A0A087YKR0_POEFO Loading...

receptor protein serine/threonine kinase

AlphaFold DB , UniProt , Accession A0A087YKR0, Species POEFO (Poecilia formosa, Amazon molly), Gene BMPR1B, Length 543 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	25.9	Very low	29.7	Very low	239 Å²	239	150.3 Å²	150.3	100%	1.177	81%	0.812	S	S	*	*				0	138.4	0	-110.2	175.7	142.5	0	0	107.6
2	P	43.2	Very low	29.2	Very low	95 Å²	95	151.1 Å²	151.1	62%	0.617	81%	0.814	S	S	*	*				-129	-167.8	-89.2	31.8	-11.5	0	0	0	108.9
3	E	32	Very low	29	Very low	146 Å²	146	147.6 Å²	147.6	68%	0.682	81%	0.808	S	S	*	*			cis	-175	125.6	42.1	-140.1	150.8	-147.2	0	0	106.6
4	Q	29.1	Very low	28.8	Very low	181 Å²	181	147.1 Å²	147.1	85%	0.846	80%	0.803	S	S	*	*				66.2	144.1	101.1	-60.5	179.4	6.5	0	0	114.1
5	G	28.4	Very low	28.5	Very low	71 Å²	71	144.5 Å²	144.5	73%	0.732	80%	0.798	S	S	*	*			cis	178.9	171.1	11	0	0	0	0	0	104.2
6	E	25.5	Very low	28.2	Very low	194 Å²	194	144.7 Å²	144.7	91%	0.907	80%	0.797	S	S	*	*			cis	-171.5	143.6	24.8	-115.9	-179.2	152.3	0	0	107.6
7	K	26.8	Very low	28.1	Very low	190 Å²	190	149.5 Å²	149.5	83%	0.826	80%	0.8	S	S	*	*			trans	-69.7	175.8	151.3	-98.5	-177.8	-179.9	176.5	0	108.3
8	P	39.2	Very low	28	Very low	93 Å²	93	146.1 Å²	146.1	60%	0.604	79%	0.79	S	S	*	*			cis	-167.4	-168.5	43.7	46.5	-22.4	0	0	0	119.7
9	R	27.1	Very low	28	Very low	241 Å²	241	150.2 Å²	150.2	91%	0.909	79%	0.793	S	S	*	*			trans	75.9	137.6	153.4	-65.4	162.8	-155.2	-162.5	7.7	117.2
10	G	23.8	Very low	28.1	Very low	72 Å²	72	148.2 Å²	148.2	74%	0.742	79%	0.792	S	S	*	*			cis	131.9	126.3	10	0	0	0	0	0	110.5
11	C	25.1	Very low	28.2	Very low	131 Å²	131	147.5 Å²	147.5	89%	0.885	80%	0.796	S	S	*	*			trans	167.4	118.4	150.1	-100.6	0	0	0	0	107.7
12	L	24.1	Very low	28.4	Very low	160 Å²	160	143.3 Å²	143.3	84%	0.838	78%	0.777	S	S	*	*			cis	59.5	102.8	48.7	-97.4	158.1	0	0	0	114.7
13	S	26.1	Very low	27.8	Very low	106 Å²	106	145.1 Å²	145.1	74%	0.741	78%	0.781	S	S	*	*			trans	172.1	105.8	132.9	-176.7	0	0	0	0	109
14	L	26.2	Very low	27.6	Very low	141 Å²	141	146.6 Å²	146.6	74%	0.738	79%	0.792	S	S	*	*				65.1	105.3	93.1	-88.2	137.2	0	0	0	115.4
15	C	24.2	Very low	27.8	Very low	108 Å²	108	145.6 Å²	145.6	73%	0.73	79%	0.792	S	S	*	*				57.2	141.7	122.2	-80.1	0	0	0	0	122.5
16	L	25.1	Very low	28.4	Very low	147 Å²	147	145 Å²	145	77%	0.77	79%	0.786	S	S	*	*			trans	98.8	97.4	134.6	-83.5	162.7	0	0	0	119.1
17	W	26.3	Very low	28.8	Very low	226 Å²	226	143.8 Å²	143.8	86%	0.856	79%	0.785	S	S	*	*				158.5	116.6	114	-83.5	26.6	0	0	0	109.2
18	S	25.5	Very low	29	Very low	88 Å²	88	144.1 Å²	144.1	62%	0.615	79%	0.787	S	S	*	*				72.9	119.4	75.7	-164.9	0	0	0	0	114
19	R	28.6	Very low	28.7	Very low	224 Å²	224	145.4 Å²	145.4	85%	0.845	80%	0.798	S	S	*	*			trans	95	104.2	155	-66.5	162.5	-176.5	-148.4	1.8	119.3
20	S	29	Very low	29	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	80%	0.799	S	S	*	*				46.1	132	122.5	-44.7	0	0	0	0	120.5
21	P	31.4	Very low	29.4	Very low	135 Å²	135	147.8 Å²	147.8	88%	0.877	81%	0.805	S	S	*	*			trans	-111.5	106.7	141.6	31.1	-17.3	0	0	0	109.5
22	L	30.2	Very low	29.7	Very low	151 Å²	151	150.8 Å²	150.8	79%	0.791	81%	0.806	S	S	*	*			trans	-116.7	126.1	154.5	-104.5	165.8	0	0	0	107
23	L	29.1	Very low	30.1	Very low	132 Å²	132	152.5 Å²	152.5	69%	0.691	81%	0.809	S	S	*	*			trans	73.9	96.6	154.3	-70.6	149	0	0	0	118.3	L25	L23-L25 HydrophobicContact CD2-CD1 4.34Å
24	L	29.7	Very low	30.5	Very low	177 Å²	177	151.8 Å²	151.8	93%	0.927	81%	0.81	S	S	*	*			trans	-131.2	75.7	134.9	-101.3	158.6	0	0	0	108.7
25	L	32.3	Very low	30.9	Very low	161 Å²	161	153 Å²	153	84%	0.843	82%	0.818	S	S	*	*			trans	-80	113.6	149.9	-89.8	161	0	0	0	105.7	L23	L23-L25 HydrophobicContact CD2-CD1 4.34Å
26	G	40.8	Very low	31.4	Very low	59 Å²	59	150.5 Å²	150.5	61%	0.608	81%	0.81	S	S	*	*			trans	168.2	9.6	179	0	0	0	0	0	117.7
27	L	33.3	Very low	32	Very low	167 Å²	167	150.6 Å²	150.6	87%	0.874	81%	0.811	S	S	*	*	S	Bend	trans	-148	60	165.9	-75.2	176.6	0	0	0	110.2
28	F	31.3	Very low	32.4	Very low	197 Å²	197	146 Å²	146	86%	0.864	80%	0.802	S	S	*	*			trans	-136.9	68.1	167	-94	-80.2	0	0	0	108.6
29	S	34.5	Very low	32.7	Very low	120 Å²	120	148.8 Å²	148.8	84%	0.839	81%	0.809	S	S	*	*	S	Bend	trans	-150.1	20.4	167.5	-68.9	0	0	0	0	113.3
30	L	32.3	Very low	33	Very low	179 Å²	179	144.1 Å²	144.1	94%	0.937	80%	0.801	S	S	*	*	S	Bend	trans	-146.3	27.8	174.9	-97.4	167.5	0	0	0	113.7
31	Q	31.9	Very low	33.2	Very low	184 Å²	184	143.5 Å²	143.5	86%	0.86	80%	0.796	S	S	*	*	S	Bend	trans	-142.3	33.4	175.9	-147.2	159.4	-15.2	0	0	113
32	Q	31.4	Very low	33.1	Very low	194 Å²	194	144.6 Å²	144.6	91%	0.907	79%	0.792	S	S	*	*	S	Bend	trans	-119.8	45.8	177	-153.7	168.8	10.1	0	0	111.2
33	Q	33.3	Very low	33.2	Very low	196 Å²	196	144.5 Å²	144.5	92%	0.916	79%	0.791	S	S	*	*	S	Bend	trans	-144.9	26.3	173.7	-151.8	164.7	-6.7	0	0	114.1
34	A	35	Very low	33.3	Very low	91 Å²	91	145.9 Å²	145.9	75%	0.752	80%	0.798	S	S	*	*	S	Bend	trans	-146.5	19.8	178.7	0	0	0	0	0	115.7
35	N	33.5	Very low	33.2	Very low	168 Å²	168	147.4 Å²	147.4	90%	0.898	80%	0.798	S	S	*	*	S	Bend	trans	-134.9	41.2	177.4	-98.3	-6.9	0	0	0	112.8
36	G	34.6	Very low	33.1	Very low	55 Å²	55	144.6 Å²	144.6	57%	0.567	80%	0.798	S	S	*	*	S	Bend	trans	-111.2	-5.2	176.8	0	0	0	0	0	115.8
37	N	37.3	Very low	32.4	Very low	149 Å²	149	147.2 Å²	147.2	80%	0.797	81%	0.807	S	S	*	*	S	Bend	trans	-122.1	19.4	-163.6	-78.1	2.5	0	0	0	116.1
38	I	34.4	Very low	32	Very low	129 Å²	129	145 Å²	145	66%	0.662	81%	0.805	S	S	*	*	S	Bend	trans	-115.5	-14.2	-179.7	-62.9	177.7	0	0	0	113.1
39	L	33.5	Very low	31.8	Very low	146 Å²	146	145 Å²	145	76%	0.764	81%	0.805	S	S	*	*	S	Bend	trans	-91.8	-15.6	179.4	-142.8	75.5	0	0	0	114.2
40	D	33.8	Very low	31.3	Very low	127 Å²	127	147.6 Å²	147.6	68%	0.679	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-4.4	-179.9	-84.9	-23.1	0	0	0	114.4
41	S	32.8	Very low	30.8	Very low	96 Å²	96	144.9 Å²	144.9	67%	0.671	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	1.2	174.8	73.9	0	0	0	0	114.4
42	M	31	Very low	30.5	Very low	159 Å²	159	141.7 Å²	141.7	78%	0.783	79%	0.787	S	S	*	*	S	Bend	trans	-110.5	-1.2	178.4	-69.3	-161.5	-165.8	0	0	114.6
43	L	31.2	Very low	30.1	Very low	149 Å²	149	140.9 Å²	140.9	78%	0.78	78%	0.784	S	S	*	*	S	Bend	trans	-116.2	24.7	-179.6	-78.8	168.1	0	0	0	114.3
44	L	30.6	Very low	29.7	Very low	160 Å²	160	137.5 Å²	137.5	84%	0.838	78%	0.782	S	S	*	*	S	Bend	trans	-127.9	35.5	177.4	-89.4	166.6	0	0	0	114
45	K	28.9	Very low	29.2	Very low	210 Å²	210	136.9 Å²	136.9	91%	0.913	78%	0.784	S	S	*	*	S	Bend	trans	-137.4	13.2	171.3	-111.3	179.8	-176.6	179.2	0	116.3
46	A	30.5	Very low	28.9	Very low	102 Å²	102	138.6 Å²	138.6	84%	0.843	78%	0.783	S	S	*	*	S	Bend	trans	-128.4	66.4	177	0	0	0	0	0	111.1
47	S	25.6	Very low	28.5	Very low	114 Å²	114	145.4 Å²	145.4	80%	0.797	80%	0.797	S	S	*	*			trans	-164.9	99.4	158.2	-167.8	0	0	0	0	110.1
48	S	25.1	Very low	27.9	Very low	121 Å²	121	142.9 Å²	142.9	85%	0.846	80%	0.797	S	S	*	*			trans	-161.2	94.8	163.9	-67.7	0	0	0	0	110.2
49	K	26.3	Very low	27.6	Very low	196 Å²	196	145.5 Å²	145.5	85%	0.852	81%	0.811	S	S	*	*			trans	52.2	108.9	141.8	-77.4	179	169.1	179.6	0	121.8
50	E	23.5	Very low	27.3	Very low	175 Å²	175	142 Å²	142	82%	0.818	81%	0.81	S	S	*	*				40.6	115.9	109	-79	-175.1	170.3	0	0	122.2
51	T	21.7	Very low	27.1	Very low	121 Å²	121	141.5 Å²	141.5	74%	0.742	82%	0.817	S	S	*	*				60.4	123.7	126.8	2.5	0	0	0	0	123.2
52	V	25.7	Very low	27	Very low	117 Å²	117	143.6 Å²	143.6	71%	0.709	83%	0.826	S	S	*	*				145.7	127.1	122.6	171.8	0	0	0	0	114.7
53	E	24.8	Very low	27.1	Very low	178 Å²	178	140.3 Å²	140.3	83%	0.832	82%	0.824	S	S	*	*			trans	59.9	122.6	151.8	-75.9	172.6	162.6	0	0	126.7
54	S	23.6	Very low	27.3	Very low	125 Å²	125	139.4 Å²	139.4	87%	0.874	83%	0.827	S	S	*	*				53.4	119.6	121.5	-159.8	0	0	0	0	121.8
55	G	25.7	Very low	27.4	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	83%	0.827	S	S	*	*			trans	175.5	108.7	158.4	0	0	0	0	0	114.6
56	K	25.7	Very low	27.8	Very low	204 Å²	204	134.8 Å²	134.8	89%	0.887	83%	0.827	S	S	*	*			trans	-72.6	137.9	174.8	-69.4	170.8	170	170.1	0	112.5
57	K	26.4	Very low	28.4	Very low	198 Å²	198	134.7 Å²	134.7	86%	0.861	82%	0.82	S	S	*	*				149.1	126.2	118.3	-85.6	-175	177	176.7	0	114.4
58	A	25.5	Very low	29.5	Very low	96 Å²	96	134.8 Å²	134.8	79%	0.793	82%	0.82	S	S	*	*			trans	72.7	123.5	133.5	0	0	0	0	0	123.4
59	L	27.1	Very low	31.2	Very low	184 Å²	184	135.6 Å²	135.6	96%	0.963	81%	0.811	S	S	*	*			trans	83.2	126.1	136.9	-151	73.3	0	0	0	120
60	G	27.6	Very low	33.4	Very low	72 Å²	72	135.2 Å²	135.2	74%	0.742	80%	0.804	S	S	*	*			trans	140.7	98.3	155.2	0	0	0	0	0	114.8
61	S	30.1	Very low	36.2	Very low	117 Å²	117	130.6 Å²	130.6	82%	0.818	78%	0.781	S	S	*	*			trans	-74.5	135.5	169.5	70.1	0	0	0	0	110.9
62	T	31	Very low	39.4	Very low	141 Å²	141	125.2 Å²	125.2	87%	0.865	75%	0.748	S	S	*	*			trans	-160.6	119	146.5	-13.5	0	0	0	0	110.2
63	A	31.8	Very low	42.5	Very low	90 Å²	90	124.3 Å²	124.3	74%	0.744	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-68.8	147.7	170	0	0	0	0	0	110.4
64	P	36.1	Very low	45.7	Very low	129 Å²	129	115.8 Å²	115.8	84%	0.838	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-76.7	139.1	174.4	29.8	-29.8	0	0	0	111.2
65	A	33.3	Very low	48.9	Very low	102 Å²	102	112.2 Å²	112.2	84%	0.843	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-64.5	141.7	-174.5	0	0	0	0	0	114.1
66	L	36.9	Very low	51.9	Low	172 Å²	172	108.6 Å²	108.6	90%	0.901	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-72.6	123.6	174.2	-163.1	78.2	0	0	0	109.9	S68	L66-S68 PolarHBondContact O-N 2.8Å
67	S	44.1	Very low	54.7	Low	99 Å²	99	104.2 Å²	104.2	69%	0.692	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-64.8	128.7	169.8	63.7	0	0	0	0	109.9	Q69	S67-Q69 PolarHBondContact O-N 3.39Å
68	S	47.5	Very low	57.3	Low	116 Å²	116	101.1 Å²	101.1	81%	0.811	59%	0.591	S	S	*	*			trans	-59.2	106.9	174.8	65	0	0	0	0	110.8	L66 R70	L66-S68 PolarHBondContact O-N 2.8Å; S68-R70 PolarHBondContact O-N 3.19Å; S68-R70 VanDerWaalsContact O-N 3.16Å
69	Q	60.5	Low	59.8	Low	139 Å²	139	102 Å²	102	65%	0.65	58%	0.579	S	S	*	*			trans	-67.2	110.5	168.7	-75.2	174.3	-21.8	0	0	108	S67 F71	S67-Q69 PolarHBondContact O-N 3.39Å; Q69-F71 HydrophobicContact CB-CD2 4.48Å; Q69-F71 HydrophobicContact CB-CE2 3.87Å; Q69-F71 HydrophobicContact CB-CZ 4.33Å; Q69-F71 WeakPolarHBondContact O-CD2 3.4Å; Q69-F71 PolarHBondContact O-N 2.7Å
70	R	73	Confident	62.5	Low	187 Å²	187	95.4 Å²	95.4	71%	0.706	55%	0.547	S	S	*	.			trans	-77.5	116.3	174.6	-174.1	174.5	177.3	-171.3	-8.6	107.4	S68 D139	S68-R70 PolarHBondContact O-N 3.19Å; S68-R70 VanDerWaalsContact O-N 3.16Å; R70-D139 PolarHBondContact NH2-O 3.3Å
71	F	83.1	Confident	65	Low	79 Å²	79	94.5 Å²	94.5	35%	0.346	53%	0.528	S	S	.	.			trans	-94.4	144.6	173	-69.2	-91.3	0	0	0	109.7	Q69 R90 T91 D92	Q69-F71 HydrophobicContact CB-CD2 4.48Å; Q69-F71 HydrophobicContact CB-CE2 3.87Å; Q69-F71 HydrophobicContact CB-CZ 4.33Å; Q69-F71 WeakPolarHBondContact O-CD2 3.4Å; Q69-F71 PolarHBondContact O-N 2.7Å; F71-R90 HydrophobicContact CB-CG 4.08Å; F71-R90 HydrophobicContact CD1-CG 4.36Å; F71-R90 VanDerWaalsContact CG-NH2 3.34Å; F71-T91 CarbonylContact C-O 3.51Å; F71-T91 WeakPolarHBondContact CA-O 3.45Å; F71-D92 HydrophobicContact CD1-CB 4.17Å; F71-D92 HydrophobicContact CE1-CB 4.03Å
72	L	88.6	Confident	67.2	Low	8 Å²	8	97.5 Å²	97.5	4%	0.042	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.8	-179.4	-159.6	69.6	0	0	0	109.6	R90 T91 C95 E140 D141	L72-R90 CarbonylContact O-C 3.54Å; L72-R90 WeakPolarHBondContact O-CA 3.46Å; L72-T91 HydrophobicContact CB-CG2 4.19Å; L72-T91 PolarHBondContact N-O 2.78Å; L72-T91 PolarHBondContact O-N 3.48Å; L72-C95 HydrophobicContact CD2-CB 4.44Å; L72-C95 WeakPolarHBondContact CD2-SG 3.4Å; L72-E140 WeakPolarHBondContact CD1-O 3.4Å; L72-D141 WeakPolarHBondContact CA-OD1 3.26Å
73	W	90.4	Very high	69.3	Low	97 Å²	97	97.4 Å²	97.4	37%	0.367	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	137.1	167.1	-69.2	92.3	0	0	0	109.9	C89 R90 D141 F142	W73-C89 CarbonylContact C-O 3.58Å; W73-C89 WeakPolarHBondContact CA-O 3.34Å; W73-R90 HydrophobicContact CD2-CB 4.27Å; W73-R90 HydrophobicContact CD2-CG 4.41Å; W73-R90 HydrophobicContact CE3-CB 4.04Å; W73-R90 HydrophobicContact CH2-CB 4.38Å; W73-R90 HydrophobicContact CZ3-CB 4.1Å; W73-D141 HydrophobicContact CB-CB 4.18Å; W73-D141 PolarHBondContact N-OD1 3.4Å; W73-D141 CarbonylContact O-C 3.59Å; W73-D141 WeakPolarHBondContact O-CA 3.28Å; W73-F142 HydrophobicContact CB-CD1 4.47Å; W73-F142 HydrophobicContact CB-CE1 3.83Å; W73-F142 HydrophobicContact CB-CE2 4.06Å; W73-F142 HydrophobicContact CB-CZ 3.61Å; W73-F142 HydrophobicContact CG-CZ 4.35Å; W73-F142 PolarHBondContact O-N 2.63Å
74	C	91.3	Very high	71.5	Confident	0 Å²	0	95 Å²	95	0%	0	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	155.3	177.5	-47.1	0	0	0	0	110.4	T88 C89 C95 C112	C74-T88 VanDerWaalsContact O-CA 3.3Å; C74-T88 WeakPolarHBondContact O-CA 3.19Å; C74-C89 PolarHBondContact N-O 2.83Å; C74-C89 PolarHBondContact O-N 3.33Å; C74-C95 VanDerWaalsContact CA-SG 3.55Å; C74-C95 HydrophobicContact CB-CB 3.62Å; C74-C95 WeakPolarHBondContact CB-SG 3.19Å; C74-C95 WeakPolarHBondContact SG-CA 3.26Å; C74-C95 WeakPolarHBondContact SG-CB 3.17Å; C74-C95 CovalentContact SG-SG 2.01Å; C74-C95 PolarHBondContact SG-SG 3.38Å; C74-C112 WeakPolarHBondContact CB-SG 3.18Å; C74-C112 PolarHBondContact SG-SG 2.81Å
75	H	91.9	Very high	73.3	Confident	50 Å²	50	93.7 Å²	93.7	23%	0.231	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	131	167.3	-178.1	-97.8	0	0	0	109.2	N87 N144 R145	H75-N87 PolarHBondContact CD2-O 3.33Å; H75-N144 PolarHBondContact N-OD1 3.14Å; H75-N144 PolarHBondContact O-ND2 3.39Å; H75-R145 HydrophobicContact CB-CG 4Å
76	C	88	Confident	75.7	Confident	0 Å²	0	96.1 Å²	96.1	0%	0	50%	0.495	C	S	.	.			trans	-114.8	140.2	175.7	70.5	0	0	0	0	110.8	C80 N87 C89 A110	C76-C80 HydrophobicContact CB-CB 3.97Å; C76-C80 WeakPolarHBondContact CB-SG 3.35Å; C76-C80 PolarHBondContact O-SG 3.06Å; C76-C80 VanDerWaalsContact O-SG 3.33Å; C76-C80 VanDerWaalsContact SG-CA 3.56Å; C76-C80 WeakPolarHBondContact SG-CB 3.49Å; C76-C80 CovalentContact SG-SG 2.04Å; C76-C80 PolarHBondContact SG-SG 2.81Å; C76-N87 PolarHBondContact N-O 2.95Å; C76-N87 WeakPolarHBondContact O-CB 3.49Å; C76-N87 VanDerWaalsContact SG-C 3.5Å; C76-C89 HydrophobicContact CB-CB 4.33Å; C76-A110 CarbonylContact C-O 3.55Å; C76-A110 VanDerWaalsContact CA-O 3.25Å; C76-A110 WeakPolarHBondContact CA-O 3.1Å
77	Y	85.3	Confident	78.1	Confident	113 Å²	113	92 Å²	92	44%	0.443	48%	0.475	S	S	.	.	B	Isolated β-bridge	trans	-150.3	127	179.3	-176.1	-105	0	0	0	108.7	H79 L108 A110	Y77-H79 PolarHBondContact O-N 2.82Å; Y77-L108 WeakPolarHBondContact CD1-O 3.47Å; Y77-A110 PolarHBondContact N-O 3.37Å; Y77-A110 PolarHBondContact O-N 2.69Å
78	H	80.3	Confident	80.3	Confident	133 Å²	133	88.3 Å²	88.3	62%	0.616	45%	0.448	S	S	*	.	B	Isolated β-bridge	trans	58.1	-13.7	-169.1	-73.8	-61.9	0	0	0	116.9	T109	H78-T109 HydrophobicContact CB-CG2 3.61Å
79	H	78.8	Confident	82.3	Confident	115 Å²	115	83.1 Å²	83.1	53%	0.532	41%	0.411	S	S	.	.	S	Bend	trans	-132.4	60	176.6	-156.4	69.8	0	0	0	111.3	Y77 F96	Y77-H79 PolarHBondContact O-N 2.82Å; H79-F96 HydrophobicContact CB-CZ 4.41Å; H79-F96 AromaticContact CD2-CZ 3.81Å
80	C	84.3	Confident	83.7	Confident	45 Å²	45	83.3 Å²	83.3	30%	0.304	41%	0.406	S	S	.	.			trans	-96.3	135.3	177.4	-71.7	0	0	0	0	111	C76 S84	C76-C80 HydrophobicContact CB-CB 3.97Å; C76-C80 WeakPolarHBondContact CB-SG 3.35Å; C76-C80 PolarHBondContact O-SG 3.06Å; C76-C80 VanDerWaalsContact O-SG 3.33Å; C76-C80 VanDerWaalsContact SG-CA 3.56Å; C76-C80 WeakPolarHBondContact SG-CB 3.49Å; C76-C80 CovalentContact SG-SG 2.04Å; C76-C80 PolarHBondContact SG-SG 2.81Å; C80-S84 WeakPolarHBondContact CB-OG 3.28Å
81	P	79.4	Confident	84.4	Confident	53 Å²	53	74.8 Å²	74.8	34%	0.344	38%	0.375	S	S	.	.			trans	-61.2	155.5	168.7	-23.5	35.9	0	0	0	112.3	D83 S84 C89	P81-D83 WeakPolarHBondContact CB-OD1 3.15Å; P81-D83 PolarHBondContact O-N 3.31Å; P81-D83 VanDerWaalsContact O-N 3.15Å; P81-S84 WeakPolarHBondContact O-CB 3.45Å; P81-S84 PolarHBondContact O-N 3.1Å; P81-S84 PolarHBondContact O-OG 3.26Å; P81-C89 HydrophobicContact CG-CB 4.01Å
