A0A087YGS2_POEFO Loading...

Growth factor receptor bound protein 14

AlphaFold DB , UniProt , Accession A0A087YGS2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 529 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	33.6	Very low	225 Å²	225	144.5 Å²	144.5	100%	1.108	75%	0.752	S	S	*	*				0	107.9	0	-68.3	170.8	177.5	0	0	106.1
2	N	30	Very low	33	Very low	139 Å²	139	139.4 Å²	139.4	74%	0.743	76%	0.761	S	S	*	*				88.3	132.1	86.9	-74.6	0.1	0	0	0	111.1
3	K	38.5	Very low	32.6	Very low	175 Å²	175	134.6 Å²	134.6	76%	0.761	76%	0.764	S	S	*	*			cis	-148.1	178.2	-13.7	-88.7	175.1	-179.2	179.4	0	105.5
4	T	37.6	Very low	32.5	Very low	121 Å²	121	138.4 Å²	138.4	74%	0.742	78%	0.78	S	S	*	*			cis	-167.4	137.7	40.4	-42.4	0	0	0	0	105.9
5	L	39.3	Very low	32.3	Very low	139 Å²	139	134.4 Å²	134.4	73%	0.728	78%	0.781	S	S	*	*				40.2	140.1	88.1	-80.4	74.1	0	0	0	114
6	D	34.9	Very low	32.4	Very low	108 Å²	108	138.1 Å²	138.1	58%	0.578	79%	0.789	S	S	*	*			cis	-157.4	179.1	16	-100.1	-27.6	0	0	0	108.2
7	K	32.7	Very low	32.3	Very low	156 Å²	156	142.2 Å²	142.2	68%	0.678	80%	0.796	S	S	*	*			cis	-160	139.5	-6.9	-111.2	156.5	-176.5	138.6	0	107.6
8	I	33.7	Very low	32.1	Very low	130 Å²	130	139.4 Å²	139.4	67%	0.667	79%	0.794	S	S	*	*				58	112.8	91.5	-56.4	178.7	0	0	0	117.2
9	H	29.1	Very low	31.9	Very low	173 Å²	173	141 Å²	141	80%	0.801	79%	0.794	S	S	*	*				178.2	132.1	128.9	-96.5	-80.4	0	0	0	107.2
10	T	30.1	Very low	31.8	Very low	111 Å²	111	140.5 Å²	140.5	68%	0.681	79%	0.789	S	S	*	*			cis	78.4	122.6	41.7	-52.9	0	0	0	0	111.2
11	S	30	Very low	31.6	Very low	112 Å²	112	144 Å²	144	78%	0.783	80%	0.796	S	S	*	*			cis	-174.2	165.5	0.2	49.2	0	0	0	0	112.9
12	G	27.3	Very low	31.4	Very low	84 Å²	84	141.4 Å²	141.4	87%	0.866	78%	0.781	S	S	*	*			trans	95.7	156.8	157.6	0	0	0	0	0	116.4
13	G	27	Very low	31.3	Very low	77 Å²	77	140.3 Å²	140.3	79%	0.794	78%	0.784	S	S	*	*			cis	-175.6	160.6	-3.8	0	0	0	0	0	111.5
14	L	32.1	Very low	30.7	Very low	188 Å²	188	135.8 Å²	135.8	98%	0.984	79%	0.787	S	S	*	*			trans	-75.9	148.8	179.9	-81.1	82.6	0	0	0	112.6
15	G	28.7	Very low	30.4	Very low	78 Å²	78	139.7 Å²	139.7	80%	0.804	79%	0.794	S	S	*	*			trans	-156.9	114.1	167.1	0	0	0	0	0	111.9
16	Q	33.4	Very low	29.7	Very low	193 Å²	193	136.3 Å²	136.3	90%	0.902	79%	0.792	S	S	*	*			trans	-82	150	172.1	-66.5	174	-19.1	0	0	110.8
17	K	30.9	Very low	29.4	Very low	208 Å²	208	139 Å²	139	90%	0.904	81%	0.807	S	S	*	*			trans	-161.1	154.8	135	-115.2	177.8	-177.7	-169.2	0	111.6
18	A	28.7	Very low	29.1	Very low	92 Å²	92	140.2 Å²	140.2	76%	0.76	82%	0.815	S	S	*	*			trans	-139.8	148.1	178.2	0	0	0	0	0	109.8
19	E	29.2	Very low	28.8	Very low	170 Å²	170	144.6 Å²	144.6	79%	0.794	82%	0.823	S	S	*	*			trans	-158.3	114.5	161.3	-106.6	154.5	-149.7	0	0	105.7
20	N	28.5	Very low	28.9	Very low	130 Å²	130	142.4 Å²	142.4	70%	0.695	82%	0.822	S	S	*	*				76.1	104.5	82.4	-75.4	-32.9	0	0	0	113.8
21	F	28.7	Very low	28.8	Very low	215 Å²	215	145.3 Å²	145.3	94%	0.943	83%	0.825	S	S	*	*			trans	-134.9	155	144.9	-112	-86.1	0	0	0	109.3
22	H	29.5	Very low	29	Very low	171 Å²	171	145.3 Å²	145.3	79%	0.792	82%	0.822	S	S	*	*			trans	-125.3	156	-156.8	-120.9	61.7	0	0	0	113.5
23	S	28.1	Very low	29.1	Very low	116 Å²	116	152.7 Å²	152.7	81%	0.811	82%	0.824	S	S	*	*			trans	74.1	117	157.6	-159.1	0	0	0	0	119.1
24	G	26	Very low	29.4	Very low	79 Å²	79	155 Å²	155	81%	0.814	83%	0.825	S	S	*	*			trans	-161.7	117.5	163.3	0	0	0	0	0	109
25	K	30.3	Very low	29.1	Very low	204 Å²	204	150.5 Å²	150.5	89%	0.887	82%	0.815	S	S	*	*			trans	-85.2	125.2	-166.1	-70.5	-179.9	177.6	178.2	0	113.7
26	G	25.1	Very low	29.1	Very low	68 Å²	68	154.8 Å²	154.8	70%	0.701	82%	0.817	S	S	*	*				52.8	127.8	125.4	0	0	0	0	0	121.4
27	N	27.7	Very low	29	Very low	164 Å²	164	152.4 Å²	152.4	88%	0.877	81%	0.809	S	S	*	*				-160.5	126.2	127.3	-109	-31.9	0	0	0	110.8
28	E	26.6	Very low	28.7	Very low	181 Å²	181	147.9 Å²	147.9	85%	0.846	80%	0.801	S	S	*	*			trans	-79	144.1	169.1	-62.8	-179.4	128.6	0	0	110.1
29	R	28.4	Very low	28.7	Very low	222 Å²	222	151.4 Å²	151.4	84%	0.838	81%	0.807	S	S	*	*			trans	-137.5	89.6	162.8	-77.7	-163.8	173.4	-161.1	-1.2	110.7
30	V	29.5	Very low	28.6	Very low	128 Å²	128	152.2 Å²	152.2	78%	0.776	81%	0.81	S	S	*	*			trans	-72.8	124.9	167.1	178.2	0	0	0	0	109.1
31	F	29.2	Very low	28.6	Very low	172 Å²	172	149.2 Å²	149.2	75%	0.754	81%	0.81	S	S	*	*			trans	-139.8	159.3	164.6	-83.7	-70.6	0	0	0	109.2
32	P	34	Very low	28.6	Very low	112 Å²	112	145.5 Å²	145.5	73%	0.727	81%	0.808	S	S	*	*				-105.4	166.4	-129	38.4	-38.4	0	0	0	115.7
33	R	30.2	Very low	28.4	Very low	239 Å²	239	142.8 Å²	142.8	90%	0.902	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-62.4	136.2	164.7	-68.8	178.2	173.8	174.4	-3	110.7
34	P	31.8	Very low	28.4	Very low	125 Å²	125	145 Å²	145	81%	0.812	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-62.5	149.8	162	-20.8	33.7	0	0	0	111.6
35	A	27.1	Very low	28.4	Very low	93 Å²	93	147.6 Å²	147.6	77%	0.769	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80.1	149.3	178.8	0	0	0	0	0	112.3
36	I	28.7	Very low	28.7	Very low	168 Å²	168	142.7 Å²	142.7	86%	0.862	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-82.1	122.9	168.8	-62.5	168	0	0	0	107.9
37	I	30.4	Very low	28.8	Very low	143 Å²	143	146.8 Å²	146.8	73%	0.733	81%	0.805	S	S	*	*			trans	-109.4	118.6	170.1	-60.5	177	0	0	0	107.5
38	P	25.9	Very low	28.8	Very low	113 Å²	113	142.5 Å²	142.5	73%	0.734	79%	0.792	S	S	*	*			trans	-76.9	146	170.1	32.8	-33	0	0	0	110.2
39	L	27.1	Very low	28.8	Very low	167 Å²	167	141.8 Å²	141.8	87%	0.874	79%	0.789	S	S	*	*			trans	-128.7	143.8	166.5	-91.7	168.3	0	0	0	109.8
40	E	28.4	Very low	28.7	Very low	187 Å²	187	141.2 Å²	141.2	87%	0.874	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-86.9	151.4	-160	-61.5	167	114.4	0	0	113
41	G	27.9	Very low	28.5	Very low	67 Å²	67	142.4 Å²	142.4	69%	0.691	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-82.7	137	167	0	0	0	0	0	111	S43	G41-S43 PolarHBondContact O-N 3.37Å
42	P	29.9	Very low	28.3	Very low	137 Å²	137	144.7 Å²	144.7	89%	0.89	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-63.2	128.1	178.4	-22.6	33.7	0	0	0	112.5
43	S	25.3	Very low	27.9	Very low	114 Å²	114	146.4 Å²	146.4	80%	0.797	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-84.5	142.6	175.3	47.7	0	0	0	0	112.2	G41	G41-S43 PolarHBondContact O-N 3.37Å
44	L	26.1	Very low	27.8	Very low	162 Å²	162	142.6 Å²	142.6	85%	0.848	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-77.4	149	164.6	-75.6	162.8	0	0	0	110.4
45	T	26.3	Very low	27.4	Very low	133 Å²	133	145.5 Å²	145.5	82%	0.816	80%	0.797	S	S	*	*			trans	159.1	167.8	148.2	38.5	0	0	0	0	110.5
46	P	37.9	Very low	27.2	Very low	102 Å²	102	146.6 Å²	146.6	66%	0.662	80%	0.797	S	S	*	*			cis	-134.9	-153	-45.1	39.9	-23.2	0	0	0	111.4
47	N	26.4	Very low	27.2	Very low	154 Å²	154	148 Å²	148	82%	0.824	80%	0.797	S	S	*	*			trans	79.4	139.4	166.2	-71.7	-18.3	0	0	0	117.8
48	A	27.3	Very low	26.9	Very low	74 Å²	74	145 Å²	145	61%	0.612	80%	0.802	S	S	*	*			cis	-160	154.6	-14.2	0	0	0	0	0	111.9
49	Q	26.3	Very low	26.9	Very low	165 Å²	165	146 Å²	146	77%	0.771	80%	0.801	S	S	*	*			trans	39.8	150.7	136.3	-66.6	-165.5	34.1	0	0	122.1
50	R	26.4	Very low	26.9	Very low	210 Å²	210	150.1 Å²	150.1	79%	0.792	81%	0.805	S	S	*	*			cis	175.4	115	-12	170.6	-167	-160	-175.3	6	107.9
51	T	25.6	Very low	26.8	Very low	153 Å²	153	147.4 Å²	147.4	94%	0.939	80%	0.797	S	S	*	*			trans	-143.6	151.4	165.8	2.2	0	0	0	0	111.2
52	R	25.6	Very low	26.7	Very low	221 Å²	221	150.8 Å²	150.8	83%	0.834	80%	0.803	S	S	*	*			trans	-150.6	115.9	-158.8	178.7	-160.3	-165.6	-165.9	9.3	110.3
53	T	25.8	Very low	26.6	Very low	147 Å²	147	153.6 Å²	153.6	90%	0.902	80%	0.796	S	S	*	*			trans	-138.9	165.7	171	1	0	0	0	0	110.8
54	K	27	Very low	26.7	Very low	160 Å²	160	155.5 Å²	155.5	70%	0.696	79%	0.793	S	S	*	*			trans	-138.8	149.5	-159.3	-104.6	-173.3	173.5	-172.3	0	110.8
55	F	23.4	Very low	26.6	Very low	186 Å²	186	151.4 Å²	151.4	82%	0.816	79%	0.79	S	S	*	*			trans	68.1	164.4	160.6	-78.4	-130.1	0	0	0	113.6
56	C	24.5	Very low	26.7	Very low	115 Å²	115	154 Å²	154	78%	0.777	79%	0.793	S	S	*	*			cis	-140.1	177.8	16.3	-150.3	0	0	0	0	114.1
57	K	26.8	Very low	26.1	Very low	197 Å²	197	156.7 Å²	156.7	86%	0.857	80%	0.802	S	S	*	*			trans	-73.2	156.3	177.4	-71.4	177.1	171.2	-179.6	0	112.8
58	G	24.7	Very low	26.1	Very low	82 Å²	82	154.5 Å²	154.5	85%	0.845	80%	0.798	S	S	*	*			trans	-143.4	98.3	160.8	0	0	0	0	0	111
59	N	26.5	Very low	26.1	Very low	132 Å²	132	157.1 Å²	157.1	71%	0.706	81%	0.812	S	S	*	*			trans	-106.4	135.9	-177.5	-131	73.4	0	0	0	110.1	N61	N59-N61 PolarHBondContact ND2-OD1 3.29Å
60	R	27.4	Very low	26.2	Very low	254 Å²	254	154.4 Å²	154.4	96%	0.958	81%	0.811	S	S	*	*			trans	-150.4	127.8	158.9	-104.5	177.7	-173.2	177.4	2	110.2
61	N	24.7	Very low	26.3	Very low	131 Å²	131	150.4 Å²	150.4	70%	0.701	82%	0.815	S	S	*	*			trans	-111	142.2	-179.8	-60.7	4.2	0	0	0	110.1	N59	N59-N61 PolarHBondContact ND2-OD1 3.29Å
62	V	26.5	Very low	26.6	Very low	137 Å²	137	148.4 Å²	148.4	83%	0.83	81%	0.808	S	S	*	*			trans	-146.1	108.4	150.8	-168.8	0	0	0	0	103.2
63	R	28.5	Very low	27.2	Very low	197 Å²	197	144.1 Å²	144.1	74%	0.743	81%	0.806	S	S	*	*				59.3	139.4	79.1	-79.3	-155.9	157.1	168.2	-4.8	113.9
64	E	26.2	Very low	27.6	Very low	153 Å²	153	142.5 Å²	142.5	72%	0.715	80%	0.798	S	S	*	*			cis	-164.4	155.6	-21	-135	149.7	-131.4	0	0	105.2
65	G	25.3	Very low	28.1	Very low	77 Å²	77	140.1 Å²	140.1	79%	0.794	79%	0.793	S	S	*	*			trans	173.7	73.5	-173.7	0	0	0	0	0	114.1
66	E	26.9	Very low	28.6	Very low	188 Å²	188	136.2 Å²	136.2	88%	0.879	79%	0.786	S	S	*	*			trans	-82.9	146.6	167.4	-58.9	177.3	124.6	0	0	109.3
67	D	25.8	Very low	29.1	Very low	158 Å²	158	138 Å²	138	85%	0.845	78%	0.781	S	S	*	*				-175.3	177.1	102.3	-138.8	-32.8	0	0	0	112.8
68	S	26.9	Very low	29.6	Very low	108 Å²	108	133.5 Å²	133.5	76%	0.755	77%	0.772	S	S	*	*			trans	71.8	81.3	169.5	69	0	0	0	0	117.2
69	S	28.1	Very low	30.3	Very low	129 Å²	129	138.5 Å²	138.5	90%	0.902	77%	0.773	S	S	*	*			trans	-72.1	131.8	163.6	53.5	0	0	0	0	111.9
70	S	27.8	Very low	30.8	Very low	108 Å²	108	139.9 Å²	139.9	76%	0.755	78%	0.779	S	S	*	*			trans	-132.6	127.7	159.9	58.1	0	0	0	0	108.8	S72	S70-S72 PolarHBondContact O-N 3.26Å; S70-S72 VanDerWaalsContact O-N 3.16Å
71	S	28.9	Very low	31.2	Very low	125 Å²	125	135 Å²	135	87%	0.874	77%	0.772	S	S	*	*			trans	-81.4	93.7	-175.2	55.4	0	0	0	0	110.6
72	S	32.2	Very low	31.5	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-77.1	124.6	172.2	45.9	0	0	0	0	111.2	S70	S70-S72 PolarHBondContact O-N 3.26Å; S70-S72 VanDerWaalsContact O-N 3.16Å
73	V	38.3	Very low	32.1	Very low	131 Å²	131	133.6 Å²	133.6	79%	0.794	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-62.5	137.6	166.9	178	0	0	0	0	108.3	N75	V73-N75 PolarHBondContact O-N 3.42Å
74	P	32.4	Very low	32.5	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-56.9	126.7	177	-24.8	34.4	0	0	0	111.3	P76	P74-P76 WeakPolarHBondContact O-CD 3.36Å
75	N	39.1	Very low	32.7	Very low	111 Å²	111	129 Å²	129	59%	0.594	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-61.8	119.2	175.1	171.9	17.6	0	0	0	109.7	V73 F77	V73-N75 PolarHBondContact O-N 3.42Å; N75-F77 PolarHBondContact ND2-O 2.64Å; N75-F77 PolarHBondContact O-N 2.72Å; N75-F77 PolarHBondContact OD1-N 3.4Å; N75-F77 PolarHBondContact OD1-O 2.92Å
76	P	33.6	Very low	33.5	Very low	104 Å²	104	131 Å²	131	68%	0.675	78%	0.779	S	S	*	*	S	Bend	trans	-72.2	-11.4	-178.3	28.4	-34.1	0	0	0	114.2	P74	P74-P76 WeakPolarHBondContact O-CD 3.36Å
77	F	35.2	Very low	33.9	Very low	153 Å²	153	125.6 Å²	125.6	67%	0.671	77%	0.774	S	S	*	*			trans	-129.5	92.9	-179.9	-68.4	-77	0	0	0	112.3	N75 E79	N75-F77 PolarHBondContact ND2-O 2.64Å; N75-F77 PolarHBondContact O-N 2.72Å; N75-F77 PolarHBondContact OD1-N 3.4Å; N75-F77 PolarHBondContact OD1-O 2.92Å; F77-E79 VanDerWaalsContact C-N 3.31Å; F77-E79 PolarHBondContact O-N 3.49Å
78	P	37.5	Very low	34.3	Very low	102 Å²	102	122.7 Å²	122.7	66%	0.662	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-14.7	179.6	-20.1	34	0	0	0	115.5	L80	P78-L80 PolarHBondContact O-N 2.95Å
79	E	38.9	Very low	34.5	Very low	187 Å²	187	123.3 Å²	123.3	87%	0.874	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	0.8	-162.9	-59.2	-166.9	143	0	0	115.5	F77	F77-E79 VanDerWaalsContact C-N 3.31Å; F77-E79 PolarHBondContact O-N 3.49Å
80	L	36.5	Very low	35	Very low	160 Å²	160	121.1 Å²	121.1	84%	0.838	74%	0.744	S	S	*	*			trans	-101.6	83.4	179.3	-63.6	-178.5	0	0	0	111.9	P78	P78-L80 PolarHBondContact O-N 2.95Å
81	L	35.9	Very low	35.2	Very low	153 Å²	153	124.4 Å²	124.4	80%	0.801	74%	0.744	S	S	*	*			trans	-92.9	141.1	168.6	-70.1	176.3	0	0	0	111.6
82	P	31.9	Very low	35.5	Very low	102 Å²	102	128.4 Å²	128.4	66%	0.662	74%	0.742	S	S	*	*			trans	-73.7	154.4	175.9	31.1	-35.1	0	0	0	112.3	T84	P82-T84 VanDerWaalsContact C-N 3.33Å; P82-T84 PolarHBondContact O-N 2.64Å
83	P	37.4	Very low	36	Very low	135 Å²	135	129.4 Å²	129.4	88%	0.877	74%	0.738	S	S	*	*	S	Bend	trans	-84	54.8	-163.5	35.6	-39.2	0	0	0	114.9
84	T	37.7	Very low	36.4	Very low	125 Å²	125	127.6 Å²	127.6	77%	0.767	72%	0.723	S	S	*	*			trans	-145.1	45.8	-177.8	-21.1	0	0	0	0	116.7	P82	P82-T84 VanDerWaalsContact C-N 3.33Å; P82-T84 PolarHBondContact O-N 2.64Å
85	V	31.4	Very low	36.9	Very low	128 Å²	128	127.6 Å²	127.6	78%	0.776	72%	0.723	S	S	*	*			trans	-135.2	109.6	161.1	-171.5	0	0	0	0	111
86	S	41	Very low	37.7	Very low	120 Å²	120	126.3 Å²	126.3	84%	0.839	71%	0.71	S	S	*	*			trans	-92.7	151.3	173.7	51.5	0	0	0	0	111.9
87	G	35.9	Very low	38.4	Very low	75 Å²	75	128 Å²	128	77%	0.773	72%	0.719	S	S	*	*	S	Bend	trans	109.8	-26.7	158.3	0	0	0	0	0	119
88	S	33.1	Very low	39.1	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	72%	0.717	S	S	*	*	S	Bend	trans	-113	-5.2	-167.2	-60.3	0	0	0	0	117.8
89	I	32.7	Very low	39.9	Very low	120 Å²	120	129.5 Å²	129.5	62%	0.615	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-80.2	-20.4	-172	-64.5	175.3	0	0	0	113.5	K91 Y92 L93	I89-K91 VanDerWaalsContact C-N 3.27Å; I89-K91 PolarHBondContact O-N 3.17Å; I89-K91 VanDerWaalsContact O-N 3.08Å; I89-Y92 PolarHBondContact O-N 3.31Å; I89-L93 HydrophobicContact CG2-CD1 3.94Å
90	S	37.3	Very low	41.2	Very low	84 Å²	84	122.8 Å²	122.8	59%	0.587	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-65.4	-17.5	-168.3	61.2	0	0	0	0	116.3
91	K	31.7	Very low	43.4	Very low	176 Å²	176	118.1 Å²	118.1	77%	0.765	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-83.9	-13	-175.3	-72.2	-169.3	175	-175.9	0	115.6	I89	I89-K91 VanDerWaalsContact C-N 3.27Å; I89-K91 PolarHBondContact O-N 3.17Å; I89-K91 VanDerWaalsContact O-N 3.08Å
92	Y	36.3	Very low	46	Very low	209 Å²	209	114.1 Å²	114.1	82%	0.82	67%	0.669	S	S	*	*	S	Bend	trans	-113.4	-0.4	-173.5	-63.5	-72.1	0	0	0	114.7	I89	I89-Y92 PolarHBondContact O-N 3.31Å
93	L	42	Very low	48.8	Very low	133 Å²	133	114 Å²	114	70%	0.696	66%	0.66	S	S	*	*	S	Bend	trans	-112.2	2.9	179.1	-65.1	176.6	0	0	0	113.7	I89	I89-L93 HydrophobicContact CG2-CD1 3.94Å
94	L	47.2	Very low	51.4	Low	92 Å²	92	112 Å²	112	48%	0.482	65%	0.645	S	S	.	*	S	Bend	trans	-98.9	139.5	172.2	-64.5	174.9	0	0	0	109.3	W96 L131	L94-W96 PolarHBondContact O-N 2.87Å; L94-L131 HydrophobicContact CD2-CD1 3.6Å
95	P	42.6	Very low	54.1	Low	114 Å²	114	106.4 Å²	106.4	74%	0.74	61%	0.61	S	S	*	*	S	Bend	trans	-65.7	0.1	-176.5	-23.4	34.4	0	0	0	116.3
96	W	56	Low	57.1	Low	84 Å²	84	105.7 Å²	105.7	32%	0.318	60%	0.597	S	S	.	*			trans	-112.8	117.5	-158.1	-171.8	43.6	0	0	0	112.5	L94 K98 S100 T102 P120	L94-W96 PolarHBondContact O-N 2.87Å; W96-K98 WeakPolarHBondContact CZ2-O 3.28Å; W96-K98 PolarHBondContact NE1-O 2.93Å; W96-S100 VanDerWaalsContact CZ2-OG 3.28Å; W96-S100 WeakPolarHBondContact CZ2-OG 3.34Å; W96-T102 HydrophobicContact CH2-CG2 3.87Å; W96-T102 HydrophobicContact CZ3-CG2 3.77Å; W96-P120 HydrophobicContact CD2-CB 4.02Å; W96-P120 HydrophobicContact CD2-CG 3.74Å; W96-P120 HydrophobicContact CE3-CB 4.03Å; W96-P120 HydrophobicContact CE3-CG 3.65Å; W96-P120 HydrophobicContact CG-CG 4.31Å; W96-P120 HydrophobicContact CH2-CB 3.65Å; W96-P120 HydrophobicContact CH2-CG 4.2Å; W96-P120 HydrophobicContact CZ2-CB 3.61Å; W96-P120 HydrophobicContact CZ2-CG 4.27Å; W96-P120 HydrophobicContact CZ3-CB 3.84Å; W96-P120 HydrophobicContact CZ3-CG 3.88Å
97	T	47.3	Very low	59.7	Low	138 Å²	138	100 Å²	100	85%	0.847	56%	0.557	S	S	*	*			trans	-120.9	14.6	-172	52.5	0	0	0	0	113.4
98	K	50.6	Low	62.3	Low	149 Å²	149	97.3 Å²	97.3	65%	0.648	52%	0.524	S	S	*	.	S	Bend	trans	-114.7	142.9	178.6	-65	179	-178	173.3	0	110.6	W96 S100	W96-K98 WeakPolarHBondContact CZ2-O 3.28Å; W96-K98 PolarHBondContact NE1-O 2.93Å; K98-S100 PolarHBondContact O-N 3.02Å
99	P	54	Low	64.8	Low	138 Å²	138	92.8 Å²	92.8	90%	0.896	49%	0.492	S	S	*	.			trans	-77.1	101.6	164.2	31.4	-30.8	0	0	0	109.6
100	S	66.1	Low	66.9	Low	47 Å²	47	88 Å²	88	33%	0.329	47%	0.467	S	S	.	.			trans	-116.3	176	159.1	107.3	0	0	0	0	108.9	W96 K98 D122	W96-S100 VanDerWaalsContact CZ2-OG 3.28Å; W96-S100 WeakPolarHBondContact CZ2-OG 3.34Å; K98-S100 PolarHBondContact O-N 3.02Å; S100-D122 PolarHBondContact OG-OD1 3.32Å
101	A	83.9	Confident	68.8	Low	62 Å²	62	86.7 Å²	86.7	51%	0.512	45%	0.453	S	S	.	.			trans	-66.5	144.5	177.3	0	0	0	0	0	110.4	T121	A101-T121 HydrophobicContact CB-CG2 3.88Å; A101-T121 PolarHBondContact O-N 3.41Å; A101-T121 PolarHBondContact O-OG1 3.17Å
102	T	90.4	Very high	71.2	Confident	69 Å²	69	82 Å²	82	42%	0.423	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	149	171	50	0	0	0	0	111.2	W96 E118 V119	W96-T102 HydrophobicContact CH2-CG2 3.87Å; W96-T102 HydrophobicContact CZ3-CG2 3.77Å; T102-E118 WeakPolarHBondContact CB-OE1 3.29Å; T102-E118 HydrophobicContact CG2-CG 4.01Å; T102-E118 PolarHBondContact OG1-OE1 3.28Å; T102-V119 CarbonylContact C-O 3.54Å; T102-V119 VanDerWaalsContact CA-O 3.3Å; T102-V119 WeakPolarHBondContact CA-O 3.32Å
103	Q	90.8	Very high	73.6	Confident	99 Å²	99	74.9 Å²	74.9	46%	0.463	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	147.2	170.2	-171.4	158.1	-14.7	0	0	110.2	E118 V119 M166	Q103-E118 WeakPolarHBondContact O-CA 3.24Å; Q103-V119 PolarHBondContact N-O 2.97Å; Q103-V119 WeakPolarHBondContact O-CG2 3.14Å; Q103-V119 PolarHBondContact O-N 3.37Å; Q103-M166 HydrophobicContact CB-CE 4.28Å; Q103-M166 HydrophobicContact CG-CE 4.03Å; Q103-M166 VanDerWaalsContact OE1-CE 3.26Å
104	V	92.4	Very high	76	Confident	94 Å²	94	70.8 Å²	70.8	57%	0.57	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	118.3	175.3	-179	0	0	0	0	109.2	A116 V117 E118	V104-A116 HydrophobicContact CG1-CB 4.06Å; V104-V117 WeakPolarHBondContact CA-O 3.16Å; V104-E118 HydrophobicContact CG2-CB 4.34Å
105	I	93.4	Very high	78.1	Confident	6 Å²	6	69.3 Å²	69.3	3%	0.031	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	158.9	169.6	65.9	169.2	0	0	0	110.5	V107 A116 V117 V119 I128 V165 M166 L169 L180	I105-V107 HydrophobicContact CD1-CG2 3.91Å; I105-V107 HydrophobicContact CG1-CG2 4.27Å; I105-A116 WeakPolarHBondContact O-CA 3.22Å; I105-V117 HydrophobicContact CD1-CG1 4.1Å; I105-V117 HydrophobicContact CG1-CG1 3.57Å; I105-V117 PolarHBondContact N-O 3.42Å; I105-V117 PolarHBondContact O-N 3.22Å; I105-V119 HydrophobicContact CB-CG2 4.45Å; I105-V119 HydrophobicContact CD1-CG1 4.27Å; I105-V119 HydrophobicContact CD1-CG2 4.01Å; I105-V119 HydrophobicContact CG1-CG1 4.35Å; I105-V119 HydrophobicContact CG1-CG2 3.86Å; I105-V119 HydrophobicContact CG2-CG2 3.88Å; I105-I128 HydrophobicContact CD1-CD1 3.44Å; I105-I128 VanDerWaalsContact CD1-CD1 3.44Å; I105-I128 HydrophobicContact CD1-CG1 4.03Å; I105-V165 HydrophobicContact CD1-CG1 4.49Å; I105-M166 HydrophobicContact CG2-SD 3.95Å; I105-L169 HydrophobicContact CG2-CD1 3.79Å; I105-L180 HydrophobicContact CD1-CD1 4.33Å
106	K	93.9	Very high	80.6	Confident	114 Å²	114	67.4 Å²	67.4	50%	0.496	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	114.8	177	-172.6	177.1	-177.9	176.9	0	109.8	F108 S114	K106-F108 HydrophobicContact CD-CE2 3.94Å; K106-F108 HydrophobicContact CD-CZ 3.8Å; K106-F108 HydrophobicContact CG-CD2 4.49Å; K106-F108 HydrophobicContact CG-CE2 3.85Å; K106-F108 HydrophobicContact CG-CZ 4.17Å; K106-S114 VanDerWaalsContact CE-CB 3.43Å; K106-S114 WeakPolarHBondContact CE-OG 3.39Å
107	V	95.1	Very high	82.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	132.1	-179	-176.6	0	0	0	0	109.2	I105 S114 K115 I128 F132 L146 L180 F182	I105-V107 HydrophobicContact CD1-CG2 3.91Å; I105-V107 HydrophobicContact CG1-CG2 4.27Å; V107-S114 CarbonylContact O-C 3.57Å; V107-S114 WeakPolarHBondContact O-CA 3.3Å; V107-K115 PolarHBondContact N-O 3.25Å; V107-K115 PolarHBondContact O-N 3.13Å; V107-I128 HydrophobicContact CG2-CG2 4.4Å; V107-F132 HydrophobicContact CB-CE1 3.98Å; V107-F132 HydrophobicContact CB-CE2 4.42Å; V107-F132 HydrophobicContact CB-CZ 3.7Å; V107-F132 HydrophobicContact CG1-CD1 4.48Å; V107-F132 HydrophobicContact CG1-CE1 3.98Å; V107-F132 HydrophobicContact CG1-CZ 4.07Å; V107-F132 HydrophobicContact CG2-CE2 4.21Å; V107-F132 HydrophobicContact CG2-CZ 3.92Å; V107-L146 HydrophobicContact CG1-CD1 4.04Å; V107-L180 CarbonylContact C-O 3.54Å; V107-L180 WeakPolarHBondContact CA-O 3.34Å; V107-F182 HydrophobicContact CG1-CB 3.6Å
108	F	92.5	Very high	84.6	Confident	19 Å²	19	63.2 Å²	63.2	8%	0.083	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	152.7	-177.4	-67.4	-102.1	0	0	0	111.9	K106 T113 R179 L180 Y181 F182	K106-F108 HydrophobicContact CD-CE2 3.94Å; K106-F108 HydrophobicContact CD-CZ 3.8Å; K106-F108 HydrophobicContact CG-CD2 4.49Å; K106-F108 HydrophobicContact CG-CE2 3.85Å; K106-F108 HydrophobicContact CG-CZ 4.17Å; F108-T113 CarbonylContact C-O 3.56Å; F108-T113 WeakPolarHBondContact CA-O 3.4Å; F108-T113 WeakPolarHBondContact CD1-O 3.3Å; F108-R179 HydrophobicContact CD2-CB 3.96Å; F108-R179 HydrophobicContact CD2-CG 4.02Å; F108-R179 HydrophobicContact CE2-CB 4.01Å; F108-R179 HydrophobicContact CE2-CG 3.59Å; F108-R179 HydrophobicContact CZ-CG 3.97Å; F108-L180 PolarHBondContact N-O 3.06Å; F108-Y181 HydrophobicContact CB-CD1 3.62Å; F108-Y181 HydrophobicContact CB-CE1 3.64Å; F108-Y181 HydrophobicContact CB-CG 4.1Å; F108-Y181 HydrophobicContact CG-CE1 4.41Å; F108-Y181 WeakPolarHBondContact O-CA 3.2Å; F108-F182 PolarHBondContact O-N 3.46Å
109	D	85.3	Confident	86.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	33%	0.326	C	S	.	.			trans	-92.6	177	167.6	77.2	-6.9	0	0	0	111.6	N111 N112 T113 Y181 L529	D109-N111 PolarHBondContact O-N 3.32Å; D109-N111 VanDerWaalsContact OD1-CA 3.25Å; D109-N111 WeakPolarHBondContact OD1-CA 3.35Å; D109-N111 WeakPolarHBondContact OD1-CB 3.49Å; D109-N111 PolarHBondContact OD1-N 3.34Å; D109-N111 PolarHBondContact OD2-ND2 2.89Å; D109-N112 PolarHBondContact O-N 3.21Å; D109-N112 VanDerWaalsContact O-N 3.11Å; D109-N112 PolarHBondContact OD1-N 2.94Å; D109-T113 PolarHBondContact N-O 2.92Å; D109-T113 WeakPolarHBondContact OD1-CA 3.3Å; D109-T113 PolarHBondContact OD1-N 2.76Å; D109-T113 PolarHBondContact OD1-OG1 3.32Å; D109-T113 PolarHBondContact OD2-OG1 2.99Å; D109-Y181 VanDerWaalsContact O-CD1 3.24Å; D109-Y181 WeakPolarHBondContact O-CD1 3.32Å; D109-Y181 WeakPolarHBondContact O-CE1 3.3Å; D109-L529 HydrophobicContact CB-CB 4.08Å; D109-L529 HydrophobicContact CB-CD1 3.67Å; D109-L529 HydrophobicContact CB-CG 3.64Å
110	E	76.9	Confident	88.5	Confident	19 Å²	19	50.8 Å²	50.8	9%	0.089	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-34.4	176.3	-55.1	-160.2	99.3	0	0	111.6	N112 R183 Q444 Q445	E110-N112 VanDerWaalsContact C-N 3.25Å; E110-N112 PolarHBondContact O-N 3.49Å; E110-R183 HydrophobicContact CG-CB 3.62Å; E110-R183 WeakPolarHBondContact OE1-CD 3.27Å; E110-Q444 HydrophobicContact CB-CB 3.94Å; E110-Q444 HydrophobicContact CB-CG 4.03Å; E110-Q444 HydrophobicContact CG-CB 4.34Å; E110-Q444 PolarHBondContact O-NE2 3.25Å; E110-Q444 WeakPolarHBondContact OE1-CB 3.29Å; E110-Q445 WeakPolarHBondContact OE1-CG 3.42Å; E110-Q445 PolarHBondContact OE2-NE2 2.97Å
111	N	76.6	Confident	89.7	Confident	57 Å²	57	51 Å²	51	31%	0.305	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-2.7	179.4	-44.5	-68.8	0	0	0	114.2	D109 T113 I527	D109-N111 PolarHBondContact O-N 3.32Å; D109-N111 VanDerWaalsContact OD1-CA 3.25Å; D109-N111 WeakPolarHBondContact OD1-CA 3.35Å; D109-N111 WeakPolarHBondContact OD1-CB 3.49Å; D109-N111 PolarHBondContact OD1-N 3.34Å; D109-N111 PolarHBondContact OD2-ND2 2.89Å; N111-T113 VanDerWaalsContact C-N 3.26Å; N111-T113 HydrophobicContact CB-CG2 4.28Å; N111-T113 PolarHBondContact O-N 3.08Å; N111-I527 PolarHBondContact ND2-O 3.01Å
112	N	82.3	Confident	90.1	Very high	79 Å²	79	52.1 Å²	52.1	42%	0.422	29%	0.287	S	S	.	.	S	Bend	trans	66	16.5	-170.9	-54.4	-95.4	0	0	0	115.5	D109 E110 R179 Y181	D109-N112 PolarHBondContact O-N 3.21Å; D109-N112 VanDerWaalsContact O-N 3.11Å; D109-N112 PolarHBondContact OD1-N 2.94Å; E110-N112 VanDerWaalsContact C-N 3.25Å; E110-N112 PolarHBondContact O-N 3.49Å; N112-R179 PolarHBondContact OD1-NH1 3.17Å; N112-Y181 PolarHBondContact OD1-OH 2.92Å
113	T	87.4	Confident	90.3	Very high	59 Å²	59	49.1 Å²	49.1	36%	0.362	27%	0.269	S	S	.	.			trans	-68	168.8	157.1	83.7	0	0	0	0	109.4	F108 D109 N111	F108-T113 CarbonylContact C-O 3.56Å; F108-T113 WeakPolarHBondContact CA-O 3.4Å; F108-T113 WeakPolarHBondContact CD1-O 3.3Å; D109-T113 PolarHBondContact N-O 2.92Å; D109-T113 WeakPolarHBondContact OD1-CA 3.3Å; D109-T113 PolarHBondContact OD1-N 2.76Å; D109-T113 PolarHBondContact OD1-OG1 3.32Å; D109-T113 PolarHBondContact OD2-OG1 2.99Å; N111-T113 VanDerWaalsContact C-N 3.26Å; N111-T113 HydrophobicContact CB-CG2 4.28Å; N111-T113 PolarHBondContact O-N 3.08Å
114	S	91.8	Very high	90.6	Very high	46 Å²	46	46.1 Å²	46.1	32%	0.322	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	136.4	-175	65.5	0	0	0	0	114.2	K106 V107	K106-S114 VanDerWaalsContact CE-CB 3.43Å; K106-S114 WeakPolarHBondContact CE-OG 3.39Å; V107-S114 CarbonylContact O-C 3.57Å; V107-S114 WeakPolarHBondContact O-CA 3.3Å
115	K	91.8	Very high	90.8	Very high	61 Å²	61	41.7 Å²	41.7	27%	0.265	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.7	167.9	-77.3	175.5	171.4	154.8	0	110.3	V107 F132 N136 L529	V107-K115 PolarHBondContact N-O 3.25Å; V107-K115 PolarHBondContact O-N 3.13Å; K115-F132 HydrophobicContact CB-CE1 4.11Å; K115-F132 HydrophobicContact CB-CZ 4.24Å; K115-F132 HydrophobicContact CD-CE1 4.33Å; K115-N136 PolarHBondContact NZ-OD1 3.29Å; K115-L529 HydrophobicContact CD-CB 4.06Å; K115-L529 WeakPolarHBondContact CE-O 3.21Å; K115-L529 WeakPolarHBondContact CE-OXT 3.46Å; K115-L529 HydrophobicContact CG-CB 4.27Å; K115-L529 PolarHBondContact NZ-OXT 3.23Å
116	A	94.1	Very high	90.9	Very high	74 Å²	74	42.5 Å²	42.5	61%	0.612	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	140	161.1	0	0	0	0	0	109	V104 I105	V104-A116 HydrophobicContact CG1-CB 4.06Å; I105-A116 WeakPolarHBondContact O-CA 3.22Å
117	V	92.9	Very high	90.9	Very high	10 Å²	10	39.9 Å²	39.9	6%	0.061	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	133.5	179.3	62.1	0	0	0	0	110.6	V104 I105 V119 L131 F132	V104-V117 WeakPolarHBondContact CA-O 3.16Å; I105-V117 HydrophobicContact CD1-CG1 4.1Å; I105-V117 HydrophobicContact CG1-CG1 3.57Å; I105-V117 PolarHBondContact N-O 3.42Å; I105-V117 PolarHBondContact O-N 3.22Å; V117-V119 HydrophobicContact CG1-CG1 4.05Å; V117-V119 HydrophobicContact CG2-CG1 4.15Å; V117-L131 HydrophobicContact CG2-CD2 3.93Å; V117-F132 HydrophobicContact CG1-CE2 4Å; V117-F132 HydrophobicContact CG1-CZ 4.14Å
118	E	94.4	Very high	90.9	Very high	125 Å²	125	39.9 Å²	39.9	58%	0.584	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	128.9	171.3	-172.3	176.6	-172.7	0	0	109.6	T102 Q103 V104	T102-E118 WeakPolarHBondContact CB-OE1 3.29Å; T102-E118 HydrophobicContact CG2-CG 4.01Å; T102-E118 PolarHBondContact OG1-OE1 3.28Å; Q103-E118 WeakPolarHBondContact O-CA 3.24Å; V104-E118 HydrophobicContact CG2-CB 4.34Å
119	V	93.2	Very high	90.9	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.024	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	157.4	-173.1	-69	0	0	0	0	111.5	T102 Q103 I105 V117 V123 I128	T102-V119 CarbonylContact C-O 3.54Å; T102-V119 VanDerWaalsContact CA-O 3.3Å; T102-V119 WeakPolarHBondContact CA-O 3.32Å; Q103-V119 PolarHBondContact N-O 2.97Å; Q103-V119 WeakPolarHBondContact O-CG2 3.14Å; Q103-V119 PolarHBondContact O-N 3.37Å; I105-V119 HydrophobicContact CB-CG2 4.45Å; I105-V119 HydrophobicContact CD1-CG1 4.27Å; I105-V119 HydrophobicContact CD1-CG2 4.01Å; I105-V119 HydrophobicContact CG1-CG1 4.35Å; I105-V119 HydrophobicContact CG1-CG2 3.86Å; I105-V119 HydrophobicContact CG2-CG2 3.88Å; V117-V119 HydrophobicContact CG1-CG1 4.05Å; V117-V119 HydrophobicContact CG2-CG1 4.15Å; V119-V123 HydrophobicContact CB-CB 4.28Å; V119-V123 HydrophobicContact CB-CG1 4.05Å; V119-V123 HydrophobicContact CB-CG2 4.29Å; V119-V123 HydrophobicContact CG2-CG1 3.92Å; V119-I128 HydrophobicContact CG1-CG1 4.35Å
120	P	92.8	Very high	91.2	Very high	21 Å²	21	41.6 Å²	41.6	14%	0.136	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	150.2	169.1	-1	-4.8	0	0	0	112.8	W96 D122 V123	W96-P120 HydrophobicContact CD2-CB 4.02Å; W96-P120 HydrophobicContact CD2-CG 3.74Å; W96-P120 HydrophobicContact CE3-CB 4.03Å; W96-P120 HydrophobicContact CE3-CG 3.65Å; W96-P120 HydrophobicContact CG-CG 4.31Å; W96-P120 HydrophobicContact CH2-CB 3.65Å; W96-P120 HydrophobicContact CH2-CG 4.2Å; W96-P120 HydrophobicContact CZ2-CB 3.61Å; W96-P120 HydrophobicContact CZ2-CG 4.27Å; W96-P120 HydrophobicContact CZ3-CB 3.84Å; W96-P120 HydrophobicContact CZ3-CG 3.88Å; P120-D122 WeakPolarHBondContact CB-OD1 3.26Å; P120-D122 PolarHBondContact O-N 3.3Å; P120-V123 HydrophobicContact CB-CB 4.23Å; P120-V123 HydrophobicContact CG-CB 3.88Å; P120-V123 HydrophobicContact CG-CG2 4.22Å; P120-V123 VanDerWaalsContact O-CB 3.3Å; P120-V123 WeakPolarHBondContact O-CB 3.41Å; P120-V123 WeakPolarHBondContact O-CG1 3.27Å; P120-V123 PolarHBondContact O-N 3.37Å
121	T	91.8	Very high	91.8	Very high	52 Å²	52	42.1 Å²	42.1	32%	0.319	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.5	165.9	51.3	0	0	0	0	112.8	A101 V123 M166	A101-T121 HydrophobicContact CB-CG2 3.88Å; A101-T121 PolarHBondContact O-N 3.41Å; A101-T121 PolarHBondContact O-OG1 3.17Å; T121-V123 VanDerWaalsContact C-N 3.35Å; T121-M166 WeakPolarHBondContact O-CG 3.4Å
122	D	91.9	Very high	92.4	Very high	85 Å²	85	39.4 Å²	39.4	46%	0.455	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	19.9	174.6	53.4	-48.2	0	0	0	114.1	S100 P120	S100-D122 PolarHBondContact OG-OD1 3.32Å; P120-D122 WeakPolarHBondContact CB-OD1 3.26Å; P120-D122 PolarHBondContact O-N 3.3Å
123	V	95.2	Very high	92.6	Very high	6 Å²	6	36.3 Å²	36.3	4%	0.036	21%	0.206	C	C	.	.			trans	-74.6	130.6	-176.9	74.3	0	0	0	0	113.2	V119 P120 T121 D127 I128 V165	V119-V123 HydrophobicContact CB-CB 4.28Å; V119-V123 HydrophobicContact CB-CG1 4.05Å; V119-V123 HydrophobicContact CB-CG2 4.29Å; V119-V123 HydrophobicContact CG2-CG1 3.92Å; P120-V123 HydrophobicContact CB-CB 4.23Å; P120-V123 HydrophobicContact CG-CB 3.88Å; P120-V123 HydrophobicContact CG-CG2 4.22Å; P120-V123 VanDerWaalsContact O-CB 3.3Å; P120-V123 WeakPolarHBondContact O-CB 3.41Å; P120-V123 WeakPolarHBondContact O-CG1 3.27Å; P120-V123 PolarHBondContact O-N 3.37Å; T121-V123 VanDerWaalsContact C-N 3.35Å; V123-D127 HydrophobicContact CG2-CB 3.83Å; V123-I128 HydrophobicContact CB-CD1 4.43Å; V123-I128 HydrophobicContact CG1-CD1 3.7Å; V123-I128 HydrophobicContact CG2-CD1 3.82Å; V123-I128 HydrophobicContact CG2-CG1 3.81Å; V123-V165 HydrophobicContact CG1-CB 4.26Å; V123-V165 PolarHBondContact O-N 2.87Å
124	T	96.8	Very high	92.4	Very high	36 Å²	36	39.1 Å²	39.1	22%	0.221	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-87.9	159.3	173.9	73.2	0	0	0	0	112.2	R126 D127 I128 D161 E163	T124-R126 PolarHBondContact O-N 3.2Å; T124-R126 PolarHBondContact OG1-N 3.18Å; T124-D127 WeakPolarHBondContact CB-OD2 3.42Å; T124-D127 PolarHBondContact N-OD2 3.07Å; T124-D127 VanDerWaalsContact N-OD2 3.08Å; T124-D127 PolarHBondContact O-N 2.92Å; T124-D127 VanDerWaalsContact O-N 3.1Å; T124-D127 PolarHBondContact OG1-N 3.3Å; T124-D127 PolarHBondContact OG1-OD2 3.11Å; T124-I128 PolarHBondContact O-N 3.35Å; T124-D161 WeakPolarHBondContact CB-O 3.36Å; T124-D161 PolarHBondContact OG1-O 2.91Å; T124-E163 WeakPolarHBondContact CA-O 3.18Å
125	A	96.9	Very high	92	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-56.7	-34.8	173.1	0	0	0	0	0	112.3	C129 L146 I159 E163 V165	A125-C129 PolarHBondContact O-N 2.85Å; A125-C129 PolarHBondContact O-SG 3.48Å; A125-C129 VanDerWaalsContact O-SG 3.39Å; A125-L146 HydrophobicContact CB-CB 4.37Å; A125-L146 HydrophobicContact CB-CD2 4.43Å; A125-I159 HydrophobicContact CB-CB 4.1Å; A125-I159 HydrophobicContact CB-CG2 3.58Å; A125-E163 PolarHBondContact N-O 2.9Å; A125-V165 HydrophobicContact CB-CG2 4.06Å
126	R	95.2	Very high	91.4	Very high	24 Å²	24	40.7 Å²	40.7	9%	0.091	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-44.7	173.8	-178	-178.2	-64.9	135.8	-12.4	112.7	T124 I128 C129 Q130 D161 N344 Q347	T124-R126 PolarHBondContact O-N 3.2Å; T124-R126 PolarHBondContact OG1-N 3.18Å; R126-I128 PolarHBondContact O-N 3.01Å; R126-C129 PolarHBondContact O-N 3.13Å; R126-C129 VanDerWaalsContact O-N 3.1Å; R126-Q130 HydrophobicContact CG-CG 4.11Å; R126-Q130 WeakPolarHBondContact O-CG 3.36Å; R126-Q130 PolarHBondContact O-N 3.17Å; R126-D161 HydrophobicContact CB-CB 3.93Å; R126-D161 WeakPolarHBondContact CB-O 3.06Å; R126-D161 IonicContact CZ-OD2 2.82Å; R126-D161 PolarHBondContact N-O 2.55Å; R126-D161 IonicContact NE-OD2 2.76Å; R126-D161 PolarHBondContact NE-OD2 2.77Å; R126-D161 IonicContact NH2-OD2 3.83Å; R126-D161 PolarHBondContact NH2-OD2 3.15Å; R126-N344 PolarHBondContact NH2-O 3.17Å; R126-Q347 VanDerWaalsContact NH1-CD 3.3Å
127	D	94.1	Very high	90.5	Very high	59 Å²	59	45.6 Å²	45.6	32%	0.316	23%	0.231	S	C	.	.	H	α-helix	trans	-61.8	-38.5	-176.8	-60.4	-53.4	0	0	0	110.7	V123 T124 Q130 L131	V123-D127 HydrophobicContact CG2-CB 3.83Å; T124-D127 WeakPolarHBondContact CB-OD2 3.42Å; T124-D127 PolarHBondContact N-OD2 3.07Å; T124-D127 VanDerWaalsContact N-OD2 3.08Å; T124-D127 PolarHBondContact O-N 2.92Å; T124-D127 VanDerWaalsContact O-N 3.1Å; T124-D127 PolarHBondContact OG1-N 3.3Å; T124-D127 PolarHBondContact OG1-OD2 3.11Å; D127-Q130 PolarHBondContact O-N 3.08Å; D127-L131 VanDerWaalsContact O-CB 3.23Å; D127-L131 WeakPolarHBondContact O-CB 3.34Å; D127-L131 PolarHBondContact O-N 3.4Å
128	I	94.7	Very high	89.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.4	-45.4	172.1	-74.9	152.5	0	0	0	111.3	I105 V107 V119 V123 T124 R126 Q130 L131 F132 L146 V165	I105-I128 HydrophobicContact CD1-CD1 3.44Å; I105-I128 VanDerWaalsContact CD1-CD1 3.44Å; I105-I128 HydrophobicContact CD1-CG1 4.03Å; V107-I128 HydrophobicContact CG2-CG2 4.4Å; V119-I128 HydrophobicContact CG1-CG1 4.35Å; V123-I128 HydrophobicContact CB-CD1 4.43Å; V123-I128 HydrophobicContact CG1-CD1 3.7Å; V123-I128 HydrophobicContact CG2-CD1 3.82Å; V123-I128 HydrophobicContact CG2-CG1 3.81Å; T124-I128 PolarHBondContact O-N 3.35Å; R126-I128 PolarHBondContact O-N 3.01Å; I128-Q130 VanDerWaalsContact C-N 3.34Å; I128-Q130 PolarHBondContact O-N 3.24Å; I128-L131 PolarHBondContact O-N 2.83Å; I128-F132 HydrophobicContact CG2-CD2 4.1Å; I128-F132 HydrophobicContact CG2-CE2 4.22Å; I128-F132 VanDerWaalsContact O-CD2 3.28Å; I128-F132 WeakPolarHBondContact O-CD2 3.3Å; I128-F132 PolarHBondContact O-N 3.18Å; I128-L146 HydrophobicContact CD1-CD2 4.4Å; I128-L146 HydrophobicContact CG2-CD1 3.96Å; I128-L146 HydrophobicContact CG2-CD2 4.08Å; I128-V165 HydrophobicContact CD1-CB 3.91Å; I128-V165 HydrophobicContact CD1-CG1 4.08Å; I128-V165 HydrophobicContact CD1-CG2 3.62Å
129	C	93.9	Very high	88.8	Confident	9 Å²	9	47 Å²	47	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-58	-45.2	174.5	-73.3	0	0	0	0	112.2	A125 R126 F132 V133 A145 L146 F182	A125-C129 PolarHBondContact O-N 2.85Å; A125-C129 PolarHBondContact O-SG 3.48Å; A125-C129 VanDerWaalsContact O-SG 3.39Å; R126-C129 PolarHBondContact O-N 3.13Å; R126-C129 VanDerWaalsContact O-N 3.1Å; C129-F132 PolarHBondContact O-N 2.94Å; C129-V133 WeakPolarHBondContact O-CB 3.5Å; C129-V133 VanDerWaalsContact O-CG2 3.29Å; C129-V133 WeakPolarHBondContact O-CG2 3.35Å; C129-V133 PolarHBondContact O-N 2.89Å; C129-A145 VanDerWaalsContact SG-C 3.56Å; C129-L146 PolarHBondContact SG-N 2.59Å; C129-F182 HydrophobicContact CB-CE2 4.2Å
130	Q	91	Very high	88.2	Confident	47 Å²	47	49.7 Å²	49.7	22%	0.22	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-40.3	178.6	-69.4	-172.7	-16.4	0	0	111.8	R126 D127 I128 F132 V133 L134	R126-Q130 HydrophobicContact CG-CG 4.11Å; R126-Q130 WeakPolarHBondContact O-CG 3.36Å; R126-Q130 PolarHBondContact O-N 3.17Å; D127-Q130 PolarHBondContact O-N 3.08Å; I128-Q130 VanDerWaalsContact C-N 3.34Å; I128-Q130 PolarHBondContact O-N 3.24Å; Q130-F132 VanDerWaalsContact C-N 3.33Å; Q130-F132 PolarHBondContact O-N 3.36Å; Q130-V133 PolarHBondContact O-N 3.1Å; Q130-L134 WeakPolarHBondContact O-CB 3.13Å; Q130-L134 VanDerWaalsContact O-CG 3.28Å; Q130-L134 WeakPolarHBondContact O-CG 3.35Å; Q130-L134 PolarHBondContact O-N 3.48Å
