondContact O-N 2.82Å; H121-Y403 AromaticContact CD2-CE1 3.91Å; H121-Y403 AromaticContact CD2-CE2 3.6Å; H121-Y403 AromaticContact CD2-CZ 3.43Å; H121-Y403 VanDerWaalsContact CD2-CZ 3.43Å; H121-Y403 PolarHBondContact NE2-O 3.45Å; H121-A406 PolarHBondContact CE1-O 3.15Å; H121-A411 HydrophobicContact CB-CB 4.24Å
122	G	93.4	Very high	94.7	Very high	12 Å²	12	31 Å²	31	12%	0.124	17%	0.17	C	C	.	.	S	Bend	trans	78	2.3	-179.2	0	0	0	0	0	114.2	K118 D119 N152	K118-G122 WeakPolarHBondContact CD-O 3.42Å; K118-G122 WeakPolarHBondContact CG-O 3.45Å; D119-G122 PolarHBondContact O-N 2.96Å; D119-G122 PolarHBondContact OD1-N 3.14Å; D119-G122 VanDerWaalsContact OD1-N 3.08Å; G122-N152 WeakPolarHBondContact O-CA 3.36Å
123	N	95.3	Very high	94.9	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.011	15%	0.147	C	C	.	.			trans	-78	136	-179.4	-72.6	-44.4	0	0	0	110.3	H95 K118 D119 H121 H127 L128 N152 Y403	H95-N123 PolarHBondContact CD2-O 2.95Å; H95-N123 PolarHBondContact NE2-O 2.87Å; K118-N123 CarbonylContact C-O 3.58Å; K118-N123 WeakPolarHBondContact CA-O 3.23Å; D119-N123 PolarHBondContact N-O 3.29Å; D119-N123 PolarHBondContact OD1-N 2.84Å; H121-N123 PolarHBondContact O-N 3.07Å; N123-H127 HydrophobicContact CB-CB 3.94Å; N123-L128 HydrophobicContact CB-CD2 4.29Å; N123-L128 HydrophobicContact CB-CG 4.38Å; N123-N152 WeakPolarHBondContact OD1-CB 3.31Å; N123-N152 PolarHBondContact OD1-ND2 2.95Å; N123-N152 VanDerWaalsContact OD1-ND2 3.08Å; N123-Y403 PolarHBondContact ND2-OH 3.28Å
124	T	97.3	Very high	95.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.139	C	C	.	.			trans	-83.1	164.7	165.1	66.4	0	0	0	0	109.5	K118 L126 H127 L128 V150	K118-T124 HydrophobicContact CG-CG2 4.03Å; T124-L126 PolarHBondContact O-N 2.81Å; T124-L126 VanDerWaalsContact O-N 3.12Å; T124-H127 PolarHBondContact N-ND1 2.81Å; T124-H127 VanDerWaalsContact N-ND1 3.13Å; T124-H127 WeakPolarHBondContact O-CB 3.44Å; T124-H127 PolarHBondContact O-N 2.85Å; T124-H127 PolarHBondContact OG1-ND1 2.73Å; T124-L128 PolarHBondContact O-N 2.86Å; T124-V150 HydrophobicContact CG2-CG2 3.9Å
125	P	97.6	Very high	95.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-53.9	-34.7	174.2	-24.7	34.5	0	0	0	112.2	V94 H95 V98 I115 H127 L128 A129 L141	V94-P125 HydrophobicContact CB-CG 4.15Å; V94-P125 HydrophobicContact CG1-CB 3.82Å; V94-P125 HydrophobicContact CG1-CG 3.57Å; H95-P125 WeakPolarHBondContact NE2-CD 3.39Å; V98-P125 WeakPolarHBondContact CG1-O 2.96Å; V98-P125 HydrophobicContact CG2-CB 4.04Å; I115-P125 WeakPolarHBondContact O-CD 3.31Å; P125-H127 PolarHBondContact O-N 3.39Å; P125-L128 PolarHBondContact O-N 2.78Å; P125-A129 PolarHBondContact O-N 3.02Å; P125-L141 HydrophobicContact CB-CD1 3.93Å; P125-L141 HydrophobicContact CB-CD2 4.06Å
126	L	98.4	Very high	95.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.2	-34.9	177.7	-175.9	62.8	0	0	0	113.1	T124 V130 A138 L141 L142 A146 V148 P158 L174	T124-L126 PolarHBondContact O-N 2.81Å; T124-L126 VanDerWaalsContact O-N 3.12Å; L126-V130 HydrophobicContact CD1-CG2 4.4Å; L126-V130 VanDerWaalsContact O-CG2 3.27Å; L126-V130 WeakPolarHBondContact O-CG2 3.42Å; L126-V130 PolarHBondContact O-N 3.04Å; L126-A138 HydrophobicContact CD1-CB 4.11Å; L126-L141 HydrophobicContact CB-CD1 4.26Å; L126-L141 HydrophobicContact CD1-CB 4.2Å; L126-L141 HydrophobicContact CD1-CD1 4.41Å; L126-L142 HydrophobicContact CD1-CD2 4.13Å; L126-L142 HydrophobicContact CD1-CG 4.11Å; L126-L142 HydrophobicContact CD2-CD2 3.76Å; L126-A146 HydrophobicContact CB-CB 4.37Å; L126-A146 HydrophobicContact CD2-CB 4.16Å; L126-V148 HydrophobicContact CD2-CG1 3.76Å; L126-P158 HydrophobicContact CB-CG 4.5Å; L126-P158 HydrophobicContact CD2-CB 3.92Å; L126-P158 HydrophobicContact CD2-CG 4Å; L126-P158 HydrophobicContact CG-CB 3.93Å; L126-P158 HydrophobicContact CG-CG 4.18Å; L126-L174 HydrophobicContact CD1-CD2 4.38Å; L126-L174 HydrophobicContact CD2-CD2 3.87Å; L126-L174 HydrophobicContact CG-CD2 4.36Å
127	H	97.3	Very high	95.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.7	-49.1	172.1	-68.4	84.6	0	0	0	110.1	N123 T124 P125 A129 V130 M131 W156 P158	N123-H127 HydrophobicContact CB-CB 3.94Å; T124-H127 PolarHBondContact N-ND1 2.81Å; T124-H127 VanDerWaalsContact N-ND1 3.13Å; T124-H127 WeakPolarHBondContact O-CB 3.44Å; T124-H127 PolarHBondContact O-N 2.85Å; T124-H127 PolarHBondContact OG1-ND1 2.73Å; P125-H127 PolarHBondContact O-N 3.39Å; H127-A129 PolarHBondContact O-N 2.61Å; H127-V130 PolarHBondContact O-N 2.9Å; H127-M131 HydrophobicContact CB-SD 4.32Å; H127-M131 WeakPolarHBondContact O-CB 3.15Å; H127-M131 WeakPolarHBondContact O-CG 3.39Å; H127-M131 PolarHBondContact O-N 2.84Å; H127-W156 PolarHBondContact NE2-O 3.24Å; H127-W156 VanDerWaalsContact NE2-O 3.15Å; H127-P158 WeakPolarHBondContact NE2-CD 3.15Å
128	L	96.3	Very high	95.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.6	-43.5	-179.3	-65.2	-178.5	0	0	0	112.4	H95 V98 N123 T124 P125 V130 M131 M132 W400 Y403 L414	H95-L128 HydrophobicContact CB-CD1 3.71Å; V98-L128 HydrophobicContact CG1-CB 4.01Å; N123-L128 HydrophobicContact CB-CD2 4.29Å; N123-L128 HydrophobicContact CB-CG 4.38Å; T124-L128 PolarHBondContact O-N 2.86Å; P125-L128 PolarHBondContact O-N 2.78Å; L128-V130 VanDerWaalsContact C-N 3.26Å; L128-V130 PolarHBondContact O-N 2.74Å; L128-M131 PolarHBondContact O-N 2.71Å; L128-M132 VanDerWaalsContact O-CB 3.29Å; L128-M132 WeakPolarHBondContact O-CB 3.3Å; L128-M132 WeakPolarHBondContact O-CG 3.38Å; L128-M132 PolarHBondContact O-N 3.42Å; L128-W400 HydrophobicContact CD1-CZ3 4.16Å; L128-Y403 HydrophobicContact CD1-CE1 4.36Å; L128-Y403 HydrophobicContact CD2-CE1 4.1Å; L128-Y403 HydrophobicContact CD2-CE2 4.31Å; L128-L414 HydrophobicContact CD2-CD1 3.66Å
129	A	97.1	Very high	95.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-57.6	-42.9	178.5	0	0	0	0	0	111.5	V98 P125 H127 G133 H134 C137 A138 L141	V98-A129 HydrophobicContact CG1-CB 3.56Å; P125-A129 PolarHBondContact O-N 3.02Å; H127-A129 PolarHBondContact O-N 2.61Å; A129-G133 CarbonylContact O-C 3.53Å; A129-G133 PolarHBondContact O-N 3.14Å; A129-G133 VanDerWaalsContact O-N 3.13Å; A129-H134 PolarHBondContact O-N 3.02Å; A129-C137 HydrophobicContact CB-CB 4.1Å; A129-A138 HydrophobicContact CB-CB 3.78Å; A129-L141 HydrophobicContact CB-CD1 4.16Å
130	V	96.4	Very high	96.1	Very high	5 Å²	5	24.1 Å²	24.1	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-71.6	-47.8	179.6	172	0	0	0	0	111.4	L126 H127 L128 M132 G133 A138 E161 A162 Y165 M170 L174	L126-V130 HydrophobicContact CD1-CG2 4.4Å; L126-V130 VanDerWaalsContact O-CG2 3.27Å; L126-V130 WeakPolarHBondContact O-CG2 3.42Å; L126-V130 PolarHBondContact O-N 3.04Å; H127-V130 PolarHBondContact O-N 2.9Å; L128-V130 VanDerWaalsContact C-N 3.26Å; L128-V130 PolarHBondContact O-N 2.74Å; V130-M132 VanDerWaalsContact C-N 3.26Å; V130-M132 PolarHBondContact O-N 3.28Å; V130-G133 PolarHBondContact O-N 3.43Å; V130-G133 VanDerWaalsContact O-N 3.08Å; V130-A138 HydrophobicContact CG2-CB 4.5Å; V130-E161 HydrophobicContact CG1-CB 4.02Å; V130-A162 HydrophobicContact CG1-CB 3.52Å; V130-Y165 WeakPolarHBondContact O-CD2 3.41Å; V130-M170 HydrophobicContact CG2-CG 4.12Å; V130-M170 HydrophobicContact CG2-SD 4.35Å; V130-L174 HydrophobicContact CG2-CD1 3.9Å
131	M	94.3	Very high	96.4	Very high	30 Å²	30	21.6 Å²	21.6	15%	0.148	11%	0.11	C	C	.	.	H	α-helix	trans	-60.7	-36.6	-179.4	-68.8	167.5	74.8	0	0	112.2	H127 L128 E161 L414	H127-M131 HydrophobicContact CB-SD 4.32Å; H127-M131 WeakPolarHBondContact O-CB 3.15Å; H127-M131 WeakPolarHBondContact O-CG 3.39Å; H127-M131 PolarHBondContact O-N 2.84Å; L128-M131 PolarHBondContact O-N 2.71Å; M131-E161 HydrophobicContact CG-CB 4.02Å; M131-E161 HydrophobicContact CG-CG 4.03Å; M131-E161 HydrophobicContact SD-CG 4.35Å; M131-L414 HydrophobicContact CB-CB 4.31Å; M131-L414 HydrophobicContact CE-CB 4.17Å; M131-L414 HydrophobicContact CE-CD1 4.11Å; M131-L414 HydrophobicContact CE-CG 4.29Å
132	M	93.1	Very high	96.6	Very high	31 Å²	31	22.1 Å²	22.1	15%	0.153	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.9	178.2	-62.2	-67.9	-69.9	0	0	113.4	F99 L128 V130 H134 N396 L414	F99-M132 HydrophobicContact CE1-CE 4.32Å; F99-M132 HydrophobicContact CE2-SD 4.39Å; F99-M132 HydrophobicContact CZ-CE 4.41Å; L128-M132 VanDerWaalsContact O-CB 3.29Å; L128-M132 WeakPolarHBondContact O-CB 3.3Å; L128-M132 WeakPolarHBondContact O-CG 3.38Å; L128-M132 PolarHBondContact O-N 3.42Å; V130-M132 VanDerWaalsContact C-N 3.26Å; V130-M132 PolarHBondContact O-N 3.28Å; M132-H134 VanDerWaalsContact C-N 3.34Å; M132-N396 HydrophobicContact CE-CB 4Å; M132-N396 HydrophobicContact SD-CB 4.14Å; M132-N396 PolarHBondContact SD-ND2 3.01Å; M132-L414 HydrophobicContact SD-CB 3.86Å; M132-L414 HydrophobicContact SD-CD1 4.29Å; M132-L414 HydrophobicContact SD-CD2 4.38Å; M132-L414 HydrophobicContact SD-CG 4.4Å
133	G	93.9	Very high	96.8	Very high	19 Å²	19	25.2 Å²	25.2	20%	0.196	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	19.7	-175.9	0	0	0	0	0	115.1	A129 V130 K135	A129-G133 CarbonylContact O-C 3.53Å; A129-G133 PolarHBondContact O-N 3.14Å; A129-G133 VanDerWaalsContact O-N 3.13Å; V130-G133 PolarHBondContact O-N 3.43Å; V130-G133 VanDerWaalsContact O-N 3.08Å; G133-K135 VanDerWaalsContact C-N 3.34Å; G133-K135 PolarHBondContact O-N 2.89Å
134	H	96.3	Very high	96.9	Very high	45 Å²	45	29.2 Å²	29.2	21%	0.208	16%	0.155	C	C	.	.			trans	-80.8	77.4	179.5	-63.4	169.7	0	0	0	111	V98 F99 G101 A129 M132 E136 C137 A138	V98-H134 PolarHBondContact O-ND1 2.87Å; F99-H134 PolarHBondContact O-CE1 2.85Å; F99-H134 VanDerWaalsContact O-CE1 3.23Å; G101-H134 VanDerWaalsContact CA-ND1 3.33Å; G101-H134 WeakPolarHBondContact CA-ND1 3.28Å; G101-H134 PolarHBondContact N-CE1 3.19Å; G101-H134 PolarHBondContact N-ND1 2.88Å; A129-H134 PolarHBondContact O-N 3.02Å; M132-H134 VanDerWaalsContact C-N 3.34Å; H134-E136 VanDerWaalsContact C-N 3.34Å; H134-E136 PolarHBondContact O-N 2.93Å; H134-C137 HydrophobicContact CB-CB 4.08Å; H134-C137 WeakPolarHBondContact O-CB 3.32Å; H134-C137 PolarHBondContact O-N 3.46Å; H134-C137 VanDerWaalsContact O-N 3.16Å; H134-A138 PolarHBondContact O-N 3.37Å
135	K	96.4	Very high	96.8	Very high	69 Å²	69	33 Å²	33	30%	0.3	18%	0.176	S	C	.	.	H	α-helix	trans	-57.4	-43	-170.8	-54.6	-168.2	-171.1	-151.6	0	113.2	G133 C137 A138 H139 D167 M170	G133-K135 VanDerWaalsContact C-N 3.34Å; G133-K135 PolarHBondContact O-N 2.89Å; K135-C137 VanDerWaalsContact C-N 3.34Å; K135-C137 PolarHBondContact O-N 3.05Å; K135-A138 PolarHBondContact O-N 3.24Å; K135-H139 PolarHBondContact O-CD2 3.29Å; K135-H139 PolarHBondContact O-N 3.47Å; K135-D167 WeakPolarHBondContact CD-OD2 3.39Å; K135-D167 WeakPolarHBondContact CE-OD2 3.37Å; K135-D167 IonicContact NZ-OD1 3.59Å; K135-D167 PolarHBondContact NZ-OD1 3.08Å; K135-D167 VanDerWaalsContact NZ-OD1 3.1Å; K135-D167 IonicContact NZ-OD2 3.61Å; K135-D167 PolarHBondContact NZ-OD2 3.39Å; K135-M170 HydrophobicContact CB-CE 4.05Å; K135-M170 HydrophobicContact CG-CE 4.35Å
136	E	97.9	Very high	96.7	Very high	126 Å²	126	33 Å²	33	59%	0.589	18%	0.176	S	C	*	.	H	α-helix	trans	-64.5	-40.3	-179	-64.6	73.6	-162.9	0	0	111.3	V103 H134 L140	V103-E136 HydrophobicContact CG1-CB 4.44Å; V103-E136 HydrophobicContact CG2-CB 3.66Å; H134-E136 VanDerWaalsContact C-N 3.34Å; H134-E136 PolarHBondContact O-N 2.93Å; E136-L140 WeakPolarHBondContact O-CB 3.26Å; E136-L140 PolarHBondContact O-N 3.11Å
137	C	98.2	Very high	96.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.8	-45.2	174	-71.3	0	0	0	0	110.9	V98 L106 A129 H134 K135 L140 L141	V98-C137 HydrophobicContact CG1-CB 4.31Å; V98-C137 HydrophobicContact CG2-CB 4.36Å; L106-C137 HydrophobicContact CD2-CB 3.73Å; A129-C137 HydrophobicContact CB-CB 4.1Å; H134-C137 HydrophobicContact CB-CB 4.08Å; H134-C137 WeakPolarHBondContact O-CB 3.32Å; H134-C137 PolarHBondContact O-N 3.46Å; H134-C137 VanDerWaalsContact O-N 3.16Å; K135-C137 VanDerWaalsContact C-N 3.34Å; K135-C137 PolarHBondContact O-N 3.05Å; C137-L140 PolarHBondContact O-N 3.02Å; C137-L141 WeakPolarHBondContact O-CB 3.29Å; C137-L141 WeakPolarHBondContact O-CD1 3.45Å; C137-L141 VanDerWaalsContact O-CG 3.24Å; C137-L141 WeakPolarHBondContact O-CG 3.38Å; C137-L141 PolarHBondContact O-N 3.49Å
138	A	98.2	Very high	96.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-47.9	178.5	0	0	0	0	0	111.6	L126 A129 V130 H134 K135 L140 L141 L142 M170	L126-A138 HydrophobicContact CD1-CB 4.11Å; A129-A138 HydrophobicContact CB-CB 3.78Å; V130-A138 HydrophobicContact CG2-CB 4.5Å; H134-A138 PolarHBondContact O-N 3.37Å; K135-A138 PolarHBondContact O-N 3.24Å; A138-L140 VanDerWaalsContact C-N 3.34Å; A138-L140 PolarHBondContact O-N 3.24Å; A138-L141 PolarHBondContact O-N 3.26Å; A138-L142 VanDerWaalsContact O-CG 3.27Å; A138-L142 WeakPolarHBondContact O-CG 3.47Å; A138-L142 PolarHBondContact O-N 3Å; A138-M170 HydrophobicContact CB-CE 3.52Å; A138-M170 HydrophobicContact CB-SD 3.64Å
139	H	98.3	Very high	96.3	Very high	80 Å²	80	42.3 Å²	42.3	37%	0.37	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-41.1	177.1	-73.2	-57	0	0	0	112.5	K135 L142 A143	K135-H139 PolarHBondContact O-CD2 3.29Å; K135-H139 PolarHBondContact O-N 3.47Å; H139-L142 PolarHBondContact O-N 3.29Å; H139-A143 WeakPolarHBondContact O-CB 3.23Å; H139-A143 PolarHBondContact O-N 3.22Å
140	L	97.9	Very high	96.2	Very high	35 Å²	35	44.2 Å²	44.2	18%	0.183	23%	0.231	C	C	.	.	H	α-helix	trans	-63.1	-43.4	175.8	-178.5	59	0	0	0	111.6	V103 L106 I110 E136 C137 A138 A143 H144	V103-L140 HydrophobicContact CG1-CD2 4.26Å; L106-L140 HydrophobicContact CB-CD2 4.4Å; L106-L140 HydrophobicContact CD2-CB 4.48Å; L106-L140 HydrophobicContact CD2-CD2 3.94Å; L106-L140 HydrophobicContact CD2-CG 4.48Å; L106-L140 HydrophobicContact CG-CD2 3.86Å; I110-L140 HydrophobicContact CD1-CG 4.27Å; E136-L140 WeakPolarHBondContact O-CB 3.26Å; E136-L140 PolarHBondContact O-N 3.11Å; C137-L140 PolarHBondContact O-N 3.02Å; A138-L140 VanDerWaalsContact C-N 3.34Å; A138-L140 PolarHBondContact O-N 3.24Å; L140-A143 PolarHBondContact O-N 3.2Å; L140-H144 PolarHBondContact O-CD2 3.1Å; L140-H144 PolarHBondContact O-N 3.05Å
141	L	98.3	Very high	96	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-43.6	175	-72.5	165.3	0	0	0	111.8	V98 L106 I110 I115 P125 L126 A129 C137 A138 H144 N145 A146	V98-L141 HydrophobicContact CG2-CD1 4.07Å; L106-L141 HydrophobicContact CD1-CD2 4.21Å; L106-L141 HydrophobicContact CD2-CG 4.34Å; I110-L141 HydrophobicContact CD1-CD2 3.94Å; I115-L141 HydrophobicContact CB-CD2 4.13Å; I115-L141 HydrophobicContact CG2-CD2 3.88Å; P125-L141 HydrophobicContact CB-CD1 3.93Å; P125-L141 HydrophobicContact CB-CD2 4.06Å; L126-L141 HydrophobicContact CB-CD1 4.26Å; L126-L141 HydrophobicContact CD1-CB 4.2Å; L126-L141 HydrophobicContact CD1-CD1 4.41Å; A129-L141 HydrophobicContact CB-CD1 4.16Å; C137-L141 WeakPolarHBondContact O-CB 3.29Å; C137-L141 WeakPolarHBondContact O-CD1 3.45Å; C137-L141 VanDerWaalsContact O-CG 3.24Å; C137-L141 WeakPolarHBondContact O-CG 3.38Å; C137-L141 PolarHBondContact O-N 3.49Å; A138-L141 PolarHBondContact O-N 3.26Å; L141-H144 CarbonylContact O-C 3.56Å; L141-H144 PolarHBondContact O-N 2.94Å; L141-N145 PolarHBondContact O-N 3.3Å; L141-A146 HydrophobicContact CB-CB 3.87Å; L141-A146 WeakPolarHBondContact O-CB 3.37Å; L141-A146 PolarHBondContact O-N 2.88Å
142	L	97.8	Very high	95.9	Very high	10 Å²	10	47 Å²	47	5%	0.052	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-39	178	-67.8	172.5	0	0	0	112.6	L126 A138 H139 H144 N145 V148 M170 A173 L174 K177	L126-L142 HydrophobicContact CD1-CD2 4.13Å; L126-L142 HydrophobicContact CD1-CG 4.11Å; L126-L142 HydrophobicContact CD2-CD2 3.76Å; A138-L142 VanDerWaalsContact O-CG 3.27Å; A138-L142 WeakPolarHBondContact O-CG 3.47Å; A138-L142 PolarHBondContact O-N 3Å; H139-L142 PolarHBondContact O-N 3.29Å; L142-H144 PolarHBondContact O-N 3.47Å; L142-N145 PolarHBondContact O-N 3.34Å; L142-V148 HydrophobicContact CD2-CG1 3.55Å; L142-M170 HydrophobicContact CD1-SD 4.47Å; L142-A173 HydrophobicContact CD1-CB 4.17Å; L142-L174 HydrophobicContact CD1-CD2 4.21Å; L142-L174 HydrophobicContact CD1-CG 4.36Å; L142-L174 HydrophobicContact CD2-CD2 3.73Å; L142-K177 HydrophobicContact CD2-CB 4.02Å; L142-K177 HydrophobicContact CD2-CG 3.85Å; L142-K177 WeakPolarHBondContact O-CE 3.44Å; L142-K177 PolarHBondContact O-NZ 3.44Å
143	A	96.8	Very high	95.7	Very high	77 Å²	77	48.5 Å²	48.5	64%	0.636	26%	0.259	S	S	*	.	H	α-helix	trans	-62	-29.5	175.2	0	0	0	0	0	112.3	H139 L140 N145	H139-A143 WeakPolarHBondContact O-CB 3.23Å; H139-A143 PolarHBondContact O-N 3.22Å; L140-A143 PolarHBondContact O-N 3.2Å; A143-N145 VanDerWaalsContact C-N 3.33Å
144	H	96.6	Very high	95.3	Very high	86 Å²	86	49.8 Å²	49.8	40%	0.398	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	21.4	174.9	-79.3	-85.8	0	0	0	113.8	I110 I115 L140 L141 L142 A146	I110-H144 HydrophobicContact CD1-CB 3.61Å; I110-H144 HydrophobicContact CG1-CB 3.9Å; I115-H144 HydrophobicContact CD1-CB 4.02Å; I115-H144 VanDerWaalsContact CD1-O 3.23Å; I115-H144 WeakPolarHBondContact CD1-O 3.48Å; L140-H144 PolarHBondContact O-CD2 3.1Å; L140-H144 PolarHBondContact O-N 3.05Å; L141-H144 CarbonylContact O-C 3.56Å; L141-H144 PolarHBondContact O-N 2.94Å; L142-H144 PolarHBondContact O-N 3.47Å; H144-A146 VanDerWaalsContact C-N 3.32Å; H144-A146 PolarHBondContact O-N 3.42Å
145	N	95.3	Very high	94.9	Very high	79 Å²	79	48.3 Å²	48.3	42%	0.422	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	36.2	178.3	-77.8	6.8	0	0	0	114.3	L141 L142 A143 K177	L141-N145 PolarHBondContact O-N 3.3Å; L142-N145 PolarHBondContact O-N 3.34Å; A143-N145 VanDerWaalsContact C-N 3.33Å; N145-K177 WeakPolarHBondContact OD1-CE 3.3Å; N145-K177 PolarHBondContact OD1-NZ 3.2Å
146	A	96.9	Very high	94.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.245	C	C	.	.			trans	-53.7	135.9	168.4	0	0	0	0	0	110.6	I115 L126 L141 H144 V148 Q181	I115-A146 HydrophobicContact CD1-CB 3.98Å; L126-A146 HydrophobicContact CB-CB 4.37Å; L126-A146 HydrophobicContact CD2-CB 4.16Å; L141-A146 HydrophobicContact CB-CB 3.87Å; L141-A146 WeakPolarHBondContact O-CB 3.37Å; L141-A146 PolarHBondContact O-N 2.88Å; H144-A146 VanDerWaalsContact C-N 3.32Å; H144-A146 PolarHBondContact O-N 3.42Å; A146-V148 PolarHBondContact O-N 3.07Å; A146-Q181 PolarHBondContact O-NE2 2.55Å
147	P	95.4	Very high	94.6	Very high	29 Å²	29	40.9 Å²	40.9	19%	0.188	23%	0.226	C	C	.	.			trans	-69.1	133.1	-176.2	27.9	-34.8	0	0	0	110.8	A116 V150	A116-P147 HydrophobicContact CB-CG 3.83Å; P147-V150 HydrophobicContact CB-CG1 3.86Å; P147-V150 HydrophobicContact CB-CG2 4.14Å; P147-V150 HydrophobicContact CG-CG1 4.02Å; P147-V150 HydrophobicContact CG-CG2 4.08Å; P147-V150 VanDerWaalsContact O-CG2 3.28Å; P147-V150 WeakPolarHBondContact O-CG2 3.48Å
148	V	95.8	Very high	94.5	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	23%	0.226	C	C	.	.	S	Bend	trans	-108.4	-12.9	-177.5	-51.5	0	0	0	0	114.2	L126 L142 A146 P158 L174 K177 L178	L126-V148 HydrophobicContact CD2-CG1 3.76Å; L142-V148 HydrophobicContact CD2-CG1 3.55Å; A146-V148 PolarHBondContact O-N 3.07Å; V148-P158 WeakPolarHBondContact O-CD 3.35Å; V148-L174 HydrophobicContact CB-CD2 4.35Å; V148-L174 HydrophobicContact CG1-CD2 3.93Å; V148-K177 HydrophobicContact CG1-CB 4.16Å; V148-K177 HydrophobicContact CG1-CG 3.99Å; V148-L178 HydrophobicContact CG2-CB 3.57Å; V148-L178 HydrophobicContact CG2-CD1 3.75Å; V148-L178 HydrophobicContact CG2-CG 4.27Å
149	K	92.2	Very high	94.4	Very high	165 Å²	165	41.6 Å²	41.6	72%	0.717	23%	0.23	S	C	*	.	S	Bend	trans	-88.1	-10.4	177.1	-167.9	170.8	-180	173.5	0	113.5	L178	K149-L178 HydrophobicContact CB-CD1 4.07Å; K149-L178 HydrophobicContact CG-CD1 4.47Å
150	V	93.6	Very high	94.2	Very high	40 Å²	40	38.2 Å²	38.2	24%	0.242	22%	0.216	C	C	.	.			trans	-64	141.6	-179.2	-75.4	0	0	0	0	111	T124 P147 S157 P158	T124-V150 HydrophobicContact CG2-CG2 3.9Å; P147-V150 HydrophobicContact CB-CG1 3.86Å; P147-V150 HydrophobicContact CB-CG2 4.14Å; P147-V150 HydrophobicContact CG-CG1 4.02Å; P147-V150 HydrophobicContact CG-CG2 4.08Å; P147-V150 VanDerWaalsContact O-CG2 3.28Å; P147-V150 WeakPolarHBondContact O-CG2 3.48Å; V150-S157 VanDerWaalsContact O-CA 3.31Å; V150-S157 WeakPolarHBondContact O-CA 3.37Å; V150-P158 HydrophobicContact CG2-CG 4.41Å; V150-P158 VanDerWaalsContact O-CD 3.28Å; V150-P158 WeakPolarHBondContact O-CD 3.34Å
151	K	92.3	Very high	94.1	Very high	86 Å²	86	37.1 Å²	37.1	37%	0.374	21%	0.21	S	C	.	.			trans	-103.9	139.5	174.2	-65.8	-178.1	173.5	-165.8	0	111.5	K118 G155 W156 S305	K118-K151 PolarHBondContact NZ-O 2.84Å; K151-G155 WeakPolarHBondContact CD-O 3.25Å; K151-W156 CarbonylContact C-O 3.6Å; K151-W156 VanDerWaalsContact CA-O 3.23Å; K151-W156 WeakPolarHBondContact CA-O 3.32Å; K151-S305 PolarHBondContact NZ-OG 2.76Å
152	N	92.3	Very high	93.9	Very high	9 Å²	9	37.2 Å²	37.2	5%	0.048	21%	0.21	C	C	.	.			trans	-71.9	-178.2	169.4	65.1	12.9	0	0	0	112.4	G122 N123 Q154 G155 W156 E161	G122-N152 WeakPolarHBondContact O-CA 3.36Å; N123-N152 WeakPolarHBondContact OD1-CB 3.31Å; N123-N152 PolarHBondContact OD1-ND2 2.95Å; N123-N152 VanDerWaalsContact OD1-ND2 3.08Å; N152-Q154 PolarHBondContact O-N 2.91Å; N152-Q154 PolarHBondContact OD1-N 2.62Å; N152-G155 PolarHBondContact O-N 3.43Å; N152-G155 PolarHBondContact OD1-N 2.77Å; N152-W156 PolarHBondContact N-O 3.02Å; N152-W156 PolarHBondContact OD1-N 2.86Å; N152-W156 PolarHBondContact OD1-O 2.86Å; N152-E161 PolarHBondContact ND2-OE1 3.02Å
153	A	89.2	Confident	93.8	Very high	61 Å²	61	37.1 Å²	37.1	50%	0.504	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.3	-179.3	0	0	0	0	0	112.7	H121 G155	H121-A153 WeakPolarHBondContact O-CB 3.4Å; H121-A153 PolarHBondContact O-N 2.82Å; A153-G155 VanDerWaalsContact C-N 3.3Å
154	Q	85.5	Confident	93.7	Very high	47 Å²	47	33.7 Å²	33.7	22%	0.22	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-3.6	175.5	-62.3	78.9	4.5	0	0	113.1	N152 R350	N152-Q154 PolarHBondContact O-N 2.91Å; N152-Q154 PolarHBondContact OD1-N 2.62Å; Q154-R350 WeakPolarHBondContact O-CD 3.37Å; Q154-R350 PolarHBondContact O-NE 3.22Å; Q154-R350 PolarHBondContact O-NH1 3.32Å
155	G	88.5	Confident	93.5	Very high	14 Å²	14	31 Å²	31	14%	0.144	17%	0.168	C	C	.	.	S	Bend	trans	84.5	15.7	176.3	0	0	0	0	0	115.1	K151 N152 A153 S305	K151-G155 WeakPolarHBondContact CD-O 3.25Å; N152-G155 PolarHBondContact O-N 3.43Å; N152-G155 PolarHBondContact OD1-N 2.77Å; A153-G155 VanDerWaalsContact C-N 3.3Å; G155-S305 PolarHBondContact O-OG 3.04Å
156	W	91.8	Very high	93.5	Very high	10 Å²	10	27.3 Å²	27.3	4%	0.038	15%	0.148	C	C	.	.			trans	-100.8	142.9	178.7	-57.6	119.5	0	0	0	111.5	H127 K151 N152 A160 E161 V303 S305 R350 R352	H127-W156 PolarHBondContact NE2-O 3.24Å; H127-W156 VanDerWaalsContact NE2-O 3.15Å; K151-W156 CarbonylContact C-O 3.6Å; K151-W156 VanDerWaalsContact CA-O 3.23Å; K151-W156 WeakPolarHBondContact CA-O 3.32Å; N152-W156 PolarHBondContact N-O 3.02Å; N152-W156 PolarHBondContact OD1-N 2.86Å; N152-W156 PolarHBondContact OD1-O 2.86Å; W156-A160 HydrophobicContact CB-CB 4.25Å; W156-A160 HydrophobicContact CE3-CB 3.97Å; W156-E161 HydrophobicContact CB-CG 4.43Å; W156-E161 VanDerWaalsContact CB-OE1 3.27Å; W156-E161 WeakPolarHBondContact CB-OE1 3.1Å; W156-V303 HydrophobicContact CE3-CG1 3.94Å; W156-V303 HydrophobicContact CH2-CG1 4.35Å; W156-V303 HydrophobicContact CZ3-CG1 3.59Å; W156-S305 VanDerWaalsContact CZ3-CB 3.48Å; W156-R350 HydrophobicContact CH2-CB 3.67Å; W156-R350 HydrophobicContact CZ2-CB 3.53Å; W156-R352 VanDerWaalsContact CD1-NH1 3.34Å; W156-R352 HydrophobicContact CH2-CB 4.3Å; W156-R352 HydrophobicContact CH2-CG 3.94Å; W156-R352 HydrophobicContact CZ2-CB 4.42Å; W156-R352 HydrophobicContact CZ2-CG 3.58Å
157	S	94.8	Very high	93.3	Very high	28 Å²	28	27.7 Å²	27.7	20%	0.196	15%	0.15	C	C	.	.			trans	-90	164.7	172.5	64	0	0	0	0	111.4	V150 L159 A160 E161	V150-S157 VanDerWaalsContact O-CA 3.31Å; V150-S157 WeakPolarHBondContact O-CA 3.37Å; S157-L159 PolarHBondContact O-N 3.01Å; S157-A160 WeakPolarHBondContact O-CB 3.3Å; S157-A160 PolarHBondContact O-N 2.77Å; S157-A160 PolarHBondContact OG-N 2.85Å; S157-E161 PolarHBondContact O-N 3.11Å
158	P	96.6	Very high	93.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-54.3	-37.2	171.5	-27.6	35.4	0	0	0	113.4	L126 H127 V148 V150 E161 A162 L174	L126-P158 HydrophobicContact CB-CG 4.5Å; L126-P158 HydrophobicContact CD2-CB 3.92Å; L126-P158 HydrophobicContact CD2-CG 4Å; L126-P158 HydrophobicContact CG-CB 3.93Å; L126-P158 HydrophobicContact CG-CG 4.18Å; H127-P158 WeakPolarHBondContact NE2-CD 3.15Å; V148-P158 WeakPolarHBondContact O-CD 3.35Å; V150-P158 HydrophobicContact CG2-CG 4.41Å; V150-P158 VanDerWaalsContact O-CD 3.28Å; V150-P158 WeakPolarHBondContact O-CD 3.34Å; P158-E161 PolarHBondContact O-N 3.43Å; P158-A162 PolarHBondContact O-N 3.08Å; P158-L174 HydrophobicContact CB-CD2 4.13Å
159	L	96.6	Very high	93.4	Very high	16 Å²	16	33 Å²	33	8%	0.084	17%	0.171	C	C	.	.	H	α-helix	trans	-63.3	-41.9	174.7	-179.5	61.8	0	0	0	111.8	S157 E161 A162 I163 I171 L174 L175 L178	S157-L159 PolarHBondContact O-N 3.01Å; L159-E161 PolarHBondContact O-N 3.32Å; L159-A162 PolarHBondContact O-N 2.7Å; L159-I163 HydrophobicContact CD1-CD1 4.44Å; L159-I163 HydrophobicContact CG-CD1 4.14Å; L159-I163 VanDerWaalsContact O-CG1 3.29Å; L159-I163 WeakPolarHBondContact O-CG1 3.48Å; L159-I163 PolarHBondContact O-N 3.09Å; L159-I171 HydrophobicContact CD1-CG2 3.95Å; L159-L174 HydrophobicContact CB-CB 4.45Å; L159-L174 HydrophobicContact CD1-CB 3.83Å; L159-L175 HydrophobicContact CD2-CD1 4.36Å; L159-L178 HydrophobicContact CD2-CD2 3.8Å
160	A	94.4	Very high	93.6	Very high	9 Å²	9	25.4 Å²	25.4	7%	0.074	14%	0.139	C	C	.	.	H	α-helix	trans	-63.4	-40.8	176.3	0	0	0	0	0	112.1	W156 S157 A162 I163 S164 V303	W156-A160 HydrophobicContact CB-CB 4.25Å; W156-A160 HydrophobicContact CE3-CB 3.97Å; S157-A160 WeakPolarHBondContact O-CB 3.3Å; S157-A160 PolarHBondContact O-N 2.77Å; S157-A160 PolarHBondContact OG-N 2.85Å; A160-A162 VanDerWaalsContact C-N 3.32Å; A160-I163 PolarHBondContact O-N 3.45Å; A160-S164 PolarHBondContact O-N 2.94Å; A160-S164 VanDerWaalsContact O-N 3.11Å; A160-V303 HydrophobicContact CB-CG1 3.77Å
161	E	94.8	Very high	93.8	Very high	12 Å²	12	23.5 Å²	23.5	6%	0.056	13%	0.127	C	C	.	.	H	α-helix	trans	-66.4	-34	174.5	-60.6	-60.8	168.6	0	0	112	V130 M131 N152 W156 S157 P158 L159 S164 Y165 R352	V130-E161 HydrophobicContact CG1-CB 4.02Å; M131-E161 HydrophobicContact CG-CB 4.02Å; M131-E161 HydrophobicContact CG-CG 4.03Å; M131-E161 HydrophobicContact SD-CG 4.35Å; N152-E161 PolarHBondContact ND2-OE1 3.02Å; W156-E161 HydrophobicContact CB-CG 4.43Å; W156-E161 VanDerWaalsContact CB-OE1 3.27Å; W156-E161 WeakPolarHBondContact CB-OE1 3.1Å; S157-E161 PolarHBondContact O-N 3.11Å; P158-E161 PolarHBondContact O-N 3.43Å; L159-E161 PolarHBondContact O-N 3.32Å; E161-S164 WeakPolarHBondContact O-CB 3.45Å; E161-S164 PolarHBondContact O-N 3.38Å; E161-Y165 WeakPolarHBondContact O-CB 3.32Å; E161-Y165 PolarHBondContact O-N 3.35Å; E161-R352 IonicContact OE1-NH1 2.66Å; E161-R352 PolarHBondContact OE1-NH1 2.9Å; E161-R352 IonicContact OE2-CZ 3.99Å; E161-R352 IonicContact OE2-NH1 3.58Å; E161-R352 PolarHBondContact OE2-NH1 2.66Å; E161-R352 IonicContact OE2-NH2 3.6Å; E161-R352 PolarHBondContact OE2-NH2 3.13Å
162	A	95.8	Very high	94	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-69.1	-38.8	177.2	0	0	0	0	0	112.4	V130 P158 L159 A160 S164 Y165 G166 M170 I171 L174	V130-A162 HydrophobicContact CG1-CB 3.52Å; P158-A162 PolarHBondContact O-N 3.08Å; L159-A162 PolarHBondContact O-N 2.7Å; A160-A162 VanDerWaalsContact C-N 3.32Å; A162-S164 VanDerWaalsContact C-N 3.34Å; A162-Y165 PolarHBondContact O-N 2.77Å; A162-G166 PolarHBondContact O-N 2.92Å; A162-M170 HydrophobicContact CB-CG 4.23Å; A162-I171 HydrophobicContact CB-CG1 3.92Å; A162-L174 HydrophobicContact CB-CD1 3.4Å
163	I	95.1	Very high	94.2	Very high	9 Å²	9	20.5 Å²	20.5	5%	0.046	12%	0.118	C	C	.	.	H	α-helix	trans	-62.7	-44.9	174.4	-64.4	160.8	0	0	0	110	L159 A160 Y165 G166 I171 L298 V303 H355	L159-I163 HydrophobicContact CD1-CD1 4.44Å; L159-I163 HydrophobicContact CG-CD1 4.14Å; L159-I163 VanDerWaalsContact O-CG1 3.29Å; L159-I163 WeakPolarHBondContact O-CG1 3.48Å; L159-I163 PolarHBondContact O-N 3.09Å; A160-I163 PolarHBondContact O-N 3.45Å; I163-Y165 PolarHBondContact O-N 3.28Å; I163-G166 WeakPolarHBondContact O-CA 3.43Å; I163-G166 PolarHBondContact O-N 3.26Å; I163-G166 VanDerWaalsContact O-N 3.13Å; I163-I171 HydrophobicContact CB-CD1 4.49Å; I163-I171 HydrophobicContact CG1-CD1 4.22Å; I163-I171 HydrophobicContact CG1-CG1 4.15Å; I163-I171 HydrophobicContact CG1-CG2 4.09Å; I163-L298 HydrophobicContact CD1-CB 3.96Å; I163-L298 HydrophobicContact CD1-CD1 4.25Å; I163-L298 HydrophobicContact CD1-CD2 3.9Å; I163-L298 HydrophobicContact CD1-CG 4.26Å; I163-L298 HydrophobicContact CG1-CB 4.25Å; I163-L298 WeakPolarHBondContact CG2-O 3.49Å; I163-V303 HydrophobicContact CB-CG2 3.87Å; I163-V303 HydrophobicContact CD1-CG2 4.42Å; I163-V303 HydrophobicContact CG2-CG2 3.37Å; I163-H355 WeakPolarHBondContact O-CB 3.37Å
164	S	93.3	Very high	94.6	Very high	4 Å²	4	17.6 Å²	17.6	3%	0.028	9%	0.094	C	C	.	.	H	α-helix	trans	-59.7	-43.2	174.9	174.8	0	0	0	0	112.7	A160 E161 A162 G166 R352 E354	A160-S164 PolarHBondContact O-N 2.94Å; A160-S164 VanDerWaalsContact O-N 3.11Å; E161-S164 WeakPolarHBondContact O-CB 3.45Å; E161-S164 PolarHBondContact O-N 3.38Å; A162-S164 VanDerWaalsContact C-N 3.34Å; S164-G166 VanDerWaalsContact C-N 3.29Å; S164-G166 PolarHBondContact O-N 2.78Å; S164-R352 PolarHBondContact OG-NH2 2.85Å; S164-E354 VanDerWaalsContact CB-OE1 3.25Å; S164-E354 WeakPolarHBondContact CB-OE1 3.34Å; S164-E354 WeakPolarHBondContact OG-CG 3.31Å; S164-E354 PolarHBondContact OG-OE1 3.37Å
165	Y	93.9	Very high	95	Very high	31 Å²	31	15.8 Å²	15.8	12%	0.122	9%	0.086	C	C	.	.	H	α-helix	trans	-64.2	-36.1	175.2	-170	-82.9	0	0	0	111.7	V130 E161 A162 I163 D167 P393	V130-Y165 WeakPolarHBondContact O-CD2 3.41Å; E161-Y165 WeakPolarHBondContact O-CB 3.32Å; E161-Y165 PolarHBondContact O-N 3.35Å; A162-Y165 PolarHBondContact O-N 2.77Å; I163-Y165 PolarHBondContact O-N 3.28Å; Y165-D167 HydrophobicContact CD1-CB 3.74Å; Y165-D167 HydrophobicContact CE1-CB 4.08Å; Y165-P393 HydrophobicContact CD2-CG 4.2Å; Y165-P393 HydrophobicContact CE2-CG 3.72Å
166	G	93.9	Very high	95.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	19.6	175.4	0	0	0	0	0	114.9	A162 I163 S164 R168 S389 L390	A162-G166 PolarHBondContact O-N 2.92Å; I163-G166 WeakPolarHBondContact O-CA 3.43Å; I163-G166 PolarHBondContact O-N 3.26Å; I163-G166 VanDerWaalsContact O-N 3.13Å; S164-G166 VanDerWaalsContact C-N 3.29Å; S164-G166 PolarHBondContact O-N 2.78Å; G166-R168 PolarHBondContact O-N 3.28Å; G166-S389 CarbonylContact O-C 3.49Å; G166-S389 VanDerWaalsContact O-CA 3.31Å; G166-S389 WeakPolarHBondContact O-CA 3.36Å; G166-L390 PolarHBondContact O-N 2.76Å
167	D	94.6	Very high	95.4	Very high	8 Å²	8	20.3 Å²	20.3	4%	0.043	10%	0.1	C	C	.	.			trans	-85.4	104.1	175.6	179	9.9	0	0	0	110.5	K135 Y165 Q169 M170 I171	K135-D167 WeakPolarHBondContact CD-OD2 3.39Å; K135-D167 WeakPolarHBondContact CE-OD2 3.37Å; K135-D167 IonicContact NZ-OD1 3.59Å; K135-D167 PolarHBondContact NZ-OD1 3.08Å; K135-D167 VanDerWaalsContact NZ-OD1 3.1Å; K135-D167 IonicContact NZ-OD2 3.61Å; K135-D167 PolarHBondContact NZ-OD2 3.39Å; Y165-D167 HydrophobicContact CD1-CB 3.74Å; Y165-D167 HydrophobicContact CE1-CB 4.08Å; D167-Q169 VanDerWaalsContact C-N 3.29Å; D167-Q169 PolarHBondContact O-N 2.97Å; D167-Q169 PolarHBondContact OD1-N 2.82Å; D167-M170 HydrophobicContact CB-CB 3.97Å; D167-M170 PolarHBondContact O-N 2.58Å; D167-M170 VanDerWaalsContact O-N 3.13Å; D167-I171 VanDerWaalsContact O-CG1 3.28Å; D167-I171 WeakPolarHBondContact O-CG1 3.01Å; D167-I171 PolarHBondContact O-N 3.35Å
168	R	95.3	Very high	95.3	Very high	13 Å²	13	21.2 Å²	21.2	5%	0.049	10%	0.102	C	C	.	.	H	α-helix	trans	-55.2	-44.6	-175.2	-170	-179.9	-148.7	-47.9	3.2	112.5	G166 M170 I171 T172 E292 V295 D296 M299 R386 R387 S389	G166-R168 PolarHBondContact O-N 3.28Å; R168-M170 VanDerWaalsContact C-N 3.31Å; R168-M170 PolarHBondContact O-N 3.02Å; R168-I171 PolarHBondContact O-N 3.14Å; R168-T172 PolarHBondContact NH1-OG1 2.81Å; R168-T172 PolarHBondContact O-N 2.92Å; R168-T172 PolarHBondContact O-OG1 2.89Å; R168-E292 IonicContact CZ-OE2 2.81Å; R168-E292 IonicContact NH1-OE2 3.91Å; R168-E292 PolarHBondContact NH1-OE2 2.81Å; R168-E292 PolarHBondContact NH2-O 3.38Å; R168-E292 IonicContact NH2-OE2 3.04Å; R168-E292 PolarHBondContact NH2-OE2 2.84Å; R168-V295 HydrophobicContact CG-CG1 3.91Å; R168-V295 VanDerWaalsContact CZ-CG1 3.49Å; R168-V295 VanDerWaalsContact NH1-CB 3.26Å; R168-D296 IonicContact CZ-OD1 3.64Å; R168-D296 IonicContact NE-OD1 3.7Å; R168-D296 VanDerWaalsContact NH2-CG 3.3Å; R168-D296 IonicContact NH2-OD1 3.3Å; R168-D296 PolarHBondContact NH2-OD1 3.33Å; R168-D296 IonicContact NH2-OD2 3.22Å; R168-M299 HydrophobicContact CB-SD 4.12Å; R168-M299 HydrophobicContact CG-SD 4.05Å; R168-R386 VanDerWaalsContact CZ-CZ 3.43Å; R168-R386 VanDerWaalsContact NE-NE 3.15Å; R168-R386 VanDerWaalsContact NH2-CZ 3.29Å; R168-R387 WeakPolarHBondContact CD-O 3.5Å; R168-R387 PolarHBondContact NE-O 3.46Å; R168-S389 VanDerWaalsContact CB-OG 3.28Å; R168-S389 WeakPolarHBondContact CB-OG 3.36Å; R168-S389 PolarHBondContact N-OG 2.91Å
169	Q	96	Very high	94.8	Very high	130 Å²	130	22.8 Å²	22.8	61%	0.607	11%	0.109	S	C	*	.	H	α-helix	trans	-66.7	-37.5	-176.1	-64.8	178.3	15.6	0	0	111.2	D167 A173	D167-Q169 VanDerWaalsContact C-N 3.29Å; D167-Q169 PolarHBondContact O-N 2.97Å; D167-Q169 PolarHBondContact OD1-N 2.82Å; Q169-A173 WeakPolarHBondContact O-CB 3.48Å; Q169-A173 PolarHBondContact O-N 3.17Å
170	M	97.4	Very high	94.5	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.03	12%	0.122	C	C	.	.	H	α-helix	trans	-69.2	-41.7	176.3	-170.4	53.6	56.3	0	0	111.7	V130 K135 A138 L142 A162 D167 R168 A173 L174	V130-M170 HydrophobicContact CG2-CG 4.12Å; V130-M170 HydrophobicContact CG2-SD 4.35Å; K135-M170 HydrophobicContact CB-CE 4.05Å; K135-M170 HydrophobicContact CG-CE 4.35Å; A138-M170 HydrophobicContact CB-CE 3.52Å; A138-M170 HydrophobicContact CB-SD 3.64Å; L142-M170 HydrophobicContact CD1-SD 4.47Å; A162-M170 HydrophobicContact CB-CG 4.23Å; D167-M170 HydrophobicContact CB-CB 3.97Å; D167-M170 PolarHBondContact O-N 2.58Å; D167-M170 VanDerWaalsContact O-N 3.13Å; R168-M170 VanDerWaalsContact C-N 3.31Å; R168-M170 PolarHBondContact O-N 3.02Å; M170-A173 PolarHBondContact O-N 2.76Å; M170-L174 HydrophobicContact CG-CD1 3.89Å; M170-L174 WeakPolarHBondContact O-CB 3.47Å; M170-L174 WeakPolarHBondContact O-CG 3.46Å; M170-L174 PolarHBondContact O-N 2.98Å; M170-L174 HydrophobicContact SD-CD1 4.21Å; M170-L174 HydrophobicContact SD-CG 4.34Å