82	D	75.3	Confident	84.6	Confident	179 Å²	179	74.3 Å²	74.3	96%	0.957	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-22.4	-177	-66.2	-37.7	0	0	0	113.6
83	D	75.7	Confident	84.6	Confident	140 Å²	140	74.3 Å²	74.3	75%	0.749	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	7.2	176.9	65	-33.9	0	0	0	113.7	P81	P81-D83 WeakPolarHBondContact CB-OD1 3.15Å; P81-D83 PolarHBondContact O-N 3.31Å; P81-D83 VanDerWaalsContact O-N 3.15Å
84	S	77.4	Confident	84.5	Confident	39 Å²	39	72.1 Å²	72.1	27%	0.273	37%	0.371	S	S	.	.			trans	-67.4	136.7	178.8	62	0	0	0	0	112.4	C80 P81 T88	C80-S84 WeakPolarHBondContact CB-OG 3.28Å; P81-S84 WeakPolarHBondContact O-CB 3.45Å; P81-S84 PolarHBondContact O-N 3.1Å; P81-S84 PolarHBondContact O-OG 3.26Å; S84-T88 VanDerWaalsContact CB-O 3.25Å; S84-T88 WeakPolarHBondContact CB-O 3.26Å
85	T	74.9	Confident	84.5	Confident	102 Å²	102	72.1 Å²	72.1	63%	0.626	37%	0.371	S	S	*	.	B	Isolated β-bridge	trans	-123.1	137.5	170.3	52.6	0	0	0	0	109	N87 T88	T85-N87 VanDerWaalsContact C-N 3.34Å; T85-N87 PolarHBondContact O-N 2.84Å; T85-T88 PolarHBondContact O-N 3.15Å; T85-T88 PolarHBondContact O-OG1 2.76Å
86	N	82.7	Confident	84.5	Confident	152 Å²	152	70.1 Å²	70.1	81%	0.813	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	39	177.4	-156.1	25.2	0	0	0	114.8	T88	N86-T88 WeakPolarHBondContact O-CG2 3.37Å; N86-T88 PolarHBondContact O-N 3.39Å
87	N	87.9	Confident	84.6	Confident	87 Å²	87	70.3 Å²	70.3	47%	0.465	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	35.1	-177.8	-61.1	-22.6	0	0	0	113.7	H75 C76 T85	H75-N87 PolarHBondContact CD2-O 3.33Å; C76-N87 PolarHBondContact N-O 2.95Å; C76-N87 WeakPolarHBondContact O-CB 3.49Å; C76-N87 VanDerWaalsContact SG-C 3.5Å; T85-N87 VanDerWaalsContact C-N 3.34Å; T85-N87 PolarHBondContact O-N 2.84Å
88	T	89.5	Confident	84.8	Confident	20 Å²	20	65.8 Å²	65.8	12%	0.123	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	145.7	176.5	66.6	0	0	0	0	111.2	C74 S84 T85 N86 F142	C74-T88 VanDerWaalsContact O-CA 3.3Å; C74-T88 WeakPolarHBondContact O-CA 3.19Å; S84-T88 VanDerWaalsContact CB-O 3.25Å; S84-T88 WeakPolarHBondContact CB-O 3.26Å; T85-T88 PolarHBondContact O-N 3.15Å; T85-T88 PolarHBondContact O-OG1 2.76Å; N86-T88 WeakPolarHBondContact O-CG2 3.37Å; N86-T88 PolarHBondContact O-N 3.39Å; T88-F142 HydrophobicContact CG2-CE1 3.58Å; T88-F142 HydrophobicContact CG2-CZ 4.18Å
89	C	89.8	Confident	85.1	Confident	7 Å²	7	60.1 Å²	60.1	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	160	173.8	62.3	0	0	0	0	109.2	W73 C74 C76 P81 C112	W73-C89 CarbonylContact C-O 3.58Å; W73-C89 WeakPolarHBondContact CA-O 3.34Å; C74-C89 PolarHBondContact N-O 2.83Å; C74-C89 PolarHBondContact O-N 3.33Å; C76-C89 HydrophobicContact CB-CB 4.33Å; P81-C89 HydrophobicContact CG-CB 4.01Å; C89-C112 HydrophobicContact CB-CB 3.91Å; C89-C112 WeakPolarHBondContact CB-SG 3.16Å; C89-C112 PolarHBondContact O-SG 3.27Å; C89-C112 VanDerWaalsContact O-SG 3.36Å; C89-C112 WeakPolarHBondContact SG-CB 3.24Å; C89-C112 PolarHBondContact SG-N 3.49Å; C89-C112 CovalentContact SG-SG 2.03Å; C89-C112 PolarHBondContact SG-SG 2.83Å
90	R	90.3	Very high	85.3	Confident	143 Å²	143	56.9 Å²	56.9	54%	0.54	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.3	-178.9	-175.3	178.2	170.7	-175.6	-3.2	110.1	F71 L72 W73	F71-R90 HydrophobicContact CB-CG 4.08Å; F71-R90 HydrophobicContact CD1-CG 4.36Å; F71-R90 VanDerWaalsContact CG-NH2 3.34Å; L72-R90 CarbonylContact O-C 3.54Å; L72-R90 WeakPolarHBondContact O-CA 3.46Å; W73-R90 HydrophobicContact CD2-CB 4.27Å; W73-R90 HydrophobicContact CD2-CG 4.41Å; W73-R90 HydrophobicContact CE3-CB 4.04Å; W73-R90 HydrophobicContact CH2-CB 4.38Å; W73-R90 HydrophobicContact CZ3-CB 4.1Å
91	T	87.2	Confident	85.2	Confident	9 Å²	9	57.9 Å²	57.9	6%	0.055	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	158.1	-178.8	-170.9	0	0	0	0	112.8	F71 L72 G93 C112 L113	F71-T91 CarbonylContact C-O 3.51Å; F71-T91 WeakPolarHBondContact CA-O 3.45Å; L72-T91 HydrophobicContact CB-CG2 4.19Å; L72-T91 PolarHBondContact N-O 2.78Å; L72-T91 PolarHBondContact O-N 3.48Å; T91-G93 PolarHBondContact OG1-N 3.29Å; T91-C112 HydrophobicContact CG2-CB 4.21Å; T91-L113 VanDerWaalsContact OG1-C 3.28Å; T91-L113 PolarHBondContact OG1-O 3.37Å
92	D	87.3	Confident	85	Confident	68 Å²	68	62.5 Å²	62.5	36%	0.364	32%	0.323	S	S	.	.	S	Bend	trans	-95.9	-4	166.3	65.8	-15.9	0	0	0	112.6	F71 L115	F71-D92 HydrophobicContact CD1-CB 4.17Å; F71-D92 HydrophobicContact CE1-CB 4.03Å; D92-L115 PolarHBondContact OD1-N 3.34Å; D92-L115 VanDerWaalsContact OD1-N 3.08Å
93	G	88.5	Confident	84.7	Confident	8 Å²	8	58 Å²	58	8%	0.082	32%	0.319	C	S	.	.	S	Bend	trans	-107.2	-116.2	178.8	0	0	0	0	0	113.2	T91 L113	T91-G93 PolarHBondContact OG1-N 3.29Å; G93-L113 CarbonylContact C-O 3.57Å; G93-L113 VanDerWaalsContact CA-O 3.32Å; G93-L113 WeakPolarHBondContact CA-O 3.35Å
94	F	89.6	Confident	84.4	Confident	52 Å²	52	53.7 Å²	53.7	23%	0.228	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	144.3	-168.3	-60.7	-103.8	0	0	0	111.9	L113 S118 C136 T138	F94-L113 PolarHBondContact N-O 3.18Å; F94-L113 PolarHBondContact O-N 3.19Å; F94-S118 WeakPolarHBondContact CD2-OG 3.15Å; F94-S118 WeakPolarHBondContact CE2-OG 3.27Å; F94-C136 HydrophobicContact CB-CB 4.14Å; F94-C136 HydrophobicContact CD1-CB 4.09Å; F94-C136 HydrophobicContact CG-CB 4.44Å; F94-T138 HydrophobicContact CB-CG2 4.21Å; F94-T138 HydrophobicContact CD1-CG2 3.14Å; F94-T138 HydrophobicContact CD2-CG2 4.4Å; F94-T138 HydrophobicContact CE1-CG2 3.39Å; F94-T138 HydrophobicContact CG-CG2 3.68Å; F94-T138 HydrophobicContact CZ-CG2 4.15Å
95	C	91.4	Very high	84.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	144	158.8	-55.7	0	0	0	0	109.3	L72 C74 C136 C137 N144	L72-C95 HydrophobicContact CD2-CB 4.44Å; L72-C95 WeakPolarHBondContact CD2-SG 3.4Å; C74-C95 VanDerWaalsContact CA-SG 3.55Å; C74-C95 HydrophobicContact CB-CB 3.62Å; C74-C95 WeakPolarHBondContact CB-SG 3.19Å; C74-C95 WeakPolarHBondContact SG-CA 3.26Å; C74-C95 WeakPolarHBondContact SG-CB 3.17Å; C74-C95 CovalentContact SG-SG 2.01Å; C74-C95 PolarHBondContact SG-SG 3.38Å; C95-C136 CarbonylContact O-C 3.58Å; C95-C136 VanDerWaalsContact O-CA 3.22Å; C95-C136 WeakPolarHBondContact O-CA 3.41Å; C95-C137 PolarHBondContact N-O 2.72Å; C95-C137 PolarHBondContact O-N 3.32Å; C95-N144 HydrophobicContact CB-CB 3.6Å
96	F	91.4	Very high	84.5	Confident	7 Å²	7	55.4 Å²	55.4	3%	0.031	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	157.2	177	79	-84.4	0	0	0	113.1	H79 M98 A110 G111 L113 L134 E135 N144	H79-F96 HydrophobicContact CB-CZ 4.41Å; H79-F96 AromaticContact CD2-CZ 3.81Å; F96-M98 HydrophobicContact CD2-CB 4.2Å; F96-M98 HydrophobicContact CE2-CB 4.27Å; F96-M98 HydrophobicContact CE2-CE 4.23Å; F96-A110 WeakPolarHBondContact O-CA 3.33Å; F96-G111 WeakPolarHBondContact CD1-O 3.06Å; F96-G111 PolarHBondContact N-O 2.96Å; F96-G111 PolarHBondContact O-N 3.44Å; F96-G111 VanDerWaalsContact O-N 3.12Å; F96-L113 HydrophobicContact CB-CD1 4.12Å; F96-L113 HydrophobicContact CD1-CD1 3.92Å; F96-L113 HydrophobicContact CD1-CD2 4.1Å; F96-L113 HydrophobicContact CD1-CG 3.56Å; F96-L113 HydrophobicContact CE1-CD2 4.02Å; F96-L113 HydrophobicContact CE1-CG 3.98Å; F96-L113 HydrophobicContact CG-CD1 4.17Å; F96-L113 HydrophobicContact CG-CG 4.3Å; F96-L134 HydrophobicContact CB-CD1 4.23Å; F96-L134 HydrophobicContact CB-CG 4.49Å; F96-L134 HydrophobicContact CD2-CD1 3.72Å; F96-L134 HydrophobicContact CD2-CG 4.48Å; F96-L134 HydrophobicContact CE2-CD1 4.42Å; F96-L134 HydrophobicContact CG-CD1 4.17Å; F96-E135 VanDerWaalsContact CA-O 3.27Å; F96-E135 WeakPolarHBondContact CA-O 3.18Å; F96-N144 PolarHBondContact O-ND2 2.96Å
97	T	90.5	Very high	84.7	Confident	4 Å²	4	51.3 Å²	51.3	3%	0.025	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136.6	167.1	-61.7	0	0	0	0	108.3	L108 T109 E135 N144 L147 P149	T97-L108 HydrophobicContact CG2-CD1 3.75Å; T97-L108 HydrophobicContact CG2-CD2 4.11Å; T97-L108 HydrophobicContact CG2-CG 4.05Å; T97-T109 CarbonylContact C-O 3.5Å; T97-T109 WeakPolarHBondContact CA-O 2.94Å; T97-E135 PolarHBondContact N-O 2.75Å; T97-E135 PolarHBondContact O-N 3.28Å; T97-N144 PolarHBondContact OG1-O 3.22Å; T97-L147 HydrophobicContact CG2-CB 4.45Å; T97-P149 HydrophobicContact CG2-CG 4.02Å
98	M	88.1	Confident	84.6	Confident	19 Å²	19	51.1 Å²	51.1	9%	0.094	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.5	-173.3	179.3	-166.6	-63.2	0	0	110.5	F96 E100 L108 T109 K132 S133 L134	F96-M98 HydrophobicContact CD2-CB 4.2Å; F96-M98 HydrophobicContact CE2-CB 4.27Å; F96-M98 HydrophobicContact CE2-CE 4.23Å; M98-E100 HydrophobicContact CG-CG 4.04Å; M98-E100 HydrophobicContact SD-CG 3.76Å; M98-L108 WeakPolarHBondContact O-CA 3.24Å; M98-L108 WeakPolarHBondContact O-CD1 3.44Å; M98-T109 PolarHBondContact N-O 2.8Å; M98-T109 PolarHBondContact O-N 3.49Å; M98-K132 VanDerWaalsContact CE-NZ 3.27Å; M98-K132 HydrophobicContact CG-CG 4.22Å; M98-K132 HydrophobicContact SD-CD 4.15Å; M98-K132 WeakPolarHBondContact SD-CE 3.24Å; M98-K132 HydrophobicContact SD-CG 4.25Å; M98-K132 PolarHBondContact SD-NZ 3.3Å; M98-S133 CarbonylContact C-O 3.59Å; M98-S133 VanDerWaalsContact CA-O 3.27Å; M98-S133 WeakPolarHBondContact CA-O 3.28Å; M98-S133 WeakPolarHBondContact CG-O 3.27Å; M98-L134 HydrophobicContact CB-CB 4.17Å; M98-L134 HydrophobicContact CB-CD1 4.38Å; M98-L134 HydrophobicContact CE-CB 4.16Å; M98-L134 HydrophobicContact CE-CD1 3.27Å; M98-L134 HydrophobicContact CE-CG 4.29Å; M98-L134 HydrophobicContact CG-CB 4.1Å
99	V	86.7	Confident	84.6	Confident	13 Å²	13	51 Å²	51	8%	0.079	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.1	169.6	63.7	0	0	0	0	109.5	P106 F107 L108 K132 S133 P149 L151	V99-P106 HydrophobicContact CG2-CB 4.08Å; V99-F107 WeakPolarHBondContact CA-O 3.42Å; V99-L108 HydrophobicContact CB-CD1 4.26Å; V99-K132 WeakPolarHBondContact O-CA 3.33Å; V99-S133 PolarHBondContact N-O 2.76Å; V99-S133 PolarHBondContact O-N 2.74Å; V99-P149 HydrophobicContact CB-CG 4.42Å; V99-P149 HydrophobicContact CG1-CB 4.1Å; V99-P149 HydrophobicContact CG1-CG 4.17Å; V99-P149 WeakPolarHBondContact CG1-O 3.39Å; V99-L151 HydrophobicContact CG1-CD2 3.91Å; V99-L151 HydrophobicContact CG1-CG 4.09Å; V99-L151 HydrophobicContact CG2-CD1 4.48Å; V99-L151 HydrophobicContact CG2-CD2 4.09Å; V99-L151 HydrophobicContact CG2-CG 3.99Å
100	E	84.6	Confident	84.7	Confident	48 Å²	48	50.9 Å²	50.9	22%	0.224	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.6	177.6	-71.2	178.2	161.1	0	0	109.5	M98 P106 F107 K132	M98-E100 HydrophobicContact CG-CG 4.04Å; M98-E100 HydrophobicContact SD-CG 3.76Å; E100-P106 WeakPolarHBondContact O-CA 3.4Å; E100-F107 HydrophobicContact CB-CD1 4.48Å; E100-F107 HydrophobicContact CB-CE1 3.74Å; E100-F107 HydrophobicContact CB-CE2 4.37Å; E100-F107 HydrophobicContact CB-CZ 3.69Å; E100-F107 PolarHBondContact N-O 3.02Å; E100-F107 VanDerWaalsContact N-O 3.1Å; E100-F107 WeakPolarHBondContact O-CD1 3.18Å; E100-F107 PolarHBondContact O-N 2.83Å; E100-F107 WeakPolarHBondContact OE2-CZ 3.41Å; E100-K132 HydrophobicContact CG-CB 4Å; E100-K132 HydrophobicContact CG-CD 4.06Å; E100-K132 HydrophobicContact CG-CG 3.74Å; E100-K132 WeakPolarHBondContact OE1-CD 3.01Å; E100-K132 WeakPolarHBondContact OE1-CE 3.43Å; E100-K132 IonicContact OE1-NZ 2.67Å; E100-K132 PolarHBondContact OE1-NZ 3.42Å
101	E	80.3	Confident	84.7	Confident	66 Å²	66	44 Å²	44	31%	0.308	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	108.6	175	-172.2	178	-162.3	0	0	110	G104 R131 L151	E101-G104 WeakPolarHBondContact OE1-CA 3.34Å; E101-R131 HydrophobicContact CB-CB 4.21Å; E101-R131 PolarHBondContact N-O 3.29Å; E101-R131 VanDerWaalsContact N-O 3.16Å; E101-R131 IonicContact OE1-NH1 2.64Å; E101-R131 PolarHBondContact OE1-NH1 3Å; E101-R131 WeakPolarHBondContact OE2-CD 3.48Å; E101-R131 IonicContact OE2-CZ 2.88Å; E101-R131 IonicContact OE2-NE 3.92Å; E101-R131 IonicContact OE2-NH1 2.75Å; E101-R131 PolarHBondContact OE2-NH1 3Å; E101-L151 HydrophobicContact CB-CD1 4Å; E101-L151 HydrophobicContact CB-CD2 4.47Å
102	E	75.1	Confident	84.9	Confident	149 Å²	149	44.8 Å²	44.8	70%	0.696	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.2	173.6	-159	177.4	-168.9	0	0	108.5	G104 V105 F107	E102-G104 PolarHBondContact O-N 2.76Å; E102-V105 PolarHBondContact N-O 2.77Å; E102-V105 PolarHBondContact O-N 3.35Å; E102-F107 HydrophobicContact CB-CD1 4.38Å; E102-F107 HydrophobicContact CB-CE1 3.72Å
103	G	69.3	Low	84.9	Confident	86 Å²	86	42.7 Å²	42.7	89%	0.887	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	18.8	-177.9	0	0	0	0	0	115.8
104	G	69.3	Low	84.7	Confident	49 Å²	49	44.2 Å²	44.2	51%	0.505	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	6.1	179.7	0	0	0	0	0	115.1	E101 E102	E101-G104 WeakPolarHBondContact OE1-CA 3.34Å; E102-G104 PolarHBondContact O-N 2.76Å
105	V	75.8	Confident	84.2	Confident	99 Å²	99	46.8 Å²	46.8	60%	0.6	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.5	175.5	-176.8	0	0	0	0	108.9	E102	E102-V105 PolarHBondContact N-O 2.77Å; E102-V105 PolarHBondContact O-N 3.35Å
106	P	80.3	Confident	83.3	Confident	78 Å²	78	53.9 Å²	53.9	51%	0.506	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	129.4	173.7	29	-32	0	0	0	109.9	V99 E100 L151	V99-P106 HydrophobicContact CG2-CB 4.08Å; E100-P106 WeakPolarHBondContact O-CA 3.4Å; P106-L151 HydrophobicContact CB-CD1 3.91Å
107	F	86.2	Confident	81.9	Confident	66 Å²	66	55.3 Å²	55.3	29%	0.289	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.6	169.3	69.7	-80.9	0	0	0	110.6	V99 E100 E102 T109	V99-F107 WeakPolarHBondContact CA-O 3.42Å; E100-F107 HydrophobicContact CB-CD1 4.48Å; E100-F107 HydrophobicContact CB-CE1 3.74Å; E100-F107 HydrophobicContact CB-CE2 4.37Å; E100-F107 HydrophobicContact CB-CZ 3.69Å; E100-F107 PolarHBondContact N-O 3.02Å; E100-F107 VanDerWaalsContact N-O 3.1Å; E100-F107 WeakPolarHBondContact O-CD1 3.18Å; E100-F107 PolarHBondContact O-N 2.83Å; E100-F107 WeakPolarHBondContact OE2-CZ 3.41Å; E102-F107 HydrophobicContact CB-CD1 4.38Å; E102-F107 HydrophobicContact CB-CE1 3.72Å; F107-T109 HydrophobicContact CD2-CG2 4.41Å; F107-T109 HydrophobicContact CE2-CG2 4.2Å
108	L	86	Confident	80.9	Confident	82 Å²	82	55.2 Å²	55.2	43%	0.429	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.3	-173.8	-165.6	84	0	0	0	110.4	Y77 T97 M98 V99 P149	Y77-L108 WeakPolarHBondContact CD1-O 3.47Å; T97-L108 HydrophobicContact CG2-CD1 3.75Å; T97-L108 HydrophobicContact CG2-CD2 4.11Å; T97-L108 HydrophobicContact CG2-CG 4.05Å; M98-L108 WeakPolarHBondContact O-CA 3.24Å; M98-L108 WeakPolarHBondContact O-CD1 3.44Å; V99-L108 HydrophobicContact CB-CD1 4.26Å; L108-P149 HydrophobicContact CD1-CG 4.5Å
109	T	89.6	Confident	79.8	Confident	17 Å²	17	59.2 Å²	59.2	10%	0.104	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.6	174	32.7	0	0	0	0	109.9	H78 T97 M98 F107	H78-T109 HydrophobicContact CB-CG2 3.61Å; T97-T109 CarbonylContact C-O 3.5Å; T97-T109 WeakPolarHBondContact CA-O 2.94Å; M98-T109 PolarHBondContact N-O 2.8Å; M98-T109 PolarHBondContact O-N 3.49Å; F107-T109 HydrophobicContact CD2-CG2 4.41Å; F107-T109 HydrophobicContact CE2-CG2 4.2Å
110	A	91.5	Very high	78.8	Confident	5 Å²	5	66 Å²	66	4%	0.041	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	150.2	177.9	0	0	0	0	0	110.5	C76 Y77 F96	C76-A110 CarbonylContact C-O 3.55Å; C76-A110 VanDerWaalsContact CA-O 3.25Å; C76-A110 WeakPolarHBondContact CA-O 3.1Å; Y77-A110 PolarHBondContact N-O 3.37Å; Y77-A110 PolarHBondContact O-N 2.69Å; F96-A110 WeakPolarHBondContact O-CA 3.33Å
111	G	90.9	Very high	78.3	Confident	0 Å²	0	69 Å²	69	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.8	-159.1	-179.9	0	0	0	0	0	114.9	F96	F96-G111 WeakPolarHBondContact CD1-O 3.06Å; F96-G111 PolarHBondContact N-O 2.96Å; F96-G111 PolarHBondContact O-N 3.44Å; F96-G111 VanDerWaalsContact O-N 3.12Å