131	L	89.4	Confident	87.5	Confident	29 Å²	29	51.4 Å²	51.4	15%	0.152	27%	0.265	C	S	.	.	H	α-helix	trans	-59.9	-40.6	173.7	-179.8	60.2	0	0	0	112.4	L94 V117 D127 I128 K135	L94-L131 HydrophobicContact CD2-CD1 3.6Å; V117-L131 HydrophobicContact CG2-CD2 3.93Å; D127-L131 VanDerWaalsContact O-CB 3.23Å; D127-L131 WeakPolarHBondContact O-CB 3.34Å; D127-L131 PolarHBondContact O-N 3.4Å; I128-L131 PolarHBondContact O-N 2.83Å; L131-K135 HydrophobicContact CD1-CD 4.1Å; L131-K135 HydrophobicContact CD1-CG 4.29Å; L131-K135 HydrophobicContact CG-CD 4.23Å; L131-K135 VanDerWaalsContact O-CB 3.27Å; L131-K135 WeakPolarHBondContact O-CB 3.38Å; L131-K135 WeakPolarHBondContact O-CG 3.44Å; L131-K135 PolarHBondContact O-N 3.05Å
132	F	89.4	Confident	87.1	Confident	1 Å²	1	50.2 Å²	50.2	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-77.9	-35.9	178.9	-83.6	-111.1	0	0	0	112.5	V107 K115 V117 I128 C129 Q130 L134 K135 N136 F182 L529	V107-F132 HydrophobicContact CB-CE1 3.98Å; V107-F132 HydrophobicContact CB-CE2 4.42Å; V107-F132 HydrophobicContact CB-CZ 3.7Å; V107-F132 HydrophobicContact CG1-CD1 4.48Å; V107-F132 HydrophobicContact CG1-CE1 3.98Å; V107-F132 HydrophobicContact CG1-CZ 4.07Å; V107-F132 HydrophobicContact CG2-CE2 4.21Å; V107-F132 HydrophobicContact CG2-CZ 3.92Å; K115-F132 HydrophobicContact CB-CE1 4.11Å; K115-F132 HydrophobicContact CB-CZ 4.24Å; K115-F132 HydrophobicContact CD-CE1 4.33Å; V117-F132 HydrophobicContact CG1-CE2 4Å; V117-F132 HydrophobicContact CG1-CZ 4.14Å; I128-F132 HydrophobicContact CG2-CD2 4.1Å; I128-F132 HydrophobicContact CG2-CE2 4.22Å; I128-F132 VanDerWaalsContact O-CD2 3.28Å; I128-F132 WeakPolarHBondContact O-CD2 3.3Å; I128-F132 PolarHBondContact O-N 3.18Å; C129-F132 PolarHBondContact O-N 2.94Å; Q130-F132 VanDerWaalsContact C-N 3.33Å; Q130-F132 PolarHBondContact O-N 3.36Å; F132-L134 VanDerWaalsContact C-N 3.33Å; F132-L134 PolarHBondContact O-N 3.04Å; F132-K135 PolarHBondContact O-N 3.28Å; F132-N136 WeakPolarHBondContact O-CB 3.43Å; F132-N136 PolarHBondContact O-N 3.07Å; F132-N136 VanDerWaalsContact O-N 3.07Å; F132-N136 PolarHBondContact O-ND2 2.89Å; F132-F182 HydrophobicContact CB-CD1 4.08Å; F132-F182 HydrophobicContact CB-CD2 3.95Å; F132-F182 HydrophobicContact CB-CE1 3.89Å; F132-F182 HydrophobicContact CB-CE2 3.77Å; F132-F182 HydrophobicContact CB-CG 4.11Å; F132-F182 HydrophobicContact CB-CZ 3.74Å; F132-F182 HydrophobicContact CD1-CD1 4.28Å; F132-F182 HydrophobicContact CD1-CG 4.33Å; F132-F182 HydrophobicContact CG-CG 4.41Å; F132-L529 HydrophobicContact CD1-CD1 4.13Å; F132-L529 HydrophobicContact CD1-CD2 3.71Å; F132-L529 HydrophobicContact CE1-CD1 3.98Å; F132-L529 HydrophobicContact CE1-CD2 4.15Å
133	V	86.4	Confident	86.9	Confident	13 Å²	13	46.4 Å²	46.4	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-58.6	-46.9	170.9	167.9	0	0	0	0	110.7	C129 Q130 H137 C138 D140 W144 F182	C129-V133 WeakPolarHBondContact O-CB 3.5Å; C129-V133 VanDerWaalsContact O-CG2 3.29Å; C129-V133 WeakPolarHBondContact O-CG2 3.35Å; C129-V133 PolarHBondContact O-N 2.89Å; Q130-V133 PolarHBondContact O-N 3.1Å; V133-H137 PolarHBondContact O-N 2.9Å; V133-C138 HydrophobicContact CB-CB 4.49Å; V133-C138 HydrophobicContact CG1-CB 4.17Å; V133-C138 WeakPolarHBondContact CG1-O 3.33Å; V133-C138 PolarHBondContact O-N 2.76Å; V133-D140 HydrophobicContact CG1-CB 4.07Å; V133-W144 HydrophobicContact CG2-CB 4.22Å; V133-W144 HydrophobicContact CG2-CD2 4.31Å; V133-W144 HydrophobicContact CG2-CG 3.67Å; V133-F182 HydrophobicContact CG2-CZ 4.04Å
134	L	83.7	Confident	86.7	Confident	119 Å²	119	46.6 Å²	46.6	62%	0.623	24%	0.235	S	C	*	.	H	α-helix	trans	-65.5	-48.6	177.6	-70.3	169	0	0	0	112.6	Q130 F132 N136 H137	Q130-L134 WeakPolarHBondContact O-CB 3.13Å; Q130-L134 VanDerWaalsContact O-CG 3.28Å; Q130-L134 WeakPolarHBondContact O-CG 3.35Å; Q130-L134 PolarHBondContact O-N 3.48Å; F132-L134 VanDerWaalsContact C-N 3.33Å; F132-L134 PolarHBondContact O-N 3.04Å; L134-N136 VanDerWaalsContact C-N 3.29Å; L134-N136 PolarHBondContact O-N 2.93Å; L134-H137 PolarHBondContact O-N 3.36Å
135	K	82.9	Confident	86.6	Confident	111 Å²	111	44.9 Å²	44.9	48%	0.483	23%	0.225	S	C	.	.	H	α-helix	trans	-65.5	-26.7	-177.6	-83.7	-177.5	173	176.8	0	114.5	L131 F132	L131-K135 HydrophobicContact CD1-CD 4.1Å; L131-K135 HydrophobicContact CD1-CG 4.29Å; L131-K135 HydrophobicContact CG-CD 4.23Å; L131-K135 VanDerWaalsContact O-CB 3.27Å; L131-K135 WeakPolarHBondContact O-CB 3.38Å; L131-K135 WeakPolarHBondContact O-CG 3.44Å; L131-K135 PolarHBondContact O-N 3.05Å; F132-K135 PolarHBondContact O-N 3.28Å
136	N	78.3	Confident	86.6	Confident	28 Å²	28	44.9 Å²	44.9	15%	0.15	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	17.8	-178.7	-48.5	-68.2	0	0	0	111.9	K115 F132 L134 C138 L529	K115-N136 PolarHBondContact NZ-OD1 3.29Å; F132-N136 WeakPolarHBondContact O-CB 3.43Å; F132-N136 PolarHBondContact O-N 3.07Å; F132-N136 VanDerWaalsContact O-N 3.07Å; F132-N136 PolarHBondContact O-ND2 2.89Å; L134-N136 VanDerWaalsContact C-N 3.29Å; L134-N136 PolarHBondContact O-N 2.93Å; N136-C138 PolarHBondContact O-N 3.25Å; N136-C138 VanDerWaalsContact O-N 3.11Å; N136-C138 PolarHBondContact O-SG 3.08Å; N136-L529 WeakPolarHBondContact ND2-CD2 3.38Å
137	H	76.7	Confident	86.6	Confident	178 Å²	178	43.9 Å²	43.9	82%	0.824	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	35.8	176.7	-56.4	-60	0	0	0	115	V133 L134	V133-H137 PolarHBondContact O-N 2.9Å; L134-H137 PolarHBondContact O-N 3.36Å
138	C	74.9	Confident	86.6	Confident	30 Å²	30	41.1 Å²	41.1	20%	0.203	21%	0.207	C	C	.	.			trans	-83	156.5	-176	-62.6	0	0	0	0	111.9	V133 N136 W144 I527	V133-C138 HydrophobicContact CB-CB 4.49Å; V133-C138 HydrophobicContact CG1-CB 4.17Å; V133-C138 WeakPolarHBondContact CG1-O 3.33Å; V133-C138 PolarHBondContact O-N 2.76Å; N136-C138 PolarHBondContact O-N 3.25Å; N136-C138 VanDerWaalsContact O-N 3.11Å; N136-C138 PolarHBondContact O-SG 3.08Å; C138-W144 HydrophobicContact CB-CZ2 4.29Å; C138-I527 WeakPolarHBondContact SG-CD1 3.35Å
139	I	76.6	Confident	86.5	Confident	133 Å²	133	42.6 Å²	42.6	68%	0.682	21%	0.213	S	C	*	.			trans	-76.1	126.5	168.7	-59.5	173.8	0	0	0	108.4	D141 W144	I139-D141 PolarHBondContact O-N 2.98Å; I139-D141 VanDerWaalsContact O-N 3.15Å; I139-W144 PolarHBondContact O-NE1 2.84Å
140	D	79.4	Confident	86.3	Confident	62 Å²	62	42.7 Å²	42.7	33%	0.332	21%	0.213	S	C	.	.			trans	-78.9	90.4	169	-168	1.1	0	0	0	110.2	V133 H142	V133-D140 HydrophobicContact CG1-CB 4.07Å; D140-H142 VanDerWaalsContact C-N 3.3Å; D140-H142 WeakPolarHBondContact OD1-CA 3.4Å; D140-H142 IonicContact OD1-CE1 3.75Å; D140-H142 IonicContact OD1-CG 2.92Å; D140-H142 PolarHBondContact OD1-N 3.06Å; D140-H142 IonicContact OD1-ND1 3.17Å; D140-H142 PolarHBondContact OD1-ND1 2.88Å; D140-H142 IonicContact OD2-CE1 3.56Å; D140-H142 PolarHBondContact OD2-CE1 2.77Å; D140-H142 IonicContact OD2-ND1 2.64Å; D140-H142 PolarHBondContact OD2-ND1 2.92Å
141	D	78.2	Confident	86.2	Confident	57 Å²	57	43.6 Å²	43.6	31%	0.305	22%	0.218	S	C	.	.			trans	-93.8	11.8	171.1	69.6	-2.2	0	0	0	112.7	I139 S143 K184	I139-D141 PolarHBondContact O-N 2.98Å; I139-D141 VanDerWaalsContact O-N 3.15Å; D141-S143 PolarHBondContact O-N 2.72Å; D141-S143 VanDerWaalsContact OD1-CB 3.24Å; D141-S143 WeakPolarHBondContact OD1-CB 3.45Å; D141-S143 PolarHBondContact OD1-N 2.78Å; D141-S143 PolarHBondContact OD1-OG 2.82Å; D141-S143 PolarHBondContact OD2-OG 3.37Å; D141-K184 IonicContact OD2-NZ 3.75Å; D141-K184 PolarHBondContact OD2-NZ 2.79Å
142	H	83.7	Confident	86	Confident	27 Å²	27	49.3 Å²	49.3	13%	0.125	25%	0.245	C	C	.	.	S	Bend	trans	58.2	10.2	-177.2	-47.3	-28.4	0	0	0	115.1	D140 P348 H349 Q352	D140-H142 VanDerWaalsContact C-N 3.3Å; D140-H142 WeakPolarHBondContact OD1-CA 3.4Å; D140-H142 IonicContact OD1-CE1 3.75Å; D140-H142 IonicContact OD1-CG 2.92Å; D140-H142 PolarHBondContact OD1-N 3.06Å; D140-H142 IonicContact OD1-ND1 3.17Å; D140-H142 PolarHBondContact OD1-ND1 2.88Å; D140-H142 IonicContact OD2-CE1 3.56Å; D140-H142 PolarHBondContact OD2-CE1 2.77Å; D140-H142 IonicContact OD2-ND1 2.64Å; D140-H142 PolarHBondContact OD2-ND1 2.92Å; H142-P348 VanDerWaalsContact CE1-CB 3.43Å; H142-P348 WeakPolarHBondContact CE1-CB 3.3Å; H142-P348 WeakPolarHBondContact NE2-CB 3.47Å; H142-H349 AromaticContact CD2-CE1 3.91Å; H142-H349 AromaticContact CD2-NE2 3.76Å; H142-Q352 PolarHBondContact NE2-NE2 2.88Å
143	S	87.1	Confident	85.8	Confident	4 Å²	4	50.6 Å²	50.6	3%	0.028	25%	0.251	C	S	.	.			trans	-82.7	-16.1	171.7	75.4	0	0	0	0	113	D141 A145 K184 N185	D141-S143 PolarHBondContact O-N 2.72Å; D141-S143 VanDerWaalsContact OD1-CB 3.24Å; D141-S143 WeakPolarHBondContact OD1-CB 3.45Å; D141-S143 PolarHBondContact OD1-N 2.78Å; D141-S143 PolarHBondContact OD1-OG 2.82Å; D141-S143 PolarHBondContact OD2-OG 3.37Å; S143-A145 PolarHBondContact O-N 2.86Å; S143-K184 VanDerWaalsContact OG-CD 3.27Å; S143-K184 WeakPolarHBondContact OG-CD 3.07Å; S143-K184 WeakPolarHBondContact OG-CG 3.37Å; S143-N185 PolarHBondContact O-N 3.1Å
144	W	91.2	Very high	86	Confident	10 Å²	10	51 Å²	51	4%	0.038	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	135.7	178.9	-62.6	109.7	0	0	0	112.1	V133 C138 I139 F182 K184 K188 I527	V133-W144 HydrophobicContact CG2-CB 4.22Å; V133-W144 HydrophobicContact CG2-CD2 4.31Å; V133-W144 HydrophobicContact CG2-CG 3.67Å; C138-W144 HydrophobicContact CB-CZ2 4.29Å; I139-W144 PolarHBondContact O-NE1 2.84Å; W144-F182 HydrophobicContact CB-CE2 4Å; W144-F182 HydrophobicContact CB-CZ 4.25Å; W144-F182 HydrophobicContact CD2-CE1 4.37Å; W144-F182 HydrophobicContact CD2-CE2 4.34Å; W144-F182 AromaticContact CD2-CZ 3.75Å; W144-F182 HydrophobicContact CD2-CZ 3.75Å; W144-F182 HydrophobicContact CE3-CD1 4.5Å; W144-F182 AromaticContact CE3-CE1 3.75Å; W144-F182 HydrophobicContact CE3-CE1 3.75Å; W144-F182 HydrophobicContact CE3-CE2 4.07Å; W144-F182 AromaticContact CE3-CZ 3.5Å; W144-F182 HydrophobicContact CE3-CZ 3.5Å; W144-F182 VanDerWaalsContact CE3-CZ 3.5Å; W144-F182 HydrophobicContact CG-CE2 4.31Å; W144-F182 HydrophobicContact CG-CZ 4.06Å; W144-F182 HydrophobicContact CZ3-CE1 4.04Å; W144-F182 HydrophobicContact CZ3-CZ 4.24Å; W144-K184 HydrophobicContact CD2-CG 4.14Å; W144-K184 HydrophobicContact CE3-CG 3.74Å; W144-K184 HydrophobicContact CH2-CD 4Å; W144-K184 VanDerWaalsContact CH2-CE 3.5Å; W144-K184 HydrophobicContact CH2-CG 3.4Å; W144-K184 VanDerWaalsContact CH2-CG 3.4Å; W144-K184 HydrophobicContact CZ2-CD 4.16Å; W144-K184 HydrophobicContact CZ2-CG 3.88Å; W144-K184 HydrophobicContact CZ3-CB 4.41Å; W144-K184 HydrophobicContact CZ3-CD 4.42Å; W144-K184 HydrophobicContact CZ3-CG 3.36Å; W144-K188 PolarHBondContact O-NZ 2.85Å; W144-I527 HydrophobicContact CE3-CD1 4.36Å; W144-I527 HydrophobicContact CH2-CD1 3.15Å; W144-I527 HydrophobicContact CH2-CG1 3.93Å; W144-I527 HydrophobicContact CZ2-CD1 3.82Å; W144-I527 HydrophobicContact CZ3-CD1 3.46Å; W144-I527 VanDerWaalsContact CZ3-CD1 3.46Å; W144-I527 HydrophobicContact CZ3-CG1 4.44Å
145	A	94.9	Very high	86.5	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	147.6	-176.5	0	0	0	0	0	110.8	C129 S143 I147 T158 R183 N185 K188	C129-A145 VanDerWaalsContact SG-C 3.56Å; S143-A145 PolarHBondContact O-N 2.86Å; A145-I147 HydrophobicContact CB-CD1 3.97Å; A145-T158 HydrophobicContact CB-CG2 4.08Å; A145-R183 PolarHBondContact N-O 3.38Å; A145-R183 PolarHBondContact O-N 2.99Å; A145-N185 HydrophobicContact CB-CB 3.92Å; A145-K188 HydrophobicContact CB-CD 4.46Å
146	L	97	Very high	87	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132.4	163.2	-161	66.8	0	0	0	107.5	V107 A125 I128 C129 I159 V165 L180 Y181	V107-L146 HydrophobicContact CG1-CD1 4.04Å; A125-L146 HydrophobicContact CB-CB 4.37Å; A125-L146 HydrophobicContact CB-CD2 4.43Å; I128-L146 HydrophobicContact CD1-CD2 4.4Å; I128-L146 HydrophobicContact CG2-CD1 3.96Å; I128-L146 HydrophobicContact CG2-CD2 4.08Å; C129-L146 PolarHBondContact SG-N 2.59Å; L146-I159 HydrophobicContact CB-CD1 4.41Å; L146-I159 HydrophobicContact CD2-CD1 3.98Å; L146-I159 HydrophobicContact CG-CD1 4.06Å; L146-I159 PolarHBondContact O-N 2.92Å; L146-V165 HydrophobicContact CD2-CG1 4.14Å; L146-V165 HydrophobicContact CD2-CG2 3.64Å; L146-L180 HydrophobicContact CD1-CB 4.18Å; L146-L180 HydrophobicContact CD2-CD1 4.38Å; L146-L180 HydrophobicContact CD2-CD2 4.24Å; L146-L180 HydrophobicContact CG-CB 4.46Å; L146-L180 HydrophobicContact CG-CD2 4.34Å; L146-Y181 CarbonylContact C-O 3.56Å; L146-Y181 WeakPolarHBondContact CA-O 3.41Å
147	I	95.8	Very high	87.8	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.1	-176.1	-51	-60.1	0	0	0	108.4	A145 E156 R157 T158 L180 Y181 R183	A145-I147 HydrophobicContact CB-CD1 3.97Å; I147-E156 HydrophobicContact CG2-CB 3.98Å; I147-R157 CarbonylContact C-O 3.49Å; I147-R157 VanDerWaalsContact CA-O 3.29Å; I147-R157 WeakPolarHBondContact CA-O 3.33Å; I147-R157 WeakPolarHBondContact CG2-O 3.45Å; I147-T158 WeakPolarHBondContact CD1-OG1 3.38Å; I147-L180 CarbonylContact O-C 3.5Å; I147-L180 WeakPolarHBondContact O-CA 3.26Å; I147-Y181 PolarHBondContact N-O 2.76Å; I147-Y181 PolarHBondContact O-N 3.4Å; I147-R183 HydrophobicContact CG1-CG 4.08Å
148	D	94.1	Very high	88.8	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.1	165.7	-178.6	15.7	0	0	0	108.7	H150 E156 R157 I159 V168 S178	D148-H150 VanDerWaalsContact CG-NE2 3.26Å; D148-H150 IonicContact OD1-CD2 3.24Å; D148-H150 PolarHBondContact OD1-CD2 2.91Å; D148-H150 IonicContact OD1-NE2 2.72Å; D148-H150 PolarHBondContact OD1-NE2 2.91Å; D148-H150 IonicContact OD2-CD2 3.93Å; D148-H150 IonicContact OD2-CE1 3.66Å; D148-H150 IonicContact OD2-NE2 3.34Å; D148-H150 PolarHBondContact OD2-NE2 2.62Å; D148-E156 CarbonylContact O-C 3.56Å; D148-E156 WeakPolarHBondContact O-CA 3.37Å; D148-R157 HydrophobicContact CB-CG 4.3Å; D148-R157 PolarHBondContact N-O 3.24Å; D148-R157 PolarHBondContact O-N 3.25Å; D148-I159 HydrophobicContact CB-CD1 4.07Å; D148-I159 HydrophobicContact CB-CG1 4.02Å; D148-V168 HydrophobicContact CB-CG1 4.27Å; D148-S178 PolarHBondContact OD1-OG 3.07Å
149	H	92.6	Very high	89.8	Confident	30 Å²	30	32 Å²	32	14%	0.139	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	112.3	-177.4	177.1	-174.5	0	0	0	110	I151 E156 S178 R179 Y181	H149-I151 PolarHBondContact O-N 2.74Å; H149-E156 HydrophobicContact CB-CB 4.13Å; H149-S178 CarbonylContact O-C 3.5Å; H149-S178 WeakPolarHBondContact O-CA 3.36Å; H149-R179 PolarHBondContact N-O 3.19Å; H149-R179 PolarHBondContact O-N 3.43Å; H149-Y181 HydrophobicContact CB-CD2 3.87Å; H149-Y181 HydrophobicContact CB-CE2 3.96Å; H149-Y181 AromaticContact ND1-CD2 3.92Å; H149-Y181 AromaticContact ND1-CE2 3.36Å; H149-Y181 WeakPolarHBondContact ND1-CE2 3.48Å
150	H	89.9	Confident	90.8	Very high	12 Å²	12	25.9 Å²	25.9	6%	0.056	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	98	178.1	-57.3	174	0	0	0	108.9	D148 Q152 L153 G154 I155 N172 Y284	D148-H150 VanDerWaalsContact CG-NE2 3.26Å; D148-H150 IonicContact OD1-CD2 3.24Å; D148-H150 PolarHBondContact OD1-CD2 2.91Å; D148-H150 IonicContact OD1-NE2 2.72Å; D148-H150 PolarHBondContact OD1-NE2 2.91Å; D148-H150 IonicContact OD2-CD2 3.93Å; D148-H150 IonicContact OD2-CE1 3.66Å; D148-H150 IonicContact OD2-NE2 3.34Å; D148-H150 PolarHBondContact OD2-NE2 2.62Å; H150-Q152 PolarHBondContact O-N 3.2Å; H150-L153 HydrophobicContact CB-CB 4.11Å; H150-L153 HydrophobicContact CB-CD1 4.06Å; H150-L153 HydrophobicContact CB-CG 4.27Å; H150-L153 PolarHBondContact O-N 3.5Å; H150-G154 PolarHBondContact O-N 2.88Å; H150-I155 HydrophobicContact CB-CG1 3.97Å; H150-I155 PolarHBondContact N-O 3.5Å; H150-I155 PolarHBondContact O-N 2.77Å; H150-N172 PolarHBondContact CE1-OD1 3.16Å; H150-N172 VanDerWaalsContact CE1-OD1 3.25Å; H150-N172 PolarHBondContact NE2-ND2 2.9Å; H150-N172 PolarHBondContact NE2-OD1 3.44Å; H150-Y284 AromaticContact CE1-CE1 3.58Å; H150-Y284 AromaticContact CE1-CZ 3.73Å; H150-Y284 PolarHBondContact CE1-OH 3.21Å; H150-Y284 AromaticContact NE2-CE1 3.8Å
151	I	87.8	Confident	91.7	Very high	65 Å²	65	23.3 Å²	23.3	33%	0.333	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-45.9	-163.9	-56.5	170.6	0	0	0	112	H149 L153 G154 D177 R179	H149-I151 PolarHBondContact O-N 2.74Å; I151-L153 VanDerWaalsContact C-N 3.25Å; I151-L153 PolarHBondContact O-N 3.37Å; I151-G154 PolarHBondContact O-N 2.93Å; I151-G154 VanDerWaalsContact O-N 3.11Å; I151-D177 PolarHBondContact N-O 3.09Å; I151-R179 HydrophobicContact CD1-CG 3.93Å; I151-R179 VanDerWaalsContact CD1-CZ 3.48Å; I151-R179 VanDerWaalsContact CD1-NE 3.33Å
152	Q	84.9	Confident	92.6	Very high	150 Å²	150	23.4 Å²	23.4	70%	0.701	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-29.8	-179.1	-65.8	-168.1	21.4	0	0	113	H150 D177	H150-Q152 PolarHBondContact O-N 3.2Å; Q152-D177 HydrophobicContact CG-CB 4.03Å; Q152-D177 WeakPolarHBondContact CG-OD1 3.45Å; Q152-D177 PolarHBondContact NE2-OD1 3.24Å; Q152-D177 PolarHBondContact NE2-OD2 3.34Å
153	L	86.9	Confident	93.2	Very high	28 Å²	28	23.4 Å²	23.4	15%	0.147	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-20.4	176.6	-60.1	-177.4	0	0	0	112.1	H150 I151 I155 L314	H150-L153 HydrophobicContact CB-CB 4.11Å; H150-L153 HydrophobicContact CB-CD1 4.06Å; H150-L153 HydrophobicContact CB-CG 4.27Å; H150-L153 PolarHBondContact O-N 3.5Å; I151-L153 VanDerWaalsContact C-N 3.25Å; I151-L153 PolarHBondContact O-N 3.37Å; L153-I155 HydrophobicContact CB-CD1 4.09Å; L153-I155 HydrophobicContact CB-CG1 3.88Å; L153-I155 HydrophobicContact CB-CG2 4.42Å; L153-I155 HydrophobicContact CD1-CD1 3.9Å; L153-I155 HydrophobicContact CD1-CG1 4.42Å; L153-L314 HydrophobicContact CB-CD1 4.47Å; L153-L314 HydrophobicContact CD1-CD1 4.42Å; L153-L314 HydrophobicContact CD2-CD1 4.27Å
154	G	90.3	Very high	93.5	Very high	20 Å²	20	24.4 Å²	24.4	21%	0.206	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	36.6	-174.8	0	0	0	0	0	112.6	H150 I151 L287	H150-G154 PolarHBondContact O-N 2.88Å; I151-G154 PolarHBondContact O-N 2.93Å; I151-G154 VanDerWaalsContact O-N 3.11Å; G154-L287 WeakPolarHBondContact O-CB 3.4Å; G154-L287 PolarHBondContact O-N 3.49Å
155	I	92.5	Very high	93.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.9	-178.1	70.4	-179.6	0	0	0	111.6	H150 L153 Y284 T285 V286 K304 L314	H150-I155 HydrophobicContact CB-CG1 3.97Å; H150-I155 PolarHBondContact N-O 3.5Å; H150-I155 PolarHBondContact O-N 2.77Å; L153-I155 HydrophobicContact CB-CD1 4.09Å; L153-I155 HydrophobicContact CB-CG1 3.88Å; L153-I155 HydrophobicContact CB-CG2 4.42Å; L153-I155 HydrophobicContact CD1-CD1 3.9Å; L153-I155 HydrophobicContact CD1-CG1 4.42Å; I155-Y284 HydrophobicContact CB-CD1 4.41Å; I155-Y284 HydrophobicContact CB-CG 4.38Å; I155-Y284 HydrophobicContact CD1-CD1 4.01Å; I155-Y284 HydrophobicContact CD1-CD2 4.26Å; I155-Y284 HydrophobicContact CD1-CG 3.89Å; I155-Y284 HydrophobicContact CG1-CD1 3.91Å; I155-Y284 HydrophobicContact CG1-CG 4.13Å; I155-T285 VanDerWaalsContact CA-O 3.3Å; I155-T285 WeakPolarHBondContact CA-O 3.25Å; I155-V286 HydrophobicContact CG2-CB 4.5Å; I155-V286 HydrophobicContact CG2-CG2 3.96Å; I155-K304 HydrophobicContact CD1-CD 4.14Å; I155-L314 HydrophobicContact CD1-CD1 4.43Å; I155-L314 HydrophobicContact CD1-CD2 4.14Å
156	E	94.6	Very high	93.5	Very high	27 Å²	27	24.9 Å²	24.9	13%	0.126	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.1	179.1	52.6	162.6	-127.9	0	0	112.6	I147 D148 H149 R183 Y284 T285 L287	I147-E156 HydrophobicContact CG2-CB 3.98Å; D148-E156 CarbonylContact O-C 3.56Å; D148-E156 WeakPolarHBondContact O-CA 3.37Å; H149-E156 HydrophobicContact CB-CB 4.13Å; E156-R183 IonicContact OE1-CZ 2.68Å; E156-R183 IonicContact OE1-NH2 2.91Å; E156-R183 PolarHBondContact OE1-NH2 2.72Å; E156-R183 IonicContact OE2-CZ 3.95Å; E156-R183 IonicContact OE2-NH1 3.75Å; E156-R183 IonicContact OE2-NH2 3.9Å; E156-R183 PolarHBondContact OE2-NH2 3.05Å; E156-Y284 CarbonylContact O-C 3.53Å; E156-Y284 WeakPolarHBondContact O-CA 3.15Å; E156-T285 PolarHBondContact N-O 2.72Å; E156-T285 PolarHBondContact O-N 2.86Å; E156-L287 HydrophobicContact CG-CD1 4.1Å; E156-L287 HydrophobicContact CG-CD2 3.9Å; E156-L287 HydrophobicContact CG-CG 4.05Å
157	R	95.4	Very high	93.2	Very high	19 Å²	19	30 Å²	30	7%	0.072	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	152.8	171	75	173.4	-176.3	92.1	-19	111.9	I147 D148 E163 D282 I283 Y284	I147-R157 CarbonylContact C-O 3.49Å; I147-R157 VanDerWaalsContact CA-O 3.29Å; I147-R157 WeakPolarHBondContact CA-O 3.33Å; I147-R157 WeakPolarHBondContact CG2-O 3.45Å; D148-R157 HydrophobicContact CB-CG 4.3Å; D148-R157 PolarHBondContact N-O 3.24Å; D148-R157 PolarHBondContact O-N 3.25Å; R157-E163 IonicContact CZ-OE1 3.15Å; R157-E163 IonicContact CZ-OE2 2.79Å; R157-E163 VanDerWaalsContact NH1-CD 3.35Å; R157-E163 IonicContact NH1-OE1 2.69Å; R157-E163 PolarHBondContact NH1-OE1 2.64Å; R157-E163 IonicContact NH1-OE2 3.33Å; R157-E163 PolarHBondContact NH1-OE2 3.43Å; R157-E163 IonicContact NH2-OE1 2.81Å; R157-E163 IonicContact NH2-OE2 3.81Å; R157-E163 PolarHBondContact NH2-OE2 2.84Å; R157-D282 IonicContact CZ-OD2 3.68Å; R157-D282 VanDerWaalsContact CZ-OD2 3.3Å; R157-D282 IonicContact NE-OD2 2.69Å; R157-D282 PolarHBondContact NE-OD2 3.34Å; R157-D282 IonicContact NH2-OD2 3.59Å; R157-D282 PolarHBondContact NH2-OD2 3.47Å; R157-I283 WeakPolarHBondContact CB-O 3.34Å; R157-Y284 HydrophobicContact CB-CD1 3.71Å; R157-Y284 HydrophobicContact CB-CE1 4.04Å; R157-Y284 HydrophobicContact CB-CG 4.05Å; R157-Y284 HydrophobicContact CG-CD1 3.82Å; R157-Y284 HydrophobicContact CG-CE1 3.59Å; R157-Y284 HydrophobicContact CG-CG 4.45Å; R157-Y284 PolarHBondContact NE-OH 3.1Å
158	T	96.9	Very high	92.9	Very high	22 Å²	22	30.5 Å²	30.5	14%	0.135	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	137.5	161.4	-62.8	0	0	0	0	109	A145 I147 N185	A145-T158 HydrophobicContact CB-CG2 4.08Å; I147-T158 WeakPolarHBondContact CD1-OG1 3.38Å; T158-N185 PolarHBondContact OG1-ND2 3.35Å
159	I	97.2	Very high	92.6	Very high	1 Å²	1	33 Å²	33	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	121.4	163.8	-53.7	171.9	0	0	0	106.1	A125 L146 D148 E163 V168 L180	A125-I159 HydrophobicContact CB-CB 4.1Å; A125-I159 HydrophobicContact CB-CG2 3.58Å; L146-I159 HydrophobicContact CB-CD1 4.41Å; L146-I159 HydrophobicContact CD2-CD1 3.98Å; L146-I159 HydrophobicContact CG-CD1 4.06Å; L146-I159 PolarHBondContact O-N 2.92Å; D148-I159 HydrophobicContact CB-CD1 4.07Å; D148-I159 HydrophobicContact CB-CG1 4.02Å; I159-E163 HydrophobicContact CG2-CB 3.61Å; I159-E163 HydrophobicContact CG2-CG 4.25Å; I159-V168 HydrophobicContact CD1-CG1 3.96Å; I159-V168 HydrophobicContact CG1-CG1 4.28Å; I159-V168 HydrophobicContact CG2-CG2 4.07Å; I159-L180 HydrophobicContact CD1-CD2 3.52Å
160	E	97.3	Very high	92.1	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.019	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-70.6	142.9	-179	-57.3	-58.1	163.7	0	0	110.6	H162 E163 R333 F337 L341	E160-H162 WeakPolarHBondContact CB-ND1 3.44Å; E160-H162 PolarHBondContact O-N 3.27Å; E160-E163 HydrophobicContact CB-CG 4.3Å; E160-E163 PolarHBondContact N-OE1 3.16Å; E160-E163 PolarHBondContact O-N 3.39Å; E160-R333 VanDerWaalsContact CD-NH2 3.26Å; E160-R333 IonicContact OE1-CZ 2.72Å; E160-R333 IonicContact OE1-NE 3.19Å; E160-R333 PolarHBondContact OE1-NE 3.14Å; E160-R333 IonicContact OE1-NH2 2.76Å; E160-R333 PolarHBondContact OE1-NH2 2.99Å; E160-R333 IonicContact OE2-CZ 2.62Å; E160-R333 IonicContact OE2-NH2 2.67Å; E160-R333 PolarHBondContact OE2-NH2 3.28Å; E160-F337 HydrophobicContact CG-CD2 3.98Å; E160-F337 HydrophobicContact CG-CE2 3.56Å; E160-F337 HydrophobicContact CG-CZ 3.87Å; E160-L341 HydrophobicContact CG-CD1 4.11Å; E160-L341 WeakPolarHBondContact OE2-CD1 3.47Å
161	D	97.3	Very high	91.1	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.043	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-38.9	-38.2	-174.9	-81.7	27.3	0	0	0	116.7	T124 R126 K188 Y189 N344	T124-D161 WeakPolarHBondContact CB-O 3.36Å; T124-D161 PolarHBondContact OG1-O 2.91Å; R126-D161 HydrophobicContact CB-CB 3.93Å; R126-D161 WeakPolarHBondContact CB-O 3.06Å; R126-D161 IonicContact CZ-OD2 2.82Å; R126-D161 PolarHBondContact N-O 2.55Å; R126-D161 IonicContact NE-OD2 2.76Å; R126-D161 PolarHBondContact NE-OD2 2.77Å; R126-D161 IonicContact NH2-OD2 3.83Å; R126-D161 PolarHBondContact NH2-OD2 3.15Å; D161-K188 VanDerWaalsContact OD1-CE 3.25Å; D161-K188 WeakPolarHBondContact OD1-CE 3.12Å; D161-K188 IonicContact OD1-NZ 3.86Å; D161-K188 PolarHBondContact OD1-NZ 3.3Å; D161-Y189 PolarHBondContact OD1-OH 3.26Å; D161-N344 HydrophobicContact CB-CB 4Å
162	H	96.5	Very high	89.8	Confident	59 Å²	59	34.4 Å²	34.4	27%	0.273	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-15.1	-178.7	74.1	-43.7	0	0	0	116.5	E160 F337 Q340 N344	E160-H162 WeakPolarHBondContact CB-ND1 3.44Å; E160-H162 PolarHBondContact O-N 3.27Å; H162-F337 AromaticContact CE1-CD1 3.54Å; H162-F337 AromaticContact CE1-CE1 3.6Å; H162-F337 AromaticContact NE2-CD1 3.61Å; H162-F337 AromaticContact NE2-CE1 3.88Å; H162-Q340 HydrophobicContact CB-CG 4.3Å; H162-Q340 WeakPolarHBondContact CD2-CG 3.48Å; H162-N344 PolarHBondContact ND1-ND2 2.91Å; H162-N344 VanDerWaalsContact ND1-ND2 3.18Å
163	E	96.4	Very high	88.5	Confident	27 Å²	27	29.9 Å²	29.9	13%	0.126	19%	0.188	C	C	.	.	S	Bend	trans	-70.6	134.8	-175.7	-67.7	-179.6	-103.9	0	0	110	T124 A125 R157 I159 E160 V165 V168	T124-E163 WeakPolarHBondContact CA-O 3.18Å; A125-E163 PolarHBondContact N-O 2.9Å; R157-E163 IonicContact CZ-OE1 3.15Å; R157-E163 IonicContact CZ-OE2 2.79Å; R157-E163 VanDerWaalsContact NH1-CD 3.35Å; R157-E163 IonicContact NH1-OE1 2.69Å; R157-E163 PolarHBondContact NH1-OE1 2.64Å; R157-E163 IonicContact NH1-OE2 3.33Å; R157-E163 PolarHBondContact NH1-OE2 3.43Å; R157-E163 IonicContact NH2-OE1 2.81Å; R157-E163 IonicContact NH2-OE2 3.81Å; R157-E163 PolarHBondContact NH2-OE2 2.84Å; I159-E163 HydrophobicContact CG2-CB 3.61Å; I159-E163 HydrophobicContact CG2-CG 4.25Å; E160-E163 HydrophobicContact CB-CG 4.3Å; E160-E163 PolarHBondContact N-OE1 3.16Å; E160-E163 PolarHBondContact O-N 3.39Å; E163-V165 PolarHBondContact O-N 3.14Å; E163-V168 HydrophobicContact CB-CG2 4.29Å
164	C	95.1	Very high	86.8	Confident	25 Å²	25	37.7 Å²	37.7	17%	0.169	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-67.1	122.5	169.4	174.3	0	0	0	0	109.2	M166 D167 V168	C164-M166 PolarHBondContact O-N 2.85Å; C164-D167 HydrophobicContact CB-CB 4.03Å; C164-D167 VanDerWaalsContact CB-OD2 3.29Å; C164-D167 WeakPolarHBondContact CB-OD2 3.49Å; C164-D167 PolarHBondContact O-N 2.77Å; C164-V168 PolarHBondContact O-N 3.23Å
165	V	94.3	Very high	85.1	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-69.2	-25.9	-177.2	175.9	0	0	0	0	111.6	I105 V123 A125 I128 L146 E163 L169 L180	I105-V165 HydrophobicContact CD1-CG1 4.49Å; V123-V165 HydrophobicContact CG1-CB 4.26Å; V123-V165 PolarHBondContact O-N 2.87Å; A125-V165 HydrophobicContact CB-CG2 4.06Å; I128-V165 HydrophobicContact CD1-CB 3.91Å; I128-V165 HydrophobicContact CD1-CG1 4.08Å; I128-V165 HydrophobicContact CD1-CG2 3.62Å; L146-V165 HydrophobicContact CD2-CG1 4.14Å; L146-V165 HydrophobicContact CD2-CG2 3.64Å; E163-V165 PolarHBondContact O-N 3.14Å; V165-L169 HydrophobicContact CG1-CD1 4.12Å; V165-L169 HydrophobicContact CG1-CG 4.33Å; V165-L169 WeakPolarHBondContact O-CB 3.42Å; V165-L169 VanDerWaalsContact O-CG 3.29Å; V165-L169 WeakPolarHBondContact O-CG 3.49Å; V165-L169 PolarHBondContact O-N 3.45Å; V165-L180 HydrophobicContact CG1-CD1 3.58Å; V165-L180 HydrophobicContact CG1-CD2 4.43Å
166	M	91.5	Very high	83.5	Confident	20 Å²	20	47.2 Å²	47.2	10%	0.099	27%	0.274	C	S	.	.	H	α-helix	trans	-72.4	-31.8	175.3	-58.3	-45.7	-52.2	0	0	112.9	Q103 I105 T121 C164 L169 S170	Q103-M166 HydrophobicContact CB-CE 4.28Å; Q103-M166 HydrophobicContact CG-CE 4.03Å; Q103-M166 VanDerWaalsContact OE1-CE 3.26Å; I105-M166 HydrophobicContact CG2-SD 3.95Å; T121-M166 WeakPolarHBondContact O-CG 3.4Å; C164-M166 PolarHBondContact O-N 2.85Å; M166-L169 HydrophobicContact CE-CD1 4.29Å; M166-L169 HydrophobicContact SD-CD1 4.29Å; M166-S170 VanDerWaalsContact O-CB 3.3Å; M166-S170 WeakPolarHBondContact O-CB 3.42Å; M166-S170 PolarHBondContact O-N 3.22Å; M166-S170 PolarHBondContact O-OG 3.26Å
167	D	90.5	Very high	82.5	Confident	108 Å²	108	48.2 Å²	48.2	58%	0.578	28%	0.281	S	S	*	.	H	α-helix	trans	-70.3	-41	175.6	-62.2	-9.7	0	0	0	110.3	C164 S170 G171	C164-D167 HydrophobicContact CB-CB 4.03Å; C164-D167 VanDerWaalsContact CB-OD2 3.29Å; C164-D167 WeakPolarHBondContact CB-OD2 3.49Å; C164-D167 PolarHBondContact O-N 2.77Å; D167-S170 PolarHBondContact O-OG 3.17Å; D167-G171 PolarHBondContact O-N 3.3Å
168	V	90.1	Very high	82	Confident	14 Å²	14	48.7 Å²	48.7	9%	0.085	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-46.6	174.2	177.8	0	0	0	0	111.3	D148 I159 E163 C164 N172	D148-V168 HydrophobicContact CB-CG1 4.27Å; I159-V168 HydrophobicContact CD1-CG1 3.96Å; I159-V168 HydrophobicContact CG1-CG1 4.28Å; I159-V168 HydrophobicContact CG2-CG2 4.07Å; E163-V168 HydrophobicContact CB-CG2 4.29Å; C164-V168 PolarHBondContact O-N 3.23Å; V168-N172 PolarHBondContact O-ND2 3.05Å
169	L	87.5	Confident	81.8	Confident	54 Å²	54	51.7 Å²	51.7	28%	0.283	30%	0.296	S	S	.	.	H	α-helix	trans	-65.9	-41	179.2	-74.6	175.5	0	0	0	112.8	I105 V165 M166 L180	I105-L169 HydrophobicContact CG2-CD1 3.79Å; V165-L169 HydrophobicContact CG1-CD1 4.12Å; V165-L169 HydrophobicContact CG1-CG 4.33Å; V165-L169 WeakPolarHBondContact O-CB 3.42Å; V165-L169 VanDerWaalsContact O-CG 3.29Å; V165-L169 WeakPolarHBondContact O-CG 3.49Å; V165-L169 PolarHBondContact O-N 3.45Å; M166-L169 HydrophobicContact CE-CD1 4.29Å; M166-L169 HydrophobicContact SD-CD1 4.29Å; L169-L180 HydrophobicContact CD1-CD1 4.05Å; L169-L180 HydrophobicContact CD2-CD1 4.04Å; L169-L180 HydrophobicContact CD2-CD2 4.27Å; L169-L180 HydrophobicContact CD2-CG 4.04Å; L169-L180 HydrophobicContact CG-CD1 4.25Å
170	S	81.6	Confident	81.6	Confident	86 Å²	86	51.8 Å²	51.8	60%	0.601	30%	0.296	S	S	*	.	H	α-helix	trans	-76.6	-26.6	-179.2	59.3	0	0	0	0	113.6	M166 D167 N172 G173	M166-S170 VanDerWaalsContact O-CB 3.3Å; M166-S170 WeakPolarHBondContact O-CB 3.42Å; M166-S170 PolarHBondContact O-N 3.22Å; M166-S170 PolarHBondContact O-OG 3.26Å; D167-S170 PolarHBondContact O-OG 3.17Å; S170-N172 PolarHBondContact O-N 3.45Å; S170-G173 PolarHBondContact O-N 3.04Å
171	G	68.4	Low	81.5	Confident	29 Å²	29	52.4 Å²	52.4	30%	0.299	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.8	176.6	0	0	0	0	0	115.4	D167 G173	D167-G171 PolarHBondContact O-N 3.3Å; G171-G173 VanDerWaalsContact C-N 3.35Å
172	N	61.1	Low	81.4	Confident	21 Å²	21	52.1 Å²	52.1	11%	0.112	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.6	179.5	-71.9	-38.6	0	0	0	114.3	H150 V168 S170	H150-N172 PolarHBondContact CE1-OD1 3.16Å; H150-N172 VanDerWaalsContact CE1-OD1 3.25Å; H150-N172 PolarHBondContact NE2-ND2 2.9Å; H150-N172 PolarHBondContact NE2-OD1 3.44Å; V168-N172 PolarHBondContact O-ND2 3.05Å; S170-N172 PolarHBondContact O-N 3.45Å
173	G	57.2	Low	81.1	Confident	55 Å²	55	51 Å²	51	57%	0.567	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	-153	-176.3	0	0	0	0	0	112.4	S170 G171 E175	S170-G173 PolarHBondContact O-N 3.04Å; G171-G173 VanDerWaalsContact C-N 3.35Å; G173-E175 PolarHBondContact O-N 3.36Å
174	M	51.6	Low	80.5	Confident	192 Å²	192	50 Å²	50	95%	0.946	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	16.6	-177.2	-59.2	-68.8	-81	0	0	113.5	T176	M174-T176 PolarHBondContact O-N 2.94Å
175	E	54.9	Low	80.3	Confident	89 Å²	89	50.4 Å²	50.4	42%	0.416	29%	0.286	S	S	.	.			trans	-83.5	106	-179.2	-66.3	-173.8	170.7	0	0	110.8	G173 D177 S309	G173-E175 PolarHBondContact O-N 3.36Å; E175-D177 PolarHBondContact O-N 3.49Å; E175-S309 VanDerWaalsContact OE1-CB 3.24Å; E175-S309 WeakPolarHBondContact OE1-CB 3.04Å
176	T	57.8	Low	79.9	Confident	131 Å²	131	51.3 Å²	51.3	80%	0.804	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	15.4	-173.1	46.7	0	0	0	0	115.5	M174	M174-T176 PolarHBondContact O-N 2.94Å
177	D	73.7	Confident	79.6	Confident	49 Å²	49	51.7 Å²	51.7	26%	0.262	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	5.2	-159.1	-68.6	-101.4	0	0	0	113.9	I151 Q152 E175	I151-D177 PolarHBondContact N-O 3.09Å; Q152-D177 HydrophobicContact CG-CB 4.03Å; Q152-D177 WeakPolarHBondContact CG-OD1 3.45Å; Q152-D177 PolarHBondContact NE2-OD1 3.24Å; Q152-D177 PolarHBondContact NE2-OD2 3.34Å; E175-D177 PolarHBondContact O-N 3.49Å
178	S	85.4	Confident	79.6	Confident	28 Å²	28	47 Å²	47	20%	0.196	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	142.4	160.6	165.4	0	0	0	0	110.6	D148 H149	D148-S178 PolarHBondContact OD1-OG 3.07Å; H149-S178 CarbonylContact O-C 3.5Å; H149-S178 WeakPolarHBondContact O-CA 3.36Å
179	R	91.4	Very high	79.8	Confident	86 Å²	86	46.7 Å²	46.7	33%	0.325	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.7	166.6	-73.5	-175.3	-169.3	162.7	6.9	110.6	F108 N112 H149 I151 Y181	F108-R179 HydrophobicContact CD2-CB 3.96Å; F108-R179 HydrophobicContact CD2-CG 4.02Å; F108-R179 HydrophobicContact CE2-CB 4.01Å; F108-R179 HydrophobicContact CE2-CG 3.59Å; F108-R179 HydrophobicContact CZ-CG 3.97Å; N112-R179 PolarHBondContact OD1-NH1 3.17Å; H149-R179 PolarHBondContact N-O 3.19Å; H149-R179 PolarHBondContact O-N 3.43Å; I151-R179 HydrophobicContact CD1-CG 3.93Å; I151-R179 VanDerWaalsContact CD1-CZ 3.48Å; I151-R179 VanDerWaalsContact CD1-NE 3.33Å; R179-Y181 HydrophobicContact CB-CD2 4.02Å; R179-Y181 HydrophobicContact CB-CE2 3.55Å; R179-Y181 HydrophobicContact CG-CE2 4.43Å; R179-Y181 PolarHBondContact NH1-OH 3.17Å; R179-Y181 VanDerWaalsContact NH1-OH 3.07Å
180	L	94.9	Very high	79.9	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	118	168.4	-61.5	176	0	0	0	109.8	I105 V107 F108 L146 I147 I159 V165 L169	I105-L180 HydrophobicContact CD1-CD1 4.33Å; V107-L180 CarbonylContact C-O 3.54Å; V107-L180 WeakPolarHBondContact CA-O 3.34Å; F108-L180 PolarHBondContact N-O 3.06Å; L146-L180 HydrophobicContact CD1-CB 4.18Å; L146-L180 HydrophobicContact CD2-CD1 4.38Å; L146-L180 HydrophobicContact CD2-CD2 4.24Å; L146-L180 HydrophobicContact CG-CB 4.46Å; L146-L180 HydrophobicContact CG-CD2 4.34Å; I147-L180 CarbonylContact O-C 3.5Å; I147-L180 WeakPolarHBondContact O-CA 3.26Å; I159-L180 HydrophobicContact CD1-CD2 3.52Å; V165-L180 HydrophobicContact CG1-CD1 3.58Å; V165-L180 HydrophobicContact CG1-CD2 4.43Å; L169-L180 HydrophobicContact CD1-CD1 4.05Å; L169-L180 HydrophobicContact CD2-CD1 4.04Å; L169-L180 HydrophobicContact CD2-CD2 4.27Å; L169-L180 HydrophobicContact CD2-CG 4.04Å; L169-L180 HydrophobicContact CG-CD1 4.25Å
181	Y	94.4	Very high	80.3	Confident	16 Å²	16	42.2 Å²	42.2	6%	0.063	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	135.7	172.6	-73.5	-97.4	0	0	0	110.9	F108 D109 N112 L146 I147 H149 R179	F108-Y181 HydrophobicContact CB-CD1 3.62Å; F108-Y181 HydrophobicContact CB-CE1 3.64Å; F108-Y181 HydrophobicContact CB-CG 4.1Å; F108-Y181 HydrophobicContact CG-CE1 4.41Å; F108-Y181 WeakPolarHBondContact O-CA 3.2Å; D109-Y181 VanDerWaalsContact O-CD1 3.24Å; D109-Y181 WeakPolarHBondContact O-CD1 3.32Å; D109-Y181 WeakPolarHBondContact O-CE1 3.3Å; N112-Y181 PolarHBondContact OD1-OH 2.92Å; L146-Y181 CarbonylContact C-O 3.56Å; L146-Y181 WeakPolarHBondContact CA-O 3.41Å; I147-Y181 PolarHBondContact N-O 2.76Å; I147-Y181 PolarHBondContact O-N 3.4Å; H149-Y181 HydrophobicContact CB-CD2 3.87Å; H149-Y181 HydrophobicContact CB-CE2 3.96Å; H149-Y181 AromaticContact ND1-CD2 3.92Å; H149-Y181 AromaticContact ND1-CE2 3.36Å; H149-Y181 WeakPolarHBondContact ND1-CE2 3.48Å; R179-Y181 HydrophobicContact CB-CD2 4.02Å; R179-Y181 HydrophobicContact CB-CE2 3.55Å; R179-Y181 HydrophobicContact CG-CE2 4.43Å; R179-Y181 PolarHBondContact NH1-OH 3.17Å; R179-Y181 VanDerWaalsContact NH1-OH 3.07Å