171	I	97.3	Very high	94.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59	-49.2	174.6	-61.7	162.5	0	0	0	109.7	L159 A162 I163 D167 R168 A173 L174 L175 V295 L298 M299	L159-I171 HydrophobicContact CD1-CG2 3.95Å; A162-I171 HydrophobicContact CB-CG1 3.92Å; I163-I171 HydrophobicContact CB-CD1 4.49Å; I163-I171 HydrophobicContact CG1-CD1 4.22Å; I163-I171 HydrophobicContact CG1-CG1 4.15Å; I163-I171 HydrophobicContact CG1-CG2 4.09Å; D167-I171 VanDerWaalsContact O-CG1 3.28Å; D167-I171 WeakPolarHBondContact O-CG1 3.01Å; D167-I171 PolarHBondContact O-N 3.35Å; R168-I171 PolarHBondContact O-N 3.14Å; I171-A173 PolarHBondContact O-N 2.77Å; I171-L174 PolarHBondContact O-N 3.13Å; I171-L175 VanDerWaalsContact O-CB 3.28Å; I171-L175 WeakPolarHBondContact O-CB 3.5Å; I171-L175 PolarHBondContact O-N 3.04Å; I171-V295 HydrophobicContact CB-CG1 4.2Å; I171-V295 HydrophobicContact CG2-CG1 3.83Å; I171-V295 HydrophobicContact CG2-CG2 4.14Å; I171-L298 HydrophobicContact CG2-CD1 4.25Å; I171-M299 HydrophobicContact CD1-CG 3.77Å; I171-M299 HydrophobicContact CD1-SD 4.08Å
172	T	96.3	Very high	93.9	Very high	8 Å²	8	29.7 Å²	29.7	5%	0.049	15%	0.146	C	C	.	.	H	α-helix	trans	-57.4	-46.7	176.4	-57.9	0	0	0	0	111.7	R168 L174 L175 R176 T291	R168-T172 PolarHBondContact NH1-OG1 2.81Å; R168-T172 PolarHBondContact O-N 2.92Å; R168-T172 PolarHBondContact O-OG1 2.89Å; T172-L174 PolarHBondContact O-N 3.28Å; T172-L175 PolarHBondContact O-N 3.3Å; T172-R176 VanDerWaalsContact CG2-CZ 3.43Å; T172-R176 WeakPolarHBondContact O-CG 3.47Å; T172-R176 PolarHBondContact O-N 3Å; T172-T291 HydrophobicContact CG2-CG2 4.11Å
173	A	97	Very high	93.1	Very high	23 Å²	23	33.4 Å²	33.4	19%	0.19	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-42.2	179.9	0	0	0	0	0	112.7	L142 Q169 M170 I171 K177	L142-A173 HydrophobicContact CD1-CB 4.17Å; Q169-A173 WeakPolarHBondContact O-CB 3.48Å; Q169-A173 PolarHBondContact O-N 3.17Å; M170-A173 PolarHBondContact O-N 2.76Å; I171-A173 PolarHBondContact O-N 2.77Å; A173-K177 WeakPolarHBondContact O-CB 3.26Å; A173-K177 PolarHBondContact O-N 2.86Å
174	L	97.4	Very high	92.8	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-68.5	-39.9	177.4	-77.3	163.3	0	0	0	112.3	L126 V130 L142 V148 P158 L159 A162 M170 I171 T172 K177 L178	L126-L174 HydrophobicContact CD1-CD2 4.38Å; L126-L174 HydrophobicContact CD2-CD2 3.87Å; L126-L174 HydrophobicContact CG-CD2 4.36Å; V130-L174 HydrophobicContact CG2-CD1 3.9Å; L142-L174 HydrophobicContact CD1-CD2 4.21Å; L142-L174 HydrophobicContact CD1-CG 4.36Å; L142-L174 HydrophobicContact CD2-CD2 3.73Å; V148-L174 HydrophobicContact CB-CD2 4.35Å; V148-L174 HydrophobicContact CG1-CD2 3.93Å; P158-L174 HydrophobicContact CB-CD2 4.13Å; L159-L174 HydrophobicContact CB-CB 4.45Å; L159-L174 HydrophobicContact CD1-CB 3.83Å; A162-L174 HydrophobicContact CB-CD1 3.4Å; M170-L174 HydrophobicContact CG-CD1 3.89Å; M170-L174 WeakPolarHBondContact O-CB 3.47Å; M170-L174 WeakPolarHBondContact O-CG 3.46Å; M170-L174 PolarHBondContact O-N 2.98Å; M170-L174 HydrophobicContact SD-CD1 4.21Å; M170-L174 HydrophobicContact SD-CG 4.34Å; I171-L174 PolarHBondContact O-N 3.13Å; T172-L174 PolarHBondContact O-N 3.28Å; L174-K177 PolarHBondContact O-N 3.07Å; L174-L178 VanDerWaalsContact O-CB 3.29Å; L174-L178 WeakPolarHBondContact O-CB 3.49Å; L174-L178 PolarHBondContact O-N 2.82Å
175	L	94.5	Very high	92.3	Very high	9 Å²	9	38 Å²	38	5%	0.047	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-49.4	176.5	-178.5	60.4	0	0	0	110.6	L159 I171 T172 K177 L178 K179 T291 E294 V295 L298	L159-L175 HydrophobicContact CD2-CD1 4.36Å; I171-L175 VanDerWaalsContact O-CB 3.28Å; I171-L175 WeakPolarHBondContact O-CB 3.5Å; I171-L175 PolarHBondContact O-N 3.04Å; T172-L175 PolarHBondContact O-N 3.3Å; L175-K177 VanDerWaalsContact C-N 3.31Å; L175-K177 PolarHBondContact O-N 3.24Å; L175-L178 WeakPolarHBondContact O-CB 3.28Å; L175-L178 PolarHBondContact O-N 3.38Å; L175-L178 VanDerWaalsContact O-N 3.14Å; L175-K179 WeakPolarHBondContact O-CG 3.47Å; L175-K179 PolarHBondContact O-N 2.89Å; L175-T291 HydrophobicContact CD2-CG2 4.34Å; L175-E294 HydrophobicContact CD2-CB 3.95Å; L175-V295 HydrophobicContact CD2-CG2 3.78Å; L175-L298 HydrophobicContact CD1-CD1 4.5Å; L175-L298 HydrophobicContact CD2-CD1 4.27Å
176	R	93.4	Very high	91.7	Very high	97 Å²	97	40.4 Å²	40.4	37%	0.366	20%	0.204	S	C	.	.	H	α-helix	trans	-55.8	-46.1	173.6	-74.3	179.4	-178.9	144.7	9.6	111.8	T172 L178 K179 Q180 E288 T291	T172-R176 VanDerWaalsContact CG2-CZ 3.43Å; T172-R176 WeakPolarHBondContact O-CG 3.47Å; T172-R176 PolarHBondContact O-N 3Å; R176-L178 VanDerWaalsContact C-N 3.33Å; R176-L178 PolarHBondContact O-N 2.91Å; R176-K179 PolarHBondContact O-N 3.11Å; R176-Q180 WeakPolarHBondContact O-CB 3.3Å; R176-Q180 PolarHBondContact O-N 2.77Å; R176-E288 IonicContact CZ-OE1 3.86Å; R176-E288 IonicContact CZ-OE2 3.28Å; R176-E288 IonicContact NE-OE1 2.88Å; R176-E288 IonicContact NH2-OE1 2.68Å; R176-E288 PolarHBondContact NH2-OE1 2.9Å; R176-E288 IonicContact NH2-OE2 3.95Å; R176-E288 PolarHBondContact NH2-OE2 3.41Å; R176-T291 HydrophobicContact CG-CG2 4.26Å
177	K	94.9	Very high	91.1	Very high	22 Å²	22	45.4 Å²	45.4	10%	0.096	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-36	179.1	-161.8	73.2	-169.4	170.4	0	112.5	L142 N145 V148 A173 L174 L175 Q180 Q181	L142-K177 HydrophobicContact CD2-CB 4.02Å; L142-K177 HydrophobicContact CD2-CG 3.85Å; L142-K177 WeakPolarHBondContact O-CE 3.44Å; L142-K177 PolarHBondContact O-NZ 3.44Å; N145-K177 WeakPolarHBondContact OD1-CE 3.3Å; N145-K177 PolarHBondContact OD1-NZ 3.2Å; V148-K177 HydrophobicContact CG1-CB 4.16Å; V148-K177 HydrophobicContact CG1-CG 3.99Å; A173-K177 WeakPolarHBondContact O-CB 3.26Å; A173-K177 PolarHBondContact O-N 2.86Å; L174-K177 PolarHBondContact O-N 3.07Å; L175-K177 VanDerWaalsContact C-N 3.31Å; L175-K177 PolarHBondContact O-N 3.24Å; K177-Q180 PolarHBondContact O-N 2.65Å; K177-Q181 WeakPolarHBondContact O-CB 3.38Å; K177-Q181 WeakPolarHBondContact O-CG 3.43Å; K177-Q181 PolarHBondContact O-N 3.06Å
178	L	92.6	Very high	90.8	Very high	48 Å²	48	51.5 Å²	51.5	25%	0.251	26%	0.26	S	S	.	.	H	α-helix	trans	-63.6	-46.9	176.4	175.8	65.9	0	0	0	110.7	V148 K149 L159 L174 L175 R176 Q181 S182	V148-L178 HydrophobicContact CG2-CB 3.57Å; V148-L178 HydrophobicContact CG2-CD1 3.75Å; V148-L178 HydrophobicContact CG2-CG 4.27Å; K149-L178 HydrophobicContact CB-CD1 4.07Å; K149-L178 HydrophobicContact CG-CD1 4.47Å; L159-L178 HydrophobicContact CD2-CD2 3.8Å; L174-L178 VanDerWaalsContact O-CB 3.29Å; L174-L178 WeakPolarHBondContact O-CB 3.49Å; L174-L178 PolarHBondContact O-N 2.82Å; L175-L178 WeakPolarHBondContact O-CB 3.28Å; L175-L178 PolarHBondContact O-N 3.38Å; L175-L178 VanDerWaalsContact O-N 3.14Å; R176-L178 VanDerWaalsContact C-N 3.33Å; R176-L178 PolarHBondContact O-N 2.91Å; L178-Q181 PolarHBondContact O-N 2.79Å; L178-S182 WeakPolarHBondContact O-CB 3.46Å; L178-S182 PolarHBondContact O-N 3.11Å
179	K	87.1	Confident	90.4	Very high	32 Å²	32	55.3 Å²	55.3	14%	0.139	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-45.6	177.1	-65.9	-175.3	-179.9	-159.2	0	111.3	L175 R176 S182 R183 E286 E294	L175-K179 WeakPolarHBondContact O-CG 3.47Å; L175-K179 PolarHBondContact O-N 2.89Å; R176-K179 PolarHBondContact O-N 3.11Å; K179-S182 WeakPolarHBondContact O-CB 3.44Å; K179-S182 PolarHBondContact O-N 3.44Å; K179-R183 WeakPolarHBondContact O-CG 3.44Å; K179-R183 PolarHBondContact O-N 3.22Å; K179-E286 WeakPolarHBondContact CD-OE1 3.27Å; K179-E286 WeakPolarHBondContact CD-OE2 3.35Å; K179-E286 WeakPolarHBondContact CE-OE1 3.41Å; K179-E286 WeakPolarHBondContact CE-OE2 3.5Å; K179-E286 IonicContact NZ-OE1 3.68Å; K179-E286 PolarHBondContact NZ-OE1 2.88Å; K179-E286 IonicContact NZ-OE2 3.27Å; K179-E286 PolarHBondContact NZ-OE2 3Å; K179-E294 WeakPolarHBondContact CE-OE2 3.31Å; K179-E294 IonicContact NZ-OE1 2.74Å; K179-E294 PolarHBondContact NZ-OE1 3.49Å; K179-E294 IonicContact NZ-OE2 2.78Å; K179-E294 PolarHBondContact NZ-OE2 3.38Å
180	Q	89.4	Confident	90	Very high	79 Å²	79	50.9 Å²	50.9	37%	0.369	25%	0.254	S	S	.	.	H	α-helix	trans	-55.9	-54.6	174.1	-177.1	-174.9	2.4	0	0	111.9	R176 K177 S182 R183 E184	R176-Q180 WeakPolarHBondContact O-CB 3.3Å; R176-Q180 PolarHBondContact O-N 2.77Å; K177-Q180 PolarHBondContact O-N 2.65Å; Q180-S182 VanDerWaalsContact C-N 3.25Å; Q180-S182 PolarHBondContact O-N 2.73Å; Q180-R183 PolarHBondContact O-N 3.08Å; Q180-R183 VanDerWaalsContact O-N 3.13Å; Q180-E184 HydrophobicContact CG-CG 4.47Å; Q180-E184 WeakPolarHBondContact CG-OE1 3.45Å; Q180-E184 PolarHBondContact NE2-OE1 2.79Å; Q180-E184 WeakPolarHBondContact O-CG 3.31Å; Q180-E184 PolarHBondContact O-N 3.15Å
181	Q	90.8	Very high	89.6	Confident	38 Å²	38	54.8 Å²	54.8	18%	0.178	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-32.8	-179.9	-75.3	-177.7	0.9	0	0	112.5	A146 K177 L178 S185	A146-Q181 PolarHBondContact O-NE2 2.55Å; K177-Q181 WeakPolarHBondContact O-CB 3.38Å; K177-Q181 WeakPolarHBondContact O-CG 3.43Å; K177-Q181 PolarHBondContact O-N 3.06Å; L178-Q181 PolarHBondContact O-N 2.79Å; Q181-S185 VanDerWaalsContact O-CB 3.25Å; Q181-S185 WeakPolarHBondContact O-CB 3.44Å; Q181-S185 PolarHBondContact O-N 3.12Å
182	S	85.1	Confident	89.3	Confident	65 Å²	65	62.9 Å²	62.9	46%	0.455	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-44	175.1	-166.6	0	0	0	0	111.3	L178 K179 Q180 S185 V186	L178-S182 WeakPolarHBondContact O-CB 3.46Å; L178-S182 PolarHBondContact O-N 3.11Å; K179-S182 WeakPolarHBondContact O-CB 3.44Å; K179-S182 PolarHBondContact O-N 3.44Å; Q180-S182 VanDerWaalsContact C-N 3.25Å; Q180-S182 PolarHBondContact O-N 2.73Å; S182-S185 PolarHBondContact O-N 3.06Å; S182-V186 WeakPolarHBondContact O-CG2 3.25Å; S182-V186 PolarHBondContact O-N 3.28Å; S182-V186 VanDerWaalsContact O-N 3.11Å
183	R	80.8	Confident	89	Confident	80 Å²	80	63.6 Å²	63.6	30%	0.302	32%	0.319	S	S	.	.	H	α-helix	trans	-64.8	-51.8	177.9	-66.3	168.1	-166.7	-162.5	-1.9	111.5	K179 Q180 S185 V186 E187 H284 E286	K179-R183 WeakPolarHBondContact O-CG 3.44Å; K179-R183 PolarHBondContact O-N 3.22Å; Q180-R183 PolarHBondContact O-N 3.08Å; Q180-R183 VanDerWaalsContact O-N 3.13Å; R183-S185 VanDerWaalsContact C-N 3.27Å; R183-S185 PolarHBondContact O-N 3.46Å; R183-V186 PolarHBondContact O-N 2.87Å; R183-E187 WeakPolarHBondContact O-CG 3.25Å; R183-E187 PolarHBondContact O-N 3.41Å; R183-H284 PolarHBondContact NH1-O 3.47Å; R183-H284 PolarHBondContact NH2-O 3.24Å; R183-E286 IonicContact NH2-OE1 3.24Å
184	E	86.8	Confident	88.8	Confident	64 Å²	64	64.1 Å²	64.1	30%	0.299	32%	0.318	S	S	.	.	H	α-helix	trans	-55.1	-43.9	176.5	-69.8	171.7	-178.6	0	0	110.8	Q180 V186 E187 D188	Q180-E184 HydrophobicContact CG-CG 4.47Å; Q180-E184 WeakPolarHBondContact CG-OE1 3.45Å; Q180-E184 PolarHBondContact NE2-OE1 2.79Å; Q180-E184 WeakPolarHBondContact O-CG 3.31Å; Q180-E184 PolarHBondContact O-N 3.15Å; E184-V186 VanDerWaalsContact C-N 3.32Å; E184-V186 PolarHBondContact O-N 3.37Å; E184-E187 PolarHBondContact O-N 2.83Å; E184-D188 WeakPolarHBondContact O-CB 3.17Å; E184-D188 PolarHBondContact O-N 3.17Å
185	S	84.5	Confident	88.5	Confident	45 Å²	45	70.5 Å²	70.5	32%	0.315	35%	0.346	S	S	.	.	H	α-helix	trans	-64.9	-32.1	177.7	177.1	0	0	0	0	113.8	Q181 S182 R183 K189	Q181-S185 VanDerWaalsContact O-CB 3.25Å; Q181-S185 WeakPolarHBondContact O-CB 3.44Å; Q181-S185 PolarHBondContact O-N 3.12Å; S182-S185 PolarHBondContact O-N 3.06Å; R183-S185 VanDerWaalsContact C-N 3.27Å; R183-S185 PolarHBondContact O-N 3.46Å; S185-K189 WeakPolarHBondContact O-CD 3.47Å; S185-K189 VanDerWaalsContact O-CG 3.25Å; S185-K189 WeakPolarHBondContact O-CG 3.42Å; S185-K189 PolarHBondContact O-N 3.08Å; S185-K189 WeakPolarHBondContact OG-CE 3.33Å; S185-K189 PolarHBondContact OG-NZ 2.64Å
186	V	79.8	Confident	88.4	Confident	81 Å²	81	70.8 Å²	70.8	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-73.1	-43.7	176.1	169.2	0	0	0	0	109.5	S182 R183 E184 K189 R190	S182-V186 WeakPolarHBondContact O-CG2 3.25Å; S182-V186 PolarHBondContact O-N 3.28Å; S182-V186 VanDerWaalsContact O-N 3.11Å; R183-V186 PolarHBondContact O-N 2.87Å; E184-V186 VanDerWaalsContact C-N 3.32Å; E184-V186 PolarHBondContact O-N 3.37Å; V186-K189 PolarHBondContact O-N 3.48Å; V186-R190 PolarHBondContact O-N 3.45Å
187	E	82.9	Confident	88.4	Confident	105 Å²	105	66.1 Å²	66.1	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-61.4	-46.4	177.5	-70.8	-177.9	165.6	0	0	112.2	R183 E184 K189 R190 P191	R183-E187 WeakPolarHBondContact O-CG 3.25Å; R183-E187 PolarHBondContact O-N 3.41Å; E184-E187 PolarHBondContact O-N 2.83Å; E187-K189 PolarHBondContact O-N 3.11Å; E187-R190 VanDerWaalsContact O-CB 3.31Å; E187-R190 WeakPolarHBondContact O-CB 3.36Å; E187-R190 PolarHBondContact O-N 2.96Å; E187-R190 VanDerWaalsContact O-N 3.11Å; E187-P191 WeakPolarHBondContact O-CD 3.28Å
188	D	87.6	Confident	88.3	Confident	136 Å²	136	72.9 Å²	72.9	73%	0.727	36%	0.361	S	S	*	.	H	α-helix	trans	-59.2	-34.3	177.5	-78.3	-15.7	0	0	0	112.6	E184	E184-D188 WeakPolarHBondContact O-CB 3.17Å; E184-D188 PolarHBondContact O-N 3.17Å
189	K	86.1	Confident	88.2	Confident	94 Å²	94	77.2 Å²	77.2	41%	0.409	38%	0.38	S	S	.	.	H	α-helix	trans	-84	-21.1	179.9	-70.6	172.2	-172.8	164.3	0	113.1	S185 V186 E187 K192 L193	S185-K189 WeakPolarHBondContact O-CD 3.47Å; S185-K189 VanDerWaalsContact O-CG 3.25Å; S185-K189 WeakPolarHBondContact O-CG 3.42Å; S185-K189 PolarHBondContact O-N 3.08Å; S185-K189 WeakPolarHBondContact OG-CE 3.33Å; S185-K189 PolarHBondContact OG-NZ 2.64Å; V186-K189 PolarHBondContact O-N 3.48Å; E187-K189 PolarHBondContact O-N 3.11Å; K189-K192 PolarHBondContact O-N 3.38Å; K189-K192 VanDerWaalsContact O-N 3.16Å; K189-L193 PolarHBondContact O-N 3.09Å
190	R	87.4	Confident	88.4	Confident	36 Å²	36	76.8 Å²	76.8	14%	0.136	38%	0.379	C	S	.	.	H	α-helix	trans	-52.5	-46.1	-173.3	-174	-178.9	179.3	92.5	2	113.2	V186 E187 K192 L193 L194 G261 A263 S268	V186-R190 PolarHBondContact O-N 3.45Å; E187-R190 VanDerWaalsContact O-CB 3.31Å; E187-R190 WeakPolarHBondContact O-CB 3.36Å; E187-R190 PolarHBondContact O-N 2.96Å; E187-R190 VanDerWaalsContact O-N 3.11Å; R190-K192 PolarHBondContact O-N 3.29Å; R190-L193 WeakPolarHBondContact O-CB 3.5Å; R190-L193 PolarHBondContact O-N 3.07Å; R190-L194 HydrophobicContact CG-CD1 4.07Å; R190-L194 HydrophobicContact CG-CG 4.18Å; R190-L194 WeakPolarHBondContact O-CG 3.47Å; R190-L194 PolarHBondContact O-N 2.91Å; R190-G261 PolarHBondContact NH2-O 2.81Å; R190-A263 PolarHBondContact NH2-O 2.7Å; R190-S268 PolarHBondContact NH1-OG 3.45Å
191	P	90.8	Very high	88.5	Confident	88 Å²	88	75 Å²	75	57%	0.571	38%	0.382	S	S	*	.	H	α-helix	trans	-62.3	-41.3	-178.8	-23.1	34.2	0	0	0	113	E187 L193 K195	E187-P191 WeakPolarHBondContact O-CD 3.28Å; P191-L193 VanDerWaalsContact C-N 3.34Å; P191-K195 WeakPolarHBondContact O-CB 3.3Å; P191-K195 PolarHBondContact O-N 3.16Å
192	K	90.8	Very high	88.7	Confident	171 Å²	171	75.1 Å²	75.1	74%	0.743	38%	0.384	S	S	*	.	H	α-helix	trans	-65.8	-41	177.1	-175.8	-178.4	176.7	-174.8	0	110.8	K189 R190 K195 A196	K189-K192 PolarHBondContact O-N 3.38Å; K189-K192 VanDerWaalsContact O-N 3.16Å; R190-K192 PolarHBondContact O-N 3.29Å; K192-K195 PolarHBondContact O-N 3.38Å; K192-A196 PolarHBondContact O-N 3.34Å
193	L	88.9	Confident	89.2	Confident	23 Å²	23	72.1 Å²	72.1	12%	0.12	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-51.7	177.5	-178	59	0	0	0	111.5	K189 R190 P191 K195 A196 L197 N446 E449 V450	K189-L193 PolarHBondContact O-N 3.09Å; R190-L193 WeakPolarHBondContact O-CB 3.5Å; R190-L193 PolarHBondContact O-N 3.07Å; P191-L193 VanDerWaalsContact C-N 3.34Å; L193-K195 VanDerWaalsContact C-N 3.29Å; L193-K195 PolarHBondContact O-N 2.85Å; L193-A196 WeakPolarHBondContact O-CB 3.46Å; L193-A196 PolarHBondContact O-N 3.01Å; L193-A196 VanDerWaalsContact O-N 3.08Å; L193-L197 WeakPolarHBondContact O-CG 2.91Å; L193-L197 PolarHBondContact O-N 2.88Å; L193-N446 HydrophobicContact CD1-CB 4.22Å; L193-N446 WeakPolarHBondContact CD1-O 3.4Å; L193-E449 HydrophobicContact CD1-CB 4.06Å; L193-E449 HydrophobicContact CD1-CG 4.32Å; L193-E449 HydrophobicContact CD2-CB 4.44Å; L193-E449 HydrophobicContact CD2-CG 4.07Å; L193-V450 HydrophobicContact CD1-CG2 3.99Å; L193-V450 HydrophobicContact CD2-CG2 3.68Å; L193-V450 HydrophobicContact CG-CG2 3.98Å
194	L	92.6	Very high	90	Very high	34 Å²	34	68.9 Å²	68.9	18%	0.178	35%	0.35	C	S	.	.	H	α-helix	trans	-60.4	-38.7	178.8	-66.2	-178.3	0	0	0	112.2	R190 L197 K198 I234 F259	R190-L194 HydrophobicContact CG-CD1 4.07Å; R190-L194 HydrophobicContact CG-CG 4.18Å; R190-L194 WeakPolarHBondContact O-CG 3.47Å; R190-L194 PolarHBondContact O-N 2.91Å; L194-L197 HydrophobicContact CD2-CD1 4.35Å; L194-L197 PolarHBondContact O-N 2.94Å; L194-K198 WeakPolarHBondContact O-CB 3.46Å; L194-K198 PolarHBondContact O-N 3.46Å; L194-I234 HydrophobicContact CD2-CB 4.43Å; L194-I234 HydrophobicContact CD2-CD1 4.45Å; L194-F259 HydrophobicContact CD2-CE1 3.84Å; L194-F259 HydrophobicContact CD2-CZ 3.84Å
195	K	92.8	Very high	90.3	Very high	133 Å²	133	65.8 Å²	65.8	58%	0.578	34%	0.336	S	S	*	.	H	α-helix	trans	-60.6	-47.3	173.2	-179.4	177.6	173.4	-180	0	111.3	P191 K192 L193 L197 K198 E199	P191-K195 WeakPolarHBondContact O-CB 3.3Å; P191-K195 PolarHBondContact O-N 3.16Å; K192-K195 PolarHBondContact O-N 3.38Å; L193-K195 VanDerWaalsContact C-N 3.29Å; L193-K195 PolarHBondContact O-N 2.85Å; K195-L197 PolarHBondContact O-N 2.82Å; K195-K198 PolarHBondContact O-N 2.89Å; K195-E199 WeakPolarHBondContact CE-OE1 3.33Å; K195-E199 IonicContact NZ-OE1 3.44Å; K195-E199 WeakPolarHBondContact O-CG 3.25Å; K195-E199 PolarHBondContact O-N 3.48Å; K195-E199 VanDerWaalsContact O-N 3.09Å
196	A	91.7	Very high	90.8	Very high	15 Å²	15	65 Å²	65	12%	0.124	33%	0.328	C	S	.	.	H	α-helix	trans	-62.1	-42.9	177.6	0	0	0	0	0	111.7	K192 L193 K198 E199 L200 N446	K192-A196 PolarHBondContact O-N 3.34Å; L193-A196 WeakPolarHBondContact O-CB 3.46Å; L193-A196 PolarHBondContact O-N 3.01Å; L193-A196 VanDerWaalsContact O-N 3.08Å; A196-K198 VanDerWaalsContact C-N 3.3Å; A196-K198 PolarHBondContact O-N 2.9Å; A196-E199 PolarHBondContact O-N 3.46Å; A196-L200 VanDerWaalsContact O-CG 3.31Å; A196-L200 WeakPolarHBondContact O-CG 3.33Å; A196-L200 PolarHBondContact O-N 3.4Å; A196-N446 HydrophobicContact CB-CB 4.29Å
197	L	92.6	Very high	91.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.1	-40	175.8	-66.1	-179.7	0	0	0	112.6	L193 L194 K195 E199 L200 K231 G233 I234 I236 F259 V450	L193-L197 WeakPolarHBondContact O-CG 2.91Å; L193-L197 PolarHBondContact O-N 2.88Å; L194-L197 HydrophobicContact CD2-CD1 4.35Å; L194-L197 PolarHBondContact O-N 2.94Å; K195-L197 PolarHBondContact O-N 2.82Å; L197-E199 VanDerWaalsContact C-N 3.31Å; L197-E199 PolarHBondContact O-N 2.87Å; L197-L200 HydrophobicContact CD2-CD1 4.11Å; L197-L200 WeakPolarHBondContact O-CB 3.31Å; L197-L200 PolarHBondContact O-N 3.29Å; L197-K231 WeakPolarHBondContact O-CE 3.35Å; L197-K231 PolarHBondContact O-NZ 3.26Å; L197-G233 CarbonylContact C-O 3.53Å; L197-G233 VanDerWaalsContact O-O 3.08Å; L197-I234 HydrophobicContact CB-CB 4.47Å; L197-I234 HydrophobicContact CB-CG2 4.37Å; L197-I236 HydrophobicContact CD1-CD1 4.32Å; L197-I236 HydrophobicContact CD2-CD1 3.78Å; L197-F259 HydrophobicContact CD1-CD1 4.4Å; L197-F259 HydrophobicContact CD1-CE1 3.89Å; L197-V450 HydrophobicContact CD1-CG2 3.81Å; L197-V450 HydrophobicContact CD2-CG2 4.3Å; L197-V450 HydrophobicContact CG-CG2 4.49Å
198	K	92.9	Very high	91.6	Very high	163 Å²	163	58.5 Å²	58.5	71%	0.709	29%	0.291	S	S	*	.	H	α-helix	trans	-66	-34.8	177.3	-172.3	173.9	-178.3	174	0	112.7	L194 K195 A196 L200 I234	L194-K198 WeakPolarHBondContact O-CB 3.46Å; L194-K198 PolarHBondContact O-N 3.46Å; K195-K198 PolarHBondContact O-N 2.89Å; A196-K198 VanDerWaalsContact C-N 3.3Å; A196-K198 PolarHBondContact O-N 2.9Å; K198-L200 VanDerWaalsContact C-N 3.33Å; K198-I234 HydrophobicContact CB-CG2 3.8Å; K198-I234 HydrophobicContact CG-CG2 4.48Å
199	E	91.9	Very high	91.6	Very high	140 Å²	140	52.2 Å²	52.2	65%	0.654	26%	0.258	S	S	*	.	H	α-helix	trans	-77.2	-21.8	177.2	-70.6	171.3	-177.6	0	0	112.3	K195 A196 L197	K195-E199 WeakPolarHBondContact CE-OE1 3.33Å; K195-E199 IonicContact NZ-OE1 3.44Å; K195-E199 WeakPolarHBondContact O-CG 3.25Å; K195-E199 PolarHBondContact O-N 3.48Å; K195-E199 VanDerWaalsContact O-N 3.09Å; A196-E199 PolarHBondContact O-N 3.46Å; L197-E199 VanDerWaalsContact C-N 3.31Å; L197-E199 PolarHBondContact O-N 2.87Å
200	L	90.1	Very high	91.7	Very high	23 Å²	23	51 Å²	51	12%	0.12	26%	0.255	C	S	.	.	S	Bend	trans	-69.4	135.9	169.5	-67	168.9	0	0	0	109.2	A196 L197 K198 K231 S443 N446 V447	A196-L200 VanDerWaalsContact O-CG 3.31Å; A196-L200 WeakPolarHBondContact O-CG 3.33Å; A196-L200 PolarHBondContact O-N 3.4Å; L197-L200 HydrophobicContact CD2-CD1 4.11Å; L197-L200 WeakPolarHBondContact O-CB 3.31Å; L197-L200 PolarHBondContact O-N 3.29Å; K198-L200 VanDerWaalsContact C-N 3.33Å; L200-K231 PolarHBondContact O-NZ 3.39Å; L200-S443 WeakPolarHBondContact CD2-OG 3.33Å; L200-N446 HydrophobicContact CD1-CB 4.45Å; L200-V447 HydrophobicContact CD1-CG2 4.12Å
201	G	91.7	Very high	91.5	Very high	41 Å²	41	49.4 Å²	49.4	42%	0.423	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-65.5	169.9	166.7	0	0	0	0	0	111.4	F203 K231	G201-F203 WeakPolarHBondContact O-CD1 3.48Å; G201-K231 WeakPolarHBondContact O-CD 3.23Å; G201-K231 PolarHBondContact O-NZ 2.84Å; G201-K231 VanDerWaalsContact O-NZ 3.15Å
202	D	95.6	Very high	91	Very high	40 Å²	40	49.8 Å²	49.8	21%	0.214	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-82.2	136.7	176.8	-65.8	-13.7	0	0	0	110.7	K231 H232 G233 Y495 D496	D202-K231 WeakPolarHBondContact CA-O 3.48Å; D202-K231 WeakPolarHBondContact CB-O 3.44Å; D202-K231 IonicContact OD1-NZ 3.98Å; D202-K231 PolarHBondContact OD1-NZ 2.94Å; D202-H232 WeakPolarHBondContact OD1-CA 3.43Å; D202-H232 IonicContact OD2-CE1 3.41Å; D202-H232 PolarHBondContact OD2-CE1 3.33Å; D202-H232 IonicContact OD2-CG 3.4Å; D202-H232 IonicContact OD2-ND1 2.76Å; D202-H232 PolarHBondContact OD2-ND1 3.25Å; D202-G233 PolarHBondContact OD1-N 3.05Å; D202-Y495 WeakPolarHBondContact O-CA 3.37Å; D202-Y495 WeakPolarHBondContact O-CD1 3.49Å; D202-D496 CarbonylContact C-O 3.59Å; D202-D496 VanDerWaalsContact CB-O 3.28Å; D202-D496 WeakPolarHBondContact CB-O 3.31Å; D202-D496 PolarHBondContact O-N 3.48Å
203	F	96.1	Very high	90.4	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.009	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	156.6	-172.6	68.6	-96.9	0	0	0	113	G201 L205 I229 K231 V447 F493 R494 Y495 F498	G201-F203 WeakPolarHBondContact O-CD1 3.48Å; F203-L205 HydrophobicContact CD2-CB 3.95Å; F203-L205 HydrophobicContact CE2-CB 3.84Å; F203-I229 HydrophobicContact CE2-CG2 4.35Å; F203-K231 HydrophobicContact CD1-CB 4.04Å; F203-K231 HydrophobicContact CD1-CD 4Å; F203-K231 HydrophobicContact CD1-CG 4.36Å; F203-K231 HydrophobicContact CE1-CB 3.68Å; F203-K231 HydrophobicContact CE1-CD 3.82Å; F203-K231 HydrophobicContact CE1-CG 3.82Å; F203-K231 HydrophobicContact CE2-CB 4.18Å; F203-K231 HydrophobicContact CG-CB 4.42Å; F203-K231 HydrophobicContact CZ-CB 3.73Å; F203-K231 HydrophobicContact CZ-CG 4.19Å; F203-K231 PolarHBondContact N-O 2.86Å; F203-K231 PolarHBondContact O-N 2.91Å; F203-V447 HydrophobicContact CE1-CG2 4.26Å; F203-V447 HydrophobicContact CZ-CG2 3.68Å; F203-F493 HydrophobicContact CB-CE2 3.78Å; F203-F493 HydrophobicContact CB-CZ 3.75Å; F203-F493 HydrophobicContact CD1-CE2 4.37Å; F203-F493 HydrophobicContact CD2-CD2 4.25Å; F203-F493 AromaticContact CD2-CE2 3.66Å; F203-F493 HydrophobicContact CD2-CE2 3.66Å; F203-F493 HydrophobicContact CD2-CZ 4.47Å; F203-F493 HydrophobicContact CE2-CE2 4.4Å; F203-F493 AromaticContact CG-CE2 3.67Å; F203-F493 HydrophobicContact CG-CE2 3.67Å; F203-F493 HydrophobicContact CG-CZ 4.05Å; F203-R494 CarbonylContact C-O 3.51Å; F203-R494 VanDerWaalsContact CA-O 3.28Å; F203-R494 WeakPolarHBondContact CA-O 3.48Å; F203-R494 WeakPolarHBondContact CB-O 3.39Å; F203-Y495 HydrophobicContact CB-CD1 4.29Å; F203-F498 VanDerWaalsContact O-CE2 3.3Å; F203-F498 WeakPolarHBondContact O-CE2 3.29Å
204	Y	96.1	Very high	89.4	Confident	12 Å²	12	49.5 Å²	49.5	5%	0.047	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	135.2	163.6	176.4	-106.9	0	0	0	109.3	E206 K228 I229 Y230 E492 F493 R494	Y204-E206 HydrophobicContact CE1-CB 3.84Å; Y204-E206 PolarHBondContact OH-OE2 2.96Å; Y204-K228 HydrophobicContact CE2-CB 4Å; Y204-K228 HydrophobicContact CE2-CD 4.4Å; Y204-K228 HydrophobicContact CE2-CG 4.28Å; Y204-K228 WeakPolarHBondContact OH-CD 3.36Å; Y204-K228 WeakPolarHBondContact OH-CG 3.48Å; Y204-I229 CarbonylContact C-O 3.56Å; Y204-I229 WeakPolarHBondContact CA-O 3.33Å; Y204-Y230 AromaticContact CD2-CD1 3.79Å; Y204-Y230 HydrophobicContact CD2-CD1 3.79Å; Y204-Y230 AromaticContact CD2-CE1 3.46Å; Y204-Y230 HydrophobicContact CD2-CE1 3.46Å; Y204-Y230 VanDerWaalsContact CD2-CE1 3.46Å; Y204-Y230 HydrophobicContact CD2-CG 4.49Å; Y204-Y230 AromaticContact CD2-CZ 3.93Å; Y204-Y230 HydrophobicContact CE2-CD1 4.33Å; Y204-Y230 AromaticContact CE2-CE1 3.62Å; Y204-Y230 HydrophobicContact CE2-CE1 3.62Å; Y204-Y230 HydrophobicContact CE2-CE2 4.34Å; Y204-Y230 AromaticContact CE2-CZ 3.61Å; Y204-E492 HydrophobicContact CD1-CG 4.32Å; Y204-E492 HydrophobicContact CE1-CB 4.26Å; Y204-E492 HydrophobicContact CE1-CG 4.22Å; Y204-F493 WeakPolarHBondContact O-CA 3.49Å; Y204-R494 HydrophobicContact CD1-CG 4.25Å; Y204-R494 PolarHBondContact N-O 3.24Å; Y204-R494 PolarHBondContact O-N 3.37Å; Y204-R494 VanDerWaalsContact O-N 3.07Å
205	L	94.4	Very high	88.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.8	172.8	170.5	66.1	0	0	0	110.2	F203 L207 I229 F437 L444 F490 E492 F493	F203-L205 HydrophobicContact CD2-CB 3.95Å; F203-L205 HydrophobicContact CE2-CB 3.84Å; L205-L207 HydrophobicContact CD2-CD2 4.35Å; L205-I229 HydrophobicContact CB-CB 4.27Å; L205-I229 HydrophobicContact CD2-CD1 4.11Å; L205-I229 PolarHBondContact N-O 2.92Å; L205-I229 PolarHBondContact O-N 3.22Å; L205-F437 HydrophobicContact CD1-CZ 4.05Å; L205-L444 HydrophobicContact CD2-CD1 4.29Å; L205-F490 HydrophobicContact CD1-CD1 3.8Å; L205-F490 HydrophobicContact CD2-CD1 4.41Å; L205-F490 HydrophobicContact CD2-CE1 4.35Å; L205-E492 WeakPolarHBondContact CD1-O 3.34Å; L205-F493 HydrophobicContact CB-CD2 4.35Å; L205-F493 HydrophobicContact CD1-CB 4.43Å; L205-F493 HydrophobicContact CD1-CD2 4.25Å
206	E	93.4	Very high	86.6	Confident	29 Å²	29	48.4 Å²	48.4	14%	0.136	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124	174.7	-172.4	166.1	171.3	0	0	110.7	Y204 H208 K228 Q491 E492	Y204-E206 HydrophobicContact CE1-CB 3.84Å; Y204-E206 PolarHBondContact OH-OE2 2.96Å; E206-H208 IonicContact OE1-CE1 2.56Å; E206-H208 PolarHBondContact OE1-CE1 3.47Å; E206-H208 IonicContact OE1-NE2 3.28Å; E206-K228 HydrophobicContact CG-CG 4.24Å; E206-Q491 PolarHBondContact O-N 2.81Å; E206-E492 HydrophobicContact CB-CB 4.07Å; E206-E492 PolarHBondContact N-O 3.41Å; E206-E492 PolarHBondContact O-N 3.3Å
207	L	90.6	Very high	85.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.2	179.4	62.6	93.2	0	0	0	110.7	L205 W209 C227 I229 F457 T489	L205-L207 HydrophobicContact CD2-CD2 4.35Å; L207-W209 VanDerWaalsContact CD1-CD1 3.47Å; L207-C227 HydrophobicContact CD1-CB 3.5Å; L207-C227 HydrophobicContact CG-CB 3.81Å; L207-C227 PolarHBondContact N-O 3.42Å; L207-C227 PolarHBondContact O-N 3.5Å; L207-I229 HydrophobicContact CD2-CD1 3.64Å; L207-F457 HydrophobicContact CD1-CE1 3.99Å; L207-F457 HydrophobicContact CD1-CZ 4.19Å; L207-F457 HydrophobicContact CD2-CE1 4.1Å; L207-T489 CarbonylContact C-O 3.53Å; L207-T489 VanDerWaalsContact CA-O 3.31Å; L207-T489 WeakPolarHBondContact CA-O 3.14Å
208	H	90.8	Very high	83.9	Confident	48 Å²	48	54.7 Å²	54.7	22%	0.222	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	135.7	-179.6	-75.7	72.3	0	0	0	110.7	E206 D225 V488 T489 Q491	E206-H208 IonicContact OE1-CE1 2.56Å; E206-H208 PolarHBondContact OE1-CE1 3.47Å; E206-H208 IonicContact OE1-NE2 3.28Å; H208-D225 CarbonylContact C-O 3.58Å; H208-D225 VanDerWaalsContact CA-O 3.31Å; H208-D225 WeakPolarHBondContact CA-O 3.34Å; H208-V488 CarbonylContact O-C 3.56Å; H208-V488 VanDerWaalsContact O-CA 3.31Å; H208-V488 WeakPolarHBondContact O-CA 3.46Å; H208-T489 PolarHBondContact N-O 2.87Å; H208-T489 PolarHBondContact O-N 3.01Å; H208-Q491 PolarHBondContact CD2-NE2 3.27Å; H208-Q491 PolarHBondContact CE1-NE2 2.85Å; H208-Q491 PolarHBondContact CE1-OE1 2.99Å; H208-Q491 VanDerWaalsContact ND1-CG 3.29Å; H208-Q491 WeakPolarHBondContact ND1-CG 3.3Å; H208-Q491 PolarHBondContact ND1-NE2 3.02Å; H208-Q491 PolarHBondContact NE2-NE2 3.44Å
209	W	87.7	Confident	82.4	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.015	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.9	171.5	-67.4	87.2	0	0	0	109.5	L207 F211 S224 D225 C227 H456 F457 L460 A486 T487 V488	L207-W209 VanDerWaalsContact CD1-CD1 3.47Å; W209-F211 HydrophobicContact CB-CD2 4.38Å; W209-F211 HydrophobicContact CB-CE2 3.75Å; W209-F211 HydrophobicContact CB-CZ 4.44Å; W209-F211 HydrophobicContact CE3-CE2 4.38Å; W209-F211 AromaticContact CE3-CZ 3.96Å; W209-F211 HydrophobicContact CE3-CZ 3.96Å; W209-F211 HydrophobicContact CG-CE2 4.48Å; W209-S224 CarbonylContact O-C 3.53Å; W209-S224 WeakPolarHBondContact O-CA 3.19Å; W209-S224 WeakPolarHBondContact O-CB 3.48Å; W209-D225 HydrophobicContact CB-CB 4.32Å; W209-D225 PolarHBondContact N-O 3.16Å; W209-D225 PolarHBondContact O-N 3.25Å; W209-C227 VanDerWaalsContact CD1-SG 3.51Å; W209-H456 AromaticContact CE2-CD2 3.89Å; W209-H456 HydrophobicContact CH2-CB 4.22Å; W209-H456 WeakPolarHBondContact CH2-O 3.34Å; W209-H456 AromaticContact CZ2-CD2 3.8Å; W209-H456 HydrophobicContact CZ3-CB 4.29Å; W209-F457 HydrophobicContact CZ2-CD1 4.06Å; W209-F457 HydrophobicContact CZ2-CE1 4.11Å; W209-F457 AromaticContact NE1-CE1 3.99Å; W209-F457 AromaticContact NE1-CZ 3.94Å; W209-L460 HydrophobicContact CH2-CB 3.84Å; W209-L460 HydrophobicContact CH2-CD2 4.46Å; W209-L460 HydrophobicContact CZ2-CB 4.17Å; W209-L460 HydrophobicContact CZ2-CD2 4.04Å; W209-A486 HydrophobicContact CE3-CB 3.94Å; W209-A486 HydrophobicContact CZ3-CB 4.05Å; W209-T487 WeakPolarHBondContact CA-O 3.29Å; W209-V488 HydrophobicContact CD2-CG2 3.87Å; W209-V488 HydrophobicContact CE3-CG2 3.51Å; W209-V488 HydrophobicContact CH2-CG2 3.57Å; W209-V488 HydrophobicContact CZ2-CG2 3.93Å; W209-V488 HydrophobicContact CZ3-CG2 3.34Å
210	D	87.2	Confident	81.1	Confident	68 Å²	68	53.2 Å²	53.2	36%	0.364	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	115.2	171.7	-180	25.6	0	0	0	109.6	Q212 A486 T487	D210-Q212 PolarHBondContact OD2-NE2 3.12Å; D210-A486 CarbonylContact O-C 3.58Å; D210-A486 WeakPolarHBondContact O-CA 3.36Å; D210-T487 PolarHBondContact N-O 3.37Å; D210-T487 PolarHBondContact O-N 3.24Å
211	F	82.9	Confident	80	Confident	3 Å²	3	56.1 Å²	56.1	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.8	-177.1	-65.5	-99.8	0	0	0	110	W209 L222 P223 L242 F245 V480 I484 A486	W209-F211 HydrophobicContact CB-CD2 4.38Å; W209-F211 HydrophobicContact CB-CE2 3.75Å; W209-F211 HydrophobicContact CB-CZ 4.44Å; W209-F211 HydrophobicContact CE3-CE2 4.38Å; W209-F211 AromaticContact CE3-CZ 3.96Å; W209-F211 HydrophobicContact CE3-CZ 3.96Å; W209-F211 HydrophobicContact CG-CE2 4.48Å; F211-L222 HydrophobicContact CB-CB 3.88Å; F211-L222 HydrophobicContact CB-CD1 4.29Å; F211-L222 HydrophobicContact CB-CG 4.46Å; F211-L222 WeakPolarHBondContact O-CB 3.48Å; F211-L222 WeakPolarHBondContact O-CD1 3.46Å; F211-P223 WeakPolarHBondContact CB-O 3.45Å; F211-P223 HydrophobicContact CD2-CG 3.88Å; F211-P223 VanDerWaalsContact CD2-O 3.25Å; F211-P223 WeakPolarHBondContact CD2-O 3.16Å; F211-P223 HydrophobicContact CE2-CG 4.24Å; F211-P223 HydrophobicContact CG-CG 4.33Å; F211-P223 PolarHBondContact N-O 2.94Å; F211-L242 HydrophobicContact CE2-CD2 4.37Å; F211-F245 HydrophobicContact CD1-CD1 4.48Å; F211-F245 AromaticContact CD1-CE1 3.99Å; F211-F245 HydrophobicContact CD1-CE1 3.99Å; F211-F245 HydrophobicContact CD1-CZ 4.46Å; F211-F245 HydrophobicContact CE1-CD1 4.16Å; F211-F245 HydrophobicContact CE1-CE1 4.08Å; F211-V480 HydrophobicContact CE1-CG2 4.3Å; F211-I484 HydrophobicContact CB-CG2 4.33Å; F211-I484 HydrophobicContact CD1-CG2 4.24Å; F211-A486 HydrophobicContact CD1-CB 3.74Å; F211-A486 HydrophobicContact CE1-CB 3.73Å; F211-A486 HydrophobicContact CG-CB 4.39Å; F211-A486 HydrophobicContact CZ-CB 4.37Å
212	Q	81.2	Confident	78.9	Confident	96 Å²	96	55.2 Å²	55.2	45%	0.449	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	145.6	-176	-61.5	-177.1	-2.6	0	0	111.1	D210 L222 I484 T485	D210-Q212 PolarHBondContact OD2-NE2 3.12Å; Q212-L222 VanDerWaalsContact C-CD1 3.45Å; Q212-I484 CarbonylContact O-C 3.57Å; Q212-I484 VanDerWaalsContact O-CA 3.3Å; Q212-I484 WeakPolarHBondContact O-CA 3.19Å; Q212-T485 PolarHBondContact N-O 3.4Å; Q212-T485 PolarHBondContact O-N 2.87Å
213	S	78	Confident	77.9	Confident	16 Å²	16	53.4 Å²	53.4	11%	0.112	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.1	174.4	175.3	0	0	0	0	111.1	V215 T483	S213-V215 WeakPolarHBondContact OG-CB 3.15Å; S213-V215 PolarHBondContact OG-N 2.86Å; S213-T483 VanDerWaalsContact CA-O 3.29Å; S213-T483 WeakPolarHBondContact CA-O 3.47Å; S213-T483 WeakPolarHBondContact CB-O 3.39Å; S213-T483 PolarHBondContact OG-O 3.43Å; S213-T483 VanDerWaalsContact OG-O 3.13Å
214	W	66.5	Low	77.2	Confident	173 Å²	173	56.1 Å²	56.1	66%	0.655	28%	0.28	S	S	*	.	S	Bend	trans	-75	-16.1	170.9	68.9	-87.1	0	0	0	112.3	P216 T483	W214-P216 WeakPolarHBondContact O-CD 3.23Å; W214-T483 HydrophobicContact CZ2-CG2 4.03Å
215	V	66.4	Low	76.6	Confident	37 Å²	37	55.7 Å²	55.7	22%	0.224	28%	0.279	C	S	.	.	S	Bend	trans	-71.1	123	175.6	-179	0	0	0	0	108.4	S213 L218 T483	S213-V215 WeakPolarHBondContact OG-CB 3.15Å; S213-V215 PolarHBondContact OG-N 2.86Å; V215-L218 HydrophobicContact CB-CB 3.98Å; V215-L218 HydrophobicContact CB-CD2 4.1Å; V215-L218 HydrophobicContact CG1-CB 4.16Å; V215-L218 HydrophobicContact CG1-CD2 4.46Å; V215-L218 HydrophobicContact CG2-CD2 4.42Å; V215-L218 PolarHBondContact O-N 2.99Å; V215-T483 HydrophobicContact CG2-CG2 3.98Å