112	C	90.1	Very high	78	Confident	25 Å²	25	67.2 Å²	67.2	17%	0.169	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.4	-176	-73.4	0	0	0	0	111.3	C74 C89 T91	C74-C112 WeakPolarHBondContact CB-SG 3.18Å; C74-C112 PolarHBondContact SG-SG 2.81Å; C89-C112 HydrophobicContact CB-CB 3.91Å; C89-C112 WeakPolarHBondContact CB-SG 3.16Å; C89-C112 PolarHBondContact O-SG 3.27Å; C89-C112 VanDerWaalsContact O-SG 3.36Å; C89-C112 WeakPolarHBondContact SG-CB 3.24Å; C89-C112 PolarHBondContact SG-N 3.49Å; C89-C112 CovalentContact SG-SG 2.03Å; C89-C112 PolarHBondContact SG-SG 2.83Å; T91-C112 HydrophobicContact CG2-CB 4.21Å
113	L	88.3	Confident	77.6	Confident	23 Å²	23	69 Å²	69	12%	0.12	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.3	170.1	-64.5	172.6	0	0	0	109.6	T91 G93 F94 F96 Q121	T91-L113 VanDerWaalsContact OG1-C 3.28Å; T91-L113 PolarHBondContact OG1-O 3.37Å; G93-L113 CarbonylContact C-O 3.57Å; G93-L113 VanDerWaalsContact CA-O 3.32Å; G93-L113 WeakPolarHBondContact CA-O 3.35Å; F94-L113 PolarHBondContact N-O 3.18Å; F94-L113 PolarHBondContact O-N 3.19Å; F96-L113 HydrophobicContact CB-CD1 4.12Å; F96-L113 HydrophobicContact CD1-CD1 3.92Å; F96-L113 HydrophobicContact CD1-CD2 4.1Å; F96-L113 HydrophobicContact CD1-CG 3.56Å; F96-L113 HydrophobicContact CE1-CD2 4.02Å; F96-L113 HydrophobicContact CE1-CG 3.98Å; F96-L113 HydrophobicContact CG-CD1 4.17Å; F96-L113 HydrophobicContact CG-CG 4.3Å; L113-Q121 HydrophobicContact CD1-CB 4.39Å
114	G	83.2	Confident	77.1	Confident	40 Å²	40	69.8 Å²	69.8	41%	0.412	39%	0.389	S	S	.	.			trans	-70.5	164.1	176.7	0	0	0	0	0	112.7	V116 S118	G114-V116 VanDerWaalsContact C-N 3.32Å; G114-V116 PolarHBondContact O-N 2.63Å; G114-S118 WeakPolarHBondContact O-CB 3.42Å; G114-S118 PolarHBondContact O-OG 2.92Å
115	L	79.1	Confident	76.4	Confident	106 Å²	106	70.9 Å²	70.9	56%	0.555	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-31.3	-174.9	-165.3	70.3	0	0	0	114.1	D92 G117 S118	D92-L115 PolarHBondContact OD1-N 3.34Å; D92-L115 VanDerWaalsContact OD1-N 3.08Å; L115-G117 PolarHBondContact O-N 2.8Å; L115-S118 PolarHBondContact O-OG 3.11Å
116	V	72.4	Confident	75.2	Confident	149 Å²	149	71.9 Å²	71.9	90%	0.903	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	112	-178.2	-176	0	0	0	0	110.3	G114	G114-V116 VanDerWaalsContact C-N 3.32Å; G114-V116 PolarHBondContact O-N 2.63Å
117	G	63.8	Low	73.9	Confident	38 Å²	38	74.9 Å²	74.9	39%	0.392	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	-10	175	0	0	0	0	0	115.6	L115 E119 F120	L115-G117 PolarHBondContact O-N 2.8Å; G117-E119 VanDerWaalsContact C-N 3.33Å; G117-E119 PolarHBondContact O-N 3.17Å; G117-F120 PolarHBondContact O-N 2.86Å
118	S	68.4	Low	72.2	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.007	42%	0.416	C	S	.	.	H	α-helix	trans	-69.7	-24.8	178.2	46.6	0	0	0	0	114.3	F94 G114 L115 F120 Q121 C122	F94-S118 WeakPolarHBondContact CD2-OG 3.15Å; F94-S118 WeakPolarHBondContact CE2-OG 3.27Å; G114-S118 WeakPolarHBondContact O-CB 3.42Å; G114-S118 PolarHBondContact O-OG 2.92Å; L115-S118 PolarHBondContact O-OG 3.11Å; S118-F120 PolarHBondContact O-N 3.44Å; S118-Q121 PolarHBondContact O-N 3.24Å; S118-Q121 VanDerWaalsContact O-N 3.15Å; S118-C122 WeakPolarHBondContact O-CB 3.23Å; S118-C122 PolarHBondContact O-N 3.03Å; S118-C122 PolarHBondContact O-SG 3.28Å
119	E	65.1	Low	70.7	Confident	103 Å²	103	81.4 Å²	81.4	48%	0.481	44%	0.435	S	S	.	.	H	α-helix	trans	-61.8	-32	176.8	-165.6	176.4	-171.2	0	0	112.1	G117 R123	G117-E119 VanDerWaalsContact C-N 3.33Å; G117-E119 PolarHBondContact O-N 3.17Å; E119-R123 VanDerWaalsContact O-CB 3.32Å; E119-R123 WeakPolarHBondContact O-CB 3.4Å; E119-R123 WeakPolarHBondContact O-CG 3.33Å; E119-R123 PolarHBondContact O-N 3.19Å; E119-R123 IonicContact OE1-CZ 2.74Å; E119-R123 IonicContact OE1-NH1 2.73Å; E119-R123 PolarHBondContact OE1-NH1 3.22Å; E119-R123 IonicContact OE1-NH2 3.32Å; E119-R123 PolarHBondContact OE1-NH2 3.43Å
120	F	66.4	Low	69.4	Low	157 Å²	157	87.4 Å²	87.4	69%	0.689	46%	0.462	S	S	*	.	H	α-helix	trans	-77.4	-37.6	174.7	-63.9	-76.8	0	0	0	112	G117 S118 D124	G117-F120 PolarHBondContact O-N 2.86Å; S118-F120 PolarHBondContact O-N 3.44Å; F120-D124 VanDerWaalsContact O-CB 3.31Å; F120-D124 WeakPolarHBondContact O-CB 3.21Å; F120-D124 PolarHBondContact O-N 3.23Å
121	Q	72.4	Confident	68.5	Low	111 Å²	111	90.6 Å²	90.6	52%	0.519	47%	0.473	S	S	.	.	H	α-helix	trans	-71.6	-36.1	-178.9	-68.1	177.3	-41	0	0	112.5	L113 S118 L134	L113-Q121 HydrophobicContact CD1-CB 4.39Å; S118-Q121 PolarHBondContact O-N 3.24Å; S118-Q121 VanDerWaalsContact O-N 3.15Å; Q121-L134 VanDerWaalsContact O-CD2 3.27Å; Q121-L134 WeakPolarHBondContact O-CD2 3.38Å
122	C	74.4	Confident	67.9	Low	27 Å²	27	94 Å²	94	18%	0.182	49%	0.488	C	S	.	.	H	α-helix	trans	-86.2	-13.2	-178.7	-64.6	0	0	0	0	114.2	S118 C136	S118-C122 WeakPolarHBondContact O-CB 3.23Å; S118-C122 PolarHBondContact O-N 3.03Å; S118-C122 PolarHBondContact O-SG 3.28Å; C122-C136 HydrophobicContact CB-CB 3.58Å; C122-C136 WeakPolarHBondContact CB-SG 3.27Å; C122-C136 WeakPolarHBondContact SG-CB 3.5Å; C122-C136 CovalentContact SG-SG 2.03Å; C122-C136 PolarHBondContact SG-SG 3.01Å
123	R	66.9	Low	67.6	Low	186 Å²	186	94 Å²	94	70%	0.702	49%	0.487	S	S	*	.	H	α-helix	trans	-103.6	-19.7	179.1	-74.7	-171.6	174.7	154.3	10.8	114.8	E119	E119-R123 VanDerWaalsContact O-CB 3.32Å; E119-R123 WeakPolarHBondContact O-CB 3.4Å; E119-R123 WeakPolarHBondContact O-CG 3.33Å; E119-R123 PolarHBondContact O-N 3.19Å; E119-R123 IonicContact OE1-CZ 2.74Å; E119-R123 IonicContact OE1-NH1 2.73Å; E119-R123 PolarHBondContact OE1-NH1 3.22Å; E119-R123 IonicContact OE1-NH2 3.32Å; E119-R123 PolarHBondContact OE1-NH2 3.43Å
124	D	58.3	Low	67.5	Low	104 Å²	104	93.7 Å²	93.7	56%	0.556	49%	0.486	S	S	*	.			trans	-107.3	77.7	-170.7	-137	-3.1	0	0	0	111.2	F120	F120-D124 VanDerWaalsContact O-CB 3.31Å; F120-D124 WeakPolarHBondContact O-CB 3.21Å; F120-D124 PolarHBondContact O-N 3.23Å
125	T	56	Low	67.7	Low	72 Å²	72	95.5 Å²	95.5	44%	0.442	48%	0.484	S	S	.	.			trans	-102.2	45.8	-175.1	55.8	0	0	0	0	113.5	L134	T125-L134 WeakPolarHBondContact CG2-O 3.25Å
126	V	50.1	Low	68.2	Low	120 Å²	120	92 Å²	92	73%	0.727	47%	0.468	S	S	*	.			trans	-147.9	80.9	168.5	-164.6	0	0	0	0	111.8	P128	V126-P128 WeakPolarHBondContact O-CD 3.29Å
127	F	52.8	Low	69	Low	141 Å²	141	85.4 Å²	85.4	62%	0.618	43%	0.428	S	S	*	.			trans	-85.9	118	162.4	-70.3	-80.4	0	0	0	109	H129	F127-H129 PolarHBondContact O-N 2.88Å; F127-H129 VanDerWaalsContact O-N 3.08Å
128	P	50.4	Low	70.2	Confident	106 Å²	106	86.6 Å²	86.6	69%	0.688	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-1.6	-168.7	24.9	-32.5	0	0	0	115.6	V126	V126-P128 WeakPolarHBondContact O-CD 3.29Å
129	H	55	Low	70.9	Confident	178 Å²	178	92.3 Å²	92.3	82%	0.824	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	-2.2	-172	-67.1	-50.8	0	0	0	115.4	F127	F127-H129 PolarHBondContact O-N 2.88Å; F127-H129 VanDerWaalsContact O-N 3.08Å
130	E	62.7	Low	72.1	Confident	144 Å²	144	92.8 Å²	92.8	67%	0.673	46%	0.461	S	S	*	.	S	Bend	trans	-136.3	127	176.1	-70	173.8	-179.1	0	0	109.1	K132	E130-K132 VanDerWaalsContact C-N 3.27Å; E130-K132 PolarHBondContact O-N 3.02Å
131	R	72	Confident	73.3	Confident	72 Å²	72	89 Å²	89	27%	0.272	45%	0.447	S	S	.	.			trans	-73.6	86.4	176.4	-77.5	-173.3	74.6	-152.1	7.7	108.7	E101 L151 P152	E101-R131 HydrophobicContact CB-CB 4.21Å; E101-R131 PolarHBondContact N-O 3.29Å; E101-R131 VanDerWaalsContact N-O 3.16Å; E101-R131 IonicContact OE1-NH1 2.64Å; E101-R131 PolarHBondContact OE1-NH1 3Å; E101-R131 WeakPolarHBondContact OE2-CD 3.48Å; E101-R131 IonicContact OE2-CZ 2.88Å; E101-R131 IonicContact OE2-NE 3.92Å; E101-R131 IonicContact OE2-NH1 2.75Å; E101-R131 PolarHBondContact OE2-NH1 3Å; R131-L151 HydrophobicContact CB-CD2 4.26Å; R131-L151 WeakPolarHBondContact O-CD2 3.37Å; R131-P152 PolarHBondContact NE-O 2.76Å; R131-P152 PolarHBondContact NH2-O 2.79Å
132	K	78.9	Confident	74.1	Confident	72 Å²	72	86.8 Å²	86.8	31%	0.313	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	140.2	-179.2	171.3	178.1	-180	141.2	0	110.2	M98 V99 E100 E130	M98-K132 VanDerWaalsContact CE-NZ 3.27Å; M98-K132 HydrophobicContact CG-CG 4.22Å; M98-K132 HydrophobicContact SD-CD 4.15Å; M98-K132 WeakPolarHBondContact SD-CE 3.24Å; M98-K132 HydrophobicContact SD-CG 4.25Å; M98-K132 PolarHBondContact SD-NZ 3.3Å; V99-K132 WeakPolarHBondContact O-CA 3.33Å; E100-K132 HydrophobicContact CG-CB 4Å; E100-K132 HydrophobicContact CG-CD 4.06Å; E100-K132 HydrophobicContact CG-CG 3.74Å; E100-K132 WeakPolarHBondContact OE1-CD 3.01Å; E100-K132 WeakPolarHBondContact OE1-CE 3.43Å; E100-K132 IonicContact OE1-NZ 2.67Å; E100-K132 PolarHBondContact OE1-NZ 3.42Å; E130-K132 VanDerWaalsContact C-N 3.27Å; E130-K132 PolarHBondContact O-N 3.02Å
133	S	82.2	Confident	74.9	Confident	23 Å²	23	86 Å²	86	16%	0.161	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	133.2	171.6	-172.6	0	0	0	0	109.6	M98 V99 T150	M98-S133 CarbonylContact C-O 3.59Å; M98-S133 VanDerWaalsContact CA-O 3.27Å; M98-S133 WeakPolarHBondContact CA-O 3.28Å; M98-S133 WeakPolarHBondContact CG-O 3.27Å; V99-S133 PolarHBondContact N-O 2.76Å; V99-S133 PolarHBondContact O-N 2.74Å; S133-T150 WeakPolarHBondContact CB-O 3.3Å
134	L	86.5	Confident	76	Confident	17 Å²	17	77.2 Å²	77.2	9%	0.089	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.5	-179.1	166.2	146.7	0	0	0	109.3	F96 M98 Q121 T125 C136	F96-L134 HydrophobicContact CB-CD1 4.23Å; F96-L134 HydrophobicContact CB-CG 4.49Å; F96-L134 HydrophobicContact CD2-CD1 3.72Å; F96-L134 HydrophobicContact CD2-CG 4.48Å; F96-L134 HydrophobicContact CE2-CD1 4.42Å; F96-L134 HydrophobicContact CG-CD1 4.17Å; M98-L134 HydrophobicContact CB-CB 4.17Å; M98-L134 HydrophobicContact CB-CD1 4.38Å; M98-L134 HydrophobicContact CE-CB 4.16Å; M98-L134 HydrophobicContact CE-CD1 3.27Å; M98-L134 HydrophobicContact CE-CG 4.29Å; M98-L134 HydrophobicContact CG-CB 4.1Å; Q121-L134 VanDerWaalsContact O-CD2 3.27Å; Q121-L134 WeakPolarHBondContact O-CD2 3.38Å; T125-L134 WeakPolarHBondContact CG2-O 3.25Å; L134-C136 VanDerWaalsContact CD2-SG 3.53Å
135	E	87.8	Confident	77.4	Confident	78 Å²	78	79.4 Å²	79.4	36%	0.364	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146	173	-73	177.6	-159.7	0	0	109.7	F96 T97 L147 P149	F96-E135 VanDerWaalsContact CA-O 3.27Å; F96-E135 WeakPolarHBondContact CA-O 3.18Å; T97-E135 PolarHBondContact N-O 2.75Å; T97-E135 PolarHBondContact O-N 3.28Å; E135-L147 HydrophobicContact CB-CD1 4.19Å; E135-L147 HydrophobicContact CB-CD2 4.25Å; E135-L147 WeakPolarHBondContact O-CD1 3.28Å; E135-P149 HydrophobicContact CG-CB 4.14Å
136	C	89.9	Confident	78.8	Confident	33 Å²	33	81.5 Å²	81.5	22%	0.223	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	152.5	-179.6	-62.2	0	0	0	0	111.9	F94 C95 C122 L134	F94-C136 HydrophobicContact CB-CB 4.14Å; F94-C136 HydrophobicContact CD1-CB 4.09Å; F94-C136 HydrophobicContact CG-CB 4.44Å; C95-C136 CarbonylContact O-C 3.58Å; C95-C136 VanDerWaalsContact O-CA 3.22Å; C95-C136 WeakPolarHBondContact O-CA 3.41Å; C122-C136 HydrophobicContact CB-CB 3.58Å; C122-C136 WeakPolarHBondContact CB-SG 3.27Å; C122-C136 WeakPolarHBondContact SG-CB 3.5Å; C122-C136 CovalentContact SG-SG 2.03Å; C122-C136 PolarHBondContact SG-SG 3.01Å; L134-C136 VanDerWaalsContact CD2-SG 3.53Å
137	C	88.2	Confident	80.5	Confident	11 Å²	11	77.1 Å²	77.1	7%	0.074	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	157.8	176	61.1	0	0	0	0	112	C95 C143 N144 L147	C95-C137 PolarHBondContact N-O 2.72Å; C95-C137 PolarHBondContact O-N 3.32Å; C137-C143 HydrophobicContact CB-CB 3.85Å; C137-C143 WeakPolarHBondContact CB-SG 3.39Å; C137-C143 WeakPolarHBondContact SG-CB 3.41Å; C137-C143 CovalentContact SG-SG 2.04Å; C137-C143 PolarHBondContact SG-SG 2.92Å; C137-N144 PolarHBondContact SG-N 3.45Å; C137-L147 HydrophobicContact CB-CD1 4.25Å
138	T	88.8	Confident	82	Confident	62 Å²	62	77.3 Å²	77.3	38%	0.38	38%	0.382	S	S	.	.			trans	-137.5	4.3	-179.2	50.5	0	0	0	0	114	F94	F94-T138 HydrophobicContact CB-CG2 4.21Å; F94-T138 HydrophobicContact CD1-CG2 3.14Å; F94-T138 HydrophobicContact CD2-CG2 4.4Å; F94-T138 HydrophobicContact CE1-CG2 3.39Å; F94-T138 HydrophobicContact CG-CG2 3.68Å; F94-T138 HydrophobicContact CZ-CG2 4.15Å
139	D	84.8	Confident	83.6	Confident	121 Å²	121	72.8 Å²	72.8	65%	0.647	35%	0.352	S	S	*	.	S	Bend	trans	-75.3	-41.8	-161.3	-53	-59.1	0	0	0	112.6	R70	R70-D139 PolarHBondContact NH2-O 3.3Å
140	E	89.4	Confident	84.8	Confident	113 Å²	113	69.6 Å²	69.6	53%	0.528	35%	0.346	S	S	.	.	S	Bend	trans	-153.8	162.5	-177.3	63.1	-178.6	-174.5	0	0	112.8	L72 F142 C143	L72-E140 WeakPolarHBondContact CD1-O 3.4Å; E140-F142 PolarHBondContact O-N 2.98Å; E140-C143 HydrophobicContact CG-CB 4.19Å; E140-C143 VanDerWaalsContact O-CB 3.24Å; E140-C143 WeakPolarHBondContact O-CB 3.27Å; E140-C143 PolarHBondContact O-N 2.89Å; E140-C143 VanDerWaalsContact O-N 3.13Å
141	D	90.8	Very high	85.5	Confident	77 Å²	77	64.6 Å²	64.6	41%	0.412	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	132.9	176.6	-74.1	-22.7	0	0	0	110.1	L72 W73 C143	L72-D141 WeakPolarHBondContact CA-OD1 3.26Å; W73-D141 HydrophobicContact CB-CB 4.18Å; W73-D141 PolarHBondContact N-OD1 3.4Å; W73-D141 CarbonylContact O-C 3.59Å; W73-D141 WeakPolarHBondContact O-CA 3.28Å; D141-C143 VanDerWaalsContact C-N 3.28Å; D141-C143 PolarHBondContact O-N 3.21Å
142	F	90.8	Very high	85.4	Confident	66 Å²	66	64 Å²	64	29%	0.289	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	21.9	-177.5	-47.7	-74.1	0	0	0	115	W73 T88 E140 N144 R145	W73-F142 HydrophobicContact CB-CD1 4.47Å; W73-F142 HydrophobicContact CB-CE1 3.83Å; W73-F142 HydrophobicContact CB-CE2 4.06Å; W73-F142 HydrophobicContact CB-CZ 3.61Å; W73-F142 HydrophobicContact CG-CZ 4.35Å; W73-F142 PolarHBondContact O-N 2.63Å; T88-F142 HydrophobicContact CG2-CE1 3.58Å; T88-F142 HydrophobicContact CG2-CZ 4.18Å; E140-F142 PolarHBondContact O-N 2.98Å; F142-N144 PolarHBondContact O-N 3.31Å; F142-R145 HydrophobicContact CB-CG 4.35Å; F142-R145 WeakPolarHBondContact O-CB 3.46Å; F142-R145 PolarHBondContact O-N 3.42Å
143	C	89.6	Confident	84.8	Confident	9 Å²	9	66 Å²	66	6%	0.061	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-52.9	-28.9	178.6	65.2	0	0	0	0	113.5	C137 E140 D141 R145 N146	C137-C143 HydrophobicContact CB-CB 3.85Å; C137-C143 WeakPolarHBondContact CB-SG 3.39Å; C137-C143 WeakPolarHBondContact SG-CB 3.41Å; C137-C143 CovalentContact SG-SG 2.04Å; C137-C143 PolarHBondContact SG-SG 2.92Å; E140-C143 HydrophobicContact CG-CB 4.19Å; E140-C143 VanDerWaalsContact O-CB 3.24Å; E140-C143 WeakPolarHBondContact O-CB 3.27Å; E140-C143 PolarHBondContact O-N 2.89Å; E140-C143 VanDerWaalsContact O-N 3.13Å; D141-C143 VanDerWaalsContact C-N 3.28Å; D141-C143 PolarHBondContact O-N 3.21Å; C143-R145 PolarHBondContact O-N 3.45Å; C143-N146 PolarHBondContact O-N 3.28Å
144	N	91.1	Very high	83.9	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.016	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-71.4	-9.4	-178.1	69.1	-33.5	0	0	0	114.9	H75 C95 F96 T97 C137 F142 N146 L147	H75-N144 PolarHBondContact N-OD1 3.14Å; H75-N144 PolarHBondContact O-ND2 3.39Å; C95-N144 HydrophobicContact CB-CB 3.6Å; F96-N144 PolarHBondContact O-ND2 2.96Å; T97-N144 PolarHBondContact OG1-O 3.22Å; C137-N144 PolarHBondContact SG-N 3.45Å; F142-N144 PolarHBondContact O-N 3.31Å; N144-N146 PolarHBondContact O-N 2.65Å; N144-L147 HydrophobicContact CB-CD1 3.99Å; N144-L147 PolarHBondContact O-N 3.41Å
145	R	87.8	Confident	82.4	Confident	149 Å²	149	79.9 Å²	79.9	56%	0.562	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-65.1	-24.6	170.1	-70.2	-174	176.7	-169	1.2	113.1	H75 F142 C143	H75-R145 HydrophobicContact CB-CG 4Å; F142-R145 HydrophobicContact CB-CG 4.35Å; F142-R145 WeakPolarHBondContact O-CB 3.46Å; F142-R145 PolarHBondContact O-N 3.42Å; C143-R145 PolarHBondContact O-N 3.45Å
146	N	84.8	Confident	80.6	Confident	117 Å²	117	81.5 Å²	81.5	63%	0.626	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-97.1	0.1	-177.9	-58.9	-32.2	0	0	0	112.7	C143 N144	C143-N146 PolarHBondContact O-N 3.28Å; N144-N146 PolarHBondContact O-N 2.65Å