182	F	94.8	Very high	81.4	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.009	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	113.5	170.7	172.5	-98.3	0	0	0	109.4	V107 F108 C129 F132 V133 W144 I527 L529	V107-F182 HydrophobicContact CG1-CB 3.6Å; F108-F182 PolarHBondContact O-N 3.46Å; C129-F182 HydrophobicContact CB-CE2 4.2Å; F132-F182 HydrophobicContact CB-CD1 4.08Å; F132-F182 HydrophobicContact CB-CD2 3.95Å; F132-F182 HydrophobicContact CB-CE1 3.89Å; F132-F182 HydrophobicContact CB-CE2 3.77Å; F132-F182 HydrophobicContact CB-CG 4.11Å; F132-F182 HydrophobicContact CB-CZ 3.74Å; F132-F182 HydrophobicContact CD1-CD1 4.28Å; F132-F182 HydrophobicContact CD1-CG 4.33Å; F132-F182 HydrophobicContact CG-CG 4.41Å; V133-F182 HydrophobicContact CG2-CZ 4.04Å; W144-F182 HydrophobicContact CB-CE2 4Å; W144-F182 HydrophobicContact CB-CZ 4.25Å; W144-F182 HydrophobicContact CD2-CE1 4.37Å; W144-F182 HydrophobicContact CD2-CE2 4.34Å; W144-F182 AromaticContact CD2-CZ 3.75Å; W144-F182 HydrophobicContact CD2-CZ 3.75Å; W144-F182 HydrophobicContact CE3-CD1 4.5Å; W144-F182 AromaticContact CE3-CE1 3.75Å; W144-F182 HydrophobicContact CE3-CE1 3.75Å; W144-F182 HydrophobicContact CE3-CE2 4.07Å; W144-F182 AromaticContact CE3-CZ 3.5Å; W144-F182 HydrophobicContact CE3-CZ 3.5Å; W144-F182 VanDerWaalsContact CE3-CZ 3.5Å; W144-F182 HydrophobicContact CG-CE2 4.31Å; W144-F182 HydrophobicContact CG-CZ 4.06Å; W144-F182 HydrophobicContact CZ3-CE1 4.04Å; W144-F182 HydrophobicContact CZ3-CZ 4.24Å; F182-I527 HydrophobicContact CE1-CD1 3.85Å; F182-L529 HydrophobicContact CD1-CD2 4.3Å
183	R	90	Very high	82.6	Confident	35 Å²	35	44.7 Å²	44.7	13%	0.132	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	-178.6	178.1	65.8	171.2	178.8	-150.8	-16.1	111.5	E110 A145 I147 E156 Q444	E110-R183 HydrophobicContact CG-CB 3.62Å; E110-R183 WeakPolarHBondContact OE1-CD 3.27Å; A145-R183 PolarHBondContact N-O 3.38Å; A145-R183 PolarHBondContact O-N 2.99Å; I147-R183 HydrophobicContact CG1-CG 4.08Å; E156-R183 IonicContact OE1-CZ 2.68Å; E156-R183 IonicContact OE1-NH2 2.91Å; E156-R183 PolarHBondContact OE1-NH2 2.72Å; E156-R183 IonicContact OE2-CZ 3.95Å; E156-R183 IonicContact OE2-NH1 3.75Å; E156-R183 IonicContact OE2-NH2 3.9Å; E156-R183 PolarHBondContact OE2-NH2 3.05Å; R183-Q444 PolarHBondContact NH1-O 3.34Å
184	K	85.2	Confident	84	Confident	7 Å²	7	46.6 Å²	46.6	3%	0.03	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	140.1	171.8	-65.1	-163.5	169.3	-163.1	0	111.8	D141 S143 W144 Y186 I525	D141-K184 IonicContact OD2-NZ 3.75Å; D141-K184 PolarHBondContact OD2-NZ 2.79Å; S143-K184 VanDerWaalsContact OG-CD 3.27Å; S143-K184 WeakPolarHBondContact OG-CD 3.07Å; S143-K184 WeakPolarHBondContact OG-CG 3.37Å; W144-K184 HydrophobicContact CD2-CG 4.14Å; W144-K184 HydrophobicContact CE3-CG 3.74Å; W144-K184 HydrophobicContact CH2-CD 4Å; W144-K184 VanDerWaalsContact CH2-CE 3.5Å; W144-K184 HydrophobicContact CH2-CG 3.4Å; W144-K184 VanDerWaalsContact CH2-CG 3.4Å; W144-K184 HydrophobicContact CZ2-CD 4.16Å; W144-K184 HydrophobicContact CZ2-CG 3.88Å; W144-K184 HydrophobicContact CZ3-CB 4.41Å; W144-K184 HydrophobicContact CZ3-CD 4.42Å; W144-K184 HydrophobicContact CZ3-CG 3.36Å; K184-Y186 HydrophobicContact CB-CD2 4.46Å; K184-Y186 HydrophobicContact CB-CE2 4.13Å; K184-Y186 HydrophobicContact CD-CE1 3.82Å; K184-Y186 HydrophobicContact CD-CE2 3.88Å; K184-Y186 WeakPolarHBondContact CD-OH 3.48Å; K184-Y186 PolarHBondContact NZ-OH 2.76Å; K184-I525 VanDerWaalsContact NZ-CD1 3.35Å
185	N	89.1	Confident	85.7	Confident	33 Å²	33	37.5 Å²	37.5	18%	0.176	19%	0.185	C	C	.	.			trans	-129.6	93.4	162	178.9	-3.3	0	0	0	108.6	S143 A145 T158 A187 K188	S143-N185 PolarHBondContact O-N 3.1Å; A145-N185 HydrophobicContact CB-CB 3.92Å; T158-N185 PolarHBondContact OG1-ND2 3.35Å; N185-A187 VanDerWaalsContact C-N 3.27Å; N185-A187 PolarHBondContact O-N 2.75Å; N185-A187 PolarHBondContact OD1-N 2.68Å; N185-A187 VanDerWaalsContact OD1-N 3.09Å; N185-K188 HydrophobicContact CB-CB 4.23Å; N185-K188 WeakPolarHBondContact O-CB 3.48Å; N185-K188 PolarHBondContact O-N 3.3Å; N185-K188 PolarHBondContact OD1-N 2.91Å
186	Y	86.5	Confident	87	Confident	19 Å²	19	37.9 Å²	37.9	8%	0.075	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-64.4	-30.1	179.1	-64.6	-72.3	0	0	0	113.1	K184 K188 H522 H523	K184-Y186 HydrophobicContact CB-CD2 4.46Å; K184-Y186 HydrophobicContact CB-CE2 4.13Å; K184-Y186 HydrophobicContact CD-CE1 3.82Å; K184-Y186 HydrophobicContact CD-CE2 3.88Å; K184-Y186 WeakPolarHBondContact CD-OH 3.48Å; K184-Y186 PolarHBondContact NZ-OH 2.76Å; Y186-K188 VanDerWaalsContact C-N 3.35Å; Y186-K188 PolarHBondContact O-N 3.4Å; Y186-H522 HydrophobicContact CD1-CB 4.44Å; Y186-H522 AromaticContact CD1-ND1 3.78Å; Y186-H522 HydrophobicContact CD2-CB 3.66Å; Y186-H522 AromaticContact CD2-CG 3.74Å; Y186-H522 HydrophobicContact CE1-CB 4.42Å; Y186-H522 HydrophobicContact CE2-CB 3.62Å; Y186-H522 HydrophobicContact CG-CB 4.06Å; Y186-H522 AromaticContact CG-CG 3.67Å; Y186-H522 AromaticContact CG-ND1 3.73Å; Y186-H523 PolarHBondContact OH-O 2.81Å
187	A	86.2	Confident	88.3	Confident	29 Å²	29	37.5 Å²	37.5	24%	0.24	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-75.9	-17.9	-179.4	0	0	0	0	0	114.1	N185 Y189 E190 I448	N185-A187 VanDerWaalsContact C-N 3.27Å; N185-A187 PolarHBondContact O-N 2.75Å; N185-A187 PolarHBondContact OD1-N 2.68Å; N185-A187 VanDerWaalsContact OD1-N 3.09Å; A187-Y189 PolarHBondContact O-N 3.29Å; A187-E190 PolarHBondContact O-N 3.32Å; A187-E190 VanDerWaalsContact O-N 3.1Å; A187-I448 HydrophobicContact CB-CD1 4.42Å
188	K	90.7	Very high	89.1	Confident	9 Å²	9	36.1 Å²	36.1	4%	0.039	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-38	-42.7	-178.1	-176.2	-173.3	-175	-169.6	0	114.6	W144 A145 D161 N185 Y186 R333	W144-K188 PolarHBondContact O-NZ 2.85Å; A145-K188 HydrophobicContact CB-CD 4.46Å; D161-K188 VanDerWaalsContact OD1-CE 3.25Å; D161-K188 WeakPolarHBondContact OD1-CE 3.12Å; D161-K188 IonicContact OD1-NZ 3.86Å; D161-K188 PolarHBondContact OD1-NZ 3.3Å; N185-K188 HydrophobicContact CB-CB 4.23Å; N185-K188 WeakPolarHBondContact O-CB 3.48Å; N185-K188 PolarHBondContact O-N 3.3Å; N185-K188 PolarHBondContact OD1-N 2.91Å; Y186-K188 VanDerWaalsContact C-N 3.35Å; Y186-K188 PolarHBondContact O-N 3.4Å; K188-R333 PolarHBondContact O-NH1 2.93Å; K188-R333 PolarHBondContact O-NH2 3.45Å
189	Y	92.6	Very high	89.3	Confident	8 Å²	8	35.5 Å²	35.5	3%	0.031	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-128.9	18.5	-177.3	-61.6	-48.4	0	0	0	114.4	D161 A187 F191 F192 K193 L341 N344 F345	D161-Y189 PolarHBondContact OD1-OH 3.26Å; A187-Y189 PolarHBondContact O-N 3.29Å; Y189-F191 VanDerWaalsContact C-N 3.26Å; Y189-F191 PolarHBondContact O-N 2.93Å; Y189-F192 AromaticContact CD1-CD2 3.91Å; Y189-F192 HydrophobicContact CD1-CD2 3.91Å; Y189-F192 HydrophobicContact CD1-CE2 4.02Å; Y189-F192 HydrophobicContact CG-CD2 4.45Å; Y189-F192 PolarHBondContact O-N 3.47Å; Y189-K193 PolarHBondContact O-N 2.76Å; Y189-L341 HydrophobicContact CE1-CD1 4.35Å; Y189-N344 HydrophobicContact CE1-CB 4.48Å; Y189-N344 WeakPolarHBondContact OH-CB 3.27Å; Y189-F345 HydrophobicContact CD1-CB 3.91Å; Y189-F345 HydrophobicContact CD1-CD2 4.36Å; Y189-F345 HydrophobicContact CD2-CB 4.45Å; Y189-F345 AromaticContact CD2-CD2 3.93Å; Y189-F345 HydrophobicContact CD2-CD2 3.93Å; Y189-F345 HydrophobicContact CE1-CB 4.1Å; Y189-F345 HydrophobicContact CG-CB 4.12Å; Y189-F345 AromaticContact CG-CD2 3.74Å; Y189-F345 HydrophobicContact CG-CD2 3.74Å; Y189-F345 HydrophobicContact CG-CG 4.35Å
190	E	89.9	Confident	89.1	Confident	43 Å²	43	32.6 Å²	32.6	20%	0.201	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-33	-172.9	-173.4	65.9	177.6	0	0	112.8	A187 F192 K193 K194 F198	A187-E190 PolarHBondContact O-N 3.32Å; A187-E190 VanDerWaalsContact O-N 3.1Å; E190-F192 VanDerWaalsContact C-N 3.34Å; E190-F192 PolarHBondContact O-N 3.03Å; E190-K193 PolarHBondContact O-N 2.88Å; E190-K193 WeakPolarHBondContact OE2-CD 3.46Å; E190-K194 PolarHBondContact O-N 2.96Å; E190-K194 IonicContact OE1-NZ 3.34Å; E190-K194 PolarHBondContact OE1-NZ 3.34Å; E190-K194 IonicContact OE2-NZ 3.08Å; E190-F198 HydrophobicContact CB-CE2 4.21Å; E190-F198 HydrophobicContact CG-CD2 4.42Å; E190-F198 HydrophobicContact CG-CE2 4.46Å
191	F	91.3	Very high	88.6	Confident	3 Å²	3	40.1 Å²	40.1	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-55.5	-42.8	171.2	169.1	-106.3	0	0	0	113.1	Y189 K193 K194 P195 F198 F199 I220 F223 T330 L334	Y189-F191 VanDerWaalsContact C-N 3.26Å; Y189-F191 PolarHBondContact O-N 2.93Å; F191-K193 VanDerWaalsContact C-N 3.26Å; F191-K193 PolarHBondContact O-N 3.37Å; F191-K194 CarbonylContact O-C 3.56Å; F191-P195 HydrophobicContact CD2-CB 4.19Å; F191-P195 HydrophobicContact CE2-CB 3.8Å; F191-P195 HydrophobicContact CZ-CB 4.19Å; F191-P195 WeakPolarHBondContact O-CA 3.39Å; F191-P195 VanDerWaalsContact O-CB 3.29Å; F191-P195 WeakPolarHBondContact O-CB 3.43Å; F191-P195 VanDerWaalsContact O-CD 3.29Å; F191-P195 WeakPolarHBondContact O-CD 3.25Å; F191-F198 HydrophobicContact CB-CD1 3.99Å; F191-F198 HydrophobicContact CB-CD2 3.94Å; F191-F198 HydrophobicContact CB-CE1 4.08Å; F191-F198 HydrophobicContact CB-CE2 4.04Å; F191-F198 HydrophobicContact CB-CG 3.92Å; F191-F198 HydrophobicContact CB-CZ 4.11Å; F191-F198 HydrophobicContact CD2-CB 4.02Å; F191-F198 AromaticContact CD2-CD1 3.8Å; F191-F198 HydrophobicContact CD2-CD1 3.8Å; F191-F198 AromaticContact CD2-CG 3.95Å; F191-F198 HydrophobicContact CD2-CG 3.95Å; F191-F198 HydrophobicContact CG-CD1 4.33Å; F191-F198 HydrophobicContact CG-CG 4.45Å; F191-F199 HydrophobicContact CD2-CD2 4.23Å; F191-F199 AromaticContact CD2-CE2 3.73Å; F191-F199 HydrophobicContact CD2-CE2 3.73Å; F191-F199 HydrophobicContact CE2-CD2 4.11Å; F191-F199 AromaticContact CE2-CE2 3.66Å; F191-F199 HydrophobicContact CE2-CE2 3.66Å; F191-I220 HydrophobicContact CE1-CG1 4.36Å; F191-I220 HydrophobicContact CZ-CG1 4.36Å; F191-F223 HydrophobicContact CE1-CB 4.45Å; F191-F223 HydrophobicContact CE2-CD2 4.02Å; F191-F223 HydrophobicContact CE2-CE2 4.14Å; F191-F223 HydrophobicContact CZ-CB 4.13Å; F191-F223 AromaticContact CZ-CD2 3.59Å; F191-F223 HydrophobicContact CZ-CD2 3.59Å; F191-F223 HydrophobicContact CZ-CE2 4.18Å; F191-F223 AromaticContact CZ-CG 3.94Å; F191-F223 HydrophobicContact CZ-CG 3.94Å; F191-T330 HydrophobicContact CB-CG2 3.89Å; F191-T330 HydrophobicContact CG-CG2 4.48Å; F191-L334 HydrophobicContact CD1-CD1 3.78Å; F191-L334 HydrophobicContact CD1-CD2 3.98Å; F191-L334 HydrophobicContact CD1-CG 4.42Å; F191-L334 HydrophobicContact CE1-CD1 3.74Å; F191-L334 HydrophobicContact CE1-CD2 3.85Å; F191-L334 HydrophobicContact CE1-CG 4.46Å; F191-L334 HydrophobicContact CG-CD1 4.22Å; F191-L334 HydrophobicContact CZ-CD1 4.15Å
192	F	90.2	Very high	88.2	Confident	8 Å²	8	45.9 Å²	45.9	4%	0.035	23%	0.228	C	C	.	.	H	α-helix	trans	-76.9	-13.6	179.3	-55.7	-56.8	0	0	0	113.4	Y189 E190 I220 L224 L334 L341 Y342 F345	Y189-F192 AromaticContact CD1-CD2 3.91Å; Y189-F192 HydrophobicContact CD1-CD2 3.91Å; Y189-F192 HydrophobicContact CD1-CE2 4.02Å; Y189-F192 HydrophobicContact CG-CD2 4.45Å; Y189-F192 PolarHBondContact O-N 3.47Å; E190-F192 VanDerWaalsContact C-N 3.34Å; E190-F192 PolarHBondContact O-N 3.03Å; F192-I220 HydrophobicContact CD1-CD1 4.3Å; F192-I220 HydrophobicContact CD1-CG1 4.48Å; F192-I220 HydrophobicContact CD1-CG2 4.4Å; F192-L224 HydrophobicContact CE1-CD2 4.47Å; F192-L334 HydrophobicContact CE1-CD2 3.99Å; F192-L334 HydrophobicContact CZ-CD2 3.91Å; F192-L341 HydrophobicContact CE2-CG 4.01Å; F192-L341 WeakPolarHBondContact CE2-O 3.24Å; F192-L341 HydrophobicContact CZ-CB 4.32Å; F192-L341 HydrophobicContact CZ-CD2 4.4Å; F192-L341 HydrophobicContact CZ-CG 4.12Å; F192-Y342 AromaticContact CD1-CD2 3.73Å; F192-Y342 HydrophobicContact CD1-CD2 3.73Å; F192-Y342 HydrophobicContact CD1-CE2 4.42Å; F192-Y342 AromaticContact CE1-CD2 3.79Å; F192-Y342 HydrophobicContact CE1-CD2 3.79Å; F192-Y342 HydrophobicContact CE1-CG 4.37Å; F192-Y342 HydrophobicContact CG-CD2 4.21Å; F192-Y342 HydrophobicContact CZ-CD2 4.32Å; F192-F345 HydrophobicContact CB-CD1 3.48Å; F192-F345 VanDerWaalsContact CB-CD1 3.48Å; F192-F345 HydrophobicContact CB-CD2 4.13Å; F192-F345 HydrophobicContact CB-CE1 3.49Å; F192-F345 VanDerWaalsContact CB-CE1 3.49Å; F192-F345 HydrophobicContact CB-CE2 4.13Å; F192-F345 HydrophobicContact CB-CG 3.81Å; F192-F345 HydrophobicContact CB-CZ 3.82Å; F192-F345 HydrophobicContact CD2-CB 3.55Å; F192-F345 AromaticContact CD2-CD1 3.99Å; F192-F345 HydrophobicContact CD2-CD1 3.99Å; F192-F345 HydrophobicContact CD2-CD2 4.25Å; F192-F345 AromaticContact CD2-CG 3.67Å; F192-F345 HydrophobicContact CD2-CG 3.67Å; F192-F345 HydrophobicContact CE2-CB 3.95Å; F192-F345 HydrophobicContact CG-CB 4.3Å; F192-F345 AromaticContact CG-CD1 3.88Å; F192-F345 HydrophobicContact CG-CD1 3.88Å; F192-F345 HydrophobicContact CG-CE1 4.38Å; F192-F345 HydrophobicContact CG-CG 4.03Å
193	K	86.9	Confident	88.1	Confident	93 Å²	93	45.9 Å²	45.9	40%	0.404	23%	0.228	S	C	.	.	H	α-helix	trans	-89.1	-29.3	175.5	-64.9	175.6	179.2	176.5	0	112.9	Y189 E190 F191 F345	Y189-K193 PolarHBondContact O-N 2.76Å; E190-K193 PolarHBondContact O-N 2.88Å; E190-K193 WeakPolarHBondContact OE2-CD 3.46Å; F191-K193 VanDerWaalsContact C-N 3.26Å; F191-K193 PolarHBondContact O-N 3.37Å; K193-F345 HydrophobicContact CG-CE2 4.18Å; K193-F345 HydrophobicContact CG-CZ 4.42Å
194	K	86.5	Confident	87.9	Confident	95 Å²	95	45.2 Å²	45.2	41%	0.413	23%	0.228	S	C	.	.	S	Bend	trans	-147.2	61.1	-178.9	-57.2	-169.7	-169.1	68.8	0	111.9	E190 F191 L196 D197 F198	E190-K194 PolarHBondContact O-N 2.96Å; E190-K194 IonicContact OE1-NZ 3.34Å; E190-K194 PolarHBondContact OE1-NZ 3.34Å; E190-K194 IonicContact OE2-NZ 3.08Å; F191-K194 CarbonylContact O-C 3.56Å; K194-L196 VanDerWaalsContact C-N 3.26Å; K194-L196 PolarHBondContact O-N 2.92Å; K194-D197 HydrophobicContact CB-CB 4.28Å; K194-D197 PolarHBondContact O-N 2.75Å; K194-F198 WeakPolarHBondContact O-CB 3.28Å; K194-F198 PolarHBondContact O-N 3.08Å; K194-F198 VanDerWaalsContact O-N 3.16Å
195	P	86.6	Confident	87.8	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.013	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-33	-170.8	26.8	-35.9	0	0	0	112.9	F191 H216 L219 I220	F191-P195 HydrophobicContact CD2-CB 4.19Å; F191-P195 HydrophobicContact CE2-CB 3.8Å; F191-P195 HydrophobicContact CZ-CB 4.19Å; F191-P195 WeakPolarHBondContact O-CA 3.39Å; F191-P195 VanDerWaalsContact O-CB 3.29Å; F191-P195 WeakPolarHBondContact O-CB 3.43Å; F191-P195 VanDerWaalsContact O-CD 3.29Å; F191-P195 WeakPolarHBondContact O-CD 3.25Å; P195-H216 WeakPolarHBondContact CD-NE2 3.34Å; P195-H216 HydrophobicContact CG-CB 4.45Å; P195-L219 HydrophobicContact CB-CD2 4.07Å; P195-L219 HydrophobicContact CB-CG 4.44Å; P195-L219 WeakPolarHBondContact O-CD2 3.43Å; P195-I220 HydrophobicContact CB-CD1 4.33Å; P195-I220 HydrophobicContact CB-CG1 3.9Å; P195-I220 HydrophobicContact CG-CD1 3.99Å; P195-I220 HydrophobicContact CG-CG1 3.99Å
196	L	83.8	Confident	86.9	Confident	97 Å²	97	48.9 Å²	48.9	51%	0.508	25%	0.252	S	S	.	.	H	α-helix	trans	-68.3	-38	179	-59.5	173.2	0	0	0	112.5	K194 L219	K194-L196 VanDerWaalsContact C-N 3.26Å; K194-L196 PolarHBondContact O-N 2.92Å; L196-L219 HydrophobicContact CD2-CD2 3.87Å
197	D	84.8	Confident	85.6	Confident	123 Å²	123	53.5 Å²	53.5	66%	0.658	29%	0.287	S	S	*	.	H	α-helix	trans	-87.7	-9.8	-179.3	-56.8	-45.7	0	0	0	113.3	K194	K194-D197 HydrophobicContact CB-CB 4.28Å; K194-D197 PolarHBondContact O-N 2.75Å
198	F	89.4	Confident	84.1	Confident	20 Å²	20	55.3 Å²	55.3	9%	0.088	30%	0.295	C	S	.	.	H	α-helix	trans	-75.3	-51.3	-163.6	-172.1	-95.4	0	0	0	113.2	E190 F191 K194 T326 C327 T330	E190-F198 HydrophobicContact CB-CE2 4.21Å; E190-F198 HydrophobicContact CG-CD2 4.42Å; E190-F198 HydrophobicContact CG-CE2 4.46Å; F191-F198 HydrophobicContact CB-CD1 3.99Å; F191-F198 HydrophobicContact CB-CD2 3.94Å; F191-F198 HydrophobicContact CB-CE1 4.08Å; F191-F198 HydrophobicContact CB-CE2 4.04Å; F191-F198 HydrophobicContact CB-CG 3.92Å; F191-F198 HydrophobicContact CB-CZ 4.11Å; F191-F198 HydrophobicContact CD2-CB 4.02Å; F191-F198 AromaticContact CD2-CD1 3.8Å; F191-F198 HydrophobicContact CD2-CD1 3.8Å; F191-F198 AromaticContact CD2-CG 3.95Å; F191-F198 HydrophobicContact CD2-CG 3.95Å; F191-F198 HydrophobicContact CG-CD1 4.33Å; F191-F198 HydrophobicContact CG-CG 4.45Å; K194-F198 WeakPolarHBondContact O-CB 3.28Å; K194-F198 PolarHBondContact O-N 3.08Å; K194-F198 VanDerWaalsContact O-N 3.16Å; F198-T326 HydrophobicContact CE2-CG2 4.46Å; F198-T326 HydrophobicContact CZ-CG2 4.16Å; F198-C327 PolarHBondContact O-SG 3.14Å; F198-C327 VanDerWaalsContact O-SG 3.33Å; F198-T330 HydrophobicContact CE1-CG2 3.76Å; F198-T330 HydrophobicContact CZ-CG2 3.73Å; F198-T330 WeakPolarHBondContact CZ-OG1 3.34Å
199	F	89.1	Confident	82.2	Confident	15 Å²	15	64.4 Å²	64.4	7%	0.066	34%	0.337	C	S	.	.	S	Bend	trans	-97.4	132.6	-179.5	-67.7	-74.1	0	0	0	110.7	F191 V204 F223 I232 C327 A331 L334	F191-F199 HydrophobicContact CD2-CD2 4.23Å; F191-F199 AromaticContact CD2-CE2 3.73Å; F191-F199 HydrophobicContact CD2-CE2 3.73Å; F191-F199 HydrophobicContact CE2-CD2 4.11Å; F191-F199 AromaticContact CE2-CE2 3.66Å; F191-F199 HydrophobicContact CE2-CE2 3.66Å; F199-V204 HydrophobicContact CB-CG2 3.36Å; F199-V204 HydrophobicContact CD1-CG2 4.4Å; F199-V204 HydrophobicContact CD2-CG2 4.31Å; F199-V204 HydrophobicContact CG-CG2 3.82Å; F199-F223 HydrophobicContact CD2-CE2 4.05Å; F199-F223 AromaticContact CD2-CZ 3.71Å; F199-F223 HydrophobicContact CD2-CZ 3.71Å; F199-F223 AromaticContact CE2-CE1 3.79Å; F199-F223 HydrophobicContact CE2-CE1 3.79Å; F199-F223 AromaticContact CE2-CE2 3.83Å; F199-F223 HydrophobicContact CE2-CE2 3.83Å; F199-F223 AromaticContact CE2-CZ 3.35Å; F199-F223 HydrophobicContact CE2-CZ 3.35Å; F199-F223 HydrophobicContact CZ-CE1 4.09Å; F199-F223 HydrophobicContact CZ-CZ 4.04Å; F199-I232 HydrophobicContact CD1-CD1 4.12Å; F199-I232 HydrophobicContact CE1-CD1 4.01Å; F199-I232 HydrophobicContact CZ-CD1 4.32Å; F199-C327 HydrophobicContact CD1-CB 3.77Å; F199-C327 HydrophobicContact CE1-CB 3.91Å; F199-A331 HydrophobicContact CE1-CB 4.11Å; F199-A331 HydrophobicContact CZ-CB 4.2Å; F199-L334 HydrophobicContact CE2-CD1 4.48Å; F199-L334 HydrophobicContact CZ-CD1 4.32Å
200	P	87.9	Confident	80.2	Confident	25 Å²	25	68 Å²	68	16%	0.162	36%	0.36	C	S	.	.			trans	-61.5	142.3	170	-22.6	33.5	0	0	0	112.3	H202 M203	P200-H202 VanDerWaalsContact CB-CE1 3.44Å; P200-H202 WeakPolarHBondContact CB-CE1 3.45Å; P200-H202 PolarHBondContact O-N 3.47Å; P200-M203 HydrophobicContact CB-CB 4.38Å; P200-M203 WeakPolarHBondContact O-CB 3.25Å; P200-M203 PolarHBondContact O-N 3.43Å
201	D	84.2	Confident	78	Confident	160 Å²	160	74.1 Å²	74.1	86%	0.856	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-50	-39.1	-179	-50.8	-42.3	0	0	0	113.4	M203	D201-M203 PolarHBondContact O-N 2.96Å
202	H	86.7	Confident	76.3	Confident	137 Å²	137	77.7 Å²	77.7	63%	0.634	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-74.4	-9.3	-177.9	71.4	-98.3	0	0	0	114	P200 H233	P200-H202 VanDerWaalsContact CB-CE1 3.44Å; P200-H202 WeakPolarHBondContact CB-CE1 3.45Å; P200-H202 PolarHBondContact O-N 3.47Å; H202-H233 PolarHBondContact O-CE1 2.96Å
203	M	91.8	Very high	74.7	Confident	3 Å²	3	84.4 Å²	84.4	2%	0.015	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-99.4	-17.5	-175.6	-178	166	179.7	0	0	113.2	P200 D201 I232 H233 C327 W328	P200-M203 HydrophobicContact CB-CB 4.38Å; P200-M203 WeakPolarHBondContact O-CB 3.25Å; P200-M203 PolarHBondContact O-N 3.43Å; D201-M203 PolarHBondContact O-N 2.96Å; M203-I232 HydrophobicContact CE-CG2 3.53Å; M203-I232 HydrophobicContact CG-CG2 4.04Å; M203-I232 CarbonylContact O-C 3.56Å; M203-I232 WeakPolarHBondContact O-CA 3.19Å; M203-H233 WeakPolarHBondContact CA-O 3.22Å; M203-H233 WeakPolarHBondContact CG-O 3.32Å; M203-H233 PolarHBondContact O-CD2 2.99Å; M203-H233 PolarHBondContact O-N 3.31Å; M203-C327 HydrophobicContact CE-CB 3.43Å; M203-C327 VanDerWaalsContact CE-CB 3.43Å; M203-C327 HydrophobicContact SD-CB 3.49Å; M203-C327 WeakPolarHBondContact SD-CB 3.4Å; M203-W328 HydrophobicContact CE-CB 4.41Å; M203-W328 VanDerWaalsContact CE-CD1 3.49Å; M203-W328 HydrophobicContact CE-CD2 3.75Å; M203-W328 HydrophobicContact CE-CG 3.64Å; M203-W328 HydrophobicContact CE-CZ2 4.44Å
204	V	86.9	Confident	73.6	Confident	21 Å²	21	81.8 Å²	81.8	13%	0.127	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139.7	179.7	-160.7	0	0	0	0	110	F199 I206 F223 P230 I232	F199-V204 HydrophobicContact CB-CG2 3.36Å; F199-V204 HydrophobicContact CD1-CG2 4.4Å; F199-V204 HydrophobicContact CD2-CG2 4.31Å; F199-V204 HydrophobicContact CG-CG2 3.82Å; V204-I206 HydrophobicContact CB-CG1 4.39Å; V204-I206 HydrophobicContact CG1-CD1 4.27Å; V204-I206 HydrophobicContact CG1-CG1 3.56Å; V204-F223 HydrophobicContact CG1-CZ 4.18Å; V204-P230 HydrophobicContact CG1-CB 3.78Å; V204-I232 HydrophobicContact CB-CD1 4.16Å; V204-I232 HydrophobicContact CG1-CD1 3.91Å; V204-I232 HydrophobicContact CG2-CD1 3.75Å
205	S	81.8	Confident	72.9	Confident	56 Å²	56	81.3 Å²	81.3	39%	0.392	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	100.4	161	-70.1	0	0	0	0	109.1	E231 H233 K267	S205-E231 PolarHBondContact N-O 3.48Å; S205-E231 PolarHBondContact O-N 2.89Å; S205-H233 PolarHBondContact N-NE2 3.31Å; S205-H233 PolarHBondContact OG-NE2 3.41Å; S205-K267 PolarHBondContact OG-NZ 3.11Å
206	I	70.8	Confident	72.4	Confident	61 Å²	61	84.7 Å²	84.7	31%	0.313	48%	0.476	S	S	.	.			trans	-92.5	128.1	171.9	-46.3	178.8	0	0	0	108.1	V204 T208 L219	V204-I206 HydrophobicContact CB-CG1 4.39Å; V204-I206 HydrophobicContact CG1-CD1 4.27Å; V204-I206 HydrophobicContact CG1-CG1 3.56Å; I206-T208 HydrophobicContact CG2-CG2 3.94Å; I206-T208 PolarHBondContact O-N 2.99Å; I206-L219 HydrophobicContact CD1-CD1 3.57Å
207	S	59.2	Low	72.1	Confident	116 Å²	116	83.3 Å²	83.3	81%	0.811	47%	0.474	S	S	*	.			trans	-94	73.5	176.3	58.6	0	0	0	0	110.9
208	T	55.3	Low	71.8	Confident	67 Å²	67	80.9 Å²	80.9	41%	0.411	46%	0.459	S	S	.	.			trans	-84.9	117.3	172.9	42.1	0	0	0	0	111	I206 V214	I206-T208 HydrophobicContact CG2-CG2 3.94Å; I206-T208 PolarHBondContact O-N 2.99Å; T208-V214 HydrophobicContact CG2-CG2 3.98Å
209	E	50.7	Low	71.4	Confident	200 Å²	200	80.6 Å²	80.6	94%	0.935	46%	0.458	S	S	*	.			trans	-82.7	0.5	163.7	-61.4	-172.5	161.5	0	0	112
210	T	50.1	Low	71.1	Confident	82 Å²	82	80.3 Å²	80.3	50%	0.503	46%	0.457	S	S	.	.	S	Bend	trans	-97.6	147	-178.7	41.1	0	0	0	0	112.6	G212	T210-G212 PolarHBondContact O-N 3.41Å
211	N	44.9	Very low	70.9	Confident	172 Å²	172	84 Å²	84	92%	0.92	47%	0.473	S	S	*	.			trans	-76.2	86.6	-169	-74.8	-39	0	0	0	114.2	I213	N211-I213 PolarHBondContact O-N 3.49Å
212	G	55.6	Low	70.8	Confident	78 Å²	78	77.6 Å²	77.6	80%	0.804	44%	0.439	S	S	*	.	S	Bend	trans	83.2	-4.8	139.3	0	0	0	0	0	119.3	T210	T210-G212 PolarHBondContact O-N 3.41Å
213	I	55.5	Low	70.6	Confident	149 Å²	149	71.6 Å²	71.6	76%	0.764	41%	0.411	S	S	*	.			trans	-135.1	118.7	169.1	-54.7	178.6	0	0	0	108.1	N211	N211-I213 PolarHBondContact O-N 3.49Å
214	V	63.2	Low	70.2	Confident	39 Å²	39	72.2 Å²	72.2	24%	0.236	42%	0.415	C	S	.	.			trans	-95	126.3	172.8	-173.9	0	0	0	0	108.2	T208 E218 L219	T208-V214 HydrophobicContact CG2-CG2 3.98Å; V214-E218 HydrophobicContact CG1-CB 4.18Å; V214-E218 HydrophobicContact CG1-CG 4.2Å; V214-L219 HydrophobicContact CG1-CB 3.89Å
215	D	73.5	Confident	69.5	Low	84 Å²	84	75.3 Å²	75.3	45%	0.449	43%	0.426	S	S	.	.			trans	-72.2	154.2	176.6	179.8	49.6	0	0	0	112.2	S217 E218 L219	D215-S217 PolarHBondContact O-N 2.99Å; D215-S217 WeakPolarHBondContact OD2-CA 3.46Å; D215-S217 WeakPolarHBondContact OD2-CB 3.47Å; D215-S217 PolarHBondContact OD2-N 3.39Å; D215-S217 PolarHBondContact OD2-OG 2.68Å; D215-E218 HydrophobicContact CB-CB 4.08Å; D215-E218 PolarHBondContact N-OE2 2.86Å; D215-E218 PolarHBondContact O-N 2.93Å; D215-E218 VanDerWaalsContact O-N 3.15Å; D215-L219 PolarHBondContact O-N 2.83Å
216	H	74.7	Confident	68.5	Low	73 Å²	73	76.7 Å²	76.7	34%	0.338	44%	0.436	S	S	.	.	H	α-helix	trans	-52.5	-38.5	171.5	-178.2	-53.7	0	0	0	112.1	P195 I220	P195-H216 WeakPolarHBondContact CD-NE2 3.34Å; P195-H216 HydrophobicContact CG-CB 4.45Å; H216-I220 WeakPolarHBondContact O-CG1 3.27Å; H216-I220 PolarHBondContact O-N 3.48Å
217	S	77.4	Confident	68.1	Low	69 Å²	69	78.1 Å²	78.1	48%	0.483	45%	0.451	S	S	.	.	H	α-helix	trans	-74	-43.6	177.8	-35.6	0	0	0	0	111.1	D215 I220 E221	D215-S217 PolarHBondContact O-N 2.99Å; D215-S217 WeakPolarHBondContact OD2-CA 3.46Å; D215-S217 WeakPolarHBondContact OD2-CB 3.47Å; D215-S217 PolarHBondContact OD2-N 3.39Å; D215-S217 PolarHBondContact OD2-OG 2.68Å; S217-I220 PolarHBondContact O-N 2.86Å; S217-E221 WeakPolarHBondContact O-CB 3.28Å; S217-E221 WeakPolarHBondContact O-CG 3.32Å; S217-E221 PolarHBondContact O-N 2.86Å
218	E	78.8	Confident	68.3	Low	71 Å²	71	75.9 Å²	75.9	33%	0.332	43%	0.433	S	S	.	.	H	α-helix	trans	-64.7	-39.7	-179.4	-174.4	178.7	-153.4	0	0	112.2	V214 D215 E221 T222	V214-E218 HydrophobicContact CG1-CB 4.18Å; V214-E218 HydrophobicContact CG1-CG 4.2Å; D215-E218 HydrophobicContact CB-CB 4.08Å; D215-E218 PolarHBondContact N-OE2 2.86Å; D215-E218 PolarHBondContact O-N 2.93Å; D215-E218 VanDerWaalsContact O-N 3.15Å; E218-E221 PolarHBondContact O-N 2.83Å; E218-T222 WeakPolarHBondContact O-CB 3.23Å; E218-T222 PolarHBondContact O-N 2.95Å; E218-T222 PolarHBondContact O-OG1 2.83Å
219	L	81.4	Confident	68.9	Low	14 Å²	14	74.4 Å²	74.4	7%	0.073	43%	0.425	C	S	.	.	H	α-helix	trans	-64.5	-47.1	175.9	-175.7	56.2	0	0	0	111.4	P195 L196 I206 V214 D215 T222 F223	P195-L219 HydrophobicContact CB-CD2 4.07Å; P195-L219 HydrophobicContact CB-CG 4.44Å; P195-L219 WeakPolarHBondContact O-CD2 3.43Å; L196-L219 HydrophobicContact CD2-CD2 3.87Å; I206-L219 HydrophobicContact CD1-CD1 3.57Å; V214-L219 HydrophobicContact CG1-CB 3.89Å; D215-L219 PolarHBondContact O-N 2.83Å; L219-T222 PolarHBondContact O-N 3.1Å; L219-F223 HydrophobicContact CD1-CD2 4.04Å; L219-F223 HydrophobicContact CD1-CE2 3.78Å; L219-F223 HydrophobicContact CG-CD2 4.38Å; L219-F223 HydrophobicContact CG-CE2 4.35Å; L219-F223 WeakPolarHBondContact O-CD2 3.22Å; L219-F223 PolarHBondContact O-N 2.88Å
220	I	83.5	Confident	70.3	Confident	9 Å²	9	65.2 Å²	65.2	5%	0.046	38%	0.382	C	S	.	.	H	α-helix	trans	-59.7	-49.9	174.6	-71.8	176.4	0	0	0	109.9	F191 F192 P195 H216 S217 T222 F223 L224 Y342	F191-I220 HydrophobicContact CE1-CG1 4.36Å; F191-I220 HydrophobicContact CZ-CG1 4.36Å; F192-I220 HydrophobicContact CD1-CD1 4.3Å; F192-I220 HydrophobicContact CD1-CG1 4.48Å; F192-I220 HydrophobicContact CD1-CG2 4.4Å; P195-I220 HydrophobicContact CB-CD1 4.33Å; P195-I220 HydrophobicContact CB-CG1 3.9Å; P195-I220 HydrophobicContact CG-CD1 3.99Å; P195-I220 HydrophobicContact CG-CG1 3.99Å; H216-I220 WeakPolarHBondContact O-CG1 3.27Å; H216-I220 PolarHBondContact O-N 3.48Å; S217-I220 PolarHBondContact O-N 2.86Å; I220-T222 VanDerWaalsContact C-N 3.25Å; I220-T222 PolarHBondContact O-N 2.96Å; I220-F223 PolarHBondContact O-N 2.81Å; I220-L224 HydrophobicContact CG2-CD1 3.55Å; I220-L224 HydrophobicContact CG2-CG 4.25Å; I220-L224 VanDerWaalsContact O-CG 3.26Å; I220-L224 WeakPolarHBondContact O-CG 3.36Å; I220-L224 PolarHBondContact O-N 2.88Å; I220-L224 VanDerWaalsContact O-N 3.07Å; I220-Y342 HydrophobicContact CG2-CD2 3.99Å; I220-Y342 HydrophobicContact CG2-CE2 3.92Å
221	E	82.9	Confident	72.1	Confident	104 Å²	104	63 Å²	63	49%	0.486	37%	0.367	S	S	.	.	H	α-helix	trans	-55.7	-39.6	176.2	-83.4	-165.2	-172.5	0	0	112.5	S217 E218 L224 K225	S217-E221 WeakPolarHBondContact O-CB 3.28Å; S217-E221 WeakPolarHBondContact O-CG 3.32Å; S217-E221 PolarHBondContact O-N 2.86Å; E218-E221 PolarHBondContact O-N 2.83Å; E221-L224 CarbonylContact O-C 3.56Å; E221-L224 PolarHBondContact O-N 2.9Å; E221-L224 VanDerWaalsContact O-N 3.17Å; E221-K225 HydrophobicContact CB-CD 4.32Å; E221-K225 VanDerWaalsContact O-CB 3.26Å; E221-K225 WeakPolarHBondContact O-CB 3.17Å; E221-K225 WeakPolarHBondContact O-CD 3.29Å; E221-K225 WeakPolarHBondContact O-CG 3.3Å; E221-K225 PolarHBondContact O-N 2.86Å; E221-K225 WeakPolarHBondContact OE2-CE 3.27Å; E221-K225 IonicContact OE2-NZ 2.83Å; E221-K225 PolarHBondContact OE2-NZ 2.98Å
222	T	83.1	Confident	74.4	Confident	24 Å²	24	54.9 Å²	54.9	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-42.7	-180	-55.7	0	0	0	0	111.5	E218 L219 I220 L224 T228 P230	E218-T222 WeakPolarHBondContact O-CB 3.23Å; E218-T222 PolarHBondContact O-N 2.95Å; E218-T222 PolarHBondContact O-OG1 2.83Å; L219-T222 PolarHBondContact O-N 3.1Å; I220-T222 VanDerWaalsContact C-N 3.25Å; I220-T222 PolarHBondContact O-N 2.96Å; T222-L224 VanDerWaalsContact C-N 3.3Å; T222-L224 PolarHBondContact O-N 3Å; T222-T228 VanDerWaalsContact O-O 3.12Å; T222-P230 HydrophobicContact CG2-CG 3.87Å
223	F	82.1	Confident	76.3	Confident	12 Å²	12	52 Å²	52	5%	0.053	29%	0.288	C	S	.	.	H	α-helix	trans	-67.8	-25.2	173.6	-83.9	-80.3	0	0	0	114	F191 F199 V204 L219 I220 P230 I232 L334	F191-F223 HydrophobicContact CE1-CB 4.45Å; F191-F223 HydrophobicContact CE2-CD2 4.02Å; F191-F223 HydrophobicContact CE2-CE2 4.14Å; F191-F223 HydrophobicContact CZ-CB 4.13Å; F191-F223 AromaticContact CZ-CD2 3.59Å; F191-F223 HydrophobicContact CZ-CD2 3.59Å; F191-F223 HydrophobicContact CZ-CE2 4.18Å; F191-F223 AromaticContact CZ-CG 3.94Å; F191-F223 HydrophobicContact CZ-CG 3.94Å; F199-F223 HydrophobicContact CD2-CE2 4.05Å; F199-F223 AromaticContact CD2-CZ 3.71Å; F199-F223 HydrophobicContact CD2-CZ 3.71Å; F199-F223 AromaticContact CE2-CE1 3.79Å; F199-F223 HydrophobicContact CE2-CE1 3.79Å; F199-F223 AromaticContact CE2-CE2 3.83Å; F199-F223 HydrophobicContact CE2-CE2 3.83Å; F199-F223 AromaticContact CE2-CZ 3.35Å; F199-F223 HydrophobicContact CE2-CZ 3.35Å; F199-F223 HydrophobicContact CZ-CE1 4.09Å; F199-F223 HydrophobicContact CZ-CZ 4.04Å; V204-F223 HydrophobicContact CG1-CZ 4.18Å; L219-F223 HydrophobicContact CD1-CD2 4.04Å; L219-F223 HydrophobicContact CD1-CE2 3.78Å; L219-F223 HydrophobicContact CG-CD2 4.38Å; L219-F223 HydrophobicContact CG-CE2 4.35Å; L219-F223 WeakPolarHBondContact O-CD2 3.22Å; L219-F223 PolarHBondContact O-N 2.88Å; I220-F223 PolarHBondContact O-N 2.81Å; F223-P230 HydrophobicContact CD1-CG 3.92Å; F223-P230 HydrophobicContact CD2-CG 4.07Å; F223-P230 HydrophobicContact CE1-CB 4.01Å; F223-P230 HydrophobicContact CE1-CG 3.82Å; F223-P230 HydrophobicContact CE2-CG 3.98Å; F223-P230 HydrophobicContact CG-CG 4.05Å; F223-P230 HydrophobicContact CZ-CB 4.02Å; F223-P230 HydrophobicContact CZ-CG 3.85Å; F223-I232 HydrophobicContact CE1-CD1 4.02Å; F223-I232 HydrophobicContact CE1-CG1 4.28Å; F223-I232 HydrophobicContact CZ-CD1 4.01Å; F223-L334 HydrophobicContact CB-CD1 4.49Å; F223-L334 HydrophobicContact CD1-CD1 3.99Å; F223-L334 HydrophobicContact CG-CD1 4.32Å
224	L	82.1	Confident	78.3	Confident	16 Å²	16	45.5 Å²	45.5	8%	0.084	26%	0.258	C	S	.	.	H	α-helix	trans	-95.6	-20.5	-179.1	-57.8	175.2	0	0	0	113.9	F192 I220 E221 T222 S226 L334 G338 M339 Y342	F192-L224 HydrophobicContact CE1-CD2 4.47Å; I220-L224 HydrophobicContact CG2-CD1 3.55Å; I220-L224 HydrophobicContact CG2-CG 4.25Å; I220-L224 VanDerWaalsContact O-CG 3.26Å; I220-L224 WeakPolarHBondContact O-CG 3.36Å; I220-L224 PolarHBondContact O-N 2.88Å; I220-L224 VanDerWaalsContact O-N 3.07Å; E221-L224 CarbonylContact O-C 3.56Å; E221-L224 PolarHBondContact O-N 2.9Å; E221-L224 VanDerWaalsContact O-N 3.17Å; T222-L224 VanDerWaalsContact C-N 3.3Å; T222-L224 PolarHBondContact O-N 3Å; L224-S226 PolarHBondContact O-N 3.18Å; L224-L334 HydrophobicContact CD2-CD2 4.26Å; L224-G338 WeakPolarHBondContact CD2-O 3.32Å; L224-M339 HydrophobicContact CB-CE 3.99Å; L224-M339 HydrophobicContact CD1-CE 4.09Å; L224-M339 HydrophobicContact CD1-SD 4.21Å; L224-Y342 VanDerWaalsContact CD1-CB 3.45Å; L224-Y342 HydrophobicContact CD1-CD1 3.78Å; L224-Y342 HydrophobicContact CD1-CD2 4.13Å; L224-Y342 HydrophobicContact CD1-CG 3.51Å
225	K	74	Confident	79.9	Confident	86 Å²	86	47.6 Å²	47.6	37%	0.374	27%	0.265	S	S	.	.			trans	-68.6	108.1	177.2	-83.8	162.7	-176.3	162	0	109.7	E221 S227 T228	E221-K225 HydrophobicContact CB-CD 4.32Å; E221-K225 VanDerWaalsContact O-CB 3.26Å; E221-K225 WeakPolarHBondContact O-CB 3.17Å; E221-K225 WeakPolarHBondContact O-CD 3.29Å; E221-K225 WeakPolarHBondContact O-CG 3.3Å; E221-K225 PolarHBondContact O-N 2.86Å; E221-K225 WeakPolarHBondContact OE2-CE 3.27Å; E221-K225 IonicContact OE2-NZ 2.83Å; E221-K225 PolarHBondContact OE2-NZ 2.98Å; K225-S227 PolarHBondContact O-N 3.02Å; K225-T228 WeakPolarHBondContact CB-OG1 3.42Å; K225-T228 PolarHBondContact O-N 2.94Å
226	S	59.5	Low	81.1	Confident	84 Å²	84	43.6 Å²	43.6	59%	0.587	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-26.4	-176.4	65.1	0	0	0	0	114	L224 R255	L224-S226 PolarHBondContact O-N 3.18Å; S226-R255 VanDerWaalsContact O-CD 3.27Å; S226-R255 WeakPolarHBondContact O-CD 3.46Å; S226-R255 PolarHBondContact O-NE 2.87Å; S226-R255 VanDerWaalsContact O-NE 3.13Å; S226-R255 PolarHBondContact O-NH1 3Å
227	S	62.8	Low	82.2	Confident	91 Å²	91	41.5 Å²	41.5	64%	0.636	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-29.5	174.4	47.5	0	0	0	0	114.8	K225	K225-S227 PolarHBondContact O-N 3.02Å
228	T	63.9	Low	83.1	Confident	69 Å²	69	39.1 Å²	39.1	42%	0.423	22%	0.217	S	C	.	.			trans	-143	44.7	-158.5	51.4	0	0	0	0	113.1	T222 K225 P230	T222-T228 VanDerWaalsContact O-O 3.12Å; K225-T228 WeakPolarHBondContact CB-OG1 3.42Å; K225-T228 PolarHBondContact O-N 2.94Å; T228-P230 WeakPolarHBondContact O-CD 3.35Å
229	C	66.9	Low	83.9	Confident	36 Å²	36	38.4 Å²	38.4	24%	0.243	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-54.5	122.1	169.3	178.9	0	0	0	0	110
230	P	80.3	Confident	84.2	Confident	7 Å²	7	39.7 Å²	39.7	5%	0.045	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-55.6	146.1	175.3	-27.1	36.2	0	0	0	111.9	V204 T222 F223 T228 I232	V204-P230 HydrophobicContact CG1-CB 3.78Å; T222-P230 HydrophobicContact CG2-CG 3.87Å; F223-P230 HydrophobicContact CD1-CG 3.92Å; F223-P230 HydrophobicContact CD2-CG 4.07Å; F223-P230 HydrophobicContact CE1-CB 4.01Å; F223-P230 HydrophobicContact CE1-CG 3.82Å; F223-P230 HydrophobicContact CE2-CG 3.98Å; F223-P230 HydrophobicContact CG-CG 4.05Å; F223-P230 HydrophobicContact CZ-CB 4.02Å; F223-P230 HydrophobicContact CZ-CG 3.85Å; T228-P230 WeakPolarHBondContact O-CD 3.35Å; P230-I232 PolarHBondContact O-N 2.98Å
231	E	88.1	Confident	83.9	Confident	37 Å²	37	46.5 Å²	46.5	17%	0.173	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	117.8	173.4	-164.2	-172.8	72.3	0	0	108.8	S205 H233 V252 R254 K267	S205-E231 PolarHBondContact N-O 3.48Å; S205-E231 PolarHBondContact O-N 2.89Å; E231-H233 PolarHBondContact O-CD2 3.39Å; E231-V252 HydrophobicContact CG-CG1 3.43Å; E231-V252 VanDerWaalsContact CG-CG1 3.43Å; E231-V252 VanDerWaalsContact OE2-CG1 3.25Å; E231-V252 WeakPolarHBondContact OE2-CG1 3.32Å; E231-R254 HydrophobicContact CG-CG 4.3Å; E231-R254 IonicContact OE2-CZ 3.93Å; E231-R254 IonicContact OE2-NE 3.3Å; E231-R254 PolarHBondContact OE2-NE 3.42Å; E231-R254 IonicContact OE2-NH2 2.92Å; E231-R254 PolarHBondContact OE2-NH2 2.89Å; E231-K267 VanDerWaalsContact OE1-CD 3.23Å; E231-K267 WeakPolarHBondContact OE1-CD 3.36Å; E231-K267 WeakPolarHBondContact OE1-CE 3.26Å; E231-K267 IonicContact OE1-NZ 3.16Å; E231-K267 PolarHBondContact OE1-NZ 2.69Å
232	I	92.8	Very high	83.3	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	130.4	174.9	-62.5	-68.4	0	0	0	108.6	F199 M203 V204 F223 P230 V252 L253 W328 A331	F199-I232 HydrophobicContact CD1-CD1 4.12Å; F199-I232 HydrophobicContact CE1-CD1 4.01Å; F199-I232 HydrophobicContact CZ-CD1 4.32Å; M203-I232 HydrophobicContact CE-CG2 3.53Å; M203-I232 HydrophobicContact CG-CG2 4.04Å; M203-I232 CarbonylContact O-C 3.56Å; M203-I232 WeakPolarHBondContact O-CA 3.19Å; V204-I232 HydrophobicContact CB-CD1 4.16Å; V204-I232 HydrophobicContact CG1-CD1 3.91Å; V204-I232 HydrophobicContact CG2-CD1 3.75Å; F223-I232 HydrophobicContact CE1-CD1 4.02Å; F223-I232 HydrophobicContact CE1-CG1 4.28Å; F223-I232 HydrophobicContact CZ-CD1 4.01Å; P230-I232 PolarHBondContact O-N 2.98Å; I232-V252 CarbonylContact O-C 3.59Å; I232-V252 WeakPolarHBondContact O-CA 3.42Å; I232-L253 HydrophobicContact CB-CB 4.02Å; I232-L253 HydrophobicContact CB-CD2 4.37Å; I232-L253 PolarHBondContact O-N 3.38Å; I232-W328 HydrophobicContact CG2-CD2 4.48Å; I232-W328 HydrophobicContact CG2-CE3 4.14Å; I232-W328 HydrophobicContact CG2-CH2 4.24Å; I232-W328 HydrophobicContact CG2-CZ3 4.03Å; I232-A331 HydrophobicContact CB-CB 4.33Å; I232-A331 HydrophobicContact CG1-CB 3.92Å; I232-A331 HydrophobicContact CG2-CB 4.13Å
233	H	95.9	Very high	82.7	Confident	16 Å²	16	51.3 Å²	51.3	7%	0.074	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	157.2	-171.7	57.1	94.8	0	0	0	112.1	H202 M203 S205 E231 Y250 F251 V252 K267	H202-H233 PolarHBondContact O-CE1 2.96Å; M203-H233 WeakPolarHBondContact CA-O 3.22Å; M203-H233 WeakPolarHBondContact CG-O 3.32Å; M203-H233 PolarHBondContact O-CD2 2.99Å; M203-H233 PolarHBondContact O-N 3.31Å; S205-H233 PolarHBondContact N-NE2 3.31Å; S205-H233 PolarHBondContact OG-NE2 3.41Å; E231-H233 PolarHBondContact O-CD2 3.39Å; H233-Y250 HydrophobicContact CB-CE1 4.43Å; H233-Y250 HydrophobicContact CB-CE2 4.44Å; H233-Y250 AromaticContact ND1-CZ 3.77Å; H233-Y250 PolarHBondContact ND1-OH 2.71Å; H233-F251 WeakPolarHBondContact CA-O 3.42Å; H233-F251 WeakPolarHBondContact CB-O 3.45Å; H233-V252 HydrophobicContact CB-CG2 4.45Å; H233-K267 PolarHBondContact CD2-NZ 3.44Å; H233-K267 PolarHBondContact ND1-NZ 3.35Å; H233-K267 PolarHBondContact NE2-NZ 3.43Å