216	P	61.6	Low	76.3	Confident	107 Å²	107	57 Å²	57	70%	0.695	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	143.2	178.8	-25.6	34.3	0	0	0	111.9	W214 L218	W214-P216 WeakPolarHBondContact O-CD 3.23Å; P216-L218 PolarHBondContact O-N 3.47Å
217	L	65.4	Low	76.2	Confident	134 Å²	134	55.6 Å²	55.6	70%	0.702	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	-26.5	-178	-51.8	171.9	0	0	0	115.9	S219 R220	L217-S219 VanDerWaalsContact C-N 3.26Å; L217-S219 PolarHBondContact O-N 2.7Å; L217-R220 WeakPolarHBondContact O-CB 3.27Å; L217-R220 PolarHBondContact O-N 2.78Å; L217-R220 VanDerWaalsContact O-N 3.11Å
218	L	60.8	Low	76.3	Confident	12 Å²	12	59.2 Å²	59.2	6%	0.063	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-64.3	-32.7	178.5	-167.1	57.9	0	0	0	111.6	V215 P216 R220 I221 L222	V215-L218 HydrophobicContact CB-CB 3.98Å; V215-L218 HydrophobicContact CB-CD2 4.1Å; V215-L218 HydrophobicContact CG1-CB 4.16Å; V215-L218 HydrophobicContact CG1-CD2 4.46Å; V215-L218 HydrophobicContact CG2-CD2 4.42Å; V215-L218 PolarHBondContact O-N 2.99Å; P216-L218 PolarHBondContact O-N 3.47Å; L218-R220 PolarHBondContact O-N 2.61Å; L218-I221 HydrophobicContact CD1-CD1 3.72Å; L218-I221 HydrophobicContact CD1-CG1 3.94Å; L218-I221 VanDerWaalsContact O-CG1 3.28Å; L218-I221 WeakPolarHBondContact O-CG1 3.18Å; L218-I221 PolarHBondContact O-N 2.76Å; L218-L222 WeakPolarHBondContact O-CG 3.5Å; L218-L222 PolarHBondContact O-N 2.8Å
219	S	62.9	Low	76.5	Confident	59 Å²	59	57 Å²	57	41%	0.413	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-61.4	-22	174.9	60.6	0	0	0	0	114.6	L217 I221	L217-S219 VanDerWaalsContact C-N 3.26Å; L217-S219 PolarHBondContact O-N 2.7Å; S219-I221 VanDerWaalsContact C-N 3.33Å
220	R	63.9	Low	76.9	Confident	213 Å²	213	58.7 Å²	58.7	80%	0.804	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-79.5	-15.8	-178.9	-67.1	-178.9	67.1	149	0.3	113.7	L217 L218	L217-R220 WeakPolarHBondContact O-CB 3.27Å; L217-R220 PolarHBondContact O-N 2.78Å; L217-R220 VanDerWaalsContact O-N 3.11Å; L218-R220 PolarHBondContact O-N 2.61Å
221	I	66.1	Low	77.3	Confident	85 Å²	85	55.5 Å²	55.5	44%	0.436	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-1.6	-176.3	65.4	171	0	0	0	112.6	L218 S219	L218-I221 HydrophobicContact CD1-CD1 3.72Å; L218-I221 HydrophobicContact CD1-CG1 3.94Å; L218-I221 VanDerWaalsContact O-CG1 3.28Å; L218-I221 WeakPolarHBondContact O-CG1 3.18Å; L218-I221 PolarHBondContact O-N 2.76Å; S219-I221 VanDerWaalsContact C-N 3.33Å
222	L	69.7	Low	77.9	Confident	21 Å²	21	57.2 Å²	57.2	11%	0.11	29%	0.286	C	S	.	.	S	Bend	trans	-76	141	175.2	-71	175.1	0	0	0	110.2	F211 Q212 L218 F245 M248 I484	F211-L222 HydrophobicContact CB-CB 3.88Å; F211-L222 HydrophobicContact CB-CD1 4.29Å; F211-L222 HydrophobicContact CB-CG 4.46Å; F211-L222 WeakPolarHBondContact O-CB 3.48Å; F211-L222 WeakPolarHBondContact O-CD1 3.46Å; Q212-L222 VanDerWaalsContact C-CD1 3.45Å; L218-L222 WeakPolarHBondContact O-CG 3.5Å; L218-L222 PolarHBondContact O-N 2.8Å; L222-F245 HydrophobicContact CD2-CE2 4.12Å; L222-F245 HydrophobicContact CD2-CZ 3.66Å; L222-M248 HydrophobicContact CD2-SD 3.95Å; L222-I484 HydrophobicContact CD1-CG1 4.31Å; L222-I484 HydrophobicContact CD1-CG2 4.05Å; L222-I484 HydrophobicContact CD2-CD1 3.84Å; L222-I484 HydrophobicContact CD2-CG1 4.31Å; L222-I484 HydrophobicContact CD2-CG2 4.36Å
223	P	74.8	Confident	78.5	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.019	28%	0.279	C	S	.	.			trans	-68.7	161.9	-179.7	27.8	-33.9	0	0	0	111.6	F211 L242 F245 C250	F211-P223 WeakPolarHBondContact CB-O 3.45Å; F211-P223 HydrophobicContact CD2-CG 3.88Å; F211-P223 VanDerWaalsContact CD2-O 3.25Å; F211-P223 WeakPolarHBondContact CD2-O 3.16Å; F211-P223 HydrophobicContact CE2-CG 4.24Å; F211-P223 HydrophobicContact CG-CG 4.33Å; F211-P223 PolarHBondContact N-O 2.94Å; P223-L242 HydrophobicContact CB-CD1 3.69Å; P223-L242 HydrophobicContact CB-CD2 4.33Å; P223-L242 HydrophobicContact CG-CD1 4.15Å; P223-L242 HydrophobicContact CG-CD2 4.3Å; P223-F245 HydrophobicContact CG-CD2 3.39Å; P223-F245 HydrophobicContact CG-CE2 3.48Å; P223-F245 VanDerWaalsContact CG-CE2 3.48Å; P223-F245 HydrophobicContact CG-CG 4.05Å; P223-F245 HydrophobicContact CG-CZ 4.2Å; P223-C250 HydrophobicContact CB-CB 4.43Å
224	S	81.5	Confident	79.3	Confident	58 Å²	58	54.6 Å²	54.6	41%	0.406	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	147.1	155.3	59.7	0	0	0	0	107.7	W209 R252	W209-S224 CarbonylContact O-C 3.53Å; W209-S224 WeakPolarHBondContact O-CA 3.19Å; W209-S224 WeakPolarHBondContact O-CB 3.48Å; S224-R252 VanDerWaalsContact O-CZ 3.29Å; S224-R252 PolarHBondContact O-NH1 2.89Å; S224-R252 PolarHBondContact O-NH2 3.26Å
225	D	84	Confident	80.6	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148.6	180	-169.6	32.1	0	0	0	111.3	H208 W209 C227 T240 T241 L242	H208-D225 CarbonylContact C-O 3.58Å; H208-D225 VanDerWaalsContact CA-O 3.31Å; H208-D225 WeakPolarHBondContact CA-O 3.34Å; W209-D225 HydrophobicContact CB-CB 4.32Å; W209-D225 PolarHBondContact N-O 3.16Å; W209-D225 PolarHBondContact O-N 3.25Å; D225-C227 PolarHBondContact OD2-SG 3.19Å; D225-T240 VanDerWaalsContact CG-OG1 3.28Å; D225-T240 PolarHBondContact OD1-OG1 2.98Å; D225-T240 PolarHBondContact OD2-OG1 3.18Å; D225-T241 WeakPolarHBondContact OD1-CA 3.37Å; D225-T241 WeakPolarHBondContact OD1-CB 3.37Å; D225-T241 PolarHBondContact OD1-N 3.32Å; D225-T241 PolarHBondContact OD1-OG1 3.21Å; D225-L242 HydrophobicContact CB-CB 3.85Å; D225-L242 HydrophobicContact CB-CD2 4.22Å; D225-L242 PolarHBondContact OD1-N 3.39Å
226	A	87.3	Confident	82	Confident	27 Å²	27	45.9 Å²	45.9	22%	0.223	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	102	173.1	0	0	0	0	0	107.3
227	C	90.6	Very high	83.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.9	178.6	-49.8	0	0	0	0	109.8	L207 W209 D225 L238 D239 F457	L207-C227 HydrophobicContact CD1-CB 3.5Å; L207-C227 HydrophobicContact CG-CB 3.81Å; L207-C227 PolarHBondContact N-O 3.42Å; L207-C227 PolarHBondContact O-N 3.5Å; W209-C227 VanDerWaalsContact CD1-SG 3.51Å; D225-C227 PolarHBondContact OD2-SG 3.19Å; C227-L238 HydrophobicContact CB-CD1 3.75Å; C227-D239 CarbonylContact C-O 3.6Å; C227-D239 VanDerWaalsContact CA-O 3.3Å; C227-D239 WeakPolarHBondContact CA-O 3.49Å; C227-F457 HydrophobicContact CB-CZ 4.23Å
228	K	93.9	Very high	84.9	Confident	76 Å²	76	36.5 Å²	36.5	33%	0.33	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.6	176.5	-61.2	176.5	-177.1	172	0	109.4	Y204 E206 Y230 L238 D239	Y204-K228 HydrophobicContact CE2-CB 4Å; Y204-K228 HydrophobicContact CE2-CD 4.4Å; Y204-K228 HydrophobicContact CE2-CG 4.28Å; Y204-K228 WeakPolarHBondContact OH-CD 3.36Å; Y204-K228 WeakPolarHBondContact OH-CG 3.48Å; E206-K228 HydrophobicContact CG-CG 4.24Å; K228-Y230 HydrophobicContact CB-CE2 3.73Å; K228-L238 CarbonylContact O-C 3.5Å; K228-L238 VanDerWaalsContact O-CA 3.31Å; K228-L238 WeakPolarHBondContact O-CA 3.08Å; K228-D239 HydrophobicContact CB-CB 4.31Å; K228-D239 PolarHBondContact N-O 2.72Å; K228-D239 PolarHBondContact O-N 2.88Å
229	I	94.9	Very high	86.5	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.1	-178.6	-61.3	166	0	0	0	108.1	F203 Y204 L205 L207 I236 R237 L238 V447 I451	F203-I229 HydrophobicContact CE2-CG2 4.35Å; Y204-I229 CarbonylContact C-O 3.56Å; Y204-I229 WeakPolarHBondContact CA-O 3.33Å; L205-I229 HydrophobicContact CB-CB 4.27Å; L205-I229 HydrophobicContact CD2-CD1 4.11Å; L205-I229 PolarHBondContact N-O 2.92Å; L205-I229 PolarHBondContact O-N 3.22Å; L207-I229 HydrophobicContact CD2-CD1 3.64Å; I229-I236 HydrophobicContact CG2-CG2 4.05Å; I229-R237 CarbonylContact C-O 3.58Å; I229-R237 WeakPolarHBondContact CA-O 3.48Å; I229-L238 HydrophobicContact CG1-CD1 3.82Å; I229-V447 HydrophobicContact CD1-CG1 4.4Å; I229-V447 HydrophobicContact CG2-CG1 4.05Å; I229-I451 HydrophobicContact CD1-CD1 3.49Å; I229-I451 VanDerWaalsContact CD1-CD1 3.49Å; I229-I451 HydrophobicContact CG1-CD1 4.22Å
230	Y	96.5	Very high	87.7	Confident	41 Å²	41	34.6 Å²	34.6	16%	0.161	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.7	172.9	-53.2	-96.7	0	0	0	107.2	Y204 K228 I236 R237 F498 I502 F503	Y204-Y230 AromaticContact CD2-CD1 3.79Å; Y204-Y230 HydrophobicContact CD2-CD1 3.79Å; Y204-Y230 AromaticContact CD2-CE1 3.46Å; Y204-Y230 HydrophobicContact CD2-CE1 3.46Å; Y204-Y230 VanDerWaalsContact CD2-CE1 3.46Å; Y204-Y230 HydrophobicContact CD2-CG 4.49Å; Y204-Y230 AromaticContact CD2-CZ 3.93Å; Y204-Y230 HydrophobicContact CE2-CD1 4.33Å; Y204-Y230 AromaticContact CE2-CE1 3.62Å; Y204-Y230 HydrophobicContact CE2-CE1 3.62Å; Y204-Y230 HydrophobicContact CE2-CE2 4.34Å; Y204-Y230 AromaticContact CE2-CZ 3.61Å; K228-Y230 HydrophobicContact CB-CE2 3.73Å; Y230-I236 CarbonylContact O-C 3.56Å; Y230-I236 WeakPolarHBondContact O-CA 3.36Å; Y230-R237 HydrophobicContact CD2-CB 4.42Å; Y230-R237 HydrophobicContact CD2-CG 4.13Å; Y230-R237 PolarHBondContact N-O 3.34Å; Y230-R237 PolarHBondContact O-N 2.87Å; Y230-F498 HydrophobicContact CD1-CD1 4.01Å; Y230-F498 AromaticContact CD1-CE1 3.61Å; Y230-F498 HydrophobicContact CD1-CE1 3.61Å; Y230-F498 AromaticContact CD1-CZ 3.9Å; Y230-F498 HydrophobicContact CD1-CZ 3.9Å; Y230-F498 HydrophobicContact CE1-CE1 4.25Å; Y230-I502 HydrophobicContact CD1-CD1 4.16Å; Y230-I502 HydrophobicContact CG-CD1 4.26Å; Y230-F503 WeakPolarHBondContact O-CE1 3.41Å
231	K	95.6	Very high	88.7	Confident	1 Å²	1	27 Å²	27	0%	0.004	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	127.5	177.4	-178.4	-91.7	168.5	-160.4	0	109.2	L197 L200 G201 D202 F203 G233 I236 F498	L197-K231 WeakPolarHBondContact O-CE 3.35Å; L197-K231 PolarHBondContact O-NZ 3.26Å; L200-K231 PolarHBondContact O-NZ 3.39Å; G201-K231 WeakPolarHBondContact O-CD 3.23Å; G201-K231 PolarHBondContact O-NZ 2.84Å; G201-K231 VanDerWaalsContact O-NZ 3.15Å; D202-K231 WeakPolarHBondContact CA-O 3.48Å; D202-K231 WeakPolarHBondContact CB-O 3.44Å; D202-K231 IonicContact OD1-NZ 3.98Å; D202-K231 PolarHBondContact OD1-NZ 2.94Å; F203-K231 HydrophobicContact CD1-CB 4.04Å; F203-K231 HydrophobicContact CD1-CD 4Å; F203-K231 HydrophobicContact CD1-CG 4.36Å; F203-K231 HydrophobicContact CE1-CB 3.68Å; F203-K231 HydrophobicContact CE1-CD 3.82Å; F203-K231 HydrophobicContact CE1-CG 3.82Å; F203-K231 HydrophobicContact CE2-CB 4.18Å; F203-K231 HydrophobicContact CG-CB 4.42Å; F203-K231 HydrophobicContact CZ-CB 3.73Å; F203-K231 HydrophobicContact CZ-CG 4.19Å; F203-K231 PolarHBondContact N-O 2.86Å; F203-K231 PolarHBondContact O-N 2.91Å; K231-G233 WeakPolarHBondContact CE-O 3.39Å; K231-G233 PolarHBondContact NZ-O 2.89Å; K231-I236 HydrophobicContact CB-CG1 4.38Å; K231-I236 HydrophobicContact CG-CG1 4.08Å; K231-F498 WeakPolarHBondContact O-CE2 3.32Å
232	H	95.1	Very high	89.2	Confident	39 Å²	39	23.4 Å²	23.4	18%	0.181	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	118.3	176.3	-176.4	67.5	0	0	0	110.8	D202 I234 N235 F498 E500 F503	D202-H232 WeakPolarHBondContact OD1-CA 3.43Å; D202-H232 IonicContact OD2-CE1 3.41Å; D202-H232 PolarHBondContact OD2-CE1 3.33Å; D202-H232 IonicContact OD2-CG 3.4Å; D202-H232 IonicContact OD2-ND1 2.76Å; D202-H232 PolarHBondContact OD2-ND1 3.25Å; H232-I234 PolarHBondContact O-N 3.04Å; H232-N235 PolarHBondContact N-O 2.69Å; H232-N235 WeakPolarHBondContact O-CB 3.4Å; H232-N235 PolarHBondContact O-N 3.31Å; H232-F498 HydrophobicContact CB-CD2 4.4Å; H232-E500 IonicContact NE2-OE1 2.84Å; H232-F503 HydrophobicContact CB-CD2 4.11Å; H232-F503 HydrophobicContact CB-CE1 4.15Å; H232-F503 HydrophobicContact CB-CE2 3.37Å; H232-F503 HydrophobicContact CB-CZ 3.4Å
233	G	93.5	Very high	89	Confident	30 Å²	30	23.9 Å²	23.9	31%	0.309	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	-109.7	-176.4	0	0	0	0	0	112.2	L197 D202 K231	L197-G233 CarbonylContact C-O 3.53Å; L197-G233 VanDerWaalsContact O-O 3.08Å; D202-G233 PolarHBondContact OD1-N 3.05Å; K231-G233 WeakPolarHBondContact CE-O 3.39Å; K231-G233 PolarHBondContact NZ-O 2.89Å
234	I	94.1	Very high	88.4	Confident	27 Å²	27	26.2 Å²	26.2	14%	0.138	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	8.9	174.2	63.6	174	0	0	0	113	L194 L197 K198 H232 G261 N262	L194-I234 HydrophobicContact CD2-CB 4.43Å; L194-I234 HydrophobicContact CD2-CD1 4.45Å; L197-I234 HydrophobicContact CB-CB 4.47Å; L197-I234 HydrophobicContact CB-CG2 4.37Å; K198-I234 HydrophobicContact CB-CG2 3.8Å; K198-I234 HydrophobicContact CG-CG2 4.48Å; H232-I234 PolarHBondContact O-N 3.04Å; I234-G261 VanDerWaalsContact CD1-C 3.44Å; I234-N262 WeakPolarHBondContact CD1-OD1 3.47Å
235	N	95.1	Very high	87	Confident	25 Å²	25	24.8 Å²	24.8	13%	0.134	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	144.3	-179.2	-56.2	-37.5	0	0	0	109.7	H232 F259 N260 G261 F503	H232-N235 PolarHBondContact N-O 2.69Å; H232-N235 WeakPolarHBondContact O-CB 3.4Å; H232-N235 PolarHBondContact O-N 3.31Å; N235-F259 VanDerWaalsContact CA-O 3.3Å; N235-F259 WeakPolarHBondContact CA-O 3.43Å; N235-N260 WeakPolarHBondContact OD1-CA 3.14Å; N235-N260 PolarHBondContact OD1-OD1 3.12Å; N235-G261 PolarHBondContact OD1-N 3.08Å; N235-G261 VanDerWaalsContact OD1-N 3.09Å; N235-F503 HydrophobicContact CB-CB 4.21Å; N235-F503 HydrophobicContact CB-CD1 3.81Å; N235-F503 HydrophobicContact CB-CE1 4.47Å; N235-F503 HydrophobicContact CB-CG 4.12Å
236	I	94.9	Very high	85.5	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136.4	176.6	-66.6	177.8	0	0	0	107.9	L197 I229 Y230 K231 F259 V447 V450 I451	L197-I236 HydrophobicContact CD1-CD1 4.32Å; L197-I236 HydrophobicContact CD2-CD1 3.78Å; I229-I236 HydrophobicContact CG2-CG2 4.05Å; Y230-I236 CarbonylContact O-C 3.56Å; Y230-I236 WeakPolarHBondContact O-CA 3.36Å; K231-I236 HydrophobicContact CB-CG1 4.38Å; K231-I236 HydrophobicContact CG-CG1 4.08Å; I236-F259 HydrophobicContact CB-CB 4.35Å; I236-F259 PolarHBondContact N-O 3.23Å; I236-F259 VanDerWaalsContact N-O 3.07Å; I236-F259 PolarHBondContact O-N 2.89Å; I236-V447 HydrophobicContact CD1-CG1 4.26Å; I236-V450 HydrophobicContact CB-CG1 4.47Å; I236-V450 HydrophobicContact CD1-CB 3.96Å; I236-V450 HydrophobicContact CD1-CG1 4.06Å; I236-V450 HydrophobicContact CD1-CG2 3.95Å; I236-I451 HydrophobicContact CG2-CG2 3.96Å
237	R	95.1	Very high	83.8	Confident	43 Å²	43	29.6 Å²	29.6	16%	0.162	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.8	166.2	168.3	170	168.3	160.2	0.5	109	I229 Y230 D239 S256 F257 I258 I502 F503	I229-R237 CarbonylContact C-O 3.58Å; I229-R237 WeakPolarHBondContact CA-O 3.48Å; Y230-R237 HydrophobicContact CD2-CB 4.42Å; Y230-R237 HydrophobicContact CD2-CG 4.13Å; Y230-R237 PolarHBondContact N-O 3.34Å; Y230-R237 PolarHBondContact O-N 2.87Å; R237-D239 WeakPolarHBondContact CG-OD1 3.36Å; R237-D239 IonicContact CZ-OD1 2.73Å; R237-D239 IonicContact CZ-OD2 3.73Å; R237-D239 IonicContact NE-OD1 3.85Å; R237-D239 PolarHBondContact NE-OD1 3.35Å; R237-D239 IonicContact NE-OD2 3.99Å; R237-D239 PolarHBondContact NE-OD2 3.14Å; R237-D239 IonicContact NH2-OD1 3.19Å; R237-D239 PolarHBondContact NH2-OD1 3.35Å; R237-D239 IonicContact NH2-OD2 3.34Å; R237-D239 PolarHBondContact NH2-OD2 3.25Å; R237-S256 PolarHBondContact NH2-OG 3.31Å; R237-S256 VanDerWaalsContact NH2-OG 3.14Å; R237-F257 CarbonylContact C-O 3.53Å; R237-F257 VanDerWaalsContact CA-O 3.23Å; R237-F257 WeakPolarHBondContact CA-O 3.31Å; R237-I258 HydrophobicContact CG-CG1 4.46Å; R237-I502 WeakPolarHBondContact CD-O 3.5Å; R237-I502 PolarHBondContact NH1-O 3.29Å; R237-F503 HydrophobicContact CB-CD1 3.82Å; R237-F503 HydrophobicContact CB-CE1 3.83Å
238	L	93.7	Very high	82	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.6	174.5	161.9	67.3	0	0	0	108.3	C227 K228 I229 S256 F257 I451 F454 F457	C227-L238 HydrophobicContact CB-CD1 3.75Å; K228-L238 CarbonylContact O-C 3.5Å; K228-L238 VanDerWaalsContact O-CA 3.31Å; K228-L238 WeakPolarHBondContact O-CA 3.08Å; I229-L238 HydrophobicContact CG1-CD1 3.82Å; L238-S256 CarbonylContact O-C 3.6Å; L238-S256 WeakPolarHBondContact O-CA 3.04Å; L238-F257 HydrophobicContact CB-CB 4.17Å; L238-F257 HydrophobicContact CD2-CD2 4.27Å; L238-F257 HydrophobicContact CG-CD2 4.29Å; L238-F257 PolarHBondContact N-O 2.85Å; L238-F257 PolarHBondContact O-N 3.45Å; L238-I451 HydrophobicContact CB-CG2 4.36Å; L238-I451 HydrophobicContact CD2-CB 4.13Å; L238-I451 HydrophobicContact CD2-CD1 4.43Å; L238-I451 HydrophobicContact CD2-CG2 4.32Å; L238-F454 HydrophobicContact CD2-CE2 4.45Å; L238-F457 HydrophobicContact CD1-CZ 4.45Å; L238-F457 HydrophobicContact CD2-CE2 4.04Å; L238-F457 HydrophobicContact CD2-CZ 4.37Å
239	D	93.3	Very high	80.1	Confident	23 Å²	23	32.5 Å²	32.5	12%	0.123	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	133.3	171.4	-64.6	-11.8	0	0	0	109	C227 K228 R237 L255 S256	C227-D239 CarbonylContact C-O 3.6Å; C227-D239 VanDerWaalsContact CA-O 3.3Å; C227-D239 WeakPolarHBondContact CA-O 3.49Å; K228-D239 HydrophobicContact CB-CB 4.31Å; K228-D239 PolarHBondContact N-O 2.72Å; K228-D239 PolarHBondContact O-N 2.88Å; R237-D239 WeakPolarHBondContact CG-OD1 3.36Å; R237-D239 IonicContact CZ-OD1 2.73Å; R237-D239 IonicContact CZ-OD2 3.73Å; R237-D239 IonicContact NE-OD1 3.85Å; R237-D239 PolarHBondContact NE-OD1 3.35Å; R237-D239 IonicContact NE-OD2 3.99Å; R237-D239 PolarHBondContact NE-OD2 3.14Å; R237-D239 IonicContact NH2-OD1 3.19Å; R237-D239 PolarHBondContact NH2-OD1 3.35Å; R237-D239 IonicContact NH2-OD2 3.34Å; R237-D239 PolarHBondContact NH2-OD2 3.25Å; D239-L255 WeakPolarHBondContact CA-O 3.27Å; D239-S256 VanDerWaalsContact OD1-CB 3.25Å; D239-S256 WeakPolarHBondContact OD1-CB 3.09Å; D239-S256 PolarHBondContact OD1-OG 3.14Å
240	T	89.1	Confident	78.5	Confident	8 Å²	8	34.8 Å²	34.8	5%	0.049	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	151.6	-178.8	167.8	0	0	0	0	110.4	D225 L242 L255 F257	D225-T240 VanDerWaalsContact CG-OG1 3.28Å; D225-T240 PolarHBondContact OD1-OG1 2.98Å; D225-T240 PolarHBondContact OD2-OG1 3.18Å; T240-L242 PolarHBondContact OG1-N 2.91Å; T240-L255 HydrophobicContact CG2-CB 4.29Å; T240-L255 PolarHBondContact N-O 2.91Å; T240-L255 PolarHBondContact O-N 3.4Å; T240-F257 HydrophobicContact CG2-CD2 3.87Å; T240-F257 HydrophobicContact CG2-CE2 3.42Å; T240-F257 VanDerWaalsContact CG2-CE2 3.42Å
241	T	84	Confident	77	Confident	53 Å²	53	38 Å²	38	33%	0.325	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-5.9	175.1	69	0	0	0	0	113.8	D225 R252 G253	D225-T241 WeakPolarHBondContact OD1-CA 3.37Å; D225-T241 WeakPolarHBondContact OD1-CB 3.37Å; D225-T241 PolarHBondContact OD1-N 3.32Å; D225-T241 PolarHBondContact OD1-OG1 3.21Å; T241-R252 WeakPolarHBondContact O-CA 3.31Å; T241-R252 PolarHBondContact OG1-NH1 3.23Å; T241-G253 CarbonylContact C-O 3.57Å; T241-G253 WeakPolarHBondContact CA-O 3.46Å; T241-G253 PolarHBondContact O-N 2.8Å; T241-G253 VanDerWaalsContact O-N 3.11Å
242	L	75.9	Confident	76	Confident	9 Å²	9	44.2 Å²	44.2	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	107.4	-173	-173.8	66.3	0	0	0	109.7	F211 P223 D225 T240 F245	F211-L242 HydrophobicContact CE2-CD2 4.37Å; P223-L242 HydrophobicContact CB-CD1 3.69Å; P223-L242 HydrophobicContact CB-CD2 4.33Å; P223-L242 HydrophobicContact CG-CD1 4.15Å; P223-L242 HydrophobicContact CG-CD2 4.3Å; D225-L242 HydrophobicContact CB-CB 3.85Å; D225-L242 HydrophobicContact CB-CD2 4.22Å; D225-L242 PolarHBondContact OD1-N 3.39Å; T240-L242 PolarHBondContact OG1-N 2.91Å; L242-F245 HydrophobicContact CD2-CB 4.28Å
243	I	66.1	Low	75.3	Confident	31 Å²	31	42.8 Å²	42.8	16%	0.159	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	-51.4	-177.4	-53.9	-173.3	0	0	0	110.4	Q251 L255 F516	I243-Q251 HydrophobicContact CB-CB 3.94Å; I243-Q251 WeakPolarHBondContact CB-O 3.36Å; I243-Q251 HydrophobicContact CD1-CB 4.25Å; I243-Q251 HydrophobicContact CG1-CB 4.37Å; I243-Q251 HydrophobicContact CG2-CB 4.48Å; I243-Q251 PolarHBondContact N-O 3.49Å; I243-L255 HydrophobicContact CB-CD1 3.96Å; I243-L255 HydrophobicContact CG1-CD1 3.68Å; I243-L255 HydrophobicContact CG1-CG 4.05Å; I243-L255 HydrophobicContact CG2-CD1 4Å; I243-F516 HydrophobicContact CG2-CD1 4.49Å; I243-F516 HydrophobicContact CG2-CE1 4.37Å
244	D	62.1	Low	75.1	Confident	53 Å²	53	45 Å²	45	28%	0.283	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	154.4	176.6	-169.1	24.8	0	0	0	111.4	T246	D244-T246 PolarHBondContact OD1-N 2.9Å; D244-T246 VanDerWaalsContact OD1-N 3.13Å; D244-T246 PolarHBondContact OD1-OG1 2.87Å; D244-T246 WeakPolarHBondContact OD2-CB 3.36Å; D244-T246 PolarHBondContact OD2-N 3.32Å; D244-T246 PolarHBondContact OD2-OG1 3.45Å
245	F	53.1	Low	75	Confident	27 Å²	27	43.7 Å²	43.7	12%	0.118	22%	0.219	C	C	.	.			trans	-136.3	39.9	170.2	-170.6	-114.6	0	0	0	110.9	F211 L222 P223 L242 M248	F211-F245 HydrophobicContact CD1-CD1 4.48Å; F211-F245 AromaticContact CD1-CE1 3.99Å; F211-F245 HydrophobicContact CD1-CE1 3.99Å; F211-F245 HydrophobicContact CD1-CZ 4.46Å; F211-F245 HydrophobicContact CE1-CD1 4.16Å; F211-F245 HydrophobicContact CE1-CE1 4.08Å; L222-F245 HydrophobicContact CD2-CE2 4.12Å; L222-F245 HydrophobicContact CD2-CZ 3.66Å; P223-F245 HydrophobicContact CG-CD2 3.39Å; P223-F245 HydrophobicContact CG-CE2 3.48Å; P223-F245 VanDerWaalsContact CG-CE2 3.48Å; P223-F245 HydrophobicContact CG-CG 4.05Å; P223-F245 HydrophobicContact CG-CZ 4.2Å; L242-F245 HydrophobicContact CD2-CB 4.28Å; F245-M248 HydrophobicContact CD1-CE 4.16Å; F245-M248 HydrophobicContact CD2-CE 4.39Å; F245-M248 HydrophobicContact CE1-CE 3.38Å; F245-M248 HydrophobicContact CE1-SD 4.45Å; F245-M248 HydrophobicContact CE2-CE 3.64Å; F245-M248 HydrophobicContact CE2-SD 4.04Å; F245-M248 HydrophobicContact CZ-CE 3.08Å; F245-M248 HydrophobicContact CZ-SD 3.63Å
246	T	50.8	Low	74.9	Confident	41 Å²	41	42.5 Å²	42.5	25%	0.252	21%	0.213	S	C	.	.	S	Bend	trans	-84.8	139.5	165.5	-32.5	0	0	0	0	108.8	D244 M248 K249 K455	D244-T246 PolarHBondContact OD1-N 2.9Å; D244-T246 VanDerWaalsContact OD1-N 3.13Å; D244-T246 PolarHBondContact OD1-OG1 2.87Å; D244-T246 WeakPolarHBondContact OD2-CB 3.36Å; D244-T246 PolarHBondContact OD2-N 3.32Å; D244-T246 PolarHBondContact OD2-OG1 3.45Å; T246-M248 VanDerWaalsContact C-N 3.29Å; T246-M248 PolarHBondContact O-N 3.16Å; T246-M248 VanDerWaalsContact O-N 3.12Å; T246-K249 PolarHBondContact O-N 2.96Å; T246-K455 PolarHBondContact OG1-NZ 2.86Å
247	D	53.1	Low	74.7	Confident	91 Å²	91	43.3 Å²	43.3	49%	0.487	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	38.1	177.7	-55	-32.7	0	0	0	115.6	K249 L371	D247-K249 PolarHBondContact O-N 3.02Å; D247-L371 HydrophobicContact CB-CD1 4.42Å; D247-L371 HydrophobicContact CB-CD2 4.21Å; D247-L371 WeakPolarHBondContact O-CD2 3.02Å
248	M	52	Low	74.6	Confident	43 Å²	43	41.5 Å²	41.5	21%	0.212	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	11.9	178.3	-51.2	-67.5	90.8	0	0	115.2	L222 F245 T246 C250 L371 F481 I484	L222-M248 HydrophobicContact CD2-SD 3.95Å; F245-M248 HydrophobicContact CD1-CE 4.16Å; F245-M248 HydrophobicContact CD2-CE 4.39Å; F245-M248 HydrophobicContact CE1-CE 3.38Å; F245-M248 HydrophobicContact CE1-SD 4.45Å; F245-M248 HydrophobicContact CE2-CE 3.64Å; F245-M248 HydrophobicContact CE2-SD 4.04Å; F245-M248 HydrophobicContact CZ-CE 3.08Å; F245-M248 HydrophobicContact CZ-SD 3.63Å; T246-M248 VanDerWaalsContact C-N 3.29Å; T246-M248 PolarHBondContact O-N 3.16Å; T246-M248 VanDerWaalsContact O-N 3.12Å; M248-C250 PolarHBondContact O-N 2.91Å; M248-L371 HydrophobicContact CB-CD2 4.01Å; M248-L371 HydrophobicContact CG-CB 4.39Å; M248-L371 HydrophobicContact CG-CD2 4.2Å; M248-F481 HydrophobicContact CE-CE2 4.35Å; M248-I484 HydrophobicContact CE-CD1 3.88Å; M248-I484 HydrophobicContact SD-CD1 3.42Å; M248-I484 WeakPolarHBondContact SD-CD1 3.47Å
249	K	54.6	Low	74.6	Confident	94 Å²	94	41.8 Å²	41.8	41%	0.409	21%	0.211	S	C	.	.			trans	-82.9	96.1	172.6	-73.5	-175.8	178	177.9	0	107.7	T246 D247 Q251	T246-K249 PolarHBondContact O-N 2.96Å; D247-K249 PolarHBondContact O-N 3.02Å; K249-Q251 PolarHBondContact O-N 2.87Å
250	C	60.7	Low	74.5	Confident	49 Å²	49	43.2 Å²	43.2	33%	0.331	22%	0.219	S	C	.	.			trans	-75.6	108.1	173.2	178.9	0	0	0	0	109.1	P223 M248	P223-C250 HydrophobicContact CB-CB 4.43Å; M248-C250 PolarHBondContact O-N 2.91Å
251	Q	64.7	Low	74.6	Confident	107 Å²	107	43.1 Å²	43.1	50%	0.5	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.7	165.9	-65.6	-172.1	24.1	0	0	108.6	I243 K249	I243-Q251 HydrophobicContact CB-CB 3.94Å; I243-Q251 WeakPolarHBondContact CB-O 3.36Å; I243-Q251 HydrophobicContact CD1-CB 4.25Å; I243-Q251 HydrophobicContact CG1-CB 4.37Å; I243-Q251 HydrophobicContact CG2-CB 4.48Å; I243-Q251 PolarHBondContact N-O 3.49Å; K249-Q251 PolarHBondContact O-N 2.87Å
252	R	75.4	Confident	74.8	Confident	132 Å²	132	46.7 Å²	46.7	50%	0.498	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	145.9	175.2	-70.3	-173.5	178.1	-91	3.5	110.2	S224 T241	S224-R252 VanDerWaalsContact O-CZ 3.29Å; S224-R252 PolarHBondContact O-NH1 2.89Å; S224-R252 PolarHBondContact O-NH2 3.26Å; T241-R252 WeakPolarHBondContact O-CA 3.31Å; T241-R252 PolarHBondContact OG1-NH1 3.23Å
253	G	80.8	Confident	75.5	Confident	9 Å²	9	47.3 Å²	47.3	9%	0.093	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	180	172.8	0	0	0	0	0	110.6	T241	T241-G253 CarbonylContact C-O 3.57Å; T241-G253 WeakPolarHBondContact CA-O 3.46Å; T241-G253 PolarHBondContact O-N 2.8Å; T241-G253 VanDerWaalsContact O-N 3.11Å
254	D	89.6	Confident	76.4	Confident	76 Å²	76	50.3 Å²	50.3	41%	0.406	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	95.3	172	-177.6	4.2	0	0	0	108.9	N274 E275	D254-N274 HydrophobicContact CB-CB 4.08Å; D254-N274 WeakPolarHBondContact O-CB 3.16Å; D254-N274 PolarHBondContact O-N 3.28Å; D254-N274 PolarHBondContact O-ND2 2.56Å; D254-N274 PolarHBondContact OD1-ND2 2.67Å; D254-N274 WeakPolarHBondContact OD2-CB 3.28Å; D254-E275 HydrophobicContact CB-CG 3.94Å
255	L	90.5	Very high	77.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.8	-176.6	-59.8	-169.5	0	0	0	112.1	D239 T240 I243 F257 L272 D273 F516	D239-L255 WeakPolarHBondContact CA-O 3.27Å; T240-L255 HydrophobicContact CG2-CB 4.29Å; T240-L255 PolarHBondContact N-O 2.91Å; T240-L255 PolarHBondContact O-N 3.4Å; I243-L255 HydrophobicContact CB-CD1 3.96Å; I243-L255 HydrophobicContact CG1-CD1 3.68Å; I243-L255 HydrophobicContact CG1-CG 4.05Å; I243-L255 HydrophobicContact CG2-CD1 4Å; L255-F257 HydrophobicContact CB-CE2 4.13Å; L255-F257 HydrophobicContact CD1-CE2 4.38Å; L255-F257 HydrophobicContact CD1-CZ 4.27Å; L255-L272 VanDerWaalsContact CA-O 3.31Å; L255-L272 WeakPolarHBondContact CA-O 3.43Å; L255-L272 WeakPolarHBondContact CD2-O 3.48Å; L255-D273 HydrophobicContact CD2-CB 4.19Å; L255-F516 HydrophobicContact CD1-CE1 4.01Å; L255-F516 HydrophobicContact CD1-CZ 4.39Å; L255-F516 HydrophobicContact CD2-CE1 3.83Å; L255-F516 HydrophobicContact CD2-CZ 3.61Å
256	S	92.9	Very high	78.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	128	171	-66.4	0	0	0	0	110.6	R237 L238 D239 L272 N274	R237-S256 PolarHBondContact NH2-OG 3.31Å; R237-S256 VanDerWaalsContact NH2-OG 3.14Å; L238-S256 CarbonylContact O-C 3.6Å; L238-S256 WeakPolarHBondContact O-CA 3.04Å; D239-S256 VanDerWaalsContact OD1-CB 3.25Å; D239-S256 WeakPolarHBondContact OD1-CB 3.09Å; D239-S256 PolarHBondContact OD1-OG 3.14Å; S256-L272 PolarHBondContact N-O 3.04Å; S256-L272 VanDerWaalsContact N-O 3.08Å; S256-L272 WeakPolarHBondContact O-CB 3.31Å; S256-L272 WeakPolarHBondContact O-CD1 3.41Å; S256-L272 PolarHBondContact O-N 2.63Å; S256-N274 PolarHBondContact OG-ND2 2.81Å
257	F	91.4	Very high	80.1	Confident	19 Å²	19	55.2 Å²	55.2	8%	0.083	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.7	172.6	-64.2	-88.7	0	0	0	108.5	R237 L238 T240 L255 V270 V271 F454 L519	R237-F257 CarbonylContact C-O 3.53Å; R237-F257 VanDerWaalsContact CA-O 3.23Å; R237-F257 WeakPolarHBondContact CA-O 3.31Å; L238-F257 HydrophobicContact CB-CB 4.17Å; L238-F257 HydrophobicContact CD2-CD2 4.27Å; L238-F257 HydrophobicContact CG-CD2 4.29Å; L238-F257 PolarHBondContact N-O 2.85Å; L238-F257 PolarHBondContact O-N 3.45Å; T240-F257 HydrophobicContact CG2-CD2 3.87Å; T240-F257 HydrophobicContact CG2-CE2 3.42Å; T240-F257 VanDerWaalsContact CG2-CE2 3.42Å; L255-F257 HydrophobicContact CB-CE2 4.13Å; L255-F257 HydrophobicContact CD1-CE2 4.38Å; L255-F257 HydrophobicContact CD1-CZ 4.27Å; F257-V270 WeakPolarHBondContact CA-O 3.47Å; F257-V271 HydrophobicContact CD1-CB 4.13Å; F257-V271 HydrophobicContact CD1-CG1 3.88Å; F257-V271 HydrophobicContact CD1-CG2 3.62Å; F257-V271 HydrophobicContact CE1-CB 3.91Å; F257-V271 HydrophobicContact CE1-CG1 3.35Å; F257-V271 HydrophobicContact CE1-CG2 3.39Å; F257-V271 HydrophobicContact CE2-CG1 4.46Å; F257-V271 HydrophobicContact CZ-CG1 3.71Å; F257-V271 HydrophobicContact CZ-CG2 4.49Å; F257-F454 HydrophobicContact CD1-CE1 4.11Å; F257-F454 AromaticContact CD1-CE2 3.88Å; F257-F454 HydrophobicContact CD1-CE2 3.88Å; F257-F454 AromaticContact CD1-CZ 3.25Å; F257-F454 HydrophobicContact CD1-CZ 3.25Å; F257-F454 HydrophobicContact CD2-CZ 4.4Å; F257-F454 AromaticContact CE1-CE1 3.4Å; F257-F454 HydrophobicContact CE1-CE1 3.4Å; F257-F454 VanDerWaalsContact CE1-CE1 3.4Å; F257-F454 AromaticContact CE1-CE2 4Å; F257-F454 HydrophobicContact CE1-CE2 4Å; F257-F454 AromaticContact CE1-CZ 3.03Å; F257-F454 HydrophobicContact CE1-CZ 3.03Å; F257-F454 HydrophobicContact CE2-CZ 4.24Å; F257-F454 HydrophobicContact CG-CE2 4.14Å; F257-F454 AromaticContact CG-CZ 3.94Å; F257-F454 HydrophobicContact CG-CZ 3.94Å; F257-F454 AromaticContact CZ-CE1 3.65Å; F257-F454 HydrophobicContact CZ-CE1 3.65Å; F257-F454 HydrophobicContact CZ-CE2 4.37Å; F257-F454 AromaticContact CZ-CZ 3.58Å; F257-F454 HydrophobicContact CZ-CZ 3.58Å; F257-L519 HydrophobicContact CE1-CD1 4.06Å; F257-L519 HydrophobicContact CZ-CD1 4.37Å
258	I	93.3	Very high	81.7	Confident	6 Å²	6	51 Å²	51	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.9	179.2	-59.5	176.7	0	0	0	108.5	R237 F269 V270 L272 F503	R237-I258 HydrophobicContact CG-CG1 4.46Å; I258-F269 WeakPolarHBondContact O-CA 3.38Å; I258-V270 HydrophobicContact CB-CG1 3.66Å; I258-V270 HydrophobicContact CG1-CG1 4.48Å; I258-V270 HydrophobicContact CG2-CG1 4.33Å; I258-V270 PolarHBondContact N-O 3.46Å; I258-V270 PolarHBondContact O-N 2.91Å; I258-L272 HydrophobicContact CB-CD1 4.48Å; I258-L272 HydrophobicContact CD1-CD1 3.68Å; I258-L272 HydrophobicContact CD1-CD2 4.06Å; I258-L272 HydrophobicContact CG1-CD1 3.91Å; I258-F503 WeakPolarHBondContact CG2-O 3.39Å
259	F	92.9	Very high	83.4	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.026	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.4	165.8	175.4	-109.1	0	0	0	110	L194 L197 N235 I236 S268 F269 V450	L194-F259 HydrophobicContact CD2-CE1 3.84Å; L194-F259 HydrophobicContact CD2-CZ 3.84Å; L197-F259 HydrophobicContact CD1-CD1 4.4Å; L197-F259 HydrophobicContact CD1-CE1 3.89Å; N235-F259 VanDerWaalsContact CA-O 3.3Å; N235-F259 WeakPolarHBondContact CA-O 3.43Å; I236-F259 HydrophobicContact CB-CB 4.35Å; I236-F259 PolarHBondContact N-O 3.23Å; I236-F259 VanDerWaalsContact N-O 3.07Å; I236-F259 PolarHBondContact O-N 2.89Å; F259-S268 CarbonylContact C-O 3.57Å; F259-S268 VanDerWaalsContact CA-O 3.26Å; F259-S268 WeakPolarHBondContact CA-O 3.45Å; F259-S268 VanDerWaalsContact CD2-O 3.32Å; F259-S268 WeakPolarHBondContact CD2-O 3.34Å; F259-F269 HydrophobicContact CB-CD1 4.09Å; F259-F269 HydrophobicContact CB-CE1 3.79Å; F259-F269 HydrophobicContact CB-CZ 4.43Å; F259-F269 AromaticContact CD2-CD1 3.77Å; F259-F269 HydrophobicContact CD2-CD1 3.77Å; F259-F269 AromaticContact CD2-CD2 3.86Å; F259-F269 HydrophobicContact CD2-CD2 3.86Å; F259-F269 AromaticContact CD2-CE1 3.3Å; F259-F269 HydrophobicContact CD2-CE1 3.3Å; F259-F269 AromaticContact CD2-CE2 3.4Å; F259-F269 HydrophobicContact CD2-CE2 3.4Å; F259-F269 VanDerWaalsContact CD2-CE2 3.4Å; F259-F269 HydrophobicContact CD2-CG 4.04Å; F259-F269 AromaticContact CD2-CZ 3.11Å; F259-F269 HydrophobicContact CD2-CZ 3.11Å; F259-F269 HydrophobicContact CE2-CD2 4.16Å; F259-F269 HydrophobicContact CE2-CE1 4.13Å; F259-F269 AromaticContact CE2-CE2 3.45Å; F259-F269 HydrophobicContact CE2-CE2 3.45Å; F259-F269 VanDerWaalsContact CE2-CE2 3.45Å; F259-F269 AromaticContact CE2-CZ 3.45Å; F259-F269 HydrophobicContact CE2-CZ 3.45Å; F259-F269 VanDerWaalsContact CE2-CZ 3.45Å; F259-F269 HydrophobicContact CG-CD1 4.39Å; F259-F269 AromaticContact CG-CE1 3.86Å; F259-F269 HydrophobicContact CG-CE1 3.86Å; F259-F269 AromaticContact CG-CZ 3.99Å; F259-F269 HydrophobicContact CG-CZ 3.99Å; F259-V450 HydrophobicContact CB-CG1 3.52Å; F259-V450 HydrophobicContact CD1-CG1 3.45Å; F259-V450 VanDerWaalsContact CD1-CG1 3.45Å; F259-V450 HydrophobicContact CD1-CG2 4.43Å; F259-V450 HydrophobicContact CD2-CG1 3.9Å; F259-V450 HydrophobicContact CE1-CG1 4.07Å; F259-V450 HydrophobicContact CE1-CG2 4.38Å; F259-V450 HydrophobicContact CE2-CG1 4.44Å; F259-V450 HydrophobicContact CG-CG1 3.32Å
260	N	92.2	Very high	85.2	Confident	54 Å²	54	47.2 Å²	47.2	29%	0.289	25%	0.249	S	C	.	.			trans	-103.6	107.9	172.7	-173.4	-24.7	0	0	0	110.1	N235 N262 A263 S268	N235-N260 WeakPolarHBondContact OD1-CA 3.14Å; N235-N260 PolarHBondContact OD1-OD1 3.12Å; N260-N262 PolarHBondContact O-N 2.84Å; N260-N262 WeakPolarHBondContact OD1-CB 2.95Å; N260-N262 PolarHBondContact OD1-N 2.84Å; N260-A263 HydrophobicContact CB-CB 4.11Å; N260-A263 PolarHBondContact O-N 3.4Å; N260-A263 PolarHBondContact OD1-N 3.34Å; N260-S268 PolarHBondContact N-O 3.3Å; N260-S268 VanDerWaalsContact O-CB 3.29Å; N260-S268 WeakPolarHBondContact O-CB 3.34Å
261	G	89.9	Confident	86.6	Confident	5 Å²	5	44.9 Å²	44.9	5%	0.052	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-20.8	-178.2	0	0	0	0	0	114.2	R190 I234 N235	R190-G261 PolarHBondContact NH2-O 2.81Å; I234-G261 VanDerWaalsContact CD1-C 3.44Å; N235-G261 PolarHBondContact OD1-N 3.08Å; N235-G261 VanDerWaalsContact OD1-N 3.09Å
262	N	89.8	Confident	87.9	Confident	128 Å²	128	39.8 Å²	39.8	68%	0.684	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-20.4	179.5	-65.3	-56.8	0	0	0	113	I234 N260	I234-N262 WeakPolarHBondContact CD1-OD1 3.47Å; N260-N262 PolarHBondContact O-N 2.84Å; N260-N262 WeakPolarHBondContact OD1-CB 2.95Å; N260-N262 PolarHBondContact OD1-N 2.84Å
263	A	88.8	Confident	88.7	Confident	22 Å²	22	33.6 Å²	33.6	18%	0.182	19%	0.186	C	C	.	.	S	Bend	trans	-74.9	159.5	179.4	0	0	0	0	0	111.9	R190 N260 E267	R190-A263 PolarHBondContact NH2-O 2.7Å; N260-A263 HydrophobicContact CB-CB 4.11Å; N260-A263 PolarHBondContact O-N 3.4Å; N260-A263 PolarHBondContact OD1-N 3.34Å; A263-E267 HydrophobicContact CB-CB 4.3Å