147	L	86.8	Confident	78.6	Confident	28 Å²	28	85.9 Å²	85.9	15%	0.147	46%	0.457	C	S	.	.			trans	-85.3	129.9	177.5	-64.2	178.7	0	0	0	110.2	T97 E135 C137 N144	T97-L147 HydrophobicContact CG2-CB 4.45Å; E135-L147 HydrophobicContact CB-CD1 4.19Å; E135-L147 HydrophobicContact CB-CD2 4.25Å; E135-L147 WeakPolarHBondContact O-CD1 3.28Å; C137-L147 HydrophobicContact CB-CD1 4.25Å; N144-L147 HydrophobicContact CB-CD1 3.99Å; N144-L147 PolarHBondContact O-N 3.41Å
148	H	83.9	Confident	76.5	Confident	144 Å²	144	93.1 Å²	93.1	67%	0.667	49%	0.494	S	S	*	.			trans	-133.7	68.6	-178.1	-62.6	-55.2	0	0	0	110.5
149	P	83.9	Confident	74.3	Confident	11 Å²	11	100.2 Å²	100.2	7%	0.071	52%	0.515	C	S	.	.			trans	-62.7	140	179	28.6	-35.9	0	0	0	110.3	T97 V99 L108 E135	T97-P149 HydrophobicContact CG2-CG 4.02Å; V99-P149 HydrophobicContact CB-CG 4.42Å; V99-P149 HydrophobicContact CG1-CB 4.1Å; V99-P149 HydrophobicContact CG1-CG 4.17Å; V99-P149 WeakPolarHBondContact CG1-O 3.39Å; L108-P149 HydrophobicContact CD1-CG 4.5Å; E135-P149 HydrophobicContact CG-CB 4.14Å
150	T	79.4	Confident	72.6	Confident	112 Å²	112	98.5 Å²	98.5	69%	0.687	51%	0.509	S	S	*	.			trans	-111.6	145.9	177.4	53.9	0	0	0	0	111	S133	S133-T150 WeakPolarHBondContact CB-O 3.3Å
151	L	77.6	Confident	70.8	Confident	38 Å²	38	96.9 Å²	96.9	20%	0.199	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-66.8	138.2	177.4	-71.2	174.3	0	0	0	110.6	V99 E101 P106 R131	V99-L151 HydrophobicContact CG1-CD2 3.91Å; V99-L151 HydrophobicContact CG1-CG 4.09Å; V99-L151 HydrophobicContact CG2-CD1 4.48Å; V99-L151 HydrophobicContact CG2-CD2 4.09Å; V99-L151 HydrophobicContact CG2-CG 3.99Å; E101-L151 HydrophobicContact CB-CD1 4Å; E101-L151 HydrophobicContact CB-CD2 4.47Å; P106-L151 HydrophobicContact CB-CD1 3.91Å; R131-L151 HydrophobicContact CB-CD2 4.26Å; R131-L151 WeakPolarHBondContact O-CD2 3.37Å
152	P	70.3	Confident	69.2	Low	59 Å²	59	102.5 Å²	102.5	38%	0.383	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-60.1	145.1	178	22.8	-31.6	0	0	0	111.2	R131	R131-P152 PolarHBondContact NE-O 2.76Å; R131-P152 PolarHBondContact NH2-O 2.79Å
153	P	66.6	Low	67.7	Low	115 Å²	115	106.4 Å²	106.4	75%	0.747	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-63.2	140	-177.5	24.9	-33.2	0	0	0	111.4	K155	P153-K155 PolarHBondContact O-N 3.2Å
154	L	63.8	Low	66.4	Low	134 Å²	134	110.8 Å²	110.8	70%	0.702	56%	0.558	S	S	*	*			trans	-61.9	110.2	172.9	-71	165.7	0	0	0	108.7	P156	L154-P156 WeakPolarHBondContact O-CD 3.27Å
155	K	55.1	Low	65	Low	198 Å²	198	116.6 Å²	116.6	86%	0.861	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-68.9	122.5	169.5	-72.5	-177.9	180	175.5	0	107.7	P153	P153-K155 PolarHBondContact O-N 3.2Å
156	P	49.7	Very low	64.2	Low	111 Å²	111	113.7 Å²	113.7	72%	0.721	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-60.6	148.6	172.6	24.5	-31.1	0	0	0	109.3	L154 L158	L154-P156 WeakPolarHBondContact O-CD 3.27Å; P156-L158 PolarHBondContact O-N 2.94Å; P156-L158 VanDerWaalsContact O-N 3.13Å
157	P	46.7	Very low	63.6	Low	126 Å²	126	113.8 Å²	113.8	82%	0.818	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-58.6	124.3	179.4	23.9	-30.7	0	0	0	108.6	Y159	P157-Y159 PolarHBondContact O-N 3.16Å
158	L	44.6	Very low	63	Low	163 Å²	163	115 Å²	115	85%	0.853	59%	0.59	S	S	*	*			trans	-52.3	104.5	169.9	-93.1	149.2	0	0	0	108	P156 V160	P156-L158 PolarHBondContact O-N 2.94Å; P156-L158 VanDerWaalsContact O-N 3.13Å; L158-V160 VanDerWaalsContact C-N 3.26Å; L158-V160 WeakPolarHBondContact O-CG2 3.19Å; L158-V160 PolarHBondContact O-N 3.09Å
159	Y	43.7	Very low	62.8	Low	211 Å²	211	113.5 Å²	113.5	83%	0.827	59%	0.586	S	S	*	*			trans	-65.2	93.4	165.8	-170.7	-93.9	0	0	0	106.7	P157 D161	P157-Y159 PolarHBondContact O-N 3.16Å; Y159-D161 PolarHBondContact O-N 3.45Å; Y159-D161 VanDerWaalsContact O-N 3.13Å
160	V	47.3	Very low	62.6	Low	85 Å²	85	117.8 Å²	117.8	52%	0.515	61%	0.608	S	S	.	*			trans	-70.2	109.3	177.9	-165.5	0	0	0	0	106.9	L158 W162 I164	L158-V160 VanDerWaalsContact C-N 3.26Å; L158-V160 WeakPolarHBondContact O-CG2 3.19Å; L158-V160 PolarHBondContact O-N 3.09Å; V160-W162 PolarHBondContact O-N 3.1Å; V160-I164 HydrophobicContact CG1-CD1 4.49Å
161	D	53.3	Low	63	Low	79 Å²	79	117.6 Å²	117.6	42%	0.422	60%	0.602	S	S	.	*			trans	-53.9	121.7	-179.1	-169.6	-6.1	0	0	0	110.1	Y159 K163 I164	Y159-D161 PolarHBondContact O-N 3.45Å; Y159-D161 VanDerWaalsContact O-N 3.13Å; D161-K163 PolarHBondContact O-N 3.43Å; D161-K163 PolarHBondContact OD1-N 3.39Å; D161-I164 HydrophobicContact CB-CD1 4.11Å; D161-I164 HydrophobicContact CB-CG1 4.29Å; D161-I164 WeakPolarHBondContact O-CB 3.4Å; D161-I164 PolarHBondContact O-N 3.09Å
162	W	55.7	Low	63.4	Low	194 Å²	194	119 Å²	119	74%	0.735	62%	0.615	S	S	*	*	H	α-helix	trans	-50.3	-24.2	-179.3	176.6	-98.9	0	0	0	112.8	V160 I164 H166	V160-W162 PolarHBondContact O-N 3.1Å; W162-I164 VanDerWaalsContact C-N 3.34Å; W162-I164 PolarHBondContact O-N 2.92Å; W162-H166 AromaticContact CD1-CD2 3.74Å; W162-H166 AromaticContact CD1-NE2 3.8Å; W162-H166 AromaticContact CE2-NE2 3.32Å; W162-H166 VanDerWaalsContact CE2-NE2 3.32Å; W162-H166 AromaticContact CZ2-NE2 3.61Å; W162-H166 AromaticContact NE1-CD2 3.51Å; W162-H166 AromaticContact NE1-NE2 3.09Å; W162-H166 PolarHBondContact NE1-NE2 3.1Å; W162-H166 PolarHBondContact O-CD2 3.29Å; W162-H166 VanDerWaalsContact O-CD2 3.27Å
163	K	59.4	Low	64.5	Low	149 Å²	149	119.7 Å²	119.7	65%	0.648	62%	0.617	S	S	*	*	H	α-helix	trans	-64.5	-30.6	174.3	-69.6	-177.9	177.5	177.4	0	114.1	D161 H166 M167	D161-K163 PolarHBondContact O-N 3.43Å; D161-K163 PolarHBondContact OD1-N 3.39Å; K163-H166 PolarHBondContact O-N 3.44Å; K163-M167 VanDerWaalsContact O-CG 3.26Å; K163-M167 WeakPolarHBondContact O-CG 3.26Å; K163-M167 PolarHBondContact O-N 3.5Å; K163-M167 VanDerWaalsContact O-N 3.07Å
164	I	62.1	Low	65.5	Low	100 Å²	100	117.6 Å²	117.6	51%	0.513	60%	0.602	S	S	.	*	H	α-helix	trans	-71.8	-38.3	-175.2	-60.3	170.7	0	0	0	111	V160 D161 W162 M167 A168	V160-I164 HydrophobicContact CG1-CD1 4.49Å; D161-I164 HydrophobicContact CB-CD1 4.11Å; D161-I164 HydrophobicContact CB-CG1 4.29Å; D161-I164 WeakPolarHBondContact O-CB 3.4Å; D161-I164 PolarHBondContact O-N 3.09Å; W162-I164 VanDerWaalsContact C-N 3.34Å; W162-I164 PolarHBondContact O-N 2.92Å; I164-M167 PolarHBondContact O-N 3.44Å; I164-A168 WeakPolarHBondContact O-CB 3.46Å; I164-A168 PolarHBondContact O-N 3.27Å
165	H	62.7	Low	67	Low	125 Å²	125	114.5 Å²	114.5	58%	0.579	59%	0.589	S	S	*	*	H	α-helix	trans	-65.1	-39.7	176.1	-78.3	-65.7	0	0	0	112.3	A168 L169	H165-A168 PolarHBondContact O-N 3.45Å; H165-L169 VanDerWaalsContact O-CB 3.28Å; H165-L169 WeakPolarHBondContact O-CB 3.19Å; H165-L169 PolarHBondContact O-N 2.92Å
166	H	69.8	Low	68.7	Low	88 Å²	88	108.3 Å²	108.3	41%	0.407	57%	0.57	S	S	.	*	H	α-helix	trans	-65.7	-40.8	174.8	-75	-65.5	0	0	0	112.1	W162 K163 L169 L170	W162-H166 AromaticContact CD1-CD2 3.74Å; W162-H166 AromaticContact CD1-NE2 3.8Å; W162-H166 AromaticContact CE2-NE2 3.32Å; W162-H166 VanDerWaalsContact CE2-NE2 3.32Å; W162-H166 AromaticContact CZ2-NE2 3.61Å; W162-H166 AromaticContact NE1-CD2 3.51Å; W162-H166 AromaticContact NE1-NE2 3.09Å; W162-H166 PolarHBondContact NE1-NE2 3.1Å; W162-H166 PolarHBondContact O-CD2 3.29Å; W162-H166 VanDerWaalsContact O-CD2 3.27Å; K163-H166 PolarHBondContact O-N 3.44Å; H166-L169 PolarHBondContact O-N 3.46Å; H166-L170 WeakPolarHBondContact O-CB 3.39Å; H166-L170 VanDerWaalsContact O-CG 3.27Å; H166-L170 WeakPolarHBondContact O-CG 3.48Å; H166-L170 PolarHBondContact O-N 2.9Å
167	M	73.5	Confident	70.8	Confident	120 Å²	120	107.9 Å²	107.9	59%	0.591	56%	0.561	S	S	*	*	H	α-helix	trans	-67.4	-41.1	176.3	-65.1	-60.6	-104.3	0	0	111.9	K163 I164 L170 I171	K163-M167 VanDerWaalsContact O-CG 3.26Å; K163-M167 WeakPolarHBondContact O-CG 3.26Å; K163-M167 PolarHBondContact O-N 3.5Å; K163-M167 VanDerWaalsContact O-N 3.07Å; I164-M167 PolarHBondContact O-N 3.44Å; M167-L170 PolarHBondContact O-N 3.28Å; M167-L170 HydrophobicContact SD-CD1 4.33Å; M167-I171 WeakPolarHBondContact O-CB 3.35Å; M167-I171 WeakPolarHBondContact O-CD1 3.47Å; M167-I171 WeakPolarHBondContact O-CG1 3.15Å; M167-I171 PolarHBondContact O-N 2.96Å
168	A	74.7	Confident	73.1	Confident	53 Å²	53	107.3 Å²	107.3	44%	0.438	55%	0.55	S	S	.	.	H	α-helix	trans	-65	-39.4	175.7	0	0	0	0	0	112.2	I164 H165 I171 S172	I164-A168 WeakPolarHBondContact O-CB 3.46Å; I164-A168 PolarHBondContact O-N 3.27Å; H165-A168 PolarHBondContact O-N 3.45Å; A168-I171 PolarHBondContact O-N 3.28Å; A168-S172 VanDerWaalsContact O-CB 3.3Å; A168-S172 WeakPolarHBondContact O-CB 3.18Å; A168-S172 PolarHBondContact O-N 3.48Å
169	L	79.6	Confident	75.4	Confident	112 Å²	112	104 Å²	104	59%	0.586	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-44.4	175	-167.4	103.7	0	0	0	111	H165 H166 I171 S172 V173	H165-L169 VanDerWaalsContact O-CB 3.28Å; H165-L169 WeakPolarHBondContact O-CB 3.19Å; H165-L169 PolarHBondContact O-N 2.92Å; H166-L169 PolarHBondContact O-N 3.46Å; L169-I171 PolarHBondContact O-N 2.92Å; L169-S172 PolarHBondContact O-N 2.92Å; L169-V173 HydrophobicContact CG-CG2 4.48Å; L169-V173 WeakPolarHBondContact O-CB 3.47Å; L169-V173 VanDerWaalsContact O-CG2 3.26Å; L169-V173 WeakPolarHBondContact O-CG2 3.15Å; L169-V173 PolarHBondContact O-N 3.36Å
170	L	80.1	Confident	77.8	Confident	102 Å²	102	98.9 Å²	98.9	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-62.2	-42.9	176.4	-76.8	165.8	0	0	0	112	H166 M167 T174	H166-L170 WeakPolarHBondContact O-CB 3.39Å; H166-L170 VanDerWaalsContact O-CG 3.27Å; H166-L170 WeakPolarHBondContact O-CG 3.48Å; H166-L170 PolarHBondContact O-N 2.9Å; M167-L170 PolarHBondContact O-N 3.28Å; M167-L170 HydrophobicContact SD-CD1 4.33Å; L170-T174 WeakPolarHBondContact O-CB 3.28Å; L170-T174 VanDerWaalsContact O-CG2 3.27Å; L170-T174 WeakPolarHBondContact O-CG2 3.36Å; L170-T174 PolarHBondContact O-N 2.86Å; L170-T174 PolarHBondContact O-OG1 2.76Å
171	I	87.3	Confident	80	Confident	108 Å²	108	96.8 Å²	96.8	55%	0.554	51%	0.51	S	S	*	.	H	α-helix	trans	-64.6	-43.4	175.4	-66.5	164	0	0	0	110.5	M167 A168 L169 T174 V175	M167-I171 WeakPolarHBondContact O-CB 3.35Å; M167-I171 WeakPolarHBondContact O-CD1 3.47Å; M167-I171 WeakPolarHBondContact O-CG1 3.15Å; M167-I171 PolarHBondContact O-N 2.96Å; A168-I171 PolarHBondContact O-N 3.28Å; L169-I171 PolarHBondContact O-N 2.92Å; I171-T174 WeakPolarHBondContact CA-OG1 3.47Å; I171-T174 PolarHBondContact O-N 3.5Å; I171-T174 PolarHBondContact O-OG1 3.42Å; I171-V175 HydrophobicContact CG2-CG2 4.42Å; I171-V175 WeakPolarHBondContact O-CB 3.39Å; I171-V175 VanDerWaalsContact O-CG2 3.23Å; I171-V175 WeakPolarHBondContact O-CG2 3.46Å; I171-V175 PolarHBondContact O-N 2.93Å
172	S	86.3	Confident	81.9	Confident	68 Å²	68	95.5 Å²	95.5	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-46.8	178.3	178.8	0	0	0	0	111.9	A168 L169 T174 V175 C176	A168-S172 VanDerWaalsContact O-CB 3.3Å; A168-S172 WeakPolarHBondContact O-CB 3.18Å; A168-S172 PolarHBondContact O-N 3.48Å; L169-S172 PolarHBondContact O-N 2.92Å; S172-T174 PolarHBondContact O-N 3.36Å; S172-V175 PolarHBondContact O-N 3.49Å; S172-C176 WeakPolarHBondContact O-CB 3.43Å; S172-C176 PolarHBondContact O-N 2.97Å; S172-C176 PolarHBondContact O-SG 2.91Å
173	V	91.6	Very high	83.7	Confident	72 Å²	72	90.6 Å²	90.6	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-42.9	179	170.8	0	0	0	0	111	L169 C176 I177	L169-V173 HydrophobicContact CG-CG2 4.48Å; L169-V173 WeakPolarHBondContact O-CB 3.47Å; L169-V173 VanDerWaalsContact O-CG2 3.26Å; L169-V173 WeakPolarHBondContact O-CG2 3.15Å; L169-V173 PolarHBondContact O-N 3.36Å; V173-C176 PolarHBondContact O-N 2.96Å; V173-I177 HydrophobicContact CG1-CD1 3.8Å; V173-I177 HydrophobicContact CG1-CG1 4.46Å; V173-I177 VanDerWaalsContact O-CG1 3.26Å; V173-I177 WeakPolarHBondContact O-CG1 3.27Å; V173-I177 PolarHBondContact O-N 3.3Å
174	T	89.4	Confident	85.3	Confident	71 Å²	71	88.6 Å²	88.6	44%	0.436	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-41.8	177.4	47.7	0	0	0	0	112.2	L170 I171 S172 C176 I177 I178	L170-T174 WeakPolarHBondContact O-CB 3.28Å; L170-T174 VanDerWaalsContact O-CG2 3.27Å; L170-T174 WeakPolarHBondContact O-CG2 3.36Å; L170-T174 PolarHBondContact O-N 2.86Å; L170-T174 PolarHBondContact O-OG1 2.76Å; I171-T174 WeakPolarHBondContact CA-OG1 3.47Å; I171-T174 PolarHBondContact O-N 3.5Å; I171-T174 PolarHBondContact O-OG1 3.42Å; S172-T174 PolarHBondContact O-N 3.36Å; T174-C176 PolarHBondContact O-N 3.46Å; T174-I177 PolarHBondContact O-N 2.93Å; T174-I178 VanDerWaalsContact O-CG1 3.28Å; T174-I178 WeakPolarHBondContact O-CG1 3.4Å; T174-I178 PolarHBondContact O-N 3.31Å
175	V	93.7	Very high	86.8	Confident	70 Å²	70	88.1 Å²	88.1	42%	0.424	49%	0.49	S	S	.	.	H	α-helix	trans	-62.4	-43.4	174.1	170.9	0	0	0	0	111.1	I171 S172 I177 I178 I179	I171-V175 HydrophobicContact CG2-CG2 4.42Å; I171-V175 WeakPolarHBondContact O-CB 3.39Å; I171-V175 VanDerWaalsContact O-CG2 3.23Å; I171-V175 WeakPolarHBondContact O-CG2 3.46Å; I171-V175 PolarHBondContact O-N 2.93Å; S172-V175 PolarHBondContact O-N 3.49Å; V175-I177 VanDerWaalsContact C-N 3.34Å; V175-I177 PolarHBondContact O-N 3.44Å; V175-I178 PolarHBondContact O-N 3.38Å; V175-I179 HydrophobicContact CG1-CD1 3.78Å; V175-I179 HydrophobicContact CG1-CG1 4.43Å; V175-I179 VanDerWaalsContact O-CG1 3.3Å; V175-I179 WeakPolarHBondContact O-CG1 3.41Å; V175-I179 PolarHBondContact O-N 3.36Å
176	C	91.6	Very high	88.2	Confident	67 Å²	67	87.8 Å²	87.8	45%	0.453	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-40.7	176.3	-72.8	0	0	0	0	112.4	S172 V173 T174 I179 L180	S172-C176 WeakPolarHBondContact O-CB 3.43Å; S172-C176 PolarHBondContact O-N 2.97Å; S172-C176 PolarHBondContact O-SG 2.91Å; V173-C176 PolarHBondContact O-N 2.96Å; T174-C176 PolarHBondContact O-N 3.46Å; C176-I179 PolarHBondContact O-N 3.35Å; C176-L180 WeakPolarHBondContact O-CB 3.36Å; C176-L180 PolarHBondContact O-N 3.27Å
177	I	94.5	Very high	89.2	Confident	103 Å²	103	87 Å²	87	53%	0.528	49%	0.491	S	S	.	.	H	α-helix	trans	-65.3	-41.9	176.3	-69.3	166.2	0	0	0	110.8	V173 T174 V175 L180 A181	V173-I177 HydrophobicContact CG1-CD1 3.8Å; V173-I177 HydrophobicContact CG1-CG1 4.46Å; V173-I177 VanDerWaalsContact O-CG1 3.26Å; V173-I177 WeakPolarHBondContact O-CG1 3.27Å; V173-I177 PolarHBondContact O-N 3.3Å; T174-I177 PolarHBondContact O-N 2.93Å; V175-I177 VanDerWaalsContact C-N 3.34Å; V175-I177 PolarHBondContact O-N 3.44Å; I177-L180 PolarHBondContact O-N 2.9Å; I177-A181 WeakPolarHBondContact O-CB 3.4Å; I177-A181 PolarHBondContact O-N 2.86Å
178	I	94.4	Very high	90.1	Very high	114 Å²	114	87.1 Å²	87.1	59%	0.585	49%	0.485	S	S	*	.	H	α-helix	trans	-63.7	-42.8	177.3	-68.6	164.9	0	0	0	110.7	T174 V175 A181 A182	T174-I178 VanDerWaalsContact O-CG1 3.28Å; T174-I178 WeakPolarHBondContact O-CG1 3.4Å; T174-I178 PolarHBondContact O-N 3.31Å; V175-I178 PolarHBondContact O-N 3.38Å; I178-A181 PolarHBondContact O-N 2.87Å; I178-A182 WeakPolarHBondContact O-CB 3.33Å; I178-A182 PolarHBondContact O-N 3.27Å
179	I	93.2	Very high	90.6	Very high	93 Å²	93	90.6 Å²	90.6	48%	0.477	49%	0.491	S	S	.	.	H	α-helix	trans	-64.2	-44.1	176.5	-68	168.6	0	0	0	110.6	V175 C176 A182 I183	V175-I179 HydrophobicContact CG1-CD1 3.78Å; V175-I179 HydrophobicContact CG1-CG1 4.43Å; V175-I179 VanDerWaalsContact O-CG1 3.3Å; V175-I179 WeakPolarHBondContact O-CG1 3.41Å; V175-I179 PolarHBondContact O-N 3.36Å; C176-I179 PolarHBondContact O-N 3.35Å; I179-A182 PolarHBondContact O-N 2.76Å; I179-I183 HydrophobicContact CG2-CD1 3.83Å; I179-I183 HydrophobicContact CG2-CG1 4.44Å; I179-I183 VanDerWaalsContact O-CG1 3.27Å; I179-I183 WeakPolarHBondContact O-CG1 3.33Å; I179-I183 PolarHBondContact O-N 3.12Å
180	L	94.1	Very high	90.8	Very high	103 Å²	103	91.9 Å²	91.9	54%	0.539	49%	0.488	S	S	.	.	H	α-helix	trans	-61.1	-44.7	175.6	-100.9	157.4	0	0	0	111.8	C176 I177 A182 I183 I184	C176-L180 WeakPolarHBondContact O-CB 3.36Å; C176-L180 PolarHBondContact O-N 3.27Å; I177-L180 PolarHBondContact O-N 2.9Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A182 PolarHBondContact O-N 2.88Å; L180-I183 PolarHBondContact O-N 3.47Å; L180-I184 WeakPolarHBondContact O-CB 3.44Å; L180-I184 VanDerWaalsContact O-CG1 3.24Å; L180-I184 WeakPolarHBondContact O-CG1 3.21Å; L180-I184 PolarHBondContact O-N 3.39Å