234	G	97.1	Very high	82.5	Confident	13 Å²	13	60.7 Å²	60.7	13%	0.134	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.7	177.4	-173.5	0	0	0	0	0	112	F251	G234-F251 PolarHBondContact N-O 3.23Å; G234-F251 VanDerWaalsContact N-O 3.14Å; G234-F251 PolarHBondContact O-N 3.15Å
235	H	97.9	Very high	82.9	Confident	84 Å²	84	61.9 Å²	61.9	39%	0.389	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	139.1	-179	-66	95.8	0	0	0	112.3	K248 F249 Y250	H235-K248 HydrophobicContact CB-CD 4.35Å; H235-K248 VanDerWaalsContact CB-CE 3.42Å; H235-K248 HydrophobicContact CB-CG 4.18Å; H235-F249 WeakPolarHBondContact CA-O 3.19Å; H235-Y250 AromaticContact CE1-CD2 3.84Å; H235-Y250 AromaticContact NE2-CD2 3.85Å
236	L	98.4	Very high	83.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150.4	169.2	-68.9	172.4	0	0	0	110.1	K248 F249 F251 F301 L317 A319 W328	L236-K248 WeakPolarHBondContact O-CA 3.43Å; L236-F249 PolarHBondContact N-O 3.44Å; L236-F249 PolarHBondContact O-N 2.84Å; L236-F251 HydrophobicContact CB-CD2 3.68Å; L236-F251 HydrophobicContact CB-CE2 3.95Å; L236-F251 HydrophobicContact CB-CG 4.47Å; L236-F251 HydrophobicContact CD1-CB 4.4Å; L236-F251 HydrophobicContact CD1-CD2 4.19Å; L236-F251 HydrophobicContact CD1-CG 4.19Å; L236-F251 HydrophobicContact CG-CD2 4.31Å; L236-F301 HydrophobicContact CD1-CE1 4.46Å; L236-F301 HydrophobicContact CD1-CZ 3.79Å; L236-F301 HydrophobicContact CD2-CE1 3.99Å; L236-F301 HydrophobicContact CD2-CZ 4.11Å; L236-L317 HydrophobicContact CB-CD2 4.38Å; L236-L317 HydrophobicContact CD1-CD1 4.33Å; L236-L317 HydrophobicContact CD1-CD2 4.21Å; L236-A319 HydrophobicContact CD2-CB 4.06Å; L236-W328 HydrophobicContact CD1-CD2 3.85Å; L236-W328 HydrophobicContact CD1-CE3 4.36Å; L236-W328 HydrophobicContact CD1-CG 4.08Å; L236-W328 HydrophobicContact CD1-CZ2 4.24Å; L236-W328 HydrophobicContact CD2-CG 4.3Å; L236-W328 HydrophobicContact CG-CD2 4.47Å; L236-W328 HydrophobicContact CG-CZ2 4.44Å
237	H	97.9	Very high	85.6	Confident	29 Å²	29	60 Å²	60	13%	0.134	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	136.4	167.2	-60.6	97.8	0	0	0	110.4	W246 K247 P296 L317 C318 D320	H237-W246 HydrophobicContact CB-CE3 4Å; H237-K247 CarbonylContact C-O 3.57Å; H237-K247 WeakPolarHBondContact CA-O 3.29Å; H237-P296 HydrophobicContact CB-CG 4.12Å; H237-L317 CarbonylContact O-C 3.38Å; H237-L317 VanDerWaalsContact O-CA 3.31Å; H237-L317 WeakPolarHBondContact O-CA 3.41Å; H237-C318 HydrophobicContact CB-CB 4.1Å; H237-C318 WeakPolarHBondContact CB-O 3.38Å; H237-C318 PolarHBondContact N-O 3.36Å; H237-C318 PolarHBondContact ND1-O 3.39Å; H237-C318 PolarHBondContact O-N 3.46Å; H237-D320 IonicContact CE1-OD1 2.74Å; H237-D320 PolarHBondContact CE1-OD1 3.37Å; H237-D320 IonicContact ND1-OD1 2.71Å
238	V	96.4	Very high	87.2	Confident	19 Å²	19	60.2 Å²	60.2	12%	0.115	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136.5	176.9	-174.3	0	0	0	0	108.9	W246 K247 F249 F251 F275 L317	V238-W246 VanDerWaalsContact C-CE3 3.47Å; V238-W246 CarbonylContact O-C 3.51Å; V238-W246 VanDerWaalsContact O-CA 3.25Å; V238-W246 WeakPolarHBondContact O-CA 2.9Å; V238-K247 PolarHBondContact N-O 3.17Å; V238-K247 PolarHBondContact O-N 3.14Å; V238-F249 HydrophobicContact CB-CD2 4.22Å; V238-F249 HydrophobicContact CB-CE2 4.4Å; V238-F249 HydrophobicContact CG2-CD2 3.74Å; V238-F249 HydrophobicContact CG2-CE2 4.34Å; V238-F251 HydrophobicContact CG2-CE2 3.43Å; V238-F251 VanDerWaalsContact CG2-CE2 3.43Å; V238-F251 HydrophobicContact CG2-CZ 3.41Å; V238-F251 VanDerWaalsContact CG2-CZ 3.41Å; V238-F275 HydrophobicContact CG1-CE2 3.74Å; V238-F275 HydrophobicContact CG1-CZ 4.2Å; V238-F275 HydrophobicContact CG2-CE2 4.33Å; V238-L317 HydrophobicContact CG2-CD2 3.95Å
239	K	94	Very high	88.8	Confident	56 Å²	56	59.7 Å²	59.7	24%	0.243	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	126.1	170.3	-165.7	-177	-179.1	-171.4	0	110	Q241 W246 H293 L316	K239-Q241 PolarHBondContact O-N 3.29Å; K239-W246 HydrophobicContact CB-CD2 3.89Å; K239-W246 HydrophobicContact CB-CE3 3.93Å; K239-W246 HydrophobicContact CB-CH2 3.93Å; K239-W246 HydrophobicContact CB-CZ2 3.86Å; K239-W246 HydrophobicContact CB-CZ3 3.94Å; K239-W246 HydrophobicContact CD-CZ2 3.92Å; K239-W246 HydrophobicContact CG-CD2 4.27Å; K239-W246 HydrophobicContact CG-CZ2 4.02Å; K239-H293 HydrophobicContact CD-CB 4.39Å; K239-H293 VanDerWaalsContact NZ-CG 3.35Å; K239-H293 PolarHBondContact NZ-ND1 3.33Å; K239-L316 HydrophobicContact CB-CB 3.85Å; K239-L316 HydrophobicContact CD-CB 4.14Å; K239-L316 HydrophobicContact CD-CD1 3.51Å; K239-L316 HydrophobicContact CD-CG 4.45Å; K239-L316 PolarHBondContact N-O 3.4Å
240	E	89.4	Confident	90.3	Very high	41 Å²	41	59.1 Å²	59.1	19%	0.192	29%	0.286	C	S	.	.			trans	-72.2	125.2	175.7	-69.1	-177.1	98.2	0	0	110.4	S242 K243 S245 K247	E240-S242 PolarHBondContact O-N 2.64Å; E240-S242 VanDerWaalsContact O-N 3.14Å; E240-K243 HydrophobicContact CB-CB 4.15Å; E240-K243 PolarHBondContact O-N 3.46Å; E240-S245 PolarHBondContact N-O 2.88Å; E240-S245 PolarHBondContact OE2-OG 3.25Å; E240-K247 HydrophobicContact CG-CD 4.07Å; E240-K247 HydrophobicContact CG-CG 4.45Å; E240-K247 VanDerWaalsContact OE1-CE 3.26Å; E240-K247 WeakPolarHBondContact OE1-CE 3.42Å; E240-K247 IonicContact OE1-NZ 2.75Å; E240-K247 PolarHBondContact OE1-NZ 3.43Å; E240-K247 VanDerWaalsContact OE2-CE 3.25Å; E240-K247 WeakPolarHBondContact OE2-CE 3.41Å; E240-K247 IonicContact OE2-NZ 2.75Å
241	Q	76.7	Confident	91.2	Very high	151 Å²	151	58.8 Å²	58.8	71%	0.706	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.9	-176.8	-72.5	179.2	-48.3	0	0	113.9	K239 R312	K239-Q241 PolarHBondContact O-N 3.29Å; Q241-R312 PolarHBondContact NE2-O 2.96Å
242	S	69.8	Low	91.6	Very high	107 Å²	107	57 Å²	57	75%	0.748	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-1	-178.3	56	0	0	0	0	114.7	E240	E240-S242 PolarHBondContact O-N 2.64Å; E240-S242 VanDerWaalsContact O-N 3.14Å
243	K	71.5	Confident	91.7	Very high	122 Å²	122	57 Å²	57	53%	0.53	28%	0.275	S	S	.	.	S	Bend	trans	-146.8	155.1	-172.4	-62.2	179	-177.3	173.7	0	111.9	E240 S245	E240-K243 HydrophobicContact CB-CB 4.15Å; E240-K243 PolarHBondContact O-N 3.46Å; K243-S245 WeakPolarHBondContact CB-OG 3.33Å; K243-S245 PolarHBondContact O-N 2.98Å
244	K	76.5	Confident	91.4	Very high	210 Å²	210	59.7 Å²	59.7	91%	0.913	28%	0.284	S	S	*	.	S	Bend	trans	-79.4	25.7	170.5	-62.9	-173.7	179.3	-178.6	0	113
245	S	90.2	Very high	91	Very high	40 Å²	40	66.8 Å²	66.8	28%	0.28	31%	0.307	S	S	.	.			trans	-105.1	148.5	-178.1	43	0	0	0	0	112	E240 K243	E240-S245 PolarHBondContact N-O 2.88Å; E240-S245 PolarHBondContact OE2-OG 3.25Å; K243-S245 WeakPolarHBondContact CB-OG 3.33Å; K243-S245 PolarHBondContact O-N 2.98Å
246	W	95.7	Very high	90.6	Very high	38 Å²	38	66.2 Å²	66.2	14%	0.144	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.8	173.5	-69	79.4	0	0	0	109.7	H237 V238 K239 H293 G294 A295 P296 L316 C318	H237-W246 HydrophobicContact CB-CE3 4Å; V238-W246 VanDerWaalsContact C-CE3 3.47Å; V238-W246 CarbonylContact O-C 3.51Å; V238-W246 VanDerWaalsContact O-CA 3.25Å; V238-W246 WeakPolarHBondContact O-CA 2.9Å; K239-W246 HydrophobicContact CB-CD2 3.89Å; K239-W246 HydrophobicContact CB-CE3 3.93Å; K239-W246 HydrophobicContact CB-CH2 3.93Å; K239-W246 HydrophobicContact CB-CZ2 3.86Å; K239-W246 HydrophobicContact CB-CZ3 3.94Å; K239-W246 HydrophobicContact CD-CZ2 3.92Å; K239-W246 HydrophobicContact CG-CD2 4.27Å; K239-W246 HydrophobicContact CG-CZ2 4.02Å; W246-H293 HydrophobicContact CZ2-CB 4.02Å; W246-H293 PolarHBondContact NE1-O 3.27Å; W246-G294 VanDerWaalsContact CD1-O 3.26Å; W246-G294 PolarHBondContact NE1-O 2.87Å; W246-A295 HydrophobicContact CH2-CB 4.06Å; W246-A295 HydrophobicContact CZ2-CB 3.63Å; W246-P296 HydrophobicContact CB-CG 4.1Å; W246-P296 HydrophobicContact CG-CG 4.34Å; W246-L316 HydrophobicContact CH2-CB 4.07Å; W246-C318 HydrophobicContact CE3-CB 4.01Å; W246-C318 HydrophobicContact CH2-CB 4.02Å; W246-C318 HydrophobicContact CZ3-CB 3.47Å; W246-C318 VanDerWaalsContact CZ3-CB 3.47Å
247	K	95.4	Very high	90.4	Very high	94 Å²	94	66.2 Å²	66.2	41%	0.409	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	132.7	179.2	-76.9	178.2	172.6	167.8	0	110.7	H237 V238 E240 F249	H237-K247 CarbonylContact C-O 3.57Å; H237-K247 WeakPolarHBondContact CA-O 3.29Å; V238-K247 PolarHBondContact N-O 3.17Å; V238-K247 PolarHBondContact O-N 3.14Å; E240-K247 HydrophobicContact CG-CD 4.07Å; E240-K247 HydrophobicContact CG-CG 4.45Å; E240-K247 VanDerWaalsContact OE1-CE 3.26Å; E240-K247 WeakPolarHBondContact OE1-CE 3.42Å; E240-K247 IonicContact OE1-NZ 2.75Å; E240-K247 PolarHBondContact OE1-NZ 3.43Å; E240-K247 VanDerWaalsContact OE2-CE 3.25Å; E240-K247 WeakPolarHBondContact OE2-CE 3.41Å; E240-K247 IonicContact OE2-NZ 2.75Å; K247-F249 HydrophobicContact CB-CD2 4.15Å; K247-F249 HydrophobicContact CB-CE2 3.54Å; K247-F249 HydrophobicContact CB-CZ 4.13Å; K247-F249 HydrophobicContact CD-CE2 4.29Å; K247-F249 HydrophobicContact CD-CZ 4.18Å
248	K	97	Very high	90.3	Very high	95 Å²	95	64.9 Å²	64.9	41%	0.413	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	126.1	175.4	-158.3	167.2	-171.7	155.5	0	109.7	H235 L236 D320	H235-K248 HydrophobicContact CB-CD 4.35Å; H235-K248 VanDerWaalsContact CB-CE 3.42Å; H235-K248 HydrophobicContact CB-CG 4.18Å; L236-K248 WeakPolarHBondContact O-CA 3.43Å; K248-D320 IonicContact NZ-OD1 3.21Å; K248-D320 PolarHBondContact NZ-OD1 2.9Å; K248-D320 IonicContact NZ-OD2 3.17Å; K248-D320 PolarHBondContact NZ-OD2 3.3Å
249	F	97.9	Very high	90.4	Very high	58 Å²	58	66.2 Å²	66.2	25%	0.254	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	157.3	173.2	-66.1	-85.4	0	0	0	109.8	H235 L236 V238 K247 F251 F260	H235-F249 WeakPolarHBondContact CA-O 3.19Å; L236-F249 PolarHBondContact N-O 3.44Å; L236-F249 PolarHBondContact O-N 2.84Å; V238-F249 HydrophobicContact CB-CD2 4.22Å; V238-F249 HydrophobicContact CB-CE2 4.4Å; V238-F249 HydrophobicContact CG2-CD2 3.74Å; V238-F249 HydrophobicContact CG2-CE2 4.34Å; K247-F249 HydrophobicContact CB-CD2 4.15Å; K247-F249 HydrophobicContact CB-CE2 3.54Å; K247-F249 HydrophobicContact CB-CZ 4.13Å; K247-F249 HydrophobicContact CD-CE2 4.29Å; K247-F249 HydrophobicContact CD-CZ 4.18Å; F249-F251 HydrophobicContact CB-CD2 4.22Å; F249-F251 HydrophobicContact CB-CE2 3.93Å; F249-F260 HydrophobicContact CB-CB 4.08Å; F249-F260 HydrophobicContact CB-CD2 4.28Å; F249-F260 AromaticContact CD1-CD2 3.63Å; F249-F260 HydrophobicContact CD1-CD2 3.63Å; F249-F260 HydrophobicContact CD1-CE2 4.07Å; F249-F260 AromaticContact CE1-CD2 4Å; F249-F260 HydrophobicContact CE1-CD2 4Å; F249-F260 AromaticContact CE1-CE2 3.94Å; F249-F260 HydrophobicContact CE1-CE2 3.94Å; F249-F260 AromaticContact CG-CD2 3.93Å; F249-F260 HydrophobicContact CG-CD2 3.93Å; F249-F260 HydrophobicContact CG-CG 4.49Å; F249-F260 HydrophobicContact CZ-CE2 4.32Å
250	Y	98.1	Very high	90.5	Very high	24 Å²	24	65 Å²	65	9%	0.094	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	121.8	168	-176.4	-107.9	0	0	0	109.2	H233 H235 V252 F260 S261 A264 T265 K267	H233-Y250 HydrophobicContact CB-CE1 4.43Å; H233-Y250 HydrophobicContact CB-CE2 4.44Å; H233-Y250 AromaticContact ND1-CZ 3.77Å; H233-Y250 PolarHBondContact ND1-OH 2.71Å; H235-Y250 AromaticContact CE1-CD2 3.84Å; H235-Y250 AromaticContact NE2-CD2 3.85Å; Y250-V252 HydrophobicContact CD1-CG2 4.3Å; Y250-V252 HydrophobicContact CE1-CG2 4.13Å; Y250-F260 CarbonylContact O-C 3.51Å; Y250-F260 WeakPolarHBondContact O-CA 3.48Å; Y250-S261 PolarHBondContact O-N 2.88Å; Y250-A264 WeakPolarHBondContact CB-O 3.23Å; Y250-T265 VanDerWaalsContact CD1-CA 3.45Å; Y250-T265 HydrophobicContact CD1-CG2 4.28Å; Y250-T265 HydrophobicContact CD2-CG2 3.8Å; Y250-T265 HydrophobicContact CE1-CG2 4.45Å; Y250-T265 VanDerWaalsContact CE1-O 3.26Å; Y250-T265 WeakPolarHBondContact CE1-O 3.41Å; Y250-T265 HydrophobicContact CE2-CG2 4.05Å; Y250-T265 HydrophobicContact CG-CG2 3.91Å; Y250-K267 HydrophobicContact CE1-CG 4.1Å; Y250-K267 WeakPolarHBondContact OH-CE 3.39Å
251	F	98.1	Very high	90.9	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	154.2	-177	-87.1	-93.8	0	0	0	112.2	H233 G234 L236 V238 F249 L258 Y259 F260 F275 L317 W328	H233-F251 WeakPolarHBondContact CA-O 3.42Å; H233-F251 WeakPolarHBondContact CB-O 3.45Å; G234-F251 PolarHBondContact N-O 3.23Å; G234-F251 VanDerWaalsContact N-O 3.14Å; G234-F251 PolarHBondContact O-N 3.15Å; L236-F251 HydrophobicContact CB-CD2 3.68Å; L236-F251 HydrophobicContact CB-CE2 3.95Å; L236-F251 HydrophobicContact CB-CG 4.47Å; L236-F251 HydrophobicContact CD1-CB 4.4Å; L236-F251 HydrophobicContact CD1-CD2 4.19Å; L236-F251 HydrophobicContact CD1-CG 4.19Å; L236-F251 HydrophobicContact CG-CD2 4.31Å; V238-F251 HydrophobicContact CG2-CE2 3.43Å; V238-F251 VanDerWaalsContact CG2-CE2 3.43Å; V238-F251 HydrophobicContact CG2-CZ 3.41Å; V238-F251 VanDerWaalsContact CG2-CZ 3.41Å; F249-F251 HydrophobicContact CB-CD2 4.22Å; F249-F251 HydrophobicContact CB-CE2 3.93Å; F251-L258 HydrophobicContact CB-CD1 4.32Å; F251-L258 HydrophobicContact CD1-CD1 3.63Å; F251-L258 HydrophobicContact CD1-CD2 3.91Å; F251-L258 HydrophobicContact CD1-CG 3.61Å; F251-L258 HydrophobicContact CE1-CD1 4.44Å; F251-L258 HydrophobicContact CE1-CD2 3.93Å; F251-L258 HydrophobicContact CE1-CG 3.94Å; F251-L258 HydrophobicContact CG-CD1 4.42Å; F251-Y259 CarbonylContact C-O 3.56Å; F251-Y259 WeakPolarHBondContact CA-O 3.47Å; F251-Y259 WeakPolarHBondContact CD1-O 3.16Å; F251-F260 HydrophobicContact CD1-CB 3.96Å; F251-F260 HydrophobicContact CD2-CB 4.18Å; F251-F260 HydrophobicContact CE1-CB 3.8Å; F251-F260 HydrophobicContact CE1-CD1 4.46Å; F251-F260 HydrophobicContact CE2-CB 4.01Å; F251-F260 HydrophobicContact CG-CB 4.18Å; F251-F260 HydrophobicContact CZ-CB 3.83Å; F251-F260 HydrophobicContact CZ-CD1 4.48Å; F251-F260 HydrophobicContact CZ-CG 4.43Å; F251-F275 HydrophobicContact CE1-CB 4.11Å; F251-F275 HydrophobicContact CE1-CD1 4.22Å; F251-F275 HydrophobicContact CE1-CD2 4.01Å; F251-F275 HydrophobicContact CE1-CE2 4.47Å; F251-F275 AromaticContact CE1-CG 3.86Å; F251-F275 HydrophobicContact CE1-CG 3.86Å; F251-F275 HydrophobicContact CZ-CD2 4.07Å; F251-F275 HydrophobicContact CZ-CE2 4.19Å; F251-F275 HydrophobicContact CZ-CG 4.36Å; F251-L317 HydrophobicContact CE1-CD2 4.22Å; F251-L317 HydrophobicContact CE2-CD2 4.07Å; F251-L317 HydrophobicContact CZ-CD2 3.68Å; F251-W328 HydrophobicContact CB-CH2 3.55Å; F251-W328 HydrophobicContact CB-CZ2 3.86Å; F251-W328 HydrophobicContact CB-CZ3 4.34Å
252	V	96.7	Very high	91.9	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	116.9	178.6	-170.1	0	0	0	0	108.6	E231 I232 H233 Y250 R254 Y259 K267 L272	E231-V252 HydrophobicContact CG-CG1 3.43Å; E231-V252 VanDerWaalsContact CG-CG1 3.43Å; E231-V252 VanDerWaalsContact OE2-CG1 3.25Å; E231-V252 WeakPolarHBondContact OE2-CG1 3.32Å; I232-V252 CarbonylContact O-C 3.59Å; I232-V252 WeakPolarHBondContact O-CA 3.42Å; H233-V252 HydrophobicContact CB-CG2 4.45Å; Y250-V252 HydrophobicContact CD1-CG2 4.3Å; Y250-V252 HydrophobicContact CE1-CG2 4.13Å; V252-R254 HydrophobicContact CG1-CG 4.09Å; V252-Y259 PolarHBondContact N-O 3.47Å; V252-Y259 PolarHBondContact O-N 3.38Å; V252-K267 HydrophobicContact CG2-CG 4.24Å; V252-L272 HydrophobicContact CB-CD2 4.42Å; V252-L272 HydrophobicContact CG2-CD2 3.95Å
253	L	94.6	Very high	93.2	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	129.5	169	-165.5	68.6	0	0	0	109.1	I232 L258 F278 W328 A331 M332 L335	I232-L253 HydrophobicContact CB-CB 4.02Å; I232-L253 HydrophobicContact CB-CD2 4.37Å; I232-L253 PolarHBondContact O-N 3.38Å; L253-L258 HydrophobicContact CB-CD1 4.39Å; L253-L258 HydrophobicContact CD1-CB 4.11Å; L253-L258 HydrophobicContact CD1-CD1 4.04Å; L253-F278 HydrophobicContact CD1-CE2 3.62Å; L253-F278 HydrophobicContact CD1-CZ 4.1Å; L253-W328 HydrophobicContact CB-CZ3 4.07Å; L253-A331 HydrophobicContact CD2-CB 3.75Å; L253-M332 HydrophobicContact CD1-CG 4.23Å; L253-M332 HydrophobicContact CD2-CG 4.5Å; L253-L335 HydrophobicContact CD1-CD2 3.71Å; L253-L335 HydrophobicContact CD2-CB 4.45Å; L253-L335 HydrophobicContact CD2-CD2 4.26Å; L253-L335 HydrophobicContact CG-CD2 3.92Å
254	R	91.3	Very high	94.3	Very high	71 Å²	71	58.4 Å²	58.4	27%	0.268	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	169.4	172.2	-67.2	-175	173.6	162.1	3.8	109.3	E231 V252 S256 G257 Y259 K267 L335	E231-R254 HydrophobicContact CG-CG 4.3Å; E231-R254 IonicContact OE2-CZ 3.93Å; E231-R254 IonicContact OE2-NE 3.3Å; E231-R254 PolarHBondContact OE2-NE 3.42Å; E231-R254 IonicContact OE2-NH2 2.92Å; E231-R254 PolarHBondContact OE2-NH2 2.89Å; V252-R254 HydrophobicContact CG1-CG 4.09Å; R254-S256 PolarHBondContact O-N 3.36Å; R254-G257 PolarHBondContact N-O 2.76Å; R254-G257 PolarHBondContact O-N 3.31Å; R254-Y259 HydrophobicContact CB-CE2 4.31Å; R254-K267 PolarHBondContact NH2-O 3.41Å; R254-L335 WeakPolarHBondContact O-CD2 3.41Å
255	R	87.6	Confident	95.2	Very high	163 Å²	163	52 Å²	52	62%	0.615	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-29.6	178.7	-173.8	176.1	175.5	-170.5	-1.8	113.9	S226	S226-R255 VanDerWaalsContact O-CD 3.27Å; S226-R255 WeakPolarHBondContact O-CD 3.46Å; S226-R255 PolarHBondContact O-NE 2.87Å; S226-R255 VanDerWaalsContact O-NE 3.13Å; S226-R255 PolarHBondContact O-NH1 3Å
256	S	90.1	Very high	95.5	Very high	71 Å²	71	51.3 Å²	51.3	50%	0.497	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	2.5	178.2	54.7	0	0	0	0	114.9	R254 Y259	R254-S256 PolarHBondContact O-N 3.36Å; S256-Y259 WeakPolarHBondContact CB-OH 3.43Å; S256-Y259 WeakPolarHBondContact OG-CE2 3.3Å; S256-Y259 PolarHBondContact OG-OH 3.3Å
257	G	93.3	Very high	95.5	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	125.4	-167.9	178.8	0	0	0	0	0	114.1	R254 Y259 A276	R254-G257 PolarHBondContact N-O 2.76Å; R254-G257 PolarHBondContact O-N 3.31Å; G257-Y259 WeakPolarHBondContact O-CD2 3.09Å; G257-Y259 WeakPolarHBondContact O-CE2 3.23Å; G257-A276 CarbonylContact C-O 3.54Å; G257-A276 WeakPolarHBondContact CA-O 3.21Å
258	L	96.5	Very high	95.4	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	133.6	-179.9	-174.7	64.1	0	0	0	110.8	F251 L253 F275 A276 F278 L317 W328 M332	F251-L258 HydrophobicContact CB-CD1 4.32Å; F251-L258 HydrophobicContact CD1-CD1 3.63Å; F251-L258 HydrophobicContact CD1-CD2 3.91Å; F251-L258 HydrophobicContact CD1-CG 3.61Å; F251-L258 HydrophobicContact CE1-CD1 4.44Å; F251-L258 HydrophobicContact CE1-CD2 3.93Å; F251-L258 HydrophobicContact CE1-CG 3.94Å; F251-L258 HydrophobicContact CG-CD1 4.42Å; L253-L258 HydrophobicContact CB-CD1 4.39Å; L253-L258 HydrophobicContact CD1-CB 4.11Å; L253-L258 HydrophobicContact CD1-CD1 4.04Å; L258-F275 HydrophobicContact CD2-CD1 3.82Å; L258-F275 HydrophobicContact CD2-CE1 4.36Å; L258-F275 HydrophobicContact CG-CB 4.45Å; L258-F275 HydrophobicContact CG-CD1 4.43Å; L258-F275 WeakPolarHBondContact O-CB 3.38Å; L258-F275 PolarHBondContact O-N 3.49Å; L258-A276 PolarHBondContact N-O 2.96Å; L258-A276 PolarHBondContact O-N 3.44Å; L258-F278 HydrophobicContact CB-CE2 4.09Å; L258-F278 HydrophobicContact CB-CZ 3.92Å; L258-L317 HydrophobicContact CD2-CD1 3.9Å; L258-W328 HydrophobicContact CD1-CE3 4.36Å; L258-W328 HydrophobicContact CD1-CH2 4.29Å; L258-W328 HydrophobicContact CD1-CZ3 3.62Å; L258-M332 HydrophobicContact CD1-CE 4.21Å; L258-M332 HydrophobicContact CD2-CE 3.64Å
259	Y	97.4	Very high	95.3	Very high	47 Å²	47	51.7 Å²	51.7	18%	0.184	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	155.7	179.4	-60.2	-97.8	0	0	0	110.5	F251 V252 R254 S256 G257 L272 Q273 F274	F251-Y259 CarbonylContact C-O 3.56Å; F251-Y259 WeakPolarHBondContact CA-O 3.47Å; F251-Y259 WeakPolarHBondContact CD1-O 3.16Å; V252-Y259 PolarHBondContact N-O 3.47Å; V252-Y259 PolarHBondContact O-N 3.38Å; R254-Y259 HydrophobicContact CB-CE2 4.31Å; S256-Y259 WeakPolarHBondContact CB-OH 3.43Å; S256-Y259 WeakPolarHBondContact OG-CE2 3.3Å; S256-Y259 PolarHBondContact OG-OH 3.3Å; G257-Y259 WeakPolarHBondContact O-CD2 3.09Å; G257-Y259 WeakPolarHBondContact O-CE2 3.23Å; Y259-L272 HydrophobicContact CD1-CB 4.39Å; Y259-Q273 CarbonylContact C-O 3.58Å; Y259-Q273 VanDerWaalsContact CA-O 3.22Å; Y259-Q273 WeakPolarHBondContact CA-O 3.49Å; Y259-F274 HydrophobicContact CD1-CB 4.06Å; Y259-F274 HydrophobicContact CD1-CD2 4.44Å; Y259-F274 HydrophobicContact CE1-CB 3.85Å; Y259-F274 AromaticContact CE1-CD2 3.87Å; Y259-F274 HydrophobicContact CE1-CD2 3.87Å; Y259-F274 HydrophobicContact CE1-CG 4.36Å; Y259-F274 AromaticContact CZ-CD2 3.94Å
260	F	97.5	Very high	95.2	Very high	30 Å²	30	58.3 Å²	58.3	13%	0.132	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.9	168.1	69.2	-85.8	0	0	0	111.7	F249 Y250 F251 T262 L272 Q273 F275	F249-F260 HydrophobicContact CB-CB 4.08Å; F249-F260 HydrophobicContact CB-CD2 4.28Å; F249-F260 AromaticContact CD1-CD2 3.63Å; F249-F260 HydrophobicContact CD1-CD2 3.63Å; F249-F260 HydrophobicContact CD1-CE2 4.07Å; F249-F260 AromaticContact CE1-CD2 4Å; F249-F260 HydrophobicContact CE1-CD2 4Å; F249-F260 AromaticContact CE1-CE2 3.94Å; F249-F260 HydrophobicContact CE1-CE2 3.94Å; F249-F260 AromaticContact CG-CD2 3.93Å; F249-F260 HydrophobicContact CG-CD2 3.93Å; F249-F260 HydrophobicContact CG-CG 4.49Å; F249-F260 HydrophobicContact CZ-CE2 4.32Å; Y250-F260 CarbonylContact O-C 3.51Å; Y250-F260 WeakPolarHBondContact O-CA 3.48Å; F251-F260 HydrophobicContact CD1-CB 3.96Å; F251-F260 HydrophobicContact CD2-CB 4.18Å; F251-F260 HydrophobicContact CE1-CB 3.8Å; F251-F260 HydrophobicContact CE1-CD1 4.46Å; F251-F260 HydrophobicContact CE2-CB 4.01Å; F251-F260 HydrophobicContact CG-CB 4.18Å; F251-F260 HydrophobicContact CZ-CB 3.83Å; F251-F260 HydrophobicContact CZ-CD1 4.48Å; F251-F260 HydrophobicContact CZ-CG 4.43Å; F260-T262 HydrophobicContact CE2-CG2 4.43Å; F260-L272 WeakPolarHBondContact O-CA 3.25Å; F260-Q273 HydrophobicContact CD1-CB 4.29Å; F260-Q273 HydrophobicContact CE1-CB 3.75Å; F260-Q273 HydrophobicContact CE2-CB 4.12Å; F260-Q273 HydrophobicContact CZ-CB 3.66Å; F260-Q273 HydrophobicContact CZ-CG 4.47Å; F260-Q273 PolarHBondContact N-O 2.71Å; F260-Q273 PolarHBondContact O-N 3.3Å; F260-F275 HydrophobicContact CD1-CB 4.27Å; F260-F275 HydrophobicContact CD1-CD2 4.12Å; F260-F275 HydrophobicContact CE1-CD2 4.32Å
261	S	97.8	Very high	95.2	Very high	4 Å²	4	58.4 Å²	58.4	3%	0.028	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	134.6	177.5	-165.4	0	0	0	0	111.8	Y250 K263 A264 S266	Y250-S261 PolarHBondContact O-N 2.88Å; S261-K263 VanDerWaalsContact C-N 3.32Å; S261-K263 PolarHBondContact OG-N 3.33Å; S261-K263 PolarHBondContact OG-O 2.79Å; S261-A264 WeakPolarHBondContact CB-O 3.31Å; S261-S266 WeakPolarHBondContact CB-O 3.44Å; S261-S266 PolarHBondContact OG-O 3.37Å
262	T	97.1	Very high	95.2	Very high	76 Å²	76	59.5 Å²	59.5	47%	0.466	30%	0.301	S	S	.	.	S	Bend	trans	-83.3	-8.3	168.9	58	0	0	0	0	112.7	F260 H271 Q273	F260-T262 HydrophobicContact CE2-CG2 4.43Å; T262-H271 PolarHBondContact N-O 3.42Å; T262-H271 PolarHBondContact OG1-O 2.75Å; T262-Q273 VanDerWaalsContact CG2-CD 3.45Å; T262-Q273 HydrophobicContact CG2-CG 3.74Å
263	K	96.1	Very high	95.2	Very high	120 Å²	120	64.5 Å²	64.5	52%	0.522	32%	0.324	S	S	.	.	S	Bend	trans	-133.2	82.5	-174.6	-170.4	-176.8	179.5	-177.4	0	111.4	S261 T265 S266 H271	S261-K263 VanDerWaalsContact C-N 3.32Å; S261-K263 PolarHBondContact OG-N 3.33Å; S261-K263 PolarHBondContact OG-O 2.79Å; K263-T265 PolarHBondContact O-N 3.28Å; K263-S266 VanDerWaalsContact O-CB 3.25Å; K263-S266 WeakPolarHBondContact O-CB 3.19Å; K263-S266 PolarHBondContact O-N 2.88Å; K263-H271 HydrophobicContact CB-CB 4.07Å; K263-H271 VanDerWaalsContact CD-NE2 3.3Å; K263-H271 WeakPolarHBondContact CD-NE2 3.32Å
264	A	94.9	Very high	95.3	Very high	83 Å²	83	69.4 Å²	69.4	69%	0.686	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	-118.7	-178.6	0	0	0	0	0	111.4	Y250 S261	Y250-A264 WeakPolarHBondContact CB-O 3.23Å; S261-A264 WeakPolarHBondContact CB-O 3.31Å
265	T	96.4	Very high	95.5	Very high	77 Å²	77	67.3 Å²	67.3	47%	0.472	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	12.8	179.1	54	0	0	0	0	113.9	Y250 K263 K267	Y250-T265 VanDerWaalsContact CD1-CA 3.45Å; Y250-T265 HydrophobicContact CD1-CG2 4.28Å; Y250-T265 HydrophobicContact CD2-CG2 3.8Å; Y250-T265 HydrophobicContact CE1-CG2 4.45Å; Y250-T265 VanDerWaalsContact CE1-O 3.26Å; Y250-T265 WeakPolarHBondContact CE1-O 3.41Å; Y250-T265 HydrophobicContact CE2-CG2 4.05Å; Y250-T265 HydrophobicContact CG-CG2 3.91Å; K263-T265 PolarHBondContact O-N 3.28Å; T265-K267 PolarHBondContact O-N 3.46Å
266	S	96.5	Very high	95.8	Very high	25 Å²	25	59.6 Å²	59.6	18%	0.175	31%	0.31	C	S	.	.			trans	-66.2	124.8	-175	-175.7	0	0	0	0	112.3	S261 K263 E268 H271	S261-S266 WeakPolarHBondContact CB-O 3.44Å; S261-S266 PolarHBondContact OG-O 3.37Å; K263-S266 VanDerWaalsContact O-CB 3.25Å; K263-S266 WeakPolarHBondContact O-CB 3.19Å; K263-S266 PolarHBondContact O-N 2.88Å; S266-E268 PolarHBondContact OG-OE1 3.03Å; S266-H271 PolarHBondContact OG-ND1 3.3Å
267	K	94.9	Very high	95.9	Very high	54 Å²	54	59 Å²	59	24%	0.235	30%	0.301	C	S	.	.			trans	-93.4	4.5	178.4	-61.7	178.9	167.8	-162.4	0	113.8	S205 E231 H233 Y250 V252 R254 T265 L272	S205-K267 PolarHBondContact OG-NZ 3.11Å; E231-K267 VanDerWaalsContact OE1-CD 3.23Å; E231-K267 WeakPolarHBondContact OE1-CD 3.36Å; E231-K267 WeakPolarHBondContact OE1-CE 3.26Å; E231-K267 IonicContact OE1-NZ 3.16Å; E231-K267 PolarHBondContact OE1-NZ 2.69Å; H233-K267 PolarHBondContact CD2-NZ 3.44Å; H233-K267 PolarHBondContact ND1-NZ 3.35Å; H233-K267 PolarHBondContact NE2-NZ 3.43Å; Y250-K267 HydrophobicContact CE1-CG 4.1Å; Y250-K267 WeakPolarHBondContact OH-CE 3.39Å; V252-K267 HydrophobicContact CG2-CG 4.24Å; R254-K267 PolarHBondContact NH2-O 3.41Å; T265-K267 PolarHBondContact O-N 3.46Å; K267-L272 WeakPolarHBondContact O-CD1 3.29Å
268	E	94.5	Very high	95.8	Very high	72 Å²	72	59.6 Å²	59.6	34%	0.336	30%	0.303	S	S	.	.			trans	-63.7	137.9	177.2	-73.2	-179.9	-102.9	0	0	111.3	S266 R270 H271 L272	S266-E268 PolarHBondContact OG-OE1 3.03Å; E268-R270 HydrophobicContact CB-CG 4.48Å; E268-R270 PolarHBondContact O-N 2.81Å; E268-R270 IonicContact OE2-CZ 3.29Å; E268-R270 VanDerWaalsContact OE2-CZ 3.29Å; E268-R270 IonicContact OE2-NE 2.63Å; E268-R270 PolarHBondContact OE2-NE 2.89Å; E268-R270 IonicContact OE2-NH2 2.93Å; E268-R270 PolarHBondContact OE2-NH2 2.83Å; E268-H271 PolarHBondContact O-N 3.46Å; E268-H271 IonicContact OE1-CE1 3.2Å; E268-H271 PolarHBondContact OE1-CE1 3.43Å; E268-H271 IonicContact OE1-ND1 2.74Å; E268-H271 PolarHBondContact OE1-ND1 3Å; E268-H271 IonicContact OE2-CE1 2.76Å; E268-L272 PolarHBondContact O-N 2.99Å
269	P	94.2	Very high	95.5	Very high	108 Å²	108	63.2 Å²	63.2	70%	0.701	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-52.2	-34.8	178.7	-28.8	35.6	0	0	0	114.6	H271 L272	P269-H271 PolarHBondContact O-N 2.97Å; P269-L272 PolarHBondContact O-N 2.87Å
270	R	96.3	Very high	95	Very high	197 Å²	197	64.9 Å²	64.9	74%	0.743	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-67.2	-20.7	179.8	88.3	-177.8	87.4	-130.5	3.1	114.3	E268	E268-R270 HydrophobicContact CB-CG 4.48Å; E268-R270 PolarHBondContact O-N 2.81Å; E268-R270 IonicContact OE2-CZ 3.29Å; E268-R270 VanDerWaalsContact OE2-CZ 3.29Å; E268-R270 IonicContact OE2-NE 2.63Å; E268-R270 PolarHBondContact OE2-NE 2.89Å; E268-R270 IonicContact OE2-NH2 2.93Å; E268-R270 PolarHBondContact OE2-NH2 2.83Å
271	H	97.5	Very high	94.7	Very high	26 Å²	26	63.9 Å²	63.9	12%	0.12	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-101.8	-12.8	-179.1	-57.3	127.1	0	0	0	112.4	T262 K263 S266 E268 P269	T262-H271 PolarHBondContact N-O 3.42Å; T262-H271 PolarHBondContact OG1-O 2.75Å; K263-H271 HydrophobicContact CB-CB 4.07Å; K263-H271 VanDerWaalsContact CD-NE2 3.3Å; K263-H271 WeakPolarHBondContact CD-NE2 3.32Å; S266-H271 PolarHBondContact OG-ND1 3.3Å; E268-H271 PolarHBondContact O-N 3.46Å; E268-H271 IonicContact OE1-CE1 3.2Å; E268-H271 PolarHBondContact OE1-CE1 3.43Å; E268-H271 IonicContact OE1-ND1 2.74Å; E268-H271 PolarHBondContact OE1-ND1 3Å; E268-H271 IonicContact OE2-CE1 2.76Å; P269-H271 PolarHBondContact O-N 2.97Å
272	L	97.8	Very high	94.4	Very high	23 Å²	23	64.6 Å²	64.6	12%	0.12	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.1	-177.8	-68.3	175.6	0	0	0	111.5	V252 Y259 F260 K267 E268 P269	V252-L272 HydrophobicContact CB-CD2 4.42Å; V252-L272 HydrophobicContact CG2-CD2 3.95Å; Y259-L272 HydrophobicContact CD1-CB 4.39Å; F260-L272 WeakPolarHBondContact O-CA 3.25Å; K267-L272 WeakPolarHBondContact O-CD1 3.29Å; E268-L272 PolarHBondContact O-N 2.99Å; P269-L272 PolarHBondContact O-N 2.87Å
273	Q	97.4	Very high	94.4	Very high	105 Å²	105	61.7 Å²	61.7	49%	0.491	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	136.1	168.9	-73.9	-176.6	-12.8	0	0	110	Y259 F260 T262	Y259-Q273 CarbonylContact C-O 3.58Å; Y259-Q273 VanDerWaalsContact CA-O 3.22Å; Y259-Q273 WeakPolarHBondContact CA-O 3.49Å; F260-Q273 HydrophobicContact CD1-CB 4.29Å; F260-Q273 HydrophobicContact CE1-CB 3.75Å; F260-Q273 HydrophobicContact CE2-CB 4.12Å; F260-Q273 HydrophobicContact CZ-CB 3.66Å; F260-Q273 HydrophobicContact CZ-CG 4.47Å; F260-Q273 PolarHBondContact N-O 2.71Å; F260-Q273 PolarHBondContact O-N 3.3Å; T262-Q273 VanDerWaalsContact CG2-CD 3.45Å; T262-Q273 HydrophobicContact CG2-CG 3.74Å
274	F	96.6	Very high	94.4	Very high	105 Å²	105	56.3 Å²	56.3	46%	0.461	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	137.4	177	174.7	-104.9	0	0	0	110.8	Y259 A276 D277	Y259-F274 HydrophobicContact CD1-CB 4.06Å; Y259-F274 HydrophobicContact CD1-CD2 4.44Å; Y259-F274 HydrophobicContact CE1-CB 3.85Å; Y259-F274 AromaticContact CE1-CD2 3.87Å; Y259-F274 HydrophobicContact CE1-CD2 3.87Å; Y259-F274 HydrophobicContact CE1-CG 4.36Å; Y259-F274 AromaticContact CZ-CD2 3.94Å; F274-A276 VanDerWaalsContact CE2-C 3.46Å; F274-A276 VanDerWaalsContact CZ-C 3.41Å; F274-D277 HydrophobicContact CE2-CB 4.33Å; F274-D277 HydrophobicContact CZ-CB 4.1Å; F274-D277 VanDerWaalsContact CZ-N 3.32Å
275	F	95.4	Very high	94.4	Very high	27 Å²	27	54 Å²	54	12%	0.118	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-54	179.6	-171.8	-96.2	0	0	0	111.8	V238 F251 L258 F260 K315 L317	V238-F275 HydrophobicContact CG1-CE2 3.74Å; V238-F275 HydrophobicContact CG1-CZ 4.2Å; V238-F275 HydrophobicContact CG2-CE2 4.33Å; F251-F275 HydrophobicContact CE1-CB 4.11Å; F251-F275 HydrophobicContact CE1-CD1 4.22Å; F251-F275 HydrophobicContact CE1-CD2 4.01Å; F251-F275 HydrophobicContact CE1-CE2 4.47Å; F251-F275 AromaticContact CE1-CG 3.86Å; F251-F275 HydrophobicContact CE1-CG 3.86Å; F251-F275 HydrophobicContact CZ-CD2 4.07Å; F251-F275 HydrophobicContact CZ-CE2 4.19Å; F251-F275 HydrophobicContact CZ-CG 4.36Å; L258-F275 HydrophobicContact CD2-CD1 3.82Å; L258-F275 HydrophobicContact CD2-CE1 4.36Å; L258-F275 HydrophobicContact CG-CB 4.45Å; L258-F275 HydrophobicContact CG-CD1 4.43Å; L258-F275 WeakPolarHBondContact O-CB 3.38Å; L258-F275 PolarHBondContact O-N 3.49Å; F260-F275 HydrophobicContact CD1-CB 4.27Å; F260-F275 HydrophobicContact CD1-CD2 4.12Å; F260-F275 HydrophobicContact CE1-CD2 4.32Å; F275-K315 HydrophobicContact CD1-CD 4.43Å; F275-K315 HydrophobicContact CE1-CB 3.69Å; F275-K315 HydrophobicContact CE1-CD 4.25Å; F275-K315 HydrophobicContact CE1-CG 4.44Å; F275-K315 HydrophobicContact CZ-CB 3.82Å; F275-K315 WeakPolarHBondContact O-CE 3.48Å; F275-K315 PolarHBondContact O-NZ 3.24Å; F275-L317 HydrophobicContact CE1-CD1 3.89Å; F275-L317 HydrophobicContact CE1-CD2 4.02Å; F275-L317 HydrophobicContact CE1-CG 4.01Å; F275-L317 HydrophobicContact CE2-CD2 4.47Å; F275-L317 HydrophobicContact CZ-CD1 4.43Å; F275-L317 HydrophobicContact CZ-CD2 3.77Å; F275-L317 HydrophobicContact CZ-CG 4.05Å
276	A	94.2	Very high	94.3	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	150.6	179.6	0	0	0	0	0	111.8	G257 L258 F274 V303 K315	G257-A276 CarbonylContact C-O 3.54Å; G257-A276 WeakPolarHBondContact CA-O 3.21Å; L258-A276 PolarHBondContact N-O 2.96Å; L258-A276 PolarHBondContact O-N 3.44Å; F274-A276 VanDerWaalsContact CE2-C 3.46Å; F274-A276 VanDerWaalsContact CZ-C 3.41Å; A276-V303 HydrophobicContact CB-CG1 4.14Å; A276-K315 HydrophobicContact CB-CD 3.96Å
277	D	92.1	Very high	94	Very high	59 Å²	59	52 Å²	52	32%	0.316	27%	0.265	S	S	.	.			trans	-96.8	-174.6	157.5	70.2	93.9	0	0	0	110.2	F274 A279	F274-D277 HydrophobicContact CE2-CB 4.33Å; F274-D277 HydrophobicContact CZ-CB 4.1Å; F274-D277 VanDerWaalsContact CZ-N 3.32Å; D277-A279 PolarHBondContact OD1-N 2.92Å
278	F	91.4	Very high	93.7	Very high	12 Å²	12	53 Å²	53	5%	0.053	28%	0.279	C	S	.	.	S	Bend	trans	-132.2	13.7	-176.3	-54.3	-79.3	0	0	0	113.2	L253 L258 I283 V303 M332 L335 K336	L253-F278 HydrophobicContact CD1-CE2 3.62Å; L253-F278 HydrophobicContact CD1-CZ 4.1Å; L258-F278 HydrophobicContact CB-CE2 4.09Å; L258-F278 HydrophobicContact CB-CZ 3.92Å; F278-I283 HydrophobicContact CD1-CD1 3.72Å; F278-I283 HydrophobicContact CD1-CG1 3.93Å; F278-I283 HydrophobicContact CE1-CD1 4.23Å; F278-I283 HydrophobicContact CE1-CG1 3.96Å; F278-V303 HydrophobicContact CD1-CG1 4.49Å; F278-V303 HydrophobicContact CE1-CG1 4.36Å; F278-V303 HydrophobicContact CE1-CG2 3.87Å; F278-M332 HydrophobicContact CD1-CB 4.34Å; F278-M332 HydrophobicContact CE1-CB 3.94Å; F278-M332 HydrophobicContact CE1-CG 3.75Å; F278-M332 HydrophobicContact CE1-SD 3.57Å; F278-M332 VanDerWaalsContact CE1-SD 3.57Å; F278-M332 HydrophobicContact CE2-CG 4.24Å; F278-M332 HydrophobicContact CZ-CB 4.12Å; F278-M332 HydrophobicContact CZ-CE 4.39Å; F278-M332 HydrophobicContact CZ-CG 3.54Å; F278-M332 HydrophobicContact CZ-SD 3.61Å; F278-L335 HydrophobicContact CD2-CD2 3.75Å; F278-L335 HydrophobicContact CD2-CG 4.44Å; F278-L335 HydrophobicContact CE2-CD2 3.98Å; F278-K336 HydrophobicContact CB-CB 4.06Å; F278-K336 HydrophobicContact CB-CG 4.34Å; F278-K336 WeakPolarHBondContact O-CG 3.45Å; F278-K336 PolarHBondContact O-NZ 2.85Å
279	A	89	Confident	93.5	Very high	77 Å²	77	49.6 Å²	49.6	64%	0.636	26%	0.263	S	S	*	.	S	Bend	trans	-70.8	-69.9	176.4	0	0	0	0	0	109.2	D277 S281 K336	D277-A279 PolarHBondContact OD1-N 2.92Å; A279-S281 PolarHBondContact O-N 3.33Å; A279-K336 PolarHBondContact O-NZ 3.07Å; A279-K336 VanDerWaalsContact O-NZ 3.17Å
280	D	86.6	Confident	93.3	Very high	82 Å²	82	49.3 Å²	49.3	44%	0.439	25%	0.251	S	S	.	.	S	Bend	trans	-88.9	26	177.7	-76.5	14.8	0	0	0	112.2	A305 T306 K307	D280-A305 CarbonylContact O-C 3.59Å; D280-A305 VanDerWaalsContact O-CA 3.3Å; D280-A305 WeakPolarHBondContact O-CA 3.38Å; D280-T306 PolarHBondContact O-N 3.46Å; D280-T306 PolarHBondContact O-OG1 2.65Å; D280-K307 IonicContact OD2-NZ 2.64Å; D280-K307 PolarHBondContact OD2-NZ 3.11Å
281	S	91.7	Very high	93	Very high	9 Å²	9	49 Å²	49	6%	0.063	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	142.2	-176.8	-67.1	0	0	0	0	113.6	A279 K304 A305 K336	A279-S281 PolarHBondContact O-N 3.33Å; S281-K304 WeakPolarHBondContact CA-O 3.12Å; S281-A305 WeakPolarHBondContact OG-CA 3.39Å; S281-K336 PolarHBondContact O-NZ 3.47Å
282	D	92.9	Very high	92.5	Very high	18 Å²	18	50.6 Å²	50.6	10%	0.096	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	155	-178.5	-74	-14.7	0	0	0	111.4	R157 Y284 V303 K304 K336	R157-D282 IonicContact CZ-OD2 3.68Å; R157-D282 VanDerWaalsContact CZ-OD2 3.3Å; R157-D282 IonicContact NE-OD2 2.69Å; R157-D282 PolarHBondContact NE-OD2 3.34Å; R157-D282 IonicContact NH2-OD2 3.59Å; R157-D282 PolarHBondContact NH2-OD2 3.47Å; D282-Y284 HydrophobicContact CB-CD2 4.35Å; D282-Y284 HydrophobicContact CB-CE2 3.51Å; D282-V303 WeakPolarHBondContact O-CA 3.44Å; D282-K304 PolarHBondContact N-O 2.81Å; D282-K304 PolarHBondContact O-N 3.48Å; D282-K336 WeakPolarHBondContact OD1-CE 3.32Å; D282-K336 IonicContact OD1-NZ 3.06Å; D282-K336 PolarHBondContact OD1-NZ 2.98Å
283	I	95.8	Very high	92.1	Very high	16 Å²	16	51.5 Å²	51.5	8%	0.082	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124.2	-175.9	-50.6	88.8	0	0	0	109.5	R157 F278 F301 C302 I329 M332 K336	R157-I283 WeakPolarHBondContact CB-O 3.34Å; F278-I283 HydrophobicContact CD1-CD1 3.72Å; F278-I283 HydrophobicContact CD1-CG1 3.93Å; F278-I283 HydrophobicContact CE1-CD1 4.23Å; F278-I283 HydrophobicContact CE1-CG1 3.96Å; I283-F301 HydrophobicContact CG2-CD2 4.25Å; I283-C302 WeakPolarHBondContact CA-O 3.26Å; I283-I329 HydrophobicContact CG2-CG1 4.2Å; I283-I329 HydrophobicContact CG2-CG2 4.35Å; I283-M332 HydrophobicContact CD1-CB 3.95Å; I283-M332 HydrophobicContact CG1-CB 3.84Å; I283-M332 HydrophobicContact CG1-SD 4.21Å; I283-M332 HydrophobicContact CG2-SD 4.43Å; I283-K336 HydrophobicContact CD1-CD 4.3Å