264	I	85.4	Confident	89.3	Confident	95 Å²	95	34.4 Å²	34.4	49%	0.487	19%	0.188	S	C	.	.			trans	-63.9	153.9	169.8	59.3	173	0	0	0	110.1	S266 E267 S268	I264-S266 VanDerWaalsContact C-N 3.27Å; I264-S266 VanDerWaalsContact CD1-OG 3.27Å; I264-S266 WeakPolarHBondContact CD1-OG 3.45Å; I264-S266 PolarHBondContact O-N 3.41Å; I264-S266 VanDerWaalsContact O-N 3.14Å; I264-E267 HydrophobicContact CD1-CG 4.11Å; I264-E267 HydrophobicContact CG1-CB 3.96Å; I264-E267 HydrophobicContact CG1-CG 3.88Å; I264-E267 CarbonylContact O-C 3.48Å; I264-E267 PolarHBondContact O-N 3Å; I264-S268 WeakPolarHBondContact O-CB 3.41Å; I264-S268 PolarHBondContact O-N 2.85Å
265	P	80.9	Confident	89.4	Confident	58 Å²	58	37.3 Å²	37.3	38%	0.377	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-49.4	-43.9	-175.4	-30.7	36.6	0	0	0	114.6	E267 S268	P265-E267 PolarHBondContact O-N 3.36Å; P265-S268 PolarHBondContact O-N 3.42Å; P265-S268 PolarHBondContact O-OG 2.98Å
266	S	77.9	Confident	89.5	Confident	55 Å²	55	42 Å²	42	39%	0.385	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-65.7	-17.9	179.6	55.1	0	0	0	0	115.1	I264	I264-S266 VanDerWaalsContact C-N 3.27Å; I264-S266 VanDerWaalsContact CD1-OG 3.27Å; I264-S266 WeakPolarHBondContact CD1-OG 3.45Å; I264-S266 PolarHBondContact O-N 3.41Å; I264-S266 VanDerWaalsContact O-N 3.14Å
267	E	84.4	Confident	89.6	Confident	111 Å²	111	46.9 Å²	46.9	52%	0.519	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-116.8	0.1	180	-64.3	-178.5	175.2	0	0	112.3	A263 I264 P265 F269	A263-E267 HydrophobicContact CB-CB 4.3Å; I264-E267 HydrophobicContact CD1-CG 4.11Å; I264-E267 HydrophobicContact CG1-CB 3.96Å; I264-E267 HydrophobicContact CG1-CG 3.88Å; I264-E267 CarbonylContact O-C 3.48Å; I264-E267 PolarHBondContact O-N 3Å; P265-E267 PolarHBondContact O-N 3.36Å; E267-F269 VanDerWaalsContact C-N 3.29Å; E267-F269 PolarHBondContact O-N 2.97Å
268	S	87.5	Confident	89.8	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.021	24%	0.244	C	C	.	.	S	Bend	trans	-78.9	-11.4	-171.6	64.7	0	0	0	0	114.4	R190 F259 N260 I264 P265	R190-S268 PolarHBondContact NH1-OG 3.45Å; F259-S268 CarbonylContact C-O 3.57Å; F259-S268 VanDerWaalsContact CA-O 3.26Å; F259-S268 WeakPolarHBondContact CA-O 3.45Å; F259-S268 VanDerWaalsContact CD2-O 3.32Å; F259-S268 WeakPolarHBondContact CD2-O 3.34Å; N260-S268 PolarHBondContact N-O 3.3Å; N260-S268 VanDerWaalsContact O-CB 3.29Å; N260-S268 WeakPolarHBondContact O-CB 3.34Å; I264-S268 WeakPolarHBondContact O-CB 3.41Å; I264-S268 PolarHBondContact O-N 2.85Å; P265-S268 PolarHBondContact O-N 3.42Å; P265-S268 PolarHBondContact O-OG 2.98Å
269	F	88.8	Confident	89.8	Confident	45 Å²	45	48 Å²	48	20%	0.197	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129	-179.5	-74.2	-83.4	0	0	0	111.4	I258 F259 E267 I282 V450	I258-F269 WeakPolarHBondContact O-CA 3.38Å; F259-F269 HydrophobicContact CB-CD1 4.09Å; F259-F269 HydrophobicContact CB-CE1 3.79Å; F259-F269 HydrophobicContact CB-CZ 4.43Å; F259-F269 AromaticContact CD2-CD1 3.77Å; F259-F269 HydrophobicContact CD2-CD1 3.77Å; F259-F269 AromaticContact CD2-CD2 3.86Å; F259-F269 HydrophobicContact CD2-CD2 3.86Å; F259-F269 AromaticContact CD2-CE1 3.3Å; F259-F269 HydrophobicContact CD2-CE1 3.3Å; F259-F269 AromaticContact CD2-CE2 3.4Å; F259-F269 HydrophobicContact CD2-CE2 3.4Å; F259-F269 VanDerWaalsContact CD2-CE2 3.4Å; F259-F269 HydrophobicContact CD2-CG 4.04Å; F259-F269 AromaticContact CD2-CZ 3.11Å; F259-F269 HydrophobicContact CD2-CZ 3.11Å; F259-F269 HydrophobicContact CE2-CD2 4.16Å; F259-F269 HydrophobicContact CE2-CE1 4.13Å; F259-F269 AromaticContact CE2-CE2 3.45Å; F259-F269 HydrophobicContact CE2-CE2 3.45Å; F259-F269 VanDerWaalsContact CE2-CE2 3.45Å; F259-F269 AromaticContact CE2-CZ 3.45Å; F259-F269 HydrophobicContact CE2-CZ 3.45Å; F259-F269 VanDerWaalsContact CE2-CZ 3.45Å; F259-F269 HydrophobicContact CG-CD1 4.39Å; F259-F269 AromaticContact CG-CE1 3.86Å; F259-F269 HydrophobicContact CG-CE1 3.86Å; F259-F269 AromaticContact CG-CZ 3.99Å; F259-F269 HydrophobicContact CG-CZ 3.99Å; E267-F269 VanDerWaalsContact C-N 3.29Å; E267-F269 PolarHBondContact O-N 2.97Å; F269-I282 HydrophobicContact CB-CB 4.06Å; F269-I282 HydrophobicContact CB-CD1 4.23Å; F269-I282 HydrophobicContact CB-CG1 4.41Å; F269-I282 PolarHBondContact O-N 3.49Å; F269-V450 HydrophobicContact CE1-CG1 3.87Å; F269-V450 VanDerWaalsContact CE1-O 3.26Å; F269-V450 WeakPolarHBondContact CE1-O 3.46Å; F269-V450 HydrophobicContact CZ-CG1 4Å; F269-V450 WeakPolarHBondContact CZ-O 3.33Å
270	V	90.6	Very high	89.6	Confident	11 Å²	11	48.3 Å²	48.3	7%	0.067	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	142.7	176.6	63	0	0	0	0	110.3	F257 I258 L272 Y279 Q280 R281 I505	F257-V270 WeakPolarHBondContact CA-O 3.47Å; I258-V270 HydrophobicContact CB-CG1 3.66Å; I258-V270 HydrophobicContact CG1-CG1 4.48Å; I258-V270 HydrophobicContact CG2-CG1 4.33Å; I258-V270 PolarHBondContact N-O 3.46Å; I258-V270 PolarHBondContact O-N 2.91Å; V270-L272 HydrophobicContact CG1-CD1 3.83Å; V270-L272 HydrophobicContact CG2-CD1 4.1Å; V270-Y279 HydrophobicContact CG2-CD2 3.59Å; V270-Y279 HydrophobicContact CG2-CG 4.16Å; V270-Q280 WeakPolarHBondContact CA-O 3.23Å; V270-Q280 WeakPolarHBondContact CG2-O 3.12Å; V270-R281 HydrophobicContact CG2-CG 4.42Å; V270-I505 HydrophobicContact CG1-CD1 4.43Å; V270-I505 HydrophobicContact CG1-CG1 4.16Å; V270-I505 HydrophobicContact CG2-CD1 4.06Å; V270-I505 HydrophobicContact CG2-CG1 4.25Å
271	V	90.5	Very high	89.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	133.4	171.9	-167.3	0	0	0	0	108.4	F257 Y279 Q280 I282 F516 L519	F257-V271 HydrophobicContact CD1-CB 4.13Å; F257-V271 HydrophobicContact CD1-CG1 3.88Å; F257-V271 HydrophobicContact CD1-CG2 3.62Å; F257-V271 HydrophobicContact CE1-CB 3.91Å; F257-V271 HydrophobicContact CE1-CG1 3.35Å; F257-V271 HydrophobicContact CE1-CG2 3.39Å; F257-V271 HydrophobicContact CE2-CG1 4.46Å; F257-V271 HydrophobicContact CZ-CG1 3.71Å; F257-V271 HydrophobicContact CZ-CG2 4.49Å; V271-Y279 CarbonylContact O-C 3.51Å; V271-Y279 WeakPolarHBondContact O-CA 3.25Å; V271-Y279 WeakPolarHBondContact O-CB 3.42Å; V271-Q280 PolarHBondContact N-O 2.96Å; V271-Q280 PolarHBondContact O-N 2.75Å; V271-I282 HydrophobicContact CG2-CD1 3.63Å; V271-I282 HydrophobicContact CG2-CG1 3.73Å; V271-F516 HydrophobicContact CB-CD2 3.99Å; V271-F516 HydrophobicContact CB-CE2 3.9Å; V271-F516 HydrophobicContact CG1-CD2 3.9Å; V271-F516 HydrophobicContact CG1-CE1 4.38Å; V271-F516 HydrophobicContact CG1-CE2 3.53Å; V271-F516 HydrophobicContact CG1-CG 4.45Å; V271-F516 HydrophobicContact CG1-CZ 3.8Å; V271-L519 HydrophobicContact CG1-CD1 4.48Å; V271-L519 HydrophobicContact CG2-CD1 4.05Å
272	L	92.6	Very high	88.8	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.8	178.1	-68.3	74.8	0	0	0	108.5	L255 S256 I258 V270 P506 Y509	L255-L272 VanDerWaalsContact CA-O 3.31Å; L255-L272 WeakPolarHBondContact CA-O 3.43Å; L255-L272 WeakPolarHBondContact CD2-O 3.48Å; S256-L272 PolarHBondContact N-O 3.04Å; S256-L272 VanDerWaalsContact N-O 3.08Å; S256-L272 WeakPolarHBondContact O-CB 3.31Å; S256-L272 WeakPolarHBondContact O-CD1 3.41Å; S256-L272 PolarHBondContact O-N 2.63Å; I258-L272 HydrophobicContact CB-CD1 4.48Å; I258-L272 HydrophobicContact CD1-CD1 3.68Å; I258-L272 HydrophobicContact CD1-CD2 4.06Å; I258-L272 HydrophobicContact CG1-CD1 3.91Å; V270-L272 HydrophobicContact CG1-CD1 3.83Å; V270-L272 HydrophobicContact CG2-CD1 4.1Å; L272-P506 HydrophobicContact CD2-CG 4.41Å; L272-Y509 HydrophobicContact CB-CE1 4.18Å; L272-Y509 HydrophobicContact CD2-CD1 4.21Å; L272-Y509 HydrophobicContact CD2-CE1 4.05Å; L272-Y509 HydrophobicContact CG-CD1 4.45Å; L272-Y509 HydrophobicContact CG-CE1 4.45Å
273	D	92.4	Very high	87.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	104.7	162.9	-170.8	-45	0	0	0	107.9	L255 E275 Q276 K277 V278 R515 F516	L255-D273 HydrophobicContact CD2-CB 4.19Å; D273-E275 VanDerWaalsContact C-N 3.3Å; D273-E275 PolarHBondContact O-N 3.3Å; D273-E275 PolarHBondContact OD1-N 3.43Å; D273-E275 VanDerWaalsContact OD1-N 3.09Å; D273-Q276 HydrophobicContact CB-CB 4.3Å; D273-Q276 PolarHBondContact OD1-N 3.03Å; D273-K277 WeakPolarHBondContact O-CA 3.22Å; D273-K277 PolarHBondContact O-N 3.32Å; D273-V278 HydrophobicContact CB-CG2 3.83Å; D273-V278 PolarHBondContact N-O 3.2Å; D273-V278 PolarHBondContact O-N 2.81Å; D273-R515 IonicContact OD2-CZ 3.19Å; D273-R515 IonicContact OD2-NE 3.43Å; D273-R515 PolarHBondContact OD2-NE 2.67Å; D273-R515 IonicContact OD2-NH2 2.67Å; D273-R515 PolarHBondContact OD2-NH2 3.34Å; D273-F516 HydrophobicContact CB-CE2 4.45Å; D273-F516 HydrophobicContact CB-CZ 3.91Å
274	N	93.9	Very high	86.6	Confident	26 Å²	26	51.5 Å²	51.5	14%	0.139	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-24.6	-173.9	-60.8	-39.4	0	0	0	112.2	D254 S256 Y509	D254-N274 HydrophobicContact CB-CB 4.08Å; D254-N274 WeakPolarHBondContact O-CB 3.16Å; D254-N274 PolarHBondContact O-N 3.28Å; D254-N274 PolarHBondContact O-ND2 2.56Å; D254-N274 PolarHBondContact OD1-ND2 2.67Å; D254-N274 WeakPolarHBondContact OD2-CB 3.28Å; S256-N274 PolarHBondContact OG-ND2 2.81Å; N274-Y509 VanDerWaalsContact CA-OH 3.3Å; N274-Y509 WeakPolarHBondContact CA-OH 3.36Å; N274-Y509 PolarHBondContact OD1-OH 3.34Å; N274-Y509 VanDerWaalsContact OD1-OH 3.08Å
275	E	91.7	Very high	85.4	Confident	138 Å²	138	55.6 Å²	55.6	65%	0.645	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-44.1	178.1	-58.6	-174	166.6	0	0	111	D254 D273	D254-E275 HydrophobicContact CB-CG 3.94Å; D273-E275 VanDerWaalsContact C-N 3.3Å; D273-E275 PolarHBondContact O-N 3.3Å; D273-E275 PolarHBondContact OD1-N 3.43Å; D273-E275 VanDerWaalsContact OD1-N 3.09Å
276	Q	91.3	Very high	84.7	Confident	99 Å²	99	56.1 Å²	56.1	46%	0.463	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.9	179.7	-62.9	-168	19.4	0	0	113.2	D273 V278 R515	D273-Q276 HydrophobicContact CB-CB 4.3Å; D273-Q276 PolarHBondContact OD1-N 3.03Å; Q276-V278 VanDerWaalsContact C-N 3.27Å; Q276-V278 HydrophobicContact CB-CG1 4.42Å; Q276-V278 HydrophobicContact CB-CG2 3.94Å; Q276-V278 PolarHBondContact O-N 3.19Å; Q276-R515 VanDerWaalsContact NE2-NH2 3.1Å
277	K	95.5	Very high	84.7	Confident	101 Å²	101	55.6 Å²	55.6	44%	0.439	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	44.8	-173.5	-57.5	-175.6	167.9	-154.1	0	111.9	D273 D508 Y509 K510	D273-K277 WeakPolarHBondContact O-CA 3.22Å; D273-K277 PolarHBondContact O-N 3.32Å; K277-D508 IonicContact NZ-OD2 2.67Å; K277-D508 PolarHBondContact NZ-OD2 3.33Å; K277-Y509 HydrophobicContact CB-CD2 3.97Å; K277-Y509 HydrophobicContact CB-CE2 4.02Å; K277-Y509 HydrophobicContact CB-CG 4.24Å; K277-Y509 HydrophobicContact CG-CD2 4.42Å; K277-Y509 HydrophobicContact CG-CE2 4.01Å; K277-Y509 VanDerWaalsContact O-CA 3.23Å; K277-Y509 WeakPolarHBondContact O-CA 3.29Å; K277-K510 PolarHBondContact O-N 3.49Å
278	V	94.8	Very high	84.6	Confident	19 Å²	19	55.9 Å²	55.9	12%	0.115	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	160.6	174.9	-59.6	0	0	0	0	110.7	D273 Q276 K510 D512 R515	D273-V278 HydrophobicContact CB-CG2 3.83Å; D273-V278 PolarHBondContact N-O 3.2Å; D273-V278 PolarHBondContact O-N 2.81Å; Q276-V278 VanDerWaalsContact C-N 3.27Å; Q276-V278 HydrophobicContact CB-CG1 4.42Å; Q276-V278 HydrophobicContact CB-CG2 3.94Å; Q276-V278 PolarHBondContact O-N 3.19Å; V278-K510 CarbonylContact C-O 3.58Å; V278-K510 WeakPolarHBondContact CA-O 3.26Å; V278-K510 WeakPolarHBondContact CB-O 3.19Å; V278-D512 HydrophobicContact CB-CB 4Å; V278-D512 HydrophobicContact CG1-CB 4.27Å; V278-D512 HydrophobicContact CG2-CB 4.28Å; V278-R515 HydrophobicContact CG2-CB 4.3Å; V278-R515 HydrophobicContact CG2-CG 3.87Å
279	Y	93.3	Very high	84.3	Confident	30 Å²	30	61.6 Å²	61.6	12%	0.118	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	153.5	174.7	73.8	-89.4	0	0	0	111.4	V270 V271 R281 I505 K510 E511 D512	V270-Y279 HydrophobicContact CG2-CD2 3.59Å; V270-Y279 HydrophobicContact CG2-CG 4.16Å; V271-Y279 CarbonylContact O-C 3.51Å; V271-Y279 WeakPolarHBondContact O-CA 3.25Å; V271-Y279 WeakPolarHBondContact O-CB 3.42Å; Y279-R281 HydrophobicContact CE2-CG 4.36Å; Y279-R281 PolarHBondContact OH-NH1 2.7Å; Y279-R281 PolarHBondContact OH-NH2 3.13Å; Y279-I505 HydrophobicContact CD1-CG2 3.49Å; Y279-I505 VanDerWaalsContact CD1-CG2 3.49Å; Y279-I505 HydrophobicContact CD2-CD1 3.79Å; Y279-I505 HydrophobicContact CD2-CG1 4.5Å; Y279-I505 HydrophobicContact CD2-CG2 4.48Å; Y279-I505 HydrophobicContact CE1-CD1 4.49Å; Y279-I505 HydrophobicContact CE1-CG2 3.71Å; Y279-I505 HydrophobicContact CE2-CD1 3.65Å; Y279-I505 HydrophobicContact CG-CD1 4.26Å; Y279-I505 HydrophobicContact CG-CG2 3.89Å; Y279-K510 WeakPolarHBondContact CD1-O 3.17Å; Y279-K510 PolarHBondContact N-O 2.96Å; Y279-E511 HydrophobicContact CD1-CB 4.5Å; Y279-E511 HydrophobicContact CD2-CB 4.48Å; Y279-E511 HydrophobicContact CD2-CG 4.33Å; Y279-E511 HydrophobicContact CE1-CB 3.91Å; Y279-E511 HydrophobicContact CE2-CB 3.87Å; Y279-E511 HydrophobicContact CE2-CG 3.83Å; Y279-E511 CarbonylContact O-C 3.5Å; Y279-E511 VanDerWaalsContact O-CA 3.31Å; Y279-E511 WeakPolarHBondContact O-CA 3.08Å; Y279-D512 PolarHBondContact O-N 2.88Å
280	Q	89.4	Confident	84	Confident	12 Å²	12	63.2 Å²	63.2	6%	0.056	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126.7	174.1	178.5	171.6	-28.1	0	0	108.8	V270 V271 P513 F516 L519	V270-Q280 WeakPolarHBondContact CA-O 3.23Å; V270-Q280 WeakPolarHBondContact CG2-O 3.12Å; V271-Q280 PolarHBondContact N-O 2.96Å; V271-Q280 PolarHBondContact O-N 2.75Å; Q280-P513 PolarHBondContact OE1-O 3.3Å; Q280-F516 HydrophobicContact CB-CD2 3.94Å; Q280-F516 PolarHBondContact NE2-O 3.32Å; Q280-F516 PolarHBondContact OE1-O 3.46Å; Q280-L519 PolarHBondContact NE2-OXT 2.94Å
281	R	87.2	Confident	83.9	Confident	60 Å²	60	63 Å²	63	23%	0.226	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	131.8	168.3	-71.3	-178.9	-175.4	86.4	7.3	108.6	V270 Y279 H283 E511	V270-R281 HydrophobicContact CG2-CG 4.42Å; Y279-R281 HydrophobicContact CE2-CG 4.36Å; Y279-R281 PolarHBondContact OH-NH1 2.7Å; Y279-R281 PolarHBondContact OH-NH2 3.13Å; R281-H283 VanDerWaalsContact C-N 3.33Å; R281-H283 WeakPolarHBondContact CB-CE1 3.39Å; R281-H283 PolarHBondContact O-N 3.25Å; R281-H283 PolarHBondContact O-ND1 3.22Å; R281-E511 IonicContact CZ-OE1 3.72Å; R281-E511 IonicContact CZ-OE2 2.79Å; R281-E511 IonicContact NH1-OE1 3.95Å; R281-E511 PolarHBondContact NH1-OE1 2.81Å; R281-E511 IonicContact NH1-OE2 2.74Å; R281-E511 PolarHBondContact NH1-OE2 3.19Å
282	I	78.1	Confident	83.8	Confident	18 Å²	18	64.7 Å²	64.7	9%	0.092	31%	0.306	C	S	.	.			trans	-75.3	92.8	176.6	-61.8	-177.5	0	0	0	106.8	F269 V271 L519	F269-I282 HydrophobicContact CB-CB 4.06Å; F269-I282 HydrophobicContact CB-CD1 4.23Å; F269-I282 HydrophobicContact CB-CG1 4.41Å; F269-I282 PolarHBondContact O-N 3.49Å; V271-I282 HydrophobicContact CG2-CD1 3.63Å; V271-I282 HydrophobicContact CG2-CG1 3.73Å; I282-L519 WeakPolarHBondContact CG2-O 3.27Å
283	H	70.2	Confident	83.5	Confident	94 Å²	94	68.9 Å²	68.9	44%	0.435	33%	0.326	S	S	.	.			trans	-91.3	134.9	175.2	-63.4	96.7	0	0	0	109.1	R281 E285	R281-H283 VanDerWaalsContact C-N 3.33Å; R281-H283 WeakPolarHBondContact CB-CE1 3.39Å; R281-H283 PolarHBondContact O-N 3.25Å; R281-H283 PolarHBondContact O-ND1 3.22Å; H283-E285 PolarHBondContact O-N 3.25Å
284	H	61.5	Low	83.3	Confident	105 Å²	105	72.1 Å²	72.1	49%	0.486	34%	0.341	S	S	.	.			trans	-89.5	28.1	171	-70.2	-66.3	0	0	0	111.5	R183 E286	R183-H284 PolarHBondContact NH1-O 3.47Å; R183-H284 PolarHBondContact NH2-O 3.24Å; H284-E286 PolarHBondContact O-N 3.19Å
285	E	60.8	Low	83.2	Confident	180 Å²	180	70.9 Å²	70.9	84%	0.841	33%	0.334	S	S	*	.			trans	-97.4	93.5	173.1	-73.1	-169.4	174.9	0	0	108.8	H283	H283-E285 PolarHBondContact O-N 3.25Å
286	E	66.3	Low	83.1	Confident	70 Å²	70	65.2 Å²	65.2	33%	0.327	31%	0.308	S	S	.	.			trans	-85.7	138	178.6	-69.3	171.1	-177.4	0	0	109.9	K179 R183 H284 E290	K179-E286 WeakPolarHBondContact CD-OE1 3.27Å; K179-E286 WeakPolarHBondContact CD-OE2 3.35Å; K179-E286 WeakPolarHBondContact CE-OE1 3.41Å; K179-E286 WeakPolarHBondContact CE-OE2 3.5Å; K179-E286 IonicContact NZ-OE1 3.68Å; K179-E286 PolarHBondContact NZ-OE1 2.88Å; K179-E286 IonicContact NZ-OE2 3.27Å; K179-E286 PolarHBondContact NZ-OE2 3Å; R183-E286 IonicContact NH2-OE1 3.24Å; H284-E286 PolarHBondContact O-N 3.19Å; E286-E290 WeakPolarHBondContact CA-OE2 3.49Å; E286-E290 WeakPolarHBondContact CB-OE2 3.37Å
287	S	77.1	Confident	83	Confident	43 Å²	43	65.1 Å²	65.1	30%	0.301	31%	0.31	S	S	.	.			trans	-70.2	154.6	172.8	69.5	0	0	0	0	111	M289 E290 T291	S287-M289 PolarHBondContact O-N 2.97Å; S287-M289 PolarHBondContact OG-N 3.14Å; S287-E290 WeakPolarHBondContact CB-OE1 3.38Å; S287-E290 PolarHBondContact N-OE1 3.1Å; S287-E290 PolarHBondContact N-OE2 3.45Å; S287-E290 VanDerWaalsContact N-OE2 3.15Å; S287-E290 PolarHBondContact O-N 2.72Å; S287-E290 WeakPolarHBondContact OG-CG 3.41Å; S287-E290 PolarHBondContact OG-N 2.8Å; S287-E290 VanDerWaalsContact OG-N 3.16Å; S287-E290 PolarHBondContact OG-OE1 3.25Å; S287-T291 PolarHBondContact O-N 3.32Å; S287-T291 PolarHBondContact O-OG1 2.95Å
288	E	83.6	Confident	82.8	Confident	117 Å²	117	62.7 Å²	62.7	55%	0.547	30%	0.301	S	S	.	.	H	α-helix	trans	-56.2	-30.8	168.9	-77.1	-75.9	126.9	0	0	110.6	R176 E292	R176-E288 IonicContact CZ-OE1 3.86Å; R176-E288 IonicContact CZ-OE2 3.28Å; R176-E288 IonicContact NE-OE1 2.88Å; R176-E288 IonicContact NH2-OE1 2.68Å; R176-E288 PolarHBondContact NH2-OE1 2.9Å; R176-E288 IonicContact NH2-OE2 3.95Å; R176-E288 PolarHBondContact NH2-OE2 3.41Å; E288-E292 WeakPolarHBondContact O-CB 3.33Å; E288-E292 WeakPolarHBondContact O-CG 2.94Å; E288-E292 PolarHBondContact O-N 3.3Å
289	M	81.9	Confident	82.7	Confident	123 Å²	123	62.2 Å²	62.2	61%	0.606	30%	0.298	S	S	*	.	H	α-helix	trans	-66.2	-46.8	178	-169.7	173.3	71.8	0	0	112.6	S287 T291 E292 E293	S287-M289 PolarHBondContact O-N 2.97Å; S287-M289 PolarHBondContact OG-N 3.14Å; M289-T291 PolarHBondContact O-N 3.25Å; M289-E292 WeakPolarHBondContact O-CA 3.29Å; M289-E292 WeakPolarHBondContact O-CB 3.38Å; M289-E292 PolarHBondContact O-N 3Å; M289-E293 WeakPolarHBondContact O-CG 2.92Å; M289-E293 PolarHBondContact O-N 3.39Å
290	E	82.4	Confident	82.5	Confident	80 Å²	80	61.6 Å²	61.6	37%	0.374	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-44.1	177.1	-74.2	147.1	-128.8	0	0	112.1	E286 S287 E292 E293 E294	E286-E290 WeakPolarHBondContact CA-OE2 3.49Å; E286-E290 WeakPolarHBondContact CB-OE2 3.37Å; S287-E290 WeakPolarHBondContact CB-OE1 3.38Å; S287-E290 PolarHBondContact N-OE1 3.1Å; S287-E290 PolarHBondContact N-OE2 3.45Å; S287-E290 VanDerWaalsContact N-OE2 3.15Å; S287-E290 PolarHBondContact O-N 2.72Å; S287-E290 WeakPolarHBondContact OG-CG 3.41Å; S287-E290 PolarHBondContact OG-N 2.8Å; S287-E290 VanDerWaalsContact OG-N 3.16Å; S287-E290 PolarHBondContact OG-OE1 3.25Å; E290-E292 PolarHBondContact O-N 3.42Å; E290-E293 PolarHBondContact O-N 2.84Å; E290-E294 PolarHBondContact O-N 3.07Å
291	T	87.9	Confident	82.5	Confident	7 Å²	7	63 Å²	63	4%	0.043	31%	0.309	C	S	.	.	H	α-helix	trans	-56.8	-36.8	175.2	-63.3	0	0	0	0	110.6	T172 L175 R176 S287 M289 V295	T172-T291 HydrophobicContact CG2-CG2 4.11Å; L175-T291 HydrophobicContact CD2-CG2 4.34Å; R176-T291 HydrophobicContact CG-CG2 4.26Å; S287-T291 PolarHBondContact O-N 3.32Å; S287-T291 PolarHBondContact O-OG1 2.95Å; M289-T291 PolarHBondContact O-N 3.25Å; T291-V295 VanDerWaalsContact O-CG2 3.26Å; T291-V295 WeakPolarHBondContact O-CG2 3.25Å; T291-V295 PolarHBondContact O-N 3.08Å
292	E	88.6	Confident	82.6	Confident	35 Å²	35	61.7 Å²	61.7	16%	0.164	31%	0.306	C	S	.	.	H	α-helix	trans	-77.6	-38.4	-176.2	-66	-73.9	-143.8	0	0	113.4	R168 E288 M289 E290 V295 D296 R386	R168-E292 IonicContact CZ-OE2 2.81Å; R168-E292 IonicContact NH1-OE2 3.91Å; R168-E292 PolarHBondContact NH1-OE2 2.81Å; R168-E292 PolarHBondContact NH2-O 3.38Å; R168-E292 IonicContact NH2-OE2 3.04Å; R168-E292 PolarHBondContact NH2-OE2 2.84Å; E288-E292 WeakPolarHBondContact O-CB 3.33Å; E288-E292 WeakPolarHBondContact O-CG 2.94Å; E288-E292 PolarHBondContact O-N 3.3Å; M289-E292 WeakPolarHBondContact O-CA 3.29Å; M289-E292 WeakPolarHBondContact O-CB 3.38Å; M289-E292 PolarHBondContact O-N 3Å; E290-E292 PolarHBondContact O-N 3.42Å; E292-V295 PolarHBondContact O-N 2.95Å; E292-D296 PolarHBondContact O-N 3.23Å; E292-R386 IonicContact OE1-CZ 3.26Å; E292-R386 IonicContact OE1-NH1 3.09Å; E292-R386 PolarHBondContact OE1-NH1 3.03Å; E292-R386 IonicContact OE1-NH2 2.92Å; E292-R386 PolarHBondContact OE1-NH2 3.21Å; E292-R386 IonicContact OE2-CZ 2.69Å; E292-R386 IonicContact OE2-NH1 2.62Å; E292-R386 PolarHBondContact OE2-NH1 2.86Å; E292-R386 IonicContact OE2-NH2 3.65Å; E292-R386 PolarHBondContact OE2-NH2 2.8Å
293	E	85.3	Confident	83.2	Confident	89 Å²	89	61.4 Å²	61.4	42%	0.416	31%	0.306	S	S	.	.	H	α-helix	trans	-61.6	-43.9	171.6	-71.7	174.7	-179.1	0	0	111	M289 E290 V295 D296 I297	M289-E293 WeakPolarHBondContact O-CG 2.92Å; M289-E293 PolarHBondContact O-N 3.39Å; E290-E293 PolarHBondContact O-N 2.84Å; E293-V295 VanDerWaalsContact C-N 3.29Å; E293-V295 PolarHBondContact O-N 2.84Å; E293-D296 WeakPolarHBondContact O-CB 3.43Å; E293-D296 PolarHBondContact O-N 3.25Å; E293-D296 VanDerWaalsContact O-N 3.11Å; E293-I297 WeakPolarHBondContact O-CG1 3.28Å; E293-I297 PolarHBondContact O-N 3.13Å
294	E	87.9	Confident	83.9	Confident	69 Å²	69	61.9 Å²	61.9	32%	0.322	30%	0.304	S	S	.	.	H	α-helix	trans	-58.6	-41.4	174.1	-80.2	-174.3	-155.1	0	0	112.3	L175 K179 E290 D296 I297 L298	L175-E294 HydrophobicContact CD2-CB 3.95Å; K179-E294 WeakPolarHBondContact CE-OE2 3.31Å; K179-E294 IonicContact NZ-OE1 2.74Å; K179-E294 PolarHBondContact NZ-OE1 3.49Å; K179-E294 IonicContact NZ-OE2 2.78Å; K179-E294 PolarHBondContact NZ-OE2 3.38Å; E290-E294 PolarHBondContact O-N 3.07Å; E294-D296 VanDerWaalsContact C-N 3.33Å; E294-D296 PolarHBondContact O-N 3.26Å; E294-I297 PolarHBondContact O-N 3.43Å; E294-L298 WeakPolarHBondContact O-CB 3.41Å; E294-L298 VanDerWaalsContact O-CG 3.24Å; E294-L298 WeakPolarHBondContact O-CG 3.15Å; E294-L298 PolarHBondContact O-N 2.92Å
295	V	92.7	Very high	85	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.9	-38.6	176.9	176.7	0	0	0	0	111	R168 I171 L175 T291 E292 E293 I297 L298 M299	R168-V295 HydrophobicContact CG-CG1 3.91Å; R168-V295 VanDerWaalsContact CZ-CG1 3.49Å; R168-V295 VanDerWaalsContact NH1-CB 3.26Å; I171-V295 HydrophobicContact CB-CG1 4.2Å; I171-V295 HydrophobicContact CG2-CG1 3.83Å; I171-V295 HydrophobicContact CG2-CG2 4.14Å; L175-V295 HydrophobicContact CD2-CG2 3.78Å; T291-V295 VanDerWaalsContact O-CG2 3.26Å; T291-V295 WeakPolarHBondContact O-CG2 3.25Å; T291-V295 PolarHBondContact O-N 3.08Å; E292-V295 PolarHBondContact O-N 2.95Å; E293-V295 VanDerWaalsContact C-N 3.29Å; E293-V295 PolarHBondContact O-N 2.84Å; V295-I297 VanDerWaalsContact C-N 3.33Å; V295-I297 PolarHBondContact O-N 3.31Å; V295-L298 PolarHBondContact O-N 2.96Å; V295-M299 HydrophobicContact CG1-CG 4.27Å; V295-M299 HydrophobicContact CG1-SD 4.04Å; V295-M299 WeakPolarHBondContact O-CB 3.47Å; V295-M299 VanDerWaalsContact O-CG 3.28Å; V295-M299 WeakPolarHBondContact O-CG 3.46Å; V295-M299 PolarHBondContact O-N 3.23Å
296	D	89.7	Confident	85.7	Confident	18 Å²	18	50.1 Å²	50.1	10%	0.096	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-39.6	175.1	-70.6	-26.5	0	0	0	111.7	R168 E292 E293 E294 M299 S300 R386 R387	R168-D296 IonicContact CZ-OD1 3.64Å; R168-D296 IonicContact NE-OD1 3.7Å; R168-D296 VanDerWaalsContact NH2-CG 3.3Å; R168-D296 IonicContact NH2-OD1 3.3Å; R168-D296 PolarHBondContact NH2-OD1 3.33Å; R168-D296 IonicContact NH2-OD2 3.22Å; E292-D296 PolarHBondContact O-N 3.23Å; E293-D296 WeakPolarHBondContact O-CB 3.43Å; E293-D296 PolarHBondContact O-N 3.25Å; E293-D296 VanDerWaalsContact O-N 3.11Å; E294-D296 VanDerWaalsContact C-N 3.33Å; E294-D296 PolarHBondContact O-N 3.26Å; D296-M299 PolarHBondContact O-N 3.06Å; D296-S300 WeakPolarHBondContact O-CB 3.4Å; D296-S300 PolarHBondContact O-N 2.98Å; D296-S300 PolarHBondContact O-OG 2.76Å; D296-R386 WeakPolarHBondContact OD2-CD 3.44Å; D296-R387 HydrophobicContact CB-CG 4.3Å; D296-R387 WeakPolarHBondContact OD1-CB 3.48Å; D296-R387 PolarHBondContact OD1-N 2.89Å
297	I	88	Confident	86.3	Confident	98 Å²	98	49.3 Å²	49.3	50%	0.503	26%	0.255	S	S	.	.	H	α-helix	trans	-61.5	-50.8	173	-67.3	166.5	0	0	0	110.1	E293 E294 V295 M299 S300 S301	E293-I297 WeakPolarHBondContact O-CG1 3.28Å; E293-I297 PolarHBondContact O-N 3.13Å; E294-I297 PolarHBondContact O-N 3.43Å; V295-I297 VanDerWaalsContact C-N 3.33Å; V295-I297 PolarHBondContact O-N 3.31Å; I297-M299 VanDerWaalsContact C-N 3.29Å; I297-M299 PolarHBondContact O-N 2.8Å; I297-S300 PolarHBondContact O-N 3.2Å; I297-S300 VanDerWaalsContact O-N 3.1Å; I297-S300 PolarHBondContact O-OG 3.25Å; I297-S300 VanDerWaalsContact O-OG 3.14Å; I297-S301 WeakPolarHBondContact O-CB 3.32Å; I297-S301 PolarHBondContact O-N 3.25Å; I297-S301 PolarHBondContact O-OG 2.83Å
298	L	92	Very high	86.2	Confident	49 Å²	49	49.7 Å²	49.7	26%	0.257	25%	0.254	S	S	.	.	H	α-helix	trans	-58.9	-38.7	179.8	-71.6	172	0	0	0	112.6	I163 I171 L175 E294 V295 S300	I163-L298 HydrophobicContact CD1-CB 3.96Å; I163-L298 HydrophobicContact CD1-CD1 4.25Å; I163-L298 HydrophobicContact CD1-CD2 3.9Å; I163-L298 HydrophobicContact CD1-CG 4.26Å; I163-L298 HydrophobicContact CG1-CB 4.25Å; I163-L298 WeakPolarHBondContact CG2-O 3.49Å; I171-L298 HydrophobicContact CG2-CD1 4.25Å; L175-L298 HydrophobicContact CD1-CD1 4.5Å; L175-L298 HydrophobicContact CD2-CD1 4.27Å; E294-L298 WeakPolarHBondContact O-CB 3.41Å; E294-L298 VanDerWaalsContact O-CG 3.24Å; E294-L298 WeakPolarHBondContact O-CG 3.15Å; E294-L298 PolarHBondContact O-N 2.92Å; V295-L298 PolarHBondContact O-N 2.96Å; L298-S300 VanDerWaalsContact C-N 3.3Å; L298-S300 PolarHBondContact O-N 3.31Å
299	M	93.1	Very high	85.9	Confident	10 Å²	10	45 Å²	45	5%	0.049	24%	0.235	C	C	.	.	H	α-helix	trans	-74.1	-18.9	179.2	-71	-174.2	74.6	0	0	113.8	R168 I171 V295 D296 I297 H355 L356 R387 Q388	R168-M299 HydrophobicContact CB-SD 4.12Å; R168-M299 HydrophobicContact CG-SD 4.05Å; I171-M299 HydrophobicContact CD1-CG 3.77Å; I171-M299 HydrophobicContact CD1-SD 4.08Å; V295-M299 HydrophobicContact CG1-CG 4.27Å; V295-M299 HydrophobicContact CG1-SD 4.04Å; V295-M299 WeakPolarHBondContact O-CB 3.47Å; V295-M299 VanDerWaalsContact O-CG 3.28Å; V295-M299 WeakPolarHBondContact O-CG 3.46Å; V295-M299 PolarHBondContact O-N 3.23Å; D296-M299 PolarHBondContact O-N 3.06Å; I297-M299 VanDerWaalsContact C-N 3.29Å; I297-M299 PolarHBondContact O-N 2.8Å; M299-H355 PolarHBondContact O-CD2 3.46Å; M299-L356 WeakPolarHBondContact O-CD2 3.46Å; M299-R387 HydrophobicContact CB-CB 4.3Å; M299-R387 HydrophobicContact CB-CG 4.3Å; M299-R387 HydrophobicContact CE-CB 4.34Å; M299-R387 HydrophobicContact SD-CB 4Å; M299-Q388 VanDerWaalsContact CE-O 3.27Å; M299-Q388 WeakPolarHBondContact CE-O 3.27Å
300	S	89.7	Confident	85.3	Confident	17 Å²	17	42.7 Å²	42.7	12%	0.119	23%	0.227	C	C	.	.	H	α-helix	trans	-106.8	-9.1	180	63.8	0	0	0	0	113.7	D296 I297 L298 L356 N364	D296-S300 WeakPolarHBondContact O-CB 3.4Å; D296-S300 PolarHBondContact O-N 2.98Å; D296-S300 PolarHBondContact O-OG 2.76Å; I297-S300 PolarHBondContact O-N 3.2Å; I297-S300 VanDerWaalsContact O-N 3.1Å; I297-S300 PolarHBondContact O-OG 3.25Å; I297-S300 VanDerWaalsContact O-OG 3.14Å; L298-S300 VanDerWaalsContact C-N 3.3Å; L298-S300 PolarHBondContact O-N 3.31Å; S300-L356 VanDerWaalsContact C-CD2 3.4Å; S300-L356 WeakPolarHBondContact O-CD2 3.39Å; S300-N364 PolarHBondContact O-ND2 2.82Å
301	S	88.5	Confident	85	Confident	41 Å²	41	48.6 Å²	48.6	29%	0.287	25%	0.251	S	S	.	.	S	Bend	trans	-100.4	153.5	-178.8	-60.4	0	0	0	0	111.8	I297 V303 H355	I297-S301 WeakPolarHBondContact O-CB 3.32Å; I297-S301 PolarHBondContact O-N 3.25Å; I297-S301 PolarHBondContact O-OG 2.83Å; S301-V303 PolarHBondContact O-N 3.01Å; S301-H355 PolarHBondContact O-CE1 3.39Å; S301-H355 PolarHBondContact O-NE2 2.92Å
302	D	89.1	Confident	84.4	Confident	32 Å²	32	51.5 Å²	51.5	17%	0.171	27%	0.272	C	S	.	.			trans	-63.1	135.1	173.8	-56.9	-67.9	0	0	0	111.2	Y304 K351 R353 L356	D302-Y304 PolarHBondContact O-N 2.74Å; D302-K351 HydrophobicContact CB-CD 4.32Å; D302-K351 HydrophobicContact CB-CG 4.07Å; D302-K351 VanDerWaalsContact CG-NZ 3.28Å; D302-K351 WeakPolarHBondContact OD1-CE 3.45Å; D302-K351 IonicContact OD1-NZ 2.76Å; D302-K351 WeakPolarHBondContact OD2-CE 3.28Å; D302-K351 IonicContact OD2-NZ 2.8Å; D302-K351 PolarHBondContact OD2-NZ 2.98Å; D302-R353 WeakPolarHBondContact OD1-CD 3.39Å; D302-R353 VanDerWaalsContact OD1-CG 3.28Å; D302-R353 WeakPolarHBondContact OD1-CG 3.38Å; D302-R353 IonicContact OD1-CZ 2.79Å; D302-R353 IonicContact OD1-NE 3.31Å; D302-R353 PolarHBondContact OD1-NE 2.8Å; D302-R353 IonicContact OD1-NH1 2.6Å; D302-L356 VanDerWaalsContact OD1-CD1 3.28Å; D302-L356 WeakPolarHBondContact OD1-CD1 3.36Å
303	V	90.9	Very high	84.1	Confident	12 Å²	12	51.4 Å²	51.4	7%	0.073	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	111.3	172.7	174.7	0	0	0	0	107.8	W156 A160 I163 S301 K351 R352	W156-V303 HydrophobicContact CE3-CG1 3.94Å; W156-V303 HydrophobicContact CH2-CG1 4.35Å; W156-V303 HydrophobicContact CZ3-CG1 3.59Å; A160-V303 HydrophobicContact CB-CG1 3.77Å; I163-V303 HydrophobicContact CB-CG2 3.87Å; I163-V303 HydrophobicContact CD1-CG2 4.42Å; I163-V303 HydrophobicContact CG2-CG2 3.37Å; S301-V303 PolarHBondContact O-N 3.01Å; V303-K351 CarbonylContact O-C 3.52Å; V303-K351 WeakPolarHBondContact O-CA 3.39Å; V303-R352 HydrophobicContact CB-CB 4.08Å; V303-R352 HydrophobicContact CG1-CB 4.49Å; V303-R352 PolarHBondContact N-O 2.95Å; V303-R352 PolarHBondContact O-N 3.12Å
304	Y	85.1	Confident	84.2	Confident	104 Å²	104	51 Å²	51	41%	0.408	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.5	-172.3	-172.9	-108.3	0	0	0	111.9	D302 A306 S349 R350 K351	D302-Y304 PolarHBondContact O-N 2.74Å; Y304-A306 HydrophobicContact CD1-CB 4.45Å; Y304-A306 HydrophobicContact CE1-CB 3.6Å; Y304-S349 VanDerWaalsContact OH-CB 3.32Å; Y304-S349 WeakPolarHBondContact OH-CB 3.26Å; Y304-R350 WeakPolarHBondContact CA-O 3.45Å; Y304-R350 WeakPolarHBondContact CD2-O 3.42Å; Y304-K351 HydrophobicContact CD2-CB 4.34Å
305	S	83.8	Confident	84.3	Confident	8 Å²	8	50.6 Å²	50.6	6%	0.056	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121.9	171.6	-170.6	0	0	0	0	108.9	K151 G155 W156 S349 R350	K151-S305 PolarHBondContact NZ-OG 2.76Å; G155-S305 PolarHBondContact O-OG 3.04Å; W156-S305 VanDerWaalsContact CZ3-CB 3.48Å; S305-S349 CarbonylContact O-C 3.49Å; S305-S349 WeakPolarHBondContact O-CA 3.31Å; S305-R350 PolarHBondContact N-O 2.85Å; S305-R350 PolarHBondContact O-N 2.85Å
306	A	77	Confident	84.3	Confident	31 Å²	31	52.8 Å²	52.8	26%	0.256	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	133.6	172.6	0	0	0	0	0	109.7	Y304 L347 E348	Y304-A306 HydrophobicContact CD1-CB 4.45Å; Y304-A306 HydrophobicContact CE1-CB 3.6Å; A306-L347 HydrophobicContact CB-CD1 4.3Å; A306-E348 WeakPolarHBondContact CA-O 3.46Å
307	T	77.3	Confident	84.4	Confident	52 Å²	52	54.8 Å²	54.8	32%	0.319	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131	178.1	51.6	0	0	0	0	110	S309 E348	T307-S309 PolarHBondContact O-N 2.93Å; T307-E348 PolarHBondContact N-O 3.31Å; T307-E348 PolarHBondContact O-N 3.28Å
308	L	76.4	Confident	84.5	Confident	51 Å²	51	50.7 Å²	50.7	27%	0.267	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	112.7	172.2	-165.5	62.8	0	0	0	108.5	T310 L345 F463 M466 P479	L308-T310 PolarHBondContact O-N 3.32Å; L308-L345 HydrophobicContact CD1-CD1 3.52Å; L308-L345 HydrophobicContact CD1-CD2 4.22Å; L308-L345 HydrophobicContact CD1-CG 3.72Å; L308-L345 HydrophobicContact CD2-CD1 3.86Å; L308-L345 HydrophobicContact CG-CD1 3.61Å; L308-L345 HydrophobicContact CG-CG 4.37Å; L308-F463 HydrophobicContact CD2-CD2 4.13Å; L308-F463 HydrophobicContact CD2-CE2 4.43Å; L308-M466 HydrophobicContact CD2-SD 4.32Å; L308-P479 HydrophobicContact CD1-CG 3.77Å
309	S	75.8	Confident	84.2	Confident	20 Å²	20	53.1 Å²	53.1	14%	0.14	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	119.2	177.5	-176.3	0	0	0	0	109.9	T307 V346	T307-S309 PolarHBondContact O-N 2.93Å; S309-V346 PolarHBondContact N-O 3.43Å
310	T	71.1	Confident	83.7	Confident	74 Å²	74	55.5 Å²	55.5	45%	0.454	30%	0.301	S	S	.	.			trans	-103.9	-0.1	-179.5	62	0	0	0	0	113.9	L308 S312 I313 M466	L308-T310 PolarHBondContact O-N 3.32Å; T310-S312 PolarHBondContact O-N 2.86Å; T310-S312 VanDerWaalsContact O-N 3.11Å; T310-I313 VanDerWaalsContact CA-CD1 3.5Å; T310-I313 HydrophobicContact CG2-CD1 3.66Å; T310-I313 PolarHBondContact O-N 3.49Å; T310-M466 HydrophobicContact CG2-CG 4.08Å; T310-M466 HydrophobicContact CG2-SD 3.42Å; T310-M466 WeakPolarHBondContact CG2-SD 3.33Å
311	K	74.3	Confident	82.9	Confident	203 Å²	203	57.3 Å²	57.3	88%	0.883	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.5	-170.6	-66.4	179.8	-179.7	174	0	114.1
312	S	75.1	Confident	81.7	Confident	69 Å²	69	67.3 Å²	67.3	48%	0.483	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	17.6	-175.3	51.6	0	0	0	0	113.2	T310 T314 G344	T310-S312 PolarHBondContact O-N 2.86Å; T310-S312 VanDerWaalsContact O-N 3.11Å; S312-T314 PolarHBondContact O-N 3.3Å; S312-G344 PolarHBondContact OG-O 2.91Å
313	I	83.8	Confident	80.6	Confident	32 Å²	32	72.6 Å²	72.6	16%	0.164	38%	0.381	C	S	.	.			trans	-68.2	129.6	-177.8	-67.8	174.2	0	0	0	110	T310 F315 V342 N343 L345 M466	T310-I313 VanDerWaalsContact CA-CD1 3.5Å; T310-I313 HydrophobicContact CG2-CD1 3.66Å; T310-I313 PolarHBondContact O-N 3.49Å; I313-F315 HydrophobicContact CG2-CD2 4.4Å; I313-F315 HydrophobicContact CG2-CE1 4.3Å; I313-F315 HydrophobicContact CG2-CE2 3.73Å; I313-F315 HydrophobicContact CG2-CZ 3.68Å; I313-V342 HydrophobicContact CG2-CG1 3.79Å; I313-N343 WeakPolarHBondContact CA-O 3.47Å; I313-L345 HydrophobicContact CD1-CD1 3.49Å; I313-L345 VanDerWaalsContact CD1-CD1 3.49Å; I313-L345 HydrophobicContact CG1-CD1 4.1Å; I313-M466 HydrophobicContact CD1-SD 3.82Å
314	T	87.5	Confident	79.8	Confident	81 Å²	81	80 Å²	80	50%	0.497	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	151.9	169.8	56.9	0	0	0	0	109.6	S312 N343	S312-T314 PolarHBondContact O-N 3.3Å; T314-N343 PolarHBondContact N-O 3.4Å; T314-N343 PolarHBondContact O-N 3.5Å