181	A	94.1	Very high	91	Very high	41 Å²	41	93.6 Å²	93.6	34%	0.339	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-42.7	175.6	0	0	0	0	0	111.2	I177 I178 I183 I184 I185	I177-A181 WeakPolarHBondContact O-CB 3.4Å; I177-A181 PolarHBondContact O-N 2.86Å; I178-A181 PolarHBondContact O-N 2.87Å; A181-I183 PolarHBondContact O-N 3.43Å; A181-I184 PolarHBondContact O-N 3.29Å; A181-I185 VanDerWaalsContact O-CB 3.27Å; A181-I185 WeakPolarHBondContact O-CB 3.35Å; A181-I185 WeakPolarHBondContact O-CD1 3.34Å; A181-I185 WeakPolarHBondContact O-CG1 3.17Å; A181-I185 PolarHBondContact O-N 3.35Å
182	A	92.8	Very high	90.6	Very high	53 Å²	53	93.2 Å²	93.2	44%	0.438	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-39.5	175.8	0	0	0	0	0	112.2	I178 I179 L180 F186	I178-A182 WeakPolarHBondContact O-CB 3.33Å; I178-A182 PolarHBondContact O-N 3.27Å; I179-A182 PolarHBondContact O-N 2.76Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A182 PolarHBondContact O-N 2.88Å; A182-F186 WeakPolarHBondContact O-CB 3.46Å; A182-F186 PolarHBondContact O-N 3.42Å
183	I	93.1	Very high	89.9	Confident	90 Å²	90	97.9 Å²	97.9	46%	0.462	49%	0.49	S	S	.	.	H	α-helix	trans	-65.8	-45.2	174.2	-68.2	166	0	0	0	110.4	I179 L180 A181 I185 F186 C187	I179-I183 HydrophobicContact CG2-CD1 3.83Å; I179-I183 HydrophobicContact CG2-CG1 4.44Å; I179-I183 VanDerWaalsContact O-CG1 3.27Å; I179-I183 WeakPolarHBondContact O-CG1 3.33Å; I179-I183 PolarHBondContact O-N 3.12Å; L180-I183 PolarHBondContact O-N 3.47Å; A181-I183 PolarHBondContact O-N 3.43Å; I183-I185 VanDerWaalsContact C-N 3.35Å; I183-I185 PolarHBondContact O-N 3.02Å; I183-F186 PolarHBondContact O-N 2.93Å; I183-C187 VanDerWaalsContact O-CB 3.26Å; I183-C187 WeakPolarHBondContact O-CB 3.43Å; I183-C187 PolarHBondContact O-N 2.81Å; I183-C187 PolarHBondContact O-SG 3.19Å
184	I	93.9	Very high	88.8	Confident	108 Å²	108	101.5 Å²	101.5	55%	0.554	50%	0.502	S	S	*	.	H	α-helix	trans	-63.1	-43.1	177.8	-69.4	165.2	0	0	0	110.3	L180 A181 C187 Y188	L180-I184 WeakPolarHBondContact O-CB 3.44Å; L180-I184 VanDerWaalsContact O-CG1 3.24Å; L180-I184 WeakPolarHBondContact O-CG1 3.21Å; L180-I184 PolarHBondContact O-N 3.39Å; A181-I184 PolarHBondContact O-N 3.29Å; I184-C187 PolarHBondContact O-N 3.48Å; I184-Y188 WeakPolarHBondContact O-CB 3.07Å; I184-Y188 PolarHBondContact O-N 3.19Å
185	I	93.4	Very high	87.9	Confident	90 Å²	90	104.2 Å²	104.2	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-64.2	-44	175.8	-71.7	166.5	0	0	0	110.1	A181 I183 Y188 F189	A181-I185 VanDerWaalsContact O-CB 3.27Å; A181-I185 WeakPolarHBondContact O-CB 3.35Å; A181-I185 WeakPolarHBondContact O-CD1 3.34Å; A181-I185 WeakPolarHBondContact O-CG1 3.17Å; A181-I185 PolarHBondContact O-N 3.35Å; I183-I185 VanDerWaalsContact C-N 3.35Å; I183-I185 PolarHBondContact O-N 3.02Å; I185-Y188 PolarHBondContact O-N 2.68Å; I185-F189 HydrophobicContact CG2-CD2 3.46Å; I185-F189 VanDerWaalsContact CG2-CD2 3.46Å; I185-F189 HydrophobicContact CG2-CE2 3.44Å; I185-F189 VanDerWaalsContact CG2-CE2 3.44Å; I185-F189 WeakPolarHBondContact O-CB 3.33Å; I185-F189 WeakPolarHBondContact O-CD2 3.39Å; I185-F189 PolarHBondContact O-N 2.62Å
186	F	91.8	Very high	85.9	Confident	118 Å²	118	104.9 Å²	104.9	52%	0.518	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-45.8	175.2	179.4	-99.2	0	0	0	111.4	A182 I183 F189 R190	A182-F186 WeakPolarHBondContact O-CB 3.46Å; A182-F186 PolarHBondContact O-N 3.42Å; I183-F186 PolarHBondContact O-N 2.93Å; F186-F189 PolarHBondContact O-N 2.83Å; F186-R190 HydrophobicContact CD1-CG 4.1Å; F186-R190 HydrophobicContact CE1-CG 3.86Å; F186-R190 HydrophobicContact CE2-CG 4.45Å; F186-R190 HydrophobicContact CZ-CG 4.06Å; F186-R190 WeakPolarHBondContact O-CB 3.23Å; F186-R190 WeakPolarHBondContact O-CG 3.35Å; F186-R190 PolarHBondContact O-N 2.97Å
187	C	90	Very high	83.5	Confident	70 Å²	70	110.3 Å²	110.3	47%	0.473	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-40.9	175	-75.6	0	0	0	0	111.7	I183 I184 R190 Y191	I183-C187 VanDerWaalsContact O-CB 3.26Å; I183-C187 WeakPolarHBondContact O-CB 3.43Å; I183-C187 PolarHBondContact O-N 2.81Å; I183-C187 PolarHBondContact O-SG 3.19Å; I184-C187 PolarHBondContact O-N 3.48Å; C187-R190 PolarHBondContact O-N 2.59Å; C187-Y191 WeakPolarHBondContact O-CB 3.14Å; C187-Y191 PolarHBondContact O-N 3.42Å
188	Y	91.6	Very high	80.7	Confident	123 Å²	123	110.3 Å²	110.3	48%	0.482	54%	0.535	S	S	.	.	H	α-helix	trans	-66.2	-42	175	173.3	-103.4	0	0	0	111.1	I184 I185 Y191 K192	I184-Y188 WeakPolarHBondContact O-CB 3.07Å; I184-Y188 PolarHBondContact O-N 3.19Å; I185-Y188 PolarHBondContact O-N 2.68Å; Y188-Y191 PolarHBondContact O-N 2.89Å; Y188-K192 HydrophobicContact CE1-CD 4.08Å; Y188-K192 WeakPolarHBondContact O-CA 3.49Å; Y188-K192 WeakPolarHBondContact O-CB 3.33Å; Y188-K192 PolarHBondContact O-N 3.15Å
189	F	85.8	Confident	77.9	Confident	126 Å²	126	116.5 Å²	116.5	55%	0.553	55%	0.551	S	S	*	*	H	α-helix	trans	-68.6	-33.8	173	-83.6	-66	0	0	0	111.9	I185 F186 R193	I185-F189 HydrophobicContact CG2-CD2 3.46Å; I185-F189 VanDerWaalsContact CG2-CD2 3.46Å; I185-F189 HydrophobicContact CG2-CE2 3.44Å; I185-F189 VanDerWaalsContact CG2-CE2 3.44Å; I185-F189 WeakPolarHBondContact O-CB 3.33Å; I185-F189 WeakPolarHBondContact O-CD2 3.39Å; I185-F189 PolarHBondContact O-N 2.62Å; F186-F189 PolarHBondContact O-N 2.83Å; F189-R193 WeakPolarHBondContact O-CA 3.02Å; F189-R193 WeakPolarHBondContact O-CB 3.4Å; F189-R193 PolarHBondContact O-N 2.89Å
190	R	85.3	Confident	75.1	Confident	139 Å²	139	122 Å²	122	53%	0.525	57%	0.567	S	S	.	*	H	α-helix	trans	-68.4	-42.7	172.6	-70.8	-137.7	78.2	102.7	-4	111.5	F186 C187 R193 Q194	F186-R190 HydrophobicContact CD1-CG 4.1Å; F186-R190 HydrophobicContact CE1-CG 3.86Å; F186-R190 HydrophobicContact CE2-CG 4.45Å; F186-R190 HydrophobicContact CZ-CG 4.06Å; F186-R190 WeakPolarHBondContact O-CB 3.23Å; F186-R190 WeakPolarHBondContact O-CG 3.35Å; F186-R190 PolarHBondContact O-N 2.97Å; C187-R190 PolarHBondContact O-N 2.59Å; R190-R193 CarbonylContact O-C 3.57Å; R190-R193 PolarHBondContact O-N 3.17Å; R190-Q194 VanDerWaalsContact O-CB 3.24Å; R190-Q194 WeakPolarHBondContact O-CB 3.33Å; R190-Q194 PolarHBondContact O-N 3.02Å
191	Y	82.5	Confident	72.1	Confident	139 Å²	139	121.2 Å²	121.2	55%	0.545	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-51.6	175.7	176.5	-92.2	0	0	0	110.4	C187 Y188 R193 Q194 E195	C187-Y191 WeakPolarHBondContact O-CB 3.14Å; C187-Y191 PolarHBondContact O-N 3.42Å; Y188-Y191 PolarHBondContact O-N 2.89Å; Y191-R193 VanDerWaalsContact C-N 3.31Å; Y191-R193 PolarHBondContact O-N 3.27Å; Y191-Q194 CarbonylContact O-C 3.54Å; Y191-Q194 WeakPolarHBondContact O-CA 3.22Å; Y191-Q194 VanDerWaalsContact O-CB 3.28Å; Y191-Q194 WeakPolarHBondContact O-CB 3.47Å; Y191-Q194 PolarHBondContact O-N 2.99Å; Y191-E195 WeakPolarHBondContact CE1-OE2 3.43Å; Y191-E195 WeakPolarHBondContact O-CB 3.3Å; Y191-E195 PolarHBondContact O-N 3.09Å
192	K	80.6	Confident	69.8	Low	100 Å²	100	127.8 Å²	127.8	44%	0.435	60%	0.598	S	S	.	*	H	α-helix	trans	-63.4	-34.4	175.4	-170.5	172.3	-176.5	173.1	0	111.8	Y188 Q194 E195 S196	Y188-K192 HydrophobicContact CE1-CD 4.08Å; Y188-K192 WeakPolarHBondContact O-CA 3.49Å; Y188-K192 WeakPolarHBondContact O-CB 3.33Å; Y188-K192 PolarHBondContact O-N 3.15Å; K192-Q194 VanDerWaalsContact C-N 3.31Å; K192-E195 CarbonylContact O-C 3.51Å; K192-E195 PolarHBondContact O-N 2.65Å; K192-S196 WeakPolarHBondContact O-CA 3.19Å; K192-S196 WeakPolarHBondContact O-CB 3.23Å; K192-S196 PolarHBondContact O-N 3.43Å; K192-S196 PolarHBondContact O-OG 2.93Å
193	R	70.8	Confident	67	Low	165 Å²	165	128.2 Å²	128.2	62%	0.623	61%	0.607	S	S	*	*	H	α-helix	trans	-72.4	-23.8	171.2	-172.5	175.5	-176.7	-177.4	2.1	112.6	F189 R190 Y191 S196 R197	F189-R193 WeakPolarHBondContact O-CA 3.02Å; F189-R193 WeakPolarHBondContact O-CB 3.4Å; F189-R193 PolarHBondContact O-N 2.89Å; R190-R193 CarbonylContact O-C 3.57Å; R190-R193 PolarHBondContact O-N 3.17Å; Y191-R193 VanDerWaalsContact C-N 3.31Å; Y191-R193 PolarHBondContact O-N 3.27Å; R193-S196 WeakPolarHBondContact CA-OG 3.26Å; R193-R197 WeakPolarHBondContact O-CG 3.47Å; R193-R197 PolarHBondContact O-N 2.94Å
194	Q	69.3	Low	64.6	Low	149 Å²	149	130.9 Å²	130.9	70%	0.696	62%	0.622	S	S	*	*	H	α-helix	trans	-79.6	-28.8	171.5	-174	173.5	-5.9	0	0	111.3	R190 Y191 K192	R190-Q194 VanDerWaalsContact O-CB 3.24Å; R190-Q194 WeakPolarHBondContact O-CB 3.33Å; R190-Q194 PolarHBondContact O-N 3.02Å; Y191-Q194 CarbonylContact O-C 3.54Å; Y191-Q194 WeakPolarHBondContact O-CA 3.22Å; Y191-Q194 VanDerWaalsContact O-CB 3.28Å; Y191-Q194 WeakPolarHBondContact O-CB 3.47Å; Y191-Q194 PolarHBondContact O-N 2.99Å; K192-Q194 VanDerWaalsContact C-N 3.31Å
195	E	69	Low	61.7	Low	128 Å²	128	135.2 Å²	135.2	60%	0.598	64%	0.64	S	S	*	*	H	α-helix	trans	-86.8	-31.1	175.7	-157.3	174.7	-154	0	0	112.7	Y191 K192	Y191-E195 WeakPolarHBondContact CE1-OE2 3.43Å; Y191-E195 WeakPolarHBondContact O-CB 3.3Å; Y191-E195 PolarHBondContact O-N 3.09Å; K192-E195 CarbonylContact O-C 3.51Å; K192-E195 PolarHBondContact O-N 2.65Å
196	S	52.1	Low	59.4	Low	83 Å²	83	138.2 Å²	138.2	58%	0.58	65%	0.652	S	S	*	*	S	Bend	trans	-92.9	0.9	172.8	73.8	0	0	0	0	113.5	K192 R193 P198	K192-S196 WeakPolarHBondContact O-CA 3.19Å; K192-S196 WeakPolarHBondContact O-CB 3.23Å; K192-S196 PolarHBondContact O-N 3.43Å; K192-S196 PolarHBondContact O-OG 2.93Å; R193-S196 WeakPolarHBondContact CA-OG 3.26Å; S196-P198 WeakPolarHBondContact O-CD 3.44Å
197	R	42.1	Very low	56.8	Low	181 Å²	181	139.4 Å²	139.4	68%	0.683	66%	0.664	S	S	*	*	S	Bend	trans	-66.8	114.1	144.8	-88.9	176.8	177.2	-168.1	-1.8	104.6	R193 R199	R193-R197 WeakPolarHBondContact O-CG 3.47Å; R193-R197 PolarHBondContact O-N 2.94Å; R197-R199 PolarHBondContact O-N 3.2Å
198	P	34.4	Very low	54.3	Low	104 Å²	104	142.4 Å²	142.4	68%	0.675	67%	0.671	S	S	*	*			trans	-53.6	127.3	176.1	8.3	-7.3	0	0	0	107.1	S196 Y200	S196-P198 WeakPolarHBondContact O-CD 3.44Å; P198-Y200 PolarHBondContact O-N 3.13Å
199	R	36.4	Very low	51.8	Low	243 Å²	243	141.8 Å²	141.8	92%	0.917	68%	0.68	S	S	*	*			trans	-51.1	97.9	145.5	-89.1	178.2	172.5	162.5	-1.6	103.8	R197 S201	R197-R199 PolarHBondContact O-N 3.2Å; R199-S201 PolarHBondContact O-N 3.14Å
200	Y	34.7	Very low	49.9	Very low	208 Å²	208	144.4 Å²	144.4	82%	0.816	69%	0.687	S	S	*	*			trans	-68.3	93.2	169.4	-154.8	-93.1	0	0	0	104.5	P198 I202	P198-Y200 PolarHBondContact O-N 3.13Å; Y200-I202 PolarHBondContact O-N 3.37Å
201	S	31.5	Very low	48	Very low	87 Å²	87	139.8 Å²	139.8	61%	0.608	67%	0.673	S	S	*	*			trans	-50.7	126.9	166.9	40.4	0	0	0	0	107.8	R199 G203	R199-S201 PolarHBondContact O-N 3.14Å; S201-G203 PolarHBondContact O-N 3.39Å
202	I	45.4	Very low	46.2	Very low	180 Å²	180	136.8 Å²	136.8	92%	0.923	67%	0.67	S	S	*	*	S	Bend	trans	-44.8	120.2	150.1	-75.5	168.6	0	0	0	107.2	Y200	Y200-I202 PolarHBondContact O-N 3.37Å
203	G	33.8	Very low	44.2	Very low	61 Å²	61	138.6 Å²	138.6	63%	0.629	69%	0.692	S	S	*	*			trans	167.2	76.7	179.2	0	0	0	0	0	112.5	S201	S201-G203 PolarHBondContact O-N 3.39Å
204	L	42.2	Very low	43.2	Very low	147 Å²	147	134.4 Å²	134.4	77%	0.77	70%	0.7	S	S	*	*			trans	40.1	95.7	150.5	-76.9	148.8	0	0	0	118	Q206	L204-Q206 HydrophobicContact CD2-CB 4.42Å
205	E	33.3	Very low	42.6	Very low	198 Å²	198	130.1 Å²	130.1	93%	0.925	68%	0.68	S	S	*	*				-128.1	110.5	124.2	-83.9	-170.7	159.9	0	0	107.9
206	Q	45.9	Very low	42.6	Very low	153 Å²	153	126.3 Å²	126.3	72%	0.715	67%	0.667	S	S	*	*			trans	-93	97.4	178.7	178.7	177.3	4.9	0	0	106.6	L204	L204-Q206 HydrophobicContact CD2-CB 4.42Å
207	D	36.6	Very low	43.5	Very low	143 Å²	143	123.5 Å²	123.5	77%	0.765	65%	0.646	S	S	*	*			trans	-172.6	92.2	157.8	-126.7	3.5	0	0	0	105.4
208	E	36.3	Very low	44.9	Very low	134 Å²	134	121 Å²	121	63%	0.626	64%	0.64	S	S	*	*				-165.7	102.3	82.1	-89.4	-75.3	-175.4	0	0	107.5	Y210	E208-Y210 PolarHBondContact O-N 2.94Å; E208-Y210 WeakPolarHBondContact OE2-CD2 3.34Å; E208-Y210 WeakPolarHBondContact OE2-CE2 3.33Å
209	T	39.8	Very low	46.7	Very low	109 Å²	109	118.6 Å²	118.6	67%	0.669	62%	0.622	S	S	*	*			trans	-83.3	89.7	173.1	-27.7	0	0	0	0	107.4	I211	T209-I211 VanDerWaalsContact C-N 3.3Å
210	Y	46.1	Very low	48.4	Very low	181 Å²	181	108.7 Å²	108.7	71%	0.71	59%	0.586	S	S	*	*			trans	-100.9	47.7	165.8	-92.1	-84.2	0	0	0	111.6	E208 R265	E208-Y210 PolarHBondContact O-N 2.94Å; E208-Y210 WeakPolarHBondContact OE2-CD2 3.34Å; E208-Y210 WeakPolarHBondContact OE2-CE2 3.33Å; Y210-R265 PolarHBondContact O-NH1 2.83Å
211	I	44.4	Very low	50.2	Low	42 Å²	42	98.8 Å²	98.8	22%	0.215	55%	0.548	C	S	.	.	S	Bend	trans	-126.1	117.9	151.3	-57.9	-178	0	0	0	104.6	T209 E215 R265	T209-I211 VanDerWaalsContact C-N 3.3Å; I211-E215 HydrophobicContact CG2-CB 3.79Å; I211-E215 WeakPolarHBondContact CG2-O 3.29Å; I211-R265 HydrophobicContact CD1-CB 3.97Å; I211-R265 HydrophobicContact CD1-CG 4.49Å
212	P	45.6	Very low	52.2	Low	77 Å²	77	99.1 Å²	99.1	50%	0.5	54%	0.539	S	S	.	.			trans	-52.1	132.2	166	-18	28.9	0	0	0	108.1	G214 E215	P212-G214 PolarHBondContact O-N 3.29Å; P212-E215 PolarHBondContact O-N 2.77Å
213	P	38.9	Very low	53.1	Low	138 Å²	138	95.3 Å²	95.3	90%	0.896	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	109.2	-178.8	20.3	-31	0	0	0	110
214	G	49.8	Very low	54.6	Low	76 Å²	76	93.5 Å²	93.5	78%	0.784	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	130.3	-15.1	-177.4	0	0	0	0	0	116.9	P212	P212-G214 PolarHBondContact O-N 3.29Å
215	E	56	Low	55.5	Low	60 Å²	60	89.1 Å²	89.1	28%	0.28	47%	0.471	S	S	.	.			trans	-95.2	121.6	-178.7	-69	-169.4	156	0	0	113.3	I211 P212 Q223	I211-E215 HydrophobicContact CG2-CB 3.79Å; I211-E215 WeakPolarHBondContact CG2-O 3.29Å; P212-E215 PolarHBondContact O-N 2.77Å; E215-Q223 PolarHBondContact OE1-NE2 2.95Å
216	S	69.8	Low	56.9	Low	47 Å²	47	85.6 Å²	85.6	33%	0.329	46%	0.463	S	S	.	.			trans	-85.2	160.9	172.7	73.9	0	0	0	0	111.7	K218 D219 L220	S216-K218 PolarHBondContact O-N 2.85Å; S216-K218 VanDerWaalsContact O-N 3.15Å; S216-K218 PolarHBondContact OG-N 3.2Å; S216-D219 WeakPolarHBondContact CA-OD2 3.34Å; S216-D219 VanDerWaalsContact CB-OD2 3.29Å; S216-D219 WeakPolarHBondContact CB-OD2 2.98Å; S216-D219 PolarHBondContact N-OD2 3.32Å; S216-D219 WeakPolarHBondContact O-CB 3.45Å; S216-D219 PolarHBondContact O-N 3.38Å; S216-D219 PolarHBondContact OG-N 3.39Å; S216-D219 PolarHBondContact OG-OD1 3.03Å; S216-D219 PolarHBondContact OG-OD2 3.2Å; S216-L220 PolarHBondContact O-N 3.44Å; S216-L220 VanDerWaalsContact O-N 3.14Å
217	L	70.8	Confident	57.5	Low	24 Å²	24	83 Å²	83	13%	0.126	46%	0.462	C	S	.	.	H	α-helix	trans	-52.7	-35	170.9	171.6	58.5	0	0	0	112.2	D219 L220 I221 W264 E267 V269 I303	L217-D219 VanDerWaalsContact C-N 3.33Å; L217-L220 PolarHBondContact O-N 3.46Å; L217-I221 HydrophobicContact CD1-CD1 4.06Å; L217-I221 HydrophobicContact CD1-CG1 4.33Å; L217-I221 HydrophobicContact CG-CD1 4.14Å; L217-I221 WeakPolarHBondContact O-CG1 3.45Å; L217-I221 PolarHBondContact O-N 3.29Å; L217-I221 VanDerWaalsContact O-N 3.16Å; L217-W264 HydrophobicContact CD1-CE3 3.69Å; L217-W264 HydrophobicContact CD1-CH2 4.15Å; L217-W264 HydrophobicContact CD1-CZ3 3.19Å; L217-W264 HydrophobicContact CD2-CE3 4.34Å; L217-E267 HydrophobicContact CB-CG 4.21Å; L217-E267 HydrophobicContact CD2-CB 4.26Å; L217-V269 HydrophobicContact CD2-CG1 4.28Å; L217-I303 HydrophobicContact CD2-CD1 4.1Å
218	K	70.9	Confident	58.3	Low	129 Å²	129	78.5 Å²	78.5	56%	0.561	45%	0.449	S	S	*	.	H	α-helix	trans	-63.7	-41.5	176.7	-172.9	-177.5	169	-164.4	0	111	S216 I221 E222	S216-K218 PolarHBondContact O-N 2.85Å; S216-K218 VanDerWaalsContact O-N 3.15Å; S216-K218 PolarHBondContact OG-N 3.2Å; K218-I221 PolarHBondContact O-N 2.95Å; K218-E222 WeakPolarHBondContact CE-OE1 3.41Å; K218-E222 IonicContact NZ-OE1 3.63Å; K218-E222 WeakPolarHBondContact O-CG 3.47Å; K218-E222 PolarHBondContact O-N 3.35Å