284	Y	95.6	Very high	91.8	Very high	7 Å²	7	48.9 Å²	48.9	3%	0.027	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145.3	-179.3	-59.6	-109.9	0	0	0	110.7	H150 I155 E156 R157 D282 F301 C302 K304	H150-Y284 AromaticContact CE1-CE1 3.58Å; H150-Y284 AromaticContact CE1-CZ 3.73Å; H150-Y284 PolarHBondContact CE1-OH 3.21Å; H150-Y284 AromaticContact NE2-CE1 3.8Å; I155-Y284 HydrophobicContact CB-CD1 4.41Å; I155-Y284 HydrophobicContact CB-CG 4.38Å; I155-Y284 HydrophobicContact CD1-CD1 4.01Å; I155-Y284 HydrophobicContact CD1-CD2 4.26Å; I155-Y284 HydrophobicContact CD1-CG 3.89Å; I155-Y284 HydrophobicContact CG1-CD1 3.91Å; I155-Y284 HydrophobicContact CG1-CG 4.13Å; E156-Y284 CarbonylContact O-C 3.53Å; E156-Y284 WeakPolarHBondContact O-CA 3.15Å; R157-Y284 HydrophobicContact CB-CD1 3.71Å; R157-Y284 HydrophobicContact CB-CE1 4.04Å; R157-Y284 HydrophobicContact CB-CG 4.05Å; R157-Y284 HydrophobicContact CG-CD1 3.82Å; R157-Y284 HydrophobicContact CG-CE1 3.59Å; R157-Y284 HydrophobicContact CG-CG 4.45Å; R157-Y284 PolarHBondContact NE-OH 3.1Å; D282-Y284 HydrophobicContact CB-CD2 4.35Å; D282-Y284 HydrophobicContact CB-CE2 3.51Å; Y284-F301 CarbonylContact O-C 3.59Å; Y284-F301 WeakPolarHBondContact O-CA 3.37Å; Y284-F301 VanDerWaalsContact O-CB 3.25Å; Y284-F301 WeakPolarHBondContact O-CB 3.47Å; Y284-C302 PolarHBondContact N-O 2.84Å; Y284-C302 PolarHBondContact O-N 2.94Å; Y284-K304 HydrophobicContact CD2-CB 4.01Å; Y284-K304 HydrophobicContact CE2-CB 3.74Å; Y284-K304 HydrophobicContact CE2-CD 4.05Å; Y284-K304 HydrophobicContact CE2-CG 4.44Å
285	T	95.8	Very high	91.7	Very high	34 Å²	34	44.3 Å²	44.3	21%	0.209	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	143.4	163.2	-64.9	0	0	0	0	109.1	I155 E156	I155-T285 VanDerWaalsContact CA-O 3.3Å; I155-T285 WeakPolarHBondContact CA-O 3.25Å; E156-T285 PolarHBondContact N-O 2.72Å; E156-T285 PolarHBondContact O-N 2.86Å
286	V	94.6	Very high	91.7	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124.3	178.6	176.4	0	0	0	0	109.3	I155 A289 A300 C302 L316	I155-V286 HydrophobicContact CG2-CB 4.5Å; I155-V286 HydrophobicContact CG2-CG2 3.96Å; V286-A289 HydrophobicContact CB-CB 4.43Å; V286-A289 HydrophobicContact CG1-CB 3.89Å; V286-A300 HydrophobicContact CB-CB 4.03Å; V286-A300 HydrophobicContact CG1-CB 4.48Å; V286-A300 PolarHBondContact N-O 2.95Å; V286-C302 HydrophobicContact CG2-CB 4.12Å; V286-L316 HydrophobicContact CG1-CD2 4.32Å; V286-L316 HydrophobicContact CG2-CD2 3.53Å
287	L	89.9	Confident	91.7	Very high	55 Å²	55	46.3 Å²	46.3	29%	0.288	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	139	-178.1	-58.2	177.8	0	0	0	111	G154 E156 A289	G154-L287 WeakPolarHBondContact O-CB 3.4Å; G154-L287 PolarHBondContact O-N 3.49Å; E156-L287 HydrophobicContact CG-CD1 4.1Å; E156-L287 HydrophobicContact CG-CD2 3.9Å; E156-L287 HydrophobicContact CG-CG 4.05Å; L287-A289 PolarHBondContact O-N 2.78Å
288	S	88.3	Confident	91.7	Very high	76 Å²	76	46.5 Å²	46.5	53%	0.531	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	39.7	178.9	-56.1	0	0	0	0	114	K290 K291 A292 E298	S288-K290 VanDerWaalsContact C-N 3.3Å; S288-K290 PolarHBondContact O-N 3.2Å; S288-K291 PolarHBondContact O-N 2.87Å; S288-A292 WeakPolarHBondContact O-CB 3.16Å; S288-A292 PolarHBondContact O-N 2.97Å; S288-E298 VanDerWaalsContact C-OE2 3.29Å
289	A	90.6	Very high	91.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-56.6	-34.3	-167.2	0	0	0	0	0	115	V286 L287 H293 G294 A295 E298 A300	V286-A289 HydrophobicContact CB-CB 4.43Å; V286-A289 HydrophobicContact CG1-CB 3.89Å; L287-A289 PolarHBondContact O-N 2.78Å; A289-H293 WeakPolarHBondContact O-CA 3.13Å; A289-H293 WeakPolarHBondContact O-CB 3.13Å; A289-H293 PolarHBondContact O-N 3.46Å; A289-G294 PolarHBondContact O-N 3.25Å; A289-A295 HydrophobicContact CB-CB 3.9Å; A289-A295 WeakPolarHBondContact O-CB 3.2Å; A289-A295 PolarHBondContact O-N 2.78Å; A289-E298 PolarHBondContact N-OE2 2.84Å; A289-A300 HydrophobicContact CB-CB 3.41Å; A289-A300 VanDerWaalsContact CB-CB 3.41Å
290	K	90.3	Very high	92.2	Very high	102 Å²	102	43.8 Å²	43.8	44%	0.443	25%	0.247	S	C	.	.	H	α-helix	trans	-64.5	-48.9	173.3	-62.9	-170.3	175.2	-161.2	0	111.2	S288 G294 A295 P296 T297 E298	S288-K290 VanDerWaalsContact C-N 3.3Å; S288-K290 PolarHBondContact O-N 3.2Å; K290-G294 VanDerWaalsContact O-CA 3.24Å; K290-G294 WeakPolarHBondContact O-CA 3.41Å; K290-G294 PolarHBondContact O-N 3.24Å; K290-A295 WeakPolarHBondContact CG-O 3.24Å; K290-P296 WeakPolarHBondContact CE-O 3.3Å; K290-P296 PolarHBondContact NZ-O 2.63Å; K290-T297 VanDerWaalsContact CE-C 3.41Å; K290-E298 VanDerWaalsContact CB-OE1 3.25Å; K290-E298 WeakPolarHBondContact CB-OE1 3.23Å; K290-E298 HydrophobicContact CD-CG 4.12Å; K290-E298 WeakPolarHBondContact CD-OE1 3.25Å; K290-E298 VanDerWaalsContact CG-CD 3.4Å; K290-E298 HydrophobicContact CG-CG 4.04Å; K290-E298 VanDerWaalsContact CG-OE1 3.25Å; K290-E298 WeakPolarHBondContact CG-OE1 3.31Å; K290-E298 PolarHBondContact N-OE2 2.76Å
291	K	89.4	Confident	92.7	Very high	192 Å²	192	39.9 Å²	39.9	84%	0.835	23%	0.226	S	C	*	.	H	α-helix	trans	-67.4	-43	-178.1	-174.5	-177.7	177.7	-175.3	0	112	S288	S288-K291 PolarHBondContact O-N 2.87Å
292	A	87.3	Confident	92.9	Very high	59 Å²	59	39.4 Å²	39.4	49%	0.488	22%	0.223	S	C	.	.	H	α-helix	trans	-78.6	-34.8	-176.4	0	0	0	0	0	113.2	S288	S288-A292 WeakPolarHBondContact O-CB 3.16Å; S288-A292 PolarHBondContact O-N 2.97Å
293	H	89.2	Confident	93.1	Very high	42 Å²	42	38.7 Å²	38.7	19%	0.194	22%	0.22	C	C	.	.	H	α-helix	trans	-135.5	2.3	-166.3	-63.8	-18.8	0	0	0	115.5	K239 W246 A289 A295	K239-H293 HydrophobicContact CD-CB 4.39Å; K239-H293 VanDerWaalsContact NZ-CG 3.35Å; K239-H293 PolarHBondContact NZ-ND1 3.33Å; W246-H293 HydrophobicContact CZ2-CB 4.02Å; W246-H293 PolarHBondContact NE1-O 3.27Å; A289-H293 WeakPolarHBondContact O-CA 3.13Å; A289-H293 WeakPolarHBondContact O-CB 3.13Å; A289-H293 PolarHBondContact O-N 3.46Å; H293-A295 VanDerWaalsContact C-N 3.27Å; H293-A295 PolarHBondContact O-N 2.85Å
294	G	92.1	Very high	92.9	Very high	50 Å²	50	38.3 Å²	38.3	52%	0.515	22%	0.217	S	C	.	.			trans	66.3	28	-177.2	0	0	0	0	0	113.4	W246 A289 K290	W246-G294 VanDerWaalsContact CD1-O 3.26Å; W246-G294 PolarHBondContact NE1-O 2.87Å; A289-G294 PolarHBondContact O-N 3.25Å; K290-G294 VanDerWaalsContact O-CA 3.24Å; K290-G294 WeakPolarHBondContact O-CA 3.41Å; K290-G294 PolarHBondContact O-N 3.24Å
295	A	94.4	Very high	92.5	Very high	8 Å²	8	39.9 Å²	39.9	7%	0.066	23%	0.232	C	C	.	.			trans	-61.1	149.8	-178.7	0	0	0	0	0	112.4	W246 A289 K290 H293 T297	W246-A295 HydrophobicContact CH2-CB 4.06Å; W246-A295 HydrophobicContact CZ2-CB 3.63Å; A289-A295 HydrophobicContact CB-CB 3.9Å; A289-A295 WeakPolarHBondContact O-CB 3.2Å; A289-A295 PolarHBondContact O-N 2.78Å; K290-A295 WeakPolarHBondContact CG-O 3.24Å; H293-A295 VanDerWaalsContact C-N 3.27Å; H293-A295 PolarHBondContact O-N 2.85Å; A295-T297 VanDerWaalsContact C-N 3.3Å; A295-T297 VanDerWaalsContact CB-O 3.24Å; A295-T297 WeakPolarHBondContact CB-O 3.33Å; A295-T297 PolarHBondContact O-N 3.02Å
296	P	95.6	Very high	91.7	Very high	52 Å²	52	41 Å²	41	34%	0.338	24%	0.239	S	C	.	.	S	Bend	trans	-60.7	-38	174	-26.8	36.2	0	0	0	113.3	H237 W246 K290	H237-P296 HydrophobicContact CB-CG 4.12Å; W246-P296 HydrophobicContact CB-CG 4.1Å; W246-P296 HydrophobicContact CG-CG 4.34Å; K290-P296 WeakPolarHBondContact CE-O 3.3Å; K290-P296 PolarHBondContact NZ-O 2.63Å
297	T	94	Very high	90.4	Very high	19 Å²	19	49.4 Å²	49.4	12%	0.117	28%	0.275	C	S	.	.	S	Bend	trans	-128.8	172.1	178.7	80.4	0	0	0	0	110.1	K290 A295 F299 C318 A319	K290-T297 VanDerWaalsContact CE-C 3.41Å; A295-T297 VanDerWaalsContact C-N 3.3Å; A295-T297 VanDerWaalsContact CB-O 3.24Å; A295-T297 WeakPolarHBondContact CB-O 3.33Å; A295-T297 PolarHBondContact O-N 3.02Å; T297-F299 HydrophobicContact CG2-CD2 4.18Å; T297-F299 WeakPolarHBondContact OG1-CB 3.5Å; T297-F299 WeakPolarHBondContact OG1-CD2 3.36Å; T297-F299 PolarHBondContact OG1-N 2.98Å; T297-C318 PolarHBondContact OG1-SG 3.07Å; T297-A319 VanDerWaalsContact CG2-O 3.22Å; T297-A319 WeakPolarHBondContact CG2-O 3.1Å; T297-A319 PolarHBondContact OG1-O 3.23Å
298	E	90.9	Very high	89.2	Confident	62 Å²	62	47.8 Å²	47.8	29%	0.29	27%	0.268	S	S	.	.	S	Bend	trans	-83.7	-0.6	167.9	-58.5	-67	178	0	0	111.6	S288 A289 K290 A300	S288-E298 VanDerWaalsContact C-OE2 3.29Å; A289-E298 PolarHBondContact N-OE2 2.84Å; K290-E298 VanDerWaalsContact CB-OE1 3.25Å; K290-E298 WeakPolarHBondContact CB-OE1 3.23Å; K290-E298 HydrophobicContact CD-CG 4.12Å; K290-E298 WeakPolarHBondContact CD-OE1 3.25Å; K290-E298 VanDerWaalsContact CG-CD 3.4Å; K290-E298 HydrophobicContact CG-CG 4.04Å; K290-E298 VanDerWaalsContact CG-OE1 3.25Å; K290-E298 WeakPolarHBondContact CG-OE1 3.31Å; K290-E298 PolarHBondContact N-OE2 2.76Å; E298-A300 PolarHBondContact O-N 2.92Å
299	F	95.1	Very high	87.8	Confident	31 Å²	31	47.6 Å²	47.6	14%	0.136	27%	0.267	C	S	.	.			trans	-85.6	49.6	-175.4	-48.3	-64.1	0	0	0	111.5	T297 A319 D320 D321 E322 K325 Q472	T297-F299 HydrophobicContact CG2-CD2 4.18Å; T297-F299 WeakPolarHBondContact OG1-CB 3.5Å; T297-F299 WeakPolarHBondContact OG1-CD2 3.36Å; T297-F299 PolarHBondContact OG1-N 2.98Å; F299-A319 HydrophobicContact CB-CB 4.17Å; F299-A319 PolarHBondContact O-N 3.01Å; F299-D320 WeakPolarHBondContact CD2-O 3.44Å; F299-D321 VanDerWaalsContact CG-C 3.46Å; F299-E322 HydrophobicContact CD1-CB 3.75Å; F299-E322 HydrophobicContact CD1-CG 4.15Å; F299-E322 HydrophobicContact CE1-CB 3.57Å; F299-E322 HydrophobicContact CE1-CG 4.16Å; F299-E322 HydrophobicContact CZ-CB 4.36Å; F299-K325 HydrophobicContact CB-CB 4.11Å; F299-K325 HydrophobicContact CB-CD 4.33Å; F299-Q472 HydrophobicContact CE1-CG 3.83Å; F299-Q472 VanDerWaalsContact CE1-NE2 3.33Å; F299-Q472 HydrophobicContact CZ-CG 4.41Å
300	A	96.3	Very high	86.7	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	154.3	-176.5	0	0	0	0	0	113.4	V286 A289 E298 L317 C318	V286-A300 HydrophobicContact CB-CB 4.03Å; V286-A300 HydrophobicContact CG1-CB 4.48Å; V286-A300 PolarHBondContact N-O 2.95Å; A289-A300 HydrophobicContact CB-CB 3.41Å; A289-A300 VanDerWaalsContact CB-CB 3.41Å; E298-A300 PolarHBondContact O-N 2.92Å; A300-L317 CarbonylContact C-O 3.6Å; A300-L317 VanDerWaalsContact CA-O 3.23Å; A300-L317 WeakPolarHBondContact CA-O 3.23Å; A300-L317 WeakPolarHBondContact CB-O 3.29Å; A300-C318 HydrophobicContact CB-CB 4.09Å
301	F	97.8	Very high	85.6	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	165.3	179.8	61.9	-79.4	0	0	0	109.1	L236 I283 Y284 L317 K325 W328 I329 M332	L236-F301 HydrophobicContact CD1-CE1 4.46Å; L236-F301 HydrophobicContact CD1-CZ 3.79Å; L236-F301 HydrophobicContact CD2-CE1 3.99Å; L236-F301 HydrophobicContact CD2-CZ 4.11Å; I283-F301 HydrophobicContact CG2-CD2 4.25Å; Y284-F301 CarbonylContact O-C 3.59Å; Y284-F301 WeakPolarHBondContact O-CA 3.37Å; Y284-F301 VanDerWaalsContact O-CB 3.25Å; Y284-F301 WeakPolarHBondContact O-CB 3.47Å; F301-L317 HydrophobicContact CD1-CB 4.19Å; F301-L317 HydrophobicContact CD2-CB 4.13Å; F301-L317 HydrophobicContact CD2-CD1 4.19Å; F301-L317 HydrophobicContact CE1-CB 3.9Å; F301-L317 HydrophobicContact CE2-CB 3.84Å; F301-L317 HydrophobicContact CE2-CD1 3.49Å; F301-L317 VanDerWaalsContact CE2-CD1 3.49Å; F301-L317 HydrophobicContact CE2-CG 4.31Å; F301-L317 HydrophobicContact CG-CB 4.3Å; F301-L317 HydrophobicContact CZ-CB 3.73Å; F301-L317 HydrophobicContact CZ-CD1 3.88Å; F301-L317 HydrophobicContact CZ-CG 4.43Å; F301-L317 PolarHBondContact N-O 3.06Å; F301-L317 PolarHBondContact O-N 2.99Å; F301-K325 HydrophobicContact CD1-CG 4Å; F301-W328 HydrophobicContact CE1-CB 4.32Å; F301-W328 HydrophobicContact CE2-CB 4.32Å; F301-W328 HydrophobicContact CZ-CB 3.72Å; F301-W328 HydrophobicContact CZ-CG 4.25Å; F301-I329 HydrophobicContact CB-CD1 3.94Å; F301-I329 HydrophobicContact CB-CG1 4.13Å; F301-I329 HydrophobicContact CD2-CG1 4.13Å; F301-I329 HydrophobicContact CG-CD1 4.33Å; F301-I329 HydrophobicContact CG-CG1 4.07Å; F301-M332 HydrophobicContact CE2-CE 3.76Å; F301-M332 HydrophobicContact CE2-SD 4.07Å; F301-M332 HydrophobicContact CZ-CE 4.29Å
302	C	96.1	Very high	84.5	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	160.2	176.7	71.4	0	0	0	0	112.4	I283 Y284 V286 K315 L316	I283-C302 WeakPolarHBondContact CA-O 3.26Å; Y284-C302 PolarHBondContact N-O 2.84Å; Y284-C302 PolarHBondContact O-N 2.94Å; V286-C302 HydrophobicContact CG2-CB 4.12Å; C302-K315 VanDerWaalsContact CA-O 3.29Å; C302-K315 WeakPolarHBondContact CA-O 3.25Å; C302-L316 HydrophobicContact CB-CD2 3.87Å; C302-L316 HydrophobicContact CB-CG 4.21Å
303	V	95.3	Very high	84	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	121	165	-174.8	0	0	0	0	107.9	A276 F278 D282 K315	A276-V303 HydrophobicContact CB-CG1 4.14Å; F278-V303 HydrophobicContact CD1-CG1 4.49Å; F278-V303 HydrophobicContact CE1-CG1 4.36Å; F278-V303 HydrophobicContact CE1-CG2 3.87Å; D282-V303 WeakPolarHBondContact O-CA 3.44Å; V303-K315 HydrophobicContact CB-CB 4.25Å; V303-K315 PolarHBondContact N-O 3.18Å; V303-K315 VanDerWaalsContact N-O 3.1Å; V303-K315 PolarHBondContact O-N 2.88Å; V303-K315 VanDerWaalsContact O-N 3.1Å
304	K	91.4	Very high	84	Confident	7 Å²	7	48 Å²	48	3%	0.03	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.9	176.1	179.3	-175.8	-168.9	-77.7	0	108.3	I155 S281 D282 Y284 C308 L314	I155-K304 HydrophobicContact CD1-CD 4.14Å; S281-K304 WeakPolarHBondContact CA-O 3.12Å; D282-K304 PolarHBondContact N-O 2.81Å; D282-K304 PolarHBondContact O-N 3.48Å; Y284-K304 HydrophobicContact CD2-CB 4.01Å; Y284-K304 HydrophobicContact CE2-CB 3.74Å; Y284-K304 HydrophobicContact CE2-CD 4.05Å; Y284-K304 HydrophobicContact CE2-CG 4.44Å; K304-C308 WeakPolarHBondContact CE-O 3.38Å; K304-C308 PolarHBondContact NZ-O 2.84Å; K304-L314 HydrophobicContact CB-CD2 3.71Å; K304-L314 HydrophobicContact CD-CD2 4.16Å; K304-L314 HydrophobicContact CG-CD2 3.78Å
305	A	87.8	Confident	84.1	Confident	40 Å²	40	49.1 Å²	49.1	33%	0.331	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	141.9	171.1	0	0	0	0	0	110.4	D280 S281 K307 C308	D280-A305 CarbonylContact O-C 3.59Å; D280-A305 VanDerWaalsContact O-CA 3.3Å; D280-A305 WeakPolarHBondContact O-CA 3.38Å; S281-A305 WeakPolarHBondContact OG-CA 3.39Å; A305-K307 PolarHBondContact O-N 3.44Å; A305-C308 HydrophobicContact CB-CB 4.22Å; A305-C308 VanDerWaalsContact O-CB 3.22Å; A305-C308 WeakPolarHBondContact O-CB 3.33Å; A305-C308 PolarHBondContact O-N 3.34Å; A305-C308 VanDerWaalsContact O-N 3.13Å
306	T	78.3	Confident	84.1	Confident	59 Å²	59	49.1 Å²	49.1	36%	0.362	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-37.4	-178.1	-46.8	0	0	0	0	111.4	D280 C308	D280-T306 PolarHBondContact O-N 3.46Å; D280-T306 PolarHBondContact O-OG1 2.65Å; T306-C308 PolarHBondContact O-N 3.07Å; T306-C308 VanDerWaalsContact O-N 3.08Å
307	K	67.9	Low	84.2	Confident	179 Å²	179	46.6 Å²	46.6	78%	0.778	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	15.2	-179.9	-65.1	160.5	-178	157.2	0	114.2	D280 A305	D280-K307 IonicContact OD2-NZ 2.64Å; D280-K307 PolarHBondContact OD2-NZ 3.11Å; A305-K307 PolarHBondContact O-N 3.44Å
308	C	65.3	Low	84.4	Confident	21 Å²	21	45.7 Å²	45.7	14%	0.142	24%	0.237	C	C	.	.			trans	-118.4	121.7	-171.3	179	0	0	0	0	113.6	K304 A305 T306 S310 D313	K304-C308 WeakPolarHBondContact CE-O 3.38Å; K304-C308 PolarHBondContact NZ-O 2.84Å; A305-C308 HydrophobicContact CB-CB 4.22Å; A305-C308 VanDerWaalsContact O-CB 3.22Å; A305-C308 WeakPolarHBondContact O-CB 3.33Å; A305-C308 PolarHBondContact O-N 3.34Å; A305-C308 VanDerWaalsContact O-N 3.13Å; T306-C308 PolarHBondContact O-N 3.07Å; T306-C308 VanDerWaalsContact O-N 3.08Å; C308-S310 PolarHBondContact SG-O 3.01Å; C308-D313 VanDerWaalsContact SG-CB 3.56Å
309	S	59.5	Low	84.7	Confident	73 Å²	73	42.8 Å²	42.8	51%	0.51	22%	0.224	S	C	.	.			trans	-95.3	-28.7	169.8	45.6	0	0	0	0	114.2	E175	E175-S309 VanDerWaalsContact OE1-CB 3.24Å; E175-S309 WeakPolarHBondContact OE1-CB 3.04Å
310	S	66.3	Low	84.7	Confident	35 Å²	35	44.9 Å²	44.9	25%	0.245	24%	0.236	C	C	.	.			trans	-83.4	132	-170.3	150.8	0	0	0	0	113.8	C308 R312 D313	C308-S310 PolarHBondContact SG-O 3.01Å; S310-R312 PolarHBondContact O-N 2.61Å; S310-R312 VanDerWaalsContact O-N 3.14Å; S310-R312 PolarHBondContact OG-N 3.07Å; S310-D313 WeakPolarHBondContact CB-OD2 3.44Å; S310-D313 PolarHBondContact O-N 2.69Å; S310-D313 PolarHBondContact OG-OD2 2.97Å
311	S	66.9	Low	84.4	Confident	75 Å²	75	47.5 Å²	47.5	52%	0.524	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-12.8	176.7	62.4	0	0	0	0	114.7
312	R	66.8	Low	83.9	Confident	200 Å²	200	48.8 Å²	48.8	76%	0.755	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-19.5	179.1	-62.8	-176.1	-69	-170.3	-1.9	113.2	Q241 S310	Q241-R312 PolarHBondContact NE2-O 2.96Å; S310-R312 PolarHBondContact O-N 2.61Å; S310-R312 VanDerWaalsContact O-N 3.14Å; S310-R312 PolarHBondContact OG-N 3.07Å
313	D	76.9	Confident	83.5	Confident	83 Å²	83	53.6 Å²	53.6	44%	0.444	28%	0.279	S	S	.	.	S	Bend	trans	-97.7	-5.8	-173.1	-54.6	-82.7	0	0	0	112	C308 S310 K315	C308-D313 VanDerWaalsContact SG-CB 3.56Å; S310-D313 WeakPolarHBondContact CB-OD2 3.44Å; S310-D313 PolarHBondContact O-N 2.69Å; S310-D313 PolarHBondContact OG-OD2 2.97Å; D313-K315 PolarHBondContact O-N 2.84Å
314	L	88.9	Confident	83.4	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.052	28%	0.284	C	S	.	.			trans	-61	116.5	171.7	-64.7	179.8	0	0	0	111	L153 I155 K304 L316	L153-L314 HydrophobicContact CB-CD1 4.47Å; L153-L314 HydrophobicContact CD1-CD1 4.42Å; L153-L314 HydrophobicContact CD2-CD1 4.27Å; I155-L314 HydrophobicContact CD1-CD1 4.43Å; I155-L314 HydrophobicContact CD1-CD2 4.14Å; K304-L314 HydrophobicContact CB-CD2 3.71Å; K304-L314 HydrophobicContact CD-CD2 4.16Å; K304-L314 HydrophobicContact CG-CD2 3.78Å; L314-L316 HydrophobicContact CB-CG 4.37Å; L314-L316 PolarHBondContact O-N 3.43Å
315	K	93.7	Very high	83.6	Confident	73 Å²	73	55.1 Å²	55.1	32%	0.317	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	87.3	178.6	-65.9	179.3	-176.8	176	0	109.9	F275 A276 C302 V303 D313	F275-K315 HydrophobicContact CD1-CD 4.43Å; F275-K315 HydrophobicContact CE1-CB 3.69Å; F275-K315 HydrophobicContact CE1-CD 4.25Å; F275-K315 HydrophobicContact CE1-CG 4.44Å; F275-K315 HydrophobicContact CZ-CB 3.82Å; F275-K315 WeakPolarHBondContact O-CE 3.48Å; F275-K315 PolarHBondContact O-NZ 3.24Å; A276-K315 HydrophobicContact CB-CD 3.96Å; C302-K315 VanDerWaalsContact CA-O 3.29Å; C302-K315 WeakPolarHBondContact CA-O 3.25Å; V303-K315 HydrophobicContact CB-CB 4.25Å; V303-K315 PolarHBondContact N-O 3.18Å; V303-K315 VanDerWaalsContact N-O 3.1Å; V303-K315 PolarHBondContact O-N 2.88Å; V303-K315 VanDerWaalsContact O-N 3.1Å; D313-K315 PolarHBondContact O-N 2.84Å
316	L	95.4	Very high	83.8	Confident	8 Å²	8	55 Å²	55	4%	0.042	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	124.8	-172.3	-81.4	160.1	0	0	0	113.3	K239 W246 V286 C302 L314	K239-L316 HydrophobicContact CB-CB 3.85Å; K239-L316 HydrophobicContact CD-CB 4.14Å; K239-L316 HydrophobicContact CD-CD1 3.51Å; K239-L316 HydrophobicContact CD-CG 4.45Å; K239-L316 PolarHBondContact N-O 3.4Å; W246-L316 HydrophobicContact CH2-CB 4.07Å; V286-L316 HydrophobicContact CG1-CD2 4.32Å; V286-L316 HydrophobicContact CG2-CD2 3.53Å; C302-L316 HydrophobicContact CB-CD2 3.87Å; C302-L316 HydrophobicContact CB-CG 4.21Å; L314-L316 HydrophobicContact CB-CG 4.37Å; L314-L316 PolarHBondContact O-N 3.43Å
317	L	97.9	Very high	84.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	151.2	-178.6	-68.6	169	0	0	0	110.6	L236 H237 V238 F251 L258 F275 A300 F301 M332	L236-L317 HydrophobicContact CB-CD2 4.38Å; L236-L317 HydrophobicContact CD1-CD1 4.33Å; L236-L317 HydrophobicContact CD1-CD2 4.21Å; H237-L317 CarbonylContact O-C 3.38Å; H237-L317 VanDerWaalsContact O-CA 3.31Å; H237-L317 WeakPolarHBondContact O-CA 3.41Å; V238-L317 HydrophobicContact CG2-CD2 3.95Å; F251-L317 HydrophobicContact CE1-CD2 4.22Å; F251-L317 HydrophobicContact CE2-CD2 4.07Å; F251-L317 HydrophobicContact CZ-CD2 3.68Å; L258-L317 HydrophobicContact CD2-CD1 3.9Å; F275-L317 HydrophobicContact CE1-CD1 3.89Å; F275-L317 HydrophobicContact CE1-CD2 4.02Å; F275-L317 HydrophobicContact CE1-CG 4.01Å; F275-L317 HydrophobicContact CE2-CD2 4.47Å; F275-L317 HydrophobicContact CZ-CD1 4.43Å; F275-L317 HydrophobicContact CZ-CD2 3.77Å; F275-L317 HydrophobicContact CZ-CG 4.05Å; A300-L317 CarbonylContact C-O 3.6Å; A300-L317 VanDerWaalsContact CA-O 3.23Å; A300-L317 WeakPolarHBondContact CA-O 3.23Å; A300-L317 WeakPolarHBondContact CB-O 3.29Å; F301-L317 HydrophobicContact CD1-CB 4.19Å; F301-L317 HydrophobicContact CD2-CB 4.13Å; F301-L317 HydrophobicContact CD2-CD1 4.19Å; F301-L317 HydrophobicContact CE1-CB 3.9Å; F301-L317 HydrophobicContact CE2-CB 3.84Å; F301-L317 HydrophobicContact CE2-CD1 3.49Å; F301-L317 VanDerWaalsContact CE2-CD1 3.49Å; F301-L317 HydrophobicContact CE2-CG 4.31Å; F301-L317 HydrophobicContact CG-CB 4.3Å; F301-L317 HydrophobicContact CZ-CB 3.73Å; F301-L317 HydrophobicContact CZ-CD1 3.88Å; F301-L317 HydrophobicContact CZ-CG 4.43Å; F301-L317 PolarHBondContact N-O 3.06Å; F301-L317 PolarHBondContact O-N 2.99Å; L317-M332 HydrophobicContact CD1-CE 4.49Å
318	C	98.1	Very high	86	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	122.5	-179.1	176.8	0	0	0	0	111.5	H237 W246 T297 A300	H237-C318 HydrophobicContact CB-CB 4.1Å; H237-C318 WeakPolarHBondContact CB-O 3.38Å; H237-C318 PolarHBondContact N-O 3.36Å; H237-C318 PolarHBondContact ND1-O 3.39Å; H237-C318 PolarHBondContact O-N 3.46Å; W246-C318 HydrophobicContact CE3-CB 4.01Å; W246-C318 HydrophobicContact CH2-CB 4.02Å; W246-C318 HydrophobicContact CZ3-CB 3.47Å; W246-C318 VanDerWaalsContact CZ3-CB 3.47Å; T297-C318 PolarHBondContact OG1-SG 3.07Å; A300-C318 HydrophobicContact CB-CB 4.09Å
319	A	97.9	Very high	87.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.227	C	C	.	.			trans	-80.7	168.1	175.9	0	0	0	0	0	112.1	L236 T297 F299 D321 T324 K325	L236-A319 HydrophobicContact CD2-CB 4.06Å; T297-A319 VanDerWaalsContact CG2-O 3.22Å; T297-A319 WeakPolarHBondContact CG2-O 3.1Å; T297-A319 PolarHBondContact OG1-O 3.23Å; F299-A319 HydrophobicContact CB-CB 4.17Å; F299-A319 PolarHBondContact O-N 3.01Å; A319-D321 WeakPolarHBondContact CB-O 3.29Å; A319-T324 HydrophobicContact CB-CG2 3.76Å; A319-K325 HydrophobicContact CB-CB 4.02Å
320	D	94.6	Very high	89.2	Confident	75 Å²	75	40.9 Å²	40.9	40%	0.401	21%	0.206	S	C	.	.	S	Bend	trans	-77.3	-28.6	171	-63.9	-40	0	0	0	112	H237 K248 F299	H237-D320 IonicContact CE1-OD1 2.74Å; H237-D320 PolarHBondContact CE1-OD1 3.37Å; H237-D320 IonicContact ND1-OD1 2.71Å; K248-D320 IonicContact NZ-OD1 3.21Å; K248-D320 PolarHBondContact NZ-OD1 2.9Å; K248-D320 IonicContact NZ-OD2 3.17Å; K248-D320 PolarHBondContact NZ-OD2 3.3Å; F299-D320 WeakPolarHBondContact CD2-O 3.44Å
321	D	89.6	Confident	90.5	Very high	56 Å²	56	39.4 Å²	39.4	30%	0.299	20%	0.196	S	C	.	.	S	Bend	trans	-148	173.1	-174	70.9	88.6	0	0	0	112.9	F299 A319 Q323 T324 K325	F299-D321 VanDerWaalsContact CG-C 3.46Å; A319-D321 WeakPolarHBondContact CB-O 3.29Å; D321-Q323 WeakPolarHBondContact OD1-CA 3.37Å; D321-Q323 WeakPolarHBondContact OD1-CB 3.36Å; D321-Q323 PolarHBondContact OD1-N 2.86Å; D321-T324 PolarHBondContact OD1-N 3.06Å; D321-T324 PolarHBondContact OD1-OG1 2.86Å; D321-T324 WeakPolarHBondContact OD2-CB 3.24Å; D321-T324 PolarHBondContact OD2-OG1 3.15Å; D321-K325 PolarHBondContact O-N 2.57Å; D321-K325 VanDerWaalsContact O-N 3.16Å
322	E	86.3	Confident	91.9	Very high	27 Å²	27	35.8 Å²	35.8	13%	0.126	17%	0.171	C	C	.	.	H	α-helix	trans	-74	-34.6	-176.8	-161	172.7	137.1	0	0	114.5	F299 K325 T326	F299-E322 HydrophobicContact CD1-CB 3.75Å; F299-E322 HydrophobicContact CD1-CG 4.15Å; F299-E322 HydrophobicContact CE1-CB 3.57Å; F299-E322 HydrophobicContact CE1-CG 4.16Å; F299-E322 HydrophobicContact CZ-CB 4.36Å; E322-K325 PolarHBondContact O-N 2.98Å; E322-T326 VanDerWaalsContact O-CB 3.31Å; E322-T326 WeakPolarHBondContact O-CB 3.27Å; E322-T326 PolarHBondContact O-N 3.1Å; E322-T326 PolarHBondContact O-OG1 3.07Å
323	Q	87.9	Confident	93.2	Very high	101 Å²	101	27.5 Å²	27.5	47%	0.472	14%	0.139	S	C	.	.	H	α-helix	trans	-67.2	-46.8	178.3	-176.6	176.1	5.3	0	0	109.2	D321 K325 T326 C327	D321-Q323 WeakPolarHBondContact OD1-CA 3.37Å; D321-Q323 WeakPolarHBondContact OD1-CB 3.36Å; D321-Q323 PolarHBondContact OD1-N 2.86Å; Q323-K325 PolarHBondContact O-N 3Å; Q323-T326 PolarHBondContact O-N 2.94Å; Q323-T326 VanDerWaalsContact O-N 3.16Å; Q323-C327 WeakPolarHBondContact O-CB 3.49Å; Q323-C327 PolarHBondContact O-N 3.35Å; Q323-C327 PolarHBondContact O-SG 2.78Å
324	T	93.7	Very high	94	Very high	21 Å²	21	23.8 Å²	23.8	13%	0.129	12%	0.119	C	C	.	.	H	α-helix	trans	-57.1	-47	174.1	-63.8	0	0	0	0	111.3	A319 D321 T326 C327 W328	A319-T324 HydrophobicContact CB-CG2 3.76Å; D321-T324 PolarHBondContact OD1-N 3.06Å; D321-T324 PolarHBondContact OD1-OG1 2.86Å; D321-T324 WeakPolarHBondContact OD2-CB 3.24Å; D321-T324 PolarHBondContact OD2-OG1 3.15Å; T324-T326 PolarHBondContact O-N 3.5Å; T324-C327 PolarHBondContact O-N 3.33Å; T324-W328 PolarHBondContact O-N 3.11Å
325	K	95.5	Very high	94.1	Very high	22 Å²	22	25.1 Å²	25.1	10%	0.096	13%	0.127	C	C	.	.	H	α-helix	trans	-55.5	-50.7	173.6	-177	-165.6	68.6	167.2	0	111.5	F299 F301 A319 D321 E322 Q323 C327 W328 I329	F299-K325 HydrophobicContact CB-CB 4.11Å; F299-K325 HydrophobicContact CB-CD 4.33Å; F301-K325 HydrophobicContact CD1-CG 4Å; A319-K325 HydrophobicContact CB-CB 4.02Å; D321-K325 PolarHBondContact O-N 2.57Å; D321-K325 VanDerWaalsContact O-N 3.16Å; E322-K325 PolarHBondContact O-N 2.98Å; Q323-K325 PolarHBondContact O-N 3Å; K325-C327 VanDerWaalsContact C-N 3.34Å; K325-C327 PolarHBondContact O-N 3.13Å; K325-W328 PolarHBondContact O-N 3.19Å; K325-I329 HydrophobicContact CD-CD1 4.2Å; K325-I329 HydrophobicContact CG-CD1 3.8Å; K325-I329 HydrophobicContact CG-CG1 4.47Å; K325-I329 WeakPolarHBondContact O-CG1 3.47Å; K325-I329 PolarHBondContact O-N 3.24Å
326	T	92.9	Very high	94.1	Very high	37 Å²	37	24.1 Å²	24.1	23%	0.227	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-37.5	-174.8	-56.7	0	0	0	0	111.7	F198 E322 Q323 T324 T330	F198-T326 HydrophobicContact CE2-CG2 4.46Å; F198-T326 HydrophobicContact CZ-CG2 4.16Å; E322-T326 VanDerWaalsContact O-CB 3.31Å; E322-T326 WeakPolarHBondContact O-CB 3.27Å; E322-T326 PolarHBondContact O-N 3.1Å; E322-T326 PolarHBondContact O-OG1 3.07Å; Q323-T326 PolarHBondContact O-N 2.94Å; Q323-T326 VanDerWaalsContact O-N 3.16Å; T324-T326 PolarHBondContact O-N 3.5Å; T326-T330 VanDerWaalsContact O-CB 3.23Å; T326-T330 WeakPolarHBondContact O-CB 3.37Å; T326-T330 PolarHBondContact O-N 2.79Å; T326-T330 PolarHBondContact O-OG1 3.47Å
327	C	95.1	Very high	93.9	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	13%	0.128	C	C	.	.	H	α-helix	trans	-62.8	-50.4	172.3	-68.7	0	0	0	0	111.6	F198 F199 M203 Q323 T324 K325 T330 A331	F198-C327 PolarHBondContact O-SG 3.14Å; F198-C327 VanDerWaalsContact O-SG 3.33Å; F199-C327 HydrophobicContact CD1-CB 3.77Å; F199-C327 HydrophobicContact CE1-CB 3.91Å; M203-C327 HydrophobicContact CE-CB 3.43Å; M203-C327 VanDerWaalsContact CE-CB 3.43Å; M203-C327 HydrophobicContact SD-CB 3.49Å; M203-C327 WeakPolarHBondContact SD-CB 3.4Å; Q323-C327 WeakPolarHBondContact O-CB 3.49Å; Q323-C327 PolarHBondContact O-N 3.35Å; Q323-C327 PolarHBondContact O-SG 2.78Å; T324-C327 PolarHBondContact O-N 3.33Å; K325-C327 VanDerWaalsContact C-N 3.34Å; K325-C327 PolarHBondContact O-N 3.13Å; C327-T330 PolarHBondContact O-N 3.09Å; C327-A331 VanDerWaalsContact O-CB 3.31Å; C327-A331 WeakPolarHBondContact O-CB 3.37Å; C327-A331 PolarHBondContact O-N 2.81Å
328	W	96.8	Very high	93.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.2	-46.6	179.5	-82.9	109.1	0	0	0	112.7	M203 I232 L236 F251 L253 L258 F301 T324 K325 T330 A331 M332	M203-W328 HydrophobicContact CE-CB 4.41Å; M203-W328 VanDerWaalsContact CE-CD1 3.49Å; M203-W328 HydrophobicContact CE-CD2 3.75Å; M203-W328 HydrophobicContact CE-CG 3.64Å; M203-W328 HydrophobicContact CE-CZ2 4.44Å; I232-W328 HydrophobicContact CG2-CD2 4.48Å; I232-W328 HydrophobicContact CG2-CE3 4.14Å; I232-W328 HydrophobicContact CG2-CH2 4.24Å; I232-W328 HydrophobicContact CG2-CZ3 4.03Å; L236-W328 HydrophobicContact CD1-CD2 3.85Å; L236-W328 HydrophobicContact CD1-CE3 4.36Å; L236-W328 HydrophobicContact CD1-CG 4.08Å; L236-W328 HydrophobicContact CD1-CZ2 4.24Å; L236-W328 HydrophobicContact CD2-CG 4.3Å; L236-W328 HydrophobicContact CG-CD2 4.47Å; L236-W328 HydrophobicContact CG-CZ2 4.44Å; F251-W328 HydrophobicContact CB-CH2 3.55Å; F251-W328 HydrophobicContact CB-CZ2 3.86Å; F251-W328 HydrophobicContact CB-CZ3 4.34Å; L253-W328 HydrophobicContact CB-CZ3 4.07Å; L258-W328 HydrophobicContact CD1-CE3 4.36Å; L258-W328 HydrophobicContact CD1-CH2 4.29Å; L258-W328 HydrophobicContact CD1-CZ3 3.62Å; F301-W328 HydrophobicContact CE1-CB 4.32Å; F301-W328 HydrophobicContact CE2-CB 4.32Å; F301-W328 HydrophobicContact CZ-CB 3.72Å; F301-W328 HydrophobicContact CZ-CG 4.25Å; T324-W328 PolarHBondContact O-N 3.11Å; K325-W328 PolarHBondContact O-N 3.19Å; W328-T330 VanDerWaalsContact C-N 3.32Å; W328-T330 PolarHBondContact O-N 3.36Å; W328-A331 PolarHBondContact O-N 3.43Å; W328-M332 HydrophobicContact CB-CE 4.31Å; W328-M332 HydrophobicContact CD2-CE 4.42Å; W328-M332 HydrophobicContact CE3-CE 3.66Å; W328-M332 HydrophobicContact CZ3-CE 4.38Å; W328-M332 VanDerWaalsContact O-CG 3.27Å; W328-M332 WeakPolarHBondContact O-CG 3.36Å; W328-M332 PolarHBondContact O-N 2.74Å
329	I	96.5	Very high	93.3	Very high	25 Å²	25	30.6 Å²	30.6	13%	0.128	16%	0.157	C	C	.	.	H	α-helix	trans	-60	-44	176.4	-67	172.9	0	0	0	110.5	I283 F301 K325 M332 R333	I283-I329 HydrophobicContact CG2-CG1 4.2Å; I283-I329 HydrophobicContact CG2-CG2 4.35Å; F301-I329 HydrophobicContact CB-CD1 3.94Å; F301-I329 HydrophobicContact CB-CG1 4.13Å; F301-I329 HydrophobicContact CD2-CG1 4.13Å; F301-I329 HydrophobicContact CG-CD1 4.33Å; F301-I329 HydrophobicContact CG-CG1 4.07Å; K325-I329 HydrophobicContact CD-CD1 4.2Å; K325-I329 HydrophobicContact CG-CD1 3.8Å; K325-I329 HydrophobicContact CG-CG1 4.47Å; K325-I329 WeakPolarHBondContact O-CG1 3.47Å; K325-I329 PolarHBondContact O-N 3.24Å; I329-M332 PolarHBondContact O-N 3.16Å; I329-R333 HydrophobicContact CG2-CG 4.45Å; I329-R333 VanDerWaalsContact O-CG 3.32Å; I329-R333 WeakPolarHBondContact O-CG 3.35Å; I329-R333 PolarHBondContact O-N 3.44Å
330	T	95.5	Very high	93	Very high	9 Å²	9	33.9 Å²	33.9	6%	0.055	17%	0.172	C	C	.	.	H	α-helix	trans	-70.8	-37.5	-178	-56.2	0	0	0	0	112.3	F191 F198 T326 C327 W328 M332 R333 L334	F191-T330 HydrophobicContact CB-CG2 3.89Å; F191-T330 HydrophobicContact CG-CG2 4.48Å; F198-T330 HydrophobicContact CE1-CG2 3.76Å; F198-T330 HydrophobicContact CZ-CG2 3.73Å; F198-T330 WeakPolarHBondContact CZ-OG1 3.34Å; T326-T330 VanDerWaalsContact O-CB 3.23Å; T326-T330 WeakPolarHBondContact O-CB 3.37Å; T326-T330 PolarHBondContact O-N 2.79Å; T326-T330 PolarHBondContact O-OG1 3.47Å; C327-T330 PolarHBondContact O-N 3.09Å; W328-T330 VanDerWaalsContact C-N 3.32Å; W328-T330 PolarHBondContact O-N 3.36Å; T330-M332 VanDerWaalsContact C-N 3.33Å; T330-M332 PolarHBondContact O-N 2.92Å; T330-R333 PolarHBondContact O-N 3.3Å; T330-L334 HydrophobicContact CG2-CD1 4.17Å; T330-L334 HydrophobicContact CG2-CG 4.48Å; T330-L334 WeakPolarHBondContact O-CB 3.42Å; T330-L334 VanDerWaalsContact O-CG 3.3Å; T330-L334 WeakPolarHBondContact O-CG 3.46Å; T330-L334 PolarHBondContact O-N 3.16Å
331	A	94.5	Very high	93	Very high	4 Å²	4	30.4 Å²	30.4	3%	0.033	15%	0.154	C	C	.	.	H	α-helix	trans	-60.7	-41.1	171.5	0	0	0	0	0	112.2	F199 I232 L253 C327 W328 L334 L335	F199-A331 HydrophobicContact CE1-CB 4.11Å; F199-A331 HydrophobicContact CZ-CB 4.2Å; I232-A331 HydrophobicContact CB-CB 4.33Å; I232-A331 HydrophobicContact CG1-CB 3.92Å; I232-A331 HydrophobicContact CG2-CB 4.13Å; L253-A331 HydrophobicContact CD2-CB 3.75Å; C327-A331 VanDerWaalsContact O-CB 3.31Å; C327-A331 WeakPolarHBondContact O-CB 3.37Å; C327-A331 PolarHBondContact O-N 2.81Å; W328-A331 PolarHBondContact O-N 3.43Å; A331-L334 PolarHBondContact O-N 3.44Å; A331-L335 WeakPolarHBondContact O-CB 3.31Å; A331-L335 PolarHBondContact O-N 3.44Å
332	M	95.1	Very high	93.1	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-69.3	-37.2	175.9	-64.9	175	-161.8	0	0	112.3	L253 L258 F278 I283 F301 L317 W328 I329 T330 L335 K336	L253-M332 HydrophobicContact CD1-CG 4.23Å; L253-M332 HydrophobicContact CD2-CG 4.5Å; L258-M332 HydrophobicContact CD1-CE 4.21Å; L258-M332 HydrophobicContact CD2-CE 3.64Å; F278-M332 HydrophobicContact CD1-CB 4.34Å; F278-M332 HydrophobicContact CE1-CB 3.94Å; F278-M332 HydrophobicContact CE1-CG 3.75Å; F278-M332 HydrophobicContact CE1-SD 3.57Å; F278-M332 VanDerWaalsContact CE1-SD 3.57Å; F278-M332 HydrophobicContact CE2-CG 4.24Å; F278-M332 HydrophobicContact CZ-CB 4.12Å; F278-M332 HydrophobicContact CZ-CE 4.39Å; F278-M332 HydrophobicContact CZ-CG 3.54Å; F278-M332 HydrophobicContact CZ-SD 3.61Å; I283-M332 HydrophobicContact CD1-CB 3.95Å; I283-M332 HydrophobicContact CG1-CB 3.84Å; I283-M332 HydrophobicContact CG1-SD 4.21Å; I283-M332 HydrophobicContact CG2-SD 4.43Å; F301-M332 HydrophobicContact CE2-CE 3.76Å; F301-M332 HydrophobicContact CE2-SD 4.07Å; F301-M332 HydrophobicContact CZ-CE 4.29Å; L317-M332 HydrophobicContact CD1-CE 4.49Å; W328-M332 HydrophobicContact CB-CE 4.31Å; W328-M332 HydrophobicContact CD2-CE 4.42Å; W328-M332 HydrophobicContact CE3-CE 3.66Å; W328-M332 HydrophobicContact CZ3-CE 4.38Å; W328-M332 VanDerWaalsContact O-CG 3.27Å; W328-M332 WeakPolarHBondContact O-CG 3.36Å; W328-M332 PolarHBondContact O-N 2.74Å; I329-M332 PolarHBondContact O-N 3.16Å; T330-M332 VanDerWaalsContact C-N 3.33Å; T330-M332 PolarHBondContact O-N 2.92Å; M332-L335 PolarHBondContact O-N 2.83Å; M332-K336 WeakPolarHBondContact O-CB 3.49Å; M332-K336 PolarHBondContact O-N 2.76Å
333	R	95.1	Very high	93.4	Very high	25 Å²	25	33.8 Å²	33.8	9%	0.094	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-44.2	171.8	-70.6	167.3	69.9	-135.8	2.2	111.9	E160 K188 I329 T330 K336 F337 L341	E160-R333 VanDerWaalsContact CD-NH2 3.26Å; E160-R333 IonicContact OE1-CZ 2.72Å; E160-R333 IonicContact OE1-NE 3.19Å; E160-R333 PolarHBondContact OE1-NE 3.14Å; E160-R333 IonicContact OE1-NH2 2.76Å; E160-R333 PolarHBondContact OE1-NH2 2.99Å; E160-R333 IonicContact OE2-CZ 2.62Å; E160-R333 IonicContact OE2-NH2 2.67Å; E160-R333 PolarHBondContact OE2-NH2 3.28Å; K188-R333 PolarHBondContact O-NH1 2.93Å; K188-R333 PolarHBondContact O-NH2 3.45Å; I329-R333 HydrophobicContact CG2-CG 4.45Å; I329-R333 VanDerWaalsContact O-CG 3.32Å; I329-R333 WeakPolarHBondContact O-CG 3.35Å; I329-R333 PolarHBondContact O-N 3.44Å; T330-R333 PolarHBondContact O-N 3.3Å; R333-K336 PolarHBondContact O-N 2.98Å; R333-F337 HydrophobicContact CB-CD2 4.46Å; R333-F337 WeakPolarHBondContact O-CB 3.25Å; R333-F337 WeakPolarHBondContact O-CD2 3.49Å; R333-F337 PolarHBondContact O-N 2.91Å; R333-L341 HydrophobicContact CB-CD2 3.91Å
334	L	92.8	Very high	93.7	Very high	5 Å²	5	29 Å²	29	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-41.9	174.8	-74.2	165.2	0	0	0	111.4	F191 F192 F199 F223 L224 T330 A331 G338 L341	F191-L334 HydrophobicContact CD1-CD1 3.78Å; F191-L334 HydrophobicContact CD1-CD2 3.98Å; F191-L334 HydrophobicContact CD1-CG 4.42Å; F191-L334 HydrophobicContact CE1-CD1 3.74Å; F191-L334 HydrophobicContact CE1-CD2 3.85Å; F191-L334 HydrophobicContact CE1-CG 4.46Å; F191-L334 HydrophobicContact CG-CD1 4.22Å; F191-L334 HydrophobicContact CZ-CD1 4.15Å; F192-L334 HydrophobicContact CE1-CD2 3.99Å; F192-L334 HydrophobicContact CZ-CD2 3.91Å; F199-L334 HydrophobicContact CE2-CD1 4.48Å; F199-L334 HydrophobicContact CZ-CD1 4.32Å; F223-L334 HydrophobicContact CB-CD1 4.49Å; F223-L334 HydrophobicContact CD1-CD1 3.99Å; F223-L334 HydrophobicContact CG-CD1 4.32Å; L224-L334 HydrophobicContact CD2-CD2 4.26Å; T330-L334 HydrophobicContact CG2-CD1 4.17Å; T330-L334 HydrophobicContact CG2-CG 4.48Å; T330-L334 WeakPolarHBondContact O-CB 3.42Å; T330-L334 VanDerWaalsContact O-CG 3.3Å; T330-L334 WeakPolarHBondContact O-CG 3.46Å; T330-L334 PolarHBondContact O-N 3.16Å; A331-L334 PolarHBondContact O-N 3.44Å; L334-G338 WeakPolarHBondContact O-CA 3.36Å; L334-G338 PolarHBondContact O-N 3.17Å; L334-L341 HydrophobicContact CD2-CD2 4.25Å; L334-L341 HydrophobicContact CG-CD2 4.49Å
335	L	91.8	Very high	93.6	Very high	39 Å²	39	29.2 Å²	29.2	20%	0.204	14%	0.142	C	C	.	.	H	α-helix	trans	-67	-41.2	175.4	177.2	60.6	0	0	0	112.9	L253 R254 F278 A331 M332	L253-L335 HydrophobicContact CD1-CD2 3.71Å; L253-L335 HydrophobicContact CD2-CB 4.45Å; L253-L335 HydrophobicContact CD2-CD2 4.26Å; L253-L335 HydrophobicContact CG-CD2 3.92Å; R254-L335 WeakPolarHBondContact O-CD2 3.41Å; F278-L335 HydrophobicContact CD2-CD2 3.75Å; F278-L335 HydrophobicContact CD2-CG 4.44Å; F278-L335 HydrophobicContact CE2-CD2 3.98Å; A331-L335 WeakPolarHBondContact O-CB 3.31Å; A331-L335 PolarHBondContact O-N 3.44Å; M332-L335 PolarHBondContact O-N 2.83Å