315	F	89.8	Confident	79.5	Confident	60 Å²	60	84.2 Å²	84.2	26%	0.263	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.6	179.2	-58.8	-88.5	0	0	0	109.2	I313 Y340 V342 I431 K467 L468 P469	I313-F315 HydrophobicContact CG2-CD2 4.4Å; I313-F315 HydrophobicContact CG2-CE1 4.3Å; I313-F315 HydrophobicContact CG2-CE2 3.73Å; I313-F315 HydrophobicContact CG2-CZ 3.68Å; F315-Y340 HydrophobicContact CB-CD1 4.18Å; F315-V342 HydrophobicContact CD1-CG2 4.04Å; F315-V342 HydrophobicContact CE1-CB 4.48Å; F315-V342 HydrophobicContact CE1-CG1 4.13Å; F315-V342 HydrophobicContact CE1-CG2 3.82Å; F315-I431 HydrophobicContact CD1-CG2 4.07Å; F315-I431 HydrophobicContact CE1-CG2 4.16Å; F315-K467 WeakPolarHBondContact CE2-O 3.13Å; F315-K467 WeakPolarHBondContact CZ-O 3.28Å; F315-L468 HydrophobicContact CZ-CD2 4.4Å; F315-P469 HydrophobicContact CB-CG 3.97Å; F315-P469 HydrophobicContact CD1-CG 3.67Å; F315-P469 HydrophobicContact CD2-CG 4.1Å; F315-P469 HydrophobicContact CE1-CG 4.16Å; F315-P469 HydrophobicContact CG-CG 3.63Å
316	S	91.6	Very high	79.6	Confident	47 Å²	47	90.3 Å²	90.3	33%	0.329	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	139.8	173	56.7	0	0	0	0	109.5	A318 Y340 S341 N343	S316-A318 PolarHBondContact O-N 2.94Å; S316-Y340 CarbonylContact O-C 3.49Å; S316-Y340 VanDerWaalsContact O-CA 3.26Å; S316-Y340 WeakPolarHBondContact O-CA 3.24Å; S316-S341 PolarHBondContact N-O 3.11Å; S316-S341 VanDerWaalsContact N-O 3.08Å; S316-S341 PolarHBondContact O-N 3.35Å; S316-N343 PolarHBondContact OG-ND2 3.28Å
317	R	93.1	Very high	80.3	Confident	59 Å²	59	92.6 Å²	92.6	22%	0.223	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	126.2	173.8	-65.6	-67.8	-65.5	161.4	-8.8	109.9	D327 D338 F339 Y340	R317-D327 VanDerWaalsContact CG-OD2 3.31Å; R317-D327 WeakPolarHBondContact CG-OD2 3.46Å; R317-D327 IonicContact CZ-OD2 2.71Å; R317-D327 IonicContact NE-OD2 3.57Å; R317-D327 PolarHBondContact NE-OD2 3.12Å; R317-D338 IonicContact CZ-OD1 3.87Å; R317-D338 IonicContact NH1-OD1 2.77Å; R317-D338 PolarHBondContact NH1-OD1 3.12Å; R317-D338 IonicContact NH1-OD2 2.73Å; R317-D338 IonicContact NH2-OD1 2.66Å; R317-D338 PolarHBondContact NH2-OD1 2.84Å; R317-D338 IonicContact NH2-OD2 3.1Å; R317-F339 PolarHBondContact NH1-O 3.5Å; R317-Y340 HydrophobicContact CG-CE1 4.24Å
318	A	88.8	Confident	81	Confident	12 Å²	12	92.4 Å²	92.4	10%	0.099	46%	0.458	C	S	.	.			trans	-69.3	141	171.5	0	0	0	0	0	108	S316 K328 F339	S316-A318 PolarHBondContact O-N 2.94Å; A318-K328 HydrophobicContact CB-CB 4.11Å; A318-K328 HydrophobicContact CB-CD 4.47Å; A318-K328 VanDerWaalsContact O-CB 3.24Å; A318-K328 WeakPolarHBondContact O-CB 3.28Å; A318-K328 PolarHBondContact O-N 3.26Å; A318-F339 HydrophobicContact CB-CB 3.77Å; A318-F339 WeakPolarHBondContact CB-O 3.44Å; A318-F339 PolarHBondContact N-O 2.94Å
319	Q	87.3	Confident	81.8	Confident	101 Å²	101	93 Å²	93	47%	0.472	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	142.7	-176.9	-63.6	-173.8	-37.5	0	0	111.1	R325 E326	Q319-R325 HydrophobicContact CB-CB 4.22Å; Q319-E326 CarbonylContact C-O 3.51Å; Q319-E326 WeakPolarHBondContact CA-O 3.39Å
320	T	82.1	Confident	82.6	Confident	60 Å²	60	96.2 Å²	96.2	37%	0.368	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	154.3	174.4	42	0	0	0	0	110.8	R325 E326 K328	T320-R325 WeakPolarHBondContact O-CA 3.28Å; T320-E326 PolarHBondContact N-O 2.84Å; T320-E326 PolarHBondContact O-N 3.18Å; T320-K328 HydrophobicContact CG2-CB 3.99Å; T320-K328 HydrophobicContact CG2-CD 3.81Å; T320-K328 HydrophobicContact CG2-CG 3.73Å
321	G	73.5	Confident	83.5	Confident	54 Å²	54	101.1 Å²	101.1	56%	0.557	49%	0.487	S	S	*	.			trans	100.9	136	177.8	0	0	0	0	0	114.2	F324	G321-F324 CarbonylContact C-O 3.54Å; G321-F324 WeakPolarHBondContact CA-O 3.31Å
322	W	62.4	Low	84.2	Confident	251 Å²	251	92 Å²	92	95%	0.951	45%	0.448	S	S	*	.	S	Bend	trans	-86	-31.2	-173.5	-170.7	52	0	0	0	113.4
323	L	66.7	Low	84.6	Confident	143 Å²	143	90.7 Å²	90.7	75%	0.749	45%	0.446	S	S	*	.	S	Bend	trans	-108.4	-37.9	-179.5	-83.3	138.3	0	0	0	113
324	F	74.3	Confident	84.8	Confident	167 Å²	167	94.3 Å²	94.3	73%	0.732	47%	0.466	S	S	*	.	S	Bend	trans	-117.4	121	172.5	-58.5	-77.7	0	0	0	107	G321	G321-F324 CarbonylContact C-O 3.54Å; G321-F324 WeakPolarHBondContact CA-O 3.31Å
325	R	78.6	Confident	84.9	Confident	194 Å²	194	91.4 Å²	91.4	73%	0.732	45%	0.446	S	S	*	.			trans	-88.2	114.7	176.3	-67.3	-167.9	-175.8	173.2	-2.4	108.2	Q319 T320	Q319-R325 HydrophobicContact CB-CB 4.22Å; T320-R325 WeakPolarHBondContact O-CA 3.28Å
326	E	86.3	Confident	85.1	Confident	135 Å²	135	92.6 Å²	92.6	63%	0.631	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	149	175.1	-69.1	-178.1	176.4	0	0	109.9	Q319 T320 K328	Q319-E326 CarbonylContact C-O 3.51Å; Q319-E326 WeakPolarHBondContact CA-O 3.39Å; T320-E326 PolarHBondContact N-O 2.84Å; T320-E326 PolarHBondContact O-N 3.18Å; E326-K328 PolarHBondContact O-N 3.11Å
327	D	90.4	Very high	85.3	Confident	79 Å²	79	90.4 Å²	90.4	42%	0.422	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	128.1	177.6	-86.2	14.1	0	0	0	110.7	R317 T329	R317-D327 VanDerWaalsContact CG-OD2 3.31Å; R317-D327 WeakPolarHBondContact CG-OD2 3.46Å; R317-D327 IonicContact CZ-OD2 2.71Å; R317-D327 IonicContact NE-OD2 3.57Å; R317-D327 PolarHBondContact NE-OD2 3.12Å; D327-T329 PolarHBondContact O-N 2.99Å
328	K	92.2	Very high	85.5	Confident	48 Å²	48	90 Å²	90	21%	0.209	44%	0.442	C	S	.	.			trans	-76.1	115.1	-174.4	-173.9	-178.5	-175.1	-171.4	0	110.8	A318 T320 E326 E330 F339	A318-K328 HydrophobicContact CB-CB 4.11Å; A318-K328 HydrophobicContact CB-CD 4.47Å; A318-K328 VanDerWaalsContact O-CB 3.24Å; A318-K328 WeakPolarHBondContact O-CB 3.28Å; A318-K328 PolarHBondContact O-N 3.26Å; T320-K328 HydrophobicContact CG2-CB 3.99Å; T320-K328 HydrophobicContact CG2-CD 3.81Å; T320-K328 HydrophobicContact CG2-CG 3.73Å; E326-K328 PolarHBondContact O-N 3.11Å; K328-E330 WeakPolarHBondContact CE-OE1 3.44Å; K328-E330 WeakPolarHBondContact CE-OE2 3.39Å; K328-E330 HydrophobicContact CG-CG 4.41Å; K328-E330 IonicContact NZ-OE1 3.02Å; K328-E330 PolarHBondContact NZ-OE1 3.27Å; K328-E330 IonicContact NZ-OE2 3.45Å; K328-E330 PolarHBondContact NZ-OE2 3.17Å; K328-F339 HydrophobicContact CB-CB 4.1Å; K328-F339 HydrophobicContact CD-CB 3.96Å; K328-F339 HydrophobicContact CD-CD1 4.23Å; K328-F339 HydrophobicContact CD-CD2 4.29Å; K328-F339 HydrophobicContact CD-CG 3.9Å; K328-F339 HydrophobicContact CG-CB 4.06Å; K328-F339 HydrophobicContact CG-CD2 4.17Å; K328-F339 HydrophobicContact CG-CG 4.15Å; K328-F339 PolarHBondContact O-N 3.46Å
329	T	92.8	Very high	85.8	Confident	64 Å²	64	89.9 Å²	89.9	39%	0.393	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	120.6	172.2	-47.5	0	0	0	0	108.6	D327 L336 A337 D338	D327-T329 PolarHBondContact O-N 2.99Å; T329-L336 HydrophobicContact CG2-CD1 3.83Å; T329-L336 HydrophobicContact CG2-CD2 4.28Å; T329-L336 HydrophobicContact CG2-CG 3.83Å; T329-A337 VanDerWaalsContact CA-O 3.32Å; T329-A337 WeakPolarHBondContact CA-O 3.24Å; T329-A337 WeakPolarHBondContact CG2-O 3.2Å; T329-D338 PolarHBondContact OG1-OD1 3.45Å
330	E	92.8	Very high	86	Confident	88 Å²	88	86.7 Å²	86.7	41%	0.411	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	161.7	-177.6	-67.2	176.8	176.3	0	0	110.4	K328 A337 F339	K328-E330 WeakPolarHBondContact CE-OE1 3.44Å; K328-E330 WeakPolarHBondContact CE-OE2 3.39Å; K328-E330 HydrophobicContact CG-CG 4.41Å; K328-E330 IonicContact NZ-OE1 3.02Å; K328-E330 PolarHBondContact NZ-OE1 3.27Å; K328-E330 IonicContact NZ-OE2 3.45Å; K328-E330 PolarHBondContact NZ-OE2 3.17Å; E330-A337 PolarHBondContact N-O 2.9Å; E330-A337 PolarHBondContact O-N 3.16Å; E330-F339 HydrophobicContact CB-CD2 4.49Å; E330-F339 HydrophobicContact CB-CE2 3.74Å; E330-F339 HydrophobicContact CB-CZ 4.34Å
331	R	91.3	Very high	86.5	Confident	177 Å²	177	85.9 Å²	85.9	67%	0.668	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	132.3	171.9	-74.3	-175.5	176.6	-85.9	-0.7	110.6	N334 F335 L336	R331-N334 PolarHBondContact NH1-O 3.12Å; R331-N334 VanDerWaalsContact NH1-O 3.07Å; R331-F335 CarbonylContact C-O 3.58Å; R331-F335 VanDerWaalsContact CA-O 3.31Å; R331-F335 WeakPolarHBondContact CA-O 3.48Å; R331-L336 HydrophobicContact CG-CD1 4.26Å
332	V	88.4	Confident	87.2	Confident	10 Å²	10	83.5 Å²	83.5	6%	0.061	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	108.7	169.2	178	0	0	0	0	106.8	N334 F335 A337 F339 A432 V474 K475 T489	V332-N334 PolarHBondContact O-N 2.8Å; V332-F335 PolarHBondContact N-O 3.4Å; V332-F335 PolarHBondContact O-N 3.26Å; V332-A337 HydrophobicContact CB-CB 4.45Å; V332-A337 HydrophobicContact CG2-CB 4.02Å; V332-F339 HydrophobicContact CG2-CE2 4.11Å; V332-F339 HydrophobicContact CG2-CZ 3.69Å; V332-A432 HydrophobicContact CG2-CB 4.08Å; V332-V474 HydrophobicContact CB-CB 4.46Å; V332-V474 HydrophobicContact CB-CG2 3.87Å; V332-V474 HydrophobicContact CG1-CB 4.27Å; V332-V474 HydrophobicContact CG1-CG2 4.12Å; V332-V474 HydrophobicContact CG2-CG2 4.25Å; V332-K475 HydrophobicContact CG1-CB 4.1Å; V332-K475 HydrophobicContact CG2-CB 4.43Å; V332-T489 HydrophobicContact CG1-CG2 3.43Å; V332-T489 VanDerWaalsContact CG1-CG2 3.43Å
333	G	83.8	Confident	88.3	Confident	42 Å²	42	74.9 Å²	74.9	43%	0.433	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	-124.5	-165.3	0	0	0	0	0	110.2
334	N	86.5	Confident	89.1	Confident	109 Å²	109	69.6 Å²	69.6	58%	0.583	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-6	179.6	-66	-30.2	0	0	0	114.4	R331 V332	R331-N334 PolarHBondContact NH1-O 3.12Å; R331-N334 VanDerWaalsContact NH1-O 3.07Å; V332-N334 PolarHBondContact O-N 2.8Å
335	F	90.9	Very high	89.5	Confident	19 Å²	19	61.7 Å²	61.7	8%	0.083	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.8	-168.3	-54	-76.4	0	0	0	111.8	R331 V332 F437 V474 F493	R331-F335 CarbonylContact C-O 3.58Å; R331-F335 VanDerWaalsContact CA-O 3.31Å; R331-F335 WeakPolarHBondContact CA-O 3.48Å; V332-F335 PolarHBondContact N-O 3.4Å; V332-F335 PolarHBondContact O-N 3.26Å; F335-F437 AromaticContact CD1-CD2 3.9Å; F335-F437 HydrophobicContact CD1-CD2 3.9Å; F335-F437 AromaticContact CD2-CD2 3.76Å; F335-F437 HydrophobicContact CD2-CD2 3.76Å; F335-F437 AromaticContact CD2-CE2 3.92Å; F335-F437 HydrophobicContact CD2-CE2 3.92Å; F335-F437 AromaticContact CE1-CD2 3.74Å; F335-F437 HydrophobicContact CE1-CD2 3.74Å; F335-F437 HydrophobicContact CE1-CE2 4.24Å; F335-F437 HydrophobicContact CE1-CG 4.49Å; F335-F437 AromaticContact CE2-CD2 3.59Å; F335-F437 HydrophobicContact CE2-CD2 3.59Å; F335-F437 AromaticContact CE2-CE2 3.41Å; F335-F437 HydrophobicContact CE2-CE2 3.41Å; F335-F437 VanDerWaalsContact CE2-CE2 3.41Å; F335-F437 AromaticContact CG-CD2 3.92Å; F335-F437 HydrophobicContact CG-CD2 3.92Å; F335-F437 AromaticContact CZ-CD2 3.58Å; F335-F437 HydrophobicContact CZ-CD2 3.58Å; F335-F437 AromaticContact CZ-CE2 3.6Å; F335-F437 HydrophobicContact CZ-CE2 3.6Å; F335-V474 HydrophobicContact CB-CG1 4.13Å; F335-V474 HydrophobicContact CD2-CG1 4.26Å; F335-V474 HydrophobicContact CG-CG1 4.26Å; F335-F493 HydrophobicContact CZ-CB 4.11Å
336	L	94	Very high	89.7	Confident	86 Å²	86	53.5 Å²	53.5	45%	0.45	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	128.5	169.3	-171.7	67.1	0	0	0	108.4	T329 R331 S434	T329-L336 HydrophobicContact CG2-CD1 3.83Å; T329-L336 HydrophobicContact CG2-CD2 4.28Å; T329-L336 HydrophobicContact CG2-CG 3.83Å; R331-L336 HydrophobicContact CG-CD1 4.26Å; L336-S434 VanDerWaalsContact O-CB 3.3Å; L336-S434 WeakPolarHBondContact O-CB 3.09Å; L336-S434 PolarHBondContact O-OG 3.23Å
337	A	96.1	Very high	89.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.3	-170.3	0	0	0	0	0	113	T329 E330 V332 F339 A432 M433 V474	T329-A337 VanDerWaalsContact CA-O 3.32Å; T329-A337 WeakPolarHBondContact CA-O 3.24Å; T329-A337 WeakPolarHBondContact CG2-O 3.2Å; E330-A337 PolarHBondContact N-O 2.9Å; E330-A337 PolarHBondContact O-N 3.16Å; V332-A337 HydrophobicContact CB-CB 4.45Å; V332-A337 HydrophobicContact CG2-CB 4.02Å; A337-F339 HydrophobicContact CB-CE2 4.42Å; A337-F339 WeakPolarHBondContact O-CD2 3.4Å; A337-A432 HydrophobicContact CB-CB 3.88Å; A337-M433 CarbonylContact C-O 3.49Å; A337-M433 WeakPolarHBondContact CA-O 2.97Å; A337-V474 HydrophobicContact CB-CG2 3.51Å
338	D	95.7	Very high	89.2	Confident	49 Å²	49	46.1 Å²	46.1	26%	0.262	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.5	179.6	-99.1	-13.8	0	0	0	109.4	R317 T329 Y340 A432 M433	R317-D338 IonicContact CZ-OD1 3.87Å; R317-D338 IonicContact NH1-OD1 2.77Å; R317-D338 PolarHBondContact NH1-OD1 3.12Å; R317-D338 IonicContact NH1-OD2 2.73Å; R317-D338 IonicContact NH2-OD1 2.66Å; R317-D338 PolarHBondContact NH2-OD1 2.84Å; R317-D338 IonicContact NH2-OD2 3.1Å; T329-D338 PolarHBondContact OG1-OD1 3.45Å; D338-Y340 HydrophobicContact CB-CE2 3.82Å; D338-Y340 VanDerWaalsContact O-CD2 3.31Å; D338-Y340 WeakPolarHBondContact O-CD2 3.44Å; D338-Y340 WeakPolarHBondContact O-CE2 3.26Å; D338-A432 WeakPolarHBondContact O-CA 3.34Å; D338-M433 WeakPolarHBondContact CB-O 3.41Å; D338-M433 PolarHBondContact N-O 3.35Å; D338-M433 PolarHBondContact O-N 3.19Å
339	F	94.9	Very high	88.9	Confident	10 Å²	10	44.5 Å²	44.5	4%	0.044	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.7	-175.9	-75.6	-108.2	0	0	0	112.1	R317 A318 K328 E330 V332 A337 T430 I431 A432 K475	R317-F339 PolarHBondContact NH1-O 3.5Å; A318-F339 HydrophobicContact CB-CB 3.77Å; A318-F339 WeakPolarHBondContact CB-O 3.44Å; A318-F339 PolarHBondContact N-O 2.94Å; K328-F339 HydrophobicContact CB-CB 4.1Å; K328-F339 HydrophobicContact CD-CB 3.96Å; K328-F339 HydrophobicContact CD-CD1 4.23Å; K328-F339 HydrophobicContact CD-CD2 4.29Å; K328-F339 HydrophobicContact CD-CG 3.9Å; K328-F339 HydrophobicContact CG-CB 4.06Å; K328-F339 HydrophobicContact CG-CD2 4.17Å; K328-F339 HydrophobicContact CG-CG 4.15Å; K328-F339 PolarHBondContact O-N 3.46Å; E330-F339 HydrophobicContact CB-CD2 4.49Å; E330-F339 HydrophobicContact CB-CE2 3.74Å; E330-F339 HydrophobicContact CB-CZ 4.34Å; V332-F339 HydrophobicContact CG2-CE2 4.11Å; V332-F339 HydrophobicContact CG2-CZ 3.69Å; A337-F339 HydrophobicContact CB-CE2 4.42Å; A337-F339 WeakPolarHBondContact O-CD2 3.4Å; F339-T430 HydrophobicContact CD1-CG2 3.84Å; F339-I431 CarbonylContact C-O 3.57Å; F339-I431 WeakPolarHBondContact CA-O 3.37Å; F339-A432 HydrophobicContact CD1-CB 4.05Å; F339-A432 HydrophobicContact CD2-CB 4.18Å; F339-A432 HydrophobicContact CE1-CB 3.84Å; F339-A432 HydrophobicContact CE2-CB 3.94Å; F339-A432 HydrophobicContact CG-CB 4.22Å; F339-A432 HydrophobicContact CZ-CB 3.79Å; F339-K475 HydrophobicContact CE1-CD 4.49Å
340	Y	93.3	Very high	88.6	Confident	35 Å²	35	43.5 Å²	43.5	14%	0.137	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	139.3	176.2	-59.1	-100.3	0	0	0	110.5	F315 S316 R317 D338 T430 I431 M433 P469	F315-Y340 HydrophobicContact CB-CD1 4.18Å; S316-Y340 CarbonylContact O-C 3.49Å; S316-Y340 VanDerWaalsContact O-CA 3.26Å; S316-Y340 WeakPolarHBondContact O-CA 3.24Å; R317-Y340 HydrophobicContact CG-CE1 4.24Å; D338-Y340 HydrophobicContact CB-CE2 3.82Å; D338-Y340 VanDerWaalsContact O-CD2 3.31Å; D338-Y340 WeakPolarHBondContact O-CD2 3.44Å; D338-Y340 WeakPolarHBondContact O-CE2 3.26Å; Y340-T430 WeakPolarHBondContact O-CA 3.31Å; Y340-T430 WeakPolarHBondContact O-CG2 3.4Å; Y340-I431 PolarHBondContact N-O 2.88Å; Y340-I431 PolarHBondContact O-N 2.57Å; Y340-M433 HydrophobicContact CD2-CB 4.49Å; Y340-M433 HydrophobicContact CD2-CG 3.9Å; Y340-M433 HydrophobicContact CE2-CB 4.09Å; Y340-M433 HydrophobicContact CE2-CG 3.88Å; Y340-P469 HydrophobicContact CD1-CG 4.23Å; Y340-P469 HydrophobicContact CD2-CB 4.38Å; Y340-P469 HydrophobicContact CD2-CG 4.13Å; Y340-P469 HydrophobicContact CE1-CB 4.25Å; Y340-P469 HydrophobicContact CE1-CG 4.44Å; Y340-P469 HydrophobicContact CE2-CB 4.1Å; Y340-P469 HydrophobicContact CE2-CG 4.36Å; Y340-P469 HydrophobicContact CG-CG 4.08Å
341	S	91	Very high	88.5	Confident	43 Å²	43	41.3 Å²	41.3	30%	0.301	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.8	163.7	-57.5	0	0	0	0	109.6	S316	S316-S341 PolarHBondContact N-O 3.11Å; S316-S341 VanDerWaalsContact N-O 3.08Å; S316-S341 PolarHBondContact O-N 3.35Å
342	V	88.2	Confident	88.5	Confident	4 Å²	4	33 Å²	33	2%	0.024	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	115.1	175	-170.4	0	0	0	0	108.3	I313 F315 L345 A429 I431	I313-V342 HydrophobicContact CG2-CG1 3.79Å; F315-V342 HydrophobicContact CD1-CG2 4.04Å; F315-V342 HydrophobicContact CE1-CB 4.48Å; F315-V342 HydrophobicContact CE1-CG1 4.13Å; F315-V342 HydrophobicContact CE1-CG2 3.82Å; V342-L345 HydrophobicContact CG1-CB 4.2Å; V342-A429 HydrophobicContact CB-CB 4.08Å; V342-A429 HydrophobicContact CG2-CB 4.14Å; V342-A429 PolarHBondContact N-O 2.77Å; V342-I431 HydrophobicContact CG2-CB 4.39Å; V342-I431 HydrophobicContact CG2-CG2 3.97Å
343	N	86.8	Confident	88.8	Confident	69 Å²	69	35 Å²	35	37%	0.369	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	147.6	179.5	-58.1	-57.1	0	0	0	110.5	I313 T314 S316 L345	I313-N343 WeakPolarHBondContact CA-O 3.47Å; T314-N343 PolarHBondContact N-O 3.4Å; T314-N343 PolarHBondContact O-N 3.5Å; S316-N343 PolarHBondContact OG-ND2 3.28Å; N343-L345 VanDerWaalsContact C-N 3.29Å; N343-L345 PolarHBondContact O-N 3.23Å
344	G	83	Confident	89.1	Confident	32 Å²	32	33.8 Å²	33.8	33%	0.33	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.9	16.2	176.6	0	0	0	0	0	114.4	S312 V346	S312-G344 PolarHBondContact OG-O 2.91Å; G344-V346 PolarHBondContact O-N 2.84Å
345	L	82.8	Confident	89.5	Confident	1 Å²	1	29 Å²	29	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	114.1	172.1	-169.1	67.7	0	0	0	109.7	L308 I313 V342 N343 F427 A429 F463 P479	L308-L345 HydrophobicContact CD1-CD1 3.52Å; L308-L345 HydrophobicContact CD1-CD2 4.22Å; L308-L345 HydrophobicContact CD1-CG 3.72Å; L308-L345 HydrophobicContact CD2-CD1 3.86Å; L308-L345 HydrophobicContact CG-CD1 3.61Å; L308-L345 HydrophobicContact CG-CG 4.37Å; I313-L345 HydrophobicContact CD1-CD1 3.49Å; I313-L345 VanDerWaalsContact CD1-CD1 3.49Å; I313-L345 HydrophobicContact CG1-CD1 4.1Å; V342-L345 HydrophobicContact CG1-CB 4.2Å; N343-L345 VanDerWaalsContact C-N 3.29Å; N343-L345 PolarHBondContact O-N 3.23Å; L345-F427 HydrophobicContact CD2-CB 4.06Å; L345-F427 HydrophobicContact CG-CB 4.36Å; L345-F427 PolarHBondContact O-N 3.02Å; L345-A429 HydrophobicContact CD2-CB 3.97Å; L345-F463 HydrophobicContact CD2-CE2 4.37Å; L345-P479 HydrophobicContact CD2-CG 4.35Å
346	V	83.5	Confident	89.6	Confident	22 Å²	22	29 Å²	29	13%	0.133	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.2	-178.6	-173	0	0	0	0	109.5	S309 G344 E348 K424 K425 N426	S309-V346 PolarHBondContact N-O 3.43Å; G344-V346 PolarHBondContact O-N 2.84Å; V346-E348 HydrophobicContact CG1-CG 4.1Å; V346-K424 HydrophobicContact CG1-CB 4.14Å; V346-K425 WeakPolarHBondContact CA-O 3.24Å; V346-N426 WeakPolarHBondContact CG2-OD1 3.27Å
347	L	80.9	Confident	89.4	Confident	15 Å²	15	27 Å²	27	8%	0.079	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	112.3	165.8	-173.8	65.8	0	0	0	107.8	A306 K424 K425 F427 P482	A306-L347 HydrophobicContact CB-CD1 4.3Å; L347-K424 WeakPolarHBondContact O-CA 3.29Å; L347-K425 PolarHBondContact N-O 3.01Å; L347-K425 PolarHBondContact O-N 3.25Å; L347-F427 HydrophobicContact CB-CD2 3.66Å; L347-F427 HydrophobicContact CB-CE2 3.4Å; L347-F427 VanDerWaalsContact CB-CE2 3.4Å; L347-F427 HydrophobicContact CD2-CE2 3.65Å; L347-F427 HydrophobicContact CD2-CZ 4.06Å; L347-F427 HydrophobicContact CG-CE2 4.17Å; L347-P482 HydrophobicContact CD2-CG 4.36Å
348	E	84.9	Confident	89	Confident	44 Å²	44	34.9 Å²	34.9	21%	0.206	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	119.8	170.4	-59.4	-167.2	151.9	0	0	107.8	A306 T307 V346 K424	A306-E348 WeakPolarHBondContact CA-O 3.46Å; T307-E348 PolarHBondContact N-O 3.31Å; T307-E348 PolarHBondContact O-N 3.28Å; V346-E348 HydrophobicContact CG1-CG 4.1Å; E348-K424 HydrophobicContact CG-CD 4.3Å; E348-K424 HydrophobicContact CG-CG 4.25Å; E348-K424 WeakPolarHBondContact OE1-CE 3.3Å; E348-K424 IonicContact OE1-NZ 3.42Å; E348-K424 PolarHBondContact OE1-NZ 3Å
349	S	84.9	Confident	88.6	Confident	14 Å²	14	39.5 Å²	39.5	10%	0.098	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.1	178.8	62.4	0	0	0	0	110.5	Y304 S305 E422 S423	Y304-S349 VanDerWaalsContact OH-CB 3.32Å; Y304-S349 WeakPolarHBondContact OH-CB 3.26Å; S305-S349 CarbonylContact O-C 3.49Å; S305-S349 WeakPolarHBondContact O-CA 3.31Å; S349-E422 WeakPolarHBondContact O-CA 3.11Å; S349-S423 PolarHBondContact N-O 3.5Å; S349-S423 PolarHBondContact O-N 3.08Å; S349-S423 PolarHBondContact OG-O 3.33Å
350	R	87.4	Confident	88.3	Confident	43 Å²	43	39.1 Å²	39.1	16%	0.162	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	138.3	-178.2	-56	175.9	178.3	-110.4	-12.4	108.2	Q154 W156 Y304 S305 E422	Q154-R350 WeakPolarHBondContact O-CD 3.37Å; Q154-R350 PolarHBondContact O-NE 3.22Å; Q154-R350 PolarHBondContact O-NH1 3.32Å; W156-R350 HydrophobicContact CH2-CB 3.67Å; W156-R350 HydrophobicContact CZ2-CB 3.53Å; Y304-R350 WeakPolarHBondContact CA-O 3.45Å; Y304-R350 WeakPolarHBondContact CD2-O 3.42Å; S305-R350 PolarHBondContact N-O 2.85Å; S305-R350 PolarHBondContact O-N 2.85Å; R350-E422 HydrophobicContact CG-CG 4.21Å; R350-E422 IonicContact CZ-OE1 2.58Å; R350-E422 VanDerWaalsContact CZ-OE1 3.27Å; R350-E422 IonicContact NH1-OE1 3.97Å; R350-E422 PolarHBondContact NH1-OE1 3.44Å; R350-E422 IonicContact NH2-OE1 3.93Å; R350-E422 IonicContact NH2-OE2 3.02Å
351	K	89.4	Confident	88	Confident	42 Å²	42	39.4 Å²	39.4	18%	0.183	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.2	-177.7	-171.1	173.7	-173	173.4	0	109.4	D302 V303 Y304 R353 C420 K421	D302-K351 HydrophobicContact CB-CD 4.32Å; D302-K351 HydrophobicContact CB-CG 4.07Å; D302-K351 VanDerWaalsContact CG-NZ 3.28Å; D302-K351 WeakPolarHBondContact OD1-CE 3.45Å; D302-K351 IonicContact OD1-NZ 2.76Å; D302-K351 WeakPolarHBondContact OD2-CE 3.28Å; D302-K351 IonicContact OD2-NZ 2.8Å; D302-K351 PolarHBondContact OD2-NZ 2.98Å; V303-K351 CarbonylContact O-C 3.52Å; V303-K351 WeakPolarHBondContact O-CA 3.39Å; Y304-K351 HydrophobicContact CD2-CB 4.34Å; K351-R353 VanDerWaalsContact CE-CZ 3.42Å; K351-R353 VanDerWaalsContact CE-NE 3.35Å; K351-R353 VanDerWaalsContact CE-NH2 3.34Å; K351-R353 HydrophobicContact CG-CG 4.48Å; K351-C420 CarbonylContact O-C 3.56Å; K351-C420 VanDerWaalsContact O-CA 3.3Å; K351-C420 WeakPolarHBondContact O-CA 3.47Å; K351-K421 PolarHBondContact N-O 3.31Å; K351-K421 PolarHBondContact O-N 2.94Å
352	R	91.9	Very high	87.8	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.015	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	141.5	178.1	-81.7	171	74.9	175.4	-1.6	110.3	W156 E161 S164 V303 E354 L418 V419 C420	W156-R352 VanDerWaalsContact CD1-NH1 3.34Å; W156-R352 HydrophobicContact CH2-CB 4.3Å; W156-R352 HydrophobicContact CH2-CG 3.94Å; W156-R352 HydrophobicContact CZ2-CB 4.42Å; W156-R352 HydrophobicContact CZ2-CG 3.58Å; E161-R352 IonicContact OE1-NH1 2.66Å; E161-R352 PolarHBondContact OE1-NH1 2.9Å; E161-R352 IonicContact OE2-CZ 3.99Å; E161-R352 IonicContact OE2-NH1 3.58Å; E161-R352 PolarHBondContact OE2-NH1 2.66Å; E161-R352 IonicContact OE2-NH2 3.6Å; E161-R352 PolarHBondContact OE2-NH2 3.13Å; S164-R352 PolarHBondContact OG-NH2 2.85Å; V303-R352 HydrophobicContact CB-CB 4.08Å; V303-R352 HydrophobicContact CG1-CB 4.49Å; V303-R352 PolarHBondContact N-O 2.95Å; V303-R352 PolarHBondContact O-N 3.12Å; R352-E354 WeakPolarHBondContact CB-OE2 3.37Å; R352-E354 IonicContact CZ-OE1 3.75Å; R352-E354 VanDerWaalsContact CZ-OE1 3.26Å; R352-E354 IonicContact NE-OE1 2.61Å; R352-E354 PolarHBondContact NE-OE1 3.46Å; R352-E354 IonicContact NE-OE2 2.99Å; R352-E354 IonicContact NH2-OE1 3.39Å; R352-E354 PolarHBondContact NH2-OE1 3.37Å; R352-E354 VanDerWaalsContact NH2-OE1 3.09Å; R352-L418 VanDerWaalsContact CZ-CD2 3.47Å; R352-V419 WeakPolarHBondContact CA-O 3.49Å; R352-C420 HydrophobicContact CG-CB 4.03Å
353	R	93.8	Very high	87.5	Confident	50 Å²	50	46.5 Å²	46.5	19%	0.189	23%	0.233	C	C	.	.			trans	-143.1	6.1	-172.2	-54.7	-164.7	-158.1	-159.3	7.2	114.3	D302 K351 H355 L356 V419	D302-R353 WeakPolarHBondContact OD1-CD 3.39Å; D302-R353 VanDerWaalsContact OD1-CG 3.28Å; D302-R353 WeakPolarHBondContact OD1-CG 3.38Å; D302-R353 IonicContact OD1-CZ 2.79Å; D302-R353 IonicContact OD1-NE 3.31Å; D302-R353 PolarHBondContact OD1-NE 2.8Å; D302-R353 IonicContact OD1-NH1 2.6Å; K351-R353 VanDerWaalsContact CE-CZ 3.42Å; K351-R353 VanDerWaalsContact CE-NE 3.35Å; K351-R353 VanDerWaalsContact CE-NH2 3.34Å; K351-R353 HydrophobicContact CG-CG 4.48Å; R353-H355 PolarHBondContact O-N 3.11Å; R353-H355 VanDerWaalsContact O-N 3.15Å; R353-L356 HydrophobicContact CB-CD1 4.05Å; R353-L356 HydrophobicContact CB-CG 4.42Å; R353-L356 HydrophobicContact CG-CD1 4.15Å; R353-L356 WeakPolarHBondContact O-CB 3.42Å; R353-L356 PolarHBondContact O-N 3.26Å; R353-V419 PolarHBondContact N-O 2.97Å
354	E	92.1	Very high	87.3	Confident	17 Å²	17	44 Å²	44	8%	0.079	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.2	-177.8	60.7	-82.5	-172.2	0	0	114.3	S164 R352 R416 E417 L418 V419	S164-E354 VanDerWaalsContact CB-OE1 3.25Å; S164-E354 WeakPolarHBondContact CB-OE1 3.34Å; S164-E354 WeakPolarHBondContact OG-CG 3.31Å; S164-E354 PolarHBondContact OG-OE1 3.37Å; R352-E354 WeakPolarHBondContact CB-OE2 3.37Å; R352-E354 IonicContact CZ-OE1 3.75Å; R352-E354 VanDerWaalsContact CZ-OE1 3.26Å; R352-E354 IonicContact NE-OE1 2.61Å; R352-E354 PolarHBondContact NE-OE1 3.46Å; R352-E354 IonicContact NE-OE2 2.99Å; R352-E354 IonicContact NH2-OE1 3.39Å; R352-E354 PolarHBondContact NH2-OE1 3.37Å; R352-E354 VanDerWaalsContact NH2-OE1 3.09Å; E354-R416 HydrophobicContact CB-CG 4.5Å; E354-R416 WeakPolarHBondContact O-CD 3.28Å; E354-E417 WeakPolarHBondContact CB-O 3.28Å; E354-L418 HydrophobicContact CG-CD2 4.5Å; E354-V419 HydrophobicContact CB-CB 4.24Å; E354-V419 HydrophobicContact CB-CG2 4.06Å; E354-V419 PolarHBondContact OE2-N 3.15Å
355	H	93.1	Very high	87.3	Confident	9 Å²	9	48 Å²	48	4%	0.042	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-11.9	174.7	65.4	-65.5	0	0	0	113.3	I163 M299 S301 R353 L390	I163-H355 WeakPolarHBondContact O-CB 3.37Å; M299-H355 PolarHBondContact O-CD2 3.46Å; S301-H355 PolarHBondContact O-CE1 3.39Å; S301-H355 PolarHBondContact O-NE2 2.92Å; R353-H355 PolarHBondContact O-N 3.11Å; R353-H355 VanDerWaalsContact O-N 3.15Å; H355-L390 HydrophobicContact CB-CD1 3.79Å; H355-L390 WeakPolarHBondContact O-CD1 3.09Å
356	L	92.9	Very high	87.1	Confident	18 Å²	18	50.6 Å²	50.6	9%	0.094	25%	0.249	C	C	.	.			trans	-87.4	143.1	-174.9	-61.9	-175.2	0	0	0	111.8	M299 S300 D302 R353 D360 I361	M299-L356 WeakPolarHBondContact O-CD2 3.46Å; S300-L356 VanDerWaalsContact C-CD2 3.4Å; S300-L356 WeakPolarHBondContact O-CD2 3.39Å; D302-L356 VanDerWaalsContact OD1-CD1 3.28Å; D302-L356 WeakPolarHBondContact OD1-CD1 3.36Å; R353-L356 HydrophobicContact CB-CD1 4.05Å; R353-L356 HydrophobicContact CB-CG 4.42Å; R353-L356 HydrophobicContact CG-CD1 4.15Å; R353-L356 WeakPolarHBondContact O-CB 3.42Å; R353-L356 PolarHBondContact O-N 3.26Å; L356-D360 HydrophobicContact CB-CB 4Å; L356-D360 HydrophobicContact CD2-CB 4.07Å; L356-D360 HydrophobicContact CG-CB 4.48Å; L356-I361 HydrophobicContact CB-CD1 4.42Å; L356-I361 HydrophobicContact CB-CG1 3.91Å; L356-I361 HydrophobicContact CD1-CG1 4.28Å
357	S	90.3	Very high	86.4	Confident	45 Å²	45	52.3 Å²	52.3	32%	0.315	26%	0.257	S	S	.	.			trans	-74.3	165.2	166.6	75.4	0	0	0	0	111.2	E359 D360 I361	S357-E359 PolarHBondContact O-N 3.01Å; S357-E359 PolarHBondContact OG-N 2.96Å; S357-D360 PolarHBondContact N-OD2 3.36Å; S357-D360 WeakPolarHBondContact O-CB 3.19Å; S357-D360 PolarHBondContact O-N 3.48Å; S357-D360 VanDerWaalsContact O-N 3.15Å; S357-D360 PolarHBondContact OG-N 2.93Å; S357-D360 VanDerWaalsContact OG-N 3.07Å; S357-D360 PolarHBondContact OG-OD2 3.23Å; S357-D360 VanDerWaalsContact OG-OD2 3.05Å; S357-I361 WeakPolarHBondContact O-CG1 2.88Å; S357-I361 PolarHBondContact O-N 2.87Å
358	E	88.9	Confident	85.8	Confident	166 Å²	166	57.1 Å²	57.1	78%	0.776	28%	0.28	S	S	*	.	H	α-helix	trans	-58.4	-38.5	172.3	-66.6	-177	174	0	0	111.8	D360 I361 L362	E358-D360 VanDerWaalsContact C-N 3.34Å; E358-D360 PolarHBondContact O-N 3.23Å; E358-I361 PolarHBondContact O-N 3.15Å; E358-L362 WeakPolarHBondContact O-CB 3.28Å; E358-L362 VanDerWaalsContact O-CG 3.31Å; E358-L362 WeakPolarHBondContact O-CG 3.46Å; E358-L362 PolarHBondContact O-N 3.45Å
359	E	87.3	Confident	85	Confident	147 Å²	147	59.8 Å²	59.8	69%	0.687	29%	0.293	S	S	*	.	H	α-helix	trans	-61.8	-41.7	175.6	-61.8	179.8	-179.7	0	0	111.7	S357 L362 R363	S357-E359 PolarHBondContact O-N 3.01Å; S357-E359 PolarHBondContact OG-N 2.96Å; E359-L362 PolarHBondContact O-N 3.16Å; E359-R363 VanDerWaalsContact O-CB 3.27Å; E359-R363 WeakPolarHBondContact O-CB 3.41Å; E359-R363 PolarHBondContact O-N 3.45Å
360	D	88	Confident	84	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.011	30%	0.298	C	S	.	.	H	α-helix	trans	-66	-41.5	176.8	-66.5	-32.1	0	0	0	111.1	L356 S357 E358 L362 R363 N364 R387	L356-D360 HydrophobicContact CB-CB 4Å; L356-D360 HydrophobicContact CD2-CB 4.07Å; L356-D360 HydrophobicContact CG-CB 4.48Å; S357-D360 PolarHBondContact N-OD2 3.36Å; S357-D360 WeakPolarHBondContact O-CB 3.19Å; S357-D360 PolarHBondContact O-N 3.48Å; S357-D360 VanDerWaalsContact O-N 3.15Å; S357-D360 PolarHBondContact OG-N 2.93Å; S357-D360 VanDerWaalsContact OG-N 3.07Å; S357-D360 PolarHBondContact OG-OD2 3.23Å; S357-D360 VanDerWaalsContact OG-OD2 3.05Å; E358-D360 VanDerWaalsContact C-N 3.34Å; E358-D360 PolarHBondContact O-N 3.23Å; D360-L362 PolarHBondContact O-N 2.88Å; D360-R363 PolarHBondContact O-N 3.25Å; D360-N364 WeakPolarHBondContact O-CB 3.36Å; D360-N364 PolarHBondContact O-N 3.45Å; D360-N364 PolarHBondContact O-ND2 3.46Å; D360-N364 PolarHBondContact O-OD1 3.49Å; D360-R387 IonicContact OD1-CZ 3.42Å; D360-R387 IonicContact OD1-NH1 2.98Å; D360-R387 PolarHBondContact OD1-NH1 3.1Å; D360-R387 IonicContact OD1-NH2 3.35Å; D360-R387 PolarHBondContact OD1-NH2 3.31Å; D360-R387 IonicContact OD2-CZ 2.7Å; D360-R387 IonicContact OD2-NH1 3.94Å; D360-R387 PolarHBondContact OD2-NH1 3.47Å; D360-R387 IonicContact OD2-NH2 2.72Å
361	I	87.4	Confident	82.6	Confident	41 Å²	41	59.5 Å²	59.5	21%	0.21	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-44.8	176.9	-68.2	167.8	0	0	0	110.7	L356 S357 E358 N364 K365	L356-I361 HydrophobicContact CB-CD1 4.42Å; L356-I361 HydrophobicContact CB-CG1 3.91Å; L356-I361 HydrophobicContact CD1-CG1 4.28Å; S357-I361 WeakPolarHBondContact O-CG1 2.88Å; S357-I361 PolarHBondContact O-N 2.87Å; E358-I361 PolarHBondContact O-N 3.15Å; I361-N364 PolarHBondContact O-N 3.25Å; I361-K365 HydrophobicContact CG2-CD 4.22Å; I361-K365 WeakPolarHBondContact O-CB 3.13Å; I361-K365 VanDerWaalsContact O-CG 3.27Å; I361-K365 WeakPolarHBondContact O-CG 3.35Å; I361-K365 PolarHBondContact O-N 2.89Å
362	L	86.3	Confident	81.1	Confident	112 Å²	112	60.4 Å²	60.4	59%	0.586	31%	0.307	S	S	*	.	H	α-helix	trans	-64.1	-43	177.2	-71.5	172.5	0	0	0	111.2	E358 E359 D360 K365 A366	E358-L362 WeakPolarHBondContact O-CB 3.28Å; E358-L362 VanDerWaalsContact O-CG 3.31Å; E358-L362 WeakPolarHBondContact O-CG 3.46Å; E358-L362 PolarHBondContact O-N 3.45Å; E359-L362 PolarHBondContact O-N 3.16Å; D360-L362 PolarHBondContact O-N 2.88Å; L362-K365 PolarHBondContact O-N 3.31Å; L362-A366 WeakPolarHBondContact O-CB 3.49Å; L362-A366 PolarHBondContact O-N 2.82Å
363	R	82.5	Confident	79.4	Confident	84 Å²	84	67.3 Å²	67.3	32%	0.317	34%	0.337	S	S	.	.	H	α-helix	trans	-59.1	-51.2	174.9	-173.9	-168	-56.2	-167.2	-0.7	111.4	E359 D360 K365 A366 I367	E359-R363 VanDerWaalsContact O-CB 3.27Å; E359-R363 WeakPolarHBondContact O-CB 3.41Å; E359-R363 PolarHBondContact O-N 3.45Å; D360-R363 PolarHBondContact O-N 3.25Å; R363-K365 VanDerWaalsContact C-N 3.29Å; R363-K365 PolarHBondContact O-N 3Å; R363-A366 PolarHBondContact O-N 2.86Å; R363-A366 VanDerWaalsContact O-N 3.14Å; R363-I367 HydrophobicContact CG-CD1 4.03Å; R363-I367 WeakPolarHBondContact O-CG1 3.48Å; R363-I367 PolarHBondContact O-N 3.31Å
364	N	82.6	Confident	77.3	Confident	15 Å²	15	67 Å²	67	8%	0.08	35%	0.349	C	S	.	.	H	α-helix	trans	-64.2	-35.3	-179.5	-66.7	-12.2	0	0	0	111.6	S300 D360 I361 M368	S300-N364 PolarHBondContact O-ND2 2.82Å; D360-N364 WeakPolarHBondContact O-CB 3.36Å; D360-N364 PolarHBondContact O-N 3.45Å; D360-N364 PolarHBondContact O-ND2 3.46Å; D360-N364 PolarHBondContact O-OD1 3.49Å; I361-N364 PolarHBondContact O-N 3.25Å; N364-M368 WeakPolarHBondContact O-CB 3.41Å; N364-M368 WeakPolarHBondContact O-CG 3.42Å; N364-M368 PolarHBondContact O-N 3Å; N364-M368 VanDerWaalsContact O-N 3.11Å
365	K	82.6	Confident	75.4	Confident	117 Å²	117	67.9 Å²	67.9	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-47.6	171.4	-77.8	176.4	179.8	-179.5	0	111.5	I361 L362 R363 I367 M368 E369	I361-K365 HydrophobicContact CG2-CD 4.22Å; I361-K365 WeakPolarHBondContact O-CB 3.13Å; I361-K365 VanDerWaalsContact O-CG 3.27Å; I361-K365 WeakPolarHBondContact O-CG 3.35Å; I361-K365 PolarHBondContact O-N 2.89Å; L362-K365 PolarHBondContact O-N 3.31Å; R363-K365 VanDerWaalsContact C-N 3.29Å; R363-K365 PolarHBondContact O-N 3Å; K365-I367 PolarHBondContact O-N 3.36Å; K365-M368 PolarHBondContact O-N 3Å; K365-E369 WeakPolarHBondContact O-CB 3.29Å; K365-E369 PolarHBondContact O-N 2.84Å
366	A	77.7	Confident	73.3	Confident	55 Å²	55	74.7 Å²	74.7	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-63.7	-40.5	-179.5	0	0	0	0	0	112.3	L362 R363 E369 S370	L362-A366 WeakPolarHBondContact O-CB 3.49Å; L362-A366 PolarHBondContact O-N 2.82Å; R363-A366 PolarHBondContact O-N 2.86Å; R363-A366 VanDerWaalsContact O-N 3.14Å; A366-E369 PolarHBondContact O-N 2.85Å; A366-S370 WeakPolarHBondContact O-CB 3.27Å; A366-S370 PolarHBondContact O-N 3.13Å
367	I	70.3	Confident	71.3	Confident	58 Å²	58	76 Å²	76	30%	0.297	41%	0.406	S	S	.	.	H	α-helix	trans	-58.4	-54.5	172.8	-68.6	167.2	0	0	0	109.2	R363 K365 E369 S370 L371 L377	R363-I367 HydrophobicContact CG-CD1 4.03Å; R363-I367 WeakPolarHBondContact O-CG1 3.48Å; R363-I367 PolarHBondContact O-N 3.31Å; K365-I367 PolarHBondContact O-N 3.36Å; I367-E369 VanDerWaalsContact C-N 3.3Å; I367-E369 PolarHBondContact O-N 3.02Å; I367-S370 PolarHBondContact O-N 3.5Å; I367-L371 HydrophobicContact CG2-CD1 3.94Å; I367-L371 HydrophobicContact CG2-CG 4.38Å; I367-L371 WeakPolarHBondContact O-CG 3.36Å; I367-L371 PolarHBondContact O-N 2.94Å; I367-L377 HydrophobicContact CG1-CD2 4.29Å; I367-L377 HydrophobicContact CG2-CD2 4.33Å
368	M	67	Low	69.1	Low	116 Å²	116	80.5 Å²	80.5	57%	0.571	43%	0.426	S	S	*	.	H	α-helix	trans	-59.6	-36.9	179.1	-76.4	-64.2	-67.7	0	0	113.6	N364 K365 L371 S372	N364-M368 WeakPolarHBondContact O-CB 3.41Å; N364-M368 WeakPolarHBondContact O-CG 3.42Å; N364-M368 PolarHBondContact O-N 3Å; N364-M368 VanDerWaalsContact O-N 3.11Å; K365-M368 PolarHBondContact O-N 3Å; M368-L371 HydrophobicContact SD-CD1 4.29Å; M368-S372 WeakPolarHBondContact O-CB 3.34Å; M368-S372 PolarHBondContact O-N 3.34Å