219	D	73.1	Confident	59.2	Low	54 Å²	54	77.7 Å²	77.7	29%	0.289	46%	0.459	S	S	.	.	H	α-helix	trans	-66.8	-40.6	179.6	-53.1	-39.1	0	0	0	111.4	S216 L217 I221 E222 Q223	S216-D219 WeakPolarHBondContact CA-OD2 3.34Å; S216-D219 VanDerWaalsContact CB-OD2 3.29Å; S216-D219 WeakPolarHBondContact CB-OD2 2.98Å; S216-D219 PolarHBondContact N-OD2 3.32Å; S216-D219 WeakPolarHBondContact O-CB 3.45Å; S216-D219 PolarHBondContact O-N 3.38Å; S216-D219 PolarHBondContact OG-N 3.39Å; S216-D219 PolarHBondContact OG-OD1 3.03Å; S216-D219 PolarHBondContact OG-OD2 3.2Å; L217-D219 VanDerWaalsContact C-N 3.33Å; D219-I221 VanDerWaalsContact C-N 3.33Å; D219-I221 PolarHBondContact O-N 3.02Å; D219-E222 PolarHBondContact O-N 2.9Å; D219-Q223 WeakPolarHBondContact O-CB 3.47Å; D219-Q223 VanDerWaalsContact O-CG 3.23Å; D219-Q223 WeakPolarHBondContact O-CG 3.45Å; D219-Q223 PolarHBondContact O-N 3.02Å
220	L	71.8	Confident	60.1	Low	34 Å²	34	73.9 Å²	73.9	18%	0.178	44%	0.441	C	S	.	.	H	α-helix	trans	-61.1	-41.5	174.7	-71	170.6	0	0	0	112.3	S216 L217 S224 L233	S216-L220 PolarHBondContact O-N 3.44Å; S216-L220 VanDerWaalsContact O-N 3.14Å; L217-L220 PolarHBondContact O-N 3.46Å; L220-S224 WeakPolarHBondContact O-CB 3.36Å; L220-S224 PolarHBondContact O-N 3.13Å; L220-S224 VanDerWaalsContact O-N 3.16Å; L220-S224 PolarHBondContact O-OG 3.29Å; L220-L233 HydrophobicContact CB-CD2 4.42Å
221	I	73.1	Confident	61.1	Low	1 Å²	1	65.8 Å²	65.8	1%	0.005	41%	0.411	C	S	.	.	H	α-helix	trans	-66.2	-45.8	176.6	-68.8	170.6	0	0	0	110	L217 K218 D219 S224 Q225 L233 I303	L217-I221 HydrophobicContact CD1-CD1 4.06Å; L217-I221 HydrophobicContact CD1-CG1 4.33Å; L217-I221 HydrophobicContact CG-CD1 4.14Å; L217-I221 WeakPolarHBondContact O-CG1 3.45Å; L217-I221 PolarHBondContact O-N 3.29Å; L217-I221 VanDerWaalsContact O-N 3.16Å; K218-I221 PolarHBondContact O-N 2.95Å; D219-I221 VanDerWaalsContact C-N 3.33Å; D219-I221 PolarHBondContact O-N 3.02Å; I221-S224 PolarHBondContact O-N 2.63Å; I221-S224 PolarHBondContact O-OG 3.02Å; I221-Q225 WeakPolarHBondContact O-CG 3.28Å; I221-Q225 PolarHBondContact O-N 3.35Å; I221-Q225 VanDerWaalsContact O-N 3.15Å; I221-L233 HydrophobicContact CG1-CD2 4.19Å; I221-L233 HydrophobicContact CG1-CG 4.34Å; I221-I303 HydrophobicContact CD1-CG1 4.11Å
222	E	72.6	Confident	62.1	Low	93 Å²	93	64 Å²	64	44%	0.435	40%	0.404	S	S	.	.	H	α-helix	trans	-62.3	-46.7	178.7	-75.5	178.4	-174.2	0	0	112	K218 D219 S224 Q225 T226	K218-E222 WeakPolarHBondContact CE-OE1 3.41Å; K218-E222 IonicContact NZ-OE1 3.63Å; K218-E222 WeakPolarHBondContact O-CG 3.47Å; K218-E222 PolarHBondContact O-N 3.35Å; D219-E222 PolarHBondContact O-N 2.9Å; E222-S224 VanDerWaalsContact C-N 3.34Å; E222-S224 PolarHBondContact O-N 2.84Å; E222-Q225 PolarHBondContact O-N 3.2Å; E222-T226 PolarHBondContact O-N 2.57Å; E222-T226 PolarHBondContact O-OG1 3.48Å
223	Q	65.5	Low	63.1	Low	101 Å²	101	61 Å²	61	47%	0.472	38%	0.383	S	S	.	.	H	α-helix	trans	-57.1	-46.6	177	-73.5	173.7	8.5	0	0	111.7	E215 D219 Q225 T226	E215-Q223 PolarHBondContact OE1-NE2 2.95Å; D219-Q223 WeakPolarHBondContact O-CB 3.47Å; D219-Q223 VanDerWaalsContact O-CG 3.23Å; D219-Q223 WeakPolarHBondContact O-CG 3.45Å; D219-Q223 PolarHBondContact O-N 3.02Å; Q223-Q225 VanDerWaalsContact C-N 3.29Å; Q223-Q225 PolarHBondContact O-N 3.14Å; Q223-T226 PolarHBondContact O-N 3.15Å; Q223-T226 PolarHBondContact O-OG1 3.16Å
224	S	64.1	Low	64.5	Low	23 Å²	23	57.6 Å²	57.6	16%	0.161	36%	0.361	C	S	.	.	H	α-helix	trans	-67.3	-25.8	-180	67.3	0	0	0	0	114.6	L220 I221 E222 G232	L220-S224 WeakPolarHBondContact O-CB 3.36Å; L220-S224 PolarHBondContact O-N 3.13Å; L220-S224 VanDerWaalsContact O-N 3.16Å; L220-S224 PolarHBondContact O-OG 3.29Å; I221-S224 PolarHBondContact O-N 2.63Å; I221-S224 PolarHBondContact O-OG 3.02Å; E222-S224 VanDerWaalsContact C-N 3.34Å; E222-S224 PolarHBondContact O-N 2.84Å; S224-G232 PolarHBondContact OG-O 3.27Å
225	Q	62.3	Low	65	Low	54 Å²	54	59.5 Å²	59.5	25%	0.252	35%	0.353	S	S	.	.	H	α-helix	trans	-78.6	-24.5	-178.6	-77	170.2	3.9	0	0	113	I221 E222 Q223 S227 G228	I221-Q225 WeakPolarHBondContact O-CG 3.28Å; I221-Q225 PolarHBondContact O-N 3.35Å; I221-Q225 VanDerWaalsContact O-N 3.15Å; E222-Q225 PolarHBondContact O-N 3.2Å; Q223-Q225 VanDerWaalsContact C-N 3.29Å; Q223-Q225 PolarHBondContact O-N 3.14Å; Q225-S227 PolarHBondContact O-N 2.89Å; Q225-S227 VanDerWaalsContact O-N 3.11Å; Q225-G228 PolarHBondContact O-N 3.36Å
226	T	61.5	Low	64.7	Low	124 Å²	124	63.8 Å²	63.8	76%	0.761	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.8	174.8	-23.8	0	0	0	0	112.8	E222 Q223	E222-T226 PolarHBondContact O-N 2.57Å; E222-T226 PolarHBondContact O-OG1 3.48Å; Q223-T226 PolarHBondContact O-N 3.15Å; Q223-T226 PolarHBondContact O-OG1 3.16Å
227	S	58.6	Low	64.2	Low	98 Å²	98	64.5 Å²	64.5	69%	0.685	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.4	177	-54.6	0	0	0	0	114.6	Q225 S229	Q225-S227 PolarHBondContact O-N 2.89Å; Q225-S227 VanDerWaalsContact O-N 3.11Å; S227-S229 PolarHBondContact O-N 2.8Å
228	G	53.5	Low	63.8	Low	49 Å²	49	63.8 Å²	63.8	51%	0.505	38%	0.375	S	S	.	.			trans	81.8	9.9	158.3	0	0	0	0	0	119.2	Q225	Q225-G228 PolarHBondContact O-N 3.36Å
229	S	54.6	Low	63.4	Low	117 Å²	117	66.4 Å²	66.4	82%	0.818	38%	0.381	S	S	*	.	S	Bend	trans	-105.3	1.5	-173.1	-53.8	0	0	0	0	117.1	S227	S227-S229 PolarHBondContact O-N 2.8Å
230	G	60	Low	63.2	Low	30 Å²	30	66.9 Å²	66.9	31%	0.309	39%	0.386	S	S	.	.			trans	158.2	177.5	178.1	0	0	0	0	0	114.5
231	S	66.7	Low	63.7	Low	11 Å²	11	65.3 Å²	65.3	8%	0.077	38%	0.378	C	S	.	.	S	Bend	trans	-89.3	139.9	175	119.3	0	0	0	0	111.2	Y289 F302	S231-Y289 WeakPolarHBondContact CB-O 3.27Å; S231-Y289 PolarHBondContact OG-O 2.85Å; S231-F302 WeakPolarHBondContact O-CD1 3.36Å; S231-F302 WeakPolarHBondContact O-CE1 3.25Å
232	G	64.8	Low	64.1	Low	5 Å²	5	65.3 Å²	65.3	5%	0.052	38%	0.378	C	S	.	.	S	Bend	trans	96.7	-168.9	-175.5	0	0	0	0	0	114.3	S224	S224-G232 PolarHBondContact OG-O 3.27Å
233	L	67.3	Low	64.6	Low	13 Å²	13	69.2 Å²	69.2	7%	0.068	39%	0.393	C	S	.	.	S	Bend	trans	-79.6	162.2	179.8	-70.6	168.8	0	0	0	112.3	L220 I221 V237 Q238 I241 W264 I303	L220-L233 HydrophobicContact CB-CD2 4.42Å; I221-L233 HydrophobicContact CG1-CD2 4.19Å; I221-L233 HydrophobicContact CG1-CG 4.34Å; L233-V237 HydrophobicContact CB-CB 4.4Å; L233-V237 HydrophobicContact CB-CG1 4.34Å; L233-V237 HydrophobicContact CD1-CG1 4.09Å; L233-Q238 HydrophobicContact CB-CG 4.24Å; L233-Q238 WeakPolarHBondContact O-CG 3.44Å; L233-Q238 PolarHBondContact O-NE2 2.77Å; L233-I241 HydrophobicContact CD1-CD1 3.69Å; L233-W264 HydrophobicContact CD1-CH2 3.54Å; L233-W264 HydrophobicContact CD1-CZ3 3.85Å; L233-I303 HydrophobicContact CD1-CG2 4.05Å; L233-I303 PolarHBondContact N-O 3.18Å
234	P	68.5	Low	65.6	Low	66 Å²	66	68.8 Å²	68.8	43%	0.429	39%	0.391	S	S	.	.			trans	-63.2	147.9	177.6	-20.4	34.4	0	0	0	112.3	L236 V237 Q238	P234-L236 VanDerWaalsContact C-N 3.27Å; P234-L236 PolarHBondContact O-N 2.92Å; P234-L236 VanDerWaalsContact O-N 3.1Å; P234-V237 HydrophobicContact CB-CG2 4.43Å; P234-V237 HydrophobicContact CG-CG2 4.44Å; P234-V237 WeakPolarHBondContact O-CA 3.49Å; P234-V237 WeakPolarHBondContact O-CB 3.49Å; P234-V237 PolarHBondContact O-N 2.84Å; P234-Q238 PolarHBondContact O-N 2.59Å
235	L	59.9	Low	66.9	Low	117 Å²	117	68 Å²	68	61%	0.613	39%	0.385	S	S	*	.	H	α-helix	trans	-52.2	-37.5	-173.3	-72.3	171.2	0	0	0	114.7	Q238 R239	L235-Q238 PolarHBondContact O-N 2.75Å; L235-R239 PolarHBondContact O-N 2.69Å
236	L	49.6	Very low	68.3	Low	150 Å²	150	71.7 Å²	71.7	79%	0.785	40%	0.402	S	S	*	.	H	α-helix	trans	-70.4	-31.8	178.5	-69	174.5	0	0	0	112.7	P234	P234-L236 VanDerWaalsContact C-N 3.27Å; P234-L236 PolarHBondContact O-N 2.92Å; P234-L236 VanDerWaalsContact O-N 3.1Å
237	V	60.2	Low	69.8	Low	61 Å²	61	68.3 Å²	68.3	37%	0.37	38%	0.379	S	S	.	.	H	α-helix	trans	-72.8	-41.9	174.1	-177.6	0	0	0	0	109.5	L233 P234 R239 T240 I241	L233-V237 HydrophobicContact CB-CB 4.4Å; L233-V237 HydrophobicContact CB-CG1 4.34Å; L233-V237 HydrophobicContact CD1-CG1 4.09Å; P234-V237 HydrophobicContact CB-CG2 4.43Å; P234-V237 HydrophobicContact CG-CG2 4.44Å; P234-V237 WeakPolarHBondContact O-CA 3.49Å; P234-V237 WeakPolarHBondContact O-CB 3.49Å; P234-V237 PolarHBondContact O-N 2.84Å; V237-R239 VanDerWaalsContact C-N 3.33Å; V237-R239 PolarHBondContact O-N 3.37Å; V237-T240 PolarHBondContact O-N 3.44Å; V237-T240 PolarHBondContact O-OG1 3.44Å; V237-I241 HydrophobicContact CG1-CD1 4.45Å; V237-I241 VanDerWaalsContact O-CG1 3.3Å; V237-I241 WeakPolarHBondContact O-CG1 3.3Å
238	Q	61.4	Low	71.5	Confident	9 Å²	9	67 Å²	67	4%	0.042	37%	0.366	C	S	.	.	H	α-helix	trans	-56.2	-40.5	-178.6	-64.8	-168.6	18.3	0	0	113.5	L233 P234 L235 T240 I241 A304 D306	L233-Q238 HydrophobicContact CB-CG 4.24Å; L233-Q238 WeakPolarHBondContact O-CG 3.44Å; L233-Q238 PolarHBondContact O-NE2 2.77Å; P234-Q238 PolarHBondContact O-N 2.59Å; L235-Q238 PolarHBondContact O-N 2.75Å; Q238-T240 PolarHBondContact O-N 2.98Å; Q238-I241 PolarHBondContact O-N 2.97Å; Q238-A304 HydrophobicContact CB-CB 4.02Å; Q238-A304 HydrophobicContact CG-CB 3.69Å; Q238-D306 WeakPolarHBondContact O-CB 3.48Å; Q238-D306 VanDerWaalsContact O-OD2 3.11Å
239	R	62.4	Low	73.4	Confident	185 Å²	185	71 Å²	71	70%	0.698	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	3.5	-174.8	-71.7	-176.5	176.9	179.4	-0.2	116.4	L235 V237 D306	L235-R239 PolarHBondContact O-N 2.69Å; V237-R239 VanDerWaalsContact C-N 3.33Å; V237-R239 PolarHBondContact O-N 3.37Å; R239-D306 WeakPolarHBondContact CA-OD1 3.45Å
240	T	69.9	Low	75.3	Confident	64 Å²	64	69.1 Å²	69.1	39%	0.393	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-4.8	178.2	63.1	0	0	0	0	113.3	V237 Q238	V237-T240 PolarHBondContact O-N 3.44Å; V237-T240 PolarHBondContact O-OG1 3.44Å; Q238-T240 PolarHBondContact O-N 2.98Å
241	I	81.3	Confident	76.9	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-73.8	-41.1	-169.4	-60.7	-179.3	0	0	0	110.9	L233 V237 Q238 K243 Q244 I245 W264 A304 D306 I319	L233-I241 HydrophobicContact CD1-CD1 3.69Å; V237-I241 HydrophobicContact CG1-CD1 4.45Å; V237-I241 VanDerWaalsContact O-CG1 3.3Å; V237-I241 WeakPolarHBondContact O-CG1 3.3Å; Q238-I241 PolarHBondContact O-N 2.97Å; I241-K243 PolarHBondContact O-N 3.18Å; I241-K243 VanDerWaalsContact O-N 3.14Å; I241-Q244 PolarHBondContact O-N 3.17Å; I241-I245 HydrophobicContact CG2-CD1 3.73Å; I241-I245 HydrophobicContact CG2-CG1 4.01Å; I241-I245 WeakPolarHBondContact O-CG1 3.38Å; I241-I245 PolarHBondContact O-N 3.02Å; I241-W264 HydrophobicContact CD1-CH2 3.94Å; I241-W264 HydrophobicContact CD1-CZ2 4.1Å; I241-W264 HydrophobicContact CD1-CZ3 4.39Å; I241-W264 HydrophobicContact CG1-CH2 4.36Å; I241-W264 HydrophobicContact CG1-CZ2 4Å; I241-W264 HydrophobicContact CG2-CD2 3.97Å; I241-W264 HydrophobicContact CG2-CE3 4.41Å; I241-W264 HydrophobicContact CG2-CG 4.28Å; I241-W264 HydrophobicContact CG2-CZ2 4.24Å; I241-A304 HydrophobicContact CD1-CB 3.58Å; I241-D306 PolarHBondContact N-OD2 3.42Å; I241-I319 HydrophobicContact CB-CD1 4.23Å; I241-I319 HydrophobicContact CG2-CD1 3.75Å
242	A	81.4	Confident	77.8	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.008	36%	0.36	C	S	.	.	H	α-helix	trans	-63.8	-25	-177.1	0	0	0	0	0	113.2	D306 K308 Y317	A242-D306 HydrophobicContact CB-CB 3.88Å; A242-D306 WeakPolarHBondContact CB-OD2 3.49Å; A242-D306 PolarHBondContact N-OD2 3.15Å; A242-K308 HydrophobicContact CB-CB 4.03Å; A242-K308 HydrophobicContact CB-CD 4.37Å; A242-K308 PolarHBondContact O-NZ 3.38Å; A242-Y317 HydrophobicContact CB-CD2 3.67Å; A242-Y317 HydrophobicContact CB-CE2 4.08Å; A242-Y317 HydrophobicContact CB-CG 4.32Å
243	K	83.1	Confident	78.8	Confident	175 Å²	175	79.2 Å²	79.2	76%	0.761	39%	0.391	S	S	*	.	H	α-helix	trans	-71.8	-31.6	173.2	-66.9	-177	-178.6	176.6	0	112.3	I241	I241-K243 PolarHBondContact O-N 3.18Å; I241-K243 VanDerWaalsContact O-N 3.14Å
244	Q	86.8	Confident	79	Confident	92 Å²	92	80.8 Å²	80.8	43%	0.43	41%	0.41	S	S	.	.	H	α-helix	trans	-89.5	-16.6	-177.8	-61.3	174	12.1	0	0	113.2	I241 Q246	I241-Q244 PolarHBondContact O-N 3.17Å; Q244-Q246 PolarHBondContact O-N 3.4Å
245	I	90.6	Very high	79.1	Confident	7 Å²	7	86.5 Å²	86.5	4%	0.036	42%	0.423	C	S	.	.			trans	-74.3	126.4	178.2	-70.8	171.8	0	0	0	110.9	I241 M247 W264 V269 V271 I319	I241-I245 HydrophobicContact CG2-CD1 3.73Å; I241-I245 HydrophobicContact CG2-CG1 4.01Å; I241-I245 WeakPolarHBondContact O-CG1 3.38Å; I241-I245 PolarHBondContact O-N 3.02Å; I245-M247 HydrophobicContact CG2-SD 3.86Å; I245-W264 HydrophobicContact CG1-CB 3.98Å; I245-W264 HydrophobicContact CG1-CG 4.15Å; I245-V269 HydrophobicContact CD1-CG2 4.37Å; I245-V271 HydrophobicContact CD1-CG2 4.1Å; I245-V271 HydrophobicContact CG2-CG2 4.12Å; I245-I319 HydrophobicContact CD1-CD1 3.49Å; I245-I319 VanDerWaalsContact CD1-CD1 3.49Å; I245-I319 HydrophobicContact CD1-CG1 3.72Å; I245-I319 HydrophobicContact CD1-CG2 4Å
246	Q	92.2	Very high	80	Confident	131 Å²	131	82.1 Å²	82.1	61%	0.612	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.3	165.9	-170.4	-179.9	27.6	0	0	109.8	Q244 G262 R263	Q244-Q246 PolarHBondContact O-N 3.4Å; Q246-G262 CarbonylContact O-C 3.27Å; Q246-G262 WeakPolarHBondContact O-CA 3.46Å; Q246-R263 PolarHBondContact N-O 3.31Å; Q246-R263 PolarHBondContact O-N 3.48Å
247	M	93.4	Very high	81.6	Confident	54 Å²	54	75 Å²	75	27%	0.266	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	126.2	174.8	-57.2	-63.7	-90.6	0	0	109.6	I245 W260 V271 V273 Y317	I245-M247 HydrophobicContact CG2-SD 3.86Å; M247-W260 HydrophobicContact CB-CE3 4.19Å; M247-W260 HydrophobicContact CE-CB 3.32Å; M247-W260 HydrophobicContact CE-CD2 3.95Å; M247-W260 HydrophobicContact CE-CE3 4.5Å; M247-W260 HydrophobicContact CE-CG 3.4Å; M247-W260 VanDerWaalsContact CE-CG 3.4Å; M247-W260 HydrophobicContact SD-CB 4.28Å; M247-V271 HydrophobicContact CE-CB 4.09Å; M247-V271 HydrophobicContact CE-CG1 4.02Å; M247-V271 HydrophobicContact SD-CB 4.14Å; M247-V271 HydrophobicContact SD-CG1 4.2Å; M247-V271 HydrophobicContact SD-CG2 4.14Å; M247-V273 HydrophobicContact CE-CG2 3.66Å; M247-Y317 HydrophobicContact CE-CE2 4.47Å; M247-Y317 HydrophobicContact SD-CE2 4.2Å
248	V	94.5	Very high	83.2	Confident	69 Å²	69	74.5 Å²	74.5	42%	0.418	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-56.6	-172.9	-176.7	0	0	0	0	112.3	M261 R263	V248-M261 WeakPolarHBondContact CA-O 3.42Å; V248-M261 HydrophobicContact CB-CE 3.57Å; V248-M261 WeakPolarHBondContact CB-O 3.46Å; V248-M261 HydrophobicContact CB-SD 3.81Å; V248-M261 HydrophobicContact CG1-CE 3.46Å; V248-M261 VanDerWaalsContact CG1-CE 3.46Å; V248-M261 HydrophobicContact CG1-SD 4.29Å; V248-M261 HydrophobicContact CG2-CE 4.3Å; V248-M261 HydrophobicContact CG2-SD 4.04Å; V248-M261 PolarHBondContact N-O 3.31Å; V248-R263 HydrophobicContact CG2-CB 4.43Å; V248-R263 HydrophobicContact CG2-CG 3.94Å
249	K	93.9	Very high	84.7	Confident	135 Å²	135	75.9 Å²	75.9	59%	0.587	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.1	133.8	-174.5	179.1	-176.6	173.8	-173.7	0	110.8	I251 W260 M261	K249-I251 PolarHBondContact O-N 3.24Å; K249-W260 VanDerWaalsContact C-CE3 3.5Å; K249-W260 CarbonylContact O-C 3.45Å; K249-W260 WeakPolarHBondContact O-CA 3.2Å; K249-M261 HydrophobicContact CB-CE 4.26Å; K249-M261 PolarHBondContact N-O 2.97Å; K249-M261 VanDerWaalsContact N-O 3.12Å; K249-M261 PolarHBondContact O-N 2.86Å
250	Q	94.5	Very high	86.3	Confident	76 Å²	76	70.1 Å²	70.1	36%	0.355	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	122.2	167.1	-170.9	175.9	7.9	0	0	109.5	E258 W260	Q250-E258 PolarHBondContact NE2-OE1 3.48Å; Q250-E258 VanDerWaalsContact NE2-OE1 3.11Å; Q250-W260 HydrophobicContact CB-CD2 4.01Å; Q250-W260 HydrophobicContact CB-CE3 4.19Å; Q250-W260 HydrophobicContact CB-CH2 4.15Å; Q250-W260 HydrophobicContact CB-CZ2 3.97Å; Q250-W260 HydrophobicContact CB-CZ3 4.26Å; Q250-W260 HydrophobicContact CG-CZ2 4.39Å