336	K	92.5	Very high	93.3	Very high	51 Å²	51	30 Å²	30	22%	0.222	15%	0.147	C	C	.	.	H	α-helix	trans	-69.8	-45.8	-178.5	-178.5	175.9	175.5	90.5	0	112.8	F278 A279 S281 D282 I283 M332 R333	F278-K336 HydrophobicContact CB-CB 4.06Å; F278-K336 HydrophobicContact CB-CG 4.34Å; F278-K336 WeakPolarHBondContact O-CG 3.45Å; F278-K336 PolarHBondContact O-NZ 2.85Å; A279-K336 PolarHBondContact O-NZ 3.07Å; A279-K336 VanDerWaalsContact O-NZ 3.17Å; S281-K336 PolarHBondContact O-NZ 3.47Å; D282-K336 WeakPolarHBondContact OD1-CE 3.32Å; D282-K336 IonicContact OD1-NZ 3.06Å; D282-K336 PolarHBondContact OD1-NZ 2.98Å; I283-K336 HydrophobicContact CD1-CD 4.3Å; M332-K336 WeakPolarHBondContact O-CB 3.49Å; M332-K336 PolarHBondContact O-N 2.76Å; R333-K336 PolarHBondContact O-N 2.98Å
337	F	92.4	Very high	92.7	Very high	38 Å²	38	32 Å²	32	17%	0.167	15%	0.154	C	C	.	.	H	α-helix	trans	-109.2	-22.7	-169.3	-60.2	-66.2	0	0	0	114	E160 H162 R333 M339 Q340 L341	E160-F337 HydrophobicContact CG-CD2 3.98Å; E160-F337 HydrophobicContact CG-CE2 3.56Å; E160-F337 HydrophobicContact CG-CZ 3.87Å; H162-F337 AromaticContact CE1-CD1 3.54Å; H162-F337 AromaticContact CE1-CE1 3.6Å; H162-F337 AromaticContact NE2-CD1 3.61Å; H162-F337 AromaticContact NE2-CE1 3.88Å; R333-F337 HydrophobicContact CB-CD2 4.46Å; R333-F337 WeakPolarHBondContact O-CB 3.25Å; R333-F337 WeakPolarHBondContact O-CD2 3.49Å; R333-F337 PolarHBondContact O-N 2.91Å; F337-M339 PolarHBondContact O-N 2.82Å; F337-Q340 VanDerWaalsContact O-CB 3.3Å; F337-Q340 WeakPolarHBondContact O-CB 3.34Å; F337-Q340 PolarHBondContact O-N 2.87Å; F337-Q340 VanDerWaalsContact O-N 3.07Å; F337-L341 HydrophobicContact CB-CB 3.94Å
338	G	90.9	Very high	91.4	Very high	16 Å²	16	32.5 Å²	32.5	17%	0.165	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	-129.3	176.1	0	0	0	0	0	113.8	L224 L334 Q340 L341	L224-G338 WeakPolarHBondContact CD2-O 3.32Å; L334-G338 WeakPolarHBondContact O-CA 3.36Å; L334-G338 PolarHBondContact O-N 3.17Å; G338-Q340 PolarHBondContact O-N 2.76Å; G338-Q340 VanDerWaalsContact O-N 3.11Å; G338-L341 WeakPolarHBondContact O-CB 3.48Å; G338-L341 PolarHBondContact O-N 2.8Å
339	M	90.9	Very high	89.7	Confident	91 Å²	91	36 Å²	36	45%	0.448	17%	0.173	S	C	.	.	H	α-helix	trans	-52.9	-31.6	179.7	-175.4	57.5	70.4	0	0	113.6	L224 F337 L341 Y342 Q343	L224-M339 HydrophobicContact CB-CE 3.99Å; L224-M339 HydrophobicContact CD1-CE 4.09Å; L224-M339 HydrophobicContact CD1-SD 4.21Å; F337-M339 PolarHBondContact O-N 2.82Å; M339-L341 VanDerWaalsContact C-N 3.28Å; M339-L341 PolarHBondContact O-N 2.73Å; M339-Y342 PolarHBondContact O-N 2.93Å; M339-Y342 HydrophobicContact SD-CD1 3.96Å; M339-Q343 HydrophobicContact CG-CG 4.39Å; M339-Q343 WeakPolarHBondContact O-CG 3.48Å; M339-Q343 PolarHBondContact O-N 3.27Å
340	Q	93.4	Very high	87.6	Confident	69 Å²	69	40.2 Å²	40.2	32%	0.322	19%	0.192	S	C	.	.	H	α-helix	trans	-64.7	-33.4	178.8	-171.3	58.3	72.3	0	0	112	H162 F337 G338 Q343 N344	H162-Q340 HydrophobicContact CB-CG 4.3Å; H162-Q340 WeakPolarHBondContact CD2-CG 3.48Å; F337-Q340 VanDerWaalsContact O-CB 3.3Å; F337-Q340 WeakPolarHBondContact O-CB 3.34Å; F337-Q340 PolarHBondContact O-N 2.87Å; F337-Q340 VanDerWaalsContact O-N 3.07Å; G338-Q340 PolarHBondContact O-N 2.76Å; G338-Q340 VanDerWaalsContact O-N 3.11Å; Q340-Q343 PolarHBondContact O-N 3.12Å; Q340-N344 PolarHBondContact NE2-OD1 2.92Å; Q340-N344 VanDerWaalsContact NE2-OD1 3.17Å; Q340-N344 WeakPolarHBondContact O-CB 3.49Å; Q340-N344 PolarHBondContact O-N 3.14Å; Q340-N344 PolarHBondContact O-ND2 3.11Å; Q340-N344 PolarHBondContact O-OD1 3.21Å
341	L	93.8	Very high	85.3	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-70	-34.2	176.7	-166.3	62.1	0	0	0	112.1	E160 Y189 F192 R333 L334 F337 G338 M339 N344 F345	E160-L341 HydrophobicContact CG-CD1 4.11Å; E160-L341 WeakPolarHBondContact OE2-CD1 3.47Å; Y189-L341 HydrophobicContact CE1-CD1 4.35Å; F192-L341 HydrophobicContact CE2-CG 4.01Å; F192-L341 WeakPolarHBondContact CE2-O 3.24Å; F192-L341 HydrophobicContact CZ-CB 4.32Å; F192-L341 HydrophobicContact CZ-CD2 4.4Å; F192-L341 HydrophobicContact CZ-CG 4.12Å; R333-L341 HydrophobicContact CB-CD2 3.91Å; L334-L341 HydrophobicContact CD2-CD2 4.25Å; L334-L341 HydrophobicContact CG-CD2 4.49Å; F337-L341 HydrophobicContact CB-CB 3.94Å; G338-L341 WeakPolarHBondContact O-CB 3.48Å; G338-L341 PolarHBondContact O-N 2.8Å; M339-L341 VanDerWaalsContact C-N 3.28Å; M339-L341 PolarHBondContact O-N 2.73Å; L341-N344 WeakPolarHBondContact O-CB 3.43Å; L341-N344 PolarHBondContact O-N 2.76Å; L341-F345 PolarHBondContact O-N 2.98Å
342	Y	92.6	Very high	83	Confident	69 Å²	69	52.6 Å²	52.6	27%	0.271	25%	0.246	S	C	.	.	H	α-helix	trans	-74.4	-40.6	174.1	-179.5	-110.5	0	0	0	112.3	F192 I220 L224 M339 N344 F345 I346	F192-Y342 AromaticContact CD1-CD2 3.73Å; F192-Y342 HydrophobicContact CD1-CD2 3.73Å; F192-Y342 HydrophobicContact CD1-CE2 4.42Å; F192-Y342 AromaticContact CE1-CD2 3.79Å; F192-Y342 HydrophobicContact CE1-CD2 3.79Å; F192-Y342 HydrophobicContact CE1-CG 4.37Å; F192-Y342 HydrophobicContact CG-CD2 4.21Å; F192-Y342 HydrophobicContact CZ-CD2 4.32Å; I220-Y342 HydrophobicContact CG2-CD2 3.99Å; I220-Y342 HydrophobicContact CG2-CE2 3.92Å; L224-Y342 VanDerWaalsContact CD1-CB 3.45Å; L224-Y342 HydrophobicContact CD1-CD1 3.78Å; L224-Y342 HydrophobicContact CD1-CD2 4.13Å; L224-Y342 HydrophobicContact CD1-CG 3.51Å; M339-Y342 PolarHBondContact O-N 2.93Å; M339-Y342 HydrophobicContact SD-CD1 3.96Å; Y342-N344 PolarHBondContact O-N 2.81Å; Y342-F345 HydrophobicContact CD2-CD1 4.14Å; Y342-F345 HydrophobicContact CE2-CD1 4.07Å; Y342-F345 HydrophobicContact CE2-CE1 4.5Å; Y342-F345 WeakPolarHBondContact O-CB 3.45Å; Y342-F345 PolarHBondContact O-N 2.97Å; Y342-F345 VanDerWaalsContact O-N 3.09Å; Y342-I346 HydrophobicContact CD1-CD1 4.26Å; Y342-I346 HydrophobicContact CD1-CG2 4.4Å; Y342-I346 HydrophobicContact CD2-CG2 4.25Å; Y342-I346 HydrophobicContact CE1-CD1 3.99Å; Y342-I346 HydrophobicContact CE1-CG2 3.92Å; Y342-I346 HydrophobicContact CE2-CG2 3.76Å; Y342-I346 PolarHBondContact O-N 2.85Å
343	Q	92.1	Very high	80.3	Confident	84 Å²	84	61 Å²	61	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-55	-42.3	168.5	-73.6	178.6	1.4	0	0	111	M339 Q340 F345 I346 Q347	M339-Q343 HydrophobicContact CG-CG 4.39Å; M339-Q343 WeakPolarHBondContact O-CG 3.48Å; M339-Q343 PolarHBondContact O-N 3.27Å; Q340-Q343 PolarHBondContact O-N 3.12Å; Q343-F345 VanDerWaalsContact C-N 3.31Å; Q343-F345 PolarHBondContact O-N 3.31Å; Q343-I346 PolarHBondContact O-N 3.37Å; Q343-Q347 VanDerWaalsContact O-CB 3.27Å; Q343-Q347 WeakPolarHBondContact O-CB 3.43Å; Q343-Q347 PolarHBondContact O-N 2.97Å
344	N	93.8	Very high	77.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-38.4	177.1	-67.9	-11.7	0	0	0	112.6	R126 D161 H162 Y189 Q340 L341 Y342 P348	R126-N344 PolarHBondContact NH2-O 3.17Å; D161-N344 HydrophobicContact CB-CB 4Å; H162-N344 PolarHBondContact ND1-ND2 2.91Å; H162-N344 VanDerWaalsContact ND1-ND2 3.18Å; Y189-N344 HydrophobicContact CE1-CB 4.48Å; Y189-N344 WeakPolarHBondContact OH-CB 3.27Å; Q340-N344 PolarHBondContact NE2-OD1 2.92Å; Q340-N344 VanDerWaalsContact NE2-OD1 3.17Å; Q340-N344 WeakPolarHBondContact O-CB 3.49Å; Q340-N344 PolarHBondContact O-N 3.14Å; Q340-N344 PolarHBondContact O-ND2 3.11Å; Q340-N344 PolarHBondContact O-OD1 3.21Å; L341-N344 WeakPolarHBondContact O-CB 3.43Å; L341-N344 PolarHBondContact O-N 2.76Å; Y342-N344 PolarHBondContact O-N 2.81Å; N344-P348 VanDerWaalsContact O-CD 3.32Å; N344-P348 WeakPolarHBondContact O-CD 3.35Å
345	F	91.9	Very high	74.4	Confident	27 Å²	27	69.9 Å²	69.9	12%	0.118	34%	0.344	C	S	.	.	H	α-helix	trans	-69.1	-44.9	174.6	168.5	-111.4	0	0	0	113.5	Y189 F192 K193 L341 Y342 Q343 P348 H349	Y189-F345 HydrophobicContact CD1-CB 3.91Å; Y189-F345 HydrophobicContact CD1-CD2 4.36Å; Y189-F345 HydrophobicContact CD2-CB 4.45Å; Y189-F345 AromaticContact CD2-CD2 3.93Å; Y189-F345 HydrophobicContact CD2-CD2 3.93Å; Y189-F345 HydrophobicContact CE1-CB 4.1Å; Y189-F345 HydrophobicContact CG-CB 4.12Å; Y189-F345 AromaticContact CG-CD2 3.74Å; Y189-F345 HydrophobicContact CG-CD2 3.74Å; Y189-F345 HydrophobicContact CG-CG 4.35Å; F192-F345 HydrophobicContact CB-CD1 3.48Å; F192-F345 VanDerWaalsContact CB-CD1 3.48Å; F192-F345 HydrophobicContact CB-CD2 4.13Å; F192-F345 HydrophobicContact CB-CE1 3.49Å; F192-F345 VanDerWaalsContact CB-CE1 3.49Å; F192-F345 HydrophobicContact CB-CE2 4.13Å; F192-F345 HydrophobicContact CB-CG 3.81Å; F192-F345 HydrophobicContact CB-CZ 3.82Å; F192-F345 HydrophobicContact CD2-CB 3.55Å; F192-F345 AromaticContact CD2-CD1 3.99Å; F192-F345 HydrophobicContact CD2-CD1 3.99Å; F192-F345 HydrophobicContact CD2-CD2 4.25Å; F192-F345 AromaticContact CD2-CG 3.67Å; F192-F345 HydrophobicContact CD2-CG 3.67Å; F192-F345 HydrophobicContact CE2-CB 3.95Å; F192-F345 HydrophobicContact CG-CB 4.3Å; F192-F345 AromaticContact CG-CD1 3.88Å; F192-F345 HydrophobicContact CG-CD1 3.88Å; F192-F345 HydrophobicContact CG-CE1 4.38Å; F192-F345 HydrophobicContact CG-CG 4.03Å; K193-F345 HydrophobicContact CG-CE2 4.18Å; K193-F345 HydrophobicContact CG-CZ 4.42Å; L341-F345 PolarHBondContact O-N 2.98Å; Y342-F345 HydrophobicContact CD2-CD1 4.14Å; Y342-F345 HydrophobicContact CE2-CD1 4.07Å; Y342-F345 HydrophobicContact CE2-CE1 4.5Å; Y342-F345 WeakPolarHBondContact O-CB 3.45Å; Y342-F345 PolarHBondContact O-N 2.97Å; Y342-F345 VanDerWaalsContact O-N 3.09Å; Q343-F345 VanDerWaalsContact C-N 3.31Å; Q343-F345 PolarHBondContact O-N 3.31Å; F345-P348 WeakPolarHBondContact O-CD 3.44Å; F345-H349 AromaticContact CD2-CE1 3.89Å; F345-H349 AromaticContact CE2-CE1 3.56Å; F345-H349 PolarHBondContact O-CE1 2.9Å; F345-H349 VanDerWaalsContact O-CE1 3.28Å; F345-H349 PolarHBondContact O-ND1 3Å
346	I	88.7	Confident	71.7	Confident	39 Å²	39	73.4 Å²	73.4	20%	0.2	37%	0.372	C	S	.	.	H	α-helix	trans	-79.1	-26.8	-174.4	67.3	-175.2	0	0	0	113.9	Y342 Q343 H349 Q350	Y342-I346 HydrophobicContact CD1-CD1 4.26Å; Y342-I346 HydrophobicContact CD1-CG2 4.4Å; Y342-I346 HydrophobicContact CD2-CG2 4.25Å; Y342-I346 HydrophobicContact CE1-CD1 3.99Å; Y342-I346 HydrophobicContact CE1-CG2 3.92Å; Y342-I346 HydrophobicContact CE2-CG2 3.76Å; Y342-I346 PolarHBondContact O-N 2.85Å; Q343-I346 PolarHBondContact O-N 3.37Å; I346-H349 WeakPolarHBondContact O-CB 3.45Å; I346-H349 PolarHBondContact O-N 3.44Å; I346-H349 VanDerWaalsContact O-N 3.16Å; I346-Q350 WeakPolarHBondContact O-CG 3.49Å; I346-Q350 PolarHBondContact O-N 3.43Å
347	Q	80.8	Confident	69.1	Low	79 Å²	79	78.9 Å²	78.9	37%	0.369	40%	0.4	S	S	.	.	H	α-helix	trans	-62.2	-37.3	-171.6	-173.5	173.7	7	0	0	115	R126 Q343 Q350 K351	R126-Q347 VanDerWaalsContact NH1-CD 3.3Å; Q343-Q347 VanDerWaalsContact O-CB 3.27Å; Q343-Q347 WeakPolarHBondContact O-CB 3.43Å; Q343-Q347 PolarHBondContact O-N 2.97Å; Q347-Q350 PolarHBondContact O-N 3.21Å; Q347-K351 PolarHBondContact O-N 3.25Å
348	P	67.8	Low	66.6	Low	10 Å²	10	88 Å²	88	7%	0.065	43%	0.433	C	S	.	.	H	α-helix	trans	-62.9	-46.5	170.8	-23.6	35.2	0	0	0	112.7	H142 N344 F345 Q350 K351 Q352	H142-P348 VanDerWaalsContact CE1-CB 3.43Å; H142-P348 WeakPolarHBondContact CE1-CB 3.3Å; H142-P348 WeakPolarHBondContact NE2-CB 3.47Å; N344-P348 VanDerWaalsContact O-CD 3.32Å; N344-P348 WeakPolarHBondContact O-CD 3.35Å; F345-P348 WeakPolarHBondContact O-CD 3.44Å; P348-Q350 VanDerWaalsContact C-N 3.26Å; P348-Q350 PolarHBondContact O-N 2.84Å; P348-K351 PolarHBondContact O-N 3.05Å; P348-Q352 PolarHBondContact O-N 3.34Å
349	H	60	Low	64.1	Low	75 Å²	75	92.4 Å²	92.4	35%	0.347	46%	0.462	S	S	.	.	H	α-helix	trans	-62.5	-31.7	177.4	-54.4	93.7	0	0	0	112.5	H142 F345 I346 Q352 K353	H142-H349 AromaticContact CD2-CE1 3.91Å; H142-H349 AromaticContact CD2-NE2 3.76Å; F345-H349 AromaticContact CD2-CE1 3.89Å; F345-H349 AromaticContact CE2-CE1 3.56Å; F345-H349 PolarHBondContact O-CE1 2.9Å; F345-H349 VanDerWaalsContact O-CE1 3.28Å; F345-H349 PolarHBondContact O-ND1 3Å; I346-H349 WeakPolarHBondContact O-CB 3.45Å; I346-H349 PolarHBondContact O-N 3.44Å; I346-H349 VanDerWaalsContact O-N 3.16Å; H349-Q352 PolarHBondContact O-N 2.94Å; H349-K353 PolarHBondContact O-N 3.08Å
350	Q	53.3	Low	61.5	Low	113 Å²	113	95.3 Å²	95.3	53%	0.528	48%	0.478	S	S	.	.	H	α-helix	trans	-67.2	-35.7	172.6	-74.4	177.1	-5.7	0	0	112.7	I346 Q347 P348 Q352 K353	I346-Q350 WeakPolarHBondContact O-CG 3.49Å; I346-Q350 PolarHBondContact O-N 3.43Å; Q347-Q350 PolarHBondContact O-N 3.21Å; P348-Q350 VanDerWaalsContact C-N 3.26Å; P348-Q350 PolarHBondContact O-N 2.84Å; Q350-Q352 VanDerWaalsContact C-N 3.29Å; Q350-Q352 PolarHBondContact O-N 2.96Å; Q350-K353 CarbonylContact O-C 3.56Å; Q350-K353 PolarHBondContact O-N 3.12Å; Q350-K353 VanDerWaalsContact O-N 3.14Å
351	K	47.8	Very low	59.1	Low	139 Å²	139	96.8 Å²	96.8	60%	0.604	50%	0.496	S	S	*	.	H	α-helix	trans	-69.9	-24.6	174.5	-74.6	-173	176.4	-177.6	0	113.2	Q347 P348	Q347-K351 PolarHBondContact O-N 3.25Å; P348-K351 PolarHBondContact O-N 3.05Å
352	Q	46.1	Very low	56.8	Low	133 Å²	133	105.4 Å²	105.4	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-73.8	-27	169.9	-67.5	-178.9	-6.9	0	0	112.2	H142 P348 H349 Q350 V354	H142-Q352 PolarHBondContact NE2-NE2 2.88Å; P348-Q352 PolarHBondContact O-N 3.34Å; H349-Q352 PolarHBondContact O-N 2.94Å; Q350-Q352 VanDerWaalsContact C-N 3.29Å; Q350-Q352 PolarHBondContact O-N 2.96Å; Q352-V354 VanDerWaalsContact C-N 3.3Å; Q352-V354 PolarHBondContact O-N 2.71Å
353	K	37.8	Very low	54.8	Low	178 Å²	178	109.2 Å²	109.2	77%	0.774	56%	0.561	S	S	*	*	S	Bend	trans	-76.7	81.3	167.1	-82.3	-170.5	171.9	-177.7	0	111.3	H349 Q350	H349-K353 PolarHBondContact O-N 3.08Å; Q350-K353 CarbonylContact O-C 3.56Å; Q350-K353 PolarHBondContact O-N 3.12Å; Q350-K353 VanDerWaalsContact O-N 3.14Å
354	V	34	Very low	52.9	Low	118 Å²	118	110.3 Å²	110.3	72%	0.715	58%	0.578	S	S	*	*			trans	66.8	95.5	166	-172.1	0	0	0	0	113.8	Q352 S356	Q352-V354 VanDerWaalsContact C-N 3.3Å; Q352-V354 PolarHBondContact O-N 2.71Å; V354-S356 PolarHBondContact O-N 3.11Å
355	S	30	Very low	51.5	Low	98 Å²	98	118.2 Å²	118.2	69%	0.685	62%	0.619	S	S	*	*			trans	-59.2	116.5	139.6	46	0	0	0	0	107.4	M357	S355-M357 VanDerWaalsContact C-N 3.31Å; S355-M357 PolarHBondContact O-N 3.19Å
356	S	36.2	Very low	50.5	Low	112 Å²	112	121.8 Å²	121.8	78%	0.783	64%	0.643	S	S	*	*			trans	-67	95.1	173.8	-174.6	0	0	0	0	108.1	V354 R358	V354-S356 PolarHBondContact O-N 3.11Å; S356-R358 PolarHBondContact O-N 2.92Å
357	M	36.3	Very low	49.9	Very low	166 Å²	166	121.8 Å²	121.8	82%	0.818	65%	0.649	S	S	*	*			trans	-57.6	135.2	171	-72.9	-166.2	-72.5	0	0	107.9	S355 S359	S355-M357 VanDerWaalsContact C-N 3.31Å; S355-M357 PolarHBondContact O-N 3.19Å; M357-S359 PolarHBondContact O-N 2.94Å
358	R	39.7	Very low	49.8	Very low	229 Å²	229	121.7 Å²	121.7	86%	0.864	65%	0.649	S	S	*	*			trans	-53.4	132.7	-177.7	-62.7	176.1	-174.4	152.3	2.8	108.9	S356 I360	S356-R358 PolarHBondContact O-N 2.92Å; R358-I360 PolarHBondContact O-N 3.27Å
359	S	38.3	Very low	50.3	Low	109 Å²	109	122.3 Å²	122.3	76%	0.762	65%	0.652	S	S	*	*			trans	-53.6	106.9	179.4	-178.4	0	0	0	0	110.6	M357	M357-S359 PolarHBondContact O-N 2.94Å
360	I	37.2	Very low	51	Low	152 Å²	152	125.9 Å²	125.9	78%	0.779	67%	0.667	S	S	*	*			trans	-98.9	131.3	154.3	-60.8	172.8	0	0	0	103.6	R358 E362	R358-I360 PolarHBondContact O-N 3.27Å; I360-E362 PolarHBondContact O-N 3.44Å
361	S	43.5	Very low	51.7	Low	100 Å²	100	125.6 Å²	125.6	70%	0.699	68%	0.678	S	S	*	*			trans	-50.4	130.5	-164.1	52.7	0	0	0	0	113.8	N363	S361-N363 PolarHBondContact O-N 3.4Å
362	E	45.3	Very low	52.8	Low	183 Å²	183	121.2 Å²	121.2	86%	0.855	67%	0.672	S	S	*	*	S	Bend	trans	-63.2	-1.6	-166.3	-66.1	168.8	108.2	0	0	116.3	I360	I360-E362 PolarHBondContact O-N 3.44Å
363	N	49.9	Very low	53.7	Low	150 Å²	150	124.9 Å²	124.9	80%	0.802	69%	0.689	S	S	*	*	S	Bend	trans	-111.6	40.1	-159.9	-69.1	19.3	0	0	0	115.3	S361	S361-N363 PolarHBondContact O-N 3.4Å
364	S	53	Low	54.8	Low	106 Å²	106	125.2 Å²	125.2	74%	0.741	69%	0.69	S	S	*	*	S	Bend	trans	-157.9	-11.4	170.7	-161.2	0	0	0	0	119.3
365	L	63.7	Low	56.8	Low	166 Å²	166	123.7 Å²	123.7	87%	0.869	68%	0.681	S	S	*	*			trans	-117.7	122.7	-173.7	-63	179.5	0	0	0	111.6
366	V	71.4	Confident	59.4	Low	102 Å²	102	124 Å²	124	62%	0.618	67%	0.667	S	S	*	*			trans	-128.2	144.5	174.2	-67.3	0	0	0	0	109.9	V377	V366-V377 HydrophobicContact CB-CG1 3.98Å; V366-V377 HydrophobicContact CG1-CG1 4.43Å; V366-V377 HydrophobicContact CG2-CG1 4.17Å
367	A	75.9	Confident	61.6	Low	40 Å²	40	121.8 Å²	121.8	33%	0.331	65%	0.649	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.1	137	174.2	0	0	0	0	0	110	I378 A384	A367-I378 HydrophobicContact CB-CB 4.1Å; A367-I378 HydrophobicContact CB-CD1 4.26Å; A367-I378 PolarHBondContact O-N 2.6Å; A367-A384 HydrophobicContact CB-CB 3.82Å
368	M	78.7	Confident	63.7	Low	76 Å²	76	114.4 Å²	114.4	37%	0.374	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.2	128.6	-176.7	-74.5	-68.5	-63.3	0	0	109.9	F370 R376 V377	M368-F370 HydrophobicContact CB-CD2 4.3Å; M368-F370 HydrophobicContact CB-CE2 3.51Å; M368-F370 HydrophobicContact CB-CZ 3.87Å; M368-F370 WeakPolarHBondContact O-CD2 3.37Å; M368-R376 WeakPolarHBondContact CA-O 3.16Å; M368-V377 HydrophobicContact SD-CB 4.28Å; M368-V377 HydrophobicContact SD-CG2 3.67Å
369	D	78.3	Confident	65.3	Low	23 Å²	23	111.7 Å²	111.7	12%	0.123	61%	0.61	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.9	126.5	175.9	-179.1	4.2	0	0	0	110	S371 T375 R376 I378	D369-S371 VanDerWaalsContact OD1-CB 3.23Å; D369-S371 WeakPolarHBondContact OD1-CB 3.14Å; D369-S371 PolarHBondContact OD1-N 3.06Å; D369-S371 PolarHBondContact OD1-OG 3.23Å; D369-S371 PolarHBondContact OD2-OG 3.24Å; D369-T375 WeakPolarHBondContact O-CA 3.38Å; D369-R376 HydrophobicContact CB-CG 3.69Å; D369-R376 PolarHBondContact N-O 2.74Å; D369-R376 PolarHBondContact O-N 3.02Å; D369-R376 IonicContact OD2-CZ 2.75Å; D369-R376 IonicContact OD2-NE 2.65Å; D369-R376 PolarHBondContact OD2-NE 2.62Å; D369-R376 IonicContact OD2-NH2 2.68Å; D369-R376 PolarHBondContact OD2-NH2 2.84Å; D369-I378 HydrophobicContact CB-CD1 4.03Å; D369-I378 HydrophobicContact CB-CG1 3.92Å
370	F	75.4	Confident	66.9	Low	150 Å²	150	110.3 Å²	110.3	66%	0.658	59%	0.594	S	S	*	*			trans	-116	9.1	179.3	-61.4	-92	0	0	0	112.6	M368 G372 T375	M368-F370 HydrophobicContact CB-CD2 4.3Å; M368-F370 HydrophobicContact CB-CE2 3.51Å; M368-F370 HydrophobicContact CB-CZ 3.87Å; M368-F370 WeakPolarHBondContact O-CD2 3.37Å; F370-G372 VanDerWaalsContact C-N 3.31Å; F370-G372 PolarHBondContact O-N 3.16Å; F370-T375 HydrophobicContact CD1-CG2 3.4Å; F370-T375 VanDerWaalsContact CD1-CG2 3.4Å; F370-T375 HydrophobicContact CE1-CG2 3.66Å; F370-T375 HydrophobicContact CG-CG2 4.3Å
371	S	68.1	Low	68.4	Low	108 Å²	108	108 Å²	108	76%	0.755	59%	0.589	S	S	*	*	S	Bend	trans	-73.1	-18.2	-174.7	64.6	0	0	0	0	114.5	D369	D369-S371 VanDerWaalsContact OD1-CB 3.23Å; D369-S371 WeakPolarHBondContact OD1-CB 3.14Å; D369-S371 PolarHBondContact OD1-N 3.06Å; D369-S371 PolarHBondContact OD1-OG 3.23Å; D369-S371 PolarHBondContact OD2-OG 3.24Å
372	G	69.6	Low	69.3	Low	46 Å²	46	107.2 Å²	107.2	47%	0.474	58%	0.583	S	S	.	*	S	Bend	trans	-116.8	173.6	-179.6	0	0	0	0	0	114.4	F370 K374	F370-G372 VanDerWaalsContact C-N 3.31Å; F370-G372 PolarHBondContact O-N 3.16Å; G372-K374 PolarHBondContact O-N 2.67Å
373	Q	66.1	Low	70.7	Confident	210 Å²	210	101.4 Å²	101.4	98%	0.981	56%	0.556	S	S	*	*	S	Bend	trans	-65	-7.4	-179.9	-72.5	-173.9	-16.7	0	0	115.2
374	K	61.3	Low	71.7	Confident	186 Å²	186	95.2 Å²	95.2	81%	0.809	53%	0.526	S	S	*	.	S	Bend	trans	-131.6	133.2	168.9	-74	-174	176.8	-179.3	0	108.9	G372	G372-K374 PolarHBondContact O-N 2.67Å
375	T	74.4	Confident	72.3	Confident	86 Å²	86	95.8 Å²	95.8	53%	0.528	52%	0.52	S	S	.	.			trans	-70	138.7	171.8	51.9	0	0	0	0	110.3	D369 F370	D369-T375 WeakPolarHBondContact O-CA 3.38Å; F370-T375 HydrophobicContact CD1-CG2 3.4Å; F370-T375 VanDerWaalsContact CD1-CG2 3.4Å; F370-T375 HydrophobicContact CE1-CG2 3.66Å; F370-T375 HydrophobicContact CG-CG2 4.3Å
376	R	84.7	Confident	72.5	Confident	104 Å²	104	91.5 Å²	91.5	39%	0.392	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152.5	174.6	64.8	173.4	-177.3	119	5.1	111.1	M368 D369 E383	M368-R376 WeakPolarHBondContact CA-O 3.16Å; D369-R376 HydrophobicContact CB-CG 3.69Å; D369-R376 PolarHBondContact N-O 2.74Å; D369-R376 PolarHBondContact O-N 3.02Å; D369-R376 IonicContact OD2-CZ 2.75Å; D369-R376 IonicContact OD2-NE 2.65Å; D369-R376 PolarHBondContact OD2-NE 2.62Å; D369-R376 IonicContact OD2-NH2 2.68Å; D369-R376 PolarHBondContact OD2-NH2 2.84Å; R376-E383 IonicContact CZ-OE1 3.25Å; R376-E383 IonicContact NH1-OE1 2.79Å; R376-E383 PolarHBondContact NH1-OE1 3.03Å; R376-E383 IonicContact NH1-OE2 2.8Å; R376-E383 IonicContact NH2-OE1 3.92Å; R376-E383 PolarHBondContact NH2-OE1 3.25Å
377	V	83.8	Confident	72.5	Confident	65 Å²	65	89.1 Å²	89.1	39%	0.394	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	136.8	165.8	-177.1	0	0	0	0	108.3	V366 M368 E379	V366-V377 HydrophobicContact CB-CG1 3.98Å; V366-V377 HydrophobicContact CG1-CG1 4.43Å; V366-V377 HydrophobicContact CG2-CG1 4.17Å; M368-V377 HydrophobicContact SD-CB 4.28Å; M368-V377 HydrophobicContact SD-CG2 3.67Å; V377-E379 HydrophobicContact CB-CG 4.48Å; V377-E379 HydrophobicContact CG1-CG 4.02Å
378	I	80.3	Confident	72.2	Confident	11 Å²	11	89.9 Å²	89.9	6%	0.056	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	95.4	168.9	-50.8	172.6	0	0	0	107.6	A367 D369 E383 A384 V387	A367-I378 HydrophobicContact CB-CB 4.1Å; A367-I378 HydrophobicContact CB-CD1 4.26Å; A367-I378 PolarHBondContact O-N 2.6Å; D369-I378 HydrophobicContact CB-CD1 4.03Å; D369-I378 HydrophobicContact CB-CG1 3.92Å; I378-E383 HydrophobicContact CG2-CB 3.81Å; I378-E383 HydrophobicContact CG2-CG 3.8Å; I378-A384 HydrophobicContact CB-CB 4.37Å; I378-A384 HydrophobicContact CG2-CB 3.89Å; I378-V387 HydrophobicContact CD1-CB 4.34Å; I378-V387 HydrophobicContact CD1-CG1 4.29Å; I378-V387 HydrophobicContact CD1-CG2 4.23Å
379	E	72.8	Confident	71.7	Confident	173 Å²	173	90.2 Å²	90.2	81%	0.808	50%	0.502	S	S	*	.			trans	-77	-22.4	-178.1	-62.9	-179	174.9	0	0	113.1	V377 P381	V377-E379 HydrophobicContact CB-CG 4.48Å; V377-E379 HydrophobicContact CG1-CG 4.02Å; E379-P381 WeakPolarHBondContact O-CD 3.49Å
380	N	71.3	Confident	71.4	Confident	79 Å²	79	95.9 Å²	95.9	42%	0.422	53%	0.528	S	S	.	.			trans	-85.9	115.8	-178.1	179.5	-11.6	0	0	0	111.2	S382 E383 A384	N380-S382 VanDerWaalsContact C-N 3.29Å; N380-S382 PolarHBondContact O-N 3.42Å; N380-S382 WeakPolarHBondContact OD1-CB 3.33Å; N380-S382 PolarHBondContact OD1-N 3.19Å; N380-E383 HydrophobicContact CB-CB 3.81Å; N380-E383 WeakPolarHBondContact O-CB 3.22Å; N380-E383 PolarHBondContact O-N 2.82Å; N380-E383 VanDerWaalsContact O-N 3.12Å; N380-A384 PolarHBondContact O-N 3.24Å
381	P	68.6	Low	71.1	Confident	104 Å²	104	93.6 Å²	93.6	68%	0.675	52%	0.519	S	S	*	.	H	α-helix	trans	-61.9	-32.2	-177.4	-24.3	35.2	0	0	0	114.2	E379 L385	E379-P381 WeakPolarHBondContact O-CD 3.49Å; P381-L385 WeakPolarHBondContact O-CB 3.36Å; P381-L385 PolarHBondContact O-N 3.33Å
382	S	61.9	Low	70.8	Confident	83 Å²	83	89.7 Å²	89.7	58%	0.58	50%	0.496	S	S	*	.	H	α-helix	trans	-72.7	-31.8	178.2	-57.6	0	0	0	0	112.1	N380 S386	N380-S382 VanDerWaalsContact C-N 3.29Å; N380-S382 PolarHBondContact O-N 3.42Å; N380-S382 WeakPolarHBondContact OD1-CB 3.33Å; N380-S382 PolarHBondContact OD1-N 3.19Å; S382-S386 WeakPolarHBondContact O-CB 3.37Å; S382-S386 PolarHBondContact O-N 3.27Å; S382-S386 VanDerWaalsContact O-N 3.11Å; S382-S386 PolarHBondContact O-OG 3.19Å
383	E	74.6	Confident	70.3	Confident	61 Å²	61	91.8 Å²	91.8	29%	0.285	50%	0.496	S	S	.	.	H	α-helix	trans	-72.4	-47.8	173.6	-171.2	-174.9	169.7	0	0	110	R376 I378 N380 L385 S386 V387	R376-E383 IonicContact CZ-OE1 3.25Å; R376-E383 IonicContact NH1-OE1 2.79Å; R376-E383 PolarHBondContact NH1-OE1 3.03Å; R376-E383 IonicContact NH1-OE2 2.8Å; R376-E383 IonicContact NH2-OE1 3.92Å; R376-E383 PolarHBondContact NH2-OE1 3.25Å; I378-E383 HydrophobicContact CG2-CB 3.81Å; I378-E383 HydrophobicContact CG2-CG 3.8Å; N380-E383 HydrophobicContact CB-CB 3.81Å; N380-E383 WeakPolarHBondContact O-CB 3.22Å; N380-E383 PolarHBondContact O-N 2.82Å; N380-E383 VanDerWaalsContact O-N 3.12Å; E383-L385 VanDerWaalsContact C-N 3.3Å; E383-L385 PolarHBondContact O-N 2.63Å; E383-S386 WeakPolarHBondContact O-CB 3.43Å; E383-S386 PolarHBondContact O-N 3.29Å; E383-S386 VanDerWaalsContact O-N 3.08Å; E383-V387 WeakPolarHBondContact O-CG2 3.49Å; E383-V387 PolarHBondContact O-N 3.41Å
384	A	72.3	Confident	70	Confident	21 Å²	21	83.3 Å²	83.3	17%	0.174	46%	0.46	C	S	.	.	H	α-helix	trans	-58.6	-40.7	176.8	0	0	0	0	0	112.1	A367 I378 N380 A388	A367-A384 HydrophobicContact CB-CB 3.82Å; I378-A384 HydrophobicContact CB-CB 4.37Å; I378-A384 HydrophobicContact CG2-CB 3.89Å; N380-A384 PolarHBondContact O-N 3.24Å; A384-A388 VanDerWaalsContact O-CB 3.27Å; A384-A388 WeakPolarHBondContact O-CB 3.33Å; A384-A388 PolarHBondContact O-N 2.67Å
385	L	64.8	Low	69.4	Low	117 Å²	117	81.9 Å²	81.9	61%	0.613	45%	0.449	S	S	*	.	H	α-helix	trans	-64.8	-43.1	173.8	-177.8	63	0	0	0	112.1	P381 E383 A388 V389	P381-L385 WeakPolarHBondContact O-CB 3.36Å; P381-L385 PolarHBondContact O-N 3.33Å; E383-L385 VanDerWaalsContact C-N 3.3Å; E383-L385 PolarHBondContact O-N 2.63Å; L385-A388 PolarHBondContact O-N 3.46Å; L385-V389 HydrophobicContact CD1-CG2 4.38Å; L385-V389 WeakPolarHBondContact O-CB 3.24Å; L385-V389 VanDerWaalsContact O-CG2 3.3Å; L385-V389 WeakPolarHBondContact O-CG2 3.22Å; L385-V389 PolarHBondContact O-N 2.9Å
386	S	68.5	Low	68.7	Low	77 Å²	77	86.7 Å²	86.7	54%	0.538	46%	0.458	S	S	.	.	H	α-helix	trans	-61.5	-47.8	177.6	-59.4	0	0	0	0	111.6	S382 E383 V389 E390	S382-S386 WeakPolarHBondContact O-CB 3.37Å; S382-S386 PolarHBondContact O-N 3.27Å; S382-S386 VanDerWaalsContact O-N 3.11Å; S382-S386 PolarHBondContact O-OG 3.19Å; E383-S386 WeakPolarHBondContact O-CB 3.43Å; E383-S386 PolarHBondContact O-N 3.29Å; E383-S386 VanDerWaalsContact O-N 3.08Å; S386-V389 PolarHBondContact O-N 3.34Å; S386-E390 PolarHBondContact O-N 3.05Å
387	V	71.1	Confident	67.3	Low	52 Å²	52	89.2 Å²	89.2	32%	0.315	47%	0.472	S	S	.	.	H	α-helix	trans	-62	-43.5	176.6	173.1	0	0	0	0	111.1	I378 E383 V389 E390 E391	I378-V387 HydrophobicContact CD1-CB 4.34Å; I378-V387 HydrophobicContact CD1-CG1 4.29Å; I378-V387 HydrophobicContact CD1-CG2 4.23Å; E383-V387 WeakPolarHBondContact O-CG2 3.49Å; E383-V387 PolarHBondContact O-N 3.41Å; V387-V389 VanDerWaalsContact C-N 3.34Å; V387-V389 PolarHBondContact O-N 3.42Å; V387-E390 PolarHBondContact O-N 2.75Å; V387-E391 VanDerWaalsContact O-CB 3.25Å; V387-E391 WeakPolarHBondContact O-CB 3.41Å; V387-E391 PolarHBondContact O-N 2.98Å
388	A	70.3	Confident	65.6	Low	56 Å²	56	91.9 Å²	91.9	46%	0.463	48%	0.478	S	S	.	.	H	α-helix	trans	-65.3	-34.4	177.3	0	0	0	0	0	113.1	A384 L385 G392	A384-A388 VanDerWaalsContact O-CB 3.27Å; A384-A388 WeakPolarHBondContact O-CB 3.33Å; A384-A388 PolarHBondContact O-N 2.67Å; L385-A388 PolarHBondContact O-N 3.46Å; A388-G392 PolarHBondContact O-N 3.32Å
389	V	68.4	Low	63.6	Low	82 Å²	82	95.3 Å²	95.3	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-70.2	-46.9	174.4	167.9	0	0	0	0	111	L385 S386 V387 G392 L393	L385-V389 HydrophobicContact CD1-CG2 4.38Å; L385-V389 WeakPolarHBondContact O-CB 3.24Å; L385-V389 VanDerWaalsContact O-CG2 3.3Å; L385-V389 WeakPolarHBondContact O-CG2 3.22Å; L385-V389 PolarHBondContact O-N 2.9Å; S386-V389 PolarHBondContact O-N 3.34Å; V387-V389 VanDerWaalsContact C-N 3.34Å; V387-V389 PolarHBondContact O-N 3.42Å; V389-G392 PolarHBondContact O-N 3.2Å; V389-L393 HydrophobicContact CG1-CD1 4.14Å; V389-L393 VanDerWaalsContact O-CG 3.29Å; V389-L393 WeakPolarHBondContact O-CG 3.46Å; V389-L393 PolarHBondContact O-N 2.88Å
390	E	70.5	Confident	62.2	Low	143 Å²	143	91.6 Å²	91.6	67%	0.668	50%	0.495	S	S	*	.	H	α-helix	trans	-62.5	-45.2	176.8	-174.6	176.3	178	0	0	111.5	S386 V387 L393 S394	S386-E390 PolarHBondContact O-N 3.05Å; V387-E390 PolarHBondContact O-N 2.75Å; E390-L393 PolarHBondContact O-N 3.22Å; E390-S394 PolarHBondContact O-N 2.71Å
391	E	70.2	Confident	60.8	Low	101 Å²	101	95.1 Å²	95.1	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-60	-49.3	174.7	179.9	165	-156.4	0	0	110.6	V387 L393 S394 W395	V387-E391 VanDerWaalsContact O-CB 3.25Å; V387-E391 WeakPolarHBondContact O-CB 3.41Å; V387-E391 PolarHBondContact O-N 2.98Å; E391-L393 PolarHBondContact O-N 2.74Å; E391-S394 CarbonylContact O-C 3.49Å; E391-S394 WeakPolarHBondContact O-CA 3.25Å; E391-S394 WeakPolarHBondContact O-CB 3.25Å; E391-S394 PolarHBondContact O-N 2.8Å; E391-S394 PolarHBondContact O-OG 3.43Å; E391-W395 VanDerWaalsContact O-CD1 3.31Å; E391-W395 PolarHBondContact O-N 3.39Å; E391-W395 PolarHBondContact OE1-NE1 2.91Å
392	G	61.9	Low	59.5	Low	26 Å²	26	99.6 Å²	99.6	27%	0.268	51%	0.512	S	S	.	.	H	α-helix	trans	-63.4	-24	178.3	0	0	0	0	0	114.7	A388 V389 R396	A388-G392 PolarHBondContact O-N 3.32Å; V389-G392 PolarHBondContact O-N 3.2Å; G392-R396 PolarHBondContact O-N 3.18Å; G392-R396 PolarHBondContact O-NE 3.26Å
393	L	59.3	Low	58.3	Low	91 Å²	91	103.8 Å²	103.8	48%	0.476	53%	0.527	S	S	.	.	H	α-helix	trans	-75.9	-41.4	166.7	-70.5	168	0	0	0	111	V389 E390 E391 R396 K397	V389-L393 HydrophobicContact CG1-CD1 4.14Å; V389-L393 VanDerWaalsContact O-CG 3.29Å; V389-L393 WeakPolarHBondContact O-CG 3.46Å; V389-L393 PolarHBondContact O-N 2.88Å; E390-L393 PolarHBondContact O-N 3.22Å; E391-L393 PolarHBondContact O-N 2.74Å; L393-R396 PolarHBondContact O-N 2.88Å; L393-K397 WeakPolarHBondContact O-CG 3.45Å; L393-K397 PolarHBondContact O-N 3.25Å
394	S	59.9	Low	56.4	Low	32 Å²	32	106.7 Å²	106.7	22%	0.224	55%	0.554	C	S	.	*	H	α-helix	trans	-64.7	-38.2	176.4	99.3	0	0	0	0	112.9	E390 E391 K397 K398	E390-S394 PolarHBondContact O-N 2.71Å; E391-S394 CarbonylContact O-C 3.49Å; E391-S394 WeakPolarHBondContact O-CA 3.25Å; E391-S394 WeakPolarHBondContact O-CB 3.25Å; E391-S394 PolarHBondContact O-N 2.8Å; E391-S394 PolarHBondContact O-OG 3.43Å; S394-K397 PolarHBondContact O-N 2.79Å; S394-K398 WeakPolarHBondContact O-CB 3.4Å; S394-K398 WeakPolarHBondContact O-CD 3.41Å; S394-K398 VanDerWaalsContact O-CG 3.23Å; S394-K398 WeakPolarHBondContact O-CG 3.25Å; S394-K398 PolarHBondContact O-N 2.81Å; S394-K398 PolarHBondContact OG-NZ 3.35Å
395	W	48.4	Very low	54.6	Low	155 Å²	155	109 Å²	109	59%	0.587	58%	0.581	S	S	*	*	H	α-helix	trans	-67.8	-40.4	176.3	-84.5	76.6	0	0	0	111.2	E391 K398 S399	E391-W395 VanDerWaalsContact O-CD1 3.31Å; E391-W395 PolarHBondContact O-N 3.39Å; E391-W395 PolarHBondContact OE1-NE1 2.91Å; W395-K398 PolarHBondContact O-N 2.92Å; W395-K398 VanDerWaalsContact O-N 3.11Å; W395-S399 WeakPolarHBondContact O-CB 3.36Å; W395-S399 PolarHBondContact O-N 2.79Å
396	R	59.3	Low	53.3	Low	187 Å²	187	113.2 Å²	113.2	71%	0.706	60%	0.596	S	S	*	*	H	α-helix	trans	-62.6	-41.1	171.9	-85.3	-176.9	-82	-157.5	-2.4	112.4	G392 L393 K398	G392-R396 PolarHBondContact O-N 3.18Å; G392-R396 PolarHBondContact O-NE 3.26Å; L393-R396 PolarHBondContact O-N 2.88Å; R396-K398 VanDerWaalsContact C-N 3.26Å; R396-K398 PolarHBondContact O-N 3.26Å
397	K	54.2	Low	51.4	Low	158 Å²	158	113.2 Å²	113.2	69%	0.687	61%	0.609	S	S	*	*	H	α-helix	trans	-62.1	-27.2	171.3	-71.6	174.8	179.3	-180	0	113.7	L393 S394 C400	L393-K397 WeakPolarHBondContact O-CG 3.45Å; L393-K397 PolarHBondContact O-N 3.25Å; S394-K397 PolarHBondContact O-N 2.79Å; K397-C400 PolarHBondContact O-SG 2.94Å; K397-C400 VanDerWaalsContact O-SG 3.34Å
398	K	48.3	Very low	49.5	Very low	120 Å²	120	116.5 Å²	116.5	52%	0.522	63%	0.634	S	S	.	*	H	α-helix	trans	-92	-28.2	-179.7	-70.5	161.7	-174.4	161.2	0	113.6	S394 W395 R396 C400 H401	S394-K398 WeakPolarHBondContact O-CB 3.4Å; S394-K398 WeakPolarHBondContact O-CD 3.41Å; S394-K398 VanDerWaalsContact O-CG 3.23Å; S394-K398 WeakPolarHBondContact O-CG 3.25Å; S394-K398 PolarHBondContact O-N 2.81Å; S394-K398 PolarHBondContact OG-NZ 3.35Å; W395-K398 PolarHBondContact O-N 2.92Å; W395-K398 VanDerWaalsContact O-N 3.11Å; R396-K398 VanDerWaalsContact C-N 3.26Å; R396-K398 PolarHBondContact O-N 3.26Å; K398-C400 PolarHBondContact O-N 3.3Å; K398-H401 PolarHBondContact O-N 3.43Å
399	S	38.2	Very low	48.3	Very low	84 Å²	84	120 Å²	120	59%	0.587	65%	0.652	S	S	*	*	H	α-helix	trans	-74.6	-25.1	-170.7	-163	0	0	0	0	114	W395 H401	W395-S399 WeakPolarHBondContact O-CB 3.36Å; W395-S399 PolarHBondContact O-N 2.79Å; S399-H401 PolarHBondContact O-N 2.98Å
400	C	45	Very low	46.5	Very low	95 Å²	95	121.2 Å²	121.2	64%	0.642	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-10	175.7	46.9	0	0	0	0	114.1	K397 K398	K397-C400 PolarHBondContact O-SG 2.94Å; K397-C400 VanDerWaalsContact O-SG 3.34Å; K398-C400 PolarHBondContact O-N 3.3Å
401	H	41.1	Very low	44.8	Very low	153 Å²	153	119.3 Å²	119.3	71%	0.708	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-1.1	-179.8	-65.4	-64.4	0	0	0	115.2	K398 S399	K398-H401 PolarHBondContact O-N 3.43Å; S399-H401 PolarHBondContact O-N 2.98Å
402	R	40.4	Very low	43.4	Very low	198 Å²	198	120.7 Å²	120.7	75%	0.747	68%	0.682	S	S	*	*			trans	-104.4	21	-173.6	-80.1	-161.9	-112.4	-141.8	2.4	116.4
403	L	37.5	Very low	42	Very low	170 Å²	170	128.6 Å²	128.6	89%	0.89	71%	0.712	S	S	*	*			trans	-120.6	59.7	172.5	-70.2	177.2	0	0	0	112.7
404	S	34.6	Very low	41	Very low	123 Å²	123	130.6 Å²	130.6	86%	0.86	73%	0.733	S	S	*	*			trans	-149.5	105.8	161.1	-89.3	0	0	0	0	109
405	G	33.8	Very low	39.6	Very low	70 Å²	70	134 Å²	134	72%	0.722	76%	0.757	S	S	*	*			trans	-97.5	134.4	-177.1	0	0	0	0	0	113.3
406	H	37.9	Very low	39.1	Very low	204 Å²	204	132.8 Å²	132.8	94%	0.944	77%	0.767	S	S	*	*			trans	53.2	98.6	158.9	-60.8	-74	0	0	0	119.3
407	G	29	Very low	38	Very low	77 Å²	77	129.5 Å²	129.5	79%	0.794	77%	0.77	S	S	*	*			trans	-144.9	128.4	151.5	0	0	0	0	0	109.6
408	S	31.3	Very low	37.5	Very low	121 Å²	121	129.4 Å²	129.4	85%	0.846	78%	0.777	S	S	*	*			trans	-78.3	152	-179.3	-65.9	0	0	0	0	112
409	P	45.8	Very low	37.3	Very low	131 Å²	131	130.9 Å²	130.9	85%	0.851	79%	0.789	S	S	*	*			trans	-86.1	146.6	-167.3	33.4	-36.1	0	0	0	114.2
410	S	30.8	Very low	37.7	Very low	107 Å²	107	130.6 Å²	130.6	75%	0.748	79%	0.792	S	S	*	*			trans	-141.6	104.6	167.3	59.9	0	0	0	0	112.2
411	S	33.7	Very low	38.7	Very low	102 Å²	102	127.6 Å²	127.6	71%	0.713	77%	0.774	S	S	*	*			trans	44.6	117.8	152.6	58.4	0	0	0	0	121.3
412	T	40.7	Very low	40.2	Very low	131 Å²	131	124.6 Å²	124.6	80%	0.804	76%	0.763	S	S	*	*			trans	60.8	89.6	138.7	58.8	0	0	0	0	119.6
413	Q	33.8	Very low	42.1	Very low	192 Å²	192	116.4 Å²	116.4	90%	0.897	73%	0.733	S	S	*	*				-149.4	145.6	125.2	-109.5	166.6	50.2	0	0	109	S415	Q413-S415 PolarHBondContact O-N 3.34Å; Q413-S415 VanDerWaalsContact O-N 3.14Å
414	S	38.3	Very low	44.2	Very low	132 Å²	132	113.7 Å²	113.7	92%	0.923	72%	0.719	S	S	*	*			trans	-81.2	91.6	-177.3	54.8	0	0	0	0	111
415	S	30.4	Very low	46.3	Very low	103 Å²	103	112 Å²	112	72%	0.72	71%	0.711	S	S	*	*			trans	-109	116.3	169.1	43.4	0	0	0	0	110.3	Q413	Q413-S415 PolarHBondContact O-N 3.34Å; Q413-S415 VanDerWaalsContact O-N 3.14Å
416	V	36.9	Very low	48.8	Very low	131 Å²	131	111.1 Å²	111.1	79%	0.794	69%	0.689	S	S	*	*			trans	-57.4	131.2	164.9	-169.3	0	0	0	0	107.1	N418	V416-N418 PolarHBondContact O-N 3.39Å
417	P	36.9	Very low	50.8	Low	117 Å²	117	104.1 Å²	104.1	76%	0.76	66%	0.661	S	S	*	*			trans	-63.7	115.2	-177.3	24.8	-33.5	0	0	0	109.5	L419	P417-L419 PolarHBondContact O-N 3.11Å
418	N	43.4	Very low	53.8	Low	157 Å²	157	101 Å²	101	84%	0.84	63%	0.625	S	S	*	*			trans	-55.1	108.9	-179.4	-91.5	-49	0	0	0	110.8	V416 A420	V416-N418 PolarHBondContact O-N 3.39Å; N418-A420 HydrophobicContact CB-CB 4.31Å; N418-A420 PolarHBondContact O-N 2.84Å
419	L	44.1	Very low	56.8	Low	150 Å²	150	96.2 Å²	96.2	79%	0.785	59%	0.589	S	S	*	*			trans	-72.3	64.7	165.1	-170.9	68.3	0	0	0	108.6	P417 A421 I422	P417-L419 PolarHBondContact O-N 3.11Å; L419-A421 PolarHBondContact O-N 2.98Å; L419-I422 HydrophobicContact CD1-CD1 4.13Å; L419-I422 HydrophobicContact CD2-CD1 4.47Å; L419-I422 HydrophobicContact CG-CD1 4.17Å
420	A	45.9	Very low	58.9	Low	78 Å²	78	91.4 Å²	91.4	65%	0.645	56%	0.556	S	S	*	*			trans	-67.3	91.1	-158.5	0	0	0	0	0	112.8	N418 I422	N418-A420 HydrophobicContact CB-CB 4.31Å; N418-A420 PolarHBondContact O-N 2.84Å; A420-I422 PolarHBondContact O-N 3.23Å
421	A	65.4	Low	61.7	Low	32 Å²	32	87 Å²	87	26%	0.264	53%	0.528	S	S	.	.			trans	53.7	61	157.5	0	0	0	0	0	114.5	L419 H423 L424	L419-A421 PolarHBondContact O-N 2.98Å; A421-H423 PolarHBondContact O-N 3.06Å; A421-L424 HydrophobicContact CB-CD1 3.71Å; A421-L424 HydrophobicContact CB-CG 3.7Å; A421-L424 VanDerWaalsContact O-CB 3.31Å; A421-L424 WeakPolarHBondContact O-CB 3.38Å; A421-L424 VanDerWaalsContact O-CG 3.31Å; A421-L424 WeakPolarHBondContact O-CG 3.29Å; A421-L424 PolarHBondContact O-N 2.9Å