369	E	68.5	Low	67	Low	101 Å²	101	80.2 Å²	80.2	47%	0.472	42%	0.424	S	S	.	.	H	α-helix	trans	-69.8	-43.9	178.1	-169.8	176.9	-178.5	0	0	111.7	K365 A366 I367 L371 S372 K373	K365-E369 WeakPolarHBondContact O-CB 3.29Å; K365-E369 PolarHBondContact O-N 2.84Å; A366-E369 PolarHBondContact O-N 2.85Å; I367-E369 VanDerWaalsContact C-N 3.3Å; I367-E369 PolarHBondContact O-N 3.02Å; E369-L371 VanDerWaalsContact C-N 3.32Å; E369-L371 PolarHBondContact O-N 2.91Å; E369-S372 PolarHBondContact O-N 2.88Å; E369-S372 PolarHBondContact O-OG 3Å; E369-K373 HydrophobicContact CG-CD 4.27Å; E369-K373 WeakPolarHBondContact O-CG 3.35Å; E369-K373 PolarHBondContact O-N 2.93Å; E369-K373 VanDerWaalsContact O-N 3.07Å; E369-K373 WeakPolarHBondContact OE1-CE 3.49Å; E369-K373 IonicContact OE1-NZ 2.85Å; E369-K373 PolarHBondContact OE1-NZ 3.11Å
370	S	64.7	Low	65	Low	30 Å²	30	79.1 Å²	79.1	21%	0.21	42%	0.419	C	S	.	.	H	α-helix	trans	-57.8	-45.1	173.3	-171.4	0	0	0	0	111.4	A366 I367 S372 K373 G374 G375	A366-S370 WeakPolarHBondContact O-CB 3.27Å; A366-S370 PolarHBondContact O-N 3.13Å; I367-S370 PolarHBondContact O-N 3.5Å; S370-S372 VanDerWaalsContact C-N 3.34Å; S370-S372 PolarHBondContact O-N 3.45Å; S370-K373 PolarHBondContact O-N 3.21Å; S370-G374 PolarHBondContact O-N 2.81Å; S370-G374 VanDerWaalsContact O-N 3.15Å; S370-G375 PolarHBondContact O-N 2.92Å; S370-G375 PolarHBondContact OG-O 3.04Å
371	L	57.5	Low	62.7	Low	21 Å²	21	86.8 Å²	86.8	11%	0.11	46%	0.46	C	S	.	.	H	α-helix	trans	-60.1	-42.2	175.5	-67.2	177.3	0	0	0	112.1	D247 M248 I367 M368 E369 K373 G374 L377	D247-L371 HydrophobicContact CB-CD1 4.42Å; D247-L371 HydrophobicContact CB-CD2 4.21Å; D247-L371 WeakPolarHBondContact O-CD2 3.02Å; M248-L371 HydrophobicContact CB-CD2 4.01Å; M248-L371 HydrophobicContact CG-CB 4.39Å; M248-L371 HydrophobicContact CG-CD2 4.2Å; I367-L371 HydrophobicContact CG2-CD1 3.94Å; I367-L371 HydrophobicContact CG2-CG 4.38Å; I367-L371 WeakPolarHBondContact O-CG 3.36Å; I367-L371 PolarHBondContact O-N 2.94Å; M368-L371 HydrophobicContact SD-CD1 4.29Å; E369-L371 VanDerWaalsContact C-N 3.32Å; E369-L371 PolarHBondContact O-N 2.91Å; L371-K373 VanDerWaalsContact C-N 3.29Å; L371-K373 PolarHBondContact O-N 3.1Å; L371-G374 PolarHBondContact O-N 2.73Å; L371-L377 HydrophobicContact CD2-CD1 4.38Å
372	S	56.9	Low	61	Low	60 Å²	60	90.5 Å²	90.5	42%	0.42	48%	0.475	S	S	.	.	H	α-helix	trans	-69.1	-26.2	179.2	74.3	0	0	0	0	113.8	M368 E369 S370	M368-S372 WeakPolarHBondContact O-CB 3.34Å; M368-S372 PolarHBondContact O-N 3.34Å; E369-S372 PolarHBondContact O-N 2.88Å; E369-S372 PolarHBondContact O-OG 3Å; S370-S372 VanDerWaalsContact C-N 3.34Å; S370-S372 PolarHBondContact O-N 3.45Å
373	K	57.3	Low	59.4	Low	150 Å²	150	93.2 Å²	93.2	65%	0.652	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	2.1	-178.4	-66.4	-178.8	-173	174.4	0	113.4	E369 S370 L371 G375	E369-K373 HydrophobicContact CG-CD 4.27Å; E369-K373 WeakPolarHBondContact O-CG 3.35Å; E369-K373 PolarHBondContact O-N 2.93Å; E369-K373 VanDerWaalsContact O-N 3.07Å; E369-K373 WeakPolarHBondContact OE1-CE 3.49Å; E369-K373 IonicContact OE1-NZ 2.85Å; E369-K373 PolarHBondContact OE1-NZ 3.11Å; S370-K373 PolarHBondContact O-N 3.21Å; L371-K373 VanDerWaalsContact C-N 3.29Å; L371-K373 PolarHBondContact O-N 3.1Å; K373-G375 PolarHBondContact O-N 3.23Å
374	G	50.3	Low	58.1	Low	42 Å²	42	94.6 Å²	94.6	43%	0.433	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	24.4	-178.9	0	0	0	0	0	113.8	S370 L371	S370-G374 PolarHBondContact O-N 2.81Å; S370-G374 VanDerWaalsContact O-N 3.15Å; L371-G374 PolarHBondContact O-N 2.73Å
375	G	51.7	Low	57.4	Low	36 Å²	36	99 Å²	99	37%	0.371	53%	0.532	S	S	.	.			trans	-76.3	140.3	176.1	0	0	0	0	0	111.2	S370 K373 L377	S370-G375 PolarHBondContact O-N 2.92Å; S370-G375 PolarHBondContact OG-O 3.04Å; K373-G375 PolarHBondContact O-N 3.23Å; G375-L377 PolarHBondContact O-N 2.91Å
376	N	48.1	Very low	57.5	Low	152 Å²	152	98.7 Å²	98.7	81%	0.813	53%	0.528	S	S	*	.			trans	-60.2	126.4	163.3	-77.6	-20.6	0	0	0	107.6	I378	N376-I378 VanDerWaalsContact C-N 3.32Å; N376-I378 PolarHBondContact O-N 3.07Å
377	L	51.6	Low	57.9	Low	46 Å²	46	98.9 Å²	98.9	24%	0.241	52%	0.517	C	S	.	.			trans	-56.9	102.6	166	-78.2	161.5	0	0	0	106.4	I367 L371 G375 E379	I367-L377 HydrophobicContact CG1-CD2 4.29Å; I367-L377 HydrophobicContact CG2-CD2 4.33Å; L371-L377 HydrophobicContact CD2-CD1 4.38Å; G375-L377 PolarHBondContact O-N 2.91Å; L377-E379 VanDerWaalsContact C-N 3.35Å; L377-E379 PolarHBondContact O-N 3.39Å
378	I	44.5	Very low	58.9	Low	140 Å²	140	103.2 Å²	103.2	72%	0.718	54%	0.536	S	S	*	.			trans	-60.4	110.7	162.5	-60.5	172.6	0	0	0	103.1	N376 Q380	N376-I378 VanDerWaalsContact C-N 3.32Å; N376-I378 PolarHBondContact O-N 3.07Å; I378-Q380 HydrophobicContact CG2-CG 4.26Å; I378-Q380 PolarHBondContact O-N 3.38Å
379	E	44.2	Very low	60.2	Low	159 Å²	159	100.2 Å²	100.2	74%	0.743	53%	0.526	S	S	*	.			trans	-56.6	81.5	158.5	-75.3	172.1	-178.2	0	0	106.2	L377 N381	L377-E379 VanDerWaalsContact C-N 3.35Å; L377-E379 PolarHBondContact O-N 3.39Å; E379-N381 PolarHBondContact O-N 3.47Å
380	Q	44.7	Very low	61.4	Low	124 Å²	124	98 Å²	98	58%	0.579	52%	0.517	S	S	*	.			trans	-59.5	119.6	155.5	-74.1	-178.5	4.8	0	0	103.5	I378 F382	I378-Q380 HydrophobicContact CG2-CG 4.26Å; I378-Q380 PolarHBondContact O-N 3.38Å; Q380-F382 HydrophobicContact CB-CD2 3.93Å; Q380-F382 HydrophobicContact CB-CE1 4.37Å; Q380-F382 HydrophobicContact CB-CE2 3.37Å; Q380-F382 HydrophobicContact CB-CZ 3.63Å; Q380-F382 HydrophobicContact CG-CE2 4.4Å; Q380-F382 HydrophobicContact CG-CZ 4.48Å; Q380-F382 WeakPolarHBondContact O-CD2 3.37Å; Q380-F382 WeakPolarHBondContact O-CG 3.45Å; Q380-F382 PolarHBondContact O-N 3.45Å
381	N	40.7	Very low	62.7	Low	164 Å²	164	101.9 Å²	101.9	88%	0.877	54%	0.54	S	S	*	.			trans	-51	84.6	179.4	-69.3	-28.1	0	0	0	110.4	E379	E379-N381 PolarHBondContact O-N 3.47Å
382	F	52.1	Low	64.3	Low	118 Å²	118	104.7 Å²	104.7	52%	0.518	56%	0.559	S	S	.	*			trans	-99.7	98	175.8	-67.4	-61.5	0	0	0	106.2	Q380 P384	Q380-F382 HydrophobicContact CB-CD2 3.93Å; Q380-F382 HydrophobicContact CB-CE1 4.37Å; Q380-F382 HydrophobicContact CB-CE2 3.37Å; Q380-F382 HydrophobicContact CB-CZ 3.63Å; Q380-F382 HydrophobicContact CG-CE2 4.4Å; Q380-F382 HydrophobicContact CG-CZ 4.48Å; Q380-F382 WeakPolarHBondContact O-CD2 3.37Å; Q380-F382 WeakPolarHBondContact O-CG 3.45Å; Q380-F382 PolarHBondContact O-N 3.45Å; F382-P384 WeakPolarHBondContact O-CD 3.19Å
383	E	51	Low	65.9	Low	170 Å²	170	103.2 Å²	103.2	79%	0.794	55%	0.548	S	S	*	.			trans	-58.9	125.3	167.7	-73.6	-176	164.9	0	0	108.4	T385	E383-T385 PolarHBondContact O-N 2.87Å; E383-T385 PolarHBondContact O-OG1 3.13Å
384	P	56	Low	67.3	Low	113 Å²	113	103.7 Å²	103.7	73%	0.734	56%	0.557	S	S	*	*			trans	-57.1	102.5	176.1	-20.9	30.6	0	0	0	109.2	F382	F382-P384 WeakPolarHBondContact O-CD 3.19Å
385	T	69.1	Low	68.9	Low	107 Å²	107	107.4 Å²	107.4	66%	0.656	57%	0.573	S	S	*	*			trans	-85.5	121	178.4	-51.5	0	0	0	0	108.2	E383 R387	E383-T385 PolarHBondContact O-N 2.87Å; E383-T385 PolarHBondContact O-OG1 3.13Å; T385-R387 PolarHBondContact O-N 3.19Å; T385-R387 VanDerWaalsContact O-N 3.1Å
386	R	84.1	Confident	70.5	Confident	111 Å²	111	107.8 Å²	107.8	42%	0.419	57%	0.567	S	S	.	*			trans	-56	114.4	179	-175.3	64.4	-175.1	-125.5	1.9	110.9	R168 E292 D296	R168-R386 VanDerWaalsContact CZ-CZ 3.43Å; R168-R386 VanDerWaalsContact NE-NE 3.15Å; R168-R386 VanDerWaalsContact NH2-CZ 3.29Å; E292-R386 IonicContact OE1-CZ 3.26Å; E292-R386 IonicContact OE1-NH1 3.09Å; E292-R386 PolarHBondContact OE1-NH1 3.03Å; E292-R386 IonicContact OE1-NH2 2.92Å; E292-R386 PolarHBondContact OE1-NH2 3.21Å; E292-R386 IonicContact OE2-CZ 2.69Å; E292-R386 IonicContact OE2-NH1 2.62Å; E292-R386 PolarHBondContact OE2-NH1 2.86Å; E292-R386 IonicContact OE2-NH2 3.65Å; E292-R386 PolarHBondContact OE2-NH2 2.8Å; D296-R386 WeakPolarHBondContact OD2-CD 3.44Å
387	R	85.3	Confident	72.4	Confident	59 Å²	59	106.9 Å²	106.9	22%	0.223	57%	0.567	C	S	.	*	P	Polyproline II helix	trans	-75.6	131.9	-178	-66.1	-72.2	178.6	145.2	4.2	110	R168 D296 M299 D360 T385	R168-R387 WeakPolarHBondContact CD-O 3.5Å; R168-R387 PolarHBondContact NE-O 3.46Å; D296-R387 HydrophobicContact CB-CG 4.3Å; D296-R387 WeakPolarHBondContact OD1-CB 3.48Å; D296-R387 PolarHBondContact OD1-N 2.89Å; M299-R387 HydrophobicContact CB-CB 4.3Å; M299-R387 HydrophobicContact CB-CG 4.3Å; M299-R387 HydrophobicContact CE-CB 4.34Å; M299-R387 HydrophobicContact SD-CB 4Å; D360-R387 IonicContact OD1-CZ 3.42Å; D360-R387 IonicContact OD1-NH1 2.98Å; D360-R387 PolarHBondContact OD1-NH1 3.1Å; D360-R387 IonicContact OD1-NH2 3.35Å; D360-R387 PolarHBondContact OD1-NH2 3.31Å; D360-R387 IonicContact OD2-CZ 2.7Å; D360-R387 IonicContact OD2-NH1 3.94Å; D360-R387 PolarHBondContact OD2-NH1 3.47Å; D360-R387 IonicContact OD2-NH2 2.72Å; T385-R387 PolarHBondContact O-N 3.19Å; T385-R387 VanDerWaalsContact O-N 3.1Å
388	Q	91.4	Very high	74.4	Confident	149 Å²	149	106.8 Å²	106.8	70%	0.696	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-85.2	161.1	170.3	-65.7	-61.2	-29.4	0	0	110.3	M299	M299-Q388 VanDerWaalsContact CE-O 3.27Å; M299-Q388 WeakPolarHBondContact CE-O 3.27Å
389	S	94.1	Very high	76.7	Confident	52 Å²	52	102.1 Å²	102.1	36%	0.364	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-60.3	142.8	172.8	-60.5	0	0	0	0	110.3	G166 R168	G166-S389 CarbonylContact O-C 3.49Å; G166-S389 VanDerWaalsContact O-CA 3.31Å; G166-S389 WeakPolarHBondContact O-CA 3.36Å; R168-S389 VanDerWaalsContact CB-OG 3.28Å; R168-S389 WeakPolarHBondContact CB-OG 3.36Å; R168-S389 PolarHBondContact N-OG 2.91Å
390	L	93.3	Very high	79	Confident	55 Å²	55	95.6 Å²	95.6	29%	0.288	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-68.1	156.5	171.9	-58	-176.4	0	0	0	110	G166 H355 P392	G166-L390 PolarHBondContact O-N 2.76Å; H355-L390 HydrophobicContact CB-CD1 3.79Å; H355-L390 WeakPolarHBondContact O-CD1 3.09Å; L390-P392 WeakPolarHBondContact O-CD 3.23Å
391	T	92.4	Very high	81.3	Confident	112 Å²	112	94.4 Å²	94.4	69%	0.687	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-59.7	127.5	169.5	-51.5	0	0	0	0	109	R416	T391-R416 PolarHBondContact O-NH2 2.88Å
392	P	91.2	Very high	83.7	Confident	80 Å²	80	91.7 Å²	91.7	52%	0.519	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-53.6	145	175.8	-28.4	36.3	0	0	0	111.9	L390	L390-P392 WeakPolarHBondContact O-CD 3.23Å
393	P	89.8	Confident	85.7	Confident	29 Å²	29	86.1 Å²	86.1	19%	0.188	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-62.9	164.4	172.6	28.7	-34.1	0	0	0	111	Y165 R416	Y165-P393 HydrophobicContact CD2-CG 4.2Å; Y165-P393 HydrophobicContact CE2-CG 3.72Å; P393-R416 HydrophobicContact CB-CB 4.23Å
394	L	87.1	Confident	87.6	Confident	160 Å²	160	79.7 Å²	79.7	84%	0.838	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-57.5	146.9	172.6	-69	172.9	0	0	0	110.3	N396	L394-N396 PolarHBondContact O-N 3.14Å
395	P	84.1	Confident	89.2	Confident	119 Å²	119	79 Å²	79	77%	0.773	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-54.2	131.5	177.5	-25.6	34.3	0	0	0	111.3	T397	P395-T397 PolarHBondContact O-N 3.34Å
396	N	85.3	Confident	90.2	Very high	45 Å²	45	75.2 Å²	75.2	24%	0.241	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-68.1	131	178.6	-174.9	5.1	0	0	0	110.4	M132 L394 I398 L414	M132-N396 HydrophobicContact CE-CB 4Å; M132-N396 HydrophobicContact SD-CB 4.14Å; M132-N396 PolarHBondContact SD-ND2 3.01Å; L394-N396 PolarHBondContact O-N 3.14Å; N396-I398 VanDerWaalsContact OD1-CB 3.26Å; N396-I398 WeakPolarHBondContact OD1-CB 3.44Å; N396-I398 WeakPolarHBondContact OD1-CG1 3.27Å; N396-I398 PolarHBondContact OD1-N 3.3Å; N396-L414 VanDerWaalsContact ND2-CA 3.35Å; N396-L414 WeakPolarHBondContact ND2-CA 3.32Å; N396-L414 WeakPolarHBondContact ND2-CD2 3.4Å
397	T	88.8	Confident	90.4	Very high	132 Å²	132	74.9 Å²	74.9	81%	0.81	42%	0.417	S	S	*	.			trans	-96.3	-6.3	179.1	54.7	0	0	0	0	113.5	P395	P395-T397 PolarHBondContact O-N 3.34Å
398	I	92.3	Very high	90	Very high	45 Å²	45	77.9 Å²	77.9	23%	0.231	44%	0.438	C	S	.	.			trans	-69.7	129.5	-179.1	-60	-65.2	0	0	0	110	F99 N396 E402 P412 L414	F99-I398 VanDerWaalsContact CE1-O 3.29Å; F99-I398 WeakPolarHBondContact CE1-O 3.38Å; F99-I398 HydrophobicContact CZ-CG2 4.34Å; F99-I398 WeakPolarHBondContact CZ-O 3.38Å; N396-I398 VanDerWaalsContact OD1-CB 3.26Å; N396-I398 WeakPolarHBondContact OD1-CB 3.44Å; N396-I398 WeakPolarHBondContact OD1-CG1 3.27Å; N396-I398 PolarHBondContact OD1-N 3.3Å; I398-E402 HydrophobicContact CG2-CB 4.03Å; I398-P412 HydrophobicContact CD1-CB 4.01Å; I398-P412 HydrophobicContact CG1-CB 4.07Å; I398-P412 HydrophobicContact CG2-CB 3.96Å; I398-P412 HydrophobicContact CG2-CG 3.66Å; I398-L414 HydrophobicContact CB-CD2 4.41Å; I398-L414 HydrophobicContact CG2-CD2 4.32Å
399	S	93.3	Very high	89.1	Confident	41 Å²	41	73.4 Å²	73.4	29%	0.287	43%	0.432	S	S	.	.			trans	-76.9	158.9	173.4	63.1	0	0	0	0	112.2	E401 E402 Y403	S399-E401 PolarHBondContact O-N 3.24Å; S399-E402 PolarHBondContact N-OE2 3.4Å; S399-E402 PolarHBondContact O-N 3.18Å; S399-E402 WeakPolarHBondContact OG-CB 3.37Å; S399-E402 WeakPolarHBondContact OG-CG 3.43Å; S399-E402 PolarHBondContact OG-N 2.98Å; S399-E402 PolarHBondContact OG-OE2 3.45Å; S399-Y403 PolarHBondContact O-N 3.1Å
400	W	92.7	Very high	88.4	Confident	23 Å²	23	80.1 Å²	80.1	9%	0.087	45%	0.449	C	S	.	.	H	α-helix	trans	-58.9	-40.1	175.1	167.6	-108	0	0	0	111.4	F92 H95 E96 F99 L128 Y403 I404	F92-W400 HydrophobicContact CB-CH2 4.03Å; F92-W400 HydrophobicContact CB-CZ2 3.98Å; H95-W400 HydrophobicContact CB-CH2 3.45Å; H95-W400 VanDerWaalsContact CB-CH2 3.45Å; H95-W400 HydrophobicContact CB-CZ2 4.43Å; H95-W400 HydrophobicContact CB-CZ3 3.84Å; E96-W400 HydrophobicContact CB-CD2 3.98Å; E96-W400 HydrophobicContact CB-CE3 4.49Å; E96-W400 HydrophobicContact CB-CG 4.36Å; E96-W400 HydrophobicContact CB-CZ2 4Å; E96-W400 HydrophobicContact CG-CD2 3.99Å; E96-W400 HydrophobicContact CG-CG 3.83Å; F99-W400 HydrophobicContact CB-CE3 3.67Å; F99-W400 HydrophobicContact CB-CZ3 4.14Å; F99-W400 HydrophobicContact CD1-CB 3.97Å; F99-W400 HydrophobicContact CD1-CE3 4.28Å; F99-W400 AromaticContact CD2-CE3 3.79Å; F99-W400 HydrophobicContact CD2-CE3 3.79Å; F99-W400 HydrophobicContact CD2-CZ3 4.25Å; F99-W400 HydrophobicContact CE1-CB 4.23Å; F99-W400 HydrophobicContact CG-CB 4.5Å; F99-W400 AromaticContact CG-CE3 3.66Å; F99-W400 HydrophobicContact CG-CE3 3.66Å; F99-W400 HydrophobicContact CG-CZ3 4.37Å; L128-W400 HydrophobicContact CD1-CZ3 4.16Å; W400-Y403 AromaticContact CE3-CD1 3.91Å; W400-Y403 HydrophobicContact CE3-CD1 3.91Å; W400-Y403 HydrophobicContact CH2-CD1 4.46Å; W400-Y403 AromaticContact CZ3-CD1 3.68Å; W400-Y403 HydrophobicContact CZ3-CD1 3.68Å; W400-Y403 AromaticContact CZ3-CE1 3.9Å; W400-Y403 HydrophobicContact CZ3-CE1 3.9Å; W400-Y403 PolarHBondContact O-N 3.28Å; W400-I404 HydrophobicContact CH2-CB 4.39Å; W400-I404 HydrophobicContact CH2-CD1 3.78Å; W400-I404 HydrophobicContact CH2-CG1 4.25Å; W400-I404 HydrophobicContact CZ2-CB 4.02Å; W400-I404 HydrophobicContact CZ2-CD1 3.89Å; W400-I404 HydrophobicContact CZ2-CG1 3.87Å; W400-I404 WeakPolarHBondContact O-CG2 3.29Å; W400-I404 PolarHBondContact O-N 2.84Å
401	E	92.1	Very high	87.9	Confident	99 Å²	99	79 Å²	79	46%	0.463	45%	0.447	S	S	.	.	H	α-helix	trans	-64.8	-44.3	-179	-65.2	70.2	-154.2	0	0	110.9	S399 Y403 T405	S399-E401 PolarHBondContact O-N 3.24Å; E401-Y403 VanDerWaalsContact C-N 3.34Å; E401-Y403 PolarHBondContact O-N 2.95Å; E401-T405 VanDerWaalsContact O-CB 3.29Å; E401-T405 WeakPolarHBondContact O-CB 3.49Å; E401-T405 WeakPolarHBondContact O-CG2 3.32Å; E401-T405 PolarHBondContact O-N 3.43Å; E401-T405 VanDerWaalsContact O-N 3.1Å; E401-T405 PolarHBondContact O-OG1 3.38Å
402	E	92.4	Very high	87.5	Confident	106 Å²	106	75 Å²	75	50%	0.495	42%	0.424	S	S	.	.	H	α-helix	trans	-61.7	-41.4	173	-74.6	163.5	164.8	0	0	111.8	I398 S399 A406	I398-E402 HydrophobicContact CG2-CB 4.03Å; S399-E402 PolarHBondContact N-OE2 3.4Å; S399-E402 PolarHBondContact O-N 3.18Å; S399-E402 WeakPolarHBondContact OG-CB 3.37Å; S399-E402 WeakPolarHBondContact OG-CG 3.43Å; S399-E402 PolarHBondContact OG-N 2.98Å; S399-E402 PolarHBondContact OG-OE2 3.45Å; E402-A406 PolarHBondContact O-N 3.44Å
403	Y	93	Very high	87.1	Confident	1 Å²	1	75.1 Å²	75.1	0%	0.004	42%	0.417	C	S	.	.	H	α-helix	trans	-64	-52.6	178	171.9	-99.7	0	0	0	112.6	F99 D119 H121 N123 L128 S399 W400 E401 T405 A406 A411 P412 L414	F99-Y403 HydrophobicContact CD2-CD1 4.23Å; F99-Y403 HydrophobicContact CD2-CG 4.34Å; F99-Y403 HydrophobicContact CE2-CD1 4.08Å; F99-Y403 HydrophobicContact CE2-CD2 4.22Å; F99-Y403 AromaticContact CE2-CG 3.74Å; F99-Y403 HydrophobicContact CE2-CG 3.74Å; D119-Y403 VanDerWaalsContact OD2-CE1 3.24Å; D119-Y403 WeakPolarHBondContact OD2-CE1 3.33Å; D119-Y403 PolarHBondContact OD2-OH 3.25Å; H121-Y403 AromaticContact CD2-CE1 3.91Å; H121-Y403 AromaticContact CD2-CE2 3.6Å; H121-Y403 AromaticContact CD2-CZ 3.43Å; H121-Y403 VanDerWaalsContact CD2-CZ 3.43Å; H121-Y403 PolarHBondContact NE2-O 3.45Å; N123-Y403 PolarHBondContact ND2-OH 3.28Å; L128-Y403 HydrophobicContact CD1-CE1 4.36Å; L128-Y403 HydrophobicContact CD2-CE1 4.1Å; L128-Y403 HydrophobicContact CD2-CE2 4.31Å; S399-Y403 PolarHBondContact O-N 3.1Å; W400-Y403 AromaticContact CE3-CD1 3.91Å; W400-Y403 HydrophobicContact CE3-CD1 3.91Å; W400-Y403 HydrophobicContact CH2-CD1 4.46Å; W400-Y403 AromaticContact CZ3-CD1 3.68Å; W400-Y403 HydrophobicContact CZ3-CD1 3.68Å; W400-Y403 AromaticContact CZ3-CE1 3.9Å; W400-Y403 HydrophobicContact CZ3-CE1 3.9Å; W400-Y403 PolarHBondContact O-N 3.28Å; E401-Y403 VanDerWaalsContact C-N 3.34Å; E401-Y403 PolarHBondContact O-N 2.95Å; Y403-T405 VanDerWaalsContact C-N 3.32Å; Y403-T405 PolarHBondContact O-N 3.04Å; Y403-A406 WeakPolarHBondContact O-CB 2.91Å; Y403-A406 PolarHBondContact O-N 2.94Å; Y403-A411 HydrophobicContact CE2-CB 4.29Å; Y403-P412 HydrophobicContact CD2-CG 3.95Å; Y403-L414 HydrophobicContact CD2-CD1 3.89Å; Y403-L414 HydrophobicContact CD2-CD2 3.92Å; Y403-L414 HydrophobicContact CD2-CG 4.25Å; Y403-L414 HydrophobicContact CE2-CD1 3.71Å; Y403-L414 HydrophobicContact CE2-CG 4.36Å
404	I	91.6	Very high	87	Confident	35 Å²	35	74 Å²	74	18%	0.179	41%	0.409	C	S	.	.	H	α-helix	trans	-76	-22.5	-171.9	-159.4	64.5	0	0	0	113	F92 D119 V120 W400	F92-I404 HydrophobicContact CD2-CD1 3.64Å; F92-I404 HydrophobicContact CD2-CG1 4.18Å; F92-I404 HydrophobicContact CE2-CD1 3.92Å; D119-I404 HydrophobicContact CB-CD1 4.26Å; V120-I404 HydrophobicContact CG1-CD1 4.06Å; V120-I404 HydrophobicContact CG2-CD1 3.82Å; W400-I404 HydrophobicContact CH2-CB 4.39Å; W400-I404 HydrophobicContact CH2-CD1 3.78Å; W400-I404 HydrophobicContact CH2-CG1 4.25Å; W400-I404 HydrophobicContact CZ2-CB 4.02Å; W400-I404 HydrophobicContact CZ2-CD1 3.89Å; W400-I404 HydrophobicContact CZ2-CG1 3.87Å; W400-I404 WeakPolarHBondContact O-CG2 3.29Å; W400-I404 PolarHBondContact O-N 2.84Å
405	T	90.5	Very high	86.9	Confident	100 Å²	100	67.4 Å²	67.4	61%	0.613	38%	0.38	S	S	*	.	H	α-helix	trans	-88.4	-11.6	177.4	61.3	0	0	0	0	113.6	E401 Y403	E401-T405 VanDerWaalsContact O-CB 3.29Å; E401-T405 WeakPolarHBondContact O-CB 3.49Å; E401-T405 WeakPolarHBondContact O-CG2 3.32Å; E401-T405 PolarHBondContact O-N 3.43Å; E401-T405 VanDerWaalsContact O-N 3.1Å; E401-T405 PolarHBondContact O-OG1 3.38Å; Y403-T405 VanDerWaalsContact C-N 3.32Å; Y403-T405 PolarHBondContact O-N 3.04Å
406	A	90.1	Very high	87.1	Confident	26 Å²	26	65.6 Å²	65.6	22%	0.215	36%	0.358	C	S	.	.	S	Bend	trans	-60.2	147.6	177.5	0	0	0	0	0	112.5	H121 E402 Y403	H121-A406 PolarHBondContact CE1-O 3.15Å; E402-A406 PolarHBondContact O-N 3.44Å; Y403-A406 WeakPolarHBondContact O-CB 2.91Å; Y403-A406 PolarHBondContact O-N 2.94Å
407	D	86.7	Confident	87.1	Confident	104 Å²	104	71.4 Å²	71.4	56%	0.556	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-60.8	144.1	178.5	-71.9	-34.6	0	0	0	111.3	G409 R410	D407-G409 PolarHBondContact O-N 2.7Å; D407-R410 HydrophobicContact CB-CB 4.29Å; D407-R410 CarbonylContact O-C 3.6Å; D407-R410 WeakPolarHBondContact O-CA 3.4Å; D407-R410 PolarHBondContact O-N 2.84Å
408	N	77.6	Confident	87	Confident	123 Å²	123	68.7 Å²	68.7	66%	0.658	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	127.7	178.3	-169.3	7.6	0	0	0	110.5	V120 R410	V120-N408 PolarHBondContact O-OD1 2.67Å; N408-R410 VanDerWaalsContact C-N 3.3Å
409	G	72.6	Confident	86.8	Confident	55 Å²	55	70.9 Å²	70.9	57%	0.567	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	0.4	-174.3	0	0	0	0	0	115	D407	D407-G409 PolarHBondContact O-N 2.7Å
410	R	80.4	Confident	86.5	Confident	193 Å²	193	71.4 Å²	71.4	73%	0.728	38%	0.382	S	S	*	.			trans	-125.2	37.9	172.9	-62.1	-175.7	176.1	-180	-2.6	111.4	D407 N408	D407-R410 HydrophobicContact CB-CB 4.29Å; D407-R410 CarbonylContact O-C 3.6Å; D407-R410 WeakPolarHBondContact O-CA 3.4Å; D407-R410 PolarHBondContact O-N 2.84Å; N408-R410 VanDerWaalsContact C-N 3.3Å
411	A	81.4	Confident	86.3	Confident	30 Å²	30	77.2 Å²	77.2	25%	0.248	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-55.6	136.8	174.6	0	0	0	0	0	110	H121 Y403	H121-A411 HydrophobicContact CB-CB 4.24Å; Y403-A411 HydrophobicContact CE2-CB 4.29Å
412	P	85.1	Confident	86.2	Confident	30 Å²	30	77.3 Å²	77.3	20%	0.195	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-62.9	148.1	172.6	26.9	-32	0	0	0	109.3	I398 Y403	I398-P412 HydrophobicContact CD1-CB 4.01Å; I398-P412 HydrophobicContact CG1-CB 4.07Å; I398-P412 HydrophobicContact CG2-CB 3.96Å; I398-P412 HydrophobicContact CG2-CG 3.66Å; Y403-P412 HydrophobicContact CD2-CG 3.95Å
413	H	82.7	Confident	85.8	Confident	81 Å²	81	75 Å²	75	38%	0.375	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-79.2	126.4	-174.8	177.5	-99.3	0	0	0	110.7	G415 R416 E417	H413-G415 PolarHBondContact CE1-O 2.88Å; H413-R416 PolarHBondContact CE1-O 3.04Å; H413-R416 PolarHBondContact NE2-O 2.81Å; H413-E417 PolarHBondContact CE1-N 3.01Å
414	L	87.1	Confident	85.5	Confident	5 Å²	5	81 Å²	81	3%	0.026	43%	0.43	C	S	.	.			trans	-104.2	-5.9	-168.3	-55	-178.4	0	0	0	115.6	F99 L128 M131 M132 N396 I398 Y403	F99-L414 HydrophobicContact CD2-CD1 4.43Å; F99-L414 HydrophobicContact CE2-CD1 3.93Å; F99-L414 HydrophobicContact CE2-CD2 3.74Å; F99-L414 HydrophobicContact CZ-CD2 4.09Å; L128-L414 HydrophobicContact CD2-CD1 3.66Å; M131-L414 HydrophobicContact CB-CB 4.31Å; M131-L414 HydrophobicContact CE-CB 4.17Å; M131-L414 HydrophobicContact CE-CD1 4.11Å; M131-L414 HydrophobicContact CE-CG 4.29Å; M132-L414 HydrophobicContact SD-CB 3.86Å; M132-L414 HydrophobicContact SD-CD1 4.29Å; M132-L414 HydrophobicContact SD-CD2 4.38Å; M132-L414 HydrophobicContact SD-CG 4.4Å; N396-L414 VanDerWaalsContact ND2-CA 3.35Å; N396-L414 WeakPolarHBondContact ND2-CA 3.32Å; N396-L414 WeakPolarHBondContact ND2-CD2 3.4Å; I398-L414 HydrophobicContact CB-CD2 4.41Å; I398-L414 HydrophobicContact CG2-CD2 4.32Å; Y403-L414 HydrophobicContact CD2-CD1 3.89Å; Y403-L414 HydrophobicContact CD2-CD2 3.92Å; Y403-L414 HydrophobicContact CD2-CG 4.25Å; Y403-L414 HydrophobicContact CE2-CD1 3.71Å; Y403-L414 HydrophobicContact CE2-CG 4.36Å
415	G	84.1	Confident	85	Confident	23 Å²	23	82.5 Å²	82.5	24%	0.237	44%	0.436	C	S	.	.	S	Bend	trans	-137	-131.3	-170.8	0	0	0	0	0	114	H413	H413-G415 PolarHBondContact CE1-O 2.88Å
416	R	88.3	Confident	84.7	Confident	81 Å²	81	83.9 Å²	83.9	31%	0.306	44%	0.439	S	S	.	.	S	Bend	trans	-84.5	134	177	-179.5	177.5	-82.3	-88.3	0.1	111.3	E354 T391 P393 H413 L418	E354-R416 HydrophobicContact CB-CG 4.5Å; E354-R416 WeakPolarHBondContact O-CD 3.28Å; T391-R416 PolarHBondContact O-NH2 2.88Å; P393-R416 HydrophobicContact CB-CB 4.23Å; H413-R416 PolarHBondContact CE1-O 3.04Å; H413-R416 PolarHBondContact NE2-O 2.81Å; R416-L418 WeakPolarHBondContact O-CD2 3.35Å; R416-L418 PolarHBondContact O-N 2.68Å
417	E	86.7	Confident	84.1	Confident	166 Å²	166	83.5 Å²	83.5	78%	0.776	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-50.1	128.2	-173.9	-174.2	173.9	-174.1	0	0	112.2	E354 H413 V419	E354-E417 WeakPolarHBondContact CB-O 3.28Å; H413-E417 PolarHBondContact CE1-N 3.01Å; E417-V419 PolarHBondContact O-N 2.89Å
418	L	86.4	Confident	83.6	Confident	76 Å²	76	88.1 Å²	88.1	40%	0.398	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-80.1	122.5	-169.8	-57.7	-175	0	0	0	112	R352 E354 R416 C420	R352-L418 VanDerWaalsContact CZ-CD2 3.47Å; E354-L418 HydrophobicContact CG-CD2 4.5Å; R416-L418 WeakPolarHBondContact O-CD2 3.35Å; R416-L418 PolarHBondContact O-N 2.68Å; L418-C420 PolarHBondContact O-N 3.35Å
419	V	88.6	Confident	83.9	Confident	91 Å²	91	82.5 Å²	82.5	55%	0.552	42%	0.418	S	S	*	.			trans	-98.7	78.9	168.4	-175.7	0	0	0	0	107.6	R352 R353 E354 E417	R352-V419 WeakPolarHBondContact CA-O 3.49Å; R353-V419 PolarHBondContact N-O 2.97Å; E354-V419 HydrophobicContact CB-CB 4.24Å; E354-V419 HydrophobicContact CB-CG2 4.06Å; E354-V419 PolarHBondContact OE2-N 3.15Å; E417-V419 PolarHBondContact O-N 2.89Å
420	C	86.8	Confident	84.7	Confident	52 Å²	52	82.2 Å²	82.2	35%	0.351	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129	-176	-167.2	0	0	0	0	112.5	K351 R352 L418	K351-C420 CarbonylContact O-C 3.56Å; K351-C420 VanDerWaalsContact O-CA 3.3Å; K351-C420 WeakPolarHBondContact O-CA 3.47Å; R352-C420 HydrophobicContact CG-CB 4.03Å; L418-C420 PolarHBondContact O-N 3.35Å
421	K	88.8	Confident	85.3	Confident	144 Å²	144	73 Å²	73	63%	0.626	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	120.8	167	-174.2	169.9	-178.4	168.3	0	109.3	K351	K351-K421 PolarHBondContact N-O 3.31Å; K351-K421 PolarHBondContact O-N 2.94Å
422	E	88.4	Confident	85.9	Confident	101 Å²	101	71.6 Å²	71.6	47%	0.472	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	142.7	172.5	-57.2	-166.6	171.8	0	0	110.3	S349 R350	S349-E422 WeakPolarHBondContact O-CA 3.11Å; R350-E422 HydrophobicContact CG-CG 4.21Å; R350-E422 IonicContact CZ-OE1 2.58Å; R350-E422 VanDerWaalsContact CZ-OE1 3.27Å; R350-E422 IonicContact NH1-OE1 3.97Å; R350-E422 PolarHBondContact NH1-OE1 3.44Å; R350-E422 IonicContact NH2-OE1 3.93Å; R350-E422 IonicContact NH2-OE2 3.02Å
423	S	85.3	Confident	86.4	Confident	58 Å²	58	70.3 Å²	70.3	41%	0.406	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	134	172.3	-179.9	0	0	0	0	109.9	S349	S349-S423 PolarHBondContact N-O 3.5Å; S349-S423 PolarHBondContact O-N 3.08Å; S349-S423 PolarHBondContact OG-O 3.33Å
424	K	86.6	Confident	87	Confident	127 Å²	127	66.5 Å²	66.5	55%	0.552	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	122	174.3	-59.2	-165.8	-176.7	-154.6	0	108.5	V346 L347 E348	V346-K424 HydrophobicContact CG1-CB 4.14Å; L347-K424 WeakPolarHBondContact O-CA 3.29Å; E348-K424 HydrophobicContact CG-CD 4.3Å; E348-K424 HydrophobicContact CG-CG 4.25Å; E348-K424 WeakPolarHBondContact OE1-CE 3.3Å; E348-K424 IonicContact OE1-NZ 3.42Å; E348-K424 PolarHBondContact OE1-NZ 3Å
425	K	81.9	Confident	87.3	Confident	67 Å²	67	72 Å²	72	29%	0.291	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	125.8	178.3	-169	169.6	-178.7	175.7	0	110.3	V346 L347 F427 P482	V346-K425 WeakPolarHBondContact CA-O 3.24Å; L347-K425 PolarHBondContact N-O 3.01Å; L347-K425 PolarHBondContact O-N 3.25Å; K425-F427 HydrophobicContact CB-CD2 4.46Å; K425-F427 HydrophobicContact CB-CE2 3.97Å; K425-F427 HydrophobicContact CD-CE2 4.13Å; K425-F427 HydrophobicContact CD-CZ 4.14Å; K425-F427 HydrophobicContact CG-CD2 4.45Å; K425-F427 HydrophobicContact CG-CE2 4.01Å; K425-F427 HydrophobicContact CG-CZ 4.48Å; K425-F427 WeakPolarHBondContact O-CD2 3.45Å; K425-P482 WeakPolarHBondContact CD-O 3.4Å; K425-P482 WeakPolarHBondContact CE-O 3.48Å; K425-P482 PolarHBondContact NZ-O 3.35Å
426	N	82.8	Confident	87.7	Confident	128 Å²	128	76.5 Å²	76.5	68%	0.684	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	130.2	170.3	-67.4	-53.7	0	0	0	108.9	V346	V346-N426 WeakPolarHBondContact CG2-OD1 3.27Å
427	F	77.5	Confident	87.8	Confident	19 Å²	19	73.3 Å²	73.3	8%	0.083	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	128	174.6	-83.3	-88.9	0	0	0	109.6	L345 L347 K425 P479	L345-F427 HydrophobicContact CD2-CB 4.06Å; L345-F427 HydrophobicContact CG-CB 4.36Å; L345-F427 PolarHBondContact O-N 3.02Å; L347-F427 HydrophobicContact CB-CD2 3.66Å; L347-F427 HydrophobicContact CB-CE2 3.4Å; L347-F427 VanDerWaalsContact CB-CE2 3.4Å; L347-F427 HydrophobicContact CD2-CE2 3.65Å; L347-F427 HydrophobicContact CD2-CZ 4.06Å; L347-F427 HydrophobicContact CG-CE2 4.17Å; K425-F427 HydrophobicContact CB-CD2 4.46Å; K425-F427 HydrophobicContact CB-CE2 3.97Å; K425-F427 HydrophobicContact CD-CE2 4.13Å; K425-F427 HydrophobicContact CD-CZ 4.14Å; K425-F427 HydrophobicContact CG-CD2 4.45Å; K425-F427 HydrophobicContact CG-CE2 4.01Å; K425-F427 HydrophobicContact CG-CZ 4.48Å; K425-F427 WeakPolarHBondContact O-CD2 3.45Å; F427-P479 HydrophobicContact CD1-CB 3.61Å; F427-P479 HydrophobicContact CD1-CG 4.47Å; F427-P479 HydrophobicContact CD2-CB 4.05Å; F427-P479 HydrophobicContact CE1-CB 3.61Å; F427-P479 HydrophobicContact CE2-CB 4.08Å; F427-P479 HydrophobicContact CG-CB 3.81Å; F427-P479 HydrophobicContact CG-CG 4.28Å; F427-P479 HydrophobicContact CZ-CB 3.84Å
428	K	77.1	Confident	88	Confident	200 Å²	200	68.4 Å²	68.4	87%	0.87	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	117.2	164.6	-66.4	-176.2	180	-179.6	0	106.4
429	A	83.7	Confident	88.2	Confident	5 Å²	5	65.2 Å²	65.2	4%	0.041	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	148.8	176.6	0	0	0	0	0	109.2	V342 L345 D477	V342-A429 HydrophobicContact CB-CB 4.08Å; V342-A429 HydrophobicContact CG2-CB 4.14Å; V342-A429 PolarHBondContact N-O 2.77Å; L345-A429 HydrophobicContact CD2-CB 3.97Å; A429-D477 HydrophobicContact CB-CB 3.98Å; A429-D477 WeakPolarHBondContact CB-O 3.27Å
430	T	88.2	Confident	88.2	Confident	49 Å²	49	62.7 Å²	62.7	30%	0.301	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	145.6	171.5	-45.4	0	0	0	0	109	F339 Y340 D477	F339-T430 HydrophobicContact CD1-CG2 3.84Å; Y340-T430 WeakPolarHBondContact O-CA 3.31Å; Y340-T430 WeakPolarHBondContact O-CG2 3.4Å; T430-D477 VanDerWaalsContact CB-OD2 3.31Å; T430-D477 WeakPolarHBondContact CB-OD2 3.38Å; T430-D477 PolarHBondContact N-OD2 3.49Å; T430-D477 PolarHBondContact O-N 3.27Å; T430-D477 VanDerWaalsContact O-N 3.08Å; T430-D477 PolarHBondContact OG1-OD2 2.9Å
431	I	92.9	Very high	88.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.6	172	-173.4	169.9	0	0	0	109.4	F315 F339 Y340 V342 M433 L468 P473 K475 L476	F315-I431 HydrophobicContact CD1-CG2 4.07Å; F315-I431 HydrophobicContact CE1-CG2 4.16Å; F339-I431 CarbonylContact C-O 3.57Å; F339-I431 WeakPolarHBondContact CA-O 3.37Å; Y340-I431 PolarHBondContact N-O 2.88Å; Y340-I431 PolarHBondContact O-N 2.57Å; V342-I431 HydrophobicContact CG2-CB 4.39Å; V342-I431 HydrophobicContact CG2-CG2 3.97Å; I431-M433 HydrophobicContact CD1-SD 3.34Å; I431-M433 WeakPolarHBondContact CD1-SD 3.22Å; I431-M433 HydrophobicContact CG1-CG 4.3Å; I431-M433 HydrophobicContact CG1-SD 3.48Å; I431-M433 WeakPolarHBondContact CG1-SD 3.37Å; I431-L468 HydrophobicContact CD1-CD1 4.08Å; I431-L468 HydrophobicContact CD1-CD2 3.68Å; I431-L468 HydrophobicContact CD1-CG 4.31Å; I431-P473 HydrophobicContact CD1-CB 4.08Å; I431-P473 HydrophobicContact CG1-CB 4.33Å; I431-K475 CarbonylContact C-O 3.5Å; I431-K475 WeakPolarHBondContact CA-O 3.18Å; I431-L476 HydrophobicContact CB-CD2 4.45Å; I431-L476 HydrophobicContact CD1-CD2 3.4Å; I431-L476 HydrophobicContact CG1-CD2 3.61Å
432	A	94.9	Very high	88.3	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.9	172.5	0	0	0	0	0	109.2	V332 A337 D338 F339 P473 V474 K475	V332-A432 HydrophobicContact CG2-CB 4.08Å; A337-A432 HydrophobicContact CB-CB 3.88Å; D338-A432 WeakPolarHBondContact O-CA 3.34Å; F339-A432 HydrophobicContact CD1-CB 4.05Å; F339-A432 HydrophobicContact CD2-CB 4.18Å; F339-A432 HydrophobicContact CE1-CB 3.84Å; F339-A432 HydrophobicContact CE2-CB 3.94Å; F339-A432 HydrophobicContact CG-CB 4.22Å; F339-A432 HydrophobicContact CZ-CB 3.79Å; A432-P473 CarbonylContact O-C 3.55Å; A432-P473 WeakPolarHBondContact O-CA 3.32Å; A432-V474 HydrophobicContact CB-CG2 4.15Å; A432-V474 WeakPolarHBondContact O-CG2 3.19Å; A432-V474 PolarHBondContact O-N 3.49Å; A432-K475 HydrophobicContact CB-CB 3.77Å; A432-K475 PolarHBondContact N-O 3.08Å; A432-K475 PolarHBondContact O-N 3.24Å
433	M	95.4	Very high	88.4	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.2	-175.6	-55.8	-61.7	-57.5	0	0	109.9	A337 D338 Y340 I431 L468 P469 G471 F472 P473	A337-M433 CarbonylContact C-O 3.49Å; A337-M433 WeakPolarHBondContact CA-O 2.97Å; D338-M433 WeakPolarHBondContact CB-O 3.41Å; D338-M433 PolarHBondContact N-O 3.35Å; D338-M433 PolarHBondContact O-N 3.19Å; Y340-M433 HydrophobicContact CD2-CB 4.49Å; Y340-M433 HydrophobicContact CD2-CG 3.9Å; Y340-M433 HydrophobicContact CE2-CB 4.09Å; Y340-M433 HydrophobicContact CE2-CG 3.88Å; I431-M433 HydrophobicContact CD1-SD 3.34Å; I431-M433 WeakPolarHBondContact CD1-SD 3.22Å; I431-M433 HydrophobicContact CG1-CG 4.3Å; I431-M433 HydrophobicContact CG1-SD 3.48Å; I431-M433 WeakPolarHBondContact CG1-SD 3.37Å; M433-L468 HydrophobicContact CE-CB 4.14Å; M433-P469 VanDerWaalsContact CE-O 3.23Å; M433-P469 WeakPolarHBondContact CE-O 3.28Å; M433-P469 HydrophobicContact CG-CB 4.09Å; M433-P469 HydrophobicContact CG-CG 4.18Å; M433-G471 VanDerWaalsContact CE-C 3.46Å; M433-G471 WeakPolarHBondContact CE-O 3.48Å; M433-F472 CarbonylContact C-O 3.56Å; M433-F472 WeakPolarHBondContact CA-O 3.37Å; M433-P473 HydrophobicContact CE-CB 4.28Å; M433-P473 HydrophobicContact SD-CB 3.9Å
434	S	95.4	Very high	88.6	Confident	2 Å²	2	56 Å²	56	1%	0.014	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.5	174.5	-170.9	0	0	0	0	110.6	L336 D436 G471 F472	L336-S434 VanDerWaalsContact O-CB 3.3Å; L336-S434 WeakPolarHBondContact O-CB 3.09Å; L336-S434 PolarHBondContact O-OG 3.23Å; S434-D436 VanDerWaalsContact C-N 3.31Å; S434-D436 PolarHBondContact OG-N 3.36Å; S434-G471 CarbonylContact O-C 3.57Å; S434-G471 WeakPolarHBondContact O-CA 3.42Å; S434-F472 PolarHBondContact N-O 3.11Å; S434-F472 PolarHBondContact O-N 2.94Å
435	Q	93.4	Very high	88.7	Confident	121 Å²	121	50.7 Å²	50.7	57%	0.565	27%	0.265	S	S	*	.	S	Bend	trans	-79.3	-19.6	172.8	-59.7	-56.9	-30.2	0	0	112.3	P470	Q435-P470 PolarHBondContact NE2-O 3.34Å