251	I	91.9	Very high	87.6	Confident	71 Å²	71	68.1 Å²	68.1	36%	0.364	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-16.2	-177.8	58.9	175.3	0	0	0	112.7	K249 V259 M261 Y322	K249-I251 PolarHBondContact O-N 3.24Å; I251-V259 HydrophobicContact CD1-CG1 3.85Å; I251-V259 HydrophobicContact CG1-CB 4.1Å; I251-V259 HydrophobicContact CG1-CG1 3.79Å; I251-V259 WeakPolarHBondContact CG1-O 3.45Å; I251-V259 PolarHBondContact N-O 3.03Å; I251-M261 HydrophobicContact CD1-CB 4.37Å; I251-M261 HydrophobicContact CG2-CB 3.73Å; I251-Y322 HydrophobicContact CD1-CD2 4.06Å; I251-Y322 HydrophobicContact CD1-CE2 3.81Å; I251-Y322 HydrophobicContact CG2-CE2 4.45Å
252	G	86.5	Confident	88.3	Confident	27 Å²	27	68.1 Å²	68.1	28%	0.278	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	163.9	176.8	0	0	0	0	0	113	V259	G252-V259 PolarHBondContact N-O 2.91Å; G252-V259 PolarHBondContact O-N 2.85Å
253	K	85.1	Confident	88.8	Confident	161 Å²	161	73 Å²	73	70%	0.7	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.8	119.7	169.5	-174.1	171.1	-179.4	172.5	0	107.7	E258	K253-E258 HydrophobicContact CG-CG 4.45Å
254	G	71.3	Confident	89.1	Confident	46 Å²	46	64.9 Å²	64.9	47%	0.474	31%	0.312	S	S	.	.			trans	-108	-174.1	179.6	0	0	0	0	0	111.8	Y256 G257	G254-Y256 VanDerWaalsContact C-N 3.35Å; G254-G257 PolarHBondContact N-O 3.33Å
255	R	72	Confident	89	Confident	186 Å²	186	65.6 Å²	65.6	70%	0.702	31%	0.311	S	S	*	.	S	Bend	trans	-61.5	-42.7	177	178.6	177.7	173.4	177.1	3.8	112.4
256	Y	78.2	Confident	88.5	Confident	24 Å²	24	67.9 Å²	67.9	9%	0.094	34%	0.336	C	S	.	.	S	Bend	trans	-97.3	-6.5	-168.7	-50.8	-63	0	0	0	114	G254 E278	G254-Y256 VanDerWaalsContact C-N 3.35Å; Y256-E278 HydrophobicContact CD1-CG 4.46Å; Y256-E278 VanDerWaalsContact CD1-OE2 3.27Å; Y256-E278 WeakPolarHBondContact CD1-OE2 3.32Å
257	G	84	Confident	88.3	Confident	2 Å²	2	66.8 Å²	66.8	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.3	-166.4	-172.4	0	0	0	0	0	114.2	G254 V273	G254-G257 PolarHBondContact N-O 3.33Å; G257-V273 CarbonylContact C-O 3.57Å; G257-V273 WeakPolarHBondContact CA-O 3.5Å
258	E	91.8	Very high	88.3	Confident	49 Å²	49	68.3 Å²	68.3	23%	0.229	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	147.1	-177.9	-58	-171.2	148.2	0	0	110.8	Q250 K253 W260 K272 V273	Q250-E258 PolarHBondContact NE2-OE1 3.48Å; Q250-E258 VanDerWaalsContact NE2-OE1 3.11Å; K253-E258 HydrophobicContact CG-CG 4.45Å; E258-W260 PolarHBondContact OE2-NE1 3.11Å; E258-W260 VanDerWaalsContact OE2-NE1 3.13Å; E258-K272 CarbonylContact O-C 3.54Å; E258-K272 WeakPolarHBondContact O-CA 3.41Å; E258-V273 PolarHBondContact N-O 3.07Å; E258-V273 PolarHBondContact O-N 2.88Å
259	V	94.3	Very high	88.4	Confident	38 Å²	38	65 Å²	65	23%	0.23	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.7	174.7	-168.3	0	0	0	0	108.6	I251 G252 V271 K272	I251-V259 HydrophobicContact CD1-CG1 3.85Å; I251-V259 HydrophobicContact CG1-CB 4.1Å; I251-V259 HydrophobicContact CG1-CG1 3.79Å; I251-V259 WeakPolarHBondContact CG1-O 3.45Å; I251-V259 PolarHBondContact N-O 3.03Å; G252-V259 PolarHBondContact N-O 2.91Å; G252-V259 PolarHBondContact O-N 2.85Å; V259-V271 WeakPolarHBondContact CA-O 3.21Å; V259-K272 HydrophobicContact CG2-CB 4.39Å; V259-K272 HydrophobicContact CG2-CG 4.15Å
260	W	95.8	Very high	88.6	Confident	65 Å²	65	59 Å²	59	25%	0.246	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	141.8	-177.9	-71.5	74.8	0	0	0	110.4	M247 K249 Q250 E258 A270 V271	M247-W260 HydrophobicContact CB-CE3 4.19Å; M247-W260 HydrophobicContact CE-CB 3.32Å; M247-W260 HydrophobicContact CE-CD2 3.95Å; M247-W260 HydrophobicContact CE-CE3 4.5Å; M247-W260 HydrophobicContact CE-CG 3.4Å; M247-W260 VanDerWaalsContact CE-CG 3.4Å; M247-W260 HydrophobicContact SD-CB 4.28Å; K249-W260 VanDerWaalsContact C-CE3 3.5Å; K249-W260 CarbonylContact O-C 3.45Å; K249-W260 WeakPolarHBondContact O-CA 3.2Å; Q250-W260 HydrophobicContact CB-CD2 4.01Å; Q250-W260 HydrophobicContact CB-CE3 4.19Å; Q250-W260 HydrophobicContact CB-CH2 4.15Å; Q250-W260 HydrophobicContact CB-CZ2 3.97Å; Q250-W260 HydrophobicContact CB-CZ3 4.26Å; Q250-W260 HydrophobicContact CG-CZ2 4.39Å; E258-W260 PolarHBondContact OE2-NE1 3.11Å; E258-W260 VanDerWaalsContact OE2-NE1 3.13Å; W260-A270 CarbonylContact O-C 3.58Å; W260-A270 WeakPolarHBondContact O-CA 3.32Å; W260-V271 PolarHBondContact N-O 2.8Å; W260-V271 PolarHBondContact O-N 2.83Å
261	M	96.6	Very high	88.6	Confident	21 Å²	21	55.4 Å²	55.4	10%	0.103	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	122.8	159	-176.9	-86.1	-65.8	0	0	107.8	V248 K249 I251 K268 V269 Y322	V248-M261 WeakPolarHBondContact CA-O 3.42Å; V248-M261 HydrophobicContact CB-CE 3.57Å; V248-M261 WeakPolarHBondContact CB-O 3.46Å; V248-M261 HydrophobicContact CB-SD 3.81Å; V248-M261 HydrophobicContact CG1-CE 3.46Å; V248-M261 VanDerWaalsContact CG1-CE 3.46Å; V248-M261 HydrophobicContact CG1-SD 4.29Å; V248-M261 HydrophobicContact CG2-CE 4.3Å; V248-M261 HydrophobicContact CG2-SD 4.04Å; V248-M261 PolarHBondContact N-O 3.31Å; K249-M261 HydrophobicContact CB-CE 4.26Å; K249-M261 PolarHBondContact N-O 2.97Å; K249-M261 VanDerWaalsContact N-O 3.12Å; K249-M261 PolarHBondContact O-N 2.86Å; I251-M261 HydrophobicContact CD1-CB 4.37Å; I251-M261 HydrophobicContact CG2-CB 3.73Å; M261-K268 HydrophobicContact SD-CG 4.39Å; M261-V269 WeakPolarHBondContact CA-O 3.34Å; M261-Y322 HydrophobicContact CB-CD2 4.2Å; M261-Y322 HydrophobicContact CB-CE2 3.94Å; M261-Y322 HydrophobicContact CG-CD1 4.37Å; M261-Y322 HydrophobicContact CG-CD2 3.89Å; M261-Y322 HydrophobicContact CG-CE1 4.26Å; M261-Y322 HydrophobicContact CG-CE2 3.8Å; M261-Y322 HydrophobicContact CG-CG 4.19Å
262	G	95.6	Very high	88.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	170.8	173.6	0	0	0	0	0	111.6	Q246 K268 V269	Q246-G262 CarbonylContact O-C 3.27Å; Q246-G262 WeakPolarHBondContact O-CA 3.46Å; G262-K268 WeakPolarHBondContact O-CA 3.17Å; G262-V269 PolarHBondContact N-O 2.86Å; G262-V269 PolarHBondContact O-N 2.96Å
263	R	93.3	Very high	89.2	Confident	103 Å²	103	52.7 Å²	52.7	39%	0.389	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.2	168.3	-73.6	179.8	180	-84.9	7.2	109.7	Q246 V248 G266 E267	Q246-R263 PolarHBondContact N-O 3.31Å; Q246-R263 PolarHBondContact O-N 3.48Å; V248-R263 HydrophobicContact CG2-CB 4.43Å; V248-R263 HydrophobicContact CG2-CG 3.94Å; R263-G266 PolarHBondContact NH1-O 2.6Å; R263-G266 VanDerWaalsContact NH1-O 3.11Å; R263-E267 CarbonylContact C-O 3.58Å; R263-E267 VanDerWaalsContact CA-O 3.26Å; R263-E267 WeakPolarHBondContact CA-O 3.28Å
264	W	89.3	Confident	89.5	Confident	5 Å²	5	45.2 Å²	45.2	2%	0.019	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	119.1	172	-173.6	46.2	0	0	0	108.5	L217 L233 I241 I245 G266 E267 V269 I303	L217-W264 HydrophobicContact CD1-CE3 3.69Å; L217-W264 HydrophobicContact CD1-CH2 4.15Å; L217-W264 HydrophobicContact CD1-CZ3 3.19Å; L217-W264 HydrophobicContact CD2-CE3 4.34Å; L233-W264 HydrophobicContact CD1-CH2 3.54Å; L233-W264 HydrophobicContact CD1-CZ3 3.85Å; I241-W264 HydrophobicContact CD1-CH2 3.94Å; I241-W264 HydrophobicContact CD1-CZ2 4.1Å; I241-W264 HydrophobicContact CD1-CZ3 4.39Å; I241-W264 HydrophobicContact CG1-CH2 4.36Å; I241-W264 HydrophobicContact CG1-CZ2 4Å; I241-W264 HydrophobicContact CG2-CD2 3.97Å; I241-W264 HydrophobicContact CG2-CE3 4.41Å; I241-W264 HydrophobicContact CG2-CG 4.28Å; I241-W264 HydrophobicContact CG2-CZ2 4.24Å; I245-W264 HydrophobicContact CG1-CB 3.98Å; I245-W264 HydrophobicContact CG1-CG 4.15Å; W264-G266 PolarHBondContact O-N 2.78Å; W264-E267 PolarHBondContact N-O 3.14Å; W264-E267 PolarHBondContact O-N 3.04Å; W264-V269 HydrophobicContact CB-CG1 4.23Å; W264-V269 HydrophobicContact CB-CG2 4.24Å; W264-I303 HydrophobicContact CE3-CG2 4.49Å; W264-I303 HydrophobicContact CZ3-CG2 4.03Å
265	R	83.3	Confident	90.2	Very high	108 Å²	108	48.3 Å²	48.3	41%	0.408	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	41.4	-177.5	-57.8	177.4	170.8	-152.4	-6.7	113.4	Y210 I211 E267	Y210-R265 PolarHBondContact O-NH1 2.83Å; I211-R265 HydrophobicContact CD1-CB 3.97Å; I211-R265 HydrophobicContact CD1-CG 4.49Å; R265-E267 VanDerWaalsContact C-N 3.26Å; R265-E267 PolarHBondContact O-N 2.93Å
266	G	80.3	Confident	90.7	Very high	54 Å²	54	43 Å²	43	56%	0.557	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	86	-26.6	-178.9	0	0	0	0	0	115.2	R263 W264	R263-G266 PolarHBondContact NH1-O 2.6Å; R263-G266 VanDerWaalsContact NH1-O 3.11Å; W264-G266 PolarHBondContact O-N 2.78Å
267	E	88.4	Confident	91.1	Very high	108 Å²	108	47.5 Å²	47.5	51%	0.505	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	148	-179.2	-71.1	-60.3	145.8	0	0	112.9	L217 R263 W264 R265	L217-E267 HydrophobicContact CB-CG 4.21Å; L217-E267 HydrophobicContact CD2-CB 4.26Å; R263-E267 CarbonylContact C-O 3.58Å; R263-E267 VanDerWaalsContact CA-O 3.26Å; R263-E267 WeakPolarHBondContact CA-O 3.28Å; W264-E267 PolarHBondContact N-O 3.14Å; W264-E267 PolarHBondContact O-N 3.04Å; R265-E267 VanDerWaalsContact C-N 3.26Å; R265-E267 PolarHBondContact O-N 2.93Å
268	K	94.6	Very high	91.2	Very high	86 Å²	86	50.1 Å²	50.1	37%	0.374	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	130.2	177	-65.1	179.8	-172.9	169.3	0	110	M261 G262 Y322	M261-K268 HydrophobicContact SD-CG 4.39Å; G262-K268 WeakPolarHBondContact O-CA 3.17Å; K268-Y322 HydrophobicContact CB-CD1 3.64Å; K268-Y322 HydrophobicContact CB-CE1 4.49Å; K268-Y322 HydrophobicContact CB-CG 4.07Å; K268-Y322 HydrophobicContact CD-CD1 3.68Å; K268-Y322 HydrophobicContact CD-CE1 3.75Å; K268-Y322 HydrophobicContact CG-CD1 4.31Å; K268-Y322 WeakPolarHBondContact O-CB 3.47Å
269	V	96.4	Very high	91.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.6	176	-63.7	0	0	0	0	110.7	L217 I245 M261 G262 W264 V271 I303 I319	L217-V269 HydrophobicContact CD2-CG1 4.28Å; I245-V269 HydrophobicContact CD1-CG2 4.37Å; M261-V269 WeakPolarHBondContact CA-O 3.34Å; G262-V269 PolarHBondContact N-O 2.86Å; G262-V269 PolarHBondContact O-N 2.96Å; W264-V269 HydrophobicContact CB-CG1 4.23Å; W264-V269 HydrophobicContact CB-CG2 4.24Å; V269-V271 HydrophobicContact CG2-CG2 4.05Å; V269-I303 HydrophobicContact CB-CD1 4.46Å; V269-I303 HydrophobicContact CG1-CD1 3.78Å; V269-I319 HydrophobicContact CB-CG2 4.12Å; V269-I319 HydrophobicContact CG1-CG2 4.47Å; V269-I319 HydrophobicContact CG2-CG2 4.29Å
270	A	96.9	Very high	90.8	Very high	10 Å²	10	55.2 Å²	55.2	8%	0.083	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128	170.8	0	0	0	0	0	109.3	W260 I319 T320 Y322	W260-A270 CarbonylContact O-C 3.58Å; W260-A270 WeakPolarHBondContact O-CA 3.32Å; A270-I319 WeakPolarHBondContact O-CA 3.41Å; A270-T320 WeakPolarHBondContact CB-OG1 3.33Å; A270-T320 PolarHBondContact N-O 3.39Å; A270-T320 PolarHBondContact O-N 3.03Å; A270-T320 PolarHBondContact O-OG1 2.9Å; A270-Y322 HydrophobicContact CB-CD2 4.38Å
271	V	96.2	Very high	90.5	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	108.6	-176.8	-172.9	0	0	0	0	108.7	I245 M247 V259 W260 V269 V273 Y317 L318 I319	I245-V271 HydrophobicContact CD1-CG2 4.1Å; I245-V271 HydrophobicContact CG2-CG2 4.12Å; M247-V271 HydrophobicContact CE-CB 4.09Å; M247-V271 HydrophobicContact CE-CG1 4.02Å; M247-V271 HydrophobicContact SD-CB 4.14Å; M247-V271 HydrophobicContact SD-CG1 4.2Å; M247-V271 HydrophobicContact SD-CG2 4.14Å; V259-V271 WeakPolarHBondContact CA-O 3.21Å; W260-V271 PolarHBondContact N-O 2.8Å; W260-V271 PolarHBondContact O-N 2.83Å; V269-V271 HydrophobicContact CG2-CG2 4.05Å; V271-V273 HydrophobicContact CG1-CG2 3.97Å; V271-Y317 HydrophobicContact CG1-CD1 4.29Å; V271-Y317 HydrophobicContact CG1-CD2 3.41Å; V271-Y317 VanDerWaalsContact CG1-CD2 3.41Å; V271-Y317 HydrophobicContact CG1-CE2 3.82Å; V271-Y317 HydrophobicContact CG1-CG 3.68Å; V271-L318 WeakPolarHBondContact CA-O 3.41Å; V271-I319 HydrophobicContact CG1-CG1 4.39Å; V271-I319 HydrophobicContact CG2-CG1 4.42Å
272	K	95.3	Very high	90.3	Very high	27 Å²	27	53.4 Å²	53.4	12%	0.117	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.6	170.4	-171.7	176.6	-173.6	-174.9	0	107.9	E258 V259 F274 E285 L318 D391	E258-K272 CarbonylContact O-C 3.54Å; E258-K272 WeakPolarHBondContact O-CA 3.41Å; V259-K272 HydrophobicContact CG2-CB 4.39Å; V259-K272 HydrophobicContact CG2-CG 4.15Å; K272-F274 HydrophobicContact CB-CE2 4.04Å; K272-F274 HydrophobicContact CD-CE1 4.29Å; K272-F274 HydrophobicContact CD-CE2 3.72Å; K272-F274 HydrophobicContact CD-CZ 3.46Å; K272-F274 VanDerWaalsContact CD-CZ 3.46Å; K272-F274 HydrophobicContact CG-CD2 4.22Å; K272-F274 HydrophobicContact CG-CE2 3.57Å; K272-F274 HydrophobicContact CG-CZ 3.79Å; K272-E285 IonicContact NZ-OE1 3.44Å; K272-E285 PolarHBondContact NZ-OE1 3.31Å; K272-E285 IonicContact NZ-OE2 2.69Å; K272-E285 PolarHBondContact NZ-OE2 2.93Å; K272-L318 HydrophobicContact CB-CB 4.27Å; K272-L318 HydrophobicContact CD-CD2 4.42Å; K272-L318 PolarHBondContact N-O 3.5Å; K272-L318 PolarHBondContact O-N 2.68Å; K272-D391 IonicContact NZ-OD1 3.64Å; K272-D391 PolarHBondContact NZ-OD1 3.11Å
273	V	93.8	Very high	90.1	Very high	14 Å²	14	59.4 Å²	59.4	9%	0.085	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113.7	-178.3	-175.3	0	0	0	0	108.3	M247 G257 E258 V271 Q315 L316 Y317	M247-V273 HydrophobicContact CE-CG2 3.66Å; G257-V273 CarbonylContact C-O 3.57Å; G257-V273 WeakPolarHBondContact CA-O 3.5Å; E258-V273 PolarHBondContact N-O 3.07Å; E258-V273 PolarHBondContact O-N 2.88Å; V271-V273 HydrophobicContact CG1-CG2 3.97Å; V273-Q315 HydrophobicContact CG1-CB 3.98Å; V273-Q315 HydrophobicContact CG1-CG 4.27Å; V273-L316 WeakPolarHBondContact CA-O 3.1Å; V273-Y317 HydrophobicContact CB-CD1 4.35Å; V273-Y317 HydrophobicContact CB-CE1 4.2Å; V273-Y317 HydrophobicContact CG1-CD1 4.05Å; V273-Y317 HydrophobicContact CG1-CE1 3.7Å; V273-Y317 HydrophobicContact CG2-CD1 3.87Å; V273-Y317 HydrophobicContact CG2-CE1 3.58Å
274	F	92.2	Very high	90	Very high	3 Å²	3	57.6 Å²	57.6	1%	0.013	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	148.6	178.6	-61	-108.4	0	0	0	110.8	K272 E278 W282 E285 L316 L318	K272-F274 HydrophobicContact CB-CE2 4.04Å; K272-F274 HydrophobicContact CD-CE1 4.29Å; K272-F274 HydrophobicContact CD-CE2 3.72Å; K272-F274 HydrophobicContact CD-CZ 3.46Å; K272-F274 VanDerWaalsContact CD-CZ 3.46Å; K272-F274 HydrophobicContact CG-CD2 4.22Å; K272-F274 HydrophobicContact CG-CE2 3.57Å; K272-F274 HydrophobicContact CG-CZ 3.79Å; F274-E278 HydrophobicContact CD1-CB 4.44Å; F274-W282 HydrophobicContact CB-CB 4.19Å; F274-W282 HydrophobicContact CD1-CB 3.98Å; F274-W282 HydrophobicContact CD2-CB 3.92Å; F274-W282 AromaticContact CD2-CD1 3.54Å; F274-W282 HydrophobicContact CD2-CG 4.09Å; F274-W282 HydrophobicContact CE1-CB 4.29Å; F274-W282 HydrophobicContact CE2-CB 4.23Å; F274-W282 AromaticContact CE2-CD1 3.69Å; F274-W282 HydrophobicContact CE2-CG 4.37Å; F274-W282 HydrophobicContact CG-CB 3.79Å; F274-W282 HydrophobicContact CG-CG 4.4Å; F274-W282 HydrophobicContact CZ-CB 4.39Å; F274-E285 VanDerWaalsContact CZ-OE2 3.3Å; F274-E285 WeakPolarHBondContact CZ-OE2 3.24Å; F274-L316 HydrophobicContact CB-CB 4.23Å; F274-L316 PolarHBondContact N-O 3.25Å; F274-L318 HydrophobicContact CE2-CB 3.85Å; F274-L318 HydrophobicContact CE2-CD2 4.44Å
275	F	85.1	Confident	90.2	Very high	111 Å²	111	57.5 Å²	57.5	49%	0.487	30%	0.301	S	S	.	.			trans	-70.4	150.5	165.6	-59.7	-65.9	0	0	0	109.8	T277 E278	F275-T277 PolarHBondContact O-N 3.41Å; F275-E278 WeakPolarHBondContact O-CA 3.44Å; F275-E278 WeakPolarHBondContact O-CB 3.49Å; F275-E278 PolarHBondContact O-N 3.05Å
276	T	83.9	Confident	90.7	Very high	75 Å²	75	52.9 Å²	52.9	46%	0.46	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-60.8	-27.8	177.6	49.8	0	0	0	0	112.9	E278 E279 T314	T276-E278 PolarHBondContact O-N 3.26Å; T276-E279 PolarHBondContact O-N 3.31Å; T276-T314 HydrophobicContact CG2-CG2 4.44Å; T276-T314 WeakPolarHBondContact CG2-O 3.19Å
277	T	85.9	Confident	91.3	Very high	118 Å²	118	53.6 Å²	53.6	72%	0.724	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-64.6	-17.1	172.7	54.5	0	0	0	0	113.3	F275	F275-T277 PolarHBondContact O-N 3.41Å