422	I	73.9	Confident	64.4	Low	91 Å²	91	91 Å²	91	47%	0.467	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-53.9	-25.7	174.1	-56.2	171.5	0	0	0	111.7	L419 A420 L424 A425 I503	L419-I422 HydrophobicContact CD1-CD1 4.13Å; L419-I422 HydrophobicContact CD2-CD1 4.47Å; L419-I422 HydrophobicContact CG-CD1 4.17Å; A420-I422 PolarHBondContact O-N 3.23Å; I422-L424 PolarHBondContact O-N 3.11Å; I422-A425 PolarHBondContact O-N 2.75Å; I422-I503 HydrophobicContact CB-CD1 4.14Å; I422-I503 HydrophobicContact CG2-CD1 3.76Å
423	H	78.9	Confident	66.9	Low	25 Å²	25	85.5 Å²	85.5	12%	0.116	50%	0.497	C	S	.	.	G	3₁₀ helix	trans	-60.1	-24.6	172.6	62.2	-108.9	0	0	0	114.3	A421 A425 Q426 W428 F429 F464 L502	A421-H423 PolarHBondContact O-N 3.06Å; H423-A425 PolarHBondContact O-N 2.87Å; H423-Q426 VanDerWaalsContact O-CB 3.3Å; H423-Q426 WeakPolarHBondContact O-CB 3.39Å; H423-Q426 PolarHBondContact O-N 3.04Å; H423-Q426 VanDerWaalsContact O-N 3.09Å; H423-W428 HydrophobicContact CB-CH2 3.99Å; H423-W428 HydrophobicContact CB-CZ3 4.36Å; H423-F429 AromaticContact CD2-CE2 3.8Å; H423-F429 AromaticContact CD2-CZ 3.86Å; H423-F429 VanDerWaalsContact O-CB 3.23Å; H423-F429 WeakPolarHBondContact O-CB 3.23Å; H423-F464 AromaticContact CE1-CZ 3.96Å; H423-F464 AromaticContact NE2-CZ 3.84Å; H423-L502 HydrophobicContact CB-CB 4.17Å; H423-L502 HydrophobicContact CB-CD1 4.16Å
424	L	82.3	Confident	69.7	Low	114 Å²	114	77.1 Å²	77.1	60%	0.597	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-64.1	-23.2	175.9	-62.3	178	0	0	0	113.1	A421 I422 Q426 F429	A421-L424 HydrophobicContact CB-CD1 3.71Å; A421-L424 HydrophobicContact CB-CG 3.7Å; A421-L424 VanDerWaalsContact O-CB 3.31Å; A421-L424 WeakPolarHBondContact O-CB 3.38Å; A421-L424 VanDerWaalsContact O-CG 3.31Å; A421-L424 WeakPolarHBondContact O-CG 3.29Å; A421-L424 PolarHBondContact O-N 2.9Å; I422-L424 PolarHBondContact O-N 3.11Å; L424-Q426 VanDerWaalsContact C-N 3.33Å; L424-F429 HydrophobicContact CD2-CD1 3.99Å; L424-F429 HydrophobicContact CD2-CE1 3.46Å; L424-F429 VanDerWaalsContact CD2-CE1 3.46Å; L424-F429 HydrophobicContact CD2-CZ 4.22Å
425	A	79.4	Confident	72.4	Confident	86 Å²	86	76.8 Å²	76.8	71%	0.711	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-90	3.9	177.2	0	0	0	0	0	113.1	I422 H423	I422-A425 PolarHBondContact O-N 2.75Å; H423-A425 PolarHBondContact O-N 2.87Å
426	Q	85.1	Confident	75.4	Confident	53 Å²	53	77.4 Å²	77.4	25%	0.248	43%	0.43	C	S	.	.			trans	-91.3	133.7	-175	-62.3	-67	-36.6	0	0	111.3	H423 L424 W428 F429 I503	H423-Q426 VanDerWaalsContact O-CB 3.3Å; H423-Q426 WeakPolarHBondContact O-CB 3.39Å; H423-Q426 PolarHBondContact O-N 3.04Å; H423-Q426 VanDerWaalsContact O-N 3.09Å; L424-Q426 VanDerWaalsContact C-N 3.33Å; Q426-W428 HydrophobicContact CB-CD2 3.74Å; Q426-W428 VanDerWaalsContact CB-CE2 3.45Å; Q426-W428 HydrophobicContact CB-CE3 4.18Å; Q426-W428 HydrophobicContact CB-CG 4.2Å; Q426-W428 HydrophobicContact CB-CH2 4.16Å; Q426-W428 HydrophobicContact CB-CZ2 3.72Å; Q426-W428 HydrophobicContact CB-CZ3 4.36Å; Q426-W428 HydrophobicContact CG-CD2 4.5Å; Q426-W428 HydrophobicContact CG-CH2 4.06Å; Q426-W428 HydrophobicContact CG-CZ2 3.53Å; Q426-W428 PolarHBondContact O-N 3.23Å; Q426-F429 HydrophobicContact CB-CB 4.4Å; Q426-F429 PolarHBondContact O-N 3.25Å; Q426-I503 HydrophobicContact CG-CD1 4.42Å; Q426-I503 HydrophobicContact CG-CG1 4.37Å
427	P	81.9	Confident	77.9	Confident	56 Å²	56	76 Å²	76	36%	0.364	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.4	-176.5	29.7	-37.1	0	0	0	113.6	H523 I525	P427-H523 WeakPolarHBondContact CG-NE2 3.46Å; P427-I525 HydrophobicContact CB-CD1 4.14Å; P427-I525 HydrophobicContact CB-CG1 4.24Å
428	W	91.7	Very high	80.6	Confident	11 Å²	11	70.4 Å²	70.4	4%	0.042	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-3.9	174.3	50.3	-106.8	0	0	0	114.2	H423 Q426 F452 L454 L502 I503 V506 H523	H423-W428 HydrophobicContact CB-CH2 3.99Å; H423-W428 HydrophobicContact CB-CZ3 4.36Å; Q426-W428 HydrophobicContact CB-CD2 3.74Å; Q426-W428 VanDerWaalsContact CB-CE2 3.45Å; Q426-W428 HydrophobicContact CB-CE3 4.18Å; Q426-W428 HydrophobicContact CB-CG 4.2Å; Q426-W428 HydrophobicContact CB-CH2 4.16Å; Q426-W428 HydrophobicContact CB-CZ2 3.72Å; Q426-W428 HydrophobicContact CB-CZ3 4.36Å; Q426-W428 HydrophobicContact CG-CD2 4.5Å; Q426-W428 HydrophobicContact CG-CH2 4.06Å; Q426-W428 HydrophobicContact CG-CZ2 3.53Å; Q426-W428 PolarHBondContact O-N 3.23Å; W428-F452 HydrophobicContact CB-CE2 3.85Å; W428-F452 HydrophobicContact CB-CZ 4.07Å; W428-F452 HydrophobicContact CG-CE2 4.26Å; W428-F452 HydrophobicContact CG-CZ 4.41Å; W428-L454 HydrophobicContact CE3-CB 4.03Å; W428-L454 HydrophobicContact CE3-CD1 4.09Å; W428-L454 HydrophobicContact CE3-CD2 4.2Å; W428-L454 HydrophobicContact CE3-CG 4.33Å; W428-L454 HydrophobicContact CZ3-CB 4.17Å; W428-L454 HydrophobicContact CZ3-CD1 4.46Å; W428-L454 HydrophobicContact CZ3-CD2 3.74Å; W428-L454 HydrophobicContact CZ3-CG 4.34Å; W428-L454 PolarHBondContact O-N 3.06Å; W428-L502 HydrophobicContact CH2-CB 3.84Å; W428-L502 WeakPolarHBondContact CH2-O 3.47Å; W428-L502 HydrophobicContact CZ3-CB 4.23Å; W428-I503 HydrophobicContact CH2-CG1 4.25Å; W428-I503 HydrophobicContact CZ2-CB 4.29Å; W428-I503 HydrophobicContact CZ2-CG1 4Å; W428-I503 HydrophobicContact CZ2-CG2 4.44Å; W428-V506 HydrophobicContact CD2-CG1 4.38Å; W428-V506 HydrophobicContact CD2-CG2 4.14Å; W428-V506 HydrophobicContact CE3-CG2 4.13Å; W428-V506 HydrophobicContact CG-CG1 4.49Å; W428-V506 HydrophobicContact CH2-CG2 4.03Å; W428-V506 HydrophobicContact CZ2-CB 4.13Å; W428-V506 HydrophobicContact CZ2-CG1 4.44Å; W428-V506 HydrophobicContact CZ2-CG2 4.02Å; W428-V506 HydrophobicContact CZ3-CG2 4.1Å; W428-H523 HydrophobicContact CB-CB 3.48Å; W428-H523 VanDerWaalsContact CB-CB 3.48Å
429	F	93	Very high	83	Confident	21 Å²	21	66 Å²	66	9%	0.092	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-105.5	123.3	-179.1	-171.8	-92.6	0	0	0	111.5	H423 L424 Q426 G431 L454 F464 L502	H423-F429 AromaticContact CD2-CE2 3.8Å; H423-F429 AromaticContact CD2-CZ 3.86Å; H423-F429 VanDerWaalsContact O-CB 3.23Å; H423-F429 WeakPolarHBondContact O-CB 3.23Å; L424-F429 HydrophobicContact CD2-CD1 3.99Å; L424-F429 HydrophobicContact CD2-CE1 3.46Å; L424-F429 VanDerWaalsContact CD2-CE1 3.46Å; L424-F429 HydrophobicContact CD2-CZ 4.22Å; Q426-F429 HydrophobicContact CB-CB 4.4Å; Q426-F429 PolarHBondContact O-N 3.25Å; F429-G431 VanDerWaalsContact CE1-N 3.3Å; F429-L454 WeakPolarHBondContact CA-O 3.33Å; F429-L454 HydrophobicContact CD2-CB 4.02Å; F429-F464 AromaticContact CE2-CD1 3.79Å; F429-F464 HydrophobicContact CE2-CD1 3.79Å; F429-F464 AromaticContact CE2-CE1 3.9Å; F429-F464 HydrophobicContact CE2-CE1 3.9Å; F429-F464 HydrophobicContact CZ-CD1 4.16Å; F429-F464 AromaticContact CZ-CE1 3.94Å; F429-F464 HydrophobicContact CZ-CE1 3.94Å; F429-L502 HydrophobicContact CD2-CD1 4.45Å; F429-L502 HydrophobicContact CE2-CD1 4.22Å
430	H	90.9	Very high	85	Confident	31 Å²	31	63.6 Å²	63.6	14%	0.144	34%	0.338	C	S	.	.			trans	-113.3	7.8	-171	-69.6	-120.3	0	0	0	113.3	K432 L433 L441 L453 L454 C524	H430-K432 PolarHBondContact O-N 3.48Å; H430-L433 HydrophobicContact CB-CB 4Å; H430-L433 HydrophobicContact CB-CD2 3.81Å; H430-L433 HydrophobicContact CB-CG 4.43Å; H430-L441 WeakPolarHBondContact ND1-CD1 3.28Å; H430-L453 HydrophobicContact CB-CD1 4.48Å; H430-L454 PolarHBondContact N-O 2.69Å; H430-C524 PolarHBondContact CE1-O 3.17Å; H430-C524 PolarHBondContact NE2-O 3.24Å
431	G	90	Very high	87	Confident	15 Å²	15	60.3 Å²	60.3	16%	0.155	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	-129.9	177.5	0	0	0	0	0	112.9	F429 L433 R455 D456	F429-G431 VanDerWaalsContact CE1-N 3.3Å; G431-L433 PolarHBondContact O-N 2.85Å; G431-R455 CarbonylContact O-C 3.46Å; G431-R455 WeakPolarHBondContact O-CA 3.31Å; G431-R455 WeakPolarHBondContact O-CB 3.1Å; G431-D456 PolarHBondContact O-N 2.84Å
432	K	89.8	Confident	88.1	Confident	185 Å²	185	58.8 Å²	58.8	80%	0.804	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	26.4	-171.9	-64.3	-177.1	178.5	177.2	0	115.6	H430 D456	H430-K432 PolarHBondContact O-N 3.48Å; K432-D456 WeakPolarHBondContact CG-OD2 3.24Å; K432-D456 PolarHBondContact N-OD2 3.32Å
433	L	92.3	Very high	88.5	Confident	15 Å²	15	57.7 Å²	57.7	8%	0.079	29%	0.294	C	S	.	.			trans	-61.8	134.2	176.2	-164	72.8	0	0	0	111.1	H430 G431 E437 A438 L441 L453 R455	H430-L433 HydrophobicContact CB-CB 4Å; H430-L433 HydrophobicContact CB-CD2 3.81Å; H430-L433 HydrophobicContact CB-CG 4.43Å; G431-L433 PolarHBondContact O-N 2.85Å; L433-E437 HydrophobicContact CD1-CB 3.55Å; L433-E437 HydrophobicContact CD1-CG 4.41Å; L433-E437 HydrophobicContact CG-CB 3.88Å; L433-A438 HydrophobicContact CD2-CB 3.82Å; L433-A438 HydrophobicContact CG-CB 4.44Å; L433-L441 HydrophobicContact CD1-CD1 4.3Å; L433-L441 HydrophobicContact CD2-CD1 3.7Å; L433-L453 HydrophobicContact CD2-CD1 3.89Å; L433-L453 HydrophobicContact CD2-CD2 3.9Å; L433-R455 HydrophobicContact CB-CB 4.04Å; L433-R455 WeakPolarHBondContact O-CD 3.3Å; L433-R455 PolarHBondContact O-NH1 3.48Å
434	S	93.6	Very high	88.3	Confident	17 Å²	17	57.3 Å²	57.3	12%	0.119	29%	0.292	C	S	.	.			trans	-70.3	171	175.4	67.7	0	0	0	0	113.1	E436 E437 A438 R455	S434-E436 VanDerWaalsContact C-N 3.28Å; S434-E437 WeakPolarHBondContact CA-OE2 3.35Å; S434-E437 WeakPolarHBondContact CB-OE2 3.48Å; S434-E437 PolarHBondContact N-OE2 2.66Å; S434-E437 WeakPolarHBondContact OG-CB 3.34Å; S434-E437 WeakPolarHBondContact OG-CG 3.49Å; S434-E437 PolarHBondContact OG-N 3.01Å; S434-E437 PolarHBondContact OG-OE2 3.06Å; S434-A438 WeakPolarHBondContact O-CB 3.4Å; S434-A438 PolarHBondContact O-N 2.98Å; S434-A438 VanDerWaalsContact O-N 3.09Å; S434-R455 VanDerWaalsContact C-NH1 3.3Å
435	R	94.4	Very high	88	Confident	124 Å²	124	52.2 Å²	52.2	47%	0.468	27%	0.266	S	S	.	.	H	α-helix	trans	-66	-37.9	173.7	-178.5	-171.2	-175.2	173.3	-0.4	110.9	Q439 H476	R435-Q439 WeakPolarHBondContact O-CG 3.29Å; R435-Q439 PolarHBondContact O-N 3.23Å; R435-H476 WeakPolarHBondContact CG-NE2 3.43Å; R435-H476 PolarHBondContact NE-CD2 3.25Å; R435-H476 VanDerWaalsContact NE-CD2 3.29Å; R435-H476 PolarHBondContact NE-NE2 3.41Å
436	E	93.5	Very high	87.5	Confident	116 Å²	116	49.8 Å²	49.8	54%	0.542	25%	0.249	S	C	.	.	H	α-helix	trans	-75.3	-43.2	-174.2	-67	59.9	-133.2	0	0	110.6	S434 Q439 H440	S434-E436 VanDerWaalsContact C-N 3.28Å; E436-Q439 WeakPolarHBondContact O-CB 3.47Å; E436-Q439 PolarHBondContact O-N 2.99Å; E436-H440 PolarHBondContact O-N 3.41Å
437	E	90.4	Very high	87.1	Confident	101 Å²	101	48.9 Å²	48.9	47%	0.472	25%	0.245	S	C	.	.	H	α-helix	trans	-64.3	-41.1	171.1	-66.9	158.1	137	0	0	111.3	L433 S434 Q439 H440 L441	L433-E437 HydrophobicContact CD1-CB 3.55Å; L433-E437 HydrophobicContact CD1-CG 4.41Å; L433-E437 HydrophobicContact CG-CB 3.88Å; S434-E437 WeakPolarHBondContact CA-OE2 3.35Å; S434-E437 WeakPolarHBondContact CB-OE2 3.48Å; S434-E437 PolarHBondContact N-OE2 2.66Å; S434-E437 WeakPolarHBondContact OG-CB 3.34Å; S434-E437 WeakPolarHBondContact OG-CG 3.49Å; S434-E437 PolarHBondContact OG-N 3.01Å; S434-E437 PolarHBondContact OG-OE2 3.06Å; E437-Q439 VanDerWaalsContact C-N 3.26Å; E437-Q439 PolarHBondContact O-N 2.91Å; E437-H440 WeakPolarHBondContact O-CA 3.35Å; E437-H440 WeakPolarHBondContact O-CB 3.44Å; E437-H440 PolarHBondContact O-N 3.34Å; E437-L441 PolarHBondContact O-N 3.35Å
438	A	93.1	Very high	87.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-34.2	173.9	0	0	0	0	0	112.8	L433 S434 I442 L453	L433-A438 HydrophobicContact CD2-CB 3.82Å; L433-A438 HydrophobicContact CG-CB 4.44Å; S434-A438 WeakPolarHBondContact O-CB 3.4Å; S434-A438 PolarHBondContact O-N 2.98Å; S434-A438 VanDerWaalsContact O-N 3.09Å; A438-I442 WeakPolarHBondContact O-CD1 3.34Å; A438-I442 WeakPolarHBondContact O-CG1 3.48Å; A438-I442 PolarHBondContact O-N 2.62Å; A438-L453 HydrophobicContact CB-CD1 4.01Å; A438-L453 HydrophobicContact CB-CD2 4.36Å
439	Q	92.9	Very high	86.9	Confident	65 Å²	65	49 Å²	49	30%	0.304	24%	0.243	S	C	.	.	H	α-helix	trans	-68.7	-38.1	171.1	-75.2	177.5	8.6	0	0	111.8	R435 E436 E437 T443 I474 H476	R435-Q439 WeakPolarHBondContact O-CG 3.29Å; R435-Q439 PolarHBondContact O-N 3.23Å; E436-Q439 WeakPolarHBondContact O-CB 3.47Å; E436-Q439 PolarHBondContact O-N 2.99Å; E437-Q439 VanDerWaalsContact C-N 3.26Å; E437-Q439 PolarHBondContact O-N 2.91Å; Q439-T443 WeakPolarHBondContact O-CB 3.23Å; Q439-T443 PolarHBondContact O-N 3.04Å; Q439-T443 PolarHBondContact O-OG1 2.95Å; Q439-I474 HydrophobicContact CB-CD1 3.98Å; Q439-I474 HydrophobicContact CG-CB 4.21Å; Q439-I474 HydrophobicContact CG-CD1 4.09Å; Q439-I474 HydrophobicContact CG-CG2 4.02Å; Q439-I474 VanDerWaalsContact O-CD1 3.24Å; Q439-I474 WeakPolarHBondContact O-CD1 3.24Å; Q439-H476 PolarHBondContact NE2-NE2 2.74Å
440	H	86.5	Confident	86.8	Confident	99 Å²	99	48 Å²	48	46%	0.458	24%	0.239	S	C	.	.	H	α-helix	trans	-64.4	-50.6	177.9	-161.3	48.9	0	0	0	112.1	E436 E437 I442 T443 Q444	E436-H440 PolarHBondContact O-N 3.41Å; E437-H440 WeakPolarHBondContact O-CA 3.35Å; E437-H440 WeakPolarHBondContact O-CB 3.44Å; E437-H440 PolarHBondContact O-N 3.34Å; H440-I442 PolarHBondContact O-N 2.86Å; H440-T443 WeakPolarHBondContact O-CA 3.19Å; H440-T443 WeakPolarHBondContact O-CB 3.35Å; H440-T443 PolarHBondContact O-N 3.41Å; H440-Q444 PolarHBondContact CD2-NE2 3.48Å; H440-Q444 VanDerWaalsContact CD2-NE2 3.26Å; H440-Q444 PolarHBondContact NE2-NE2 3.41Å; H440-Q444 VanDerWaalsContact NE2-NE2 3.18Å; H440-Q444 WeakPolarHBondContact O-CG 3.38Å; H440-Q444 PolarHBondContact O-N 3.21Å; H440-Q444 PolarHBondContact O-OE1 3.34Å
441	L	87.3	Confident	86.9	Confident	10 Å²	10	46.5 Å²	46.5	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-55.9	-49	178	-65.9	-173.8	0	0	0	112.5	H430 L433 E437 T443 Q444 Q445 L453	H430-L441 WeakPolarHBondContact ND1-CD1 3.28Å; L433-L441 HydrophobicContact CD1-CD1 4.3Å; L433-L441 HydrophobicContact CD2-CD1 3.7Å; E437-L441 PolarHBondContact O-N 3.35Å; L441-T443 VanDerWaalsContact C-N 3.25Å; L441-T443 PolarHBondContact O-N 2.79Å; L441-Q444 VanDerWaalsContact CA-OE1 3.25Å; L441-Q444 PolarHBondContact O-N 2.98Å; L441-Q445 PolarHBondContact O-N 3.33Å; L441-L453 HydrophobicContact CB-CD2 4.15Å; L441-L453 HydrophobicContact CD1-CD2 4.01Å
442	I	88.7	Confident	87.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-28.9	179.1	-67	170.9	0	0	0	111.5	A438 H440 L447 V451 L453 C469 I474	A438-I442 WeakPolarHBondContact O-CD1 3.34Å; A438-I442 WeakPolarHBondContact O-CG1 3.48Å; A438-I442 PolarHBondContact O-N 2.62Å; H440-I442 PolarHBondContact O-N 2.86Å; I442-L447 PolarHBondContact O-N 3.19Å; I442-V451 HydrophobicContact CB-CG1 4.49Å; I442-V451 HydrophobicContact CG1-CG1 4.32Å; I442-V451 HydrophobicContact CG2-CG1 4.13Å; I442-L453 HydrophobicContact CD1-CD2 4.4Å; I442-L453 HydrophobicContact CD1-CG 4.35Å; I442-L453 HydrophobicContact CG1-CD2 4.22Å; I442-C469 HydrophobicContact CG2-CB 3.57Å; I442-I474 HydrophobicContact CB-CD1 3.83Å; I442-I474 HydrophobicContact CB-CG1 4.38Å; I442-I474 HydrophobicContact CD1-CG2 3.89Å; I442-I474 HydrophobicContact CG2-CD1 3.7Å; I442-I474 HydrophobicContact CG2-CG1 3.78Å; I442-I474 HydrophobicContact CG2-CG2 4.49Å
443	T	83.1	Confident	87.6	Confident	67 Å²	67	37 Å²	37	41%	0.411	19%	0.186	S	C	.	.	H	α-helix	trans	-73.7	-41.8	175.4	-56.5	0	0	0	0	112.1	Q439 H440 L441 Q445 G446 L447	Q439-T443 WeakPolarHBondContact O-CB 3.23Å; Q439-T443 PolarHBondContact O-N 3.04Å; Q439-T443 PolarHBondContact O-OG1 2.95Å; H440-T443 WeakPolarHBondContact O-CA 3.19Å; H440-T443 WeakPolarHBondContact O-CB 3.35Å; H440-T443 PolarHBondContact O-N 3.41Å; L441-T443 VanDerWaalsContact C-N 3.25Å; L441-T443 PolarHBondContact O-N 2.79Å; T443-Q445 PolarHBondContact O-N 3.19Å; T443-G446 PolarHBondContact O-N 3.08Å; T443-L447 HydrophobicContact CG2-CD1 4.35Å; T443-L447 HydrophobicContact CG2-CD2 4.3Å; T443-L447 HydrophobicContact CG2-CG 4.23Å
444	Q	74.8	Confident	87.7	Confident	17 Å²	17	36.2 Å²	36.2	8%	0.079	18%	0.183	C	C	.	.	H	α-helix	trans	-59.6	-32.8	178.1	-71	158.4	-32.9	0	0	112	E110 R183 H440 L441 G446	E110-Q444 HydrophobicContact CB-CB 3.94Å; E110-Q444 HydrophobicContact CB-CG 4.03Å; E110-Q444 HydrophobicContact CG-CB 4.34Å; E110-Q444 PolarHBondContact O-NE2 3.25Å; E110-Q444 WeakPolarHBondContact OE1-CB 3.29Å; R183-Q444 PolarHBondContact NH1-O 3.34Å; H440-Q444 PolarHBondContact CD2-NE2 3.48Å; H440-Q444 VanDerWaalsContact CD2-NE2 3.26Å; H440-Q444 PolarHBondContact NE2-NE2 3.41Å; H440-Q444 VanDerWaalsContact NE2-NE2 3.18Å; H440-Q444 WeakPolarHBondContact O-CG 3.38Å; H440-Q444 PolarHBondContact O-N 3.21Å; H440-Q444 PolarHBondContact O-OE1 3.34Å; L441-Q444 VanDerWaalsContact CA-OE1 3.25Å; L441-Q444 PolarHBondContact O-N 2.98Å; Q444-G446 PolarHBondContact O-N 3.27Å
445	Q	74.8	Confident	87.8	Confident	8 Å²	8	36 Å²	36	4%	0.037	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	18.3	176.1	-58.7	-163.7	-7.3	0	0	114.3	E110 L441 T443 V451	E110-Q445 WeakPolarHBondContact OE1-CG 3.42Å; E110-Q445 PolarHBondContact OE2-NE2 2.97Å; L441-Q445 PolarHBondContact O-N 3.33Å; T443-Q445 PolarHBondContact O-N 3.19Å; Q445-V451 HydrophobicContact CB-CG1 4.37Å
446	G	69.3	Low	87.8	Confident	34 Å²	34	32.3 Å²	32.3	35%	0.351	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	89	9.3	166.3	0	0	0	0	0	116.2	T443 Q444 I448	T443-G446 PolarHBondContact O-N 3.08Å; Q444-G446 PolarHBondContact O-N 3.27Å; G446-I448 PolarHBondContact O-N 2.89Å
447	L	78.4	Confident	87.7	Confident	34 Å²	34	27.2 Å²	27.2	18%	0.178	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	26.9	-179.5	-65	173.8	0	0	0	115.2	I442 T443 C469 Q472 I474	I442-L447 PolarHBondContact O-N 3.19Å; T443-L447 HydrophobicContact CG2-CD1 4.35Å; T443-L447 HydrophobicContact CG2-CD2 4.3Å; T443-L447 HydrophobicContact CG2-CG 4.23Å; L447-C469 PolarHBondContact O-SG 3.05Å; L447-C469 VanDerWaalsContact O-SG 3.32Å; L447-Q472 HydrophobicContact CB-CB 4.24Å; L447-Q472 HydrophobicContact CB-CG 4.07Å; L447-Q472 HydrophobicContact CD1-CB 4.17Å; L447-Q472 HydrophobicContact CD1-CG 4.46Å; L447-I474 HydrophobicContact CD2-CD1 3.84Å; L447-I474 HydrophobicContact CD2-CG1 3.99Å
448	I	82.3	Confident	87.6	Confident	31 Å²	31	28.2 Å²	28.2	16%	0.159	15%	0.15	C	C	.	.			trans	-69.4	135.8	-174.9	-59.7	166.7	0	0	0	111.7	A187 G446 G450 V451	A187-I448 HydrophobicContact CB-CD1 4.42Å; G446-I448 PolarHBondContact O-N 2.89Å; I448-G450 PolarHBondContact O-N 3.25Å; I448-V451 HydrophobicContact CB-CG2 3.8Å; I448-V451 HydrophobicContact CG2-CG2 4.45Å; I448-V451 WeakPolarHBondContact O-CB 3.23Å; I448-V451 VanDerWaalsContact O-CG2 3.29Å; I448-V451 WeakPolarHBondContact O-CG2 3.28Å; I448-V451 PolarHBondContact O-N 2.86Å
449	D	86.9	Confident	87.2	Confident	38 Å²	38	33.2 Å²	33.2	20%	0.203	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	119.3	175.7	-104	45.2	0	0	0	113	H470 M471 K521	D449-H470 WeakPolarHBondContact OD1-CA 3.47Å; D449-H470 IonicContact OD2-CD2 3.33Å; D449-H470 PolarHBondContact OD2-CD2 3.09Å; D449-H470 VanDerWaalsContact OD2-CD2 3.25Å; D449-H470 IonicContact OD2-NE2 3.43Å; D449-M471 PolarHBondContact OD1-N 2.88Å; D449-K521 WeakPolarHBondContact O-CD 3.44Å; D449-K521 VanDerWaalsContact O-CE 3.23Å; D449-K521 WeakPolarHBondContact O-CE 3.3Å; D449-K521 PolarHBondContact O-NZ 3.05Å
450	G	90.2	Very high	86.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.5	4.2	-178.7	0	0	0	0	0	115.1	I448 C469 R519 K521 H522	I448-G450 PolarHBondContact O-N 3.25Å; G450-C469 PolarHBondContact N-O 2.98Å; G450-R519 WeakPolarHBondContact CA-O 3.25Å; G450-K521 PolarHBondContact O-N 2.84Å; G450-H522 PolarHBondContact O-N 2.65Å; G450-H522 VanDerWaalsContact O-N 3.11Å
451	V	93.2	Very high	86.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	127.9	166.4	173.1	0	0	0	0	109.9	I442 Q445 I448 L468 C469 H522 C524	I442-V451 HydrophobicContact CB-CG1 4.49Å; I442-V451 HydrophobicContact CG1-CG1 4.32Å; I442-V451 HydrophobicContact CG2-CG1 4.13Å; Q445-V451 HydrophobicContact CB-CG1 4.37Å; I448-V451 HydrophobicContact CB-CG2 3.8Å; I448-V451 HydrophobicContact CG2-CG2 4.45Å; I448-V451 WeakPolarHBondContact O-CB 3.23Å; I448-V451 VanDerWaalsContact O-CG2 3.29Å; I448-V451 WeakPolarHBondContact O-CG2 3.28Å; I448-V451 PolarHBondContact O-N 2.86Å; V451-L468 WeakPolarHBondContact O-CA 3.03Å; V451-C469 HydrophobicContact CB-CB 4.4Å; V451-C469 PolarHBondContact O-N 2.84Å; V451-H522 CarbonylContact C-O 3.58Å; V451-H522 VanDerWaalsContact CA-O 3.24Å; V451-H522 WeakPolarHBondContact CA-O 3.47Å; V451-H522 HydrophobicContact CG2-CB 4.07Å; V451-C524 WeakPolarHBondContact CG1-SG 3.38Å
452	F	96.8	Very high	86.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	165.2	-174.3	80.3	-80.7	0	0	0	115	W428 L454 L466 S467 L468 V506 L520 H522 H523 C524	W428-F452 HydrophobicContact CB-CE2 3.85Å; W428-F452 HydrophobicContact CB-CZ 4.07Å; W428-F452 HydrophobicContact CG-CE2 4.26Å; W428-F452 HydrophobicContact CG-CZ 4.41Å; F452-L454 HydrophobicContact CD2-CD1 3.87Å; F452-L454 HydrophobicContact CE2-CD1 3.91Å; F452-L466 HydrophobicContact CB-CD1 3.97Å; F452-L466 HydrophobicContact CD2-CD1 3.78Å; F452-L466 HydrophobicContact CG-CD1 4.26Å; F452-S467 CarbonylContact C-O 3.51Å; F452-S467 WeakPolarHBondContact CA-O 3.4Å; F452-S467 WeakPolarHBondContact CB-O 3.37Å; F452-L468 HydrophobicContact CB-CB 4.43Å; F452-L468 HydrophobicContact CB-CD1 4.1Å; F452-V506 HydrophobicContact CE2-CG1 3.96Å; F452-V506 HydrophobicContact CE2-CG2 4.26Å; F452-V506 HydrophobicContact CZ-CG1 3.79Å; F452-L520 HydrophobicContact CB-CD2 3.88Å; F452-L520 HydrophobicContact CD1-CB 3.74Å; F452-L520 HydrophobicContact CD1-CD2 4.07Å; F452-L520 HydrophobicContact CD1-CG 4.3Å; F452-L520 HydrophobicContact CD2-CD1 4.08Å; F452-L520 HydrophobicContact CD2-CD2 4.21Å; F452-L520 HydrophobicContact CE1-CB 3.74Å; F452-L520 HydrophobicContact CE1-CD1 4.44Å; F452-L520 HydrophobicContact CE2-CD1 3.99Å; F452-L520 HydrophobicContact CG-CB 4.29Å; F452-L520 HydrophobicContact CG-CD1 4.35Å; F452-L520 HydrophobicContact CG-CD2 3.8Å; F452-L520 HydrophobicContact CG-CG 4.35Å; F452-L520 HydrophobicContact CZ-CB 4.26Å; F452-L520 HydrophobicContact CZ-CD1 4.18Å; F452-H522 WeakPolarHBondContact CD1-O 3.36Å; F452-H522 PolarHBondContact N-O 3.05Å; F452-H523 HydrophobicContact CD1-CB 4.44Å; F452-H523 HydrophobicContact CE1-CB 3.91Å; F452-H523 HydrophobicContact CE2-CB 4.45Å; F452-H523 HydrophobicContact CZ-CB 3.91Å; F452-H523 CarbonylContact O-C 3.51Å; F452-H523 VanDerWaalsContact O-CA 3.28Å; F452-H523 WeakPolarHBondContact O-CA 3.49Å; F452-C524 PolarHBondContact O-N 3.14Å
453	L	96.3	Very high	86.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	157	162.9	62.6	86.4	0	0	0	110.8	H430 L433 A438 L441 I442 R455 S467 C524	H430-L453 HydrophobicContact CB-CD1 4.48Å; L433-L453 HydrophobicContact CD2-CD1 3.89Å; L433-L453 HydrophobicContact CD2-CD2 3.9Å; A438-L453 HydrophobicContact CB-CD1 4.01Å; A438-L453 HydrophobicContact CB-CD2 4.36Å; L441-L453 HydrophobicContact CB-CD2 4.15Å; L441-L453 HydrophobicContact CD1-CD2 4.01Å; I442-L453 HydrophobicContact CD1-CD2 4.4Å; I442-L453 HydrophobicContact CD1-CG 4.35Å; I442-L453 HydrophobicContact CG1-CD2 4.22Å; L453-R455 HydrophobicContact CD1-CB 4.12Å; L453-R455 HydrophobicContact CD1-CG 4.33Å; L453-S467 PolarHBondContact N-O 3.49Å; L453-S467 PolarHBondContact O-N 2.92Å; L453-C524 HydrophobicContact CB-CB 4.32Å; L453-C524 HydrophobicContact CD2-CB 3.99Å
454	L	96.3	Very high	86.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	145.4	167.2	-80.8	71	0	0	0	109.9	W428 F429 H430 F452 V465 L466 I479 L502 V506	W428-L454 HydrophobicContact CE3-CB 4.03Å; W428-L454 HydrophobicContact CE3-CD1 4.09Å; W428-L454 HydrophobicContact CE3-CD2 4.2Å; W428-L454 HydrophobicContact CE3-CG 4.33Å; W428-L454 HydrophobicContact CZ3-CB 4.17Å; W428-L454 HydrophobicContact CZ3-CD1 4.46Å; W428-L454 HydrophobicContact CZ3-CD2 3.74Å; W428-L454 HydrophobicContact CZ3-CG 4.34Å; W428-L454 PolarHBondContact O-N 3.06Å; F429-L454 WeakPolarHBondContact CA-O 3.33Å; F429-L454 HydrophobicContact CD2-CB 4.02Å; H430-L454 PolarHBondContact N-O 2.69Å; F452-L454 HydrophobicContact CD2-CD1 3.87Å; F452-L454 HydrophobicContact CE2-CD1 3.91Å; L454-V465 WeakPolarHBondContact CA-O 3.47Å; L454-L466 HydrophobicContact CD1-CB 4.47Å; L454-L466 HydrophobicContact CD1-CD1 3.73Å; L454-L466 HydrophobicContact CG-CB 4.48Å; L454-I479 HydrophobicContact CD2-CD1 3.45Å; L454-I479 VanDerWaalsContact CD2-CD1 3.45Å; L454-I479 HydrophobicContact CG-CD1 3.95Å; L454-L502 HydrophobicContact CD2-CB 4.27Å; L454-L502 HydrophobicContact CD2-CD1 4.28Å; L454-L502 HydrophobicContact CD2-CD2 4.37Å; L454-V506 HydrophobicContact CD1-CG2 3.69Å; L454-V506 HydrophobicContact CD2-CG2 3.98Å
455	R	95.1	Very high	88	Confident	13 Å²	13	40.2 Å²	40.2	5%	0.049	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	165.1	179.4	68	-168.2	-171.1	81	7.5	111	G431 L433 S434 L453 F464 V465 S467	G431-R455 CarbonylContact O-C 3.46Å; G431-R455 WeakPolarHBondContact O-CA 3.31Å; G431-R455 WeakPolarHBondContact O-CB 3.1Å; L433-R455 HydrophobicContact CB-CB 4.04Å; L433-R455 WeakPolarHBondContact O-CD 3.3Å; L433-R455 PolarHBondContact O-NH1 3.48Å; S434-R455 VanDerWaalsContact C-NH1 3.3Å; L453-R455 HydrophobicContact CD1-CB 4.12Å; L453-R455 HydrophobicContact CD1-CG 4.33Å; R455-F464 CarbonylContact O-C 3.59Å; R455-F464 WeakPolarHBondContact O-CA 3.23Å; R455-V465 HydrophobicContact CG-CB 4.07Å; R455-V465 PolarHBondContact N-O 2.8Å; R455-V465 VanDerWaalsContact N-O 3.08Å; R455-V465 PolarHBondContact O-N 3.09Å; R455-S467 PolarHBondContact NE-OG 2.98Å
456	D	93.3	Very high	89.1	Confident	46 Å²	46	39.8 Å²	39.8	25%	0.246	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	141.9	172.4	-63.3	-33.2	0	0	0	110.9	G431 K432 Q458	G431-D456 PolarHBondContact O-N 2.84Å; K432-D456 WeakPolarHBondContact CG-OD2 3.24Å; K432-D456 PolarHBondContact N-OD2 3.32Å; D456-Q458 PolarHBondContact O-N 2.83Å
457	S	91.9	Very high	90.5	Very high	9 Å²	9	38.2 Å²	38.2	6%	0.063	20%	0.204	C	C	.	.			trans	-78.5	113.3	172.8	-174	0	0	0	0	111	S459 N460 T463	S457-S459 VanDerWaalsContact C-N 3.29Å; S457-S459 PolarHBondContact O-N 2.85Å; S457-S459 PolarHBondContact OG-OG 2.89Å; S457-N460 WeakPolarHBondContact CB-O 3.41Å; S457-N460 PolarHBondContact OG-N 3Å; S457-T463 WeakPolarHBondContact CB-O 3.44Å; S457-T463 WeakPolarHBondContact CB-OG1 3.49Å; S457-T463 PolarHBondContact N-O 3.22Å; S457-T463 PolarHBondContact OG-OG1 3.43Å
458	Q	88.6	Confident	91.4	Very high	121 Å²	121	36.6 Å²	36.6	57%	0.565	20%	0.195	S	C	*	.	S	Bend	trans	-71	-23.3	174.3	-68.2	174.4	-51.1	0	0	113.2	D456	D456-Q458 PolarHBondContact O-N 2.83Å
459	S	85.5	Confident	92	Very high	106 Å²	106	35.1 Å²	35.1	74%	0.741	19%	0.188	S	C	*	.	S	Bend	trans	-94	-20.9	-177.2	52.7	0	0	0	0	114.1	S457	S457-S459 VanDerWaalsContact C-N 3.29Å; S457-S459 PolarHBondContact O-N 2.85Å; S457-S459 PolarHBondContact OG-OG 2.89Å
460	N	85.4	Confident	92.3	Very high	69 Å²	69	35.1 Å²	35.1	37%	0.369	19%	0.186	S	C	.	.	S	Bend	trans	-142	98.4	179.2	-175.7	7.7	0	0	0	110.2	S457 T463 Q478	S457-N460 WeakPolarHBondContact CB-O 3.41Å; S457-N460 PolarHBondContact OG-N 3Å; N460-T463 HydrophobicContact CB-CG2 4.31Å; N460-T463 WeakPolarHBondContact CB-OG1 3.42Å; N460-T463 WeakPolarHBondContact ND2-CG2 3.16Å; N460-T463 PolarHBondContact O-N 2.87Å; N460-T463 PolarHBondContact O-OG1 3.03Å; N460-Q478 VanDerWaalsContact CB-NE2 3.31Å; N460-Q478 PolarHBondContact ND2-NE2 2.86Å
461	P	80.3	Confident	92	Very high	102 Å²	102	41.3 Å²	41.3	66%	0.662	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.7	147.1	-177.4	-27.6	35.5	0	0	0	113.5	T463	P461-T463 PolarHBondContact O-N 3.36Å
462	K	80.3	Confident	91.3	Very high	197 Å²	197	43.4 Å²	43.4	86%	0.857	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	6.6	-174.9	-48	178.1	179.6	-179.4	0	115.8
463	T	91.1	Very high	90.9	Very high	7 Å²	7	50.6 Å²	50.6	4%	0.043	26%	0.258	C	S	.	.			trans	-108.4	160.5	170.6	74.1	0	0	0	0	110.9	S457 N460 P461 Q478 L480 P481	S457-T463 WeakPolarHBondContact CB-O 3.44Å; S457-T463 WeakPolarHBondContact CB-OG1 3.49Å; S457-T463 PolarHBondContact N-O 3.22Å; S457-T463 PolarHBondContact OG-OG1 3.43Å; N460-T463 HydrophobicContact CB-CG2 4.31Å; N460-T463 WeakPolarHBondContact CB-OG1 3.42Å; N460-T463 WeakPolarHBondContact ND2-CG2 3.16Å; N460-T463 PolarHBondContact O-N 2.87Å; N460-T463 PolarHBondContact O-OG1 3.03Å; P461-T463 PolarHBondContact O-N 3.36Å; T463-Q478 PolarHBondContact OG1-NE2 3.07Å; T463-L480 HydrophobicContact CG2-CD2 4.05Å; T463-P481 HydrophobicContact CG2-CG 4.32Å
464	F	95.4	Very high	90.9	Very high	20 Å²	20	52 Å²	52	9%	0.088	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	165.5	-178.1	-56.4	-79.7	0	0	0	111.2	H423 F429 R455 I479 Y490 L502	H423-F464 AromaticContact CE1-CZ 3.96Å; H423-F464 AromaticContact NE2-CZ 3.84Å; F429-F464 AromaticContact CE2-CD1 3.79Å; F429-F464 HydrophobicContact CE2-CD1 3.79Å; F429-F464 AromaticContact CE2-CE1 3.9Å; F429-F464 HydrophobicContact CE2-CE1 3.9Å; F429-F464 HydrophobicContact CZ-CD1 4.16Å; F429-F464 AromaticContact CZ-CE1 3.94Å; F429-F464 HydrophobicContact CZ-CE1 3.94Å; R455-F464 CarbonylContact O-C 3.59Å; R455-F464 WeakPolarHBondContact O-CA 3.23Å; F464-I479 HydrophobicContact CB-CB 4.13Å; F464-I479 HydrophobicContact CB-CD1 4.18Å; F464-I479 PolarHBondContact N-O 3.07Å; F464-I479 PolarHBondContact O-N 2.79Å; F464-Y490 HydrophobicContact CD2-CD1 4.41Å; F464-Y490 HydrophobicContact CD2-CE1 4.01Å; F464-Y490 AromaticContact CE2-CE1 3.75Å; F464-Y490 HydrophobicContact CE2-CE1 3.75Å; F464-L502 HydrophobicContact CD1-CD1 4.08Å; F464-L502 HydrophobicContact CD2-CD1 3.74Å; F464-L502 HydrophobicContact CD2-CD2 3.88Å; F464-L502 HydrophobicContact CD2-CG 4.28Å; F464-L502 HydrophobicContact CE1-CD1 4.17Å; F464-L502 HydrophobicContact CE2-CD1 3.83Å; F464-L502 HydrophobicContact CE2-CD2 4.37Å; F464-L502 HydrophobicContact CE2-CG 4.38Å; F464-L502 HydrophobicContact CG-CD1 3.86Å; F464-L502 HydrophobicContact CG-CD2 4.41Å; F464-L502 HydrophobicContact CZ-CD1 4.04Å
465	V	97.3	Very high	90.9	Very high	9 Å²	9	56.3 Å²	56.3	6%	0.055	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	116.4	179.4	-179.5	0	0	0	0	110.1	L454 R455 H476 F477	L454-V465 WeakPolarHBondContact CA-O 3.47Å; R455-V465 HydrophobicContact CG-CB 4.07Å; R455-V465 PolarHBondContact N-O 2.8Å; R455-V465 VanDerWaalsContact N-O 3.08Å; R455-V465 PolarHBondContact O-N 3.09Å; V465-H476 HydrophobicContact CG1-CB 3.76Å; V465-F477 WeakPolarHBondContact CA-O 3.48Å
466	L	97.5	Very high	91	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	117.2	164.1	166.9	62.2	0	0	0	108.5	F452 L454 L468 H476 F477 I479 L492 L516 L520	F452-L466 HydrophobicContact CB-CD1 3.97Å; F452-L466 HydrophobicContact CD2-CD1 3.78Å; F452-L466 HydrophobicContact CG-CD1 4.26Å; L454-L466 HydrophobicContact CD1-CB 4.47Å; L454-L466 HydrophobicContact CD1-CD1 3.73Å; L454-L466 HydrophobicContact CG-CB 4.48Å; L466-L468 HydrophobicContact CG-CB 4.49Å; L466-H476 CarbonylContact O-C 3.59Å; L466-H476 WeakPolarHBondContact O-CA 3.49Å; L466-F477 HydrophobicContact CB-CB 4.43Å; L466-F477 HydrophobicContact CD2-CD2 4.44Å; L466-F477 HydrophobicContact CG-CD2 4.41Å; L466-F477 PolarHBondContact N-O 2.97Å; L466-F477 PolarHBondContact O-N 3.4Å; L466-I479 HydrophobicContact CB-CD1 4.16Å; L466-I479 HydrophobicContact CB-CG1 4.4Å; L466-L492 HydrophobicContact CD2-CD1 3.9Å; L466-L516 HydrophobicContact CD2-CD1 3.7Å; L466-L516 HydrophobicContact CD2-CD2 3.75Å; L466-L516 HydrophobicContact CD2-CG 4.39Å; L466-L520 HydrophobicContact CD1-CD1 4.46Å; L466-L520 HydrophobicContact CD1-CD2 3.96Å; L466-L520 HydrophobicContact CD2-CD2 4.22Å
467	S	97.9	Very high	91.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.8	171.2	-55.7	0	0	0	0	108.7	F452 L453 R455 K475 H476	F452-S467 CarbonylContact C-O 3.51Å; F452-S467 WeakPolarHBondContact CA-O 3.4Å; F452-S467 WeakPolarHBondContact CB-O 3.37Å; L453-S467 PolarHBondContact N-O 3.49Å; L453-S467 PolarHBondContact O-N 2.92Å; R455-S467 PolarHBondContact NE-OG 2.98Å; S467-K475 WeakPolarHBondContact CA-O 3.38Å; S467-H476 PolarHBondContact OG-ND1 3.23Å
468	L	97.6	Very high	91.3	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	133.2	-167.4	166.9	64.2	0	0	0	111	V451 F452 L466 I474 K475 F477 L516 P517 L520	V451-L468 WeakPolarHBondContact O-CA 3.03Å; F452-L468 HydrophobicContact CB-CB 4.43Å; F452-L468 HydrophobicContact CB-CD1 4.1Å; L466-L468 HydrophobicContact CG-CB 4.49Å; L468-I474 WeakPolarHBondContact O-CA 3.2Å; L468-K475 PolarHBondContact N-O 2.57Å; L468-K475 PolarHBondContact O-N 2.81Å; L468-F477 HydrophobicContact CB-CE2 4.17Å; L468-F477 HydrophobicContact CD2-CE2 4.05Å; L468-L516 HydrophobicContact CD2-CB 4.23Å; L468-L516 HydrophobicContact CD2-CD1 4.16Å; L468-L516 HydrophobicContact CD2-CD2 4.36Å; L468-L516 HydrophobicContact CD2-CG 4.49Å; L468-P517 HydrophobicContact CD2-CG 4.06Å; L468-L520 HydrophobicContact CD1-CD2 3.91Å; L468-L520 HydrophobicContact CD2-CD2 4.15Å
469	C	95.7	Very high	91.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	135.7	171.1	-144.3	0	0	0	0	112.7	I442 L447 G450 V451	I442-C469 HydrophobicContact CG2-CB 3.57Å; L447-C469 PolarHBondContact O-SG 3.05Å; L447-C469 VanDerWaalsContact O-SG 3.32Å; G450-C469 PolarHBondContact N-O 2.98Å; V451-C469 HydrophobicContact CB-CB 4.4Å; V451-C469 PolarHBondContact O-N 2.84Å
470	H	92.8	Very high	92.1	Very high	38 Å²	38	53.2 Å²	53.2	18%	0.176	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	127.4	170	171.7	-87.5	0	0	0	111.2	D449 Q472 K473 P517	D449-H470 WeakPolarHBondContact OD1-CA 3.47Å; D449-H470 IonicContact OD2-CD2 3.33Å; D449-H470 PolarHBondContact OD2-CD2 3.09Å; D449-H470 VanDerWaalsContact OD2-CD2 3.25Å; D449-H470 IonicContact OD2-NE2 3.43Å; H470-Q472 VanDerWaalsContact C-N 3.31Å; H470-Q472 PolarHBondContact O-N 3.08Å; H470-K473 PolarHBondContact N-O 2.81Å; H470-K473 PolarHBondContact O-N 2.94Å; H470-P517 HydrophobicContact CB-CB 4.1Å; H470-P517 HydrophobicContact CB-CG 3.78Å
471	M	84.8	Confident	92.3	Very high	130 Å²	130	52.6 Å²	52.6	64%	0.64	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	50.3	-171.3	-59.9	177.6	82.9	0	0	111.7	D449 K473	D449-M471 PolarHBondContact OD1-N 2.88Å; M471-K473 PolarHBondContact O-N 3.49Å
472	Q	78.5	Confident	92.8	Very high	45 Å²	45	49.5 Å²	49.5	21%	0.21	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	10.1	-173.2	-61	-174.9	-25.3	0	0	116.1	F299 L447 H470	F299-Q472 HydrophobicContact CE1-CG 3.83Å; F299-Q472 VanDerWaalsContact CE1-NE2 3.33Å; F299-Q472 HydrophobicContact CZ-CG 4.41Å; L447-Q472 HydrophobicContact CB-CB 4.24Å; L447-Q472 HydrophobicContact CB-CG 4.07Å; L447-Q472 HydrophobicContact CD1-CB 4.17Å; L447-Q472 HydrophobicContact CD1-CG 4.46Å; H470-Q472 VanDerWaalsContact C-N 3.31Å; H470-Q472 PolarHBondContact O-N 3.08Å
473	K	87.8	Confident	93.2	Very high	150 Å²	150	45.7 Å²	45.7	65%	0.652	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.3	177.9	-67.8	180	-177	-179.8	0	109.9	H470 M471 K475	H470-K473 PolarHBondContact N-O 2.81Å; H470-K473 PolarHBondContact O-N 2.94Å; M471-K473 PolarHBondContact O-N 3.49Å; K473-K475 PolarHBondContact O-N 3.46Å
474	I	95.7	Very high	92.9	Very high	31 Å²	31	48.6 Å²	48.6	16%	0.159	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	114.5	177.1	-52.6	176.3	0	0	0	107.9	Q439 I442 L447 L468	Q439-I474 HydrophobicContact CB-CD1 3.98Å; Q439-I474 HydrophobicContact CG-CB 4.21Å; Q439-I474 HydrophobicContact CG-CD1 4.09Å; Q439-I474 HydrophobicContact CG-CG2 4.02Å; Q439-I474 VanDerWaalsContact O-CD1 3.24Å; Q439-I474 WeakPolarHBondContact O-CD1 3.24Å; I442-I474 HydrophobicContact CB-CD1 3.83Å; I442-I474 HydrophobicContact CB-CG1 4.38Å; I442-I474 HydrophobicContact CD1-CG2 3.89Å; I442-I474 HydrophobicContact CG2-CD1 3.7Å; I442-I474 HydrophobicContact CG2-CG1 3.78Å; I442-I474 HydrophobicContact CG2-CG2 4.49Å; L447-I474 HydrophobicContact CD2-CD1 3.84Å; L447-I474 HydrophobicContact CD2-CG1 3.99Å; L468-I474 WeakPolarHBondContact O-CA 3.2Å
475	K	96.1	Very high	92.5	Very high	89 Å²	89	57.1 Å²	57.1	39%	0.387	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	149.5	175	-65.4	-175.4	-176.2	-179	0	109.3	S467 L468 K473 F477 P517	S467-K475 WeakPolarHBondContact CA-O 3.38Å; L468-K475 PolarHBondContact N-O 2.57Å; L468-K475 PolarHBondContact O-N 2.81Å; K473-K475 PolarHBondContact O-N 3.46Å; K475-F477 HydrophobicContact CB-CD2 4.37Å; K475-F477 HydrophobicContact CB-CE2 3.47Å; K475-F477 VanDerWaalsContact CB-CE2 3.47Å; K475-F477 HydrophobicContact CB-CZ 3.64Å; K475-F477 HydrophobicContact CD-CE2 4.4Å; K475-F477 HydrophobicContact CD-CZ 3.76Å; K475-F477 HydrophobicContact CG-CZ 4.37Å; K475-P517 HydrophobicContact CD-CG 4.28Å