436	D	91.8	Very high	89.1	Confident	117 Å²	117	49.6 Å²	49.6	63%	0.626	26%	0.263	S	S	*	.			trans	-95.4	0.9	-169.4	-54.9	-38.1	0	0	0	112.6	S434 P438	S434-D436 VanDerWaalsContact C-N 3.31Å; S434-D436 PolarHBondContact OG-N 3.36Å; D436-P438 WeakPolarHBondContact O-CD 3.48Å
437	F	91.8	Very high	89.4	Confident	14 Å²	14	43.5 Å²	43.5	6%	0.061	23%	0.23	C	C	.	.			trans	-69.3	126.6	178.4	-159.5	-93.3	0	0	0	109.8	L205 F335 L439 F472 V474 F490 F493	L205-F437 HydrophobicContact CD1-CZ 4.05Å; F335-F437 AromaticContact CD1-CD2 3.9Å; F335-F437 HydrophobicContact CD1-CD2 3.9Å; F335-F437 AromaticContact CD2-CD2 3.76Å; F335-F437 HydrophobicContact CD2-CD2 3.76Å; F335-F437 AromaticContact CD2-CE2 3.92Å; F335-F437 HydrophobicContact CD2-CE2 3.92Å; F335-F437 AromaticContact CE1-CD2 3.74Å; F335-F437 HydrophobicContact CE1-CD2 3.74Å; F335-F437 HydrophobicContact CE1-CE2 4.24Å; F335-F437 HydrophobicContact CE1-CG 4.49Å; F335-F437 AromaticContact CE2-CD2 3.59Å; F335-F437 HydrophobicContact CE2-CD2 3.59Å; F335-F437 AromaticContact CE2-CE2 3.41Å; F335-F437 HydrophobicContact CE2-CE2 3.41Å; F335-F437 VanDerWaalsContact CE2-CE2 3.41Å; F335-F437 AromaticContact CG-CD2 3.92Å; F335-F437 HydrophobicContact CG-CD2 3.92Å; F335-F437 AromaticContact CZ-CD2 3.58Å; F335-F437 HydrophobicContact CZ-CD2 3.58Å; F335-F437 AromaticContact CZ-CE2 3.6Å; F335-F437 HydrophobicContact CZ-CE2 3.6Å; F437-L439 VanDerWaalsContact C-N 3.3Å; F437-L439 HydrophobicContact CD1-CB 3.75Å; F437-L439 HydrophobicContact CE1-CB 3.54Å; F437-L439 PolarHBondContact O-N 2.75Å; F437-F472 HydrophobicContact CB-CB 3.48Å; F437-F472 VanDerWaalsContact CB-CB 3.48Å; F437-F472 HydrophobicContact CB-CD1 3.83Å; F437-F472 HydrophobicContact CB-CG 3.75Å; F437-F472 HydrophobicContact CD1-CB 4.18Å; F437-F472 AromaticContact CD1-CD1 3.35Å; F437-F472 HydrophobicContact CD1-CD1 3.35Å; F437-F472 AromaticContact CD1-CD2 3.76Å; F437-F472 HydrophobicContact CD1-CD2 3.76Å; F437-F472 AromaticContact CD1-CE1 3.5Å; F437-F472 HydrophobicContact CD1-CE1 3.5Å; F437-F472 VanDerWaalsContact CD1-CE1 3.5Å; F437-F472 AromaticContact CD1-CE2 3.87Å; F437-F472 HydrophobicContact CD1-CE2 3.87Å; F437-F472 AromaticContact CD1-CG 3.48Å; F437-F472 HydrophobicContact CD1-CG 3.48Å; F437-F472 VanDerWaalsContact CD1-CG 3.48Å; F437-F472 AromaticContact CD1-CZ 3.74Å; F437-F472 HydrophobicContact CD1-CZ 3.74Å; F437-F472 AromaticContact CD2-CD1 3.87Å; F437-F472 HydrophobicContact CD2-CD1 3.87Å; F437-F472 HydrophobicContact CD2-CE1 4.16Å; F437-F472 AromaticContact CE1-CD1 3.81Å; F437-F472 HydrophobicContact CE1-CD1 3.81Å; F437-F472 HydrophobicContact CE1-CD2 4.33Å; F437-F472 AromaticContact CE1-CE1 3.41Å; F437-F472 HydrophobicContact CE1-CE1 3.41Å; F437-F472 VanDerWaalsContact CE1-CE1 3.41Å; F437-F472 AromaticContact CE1-CE2 3.97Å; F437-F472 HydrophobicContact CE1-CE2 3.97Å; F437-F472 HydrophobicContact CE1-CG 4.24Å; F437-F472 AromaticContact CE1-CZ 3.48Å; F437-F472 HydrophobicContact CE1-CZ 3.48Å; F437-F472 VanDerWaalsContact CE1-CZ 3.48Å; F437-F472 HydrophobicContact CE2-CD1 4.26Å; F437-F472 HydrophobicContact CE2-CE1 4.07Å; F437-F472 HydrophobicContact CG-CB 4.02Å; F437-F472 AromaticContact CG-CD1 3.39Å; F437-F472 HydrophobicContact CG-CD1 3.39Å; F437-F472 HydrophobicContact CG-CD2 4.42Å; F437-F472 AromaticContact CG-CE1 3.88Å; F437-F472 HydrophobicContact CG-CE1 3.88Å; F437-F472 AromaticContact CG-CG 3.69Å; F437-F472 HydrophobicContact CG-CG 3.69Å; F437-F472 HydrophobicContact CZ-CD1 4.23Å; F437-F472 AromaticContact CZ-CE1 3.71Å; F437-F472 HydrophobicContact CZ-CE1 3.71Å; F437-F472 HydrophobicContact CZ-CZ 4.1Å; F437-V474 HydrophobicContact CB-CG1 4.37Å; F437-V474 HydrophobicContact CD2-CG1 3.58Å; F437-V474 HydrophobicContact CE2-CG1 4.2Å; F437-V474 HydrophobicContact CG-CG1 4.24Å; F437-F490 HydrophobicContact CE2-CB 4.03Å; F437-F490 HydrophobicContact CZ-CB 4.26Å; F437-F490 HydrophobicContact CZ-CD1 4.27Å; F437-F493 HydrophobicContact CE1-CB 4.26Å; F437-F493 HydrophobicContact CE1-CD2 4.15Å; F437-F493 HydrophobicContact CE1-CG 4.23Å; F437-F493 HydrophobicContact CE2-CB 3.99Å; F437-F493 HydrophobicContact CZ-CB 3.62Å; F437-F493 HydrophobicContact CZ-CD2 4.18Å; F437-F493 HydrophobicContact CZ-CG 4.07Å
438	P	90.2	Very high	89.8	Confident	63 Å²	63	42.6 Å²	42.6	41%	0.409	23%	0.226	S	C	.	.	S	Bend	trans	-72.5	-20.8	-169.9	-21.4	34.3	0	0	0	114.7	D436 F493 Y495	D436-P438 WeakPolarHBondContact O-CD 3.48Å; P438-F493 HydrophobicContact CB-CD1 3.83Å; P438-F493 HydrophobicContact CB-CE1 3.55Å; P438-F493 HydrophobicContact CB-CZ 4.42Å; P438-F493 HydrophobicContact CG-CD1 3.62Å; P438-F493 HydrophobicContact CG-CE1 3.88Å; P438-Y495 HydrophobicContact CB-CE2 4.08Å
439	L	89.9	Confident	90.1	Very high	9 Å²	9	35.5 Å²	35.5	5%	0.047	20%	0.196	C	C	.	.	S	Bend	trans	-91.2	136.6	-179.4	-162	67.1	0	0	0	111.3	F437 S443 L444 F472 F493	F437-L439 VanDerWaalsContact C-N 3.3Å; F437-L439 HydrophobicContact CD1-CB 3.75Å; F437-L439 HydrophobicContact CE1-CB 3.54Å; F437-L439 PolarHBondContact O-N 2.75Å; L439-S443 VanDerWaalsContact CD1-CB 3.49Å; L439-L444 HydrophobicContact CD2-CB 4.11Å; L439-F472 HydrophobicContact CB-CE2 4.35Å; L439-F472 WeakPolarHBondContact O-CD2 3.24Å; L439-F472 WeakPolarHBondContact O-CE2 3.24Å; L439-F493 HydrophobicContact CB-CD2 4.39Å; L439-F493 HydrophobicContact CB-CE2 3.96Å; L439-F493 HydrophobicContact CB-CZ 4.31Å; L439-F493 HydrophobicContact CD1-CE2 4.1Å; L439-F493 HydrophobicContact CD1-CZ 4.35Å; L439-F493 HydrophobicContact CD2-CE2 4.24Å; L439-F493 HydrophobicContact CG-CE2 4.32Å
440	G	90.1	Very high	89.9	Confident	37 Å²	37	35.3 Å²	35.3	38%	0.381	19%	0.194	S	C	.	.			trans	-78.2	158.6	170	0	0	0	0	0	113.1	E442 S443 L444	G440-E442 VanDerWaalsContact C-N 3.35Å; G440-E442 PolarHBondContact O-N 3.05Å; G440-S443 WeakPolarHBondContact O-CB 3.37Å; G440-S443 PolarHBondContact O-N 2.96Å; G440-L444 PolarHBondContact O-N 3.18Å
441	I	89.7	Confident	89.3	Confident	44 Å²	44	33.4 Å²	33.4	23%	0.226	18%	0.182	C	C	.	.	H	α-helix	trans	-61.6	-42.4	176.5	-65.2	173	0	0	0	111.2	S443 L444 L445 V464 L468 F472	I441-S443 VanDerWaalsContact C-N 3.28Å; I441-S443 PolarHBondContact O-N 3.37Å; I441-L444 WeakPolarHBondContact O-CB 3.21Å; I441-L444 PolarHBondContact O-N 2.9Å; I441-L445 HydrophobicContact CG2-CD1 4.22Å; I441-L445 HydrophobicContact CG2-CG 4.39Å; I441-L445 WeakPolarHBondContact O-CG 3.4Å; I441-L445 PolarHBondContact O-N 2.66Å; I441-V464 HydrophobicContact CG2-CB 4.5Å; I441-L468 HydrophobicContact CD1-CD1 4.33Å; I441-F472 HydrophobicContact CG1-CD2 4.22Å
442	E	88.2	Confident	87.8	Confident	140 Å²	140	33.9 Å²	33.9	65%	0.654	19%	0.186	S	C	*	.	H	α-helix	trans	-60.2	-39.5	177.1	-65.7	-61.5	143.2	0	0	111.9	G440 L445 N446	G440-E442 VanDerWaalsContact C-N 3.35Å; G440-E442 PolarHBondContact O-N 3.05Å; E442-L445 WeakPolarHBondContact O-CB 3.39Å; E442-L445 PolarHBondContact O-N 3.23Å; E442-N446 PolarHBondContact O-N 3.08Å; E442-N446 VanDerWaalsContact O-N 3.14Å; E442-N446 PolarHBondContact O-ND2 3.09Å
443	S	89.9	Confident	86	Confident	31 Å²	31	37.6 Å²	37.6	22%	0.217	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-46	175.3	-58.3	0	0	0	0	111.7	L200 L439 G440 I441 L445 N446 V447	L200-S443 WeakPolarHBondContact CD2-OG 3.33Å; L439-S443 VanDerWaalsContact CD1-CB 3.49Å; G440-S443 WeakPolarHBondContact O-CB 3.37Å; G440-S443 PolarHBondContact O-N 2.96Å; I441-S443 VanDerWaalsContact C-N 3.28Å; I441-S443 PolarHBondContact O-N 3.37Å; S443-L445 VanDerWaalsContact C-N 3.31Å; S443-L445 PolarHBondContact O-N 3.33Å; S443-N446 PolarHBondContact O-N 3.08Å; S443-V447 WeakPolarHBondContact O-CG2 3.06Å; S443-V447 PolarHBondContact O-N 3.25Å
444	L	89.9	Confident	84.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.4	-42.5	173.7	176.7	66.6	0	0	0	111.2	L205 L439 G440 I441 N446 V447 L448 V464 F472 F490	L205-L444 HydrophobicContact CD2-CD1 4.29Å; L439-L444 HydrophobicContact CD2-CB 4.11Å; G440-L444 PolarHBondContact O-N 3.18Å; I441-L444 WeakPolarHBondContact O-CB 3.21Å; I441-L444 PolarHBondContact O-N 2.9Å; L444-N446 VanDerWaalsContact C-N 3.29Å; L444-N446 PolarHBondContact O-N 3.32Å; L444-V447 PolarHBondContact O-N 3.07Å; L444-V447 VanDerWaalsContact O-N 3.17Å; L444-L448 HydrophobicContact CD1-CD1 4.21Å; L444-L448 HydrophobicContact CD1-CD2 4.41Å; L444-L448 HydrophobicContact CD1-CG 3.99Å; L444-L448 HydrophobicContact CD2-CD1 4.19Å; L444-L448 HydrophobicContact CG-CD1 3.82Å; L444-L448 HydrophobicContact CG-CG 4.02Å; L444-L448 WeakPolarHBondContact O-CB 3.29Å; L444-L448 VanDerWaalsContact O-CG 3.28Å; L444-L448 WeakPolarHBondContact O-CG 3.16Å; L444-L448 PolarHBondContact O-N 3.36Å; L444-V464 HydrophobicContact CD2-CG1 4.49Å; L444-F472 HydrophobicContact CB-CE2 4.18Å; L444-F472 HydrophobicContact CD2-CE2 4.07Å; L444-F472 HydrophobicContact CD2-CZ 3.83Å; L444-F490 HydrophobicContact CD1-CE1 3.99Å; L444-F490 HydrophobicContact CD1-CZ 4.45Å; L444-F490 HydrophobicContact CD2-CE1 3.94Å; L444-F490 HydrophobicContact CD2-CZ 3.7Å
445	L	89	Confident	82.9	Confident	15 Å²	15	45.7 Å²	45.7	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-36.9	179.2	-74.2	175	0	0	0	113	I441 E442 S443 E449 R461 V464 Q465	I441-L445 HydrophobicContact CG2-CD1 4.22Å; I441-L445 HydrophobicContact CG2-CG 4.39Å; I441-L445 WeakPolarHBondContact O-CG 3.4Å; I441-L445 PolarHBondContact O-N 2.66Å; E442-L445 WeakPolarHBondContact O-CB 3.39Å; E442-L445 PolarHBondContact O-N 3.23Å; S443-L445 VanDerWaalsContact C-N 3.31Å; S443-L445 PolarHBondContact O-N 3.33Å; L445-E449 PolarHBondContact O-N 2.77Å; L445-R461 HydrophobicContact CD2-CG 3.68Å; L445-V464 HydrophobicContact CD2-CG2 3.55Å; L445-V464 HydrophobicContact CG-CG2 4.26Å; L445-Q465 HydrophobicContact CD1-CG 3.88Å; L445-Q465 HydrophobicContact CD2-CG 3.67Å; L445-Q465 HydrophobicContact CG-CG 4.46Å
446	N	89.1	Confident	81.5	Confident	45 Å²	45	41.6 Å²	41.6	24%	0.241	23%	0.226	C	C	.	.	H	α-helix	trans	-66.4	-43	174.7	-65.7	-44.9	0	0	0	111.6	L193 A196 L200 E442 S443 L444 E449 V450	L193-N446 HydrophobicContact CD1-CB 4.22Å; L193-N446 WeakPolarHBondContact CD1-O 3.4Å; A196-N446 HydrophobicContact CB-CB 4.29Å; L200-N446 HydrophobicContact CD1-CB 4.45Å; E442-N446 PolarHBondContact O-N 3.08Å; E442-N446 VanDerWaalsContact O-N 3.14Å; E442-N446 PolarHBondContact O-ND2 3.09Å; S443-N446 PolarHBondContact O-N 3.08Å; L444-N446 VanDerWaalsContact C-N 3.29Å; L444-N446 PolarHBondContact O-N 3.32Å; N446-E449 PolarHBondContact O-N 2.92Å; N446-V450 PolarHBondContact O-N 2.92Å
447	V	88.6	Confident	80.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-47.6	176	176.2	0	0	0	0	110.1	L200 F203 I229 I236 S443 L444 E449 V450 I451	L200-V447 HydrophobicContact CD1-CG2 4.12Å; F203-V447 HydrophobicContact CE1-CG2 4.26Å; F203-V447 HydrophobicContact CZ-CG2 3.68Å; I229-V447 HydrophobicContact CD1-CG1 4.4Å; I229-V447 HydrophobicContact CG2-CG1 4.05Å; I236-V447 HydrophobicContact CD1-CG1 4.26Å; S443-V447 WeakPolarHBondContact O-CG2 3.06Å; S443-V447 PolarHBondContact O-N 3.25Å; L444-V447 PolarHBondContact O-N 3.07Å; L444-V447 VanDerWaalsContact O-N 3.17Å; V447-E449 VanDerWaalsContact C-N 3.28Å; V447-E449 PolarHBondContact O-N 2.81Å; V447-V450 WeakPolarHBondContact O-CB 3.46Å; V447-V450 PolarHBondContact O-N 3.47Å; V447-V450 VanDerWaalsContact O-N 3.1Å; V447-I451 HydrophobicContact CG1-CD1 4.44Å; V447-I451 WeakPolarHBondContact O-CG1 3.49Å; V447-I451 PolarHBondContact O-N 2.81Å
448	L	86.6	Confident	79.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-34	176.9	-70	-179.5	0	0	0	112.3	L444 V450 I451 A452 F457 L460 R461 V464	L444-L448 HydrophobicContact CD1-CD1 4.21Å; L444-L448 HydrophobicContact CD1-CD2 4.41Å; L444-L448 HydrophobicContact CD1-CG 3.99Å; L444-L448 HydrophobicContact CD2-CD1 4.19Å; L444-L448 HydrophobicContact CG-CD1 3.82Å; L444-L448 HydrophobicContact CG-CG 4.02Å; L444-L448 WeakPolarHBondContact O-CB 3.29Å; L444-L448 VanDerWaalsContact O-CG 3.28Å; L444-L448 WeakPolarHBondContact O-CG 3.16Å; L444-L448 PolarHBondContact O-N 3.36Å; L448-V450 VanDerWaalsContact C-N 3.29Å; L448-V450 PolarHBondContact O-N 3.46Å; L448-I451 HydrophobicContact CD2-CD1 4.11Å; L448-I451 HydrophobicContact CD2-CG1 4.27Å; L448-I451 CarbonylContact O-C 3.45Å; L448-I451 PolarHBondContact O-N 3.04Å; L448-A452 VanDerWaalsContact O-CA 3.25Å; L448-A452 WeakPolarHBondContact O-CA 3.46Å; L448-A452 WeakPolarHBondContact O-CB 3.49Å; L448-A452 PolarHBondContact O-N 2.85Å; L448-F457 HydrophobicContact CD2-CD1 3.59Å; L448-F457 HydrophobicContact CD2-CE1 4.28Å; L448-F457 HydrophobicContact CD2-CG 4.45Å; L448-L460 HydrophobicContact CD1-CD2 4.18Å; L448-L460 HydrophobicContact CD1-CG 4.04Å; L448-L460 HydrophobicContact CD2-CD2 4.04Å; L448-R461 HydrophobicContact CB-CB 4.48Å; L448-R461 HydrophobicContact CD1-CB 4.19Å; L448-V464 HydrophobicContact CD1-CG2 4.3Å
449	E	83.9	Confident	79	Confident	50 Å²	50	38.6 Å²	38.6	23%	0.234	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-36.6	175.2	-171.4	86.6	-128.7	0	0	112.2	L193 L445 N446 V447 R461	L193-E449 HydrophobicContact CD1-CB 4.06Å; L193-E449 HydrophobicContact CD1-CG 4.32Å; L193-E449 HydrophobicContact CD2-CB 4.44Å; L193-E449 HydrophobicContact CD2-CG 4.07Å; L445-E449 PolarHBondContact O-N 2.77Å; N446-E449 PolarHBondContact O-N 2.92Å; V447-E449 VanDerWaalsContact C-N 3.28Å; V447-E449 PolarHBondContact O-N 2.81Å; E449-R461 IonicContact OE1-CZ 3.54Å; E449-R461 IonicContact OE1-NH1 3.65Å; E449-R461 PolarHBondContact OE1-NH1 2.85Å; E449-R461 IonicContact OE1-NH2 2.74Å; E449-R461 IonicContact OE2-CZ 3.62Å; E449-R461 IonicContact OE2-NE 2.8Å; E449-R461 IonicContact OE2-NH1 3.78Å; E449-R461 PolarHBondContact OE2-NH1 3.01Å; E449-R461 IonicContact OE2-NH2 3.3Å; E449-R461 PolarHBondContact OE2-NH2 3.19Å
450	V	79.6	Confident	78.6	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-70.9	-44.9	178.2	179.2	0	0	0	0	110.8	L193 L197 I236 F259 F269 N446 V447 L448 A452 P453	L193-V450 HydrophobicContact CD1-CG2 3.99Å; L193-V450 HydrophobicContact CD2-CG2 3.68Å; L193-V450 HydrophobicContact CG-CG2 3.98Å; L197-V450 HydrophobicContact CD1-CG2 3.81Å; L197-V450 HydrophobicContact CD2-CG2 4.3Å; L197-V450 HydrophobicContact CG-CG2 4.49Å; I236-V450 HydrophobicContact CB-CG1 4.47Å; I236-V450 HydrophobicContact CD1-CB 3.96Å; I236-V450 HydrophobicContact CD1-CG1 4.06Å; I236-V450 HydrophobicContact CD1-CG2 3.95Å; F259-V450 HydrophobicContact CB-CG1 3.52Å; F259-V450 HydrophobicContact CD1-CG1 3.45Å; F259-V450 VanDerWaalsContact CD1-CG1 3.45Å; F259-V450 HydrophobicContact CD1-CG2 4.43Å; F259-V450 HydrophobicContact CD2-CG1 3.9Å; F259-V450 HydrophobicContact CE1-CG1 4.07Å; F259-V450 HydrophobicContact CE1-CG2 4.38Å; F259-V450 HydrophobicContact CE2-CG1 4.44Å; F259-V450 HydrophobicContact CG-CG1 3.32Å; F269-V450 HydrophobicContact CE1-CG1 3.87Å; F269-V450 VanDerWaalsContact CE1-O 3.26Å; F269-V450 WeakPolarHBondContact CE1-O 3.46Å; F269-V450 HydrophobicContact CZ-CG1 4Å; F269-V450 WeakPolarHBondContact CZ-O 3.33Å; N446-V450 PolarHBondContact O-N 2.92Å; V447-V450 WeakPolarHBondContact O-CB 3.46Å; V447-V450 PolarHBondContact O-N 3.47Å; V447-V450 VanDerWaalsContact O-N 3.1Å; L448-V450 VanDerWaalsContact C-N 3.29Å; L448-V450 PolarHBondContact O-N 3.46Å; V450-A452 VanDerWaalsContact C-N 3.33Å; V450-P453 VanDerWaalsContact O-CD 3.28Å; V450-P453 WeakPolarHBondContact O-CD 3.5Å
451	I	74.9	Confident	78.3	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.041	19%	0.192	C	C	.	.	H	α-helix	trans	-91.8	6.3	-177.1	69.2	177.2	0	0	0	113.1	I229 I236 L238 V447 L448 P453 F454 F457	I229-I451 HydrophobicContact CD1-CD1 3.49Å; I229-I451 VanDerWaalsContact CD1-CD1 3.49Å; I229-I451 HydrophobicContact CG1-CD1 4.22Å; I236-I451 HydrophobicContact CG2-CG2 3.96Å; L238-I451 HydrophobicContact CB-CG2 4.36Å; L238-I451 HydrophobicContact CD2-CB 4.13Å; L238-I451 HydrophobicContact CD2-CD1 4.43Å; L238-I451 HydrophobicContact CD2-CG2 4.32Å; V447-I451 HydrophobicContact CG1-CD1 4.44Å; V447-I451 WeakPolarHBondContact O-CG1 3.49Å; V447-I451 PolarHBondContact O-N 2.81Å; L448-I451 HydrophobicContact CD2-CD1 4.11Å; L448-I451 HydrophobicContact CD2-CG1 4.27Å; L448-I451 CarbonylContact O-C 3.45Å; L448-I451 PolarHBondContact O-N 3.04Å; I451-P453 WeakPolarHBondContact O-CD 3.25Å; I451-F454 VanDerWaalsContact O-CD2 3.23Å; I451-F454 WeakPolarHBondContact O-CD2 3.48Å; I451-F457 HydrophobicContact CD1-CD1 4.07Å; I451-F457 HydrophobicContact CD1-CE1 3.92Å; I451-F457 HydrophobicContact CD1-CG 4.49Å; I451-F457 HydrophobicContact CD1-CZ 4.22Å; I451-F457 HydrophobicContact CG1-CD1 4.43Å; I451-F457 HydrophobicContact CG1-CG 4.44Å
452	A	60.8	Low	77.8	Confident	10 Å²	10	41.7 Å²	41.7	8%	0.083	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-8.5	179.7	0	0	0	0	0	117.5	L448 V450 F454 N458	L448-A452 VanDerWaalsContact O-CA 3.25Å; L448-A452 WeakPolarHBondContact O-CA 3.46Å; L448-A452 WeakPolarHBondContact O-CB 3.49Å; L448-A452 PolarHBondContact O-N 2.85Å; V450-A452 VanDerWaalsContact C-N 3.33Å; A452-F454 PolarHBondContact O-N 3.4Å; A452-N458 WeakPolarHBondContact CB-OD1 3.45Å; A452-N458 PolarHBondContact O-ND2 3.4Å; A452-N458 PolarHBondContact O-OD1 3.05Å
453	P	57.9	Low	77.4	Confident	79 Å²	79	35.2 Å²	35.2	51%	0.513	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-21.9	172.6	-28.4	36.3	0	0	0	113.3	V450 I451	V450-P453 VanDerWaalsContact O-CD 3.28Å; V450-P453 WeakPolarHBondContact O-CD 3.5Å; I451-P453 WeakPolarHBondContact O-CD 3.25Å
454	F	63.7	Low	77.1	Confident	27 Å²	27	33.9 Å²	33.9	12%	0.118	17%	0.165	C	C	.	.	S	Bend	trans	-85.1	134.6	176.6	-49.2	-69.5	0	0	0	113.5	L238 F257 I451 A452 H456 F457 N458 L519	L238-F454 HydrophobicContact CD2-CE2 4.45Å; F257-F454 HydrophobicContact CD1-CE1 4.11Å; F257-F454 AromaticContact CD1-CE2 3.88Å; F257-F454 HydrophobicContact CD1-CE2 3.88Å; F257-F454 AromaticContact CD1-CZ 3.25Å; F257-F454 HydrophobicContact CD1-CZ 3.25Å; F257-F454 HydrophobicContact CD2-CZ 4.4Å; F257-F454 AromaticContact CE1-CE1 3.4Å; F257-F454 HydrophobicContact CE1-CE1 3.4Å; F257-F454 VanDerWaalsContact CE1-CE1 3.4Å; F257-F454 AromaticContact CE1-CE2 4Å; F257-F454 HydrophobicContact CE1-CE2 4Å; F257-F454 AromaticContact CE1-CZ 3.03Å; F257-F454 HydrophobicContact CE1-CZ 3.03Å; F257-F454 HydrophobicContact CE2-CZ 4.24Å; F257-F454 HydrophobicContact CG-CE2 4.14Å; F257-F454 AromaticContact CG-CZ 3.94Å; F257-F454 HydrophobicContact CG-CZ 3.94Å; F257-F454 AromaticContact CZ-CE1 3.65Å; F257-F454 HydrophobicContact CZ-CE1 3.65Å; F257-F454 HydrophobicContact CZ-CE2 4.37Å; F257-F454 AromaticContact CZ-CZ 3.58Å; F257-F454 HydrophobicContact CZ-CZ 3.58Å; I451-F454 VanDerWaalsContact O-CD2 3.23Å; I451-F454 WeakPolarHBondContact O-CD2 3.48Å; A452-F454 PolarHBondContact O-N 3.4Å; F454-H456 VanDerWaalsContact C-N 3.27Å; F454-H456 PolarHBondContact O-N 2.54Å; F454-H456 VanDerWaalsContact O-N 3.12Å; F454-F457 HydrophobicContact CB-CD2 4.11Å; F454-F457 HydrophobicContact CD2-CD2 4.4Å; F454-F457 PolarHBondContact O-N 2.69Å; F454-N458 PolarHBondContact O-N 2.89Å; F454-L519 HydrophobicContact CD1-CD2 4.31Å; F454-L519 HydrophobicContact CE1-CD1 4.2Å; F454-L519 HydrophobicContact CE1-CD2 3.78Å
455	K	61.3	Low	76.7	Confident	148 Å²	148	39 Å²	39	64%	0.643	19%	0.189	S	C	*	.	H	α-helix	trans	-54.7	-35.3	-172.7	-66.1	174.5	-173.4	161.5	0	113.9	T246	T246-K455 PolarHBondContact OG1-NZ 2.86Å
456	H	65.2	Low	76.3	Confident	35 Å²	35	39.7 Å²	39.7	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-81.1	-33.5	-176.2	55.8	-92.6	0	0	0	113.7	W209 F454 N458 K459 L460	W209-H456 AromaticContact CE2-CD2 3.89Å; W209-H456 HydrophobicContact CH2-CB 4.22Å; W209-H456 WeakPolarHBondContact CH2-O 3.34Å; W209-H456 AromaticContact CZ2-CD2 3.8Å; W209-H456 HydrophobicContact CZ3-CB 4.29Å; F454-H456 VanDerWaalsContact C-N 3.27Å; F454-H456 PolarHBondContact O-N 2.54Å; F454-H456 VanDerWaalsContact O-N 3.12Å; H456-N458 VanDerWaalsContact C-N 3.3Å; H456-N458 PolarHBondContact O-N 3.13Å; H456-K459 WeakPolarHBondContact O-CB 3.46Å; H456-K459 PolarHBondContact O-N 2.62Å; H456-K459 VanDerWaalsContact O-N 3.12Å; H456-L460 PolarHBondContact O-N 3.3Å
457	F	73.9	Confident	75.9	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-67.7	-30.1	174.8	-76.7	-74	0	0	0	112.7	L207 W209 C227 L238 L448 I451 F454 K459 L460 R461	L207-F457 HydrophobicContact CD1-CE1 3.99Å; L207-F457 HydrophobicContact CD1-CZ 4.19Å; L207-F457 HydrophobicContact CD2-CE1 4.1Å; W209-F457 HydrophobicContact CZ2-CD1 4.06Å; W209-F457 HydrophobicContact CZ2-CE1 4.11Å; W209-F457 AromaticContact NE1-CE1 3.99Å; W209-F457 AromaticContact NE1-CZ 3.94Å; C227-F457 HydrophobicContact CB-CZ 4.23Å; L238-F457 HydrophobicContact CD1-CZ 4.45Å; L238-F457 HydrophobicContact CD2-CE2 4.04Å; L238-F457 HydrophobicContact CD2-CZ 4.37Å; L448-F457 HydrophobicContact CD2-CD1 3.59Å; L448-F457 HydrophobicContact CD2-CE1 4.28Å; L448-F457 HydrophobicContact CD2-CG 4.45Å; I451-F457 HydrophobicContact CD1-CD1 4.07Å; I451-F457 HydrophobicContact CD1-CE1 3.92Å; I451-F457 HydrophobicContact CD1-CG 4.49Å; I451-F457 HydrophobicContact CD1-CZ 4.22Å; I451-F457 HydrophobicContact CG1-CD1 4.43Å; I451-F457 HydrophobicContact CG1-CG 4.44Å; F454-F457 HydrophobicContact CB-CD2 4.11Å; F454-F457 HydrophobicContact CD2-CD2 4.4Å; F454-F457 PolarHBondContact O-N 2.69Å; F457-K459 VanDerWaalsContact C-N 3.28Å; F457-K459 PolarHBondContact O-N 2.92Å; F457-L460 HydrophobicContact CD1-CD2 4.3Å; F457-L460 PolarHBondContact O-N 2.75Å; F457-R461 WeakPolarHBondContact O-CB 3.47Å; F457-R461 PolarHBondContact O-N 2.92Å
458	N	72.4	Confident	75.8	Confident	58 Å²	58	48.2 Å²	48.2	31%	0.31	23%	0.228	S	C	.	.	H	α-helix	trans	-59.9	-38	170.5	-78.3	-46.4	0	0	0	112.4	A452 F454 H456 R461 E462	A452-N458 WeakPolarHBondContact CB-OD1 3.45Å; A452-N458 PolarHBondContact O-ND2 3.4Å; A452-N458 PolarHBondContact O-OD1 3.05Å; F454-N458 PolarHBondContact O-N 2.89Å; H456-N458 VanDerWaalsContact C-N 3.3Å; H456-N458 PolarHBondContact O-N 3.13Å; N458-R461 PolarHBondContact O-N 3.38Å; N458-E462 WeakPolarHBondContact O-CB 3.4Å; N458-E462 WeakPolarHBondContact O-CG 3.44Å; N458-E462 PolarHBondContact O-N 2.79Å
459	K	74.9	Confident	75.9	Confident	70 Å²	70	49 Å²	49	30%	0.304	23%	0.233	S	C	.	.	H	α-helix	trans	-68.6	-41.3	176.4	-70.2	-71.7	165	-152.8	0	112.2	H456 F457 R461 E462 F463 I478	H456-K459 WeakPolarHBondContact O-CB 3.46Å; H456-K459 PolarHBondContact O-N 2.62Å; H456-K459 VanDerWaalsContact O-N 3.12Å; F457-K459 VanDerWaalsContact C-N 3.28Å; F457-K459 PolarHBondContact O-N 2.92Å; K459-R461 VanDerWaalsContact C-N 3.34Å; K459-E462 IonicContact NZ-OE2 3.34Å; K459-E462 PolarHBondContact NZ-OE2 3.05Å; K459-E462 PolarHBondContact O-N 3.31Å; K459-F463 WeakPolarHBondContact O-CB 3.38Å; K459-F463 PolarHBondContact O-N 3.49Å; K459-I478 HydrophobicContact CB-CG2 4.29Å
460	L	81.6	Confident	76.2	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-47	171.9	176.7	60.5	0	0	0	111.2	W209 L448 H456 F457 F463 V464 L476 I478 V488	W209-L460 HydrophobicContact CH2-CB 3.84Å; W209-L460 HydrophobicContact CH2-CD2 4.46Å; W209-L460 HydrophobicContact CZ2-CB 4.17Å; W209-L460 HydrophobicContact CZ2-CD2 4.04Å; L448-L460 HydrophobicContact CD1-CD2 4.18Å; L448-L460 HydrophobicContact CD1-CG 4.04Å; L448-L460 HydrophobicContact CD2-CD2 4.04Å; H456-L460 PolarHBondContact O-N 3.3Å; F457-L460 HydrophobicContact CD1-CD2 4.3Å; F457-L460 PolarHBondContact O-N 2.75Å; L460-F463 PolarHBondContact O-N 2.83Å; L460-F463 VanDerWaalsContact O-N 3.16Å; L460-V464 HydrophobicContact CD1-CG1 3.86Å; L460-V464 HydrophobicContact CG-CG1 4.49Å; L460-V464 WeakPolarHBondContact O-CG1 3.31Å; L460-V464 WeakPolarHBondContact O-CG2 3.48Å; L460-V464 PolarHBondContact O-N 3.34Å; L460-L476 HydrophobicContact CD1-CD1 3.52Å; L460-I478 HydrophobicContact CB-CD1 4.17Å; L460-I478 HydrophobicContact CD1-CD1 3.83Å; L460-V488 HydrophobicContact CD1-CB 4.41Å; L460-V488 HydrophobicContact CD1-CG1 4.23Å; L460-V488 HydrophobicContact CD1-CG2 4.29Å; L460-V488 HydrophobicContact CD2-CG1 4.17Å
461	R	83.9	Confident	76.8	Confident	49 Å²	49	52.1 Å²	52.1	19%	0.185	26%	0.263	C	S	.	.	H	α-helix	trans	-58.5	-50.8	177.3	-174.9	-170.9	163.9	-179.6	5.2	112.2	L445 L448 E449 F457 N458 K459 F463 V464 Q465	L445-R461 HydrophobicContact CD2-CG 3.68Å; L448-R461 HydrophobicContact CB-CB 4.48Å; L448-R461 HydrophobicContact CD1-CB 4.19Å; E449-R461 IonicContact OE1-CZ 3.54Å; E449-R461 IonicContact OE1-NH1 3.65Å; E449-R461 PolarHBondContact OE1-NH1 2.85Å; E449-R461 IonicContact OE1-NH2 2.74Å; E449-R461 IonicContact OE2-CZ 3.62Å; E449-R461 IonicContact OE2-NE 2.8Å; E449-R461 IonicContact OE2-NH1 3.78Å; E449-R461 PolarHBondContact OE2-NH1 3.01Å; E449-R461 IonicContact OE2-NH2 3.3Å; E449-R461 PolarHBondContact OE2-NH2 3.19Å; F457-R461 WeakPolarHBondContact O-CB 3.47Å; F457-R461 PolarHBondContact O-N 2.92Å; N458-R461 PolarHBondContact O-N 3.38Å; K459-R461 VanDerWaalsContact C-N 3.34Å; R461-F463 PolarHBondContact O-N 3.46Å; R461-V464 PolarHBondContact O-N 2.66Å; R461-Q465 VanDerWaalsContact O-CG 3.27Å; R461-Q465 WeakPolarHBondContact O-CG 3.34Å; R461-Q465 PolarHBondContact O-N 3.07Å; R461-Q465 VanDerWaalsContact O-N 3.16Å
462	E	78.3	Confident	77.7	Confident	107 Å²	107	52 Å²	52	50%	0.5	26%	0.262	S	S	.	.	H	α-helix	trans	-55.1	-39.8	175.7	-76.6	176.1	175.6	0	0	111.3	N458 K459	N458-E462 WeakPolarHBondContact O-CB 3.4Å; N458-E462 WeakPolarHBondContact O-CG 3.44Å; N458-E462 PolarHBondContact O-N 2.79Å; K459-E462 IonicContact NZ-OE2 3.34Å; K459-E462 PolarHBondContact NZ-OE2 3.05Å; K459-E462 PolarHBondContact O-N 3.31Å
463	F	79.4	Confident	79.2	Confident	3 Å²	3	51.6 Å²	51.6	1%	0.013	26%	0.258	C	S	.	.	H	α-helix	trans	-72.5	-44.6	-177.8	-161	-77.8	0	0	0	112.6	L308 L345 K459 L460 R461 Q465 M466 L468 L476 I478	L308-F463 HydrophobicContact CD2-CD2 4.13Å; L308-F463 HydrophobicContact CD2-CE2 4.43Å; L345-F463 HydrophobicContact CD2-CE2 4.37Å; K459-F463 WeakPolarHBondContact O-CB 3.38Å; K459-F463 PolarHBondContact O-N 3.49Å; L460-F463 PolarHBondContact O-N 2.83Å; L460-F463 VanDerWaalsContact O-N 3.16Å; R461-F463 PolarHBondContact O-N 3.46Å; F463-Q465 VanDerWaalsContact C-N 3.27Å; F463-Q465 PolarHBondContact O-N 3.42Å; F463-M466 HydrophobicContact CB-CE 4.21Å; F463-M466 HydrophobicContact CD1-CE 3.41Å; F463-M466 VanDerWaalsContact CD1-CE 3.41Å; F463-M466 HydrophobicContact CD2-CE 3.38Å; F463-M466 HydrophobicContact CE1-CE 3.44Å; F463-M466 VanDerWaalsContact CE1-CE 3.44Å; F463-M466 HydrophobicContact CE2-CE 3.44Å; F463-M466 VanDerWaalsContact CE2-CE 3.44Å; F463-M466 HydrophobicContact CG-CE 3.39Å; F463-M466 HydrophobicContact CZ-CE 3.48Å; F463-M466 VanDerWaalsContact CZ-CE 3.48Å; F463-M466 VanDerWaalsContact O-CB 3.25Å; F463-M466 WeakPolarHBondContact O-CB 3.2Å; F463-M466 VanDerWaalsContact O-CE 3.27Å; F463-M466 WeakPolarHBondContact O-CE 3.45Å; F463-M466 VanDerWaalsContact O-CG 3.28Å; F463-M466 WeakPolarHBondContact O-CG 2.83Å; F463-M466 PolarHBondContact O-N 2.88Å; F463-M466 VanDerWaalsContact O-N 3.14Å; F463-L468 HydrophobicContact CE1-CD2 4.39Å; F463-L476 HydrophobicContact CD1-CD2 3.66Å; F463-L476 HydrophobicContact CE1-CD2 3.47Å; F463-L476 VanDerWaalsContact CE1-CD2 3.47Å; F463-I478 HydrophobicContact CB-CD1 4.1Å; F463-I478 HydrophobicContact CB-CG1 4.37Å; F463-I478 HydrophobicContact CD2-CB 4.45Å; F463-I478 HydrophobicContact CD2-CG1 4.01Å; F463-I478 HydrophobicContact CD2-CG2 4.16Å; F463-I478 HydrophobicContact CE2-CG1 4.45Å; F463-I478 HydrophobicContact CG-CD1 4.3Å; F463-I478 HydrophobicContact CG-CG1 4.06Å
464	V	84.2	Confident	81	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.018	23%	0.234	C	C	.	.	H	α-helix	trans	-74.6	-16.1	-178.9	-57.1	0	0	0	0	113.5	I441 L444 L445 L448 L460 R461 M466 P473 L476	I441-V464 HydrophobicContact CG2-CB 4.5Å; L444-V464 HydrophobicContact CD2-CG1 4.49Å; L445-V464 HydrophobicContact CD2-CG2 3.55Å; L445-V464 HydrophobicContact CG-CG2 4.26Å; L448-V464 HydrophobicContact CD1-CG2 4.3Å; L460-V464 HydrophobicContact CD1-CG1 3.86Å; L460-V464 HydrophobicContact CG-CG1 4.49Å; L460-V464 WeakPolarHBondContact O-CG1 3.31Å; L460-V464 WeakPolarHBondContact O-CG2 3.48Å; L460-V464 PolarHBondContact O-N 3.34Å; R461-V464 PolarHBondContact O-N 2.66Å; V464-M466 PolarHBondContact O-N 3.48Å; V464-P473 HydrophobicContact CG1-CG 4.09Å; V464-L476 HydrophobicContact CG1-CD1 3.82Å
465	Q	82.2	Confident	82.5	Confident	107 Å²	107	49.9 Å²	49.9	50%	0.5	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.3	169.2	-73.8	178.1	-21.5	0	0	113.5	L445 R461 F463	L445-Q465 HydrophobicContact CD1-CG 3.88Å; L445-Q465 HydrophobicContact CD2-CG 3.67Å; L445-Q465 HydrophobicContact CG-CG 4.46Å; R461-Q465 VanDerWaalsContact O-CG 3.27Å; R461-Q465 WeakPolarHBondContact O-CG 3.34Å; R461-Q465 PolarHBondContact O-N 3.07Å; R461-Q465 VanDerWaalsContact O-N 3.16Å; F463-Q465 VanDerWaalsContact C-N 3.27Å; F463-Q465 PolarHBondContact O-N 3.42Å
466	M	79.3	Confident	83.9	Confident	30 Å²	30	42.8 Å²	42.8	15%	0.148	21%	0.212	C	C	.	.	S	Bend	trans	-67.5	161.9	174.3	-61.8	-169.3	-63.8	0	0	111	L308 T310 I313 F463 V464 L468	L308-M466 HydrophobicContact CD2-SD 4.32Å; T310-M466 HydrophobicContact CG2-CG 4.08Å; T310-M466 HydrophobicContact CG2-SD 3.42Å; T310-M466 WeakPolarHBondContact CG2-SD 3.33Å; I313-M466 HydrophobicContact CD1-SD 3.82Å; F463-M466 HydrophobicContact CB-CE 4.21Å; F463-M466 HydrophobicContact CD1-CE 3.41Å; F463-M466 VanDerWaalsContact CD1-CE 3.41Å; F463-M466 HydrophobicContact CD2-CE 3.38Å; F463-M466 HydrophobicContact CE1-CE 3.44Å; F463-M466 VanDerWaalsContact CE1-CE 3.44Å; F463-M466 HydrophobicContact CE2-CE 3.44Å; F463-M466 VanDerWaalsContact CE2-CE 3.44Å; F463-M466 HydrophobicContact CG-CE 3.39Å; F463-M466 HydrophobicContact CZ-CE 3.48Å; F463-M466 VanDerWaalsContact CZ-CE 3.48Å; F463-M466 VanDerWaalsContact O-CB 3.25Å; F463-M466 WeakPolarHBondContact O-CB 3.2Å; F463-M466 VanDerWaalsContact O-CE 3.27Å; F463-M466 WeakPolarHBondContact O-CE 3.45Å; F463-M466 VanDerWaalsContact O-CG 3.28Å; F463-M466 WeakPolarHBondContact O-CG 2.83Å; F463-M466 PolarHBondContact O-N 2.88Å; F463-M466 VanDerWaalsContact O-N 3.14Å; V464-M466 PolarHBondContact O-N 3.48Å; M466-L468 VanDerWaalsContact C-N 3.31Å; M466-L468 HydrophobicContact CB-CD2 4.28Å; M466-L468 PolarHBondContact O-N 3.36Å
467	K	81.1	Confident	85	Confident	197 Å²	197	42.3 Å²	42.3	86%	0.857	21%	0.21	S	C	*	.			trans	-71.3	88.6	171.2	-69.4	-174.1	178.5	-176.8	0	109.6	F315	F315-K467 WeakPolarHBondContact CE2-O 3.13Å; F315-K467 WeakPolarHBondContact CZ-O 3.28Å
468	L	87.4	Confident	85.2	Confident	28 Å²	28	42.4 Å²	42.4	15%	0.147	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-76.9	161.7	176.3	-57.8	-175.4	0	0	0	111.1	F315 I431 M433 I441 F463 M466 P473	F315-L468 HydrophobicContact CZ-CD2 4.4Å; I431-L468 HydrophobicContact CD1-CD1 4.08Å; I431-L468 HydrophobicContact CD1-CD2 3.68Å; I431-L468 HydrophobicContact CD1-CG 4.31Å; M433-L468 HydrophobicContact CE-CB 4.14Å; I441-L468 HydrophobicContact CD1-CD1 4.33Å; F463-L468 HydrophobicContact CE1-CD2 4.39Å; M466-L468 VanDerWaalsContact C-N 3.31Å; M466-L468 HydrophobicContact CB-CD2 4.28Å; M466-L468 PolarHBondContact O-N 3.36Å; L468-P473 HydrophobicContact CD1-CB 3.96Å; L468-P473 HydrophobicContact CD1-CG 3.78Å
469	P	89	Confident	85.3	Confident	15 Å²	15	40.1 Å²	40.1	10%	0.097	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-58.5	168.5	166.8	-17.3	30.2	0	0	0	111.4	F315 Y340 M433	F315-P469 HydrophobicContact CB-CG 3.97Å; F315-P469 HydrophobicContact CD1-CG 3.67Å; F315-P469 HydrophobicContact CD2-CG 4.1Å; F315-P469 HydrophobicContact CE1-CG 4.16Å; F315-P469 HydrophobicContact CG-CG 3.63Å; Y340-P469 HydrophobicContact CD1-CG 4.23Å; Y340-P469 HydrophobicContact CD2-CB 4.38Å; Y340-P469 HydrophobicContact CD2-CG 4.13Å; Y340-P469 HydrophobicContact CE1-CB 4.25Å; Y340-P469 HydrophobicContact CE1-CG 4.44Å; Y340-P469 HydrophobicContact CE2-CB 4.1Å; Y340-P469 HydrophobicContact CE2-CG 4.36Å; Y340-P469 HydrophobicContact CG-CG 4.08Å; M433-P469 VanDerWaalsContact CE-O 3.23Å; M433-P469 WeakPolarHBondContact CE-O 3.28Å; M433-P469 HydrophobicContact CG-CB 4.09Å; M433-P469 HydrophobicContact CG-CG 4.18Å
470	P	89.8	Confident	85.1	Confident	94 Å²	94	38.4 Å²	38.4	61%	0.61	20%	0.195	S	C	*	.	S	Bend	trans	-58.4	143.9	178.3	-24.1	34.7	0	0	0	112.6	Q435	Q435-P470 PolarHBondContact NE2-O 3.34Å
471	G	91.3	Very high	84.4	Confident	25 Å²	25	42.8 Å²	42.8	26%	0.258	21%	0.214	S	C	.	.	S	Bend	trans	103.2	-170	178.7	0	0	0	0	0	113.3	M433 S434	M433-G471 VanDerWaalsContact CE-C 3.46Å; M433-G471 WeakPolarHBondContact CE-O 3.48Å; S434-G471 CarbonylContact O-C 3.57Å; S434-G471 WeakPolarHBondContact O-CA 3.42Å
472	F	93.7	Very high	83.4	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	137.8	177.2	-173.7	-88.6	0	0	0	111.5	M433 S434 F437 L439 I441 L444 V474 F490	M433-F472 CarbonylContact C-O 3.56Å; M433-F472 WeakPolarHBondContact CA-O 3.37Å; S434-F472 PolarHBondContact N-O 3.11Å; S434-F472 PolarHBondContact O-N 2.94Å; F437-F472 HydrophobicContact CB-CB 3.48Å; F437-F472 VanDerWaalsContact CB-CB 3.48Å; F437-F472 HydrophobicContact CB-CD1 3.83Å; F437-F472 HydrophobicContact CB-CG 3.75Å; F437-F472 HydrophobicContact CD1-CB 4.18Å; F437-F472 AromaticContact CD1-CD1 3.35Å; F437-F472 HydrophobicContact CD1-CD1 3.35Å; F437-F472 AromaticContact CD1-CD2 3.76Å; F437-F472 HydrophobicContact CD1-CD2 3.76Å; F437-F472 AromaticContact CD1-CE1 3.5Å; F437-F472 HydrophobicContact CD1-CE1 3.5Å; F437-F472 VanDerWaalsContact CD1-CE1 3.5Å; F437-F472 AromaticContact CD1-CE2 3.87Å; F437-F472 HydrophobicContact CD1-CE2 3.87Å; F437-F472 AromaticContact CD1-CG 3.48Å; F437-F472 HydrophobicContact CD1-CG 3.48Å; F437-F472 VanDerWaalsContact CD1-CG 3.48Å; F437-F472 AromaticContact CD1-CZ 3.74Å; F437-F472 HydrophobicContact CD1-CZ 3.74Å; F437-F472 AromaticContact CD2-CD1 3.87Å; F437-F472 HydrophobicContact CD2-CD1 3.87Å; F437-F472 HydrophobicContact CD2-CE1 4.16Å; F437-F472 AromaticContact CE1-CD1 3.81Å; F437-F472 HydrophobicContact CE1-CD1 3.81Å; F437-F472 HydrophobicContact CE1-CD2 4.33Å; F437-F472 AromaticContact CE1-CE1 3.41Å; F437-F472 HydrophobicContact CE1-CE1 3.41Å; F437-F472 VanDerWaalsContact CE1-CE1 3.41Å; F437-F472 AromaticContact CE1-CE2 3.97Å; F437-F472 HydrophobicContact CE1-CE2 3.97Å; F437-F472 HydrophobicContact CE1-CG 4.24Å; F437-F472 AromaticContact CE1-CZ 3.48Å; F437-F472 HydrophobicContact CE1-CZ 3.48Å; F437-F472 VanDerWaalsContact CE1-CZ 3.48Å; F437-F472 HydrophobicContact CE2-CD1 4.26Å; F437-F472 HydrophobicContact CE2-CE1 4.07Å; F437-F472 HydrophobicContact CG-CB 4.02Å; F437-F472 AromaticContact CG-CD1 3.39Å; F437-F472 HydrophobicContact CG-CD1 3.39Å; F437-F472 HydrophobicContact CG-CD2 4.42Å; F437-F472 AromaticContact CG-CE1 3.88Å; F437-F472 HydrophobicContact CG-CE1 3.88Å; F437-F472 AromaticContact CG-CG 3.69Å; F437-F472 HydrophobicContact CG-CG 3.69Å; F437-F472 HydrophobicContact CZ-CD1 4.23Å; F437-F472 AromaticContact CZ-CE1 3.71Å; F437-F472 HydrophobicContact CZ-CE1 3.71Å; F437-F472 HydrophobicContact CZ-CZ 4.1Å; L439-F472 HydrophobicContact CB-CE2 4.35Å; L439-F472 WeakPolarHBondContact O-CD2 3.24Å; L439-F472 WeakPolarHBondContact O-CE2 3.24Å; I441-F472 HydrophobicContact CG1-CD2 4.22Å; L444-F472 HydrophobicContact CB-CE2 4.18Å; L444-F472 HydrophobicContact CD2-CE2 4.07Å; L444-F472 HydrophobicContact CD2-CZ 3.83Å; F472-V474 HydrophobicContact CD1-CG1 3.99Å; F472-V474 PolarHBondContact O-N 2.9Å; F472-V474 VanDerWaalsContact O-N 3.09Å; F472-F490 HydrophobicContact CE1-CB 4.48Å; F472-F490 AromaticContact CE1-CD1 3.73Å; F472-F490 HydrophobicContact CE1-CD1 3.73Å; F472-F490 HydrophobicContact CE1-CD2 4.07Å; F472-F490 AromaticContact CE1-CE1 3.91Å; F472-F490 HydrophobicContact CE1-CE1 3.91Å; F472-F490 HydrophobicContact CE1-CE2 4.21Å; F472-F490 AromaticContact CE1-CG 3.84Å; F472-F490 HydrophobicContact CE1-CG 3.84Å; F472-F490 HydrophobicContact CE1-CZ 4.14Å; F472-F490 AromaticContact CZ-CD1 3.97Å; F472-F490 HydrophobicContact CZ-CD1 3.97Å; F472-F490 AromaticContact CZ-CE1 3.77Å; F472-F490 HydrophobicContact CZ-CE1 3.77Å; F472-F490 HydrophobicContact CZ-CZ 4.12Å