476	H	96.8	Very high	91.7	Very high	46 Å²	46	59.4 Å²	59.4	21%	0.213	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	125.6	175.9	-49.3	-81.3	0	0	0	107.9	R435 Q439 V465 L466 S467	R435-H476 WeakPolarHBondContact CG-NE2 3.43Å; R435-H476 PolarHBondContact NE-CD2 3.25Å; R435-H476 VanDerWaalsContact NE-CD2 3.29Å; R435-H476 PolarHBondContact NE-NE2 3.41Å; Q439-H476 PolarHBondContact NE2-NE2 2.74Å; V465-H476 HydrophobicContact CG1-CB 3.76Å; L466-H476 CarbonylContact O-C 3.59Å; L466-H476 WeakPolarHBondContact O-CA 3.49Å; S467-H476 PolarHBondContact OG-ND1 3.23Å
477	F	96.9	Very high	91.2	Very high	47 Å²	47	66 Å²	66	21%	0.206	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129.4	179.7	-54.2	-93.7	0	0	0	107.9	V465 L466 L468 K475 L492 L516 P517	V465-F477 WeakPolarHBondContact CA-O 3.48Å; L466-F477 HydrophobicContact CB-CB 4.43Å; L466-F477 HydrophobicContact CD2-CD2 4.44Å; L466-F477 HydrophobicContact CG-CD2 4.41Å; L466-F477 PolarHBondContact N-O 2.97Å; L466-F477 PolarHBondContact O-N 3.4Å; L468-F477 HydrophobicContact CB-CE2 4.17Å; L468-F477 HydrophobicContact CD2-CE2 4.05Å; K475-F477 HydrophobicContact CB-CD2 4.37Å; K475-F477 HydrophobicContact CB-CE2 3.47Å; K475-F477 VanDerWaalsContact CB-CE2 3.47Å; K475-F477 HydrophobicContact CB-CZ 3.64Å; K475-F477 HydrophobicContact CD-CE2 4.4Å; K475-F477 HydrophobicContact CD-CZ 3.76Å; K475-F477 HydrophobicContact CG-CZ 4.37Å; F477-L492 HydrophobicContact CB-CD2 3.51Å; F477-L516 HydrophobicContact CD1-CD2 3.99Å; F477-L516 HydrophobicContact CD2-CD2 3.83Å; F477-L516 HydrophobicContact CE1-CD2 4.14Å; F477-L516 HydrophobicContact CE2-CD2 4Å; F477-L516 HydrophobicContact CG-CD2 3.84Å; F477-L516 HydrophobicContact CZ-CD2 4.16Å; F477-P517 VanDerWaalsContact CZ-CD 3.47Å; F477-P517 HydrophobicContact CZ-CG 4.14Å
478	Q	95.9	Very high	90.7	Very high	75 Å²	75	70.1 Å²	70.1	35%	0.35	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	122.7	-177.6	-168.7	164.8	-4.8	0	0	109.5	N460 T463 L480	N460-Q478 VanDerWaalsContact CB-NE2 3.31Å; N460-Q478 PolarHBondContact ND2-NE2 2.86Å; T463-Q478 PolarHBondContact OG1-NE2 3.07Å; Q478-L480 HydrophobicContact CG-CD2 3.8Å; Q478-L480 HydrophobicContact CG-CG 4.3Å
479	I	96.1	Very high	90.4	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	111.1	173.7	-56.2	167.6	0	0	0	106.3	L454 F464 L466 Y490 S491 L492 L502 L505	L454-I479 HydrophobicContact CD2-CD1 3.45Å; L454-I479 VanDerWaalsContact CD2-CD1 3.45Å; L454-I479 HydrophobicContact CG-CD1 3.95Å; F464-I479 HydrophobicContact CB-CB 4.13Å; F464-I479 HydrophobicContact CB-CD1 4.18Å; F464-I479 PolarHBondContact N-O 3.07Å; F464-I479 PolarHBondContact O-N 2.79Å; L466-I479 HydrophobicContact CB-CD1 4.16Å; L466-I479 HydrophobicContact CB-CG1 4.4Å; I479-Y490 HydrophobicContact CG2-CD1 4.09Å; I479-Y490 HydrophobicContact CG2-CG 4.34Å; I479-S491 WeakPolarHBondContact CA-O 3.32Å; I479-L492 HydrophobicContact CG1-CD1 4.36Å; I479-L492 HydrophobicContact CG1-CD2 3.73Å; I479-L492 HydrophobicContact CG1-CG 3.92Å; I479-L502 HydrophobicContact CD1-CD2 4.19Å; I479-L502 HydrophobicContact CG2-CD2 3.92Å; I479-L505 HydrophobicContact CD1-CD1 4.19Å; I479-L505 HydrophobicContact CD1-CD2 4.22Å; I479-L505 HydrophobicContact CG1-CD1 4.23Å; I479-L505 HydrophobicContact CG2-CD1 3.62Å
480	L	93.9	Very high	90.3	Very high	62 Å²	62	73.9 Å²	73.9	33%	0.325	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	142.7	-177.4	-65.9	176.1	0	0	0	110.7	T463 Q478 Y490 S491	T463-L480 HydrophobicContact CG2-CD2 4.05Å; Q478-L480 HydrophobicContact CG-CD2 3.8Å; Q478-L480 HydrophobicContact CG-CG 4.3Å; L480-Y490 WeakPolarHBondContact O-CA 3.4Å; L480-S491 PolarHBondContact N-O 3.12Å; L480-S491 PolarHBondContact O-N 3.09Å
481	P	91.1	Very high	90.4	Very high	57 Å²	57	72.2 Å²	72.2	37%	0.37	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	141.1	163.6	28.8	-32.5	0	0	0	110.1	T463 L488 F489	T463-P481 HydrophobicContact CG2-CG 4.32Å; P481-L488 HydrophobicContact CB-CD1 3.71Å; P481-F489 CarbonylContact C-O 3.54Å; P481-F489 VanDerWaalsContact CA-O 3.3Å; P481-F489 WeakPolarHBondContact CA-O 3.36Å
482	V	90.1	Very high	90.9	Very high	36 Å²	36	67.1 Å²	67.1	22%	0.218	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	121.8	173	-179.2	0	0	0	0	107	F489	V482-F489 HydrophobicContact CB-CB 4.47Å; V482-F489 PolarHBondContact N-O 3.43Å; V482-F489 PolarHBondContact O-N 3.06Å
483	D	88.6	Confident	91.6	Very high	118 Å²	118	66 Å²	66	63%	0.631	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	129.6	174.1	-164.2	-68.8	0	0	0	108.5	G486	D483-G486 WeakPolarHBondContact OD1-CA 3.13Å; D483-G486 PolarHBondContact OD1-N 2.9Å
484	D	85.1	Confident	91.5	Very high	68 Å²	68	66.1 Å²	66.1	36%	0.364	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	120.5	171.1	-169.6	37.3	0	0	0	109.1	G486 E487 F489 R498	D484-G486 PolarHBondContact O-N 3.31Å; D484-E487 PolarHBondContact N-O 3.35Å; D484-E487 PolarHBondContact O-N 2.91Å; D484-F489 HydrophobicContact CB-CD2 4.13Å; D484-F489 HydrophobicContact CB-CE2 4Å; D484-R498 VanDerWaalsContact CB-NH1 3.3Å; D484-R498 VanDerWaalsContact CG-NH1 3.29Å; D484-R498 IonicContact OD2-CZ 3.47Å; D484-R498 IonicContact OD2-NH1 3.6Å; D484-R498 PolarHBondContact OD2-NH1 3.29Å; D484-R498 IonicContact OD2-NH2 3.18Å; D484-R498 PolarHBondContact OD2-NH2 3.36Å
485	E	86.6	Confident	91.2	Very high	199 Å²	199	65.6 Å²	65.6	93%	0.93	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	22.7	-173.1	-54.1	-162	141.2	0	0	115.5
486	G	81.6	Confident	90.8	Very high	57 Å²	57	69.2 Å²	69.2	59%	0.588	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	0	-177	0	0	0	0	0	115.2	D483 D484	D483-G486 WeakPolarHBondContact OD1-CA 3.13Å; D483-G486 PolarHBondContact OD1-N 2.9Å; D484-G486 PolarHBondContact O-N 3.31Å
487	E	85	Confident	90.6	Very high	137 Å²	137	68.9 Å²	68.9	64%	0.64	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	141.7	169	-73.5	-65.4	161.8	0	0	110.9	D484 F489	D484-E487 PolarHBondContact N-O 3.35Å; D484-E487 PolarHBondContact O-N 2.91Å; E487-F489 HydrophobicContact CB-CE2 3.78Å; E487-F489 HydrophobicContact CB-CZ 4.23Å
488	L	87.4	Confident	90.5	Very high	88 Å²	88	71.7 Å²	71.7	46%	0.461	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	113.1	-172.7	-175	67.6	0	0	0	111.7	P481	P481-L488 HydrophobicContact CB-CD1 3.71Å
489	F	92.1	Very high	90.4	Very high	44 Å²	44	68.5 Å²	68.5	19%	0.193	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	164.5	174.7	-60.8	-88.6	0	0	0	111.9	P481 V482 D484 E487 R498 F499 T500	P481-F489 CarbonylContact C-O 3.54Å; P481-F489 VanDerWaalsContact CA-O 3.3Å; P481-F489 WeakPolarHBondContact CA-O 3.36Å; V482-F489 HydrophobicContact CB-CB 4.47Å; V482-F489 PolarHBondContact N-O 3.43Å; V482-F489 PolarHBondContact O-N 3.06Å; D484-F489 HydrophobicContact CB-CD2 4.13Å; D484-F489 HydrophobicContact CB-CE2 4Å; E487-F489 HydrophobicContact CB-CE2 3.78Å; E487-F489 HydrophobicContact CB-CZ 4.23Å; F489-R498 HydrophobicContact CB-CB 4.13Å; F489-R498 HydrophobicContact CD1-CB 4.18Å; F489-R498 HydrophobicContact CG-CB 4.27Å; F489-F499 CarbonylContact C-O 3.46Å; F489-F499 VanDerWaalsContact CA-O 3.31Å; F489-F499 WeakPolarHBondContact CA-O 3.5Å; F489-T500 HydrophobicContact CD1-CG2 4.38Å; F489-T500 HydrophobicContact CE1-CG2 4.03Å
490	Y	93.8	Very high	90.1	Very high	35 Å²	35	72.5 Å²	72.5	14%	0.137	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.2	169.3	-63.5	-76	0	0	0	110.5	F464 I479 L480 F499 L502	F464-Y490 HydrophobicContact CD2-CD1 4.41Å; F464-Y490 HydrophobicContact CD2-CE1 4.01Å; F464-Y490 AromaticContact CE2-CE1 3.75Å; F464-Y490 HydrophobicContact CE2-CE1 3.75Å; I479-Y490 HydrophobicContact CG2-CD1 4.09Å; I479-Y490 HydrophobicContact CG2-CG 4.34Å; L480-Y490 WeakPolarHBondContact O-CA 3.4Å; Y490-F499 PolarHBondContact N-O 2.81Å; Y490-F499 WeakPolarHBondContact O-CD2 3.32Å; Y490-F499 PolarHBondContact O-N 2.81Å; Y490-L502 HydrophobicContact CD1-CD2 4.12Å; Y490-L502 HydrophobicContact CD2-CD2 4.31Å; Y490-L502 HydrophobicContact CG-CD2 4Å
491	S	94.8	Very high	90	Very high	2 Å²	2	72.4 Å²	72.4	1%	0.014	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	156.1	178	177.6	0	0	0	0	112	I479 L480 D493 G495 T497	I479-S491 WeakPolarHBondContact CA-O 3.32Å; L480-S491 PolarHBondContact N-O 3.12Å; L480-S491 PolarHBondContact O-N 3.09Å; S491-D493 PolarHBondContact OG-N 3.48Å; S491-D493 VanDerWaalsContact OG-N 3.11Å; S491-D493 PolarHBondContact OG-OD1 3.47Å; S491-G495 WeakPolarHBondContact OG-CA 3.3Å; S491-G495 PolarHBondContact OG-N 2.77Å; S491-T497 WeakPolarHBondContact CB-O 3.26Å; S491-T497 PolarHBondContact OG-O 2.89Å
492	L	95.4	Very high	90.1	Very high	24 Å²	24	69.7 Å²	69.7	13%	0.126	37%	0.367	C	S	.	.	S	Bend	trans	-115.5	2.8	173.6	-89.2	166.5	0	0	0	112.4	L466 F477 I479 L505 Y509	L466-L492 HydrophobicContact CD2-CD1 3.9Å; F477-L492 HydrophobicContact CB-CD2 3.51Å; I479-L492 HydrophobicContact CG1-CD1 4.36Å; I479-L492 HydrophobicContact CG1-CD2 3.73Å; I479-L492 HydrophobicContact CG1-CG 3.92Å; L492-L505 HydrophobicContact CD1-CD1 4.26Å; L492-L505 HydrophobicContact CD1-CD2 3.83Å; L492-L505 HydrophobicContact CD1-CG 4.27Å; L492-L505 HydrophobicContact CG-CD1 4.42Å; L492-Y509 HydrophobicContact CB-CE2 4.22Å; L492-Y509 HydrophobicContact CD1-CD2 3.87Å; L492-Y509 HydrophobicContact CD1-CE2 3.52Å; L492-Y509 HydrophobicContact CG-CE2 4.45Å
493	D	92.4	Very high	90.3	Very high	21 Å²	21	69.3 Å²	69.3	11%	0.112	36%	0.364	C	S	.	.	S	Bend	trans	-150.4	45.7	-164.8	61	-17.2	0	0	0	111.8	S491 G495 H496 T497 T515	S491-D493 PolarHBondContact OG-N 3.48Å; S491-D493 VanDerWaalsContact OG-N 3.11Å; S491-D493 PolarHBondContact OG-OD1 3.47Å; D493-G495 PolarHBondContact O-N 2.87Å; D493-G495 VanDerWaalsContact O-N 3.17Å; D493-H496 WeakPolarHBondContact O-CB 3.5Å; D493-H496 PolarHBondContact O-CD2 3.08Å; D493-H496 VanDerWaalsContact O-CD2 3.24Å; D493-H496 PolarHBondContact O-N 3.02Å; D493-T497 VanDerWaalsContact CG-N 3.32Å; D493-T497 WeakPolarHBondContact OD1-CA 3.19Å; D493-T497 WeakPolarHBondContact OD1-CB 3.26Å; D493-T497 PolarHBondContact OD1-N 2.81Å; D493-T497 VanDerWaalsContact OD1-O 3.09Å; D493-T497 VanDerWaalsContact OD2-CB 3.25Å; D493-T497 WeakPolarHBondContact OD2-CB 3.46Å; D493-T497 PolarHBondContact OD2-N 2.82Å; D493-T497 VanDerWaalsContact OD2-N 3.16Å; D493-T497 PolarHBondContact OD2-OG1 3.36Å; D493-T515 HydrophobicContact CB-CG2 3.55Å
494	D	87.1	Confident	90.6	Very high	153 Å²	153	67.7 Å²	67.7	82%	0.818	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	33	173	-144.3	33.5	0	0	0	114.5
495	G	88.5	Confident	91.1	Very high	19 Å²	19	64.4 Å²	64.4	20%	0.196	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	0.5	179.5	0	0	0	0	0	115.3	S491 D493 R498	S491-G495 WeakPolarHBondContact OG-CA 3.3Å; S491-G495 PolarHBondContact OG-N 2.77Å; D493-G495 PolarHBondContact O-N 2.87Å; D493-G495 VanDerWaalsContact O-N 3.17Å; G495-R498 WeakPolarHBondContact O-CD 3.33Å; G495-R498 WeakPolarHBondContact O-CG 3.5Å
496	H	88.3	Confident	91.5	Very high	166 Å²	166	55 Å²	55	77%	0.769	29%	0.291	S	S	*	.	S	Bend	trans	-64.8	-44.9	175.3	-70.7	-47	0	0	0	112.6	D493	D493-H496 WeakPolarHBondContact O-CB 3.5Å; D493-H496 PolarHBondContact O-CD2 3.08Å; D493-H496 VanDerWaalsContact O-CD2 3.24Å; D493-H496 PolarHBondContact O-N 3.02Å
497	T	93	Very high	92	Very high	39 Å²	39	57.6 Å²	57.6	24%	0.239	29%	0.287	C	S	.	.	S	Bend	trans	-111.8	127.6	170.2	-41.8	0	0	0	0	108.9	S491 D493 F499 F508	S491-T497 WeakPolarHBondContact CB-O 3.26Å; S491-T497 PolarHBondContact OG-O 2.89Å; D493-T497 VanDerWaalsContact CG-N 3.32Å; D493-T497 WeakPolarHBondContact OD1-CA 3.19Å; D493-T497 WeakPolarHBondContact OD1-CB 3.26Å; D493-T497 PolarHBondContact OD1-N 2.81Å; D493-T497 VanDerWaalsContact OD1-O 3.09Å; D493-T497 VanDerWaalsContact OD2-CB 3.25Å; D493-T497 WeakPolarHBondContact OD2-CB 3.46Å; D493-T497 PolarHBondContact OD2-N 2.82Å; D493-T497 VanDerWaalsContact OD2-N 3.16Å; D493-T497 PolarHBondContact OD2-OG1 3.36Å; T497-F499 HydrophobicContact CG2-CE1 3.97Å; T497-F499 HydrophobicContact CG2-CE2 3.85Å; T497-F499 HydrophobicContact CG2-CZ 3.34Å; T497-F508 HydrophobicContact CG2-CE1 4.21Å; T497-F508 HydrophobicContact CG2-CZ 4.15Å
498	R	93.5	Very high	92.5	Very high	106 Å²	106	54 Å²	54	40%	0.4	27%	0.27	S	S	.	.			trans	-125.7	136.8	-170.8	-59.7	-172.1	-71.5	150.1	-13.7	110.6	D484 F489 G495	D484-R498 VanDerWaalsContact CB-NH1 3.3Å; D484-R498 VanDerWaalsContact CG-NH1 3.29Å; D484-R498 IonicContact OD2-CZ 3.47Å; D484-R498 IonicContact OD2-NH1 3.6Å; D484-R498 PolarHBondContact OD2-NH1 3.29Å; D484-R498 IonicContact OD2-NH2 3.18Å; D484-R498 PolarHBondContact OD2-NH2 3.36Å; F489-R498 HydrophobicContact CB-CB 4.13Å; F489-R498 HydrophobicContact CD1-CB 4.18Å; F489-R498 HydrophobicContact CG-CB 4.27Å; G495-R498 WeakPolarHBondContact O-CD 3.33Å; G495-R498 WeakPolarHBondContact O-CG 3.5Å
499	F	93.7	Very high	92.9	Very high	7 Å²	7	49.9 Å²	49.9	3%	0.031	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-129.2	140.6	-177.3	-52.6	-77	0	0	0	110.6	F489 Y490 T497 D501 Q504 L505 F508 Y509	F489-F499 CarbonylContact C-O 3.46Å; F489-F499 VanDerWaalsContact CA-O 3.31Å; F489-F499 WeakPolarHBondContact CA-O 3.5Å; Y490-F499 PolarHBondContact N-O 2.81Å; Y490-F499 WeakPolarHBondContact O-CD2 3.32Å; Y490-F499 PolarHBondContact O-N 2.81Å; T497-F499 HydrophobicContact CG2-CE1 3.97Å; T497-F499 HydrophobicContact CG2-CE2 3.85Å; T497-F499 HydrophobicContact CG2-CZ 3.34Å; F499-D501 VanDerWaalsContact C-N 3.28Å; F499-D501 PolarHBondContact O-N 3.46Å; F499-Q504 HydrophobicContact CB-CB 4.45Å; F499-Q504 HydrophobicContact CD1-CG 4.13Å; F499-L505 HydrophobicContact CB-CB 3.95Å; F499-L505 HydrophobicContact CD1-CB 4.29Å; F499-L505 HydrophobicContact CD2-CB 3.66Å; F499-L505 HydrophobicContact CD2-CD1 3.79Å; F499-L505 HydrophobicContact CD2-CG 3.67Å; F499-L505 HydrophobicContact CE2-CB 4.24Å; F499-L505 HydrophobicContact CE2-CD1 4.29Å; F499-L505 HydrophobicContact CE2-CG 3.92Å; F499-L505 HydrophobicContact CG-CB 3.68Å; F499-L505 HydrophobicContact CG-CG 4.23Å; F499-F508 HydrophobicContact CD1-CB 4.34Å; F499-F508 HydrophobicContact CE1-CB 3.43Å; F499-F508 VanDerWaalsContact CE1-CB 3.43Å; F499-F508 AromaticContact CE1-CD1 3.83Å; F499-F508 HydrophobicContact CE1-CD1 3.83Å; F499-F508 HydrophobicContact CE1-CD2 4.07Å; F499-F508 AromaticContact CE1-CG 3.5Å; F499-F508 HydrophobicContact CE1-CG 3.5Å; F499-F508 HydrophobicContact CZ-CB 3.95Å; F499-F508 AromaticContact CZ-CD1 3.49Å; F499-F508 HydrophobicContact CZ-CD1 3.49Å; F499-F508 VanDerWaalsContact CZ-CD1 3.49Å; F499-F508 HydrophobicContact CZ-CD2 4.46Å; F499-F508 HydrophobicContact CZ-CE1 4.08Å; F499-F508 AromaticContact CZ-CG 3.71Å; F499-F508 HydrophobicContact CZ-CG 3.71Å; F499-Y509 HydrophobicContact CE2-CD2 4.41Å; F499-Y509 AromaticContact CE2-CE2 3.77Å; F499-Y509 HydrophobicContact CE2-CE2 3.77Å; F499-Y509 HydrophobicContact CZ-CD2 4.27Å; F499-Y509 AromaticContact CZ-CE2 3.83Å; F499-Y509 HydrophobicContact CZ-CE2 3.83Å
500	T	91.4	Very high	92.9	Very high	85 Å²	85	51.4 Å²	51.4	52%	0.521	26%	0.256	S	S	.	.	S	Bend	trans	-71	-26	178.6	53.1	0	0	0	0	112.5	F489 Q504	F489-T500 HydrophobicContact CD1-CG2 4.38Å; F489-T500 HydrophobicContact CE1-CG2 4.03Å; T500-Q504 PolarHBondContact OG1-OE1 2.96Å
501	D	91.2	Very high	92.6	Very high	60 Å²	60	55.7 Å²	55.7	32%	0.321	28%	0.281	S	S	.	.	S	Bend	trans	-152.7	174.4	175.1	64.9	55.1	0	0	0	112.4	F499 I503 Q504 L505	F499-D501 VanDerWaalsContact C-N 3.28Å; F499-D501 PolarHBondContact O-N 3.46Å; D501-I503 VanDerWaalsContact C-N 3.27Å; D501-I503 PolarHBondContact O-N 3.26Å; D501-I503 VanDerWaalsContact OD1-CA 3.26Å; D501-I503 WeakPolarHBondContact OD1-CA 3.37Å; D501-I503 WeakPolarHBondContact OD1-CB 3.5Å; D501-I503 PolarHBondContact OD1-N 3.22Å; D501-Q504 PolarHBondContact OD1-N 2.82Å; D501-L505 PolarHBondContact O-N 3.27Å
502	L	93.1	Very high	92.2	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-69.4	-20	179.4	-59.7	-176.7	0	0	0	113.9	H423 W428 F429 L454 F464 I479 Y490 V506	H423-L502 HydrophobicContact CB-CB 4.17Å; H423-L502 HydrophobicContact CB-CD1 4.16Å; W428-L502 HydrophobicContact CH2-CB 3.84Å; W428-L502 WeakPolarHBondContact CH2-O 3.47Å; W428-L502 HydrophobicContact CZ3-CB 4.23Å; F429-L502 HydrophobicContact CD2-CD1 4.45Å; F429-L502 HydrophobicContact CE2-CD1 4.22Å; L454-L502 HydrophobicContact CD2-CB 4.27Å; L454-L502 HydrophobicContact CD2-CD1 4.28Å; L454-L502 HydrophobicContact CD2-CD2 4.37Å; F464-L502 HydrophobicContact CD1-CD1 4.08Å; F464-L502 HydrophobicContact CD2-CD1 3.74Å; F464-L502 HydrophobicContact CD2-CD2 3.88Å; F464-L502 HydrophobicContact CD2-CG 4.28Å; F464-L502 HydrophobicContact CE1-CD1 4.17Å; F464-L502 HydrophobicContact CE2-CD1 3.83Å; F464-L502 HydrophobicContact CE2-CD2 4.37Å; F464-L502 HydrophobicContact CE2-CG 4.38Å; F464-L502 HydrophobicContact CG-CD1 3.86Å; F464-L502 HydrophobicContact CG-CD2 4.41Å; F464-L502 HydrophobicContact CZ-CD1 4.04Å; I479-L502 HydrophobicContact CD1-CD2 4.19Å; I479-L502 HydrophobicContact CG2-CD2 3.92Å; Y490-L502 HydrophobicContact CD1-CD2 4.12Å; Y490-L502 HydrophobicContact CD2-CD2 4.31Å; Y490-L502 HydrophobicContact CG-CD2 4Å; L502-V506 WeakPolarHBondContact O-CB 3.36Å; L502-V506 VanDerWaalsContact O-CG2 3.26Å; L502-V506 WeakPolarHBondContact O-CG2 3.46Å; L502-V506 PolarHBondContact O-N 3.22Å
503	I	93.8	Very high	92	Very high	28 Å²	28	65 Å²	65	14%	0.144	32%	0.319	C	S	.	.	H	α-helix	trans	-75.5	-50.8	179.7	-47.2	178.2	0	0	0	108.7	I422 Q426 W428 D501 L505 V506 E507	I422-I503 HydrophobicContact CB-CD1 4.14Å; I422-I503 HydrophobicContact CG2-CD1 3.76Å; Q426-I503 HydrophobicContact CG-CD1 4.42Å; Q426-I503 HydrophobicContact CG-CG1 4.37Å; W428-I503 HydrophobicContact CH2-CG1 4.25Å; W428-I503 HydrophobicContact CZ2-CB 4.29Å; W428-I503 HydrophobicContact CZ2-CG1 4Å; W428-I503 HydrophobicContact CZ2-CG2 4.44Å; D501-I503 VanDerWaalsContact C-N 3.27Å; D501-I503 PolarHBondContact O-N 3.26Å; D501-I503 VanDerWaalsContact OD1-CA 3.26Å; D501-I503 WeakPolarHBondContact OD1-CA 3.37Å; D501-I503 WeakPolarHBondContact OD1-CB 3.5Å; D501-I503 PolarHBondContact OD1-N 3.22Å; I503-L505 VanDerWaalsContact C-N 3.25Å; I503-L505 PolarHBondContact O-N 3.19Å; I503-V506 PolarHBondContact O-N 3.36Å; I503-V506 VanDerWaalsContact O-N 3.07Å; I503-E507 WeakPolarHBondContact O-CG 3.41Å; I503-E507 PolarHBondContact O-N 3.28Å
504	Q	94.1	Very high	92	Very high	83 Å²	83	66.3 Å²	66.3	39%	0.388	34%	0.338	S	S	.	.	H	α-helix	trans	-57.6	-39.5	174.3	-167.6	-168.7	43.3	0	0	111.8	F499 T500 D501 F508	F499-Q504 HydrophobicContact CB-CB 4.45Å; F499-Q504 HydrophobicContact CD1-CG 4.13Å; T500-Q504 PolarHBondContact OG1-OE1 2.96Å; D501-Q504 PolarHBondContact OD1-N 2.82Å; Q504-F508 WeakPolarHBondContact O-CB 3.18Å; Q504-F508 PolarHBondContact O-N 2.9Å
505	L	96	Very high	92.2	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.8	-49.8	173.1	-177.2	158.8	0	0	0	111.5	I479 L492 F499 D501 I503 F508 Y509	I479-L505 HydrophobicContact CD1-CD1 4.19Å; I479-L505 HydrophobicContact CD1-CD2 4.22Å; I479-L505 HydrophobicContact CG1-CD1 4.23Å; I479-L505 HydrophobicContact CG2-CD1 3.62Å; L492-L505 HydrophobicContact CD1-CD1 4.26Å; L492-L505 HydrophobicContact CD1-CD2 3.83Å; L492-L505 HydrophobicContact CD1-CG 4.27Å; L492-L505 HydrophobicContact CG-CD1 4.42Å; F499-L505 HydrophobicContact CB-CB 3.95Å; F499-L505 HydrophobicContact CD1-CB 4.29Å; F499-L505 HydrophobicContact CD2-CB 3.66Å; F499-L505 HydrophobicContact CD2-CD1 3.79Å; F499-L505 HydrophobicContact CD2-CG 3.67Å; F499-L505 HydrophobicContact CE2-CB 4.24Å; F499-L505 HydrophobicContact CE2-CD1 4.29Å; F499-L505 HydrophobicContact CE2-CG 3.92Å; F499-L505 HydrophobicContact CG-CB 3.68Å; F499-L505 HydrophobicContact CG-CG 4.23Å; D501-L505 PolarHBondContact O-N 3.27Å; I503-L505 VanDerWaalsContact C-N 3.25Å; I503-L505 PolarHBondContact O-N 3.19Å; L505-F508 PolarHBondContact O-N 3.05Å; L505-Y509 HydrophobicContact CD2-CD2 4.07Å; L505-Y509 HydrophobicContact CG-CD2 4.17Å; L505-Y509 HydrophobicContact CG-CE2 4.4Å; L505-Y509 WeakPolarHBondContact O-CD2 3.31Å; L505-Y509 PolarHBondContact O-N 2.89Å
506	V	95.5	Very high	92.6	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-65.3	-42.9	-179.7	166.4	0	0	0	0	111.5	W428 F452 L454 L502 I503 Y509 Q510 L520	W428-V506 HydrophobicContact CD2-CG1 4.38Å; W428-V506 HydrophobicContact CD2-CG2 4.14Å; W428-V506 HydrophobicContact CE3-CG2 4.13Å; W428-V506 HydrophobicContact CG-CG1 4.49Å; W428-V506 HydrophobicContact CH2-CG2 4.03Å; W428-V506 HydrophobicContact CZ2-CB 4.13Å; W428-V506 HydrophobicContact CZ2-CG1 4.44Å; W428-V506 HydrophobicContact CZ2-CG2 4.02Å; W428-V506 HydrophobicContact CZ3-CG2 4.1Å; F452-V506 HydrophobicContact CE2-CG1 3.96Å; F452-V506 HydrophobicContact CE2-CG2 4.26Å; F452-V506 HydrophobicContact CZ-CG1 3.79Å; L454-V506 HydrophobicContact CD1-CG2 3.69Å; L454-V506 HydrophobicContact CD2-CG2 3.98Å; L502-V506 WeakPolarHBondContact O-CB 3.36Å; L502-V506 VanDerWaalsContact O-CG2 3.26Å; L502-V506 WeakPolarHBondContact O-CG2 3.46Å; L502-V506 PolarHBondContact O-N 3.22Å; I503-V506 PolarHBondContact O-N 3.36Å; I503-V506 VanDerWaalsContact O-N 3.07Å; V506-Y509 PolarHBondContact O-N 3.16Å; V506-Q510 HydrophobicContact CG1-CG 4.42Å; V506-Q510 VanDerWaalsContact O-CG 3.28Å; V506-Q510 WeakPolarHBondContact O-CG 3.07Å; V506-Q510 PolarHBondContact O-N 2.96Å; V506-L520 HydrophobicContact CG1-CD1 4.39Å
507	E	92.8	Very high	92.8	Very high	110 Å²	110	54.6 Å²	54.6	51%	0.514	28%	0.28	S	S	.	.	H	α-helix	trans	-61.1	-46.4	176.2	-71.9	175.1	177.8	0	0	111.7	I503 Y509 Q510 L511	I503-E507 WeakPolarHBondContact O-CG 3.41Å; I503-E507 PolarHBondContact O-N 3.28Å; E507-Y509 PolarHBondContact O-N 3.41Å; E507-Q510 PolarHBondContact O-N 3.5Å; E507-L511 PolarHBondContact O-N 2.82Å
508	F	94.9	Very high	92.7	Very high	63 Å²	63	53.5 Å²	53.5	28%	0.276	27%	0.273	S	S	.	.	H	α-helix	trans	-58.1	-46.6	175.9	175.7	-90.5	0	0	0	111.9	T497 F499 Q504 L505 Q510 L511 N512	T497-F508 HydrophobicContact CG2-CE1 4.21Å; T497-F508 HydrophobicContact CG2-CZ 4.15Å; F499-F508 HydrophobicContact CD1-CB 4.34Å; F499-F508 HydrophobicContact CE1-CB 3.43Å; F499-F508 VanDerWaalsContact CE1-CB 3.43Å; F499-F508 AromaticContact CE1-CD1 3.83Å; F499-F508 HydrophobicContact CE1-CD1 3.83Å; F499-F508 HydrophobicContact CE1-CD2 4.07Å; F499-F508 AromaticContact CE1-CG 3.5Å; F499-F508 HydrophobicContact CE1-CG 3.5Å; F499-F508 HydrophobicContact CZ-CB 3.95Å; F499-F508 AromaticContact CZ-CD1 3.49Å; F499-F508 HydrophobicContact CZ-CD1 3.49Å; F499-F508 VanDerWaalsContact CZ-CD1 3.49Å; F499-F508 HydrophobicContact CZ-CD2 4.46Å; F499-F508 HydrophobicContact CZ-CE1 4.08Å; F499-F508 AromaticContact CZ-CG 3.71Å; F499-F508 HydrophobicContact CZ-CG 3.71Å; Q504-F508 WeakPolarHBondContact O-CB 3.18Å; Q504-F508 PolarHBondContact O-N 2.9Å; L505-F508 PolarHBondContact O-N 3.05Å; F508-Q510 VanDerWaalsContact C-N 3.33Å; F508-Q510 PolarHBondContact O-N 2.8Å; F508-L511 PolarHBondContact O-N 2.79Å; F508-N512 HydrophobicContact CD1-CB 4.4Å; F508-N512 HydrophobicContact CE1-CB 4.04Å; F508-N512 HydrophobicContact CE2-CB 4.29Å; F508-N512 HydrophobicContact CZ-CB 3.98Å; F508-N512 WeakPolarHBondContact O-CA 3.44Å; F508-N512 VanDerWaalsContact O-CB 3.3Å; F508-N512 WeakPolarHBondContact O-CB 3.4Å; F508-N512 PolarHBondContact O-N 2.92Å; F508-N512 PolarHBondContact O-ND2 2.96Å; F508-N512 VanDerWaalsContact O-ND2 3.08Å
509	Y	95.8	Very high	92.7	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-80.1	-8.8	-178.4	-80.1	-72.4	0	0	0	114.4	L492 F499 L505 V506 E507 N512 R513 T515 L516 L520	L492-Y509 HydrophobicContact CB-CE2 4.22Å; L492-Y509 HydrophobicContact CD1-CD2 3.87Å; L492-Y509 HydrophobicContact CD1-CE2 3.52Å; L492-Y509 HydrophobicContact CG-CE2 4.45Å; F499-Y509 HydrophobicContact CE2-CD2 4.41Å; F499-Y509 AromaticContact CE2-CE2 3.77Å; F499-Y509 HydrophobicContact CE2-CE2 3.77Å; F499-Y509 HydrophobicContact CZ-CD2 4.27Å; F499-Y509 AromaticContact CZ-CE2 3.83Å; F499-Y509 HydrophobicContact CZ-CE2 3.83Å; L505-Y509 HydrophobicContact CD2-CD2 4.07Å; L505-Y509 HydrophobicContact CG-CD2 4.17Å; L505-Y509 HydrophobicContact CG-CE2 4.4Å; L505-Y509 WeakPolarHBondContact O-CD2 3.31Å; L505-Y509 PolarHBondContact O-N 2.89Å; V506-Y509 PolarHBondContact O-N 3.16Å; E507-Y509 PolarHBondContact O-N 3.41Å; Y509-N512 CarbonylContact C-O 3.52Å; Y509-N512 WeakPolarHBondContact CA-O 3.36Å; Y509-N512 VanDerWaalsContact O-O 3.06Å; Y509-R513 WeakPolarHBondContact CD1-O 3.11Å; Y509-R513 WeakPolarHBondContact CE1-O 3.38Å; Y509-T515 PolarHBondContact OH-OG1 2.6Å; Y509-L516 HydrophobicContact CD1-CB 4.42Å; Y509-L516 HydrophobicContact CD1-CD1 3.35Å; Y509-L516 HydrophobicContact CD1-CG 3.64Å; Y509-L516 HydrophobicContact CE1-CD1 3.94Å; Y509-L516 HydrophobicContact CE1-CG 3.7Å; Y509-L516 HydrophobicContact CG-CD1 3.72Å; Y509-L516 HydrophobicContact CG-CG 4.4Å; Y509-L520 WeakPolarHBondContact O-CG 3.15Å; Y509-L520 PolarHBondContact O-N 3.33Å
510	Q	91.7	Very high	92.8	Very high	76 Å²	76	54.8 Å²	54.8	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-76.2	-42.4	164	-77.4	174	10	0	0	111.4	V506 E507 F508 L520	V506-Q510 HydrophobicContact CG1-CG 4.42Å; V506-Q510 VanDerWaalsContact O-CG 3.28Å; V506-Q510 WeakPolarHBondContact O-CG 3.07Å; V506-Q510 PolarHBondContact O-N 2.96Å; E507-Q510 PolarHBondContact O-N 3.5Å; F508-Q510 VanDerWaalsContact C-N 3.33Å; F508-Q510 PolarHBondContact O-N 2.8Å; Q510-L520 WeakPolarHBondContact CA-O 3.38Å; Q510-L520 HydrophobicContact CG-CB 3.74Å
511	L	87.4	Confident	92.7	Very high	126 Å²	126	56 Å²	56	66%	0.66	28%	0.277	S	S	*	.	H	α-helix	trans	-77.1	-43.5	179.1	-63.9	176	0	0	0	112.2	E507 F508 R519	E507-L511 PolarHBondContact O-N 2.82Å; F508-L511 PolarHBondContact O-N 2.79Å; L511-R519 WeakPolarHBondContact O-CD 3.46Å; L511-R519 PolarHBondContact O-NH1 3.36Å; L511-R519 VanDerWaalsContact O-NH1 3.08Å
512	N	87.5	Confident	92.5	Very high	74 Å²	74	54.8 Å²	54.8	40%	0.396	27%	0.269	S	S	.	.			trans	-114.7	149.1	-171.1	-55.5	-77.3	0	0	0	111.5	F508 Y509	F508-N512 HydrophobicContact CD1-CB 4.4Å; F508-N512 HydrophobicContact CE1-CB 4.04Å; F508-N512 HydrophobicContact CE2-CB 4.29Å; F508-N512 HydrophobicContact CZ-CB 3.98Å; F508-N512 WeakPolarHBondContact O-CA 3.44Å; F508-N512 VanDerWaalsContact O-CB 3.3Å; F508-N512 WeakPolarHBondContact O-CB 3.4Å; F508-N512 PolarHBondContact O-N 2.92Å; F508-N512 PolarHBondContact O-ND2 2.96Å; F508-N512 VanDerWaalsContact O-ND2 3.08Å; Y509-N512 CarbonylContact C-O 3.52Å; Y509-N512 WeakPolarHBondContact CA-O 3.36Å; Y509-N512 VanDerWaalsContact O-O 3.06Å
513	R	90.4	Very high	92.3	Very high	147 Å²	147	56.8 Å²	56.8	56%	0.555	28%	0.278	S	S	*	.			trans	-77.5	-39.3	174.6	177.2	178.9	159.2	178.9	-5.7	112.3	Y509 T515 L516 P517 R519	Y509-R513 WeakPolarHBondContact CD1-O 3.11Å; Y509-R513 WeakPolarHBondContact CE1-O 3.38Å; R513-T515 PolarHBondContact O-N 3.11Å; R513-L516 WeakPolarHBondContact CG-O 3.21Å; R513-L516 PolarHBondContact NE-O 2.96Å; R513-L516 WeakPolarHBondContact O-CB 3.31Å; R513-L516 PolarHBondContact O-N 2.96Å; R513-L516 VanDerWaalsContact O-N 3.09Å; R513-P517 PolarHBondContact NE-O 2.71Å; R513-P517 VanDerWaalsContact NE-O 3.12Å; R513-P517 PolarHBondContact NH1-O 2.96Å; R513-R519 HydrophobicContact CB-CG 4.21Å
514	G	91.6	Very high	91.8	Very high	48 Å²	48	55.5 Å²	55.5	50%	0.495	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	-134	-172.4	0	0	0	0	0	112.3	L516	G514-L516 VanDerWaalsContact C-N 3.33Å
515	T	92.3	Very high	90.8	Very high	78 Å²	78	53.6 Å²	53.6	48%	0.479	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.8	177.3	53.2	0	0	0	0	115	D493 Y509 R513	D493-T515 HydrophobicContact CB-CG2 3.55Å; Y509-T515 PolarHBondContact OH-OG1 2.6Å; R513-T515 PolarHBondContact O-N 3.11Å
516	L	95.9	Very high	89.2	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	29%	0.286	C	S	.	.	S	Bend	trans	-72.1	160.4	179.2	-61	-179	0	0	0	111.7	L466 L468 F477 Y509 R513 G514 C518 L520	L466-L516 HydrophobicContact CD2-CD1 3.7Å; L466-L516 HydrophobicContact CD2-CD2 3.75Å; L466-L516 HydrophobicContact CD2-CG 4.39Å; L468-L516 HydrophobicContact CD2-CB 4.23Å; L468-L516 HydrophobicContact CD2-CD1 4.16Å; L468-L516 HydrophobicContact CD2-CD2 4.36Å; L468-L516 HydrophobicContact CD2-CG 4.49Å; F477-L516 HydrophobicContact CD1-CD2 3.99Å; F477-L516 HydrophobicContact CD2-CD2 3.83Å; F477-L516 HydrophobicContact CE1-CD2 4.14Å; F477-L516 HydrophobicContact CE2-CD2 4Å; F477-L516 HydrophobicContact CG-CD2 3.84Å; F477-L516 HydrophobicContact CZ-CD2 4.16Å; Y509-L516 HydrophobicContact CD1-CB 4.42Å; Y509-L516 HydrophobicContact CD1-CD1 3.35Å; Y509-L516 HydrophobicContact CD1-CG 3.64Å; Y509-L516 HydrophobicContact CE1-CD1 3.94Å; Y509-L516 HydrophobicContact CE1-CG 3.7Å; Y509-L516 HydrophobicContact CG-CD1 3.72Å; Y509-L516 HydrophobicContact CG-CG 4.4Å; R513-L516 WeakPolarHBondContact CG-O 3.21Å; R513-L516 PolarHBondContact NE-O 2.96Å; R513-L516 WeakPolarHBondContact O-CB 3.31Å; R513-L516 PolarHBondContact O-N 2.96Å; R513-L516 VanDerWaalsContact O-N 3.09Å; G514-L516 VanDerWaalsContact C-N 3.33Å; L516-C518 WeakPolarHBondContact CB-O 3.43Å; L516-L520 HydrophobicContact CD1-CD2 3.9Å; L516-L520 HydrophobicContact CD1-CG 4.22Å
517	P	93.1	Very high	87.2	Confident	13 Å²	13	59.2 Å²	59.2	8%	0.084	29%	0.29	C	S	.	.	S	Bend	trans	-70.8	-31.5	176	30.1	-38.4	0	0	0	112.8	L468 H470 K475 F477 R513	L468-P517 HydrophobicContact CD2-CG 4.06Å; H470-P517 HydrophobicContact CB-CB 4.1Å; H470-P517 HydrophobicContact CB-CG 3.78Å; K475-P517 HydrophobicContact CD-CG 4.28Å; F477-P517 VanDerWaalsContact CZ-CD 3.47Å; F477-P517 HydrophobicContact CZ-CG 4.14Å; R513-P517 PolarHBondContact NE-O 2.71Å; R513-P517 VanDerWaalsContact NE-O 3.12Å; R513-P517 PolarHBondContact NH1-O 2.96Å
518	C	91.2	Very high	85.3	Confident	16 Å²	16	58.3 Å²	58.3	11%	0.108	29%	0.292	C	S	.	.	S	Bend	trans	-146.6	171.3	173.3	62.9	0	0	0	0	110.1	L516	L516-C518 WeakPolarHBondContact CB-O 3.43Å
519	R	93.4	Very high	82.9	Confident	137 Å²	137	57.1 Å²	57.1	52%	0.517	29%	0.289	S	S	.	.			trans	-69.9	148.6	172.5	-64	-170.5	-73.7	-175.5	-2.6	111.1	G450 L511 R513	G450-R519 WeakPolarHBondContact CA-O 3.25Å; L511-R519 WeakPolarHBondContact O-CD 3.46Å; L511-R519 PolarHBondContact O-NH1 3.36Å; L511-R519 VanDerWaalsContact O-NH1 3.08Å; R513-R519 HydrophobicContact CB-CG 4.21Å
520	L	95.9	Very high	82.3	Confident	4 Å²	4	60 Å²	60	2%	0.021	30%	0.303	C	S	.	.			trans	-66.6	131.4	166.5	-53.4	-176.4	0	0	0	108.7	F452 L466 L468 V506 Y509 Q510 L516	F452-L520 HydrophobicContact CB-CD2 3.88Å; F452-L520 HydrophobicContact CD1-CB 3.74Å; F452-L520 HydrophobicContact CD1-CD2 4.07Å; F452-L520 HydrophobicContact CD1-CG 4.3Å; F452-L520 HydrophobicContact CD2-CD1 4.08Å; F452-L520 HydrophobicContact CD2-CD2 4.21Å; F452-L520 HydrophobicContact CE1-CB 3.74Å; F452-L520 HydrophobicContact CE1-CD1 4.44Å; F452-L520 HydrophobicContact CE2-CD1 3.99Å; F452-L520 HydrophobicContact CG-CB 4.29Å; F452-L520 HydrophobicContact CG-CD1 4.35Å; F452-L520 HydrophobicContact CG-CD2 3.8Å; F452-L520 HydrophobicContact CG-CG 4.35Å; F452-L520 HydrophobicContact CZ-CB 4.26Å; F452-L520 HydrophobicContact CZ-CD1 4.18Å; L466-L520 HydrophobicContact CD1-CD1 4.46Å; L466-L520 HydrophobicContact CD1-CD2 3.96Å; L466-L520 HydrophobicContact CD2-CD2 4.22Å; L468-L520 HydrophobicContact CD1-CD2 3.91Å; L468-L520 HydrophobicContact CD2-CD2 4.15Å; V506-L520 HydrophobicContact CG1-CD1 4.39Å; Y509-L520 WeakPolarHBondContact O-CG 3.15Å; Y509-L520 PolarHBondContact O-N 3.33Å; Q510-L520 WeakPolarHBondContact CA-O 3.38Å; Q510-L520 HydrophobicContact CG-CB 3.74Å; L516-L520 HydrophobicContact CD1-CD2 3.9Å; L516-L520 HydrophobicContact CD1-CG 4.22Å
521	K	88.4	Confident	81.8	Confident	110 Å²	110	59.2 Å²	59.2	48%	0.478	30%	0.3	S	S	.	.			trans	-125.2	-41.6	-178.3	-58	-179.5	-158.5	157.6	0	112.8	D449 G450	D449-K521 WeakPolarHBondContact O-CD 3.44Å; D449-K521 VanDerWaalsContact O-CE 3.23Å; D449-K521 WeakPolarHBondContact O-CE 3.3Å; D449-K521 PolarHBondContact O-NZ 3.05Å; G450-K521 PolarHBondContact O-N 2.84Å
522	H	87.9	Confident	81.5	Confident	35 Å²	35	55.4 Å²	55.4	16%	0.162	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	128.2	-166.4	-56.6	-43.1	0	0	0	108.6	Y186 G450 V451 F452	Y186-H522 HydrophobicContact CD1-CB 4.44Å; Y186-H522 AromaticContact CD1-ND1 3.78Å; Y186-H522 HydrophobicContact CD2-CB 3.66Å; Y186-H522 AromaticContact CD2-CG 3.74Å; Y186-H522 HydrophobicContact CE1-CB 4.42Å; Y186-H522 HydrophobicContact CE2-CB 3.62Å; Y186-H522 HydrophobicContact CG-CB 4.06Å; Y186-H522 AromaticContact CG-CG 3.67Å; Y186-H522 AromaticContact CG-ND1 3.73Å; G450-H522 PolarHBondContact O-N 2.65Å; G450-H522 VanDerWaalsContact O-N 3.11Å; V451-H522 CarbonylContact C-O 3.58Å; V451-H522 VanDerWaalsContact CA-O 3.24Å; V451-H522 WeakPolarHBondContact CA-O 3.47Å; V451-H522 HydrophobicContact CG2-CB 4.07Å; F452-H522 WeakPolarHBondContact CD1-O 3.36Å; F452-H522 PolarHBondContact N-O 3.05Å
523	H	88.6	Confident	81.1	Confident	42 Å²	42	54.4 Å²	54.4	19%	0.194	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	144.1	176.6	56.1	-90.9	0	0	0	111.2	Y186 P427 W428 F452 I525	Y186-H523 PolarHBondContact OH-O 2.81Å; P427-H523 WeakPolarHBondContact CG-NE2 3.46Å; W428-H523 HydrophobicContact CB-CB 3.48Å; W428-H523 VanDerWaalsContact CB-CB 3.48Å; F452-H523 HydrophobicContact CD1-CB 4.44Å; F452-H523 HydrophobicContact CE1-CB 3.91Å; F452-H523 HydrophobicContact CE2-CB 4.45Å; F452-H523 HydrophobicContact CZ-CB 3.91Å; F452-H523 CarbonylContact O-C 3.51Å; F452-H523 VanDerWaalsContact O-CA 3.28Å; F452-H523 WeakPolarHBondContact O-CA 3.49Å; H523-I525 VanDerWaalsContact CD2-CG1 3.49Å; H523-I525 WeakPolarHBondContact CD2-CG1 3.43Å
524	C	84.5	Confident	80.5	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.007	26%	0.256	C	S	.	.			trans	-68.3	137.3	167.1	-60	0	0	0	0	109.4	H430 V451 F452 L453	H430-C524 PolarHBondContact CE1-O 3.17Å; H430-C524 PolarHBondContact NE2-O 3.24Å; V451-C524 WeakPolarHBondContact CG1-SG 3.38Å; F452-C524 PolarHBondContact O-N 3.14Å; L453-C524 HydrophobicContact CB-CB 4.32Å; L453-C524 HydrophobicContact CD2-CB 3.99Å
525	I	71.9	Confident	79.8	Confident	42 Å²	42	48.6 Å²	48.6	22%	0.215	24%	0.24	C	C	.	.			trans	-121	123.4	169.1	-59	-172.9	0	0	0	105.7	K184 P427 H523 I527	K184-I525 VanDerWaalsContact NZ-CD1 3.35Å; P427-I525 HydrophobicContact CB-CD1 4.14Å; P427-I525 HydrophobicContact CB-CG1 4.24Å; H523-I525 VanDerWaalsContact CD2-CG1 3.49Å; H523-I525 WeakPolarHBondContact CD2-CG1 3.43Å; I525-I527 PolarHBondContact O-N 2.93Å
526	Q	62.3	Low	78.9	Confident	103 Å²	103	46.5 Å²	46.5	48%	0.481	22%	0.223	S	C	.	.			trans	-76.3	107.2	172.3	-176.2	176.6	-0.3	0	0	108.9
527	I	53.4	Low	77.6	Confident	17 Å²	17	50 Å²	50	9%	0.087	24%	0.24	C	C	.	.			trans	-90.3	126	159.9	-71.5	-171.5	0	0	0	108.2	N111 C138 W144 F182 I525 L529	N111-I527 PolarHBondContact ND2-O 3.01Å; C138-I527 WeakPolarHBondContact SG-CD1 3.35Å; W144-I527 HydrophobicContact CE3-CD1 4.36Å; W144-I527 HydrophobicContact CH2-CD1 3.15Å; W144-I527 HydrophobicContact CH2-CG1 3.93Å; W144-I527 HydrophobicContact CZ2-CD1 3.82Å; W144-I527 HydrophobicContact CZ3-CD1 3.46Å; W144-I527 VanDerWaalsContact CZ3-CD1 3.46Å; W144-I527 HydrophobicContact CZ3-CG1 4.44Å; F182-I527 HydrophobicContact CE1-CD1 3.85Å; I525-I527 PolarHBondContact O-N 2.93Å; I527-L529 HydrophobicContact CG2-CD2 3.73Å; I527-L529 HydrophobicContact CG2-CG 3.99Å
528	T	53.6	Low	76.3	Confident	91 Å²	91	53.1 Å²	53.1	56%	0.558	25%	0.253	S	S	*	.			trans	-94.9	131.2	152.8	-54.5	0	0	0	0	107.1
529	L	44.8	Very low	75	Confident	39 Å²	39	56.5 Å²	56.5	20%	0.204	27%	0.266	C	S	.	.			trans	-88.1	0	170.9	-71.7	-176.5	0	0	0	111	D109 K115 F132 N136 F182 I527	D109-L529 HydrophobicContact CB-CB 4.08Å; D109-L529 HydrophobicContact CB-CD1 3.67Å; D109-L529 HydrophobicContact CB-CG 3.64Å; K115-L529 HydrophobicContact CD-CB 4.06Å; K115-L529 WeakPolarHBondContact CE-O 3.21Å; K115-L529 WeakPolarHBondContact CE-OXT 3.46Å; K115-L529 HydrophobicContact CG-CB 4.27Å; K115-L529 PolarHBondContact NZ-OXT 3.23Å; F132-L529 HydrophobicContact CD1-CD1 4.13Å; F132-L529 HydrophobicContact CD1-CD2 3.71Å; F132-L529 HydrophobicContact CE1-CD1 3.98Å; F132-L529 HydrophobicContact CE1-CD2 4.15Å; N136-L529 WeakPolarHBondContact ND2-CD2 3.38Å; F182-L529 HydrophobicContact CD1-CD2 4.3Å; I527-L529 HydrophobicContact CG2-CD2 3.73Å; I527-L529 HydrophobicContact CG2-CG 3.99Å

Retrieved 529 of 529 residues in 343.7 ms (Link to these results)

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