473	P	93.8	Very high	82.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	93.4	-177.9	32.4	-35.5	0	0	0	112	I431 A432 M433 V464 L468 K475 L476 F490	I431-P473 HydrophobicContact CD1-CB 4.08Å; I431-P473 HydrophobicContact CG1-CB 4.33Å; A432-P473 CarbonylContact O-C 3.55Å; A432-P473 WeakPolarHBondContact O-CA 3.32Å; M433-P473 HydrophobicContact CE-CB 4.28Å; M433-P473 HydrophobicContact SD-CB 3.9Å; V464-P473 HydrophobicContact CG1-CG 4.09Å; L468-P473 HydrophobicContact CD1-CB 3.96Å; L468-P473 HydrophobicContact CD1-CG 3.78Å; P473-K475 VanDerWaalsContact C-N 3.34Å; P473-L476 HydrophobicContact CB-CD1 3.94Å; P473-L476 HydrophobicContact CB-CD2 3.7Å; P473-L476 HydrophobicContact CB-CG 3.86Å; P473-L476 HydrophobicContact CG-CD1 4.19Å; P473-F490 WeakPolarHBondContact O-CD2 3.35Å; P473-F490 WeakPolarHBondContact O-CE2 3.49Å
474	V	94.4	Very high	82.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-16.4	179.5	-63.4	0	0	0	0	113.6	V332 F335 A337 A432 F437 F472 T489 F490	V332-V474 HydrophobicContact CB-CB 4.46Å; V332-V474 HydrophobicContact CB-CG2 3.87Å; V332-V474 HydrophobicContact CG1-CB 4.27Å; V332-V474 HydrophobicContact CG1-CG2 4.12Å; V332-V474 HydrophobicContact CG2-CG2 4.25Å; F335-V474 HydrophobicContact CB-CG1 4.13Å; F335-V474 HydrophobicContact CD2-CG1 4.26Å; F335-V474 HydrophobicContact CG-CG1 4.26Å; A337-V474 HydrophobicContact CB-CG2 3.51Å; A432-V474 HydrophobicContact CB-CG2 4.15Å; A432-V474 WeakPolarHBondContact O-CG2 3.19Å; A432-V474 PolarHBondContact O-N 3.49Å; F437-V474 HydrophobicContact CB-CG1 4.37Å; F437-V474 HydrophobicContact CD2-CG1 3.58Å; F437-V474 HydrophobicContact CE2-CG1 4.2Å; F437-V474 HydrophobicContact CG-CG1 4.24Å; F472-V474 HydrophobicContact CD1-CG1 3.99Å; F472-V474 PolarHBondContact O-N 2.9Å; F472-V474 VanDerWaalsContact O-N 3.09Å; V474-T489 WeakPolarHBondContact O-CA 3.36Å; V474-F490 PolarHBondContact O-N 3.14Å
475	K	94.4	Very high	82.5	Confident	70 Å²	70	41 Å²	41	30%	0.304	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	136.5	170	-174.2	176.1	177.7	174	0	111.7	V332 F339 I431 A432 P473 T487 V488	V332-K475 HydrophobicContact CG1-CB 4.1Å; V332-K475 HydrophobicContact CG2-CB 4.43Å; F339-K475 HydrophobicContact CE1-CD 4.49Å; I431-K475 CarbonylContact C-O 3.5Å; I431-K475 WeakPolarHBondContact CA-O 3.18Å; A432-K475 HydrophobicContact CB-CB 3.77Å; A432-K475 PolarHBondContact N-O 3.08Å; A432-K475 PolarHBondContact O-N 3.24Å; P473-K475 VanDerWaalsContact C-N 3.34Å; K475-T487 HydrophobicContact CD-CG2 4.43Å; K475-T487 VanDerWaalsContact CE-CG2 3.4Å; K475-T487 HydrophobicContact CG-CG2 4.16Å; K475-V488 CarbonylContact C-O 3.48Å; K475-V488 VanDerWaalsContact CA-O 3.27Å; K475-V488 WeakPolarHBondContact CA-O 3.46Å
476	L	90.9	Very high	82.6	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	128.8	-173.7	-66.7	159	0	0	0	111.7	I431 L460 F463 V464 P473 I478 T487 V488 F490	I431-L476 HydrophobicContact CB-CD2 4.45Å; I431-L476 HydrophobicContact CD1-CD2 3.4Å; I431-L476 HydrophobicContact CG1-CD2 3.61Å; L460-L476 HydrophobicContact CD1-CD1 3.52Å; F463-L476 HydrophobicContact CD1-CD2 3.66Å; F463-L476 HydrophobicContact CE1-CD2 3.47Å; F463-L476 VanDerWaalsContact CE1-CD2 3.47Å; V464-L476 HydrophobicContact CG1-CD1 3.82Å; P473-L476 HydrophobicContact CB-CD1 3.94Å; P473-L476 HydrophobicContact CB-CD2 3.7Å; P473-L476 HydrophobicContact CB-CG 3.86Å; P473-L476 HydrophobicContact CG-CD1 4.19Å; L476-I478 HydrophobicContact CB-CG1 4.25Å; L476-T487 CarbonylContact O-C 3.55Å; L476-T487 WeakPolarHBondContact O-CA 3.49Å; L476-V488 HydrophobicContact CB-CB 4.38Å; L476-V488 PolarHBondContact N-O 3.37Å; L476-V488 PolarHBondContact O-N 2.85Å; L476-F490 HydrophobicContact CD1-CE2 4.14Å
477	D	88.1	Confident	83.1	Confident	24 Å²	24	35 Å²	35	13%	0.128	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	115	166.6	-57.8	-19.4	0	0	0	109.8	A429 T430 T485	A429-D477 HydrophobicContact CB-CB 3.98Å; A429-D477 WeakPolarHBondContact CB-O 3.27Å; T430-D477 VanDerWaalsContact CB-OD2 3.31Å; T430-D477 WeakPolarHBondContact CB-OD2 3.38Å; T430-D477 PolarHBondContact N-OD2 3.49Å; T430-D477 PolarHBondContact O-N 3.27Å; T430-D477 VanDerWaalsContact O-N 3.08Å; T430-D477 PolarHBondContact OG1-OD2 2.9Å; D477-T485 HydrophobicContact CB-CG2 3.97Å
478	I	79	Confident	83.6	Confident	4 Å²	4	25.6 Å²	25.6	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.4	-176	-53.5	-179.3	0	0	0	109.7	K459 L460 F463 L476 V480 T485 A486 V488	K459-I478 HydrophobicContact CB-CG2 4.29Å; L460-I478 HydrophobicContact CB-CD1 4.17Å; L460-I478 HydrophobicContact CD1-CD1 3.83Å; F463-I478 HydrophobicContact CB-CD1 4.1Å; F463-I478 HydrophobicContact CB-CG1 4.37Å; F463-I478 HydrophobicContact CD2-CB 4.45Å; F463-I478 HydrophobicContact CD2-CG1 4.01Å; F463-I478 HydrophobicContact CD2-CG2 4.16Å; F463-I478 HydrophobicContact CE2-CG1 4.45Å; F463-I478 HydrophobicContact CG-CD1 4.3Å; F463-I478 HydrophobicContact CG-CG1 4.06Å; L476-I478 HydrophobicContact CB-CG1 4.25Å; I478-V480 PolarHBondContact O-N 2.72Å; I478-T485 CarbonylContact O-C 3.55Å; I478-T485 WeakPolarHBondContact O-CA 3.45Å; I478-A486 PolarHBondContact N-O 2.88Å; I478-A486 PolarHBondContact O-N 2.81Å; I478-V488 HydrophobicContact CD1-CG2 3.92Å
479	P	74.5	Confident	83.9	Confident	10 Å²	10	25.5 Å²	25.5	7%	0.065	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	114.7	171.5	28.7	-32.1	0	0	0	109.9	L308 L345 F427	L308-P479 HydrophobicContact CD1-CG 3.77Å; L345-P479 HydrophobicContact CD2-CG 4.35Å; F427-P479 HydrophobicContact CD1-CB 3.61Å; F427-P479 HydrophobicContact CD1-CG 4.47Å; F427-P479 HydrophobicContact CD2-CB 4.05Å; F427-P479 HydrophobicContact CE1-CB 3.61Å; F427-P479 HydrophobicContact CE2-CB 4.08Å; F427-P479 HydrophobicContact CG-CB 3.81Å; F427-P479 HydrophobicContact CG-CG 4.28Å; F427-P479 HydrophobicContact CZ-CB 3.84Å
480	V	71	Confident	84.1	Confident	35 Å²	35	24.8 Å²	24.8	21%	0.212	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-43.8	177.9	-176.2	0	0	0	0	110.3	F211 I478 I484 A486	F211-V480 HydrophobicContact CE1-CG2 4.3Å; I478-V480 PolarHBondContact O-N 2.72Å; V480-I484 PolarHBondContact N-O 3.1Å; V480-A486 HydrophobicContact CG2-CB 3.42Å; V480-A486 VanDerWaalsContact CG2-CB 3.42Å
481	F	66.1	Low	84	Confident	92 Å²	92	23.9 Å²	23.9	40%	0.404	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	163.7	173.9	-78.6	-79.1	0	0	0	110.6	M248 T483 I484	M248-F481 HydrophobicContact CE-CE2 4.35Å; F481-T483 PolarHBondContact O-N 3.22Å; F481-I484 HydrophobicContact CB-CB 4.1Å; F481-I484 HydrophobicContact CB-CD1 4.36Å; F481-I484 HydrophobicContact CB-CG1 4.38Å; F481-I484 HydrophobicContact CD2-CD1 4.24Å; F481-I484 PolarHBondContact N-O 3.07Å; F481-I484 PolarHBondContact O-N 2.83Å
482	P	63.5	Low	84	Confident	40 Å²	40	25.2 Å²	25.2	26%	0.26	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-27	176.6	-29.4	36.4	0	0	0	114.1	L347 K425	L347-P482 HydrophobicContact CD2-CG 4.36Å; K425-P482 WeakPolarHBondContact CD-O 3.4Å; K425-P482 WeakPolarHBondContact CE-O 3.48Å; K425-P482 PolarHBondContact NZ-O 3.35Å
483	T	67.6	Low	84.1	Confident	46 Å²	46	25.8 Å²	25.8	28%	0.282	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-12.4	179.7	54.7	0	0	0	0	115	S213 W214 V215 F481	S213-T483 VanDerWaalsContact CA-O 3.29Å; S213-T483 WeakPolarHBondContact CA-O 3.47Å; S213-T483 WeakPolarHBondContact CB-O 3.39Å; S213-T483 PolarHBondContact OG-O 3.43Å; S213-T483 VanDerWaalsContact OG-O 3.13Å; W214-T483 HydrophobicContact CZ2-CG2 4.03Å; V215-T483 HydrophobicContact CG2-CG2 3.98Å; F481-T483 PolarHBondContact O-N 3.22Å
484	I	75.3	Confident	84.1	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.021	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	127.1	-170.9	-56.7	166.3	0	0	0	110.5	F211 Q212 L222 M248 V480 F481	F211-I484 HydrophobicContact CB-CG2 4.33Å; F211-I484 HydrophobicContact CD1-CG2 4.24Å; Q212-I484 CarbonylContact O-C 3.57Å; Q212-I484 VanDerWaalsContact O-CA 3.3Å; Q212-I484 WeakPolarHBondContact O-CA 3.19Å; L222-I484 HydrophobicContact CD1-CG1 4.31Å; L222-I484 HydrophobicContact CD1-CG2 4.05Å; L222-I484 HydrophobicContact CD2-CD1 3.84Å; L222-I484 HydrophobicContact CD2-CG1 4.31Å; L222-I484 HydrophobicContact CD2-CG2 4.36Å; M248-I484 HydrophobicContact CE-CD1 3.88Å; M248-I484 HydrophobicContact SD-CD1 3.42Å; M248-I484 WeakPolarHBondContact SD-CD1 3.47Å; V480-I484 PolarHBondContact N-O 3.1Å; F481-I484 HydrophobicContact CB-CB 4.1Å; F481-I484 HydrophobicContact CB-CD1 4.36Å; F481-I484 HydrophobicContact CB-CG1 4.38Å; F481-I484 HydrophobicContact CD2-CD1 4.24Å; F481-I484 PolarHBondContact N-O 3.07Å; F481-I484 PolarHBondContact O-N 2.83Å
485	T	80.2	Confident	84.1	Confident	35 Å²	35	37.6 Å²	37.6	22%	0.215	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.4	171.3	-57.4	0	0	0	0	108.5	Q212 D477 I478	Q212-T485 PolarHBondContact N-O 3.4Å; Q212-T485 PolarHBondContact O-N 2.87Å; D477-T485 HydrophobicContact CB-CG2 3.97Å; I478-T485 CarbonylContact O-C 3.55Å; I478-T485 WeakPolarHBondContact O-CA 3.45Å
486	A	85.1	Confident	84	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130	168.6	0	0	0	0	0	109.9	W209 D210 F211 I478 V480	W209-A486 HydrophobicContact CE3-CB 3.94Å; W209-A486 HydrophobicContact CZ3-CB 4.05Å; D210-A486 CarbonylContact O-C 3.58Å; D210-A486 WeakPolarHBondContact O-CA 3.36Å; F211-A486 HydrophobicContact CD1-CB 3.74Å; F211-A486 HydrophobicContact CE1-CB 3.73Å; F211-A486 HydrophobicContact CG-CB 4.39Å; F211-A486 HydrophobicContact CZ-CB 4.37Å; I478-A486 PolarHBondContact N-O 2.88Å; I478-A486 PolarHBondContact O-N 2.81Å; V480-A486 HydrophobicContact CG2-CB 3.42Å; V480-A486 VanDerWaalsContact CG2-CB 3.42Å
487	T	89.8	Confident	84	Confident	10 Å²	10	45 Å²	45	6%	0.061	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116.1	171.7	-53.2	0	0	0	0	108.1	W209 D210 K475 L476	W209-T487 WeakPolarHBondContact CA-O 3.29Å; D210-T487 PolarHBondContact N-O 3.37Å; D210-T487 PolarHBondContact O-N 3.24Å; K475-T487 HydrophobicContact CD-CG2 4.43Å; K475-T487 VanDerWaalsContact CE-CG2 3.4Å; K475-T487 HydrophobicContact CG-CG2 4.16Å; L476-T487 CarbonylContact O-C 3.55Å; L476-T487 WeakPolarHBondContact O-CA 3.49Å
488	V	91.3	Very high	84.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.5	173.9	-173.2	0	0	0	0	108.6	H208 W209 L460 K475 L476 I478 F490	H208-V488 CarbonylContact O-C 3.56Å; H208-V488 VanDerWaalsContact O-CA 3.31Å; H208-V488 WeakPolarHBondContact O-CA 3.46Å; W209-V488 HydrophobicContact CD2-CG2 3.87Å; W209-V488 HydrophobicContact CE3-CG2 3.51Å; W209-V488 HydrophobicContact CH2-CG2 3.57Å; W209-V488 HydrophobicContact CZ2-CG2 3.93Å; W209-V488 HydrophobicContact CZ3-CG2 3.34Å; L460-V488 HydrophobicContact CD1-CB 4.41Å; L460-V488 HydrophobicContact CD1-CG1 4.23Å; L460-V488 HydrophobicContact CD1-CG2 4.29Å; L460-V488 HydrophobicContact CD2-CG1 4.17Å; K475-V488 CarbonylContact C-O 3.48Å; K475-V488 VanDerWaalsContact CA-O 3.27Å; K475-V488 WeakPolarHBondContact CA-O 3.46Å; L476-V488 HydrophobicContact CB-CB 4.38Å; L476-V488 PolarHBondContact N-O 3.37Å; L476-V488 PolarHBondContact O-N 2.85Å; I478-V488 HydrophobicContact CD1-CG2 3.92Å; V488-F490 HydrophobicContact CG1-CE2 4.21Å
489	T	93.1	Very high	84.9	Confident	25 Å²	25	50.4 Å²	50.4	15%	0.153	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123.4	178.2	-54.5	0	0	0	0	110.4	L207 H208 V332 V474 Q491	L207-T489 CarbonylContact C-O 3.53Å; L207-T489 VanDerWaalsContact CA-O 3.31Å; L207-T489 WeakPolarHBondContact CA-O 3.14Å; H208-T489 PolarHBondContact N-O 2.87Å; H208-T489 PolarHBondContact O-N 3.01Å; V332-T489 HydrophobicContact CG1-CG2 3.43Å; V332-T489 VanDerWaalsContact CG1-CG2 3.43Å; V474-T489 WeakPolarHBondContact O-CA 3.36Å; T489-Q491 HydrophobicContact CG2-CG 4.16Å; T489-Q491 PolarHBondContact O-N 3.26Å
490	F	93.1	Very high	85.6	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	103.9	172.8	-63.8	-102.3	0	0	0	107.8	L205 F437 L444 F472 P473 V474 L476 V488	L205-F490 HydrophobicContact CD1-CD1 3.8Å; L205-F490 HydrophobicContact CD2-CD1 4.41Å; L205-F490 HydrophobicContact CD2-CE1 4.35Å; F437-F490 HydrophobicContact CE2-CB 4.03Å; F437-F490 HydrophobicContact CZ-CB 4.26Å; F437-F490 HydrophobicContact CZ-CD1 4.27Å; L444-F490 HydrophobicContact CD1-CE1 3.99Å; L444-F490 HydrophobicContact CD1-CZ 4.45Å; L444-F490 HydrophobicContact CD2-CE1 3.94Å; L444-F490 HydrophobicContact CD2-CZ 3.7Å; F472-F490 HydrophobicContact CE1-CB 4.48Å; F472-F490 AromaticContact CE1-CD1 3.73Å; F472-F490 HydrophobicContact CE1-CD1 3.73Å; F472-F490 HydrophobicContact CE1-CD2 4.07Å; F472-F490 AromaticContact CE1-CE1 3.91Å; F472-F490 HydrophobicContact CE1-CE1 3.91Å; F472-F490 HydrophobicContact CE1-CE2 4.21Å; F472-F490 AromaticContact CE1-CG 3.84Å; F472-F490 HydrophobicContact CE1-CG 3.84Å; F472-F490 HydrophobicContact CE1-CZ 4.14Å; F472-F490 AromaticContact CZ-CD1 3.97Å; F472-F490 HydrophobicContact CZ-CD1 3.97Å; F472-F490 AromaticContact CZ-CE1 3.77Å; F472-F490 HydrophobicContact CZ-CE1 3.77Å; F472-F490 HydrophobicContact CZ-CZ 4.12Å; P473-F490 WeakPolarHBondContact O-CD2 3.35Å; P473-F490 WeakPolarHBondContact O-CE2 3.49Å; V474-F490 PolarHBondContact O-N 3.14Å; L476-F490 HydrophobicContact CD1-CE2 4.14Å; V488-F490 HydrophobicContact CG1-CE2 4.21Å
491	Q	88.9	Confident	86.6	Confident	76 Å²	76	58 Å²	58	36%	0.355	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-45.7	-172	-74.7	-156.1	11.2	0	0	112.4	E206 H208 T489	E206-Q491 PolarHBondContact O-N 2.81Å; H208-Q491 PolarHBondContact CD2-NE2 3.27Å; H208-Q491 PolarHBondContact CE1-NE2 2.85Å; H208-Q491 PolarHBondContact CE1-OE1 2.99Å; H208-Q491 VanDerWaalsContact ND1-CG 3.29Å; H208-Q491 WeakPolarHBondContact ND1-CG 3.3Å; H208-Q491 PolarHBondContact ND1-NE2 3.02Å; H208-Q491 PolarHBondContact NE2-NE2 3.44Å; T489-Q491 HydrophobicContact CG2-CG 4.16Å; T489-Q491 PolarHBondContact O-N 3.26Å
492	E	91.3	Very high	88	Confident	53 Å²	53	55.8 Å²	55.8	25%	0.248	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141	-175.8	-168.9	173.7	168.8	0	0	110.7	Y204 L205 E206 R494	Y204-E492 HydrophobicContact CD1-CG 4.32Å; Y204-E492 HydrophobicContact CE1-CB 4.26Å; Y204-E492 HydrophobicContact CE1-CG 4.22Å; L205-E492 WeakPolarHBondContact CD1-O 3.34Å; E206-E492 HydrophobicContact CB-CB 4.07Å; E206-E492 PolarHBondContact N-O 3.41Å; E206-E492 PolarHBondContact O-N 3.3Å; E492-R494 IonicContact OE1-CZ 3.08Å; E492-R494 IonicContact OE1-NH1 2.85Å; E492-R494 PolarHBondContact OE1-NH1 3.3Å
493	F	93.9	Very high	89.4	Confident	17 Å²	17	54.2 Å²	54.2	8%	0.075	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	135.3	167.4	177.2	-82.7	0	0	0	108.4	F203 Y204 L205 F335 F437 P438 L439 Y495	F203-F493 HydrophobicContact CB-CE2 3.78Å; F203-F493 HydrophobicContact CB-CZ 3.75Å; F203-F493 HydrophobicContact CD1-CE2 4.37Å; F203-F493 HydrophobicContact CD2-CD2 4.25Å; F203-F493 AromaticContact CD2-CE2 3.66Å; F203-F493 HydrophobicContact CD2-CE2 3.66Å; F203-F493 HydrophobicContact CD2-CZ 4.47Å; F203-F493 HydrophobicContact CE2-CE2 4.4Å; F203-F493 AromaticContact CG-CE2 3.67Å; F203-F493 HydrophobicContact CG-CE2 3.67Å; F203-F493 HydrophobicContact CG-CZ 4.05Å; Y204-F493 WeakPolarHBondContact O-CA 3.49Å; L205-F493 HydrophobicContact CB-CD2 4.35Å; L205-F493 HydrophobicContact CD1-CB 4.43Å; L205-F493 HydrophobicContact CD1-CD2 4.25Å; F335-F493 HydrophobicContact CZ-CB 4.11Å; F437-F493 HydrophobicContact CE1-CB 4.26Å; F437-F493 HydrophobicContact CE1-CD2 4.15Å; F437-F493 HydrophobicContact CE1-CG 4.23Å; F437-F493 HydrophobicContact CE2-CB 3.99Å; F437-F493 HydrophobicContact CZ-CB 3.62Å; F437-F493 HydrophobicContact CZ-CD2 4.18Å; F437-F493 HydrophobicContact CZ-CG 4.07Å; P438-F493 HydrophobicContact CB-CD1 3.83Å; P438-F493 HydrophobicContact CB-CE1 3.55Å; P438-F493 HydrophobicContact CB-CZ 4.42Å; P438-F493 HydrophobicContact CG-CD1 3.62Å; P438-F493 HydrophobicContact CG-CE1 3.88Å; L439-F493 HydrophobicContact CB-CD2 4.39Å; L439-F493 HydrophobicContact CB-CE2 3.96Å; L439-F493 HydrophobicContact CB-CZ 4.31Å; L439-F493 HydrophobicContact CD1-CE2 4.1Å; L439-F493 HydrophobicContact CD1-CZ 4.35Å; L439-F493 HydrophobicContact CD2-CE2 4.24Å; L439-F493 HydrophobicContact CG-CE2 4.32Å; F493-Y495 HydrophobicContact CE1-CD1 4.44Å; F493-Y495 HydrophobicContact CE1-CD2 4.23Å; F493-Y495 HydrophobicContact CE1-CE1 4.2Å; F493-Y495 AromaticContact CE1-CE2 3.99Å; F493-Y495 HydrophobicContact CE1-CE2 3.99Å; F493-Y495 HydrophobicContact CE1-CG 4.46Å; F493-Y495 AromaticContact CE1-CZ 3.97Å; F493-Y495 HydrophobicContact CZ-CD1 4.34Å; F493-Y495 AromaticContact CZ-CE1 3.95Å; F493-Y495 HydrophobicContact CZ-CE1 3.95Å
494	R	93.9	Very high	90.7	Very high	108 Å²	108	55.6 Å²	55.6	41%	0.408	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	145.3	170.3	59.7	-176.6	-166.1	-126.7	3.7	110.4	F203 Y204 E492 D496	F203-R494 CarbonylContact C-O 3.51Å; F203-R494 VanDerWaalsContact CA-O 3.28Å; F203-R494 WeakPolarHBondContact CA-O 3.48Å; F203-R494 WeakPolarHBondContact CB-O 3.39Å; Y204-R494 HydrophobicContact CD1-CG 4.25Å; Y204-R494 PolarHBondContact N-O 3.24Å; Y204-R494 PolarHBondContact O-N 3.37Å; Y204-R494 VanDerWaalsContact O-N 3.07Å; E492-R494 IonicContact OE1-CZ 3.08Å; E492-R494 IonicContact OE1-NH1 2.85Å; E492-R494 PolarHBondContact OE1-NH1 3.3Å; R494-D496 HydrophobicContact CG-CB 4.38Å; R494-D496 IonicContact CZ-OD2 3.62Å; R494-D496 IonicContact NE-OD2 3.41Å; R494-D496 PolarHBondContact NE-OD2 2.87Å; R494-D496 IonicContact NH2-OD2 2.63Å; R494-D496 PolarHBondContact NH2-OD2 2.81Å; R494-D496 VanDerWaalsContact NH2-OD2 3.08Å
495	Y	94.4	Very high	91.6	Very high	141 Å²	141	57.9 Å²	57.9	55%	0.553	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	132.8	162.4	-63.8	-70.9	0	0	0	108	D202 F203 P438 F493	D202-Y495 WeakPolarHBondContact O-CA 3.37Å; D202-Y495 WeakPolarHBondContact O-CD1 3.49Å; F203-Y495 HydrophobicContact CB-CD1 4.29Å; P438-Y495 HydrophobicContact CB-CE2 4.08Å; F493-Y495 HydrophobicContact CE1-CD1 4.44Å; F493-Y495 HydrophobicContact CE1-CD2 4.23Å; F493-Y495 HydrophobicContact CE1-CE1 4.2Å; F493-Y495 AromaticContact CE1-CE2 3.99Å; F493-Y495 HydrophobicContact CE1-CE2 3.99Å; F493-Y495 HydrophobicContact CE1-CG 4.46Å; F493-Y495 AromaticContact CE1-CZ 3.97Å; F493-Y495 HydrophobicContact CZ-CD1 4.34Å; F493-Y495 AromaticContact CZ-CE1 3.95Å; F493-Y495 HydrophobicContact CZ-CE1 3.95Å
496	D	93.2	Very high	92.3	Very high	53 Å²	53	58.3 Å²	58.3	28%	0.283	29%	0.288	S	S	.	.			trans	-153.4	154.7	-172.5	-149.9	-10.4	0	0	0	109.2	D202 R494 F498	D202-D496 CarbonylContact C-O 3.59Å; D202-D496 VanDerWaalsContact CB-O 3.28Å; D202-D496 WeakPolarHBondContact CB-O 3.31Å; D202-D496 PolarHBondContact O-N 3.48Å; R494-D496 HydrophobicContact CG-CB 4.38Å; R494-D496 IonicContact CZ-OD2 3.62Å; R494-D496 IonicContact NE-OD2 3.41Å; R494-D496 PolarHBondContact NE-OD2 2.87Å; R494-D496 IonicContact NH2-OD2 2.63Å; R494-D496 PolarHBondContact NH2-OD2 2.81Å; R494-D496 VanDerWaalsContact NH2-OD2 3.08Å; D496-F498 HydrophobicContact CB-CE1 3.8Å; D496-F498 HydrophobicContact CB-CE2 4.27Å; D496-F498 HydrophobicContact CB-CZ 3.59Å
497	E	91.6	Very high	92.7	Very high	173 Å²	173	65.5 Å²	65.5	81%	0.808	33%	0.333	S	S	*	.			trans	-109.9	139.7	173.7	-70.9	-177.8	-178.2	0	0	108.6
498	F	93.5	Very high	93	Very high	30 Å²	30	69 Å²	69	13%	0.132	35%	0.351	C	S	.	.			trans	-125.9	152	-174	-52.7	-68.8	0	0	0	110.5	F203 Y230 K231 H232 D496 E500 I502 F503	F203-F498 VanDerWaalsContact O-CE2 3.3Å; F203-F498 WeakPolarHBondContact O-CE2 3.29Å; Y230-F498 HydrophobicContact CD1-CD1 4.01Å; Y230-F498 AromaticContact CD1-CE1 3.61Å; Y230-F498 HydrophobicContact CD1-CE1 3.61Å; Y230-F498 AromaticContact CD1-CZ 3.9Å; Y230-F498 HydrophobicContact CD1-CZ 3.9Å; Y230-F498 HydrophobicContact CE1-CE1 4.25Å; K231-F498 WeakPolarHBondContact O-CE2 3.32Å; H232-F498 HydrophobicContact CB-CD2 4.4Å; D496-F498 HydrophobicContact CB-CE1 3.8Å; D496-F498 HydrophobicContact CB-CE2 4.27Å; D496-F498 HydrophobicContact CB-CZ 3.59Å; F498-E500 PolarHBondContact O-N 3.15Å; F498-I502 HydrophobicContact CB-CD1 3.85Å; F498-I502 HydrophobicContact CD1-CD1 4.29Å; F498-I502 HydrophobicContact CG-CD1 4.15Å; F498-F503 HydrophobicContact CB-CE2 3.87Å; F498-F503 HydrophobicContact CB-CZ 4.39Å; F498-F503 HydrophobicContact CD2-CE2 4.44Å; F498-F503 HydrophobicContact CD2-CZ 4.18Å; F498-F503 HydrophobicContact CG-CE2 4.46Å
499	D	92.3	Very high	93.3	Very high	111 Å²	111	70.7 Å²	70.7	59%	0.594	36%	0.357	S	S	*	.			trans	-66.5	130	168.3	-164.3	-56.3	0	0	0	109.6	S501 I502	D499-S501 PolarHBondContact O-N 3.15Å; D499-S501 WeakPolarHBondContact OD1-CB 3.31Å; D499-S501 PolarHBondContact OD1-N 3.41Å; D499-S501 PolarHBondContact OD1-OG 3.34Å; D499-S501 VanDerWaalsContact OD1-OG 3.11Å; D499-I502 WeakPolarHBondContact O-CG1 3.27Å; D499-I502 PolarHBondContact O-N 2.99Å
500	E	89.4	Confident	93.4	Very high	138 Å²	138	77 Å²	77	65%	0.645	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-55.2	-26.6	177.5	-70.3	-174.1	-175.1	0	0	112.3	H232 F498 I502 F503	H232-E500 IonicContact NE2-OE1 2.84Å; F498-E500 PolarHBondContact O-N 3.15Å; E500-I502 PolarHBondContact O-N 2.97Å; E500-I502 VanDerWaalsContact O-N 3.17Å; E500-F503 PolarHBondContact O-N 3.35Å
501	S	92.3	Very high	93.5	Very high	66 Å²	66	81 Å²	81	46%	0.462	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-58.1	-31.5	-179.1	76	0	0	0	0	113.1	D499 F503 T504	D499-S501 PolarHBondContact O-N 3.15Å; D499-S501 WeakPolarHBondContact OD1-CB 3.31Å; D499-S501 PolarHBondContact OD1-N 3.41Å; D499-S501 PolarHBondContact OD1-OG 3.34Å; D499-S501 VanDerWaalsContact OD1-OG 3.11Å; S501-F503 PolarHBondContact O-N 2.92Å; S501-T504 PolarHBondContact O-N 2.6Å; S501-T504 VanDerWaalsContact O-N 3.14Å; S501-T504 PolarHBondContact O-OG1 2.78Å
502	I	93.9	Very high	93.5	Very high	46 Å²	46	79.6 Å²	79.6	24%	0.236	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-69.2	-17.6	-178.6	78.9	176	0	0	0	112.3	Y230 R237 F498 D499 E500 T504	Y230-I502 HydrophobicContact CD1-CD1 4.16Å; Y230-I502 HydrophobicContact CG-CD1 4.26Å; R237-I502 WeakPolarHBondContact CD-O 3.5Å; R237-I502 PolarHBondContact NH1-O 3.29Å; F498-I502 HydrophobicContact CB-CD1 3.85Å; F498-I502 HydrophobicContact CD1-CD1 4.29Å; F498-I502 HydrophobicContact CG-CD1 4.15Å; D499-I502 WeakPolarHBondContact O-CG1 3.27Å; D499-I502 PolarHBondContact O-N 2.99Å; E500-I502 PolarHBondContact O-N 2.97Å; E500-I502 VanDerWaalsContact O-N 3.17Å; I502-T504 VanDerWaalsContact C-N 3.35Å
503	F	94.6	Very high	93.2	Very high	6 Å²	6	81.5 Å²	81.5	3%	0.026	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-97	15.9	177.3	-57.7	-89.4	0	0	0	112.5	Y230 H232 N235 R237 I258 F498 E500 S501	Y230-F503 WeakPolarHBondContact O-CE1 3.41Å; H232-F503 HydrophobicContact CB-CD2 4.11Å; H232-F503 HydrophobicContact CB-CE1 4.15Å; H232-F503 HydrophobicContact CB-CE2 3.37Å; H232-F503 HydrophobicContact CB-CZ 3.4Å; N235-F503 HydrophobicContact CB-CB 4.21Å; N235-F503 HydrophobicContact CB-CD1 3.81Å; N235-F503 HydrophobicContact CB-CE1 4.47Å; N235-F503 HydrophobicContact CB-CG 4.12Å; R237-F503 HydrophobicContact CB-CD1 3.82Å; R237-F503 HydrophobicContact CB-CE1 3.83Å; I258-F503 WeakPolarHBondContact CG2-O 3.39Å; F498-F503 HydrophobicContact CB-CE2 3.87Å; F498-F503 HydrophobicContact CB-CZ 4.39Å; F498-F503 HydrophobicContact CD2-CE2 4.44Å; F498-F503 HydrophobicContact CD2-CZ 4.18Å; F498-F503 HydrophobicContact CG-CE2 4.46Å; E500-F503 PolarHBondContact O-N 3.35Å; S501-F503 PolarHBondContact O-N 2.92Å
504	T	93.6	Very high	92.6	Very high	75 Å²	75	85 Å²	85	46%	0.46	44%	0.44	S	S	.	.	S	Bend	trans	-124.4	157.7	177.4	65.7	0	0	0	0	110.5	S501 I502 P506	S501-T504 PolarHBondContact O-N 2.6Å; S501-T504 VanDerWaalsContact O-N 3.14Å; S501-T504 PolarHBondContact O-OG1 2.78Å; I502-T504 VanDerWaalsContact C-N 3.35Å; T504-P506 WeakPolarHBondContact O-CD 3.34Å
505	I	94.4	Very high	92.1	Very high	52 Å²	52	83.3 Å²	83.3	27%	0.267	43%	0.433	S	S	.	.			trans	-70.5	124.3	174.7	-58.4	162.8	0	0	0	107.6	V270 Y279	V270-I505 HydrophobicContact CG1-CD1 4.43Å; V270-I505 HydrophobicContact CG1-CG1 4.16Å; V270-I505 HydrophobicContact CG2-CD1 4.06Å; V270-I505 HydrophobicContact CG2-CG1 4.25Å; Y279-I505 HydrophobicContact CD1-CG2 3.49Å; Y279-I505 VanDerWaalsContact CD1-CG2 3.49Å; Y279-I505 HydrophobicContact CD2-CD1 3.79Å; Y279-I505 HydrophobicContact CD2-CG1 4.5Å; Y279-I505 HydrophobicContact CD2-CG2 4.48Å; Y279-I505 HydrophobicContact CE1-CD1 4.49Å; Y279-I505 HydrophobicContact CE1-CG2 3.71Å; Y279-I505 HydrophobicContact CE2-CD1 3.65Å; Y279-I505 HydrophobicContact CG-CD1 4.26Å; Y279-I505 HydrophobicContact CG-CG2 3.89Å
506	P	94.9	Very high	91.3	Very high	44 Å²	44	77.1 Å²	77.1	29%	0.286	41%	0.409	S	S	.	.			trans	-61.1	142.7	177.4	-20.8	31.9	0	0	0	111.4	L272 T504 D508 Y509	L272-P506 HydrophobicContact CD2-CG 4.41Å; T504-P506 WeakPolarHBondContact O-CD 3.34Å; P506-D508 WeakPolarHBondContact CB-OD1 3.21Å; P506-D508 PolarHBondContact O-N 2.63Å; P506-D508 VanDerWaalsContact O-N 3.14Å; P506-Y509 HydrophobicContact CB-CD2 3.56Å; P506-Y509 HydrophobicContact CB-CE2 3.73Å; P506-Y509 HydrophobicContact CB-CG 4.27Å; P506-Y509 HydrophobicContact CG-CD2 3.84Å; P506-Y509 HydrophobicContact CG-CE2 3.69Å; P506-Y509 HydrophobicContact CG-CG 4.31Å; P506-Y509 WeakPolarHBondContact O-CB 3.15Å; P506-Y509 PolarHBondContact O-N 3.21Å
507	T	94	Very high	89.9	Confident	152 Å²	152	79.5 Å²	79.5	93%	0.933	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21	-172.6	52.3	0	0	0	0	114.3	Y509	T507-Y509 VanDerWaalsContact C-N 3.32Å
508	D	95.6	Very high	88.5	Confident	83 Å²	83	78 Å²	78	44%	0.444	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-2	177.3	65.1	-44.3	0	0	0	113.5	K277 P506	K277-D508 IonicContact NZ-OD2 2.67Å; K277-D508 PolarHBondContact NZ-OD2 3.33Å; P506-D508 WeakPolarHBondContact CB-OD1 3.21Å; P506-D508 PolarHBondContact O-N 2.63Å; P506-D508 VanDerWaalsContact O-N 3.14Å
509	Y	96.6	Very high	87	Confident	36 Å²	36	79.9 Å²	79.9	14%	0.141	44%	0.436	C	S	.	.			trans	-87.1	147	-180	-76.5	-136.3	0	0	0	111.2	L272 N274 K277 P506 T507	L272-Y509 HydrophobicContact CB-CE1 4.18Å; L272-Y509 HydrophobicContact CD2-CD1 4.21Å; L272-Y509 HydrophobicContact CD2-CE1 4.05Å; L272-Y509 HydrophobicContact CG-CD1 4.45Å; L272-Y509 HydrophobicContact CG-CE1 4.45Å; N274-Y509 VanDerWaalsContact CA-OH 3.3Å; N274-Y509 WeakPolarHBondContact CA-OH 3.36Å; N274-Y509 PolarHBondContact OD1-OH 3.34Å; N274-Y509 VanDerWaalsContact OD1-OH 3.08Å; K277-Y509 HydrophobicContact CB-CD2 3.97Å; K277-Y509 HydrophobicContact CB-CE2 4.02Å; K277-Y509 HydrophobicContact CB-CG 4.24Å; K277-Y509 HydrophobicContact CG-CD2 4.42Å; K277-Y509 HydrophobicContact CG-CE2 4.01Å; K277-Y509 VanDerWaalsContact O-CA 3.23Å; K277-Y509 WeakPolarHBondContact O-CA 3.29Å; P506-Y509 HydrophobicContact CB-CD2 3.56Å; P506-Y509 HydrophobicContact CB-CE2 3.73Å; P506-Y509 HydrophobicContact CB-CG 4.27Å; P506-Y509 HydrophobicContact CG-CD2 3.84Å; P506-Y509 HydrophobicContact CG-CE2 3.69Å; P506-Y509 HydrophobicContact CG-CG 4.31Å; P506-Y509 WeakPolarHBondContact O-CB 3.15Å; P506-Y509 PolarHBondContact O-N 3.21Å; T507-Y509 VanDerWaalsContact C-N 3.32Å
510	K	96.3	Very high	86.7	Confident	158 Å²	158	78.3 Å²	78.3	69%	0.687	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	144	178.2	-65.4	-178.2	-178.7	177	0	111.2	K277 V278 Y279 D512	K277-K510 PolarHBondContact O-N 3.49Å; V278-K510 CarbonylContact C-O 3.58Å; V278-K510 WeakPolarHBondContact CA-O 3.26Å; V278-K510 WeakPolarHBondContact CB-O 3.19Å; Y279-K510 WeakPolarHBondContact CD1-O 3.17Å; Y279-K510 PolarHBondContact N-O 2.96Å; K510-D512 PolarHBondContact O-N 2.95Å
511	E	94	Very high	86.6	Confident	83 Å²	83	75.2 Å²	75.2	39%	0.388	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	127.7	173.4	-168.2	164.4	-159.7	0	0	109.9	Y279 R281 P513	Y279-E511 HydrophobicContact CD1-CB 4.5Å; Y279-E511 HydrophobicContact CD2-CB 4.48Å; Y279-E511 HydrophobicContact CD2-CG 4.33Å; Y279-E511 HydrophobicContact CE1-CB 3.91Å; Y279-E511 HydrophobicContact CE2-CB 3.87Å; Y279-E511 HydrophobicContact CE2-CG 3.83Å; Y279-E511 CarbonylContact O-C 3.5Å; Y279-E511 VanDerWaalsContact O-CA 3.31Å; Y279-E511 WeakPolarHBondContact O-CA 3.08Å; R281-E511 IonicContact CZ-OE1 3.72Å; R281-E511 IonicContact CZ-OE2 2.79Å; R281-E511 IonicContact NH1-OE1 3.95Å; R281-E511 PolarHBondContact NH1-OE1 2.81Å; R281-E511 IonicContact NH1-OE2 2.74Å; R281-E511 PolarHBondContact NH1-OE2 3.19Å; E511-P513 HydrophobicContact CG-CG 4.32Å
512	D	90.4	Very high	86.3	Confident	46 Å²	46	75.7 Å²	75.7	25%	0.246	42%	0.415	C	S	.	.			trans	-129.5	96.2	170.1	-177.2	-5.7	0	0	0	108.6	V278 Y279 K510 S514 R515	V278-D512 HydrophobicContact CB-CB 4Å; V278-D512 HydrophobicContact CG1-CB 4.27Å; V278-D512 HydrophobicContact CG2-CB 4.28Å; Y279-D512 PolarHBondContact O-N 2.88Å; K510-D512 PolarHBondContact O-N 2.95Å; D512-S514 PolarHBondContact O-N 3.26Å; D512-S514 VanDerWaalsContact O-N 3.11Å; D512-S514 PolarHBondContact OD1-N 3.41Å; D512-S514 PolarHBondContact OD1-OG 3.41Å; D512-R515 HydrophobicContact CB-CB 4.17Å; D512-R515 PolarHBondContact O-N 3.48Å; D512-R515 PolarHBondContact OD1-N 3.26Å
513	P	84.1	Confident	85.8	Confident	94 Å²	94	77.4 Å²	77.4	61%	0.61	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-10.6	179.6	-21.6	33.8	0	0	0	114.5	Q280 E511	Q280-P513 PolarHBondContact OE1-O 3.3Å; E511-P513 HydrophobicContact CG-CG 4.32Å
514	S	82.2	Confident	85.3	Confident	90 Å²	90	81.9 Å²	81.9	63%	0.629	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-0.2	-176.8	67.9	0	0	0	0	113.6	D512	D512-S514 PolarHBondContact O-N 3.26Å; D512-S514 VanDerWaalsContact O-N 3.11Å; D512-S514 PolarHBondContact OD1-N 3.41Å; D512-S514 PolarHBondContact OD1-OG 3.41Å
515	R	82.8	Confident	84.7	Confident	72 Å²	72	82.3 Å²	82.3	27%	0.272	45%	0.449	S	S	.	.	S	Bend	trans	-66.3	-41.9	-173	179.1	62.7	-169	133.3	3.7	112.4	D273 Q276 V278 D512	D273-R515 IonicContact OD2-CZ 3.19Å; D273-R515 IonicContact OD2-NE 3.43Å; D273-R515 PolarHBondContact OD2-NE 2.67Å; D273-R515 IonicContact OD2-NH2 2.67Å; D273-R515 PolarHBondContact OD2-NH2 3.34Å; Q276-R515 VanDerWaalsContact NE2-NH2 3.1Å; V278-R515 HydrophobicContact CG2-CB 4.3Å; V278-R515 HydrophobicContact CG2-CG 3.87Å; D512-R515 HydrophobicContact CB-CB 4.17Å; D512-R515 PolarHBondContact O-N 3.48Å; D512-R515 PolarHBondContact OD1-N 3.26Å
516	F	76.8	Confident	84	Confident	11 Å²	11	84.5 Å²	84.5	5%	0.048	46%	0.462	C	S	.	.			trans	-124	76.2	-178.3	-52.3	-74.6	0	0	0	108.9	I243 L255 V271 D273 Q280 D518 L519	I243-F516 HydrophobicContact CG2-CD1 4.49Å; I243-F516 HydrophobicContact CG2-CE1 4.37Å; L255-F516 HydrophobicContact CD1-CE1 4.01Å; L255-F516 HydrophobicContact CD1-CZ 4.39Å; L255-F516 HydrophobicContact CD2-CE1 3.83Å; L255-F516 HydrophobicContact CD2-CZ 3.61Å; V271-F516 HydrophobicContact CB-CD2 3.99Å; V271-F516 HydrophobicContact CB-CE2 3.9Å; V271-F516 HydrophobicContact CG1-CD2 3.9Å; V271-F516 HydrophobicContact CG1-CE1 4.38Å; V271-F516 HydrophobicContact CG1-CE2 3.53Å; V271-F516 HydrophobicContact CG1-CG 4.45Å; V271-F516 HydrophobicContact CG1-CZ 3.8Å; D273-F516 HydrophobicContact CB-CE2 4.45Å; D273-F516 HydrophobicContact CB-CZ 3.91Å; Q280-F516 HydrophobicContact CB-CD2 3.94Å; Q280-F516 PolarHBondContact NE2-O 3.32Å; Q280-F516 PolarHBondContact OE1-O 3.46Å; F516-D518 PolarHBondContact O-N 3.49Å; F516-D518 VanDerWaalsContact O-N 3.08Å; F516-L519 HydrophobicContact CB-CB 4Å; F516-L519 HydrophobicContact CB-CD1 4.03Å; F516-L519 HydrophobicContact CB-CG 4.26Å; F516-L519 HydrophobicContact CG-CD1 4.3Å; F516-L519 PolarHBondContact O-N 3.36Å; F516-L519 VanDerWaalsContact O-N 3.12Å
517	P	65.4	Low	83.2	Confident	104 Å²	104	87.6 Å²	87.6	68%	0.675	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-19	-175.8	26.9	-35.3	0	0	0	113.3
518	D	62.3	Low	82.3	Confident	142 Å²	142	82.3 Å²	82.3	76%	0.759	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	0.3	-180	-57.9	-50.8	0	0	0	114.2	F516	F516-D518 PolarHBondContact O-N 3.49Å; F516-D518 VanDerWaalsContact O-N 3.08Å
519	L	61.2	Low	81.1	Confident	68 Å²	68	82.2 Å²	82.2	36%	0.356	44%	0.437	S	S	.	.			trans	-124.4	0	-177.2	-66.3	179.7	0	0	0	111.9	F257 V271 Q280 I282 F454 F516	F257-L519 HydrophobicContact CE1-CD1 4.06Å; F257-L519 HydrophobicContact CZ-CD1 4.37Å; V271-L519 HydrophobicContact CG1-CD1 4.48Å; V271-L519 HydrophobicContact CG2-CD1 4.05Å; Q280-L519 PolarHBondContact NE2-OXT 2.94Å; I282-L519 WeakPolarHBondContact CG2-O 3.27Å; F454-L519 HydrophobicContact CD1-CD2 4.31Å; F454-L519 HydrophobicContact CE1-CD1 4.2Å; F454-L519 HydrophobicContact CE1-CD2 3.78Å; F516-L519 HydrophobicContact CB-CB 4Å; F516-L519 HydrophobicContact CB-CD1 4.03Å; F516-L519 HydrophobicContact CB-CG 4.26Å; F516-L519 HydrophobicContact CG-CD1 4.3Å; F516-L519 PolarHBondContact O-N 3.36Å; F516-L519 VanDerWaalsContact O-N 3.12Å

Retrieved 519 of 519 residues in 1960 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).