278	E	87	Confident	91.6	Very high	58 Å²	58	48.5 Å²	48.5	27%	0.271	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-108.2	25.2	-178.1	-63.9	-64.8	161.9	0	0	112.1	Y256 F274 F275 T276 A280 S281 W282	Y256-E278 HydrophobicContact CD1-CG 4.46Å; Y256-E278 VanDerWaalsContact CD1-OE2 3.27Å; Y256-E278 WeakPolarHBondContact CD1-OE2 3.32Å; F274-E278 HydrophobicContact CD1-CB 4.44Å; F275-E278 WeakPolarHBondContact O-CA 3.44Å; F275-E278 WeakPolarHBondContact O-CB 3.49Å; F275-E278 PolarHBondContact O-N 3.05Å; T276-E278 PolarHBondContact O-N 3.26Å; E278-A280 VanDerWaalsContact C-N 3.31Å; E278-A280 PolarHBondContact O-N 2.72Å; E278-S281 WeakPolarHBondContact O-CB 3.22Å; E278-S281 PolarHBondContact O-N 2.85Å; E278-S281 PolarHBondContact OE2-OG 3.31Å; E278-W282 PolarHBondContact O-N 3.14Å
279	E	89.4	Confident	91.7	Very high	114 Å²	114	44.6 Å²	44.6	53%	0.533	23%	0.233	S	C	.	.	H	α-helix	trans	-56.1	-41.9	179.8	-177.4	176.2	-178.9	0	0	112.8	T276 S281 W282 F283 L316	T276-E279 PolarHBondContact O-N 3.31Å; E279-S281 VanDerWaalsContact C-N 3.27Å; E279-S281 PolarHBondContact O-N 3.18Å; E279-W282 PolarHBondContact O-N 3.42Å; E279-F283 WeakPolarHBondContact O-CB 3.27Å; E279-F283 PolarHBondContact O-N 2.85Å; E279-L316 HydrophobicContact CB-CD1 3.86Å; E279-L316 HydrophobicContact CG-CD1 4Å
280	A	88.4	Confident	91.5	Very high	79 Å²	79	47.5 Å²	47.5	65%	0.653	25%	0.247	S	C	*	.	H	α-helix	trans	-61.6	-36.1	177	0	0	0	0	0	112.4	E278 R284	E278-A280 VanDerWaalsContact C-N 3.31Å; E278-A280 PolarHBondContact O-N 2.72Å; A280-R284 WeakPolarHBondContact O-CB 3.46Å; A280-R284 PolarHBondContact O-N 3.01Å
281	S	88.5	Confident	91.3	Very high	21 Å²	21	47.6 Å²	47.6	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-69.2	-43.6	176.5	-57.8	0	0	0	0	110.9	E278 E279 E285	E278-S281 WeakPolarHBondContact O-CB 3.22Å; E278-S281 PolarHBondContact O-N 2.85Å; E278-S281 PolarHBondContact OE2-OG 3.31Å; E279-S281 VanDerWaalsContact C-N 3.27Å; E279-S281 PolarHBondContact O-N 3.18Å; S281-E285 WeakPolarHBondContact O-CB 3.33Å; S281-E285 PolarHBondContact O-N 2.91Å
282	W	92.4	Very high	91	Very high	28 Å²	28	49 Å²	49	11%	0.106	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-44.8	175	170.6	77.8	0	0	0	112.3	F274 E278 E279 E285 T286 A305 I307 L316 Y317	F274-W282 HydrophobicContact CB-CB 4.19Å; F274-W282 HydrophobicContact CD1-CB 3.98Å; F274-W282 HydrophobicContact CD2-CB 3.92Å; F274-W282 AromaticContact CD2-CD1 3.54Å; F274-W282 HydrophobicContact CD2-CG 4.09Å; F274-W282 HydrophobicContact CE1-CB 4.29Å; F274-W282 HydrophobicContact CE2-CB 4.23Å; F274-W282 AromaticContact CE2-CD1 3.69Å; F274-W282 HydrophobicContact CE2-CG 4.37Å; F274-W282 HydrophobicContact CG-CB 3.79Å; F274-W282 HydrophobicContact CG-CG 4.4Å; F274-W282 HydrophobicContact CZ-CB 4.39Å; E278-W282 PolarHBondContact O-N 3.14Å; E279-W282 PolarHBondContact O-N 3.42Å; W282-E285 PolarHBondContact O-N 2.89Å; W282-T286 VanDerWaalsContact O-CB 3.29Å; W282-T286 WeakPolarHBondContact O-CB 3.21Å; W282-T286 PolarHBondContact O-N 3.28Å; W282-T286 PolarHBondContact O-OG1 3.41Å; W282-A305 HydrophobicContact CZ2-CB 3.84Å; W282-I307 HydrophobicContact CH2-CD1 4.09Å; W282-I307 HydrophobicContact CH2-CG1 4.05Å; W282-I307 HydrophobicContact CZ2-CG1 4.28Å; W282-L316 HydrophobicContact CB-CB 4.3Å; W282-L316 HydrophobicContact CB-CD1 4.06Å; W282-L316 HydrophobicContact CD2-CB 3.8Å; W282-L316 HydrophobicContact CD2-CD1 4.11Å; W282-L316 HydrophobicContact CD2-CG 4.38Å; W282-L316 HydrophobicContact CE3-CB 4.42Å; W282-L316 HydrophobicContact CE3-CD1 4.05Å; W282-L316 HydrophobicContact CE3-CD2 4.4Å; W282-L316 HydrophobicContact CG-CB 3.71Å; W282-L316 HydrophobicContact CG-CD1 4.14Å; W282-L316 HydrophobicContact CZ3-CD2 4.5Å; W282-Y317 PolarHBondContact NE1-O 3.26Å
283	F	91.7	Very high	90.9	Very high	125 Å²	125	52.1 Å²	52.1	55%	0.548	27%	0.273	S	S	.	.	H	α-helix	trans	-61.1	-51.7	179.5	-176	-89.3	0	0	0	110.6	E279 E285 T286 E287	E279-F283 WeakPolarHBondContact O-CB 3.27Å; E279-F283 PolarHBondContact O-N 2.85Å; F283-E285 PolarHBondContact O-N 2.82Å; F283-T286 PolarHBondContact O-N 3.32Å; F283-E287 VanDerWaalsContact O-CB 3.32Å; F283-E287 WeakPolarHBondContact O-CB 3.21Å; F283-E287 PolarHBondContact O-N 3.39Å
284	R	90.4	Very high	90.9	Very high	65 Å²	65	51.6 Å²	51.6	25%	0.245	27%	0.269	C	S	.	.	H	α-helix	trans	-56.6	-52	177.5	175.7	171.6	-72.8	143	1.9	111.5	A280 T286 E287 I288 G393 P408	A280-R284 WeakPolarHBondContact O-CB 3.46Å; A280-R284 PolarHBondContact O-N 3.01Å; R284-T286 VanDerWaalsContact C-N 3.3Å; R284-T286 PolarHBondContact O-N 3.13Å; R284-E287 PolarHBondContact O-N 2.81Å; R284-I288 HydrophobicContact CG-CG1 4.34Å; R284-I288 WeakPolarHBondContact O-CG1 3.43Å; R284-I288 PolarHBondContact O-N 3.09Å; R284-G393 WeakPolarHBondContact CD-O 3.48Å; R284-P408 VanDerWaalsContact CZ-CG 3.42Å
285	E	93.8	Very high	90.9	Very high	3 Å²	3	55.4 Å²	55.4	1%	0.014	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-41.1	-177	-167.1	167.5	172	0	0	111.9	K272 F274 S281 W282 F283 I288 Y289 L318	K272-E285 IonicContact NZ-OE1 3.44Å; K272-E285 PolarHBondContact NZ-OE1 3.31Å; K272-E285 IonicContact NZ-OE2 2.69Å; K272-E285 PolarHBondContact NZ-OE2 2.93Å; F274-E285 VanDerWaalsContact CZ-OE2 3.3Å; F274-E285 WeakPolarHBondContact CZ-OE2 3.24Å; S281-E285 WeakPolarHBondContact O-CB 3.33Å; S281-E285 PolarHBondContact O-N 2.91Å; W282-E285 PolarHBondContact O-N 2.89Å; F283-E285 PolarHBondContact O-N 2.82Å; E285-I288 PolarHBondContact O-N 3.38Å; E285-Y289 HydrophobicContact CG-CD2 3.91Å; E285-Y289 HydrophobicContact CG-CE2 3.74Å; E285-Y289 WeakPolarHBondContact O-CD2 3.22Å; E285-Y289 PolarHBondContact O-N 3.22Å; E285-L318 HydrophobicContact CB-CD2 4.43Å; E285-L318 HydrophobicContact CG-CD2 3.71Å
286	T	94.1	Very high	91.4	Very high	11 Å²	11	52.3 Å²	52.3	7%	0.067	27%	0.271	C	S	.	.	H	α-helix	trans	-60.3	-47.1	174.1	-60	0	0	0	0	111.5	W282 F283 R284 I288 Y289 Q290 A305	W282-T286 VanDerWaalsContact O-CB 3.29Å; W282-T286 WeakPolarHBondContact O-CB 3.21Å; W282-T286 PolarHBondContact O-N 3.28Å; W282-T286 PolarHBondContact O-OG1 3.41Å; F283-T286 PolarHBondContact O-N 3.32Å; R284-T286 VanDerWaalsContact C-N 3.3Å; R284-T286 PolarHBondContact O-N 3.13Å; T286-I288 VanDerWaalsContact C-N 3.35Å; T286-I288 PolarHBondContact O-N 3.4Å; T286-Y289 PolarHBondContact O-N 3.33Å; T286-Q290 HydrophobicContact CG2-CG 4.31Å; T286-Q290 WeakPolarHBondContact O-CB 3.36Å; T286-Q290 WeakPolarHBondContact O-CG 3.43Å; T286-Q290 PolarHBondContact O-N 2.64Å; T286-A305 HydrophobicContact CG2-CB 3.39Å
287	E	93.7	Very high	92.1	Very high	69 Å²	69	54.6 Å²	54.6	32%	0.322	28%	0.276	S	S	.	.	H	α-helix	trans	-64.7	-36.8	-179.4	-165.8	-142.3	135.2	0	0	112.4	F283 R284 T291 K397	F283-E287 VanDerWaalsContact O-CB 3.32Å; F283-E287 WeakPolarHBondContact O-CB 3.21Å; F283-E287 PolarHBondContact O-N 3.39Å; R284-E287 PolarHBondContact O-N 2.81Å; E287-T291 PolarHBondContact O-N 3Å; E287-T291 PolarHBondContact O-OG1 3.42Å; E287-K397 PolarHBondContact O-NZ 3.46Å; E287-K397 IonicContact OE1-NZ 3.43Å; E287-K397 PolarHBondContact OE1-NZ 3.36Å
288	I	94.4	Very high	92.7	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-49.5	172.3	-60.2	-56	0	0	0	109.8	R284 E285 T286 Q290 T291 I369 L392 A395 K397	R284-I288 HydrophobicContact CG-CG1 4.34Å; R284-I288 WeakPolarHBondContact O-CG1 3.43Å; R284-I288 PolarHBondContact O-N 3.09Å; E285-I288 PolarHBondContact O-N 3.38Å; T286-I288 VanDerWaalsContact C-N 3.35Å; T286-I288 PolarHBondContact O-N 3.4Å; I288-Q290 VanDerWaalsContact C-N 3.31Å; I288-Q290 PolarHBondContact O-N 2.98Å; I288-T291 WeakPolarHBondContact O-CB 3.4Å; I288-T291 PolarHBondContact O-N 2.86Å; I288-T291 PolarHBondContact O-OG1 3.11Å; I288-I369 HydrophobicContact CG2-CD1 4.46Å; I288-L392 HydrophobicContact CB-CB 4.24Å; I288-L392 HydrophobicContact CG2-CB 3.76Å; I288-L392 HydrophobicContact CG2-CD1 3.81Å; I288-L392 HydrophobicContact CG2-CG 4.38Å; I288-A395 HydrophobicContact CD1-CB 4.45Å; I288-A395 HydrophobicContact CG1-CB 4.24Å; I288-A395 HydrophobicContact CG2-CB 4.27Å; I288-K397 HydrophobicContact CD1-CD 4Å; I288-K397 VanDerWaalsContact CD1-CE 3.49Å; I288-K397 HydrophobicContact CD1-CG 3.95Å
289	Y	95.3	Very high	93.2	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-36.6	-179.7	-86.7	-61.9	0	0	0	113.4	S231 E285 T286 T291 L300 F302 L318 D391 L392	S231-Y289 WeakPolarHBondContact CB-O 3.27Å; S231-Y289 PolarHBondContact OG-O 2.85Å; E285-Y289 HydrophobicContact CG-CD2 3.91Å; E285-Y289 HydrophobicContact CG-CE2 3.74Å; E285-Y289 WeakPolarHBondContact O-CD2 3.22Å; E285-Y289 PolarHBondContact O-N 3.22Å; T286-Y289 PolarHBondContact O-N 3.33Å; Y289-T291 PolarHBondContact O-N 3.29Å; Y289-L300 HydrophobicContact CE1-CB 4.32Å; Y289-F302 HydrophobicContact CD1-CB 3.84Å; Y289-F302 HydrophobicContact CG-CB 4Å; Y289-F302 HydrophobicContact CG-CD2 4.13Å; Y289-F302 HydrophobicContact CG-CG 4.3Å; Y289-L318 HydrophobicContact CD2-CD1 4.28Å; Y289-L318 HydrophobicContact CD2-CD2 4.06Å; Y289-L318 HydrophobicContact CE2-CD2 3.95Å; Y289-D391 PolarHBondContact OH-N 3.26Å; Y289-L392 HydrophobicContact CD1-CD1 3.89Å; Y289-L392 HydrophobicContact CE1-CD1 3.6Å; Y289-L392 HydrophobicContact CE1-CG 4.17Å; Y289-L392 HydrophobicContact CE2-CB 4.34Å; Y289-L392 HydrophobicContact CE2-CD1 4.39Å; Y289-L392 HydrophobicContact CE2-CG 4.34Å; Y289-L392 HydrophobicContact CG-CD1 4.4Å
290	Q	93.8	Very high	93.6	Very high	61 Å²	61	41.7 Å²	41.7	29%	0.285	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.2	179.8	-73.6	-179.4	-19.5	0	0	114.2	T286 I288 V292 F302	T286-Q290 HydrophobicContact CG2-CG 4.31Å; T286-Q290 WeakPolarHBondContact O-CB 3.36Å; T286-Q290 WeakPolarHBondContact O-CG 3.43Å; T286-Q290 PolarHBondContact O-N 2.64Å; I288-Q290 VanDerWaalsContact C-N 3.31Å; I288-Q290 PolarHBondContact O-N 2.98Å; Q290-V292 PolarHBondContact O-N 3.48Å; Q290-F302 HydrophobicContact CG-CD1 4.34Å; Q290-F302 HydrophobicContact CG-CE1 3.6Å; Q290-F302 HydrophobicContact CG-CZ 3.79Å
291	T	92.1	Very high	93.9	Very high	13 Å²	13	38.2 Å²	38.2	8%	0.08	18%	0.18	C	C	.	.	S	Bend	trans	-50.5	140	178.2	-57	0	0	0	0	111.6	E287 I288 Y289 M294 K366 P367 I369 K397	E287-T291 PolarHBondContact O-N 3Å; E287-T291 PolarHBondContact O-OG1 3.42Å; I288-T291 WeakPolarHBondContact O-CB 3.4Å; I288-T291 PolarHBondContact O-N 2.86Å; I288-T291 PolarHBondContact O-OG1 3.11Å; Y289-T291 PolarHBondContact O-N 3.29Å; T291-M294 WeakPolarHBondContact O-CB 3.37Å; T291-M294 PolarHBondContact O-N 3.3Å; T291-M294 VanDerWaalsContact O-N 3.16Å; T291-K366 HydrophobicContact CG2-CG 4.32Å; T291-P367 HydrophobicContact CG2-CG 4.08Å; T291-I369 HydrophobicContact CG2-CD1 4.39Å; T291-K397 WeakPolarHBondContact OG1-CE 3.22Å; T291-K397 PolarHBondContact OG1-NZ 2.7Å
292	V	90.2	Very high	94.3	Very high	30 Å²	30	37.4 Å²	37.4	18%	0.182	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	140.1	-179.6	-175.5	0	0	0	0	110.3	Q290 M294 Q364 K366	Q290-V292 PolarHBondContact O-N 3.48Å; V292-M294 PolarHBondContact O-N 3.03Å; V292-Q364 HydrophobicContact CB-CB 4.45Å; V292-Q364 HydrophobicContact CG1-CB 3.79Å; V292-Q364 WeakPolarHBondContact CG1-O 3.26Å; V292-Q364 HydrophobicContact CG2-CB 4.42Å; V292-K366 WeakPolarHBondContact O-CB 3.31Å; V292-K366 WeakPolarHBondContact O-CG 3.42Å
293	L	91.8	Very high	94.2	Very high	92 Å²	92	36 Å²	36	48%	0.482	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	21.2	-174	-53.3	167.3	0	0	0	114.5	H355 I360 K366	L293-H355 PolarHBondContact O-CE1 3.28Å; L293-H355 VanDerWaalsContact O-CE1 3.32Å; L293-H355 PolarHBondContact O-NE2 3.32Å; L293-I360 HydrophobicContact CB-CD1 4.36Å; L293-I360 HydrophobicContact CD1-CB 4.31Å; L293-I360 HydrophobicContact CD1-CG2 3.85Å; L293-K366 HydrophobicContact CB-CB 4.13Å
294	M	94.1	Very high	94.2	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	14%	0.142	C	C	.	.			trans	-71.7	-30.4	177.6	-171	59.3	-128.5	0	0	112.9	T291 V292 H296 I299 H355 L356 I369 L392	T291-M294 WeakPolarHBondContact O-CB 3.37Å; T291-M294 PolarHBondContact O-N 3.3Å; T291-M294 VanDerWaalsContact O-N 3.16Å; V292-M294 PolarHBondContact O-N 3.03Å; M294-H296 PolarHBondContact O-N 2.9Å; M294-I299 HydrophobicContact CE-CB 4.3Å; M294-I299 HydrophobicContact CE-CD1 4.05Å; M294-I299 HydrophobicContact CE-CG1 3.81Å; M294-I299 HydrophobicContact CE-CG2 3.69Å; M294-H355 PolarHBondContact O-NE2 3.43Å; M294-L356 HydrophobicContact CE-CD2 3.28Å; M294-L356 HydrophobicContact CE-CG 3.98Å; M294-L356 HydrophobicContact SD-CD2 4.15Å; M294-I369 HydrophobicContact SD-CD1 3.61Å; M294-L392 HydrophobicContact CE-CD1 4.38Å
295	R	92.8	Very high	94.4	Very high	83 Å²	83	27.5 Å²	27.5	31%	0.313	14%	0.135	S	C	.	.			trans	-64.3	126.4	-178	-169.2	168.8	179.1	83.3	1.7	110.6
296	H	96.5	Very high	94.2	Very high	47 Å²	47	28 Å²	28	22%	0.218	14%	0.137	C	C	.	.			trans	-152.1	151.6	179.5	177.7	-92.3	0	0	0	108.6	M294 N298 I299 H355	M294-H296 PolarHBondContact O-N 2.9Å; H296-N298 PolarHBondContact CE1-OD1 3.1Å; H296-N298 PolarHBondContact ND1-N 3.34Å; H296-N298 PolarHBondContact O-N 2.76Å; H296-N298 VanDerWaalsContact O-N 3.1Å; H296-I299 HydrophobicContact CB-CB 4.34Å; H296-I299 HydrophobicContact CB-CG1 3.94Å; H296-I299 PolarHBondContact O-N 3.02Å; H296-I299 VanDerWaalsContact O-O 3.08Å; H296-H355 HydrophobicContact CB-CB 4.38Å; H296-H355 VanDerWaalsContact CB-CD2 3.45Å; H296-H355 WeakPolarHBondContact CB-CD2 3.41Å; H296-H355 AromaticContact CD2-CG 3.8Å; H296-H355 AromaticContact CD2-ND1 3.79Å; H296-H355 AromaticContact CG-CD2 3.96Å; H296-H355 AromaticContact CG-CG 3.73Å
297	E	96.9	Very high	94	Very high	122 Å²	122	31.7 Å²	31.7	57%	0.57	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.4	-176.8	58.9	166.1	159.1	0	0	113.2	K382	E297-K382 WeakPolarHBondContact O-CE 3.01Å; E297-K382 PolarHBondContact O-NZ 3.42Å
298	N	98.6	Very high	93.6	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.016	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	21.6	178.6	-49.1	121.7	0	0	0	113.7	H296 S348 S351 C387 C388 I389	H296-N298 PolarHBondContact CE1-OD1 3.1Å; H296-N298 PolarHBondContact ND1-N 3.34Å; H296-N298 PolarHBondContact O-N 2.76Å; H296-N298 VanDerWaalsContact O-N 3.1Å; N298-S348 WeakPolarHBondContact CB-O 3.1Å; N298-S348 WeakPolarHBondContact ND2-CB 3.32Å; N298-S348 PolarHBondContact OD1-O 2.85Å; N298-S351 WeakPolarHBondContact OD1-CB 3.44Å; N298-C387 WeakPolarHBondContact CA-O 3.41Å; N298-C387 WeakPolarHBondContact CB-O 3.27Å; N298-C387 PolarHBondContact ND2-O 2.99Å; N298-C388 CarbonylContact O-C 3.55Å; N298-C388 VanDerWaalsContact O-CA 3.24Å; N298-C388 WeakPolarHBondContact O-CA 3.47Å; N298-I389 PolarHBondContact O-N 3.37Å
299	I	98.4	Very high	92.9	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-117.2	140.4	165.7	-59	-61.7	0	0	0	107.6	M294 H296 G301 L356 I389	M294-I299 HydrophobicContact CE-CB 4.3Å; M294-I299 HydrophobicContact CE-CD1 4.05Å; M294-I299 HydrophobicContact CE-CG1 3.81Å; M294-I299 HydrophobicContact CE-CG2 3.69Å; H296-I299 HydrophobicContact CB-CB 4.34Å; H296-I299 HydrophobicContact CB-CG1 3.94Å; H296-I299 PolarHBondContact O-N 3.02Å; H296-I299 VanDerWaalsContact O-O 3.08Å; I299-G301 PolarHBondContact O-N 2.83Å; I299-L356 HydrophobicContact CD1-CD1 3.77Å; I299-L356 HydrophobicContact CD1-CD2 4.4Å; I299-L356 HydrophobicContact CD1-CG 3.72Å; I299-I389 HydrophobicContact CD1-CB 4.03Å; I299-I389 HydrophobicContact CD1-CD1 4.46Å
300	L	97.9	Very high	91.7	Very high	13 Å²	13	36.2 Å²	36.2	7%	0.068	20%	0.196	C	C	.	.			trans	-57	128.7	179.6	179.7	57.1	0	0	0	110.4	Y289 F302 T320 D321 L380 I389 A390	Y289-L300 HydrophobicContact CE1-CB 4.32Å; L300-F302 PolarHBondContact O-N 3.2Å; L300-F302 VanDerWaalsContact O-N 3.1Å; L300-T320 HydrophobicContact CD2-CG2 3.96Å; L300-T320 HydrophobicContact CG-CG2 4.19Å; L300-D321 HydrophobicContact CD1-CB 4.28Å; L300-L380 HydrophobicContact CD1-CD1 3.87Å; L300-L380 HydrophobicContact CD2-CD1 4.06Å; L300-I389 WeakPolarHBondContact CB-O 3.41Å; L300-I389 PolarHBondContact N-O 3.47Å; L300-A390 HydrophobicContact CB-CB 4.12Å; L300-A390 HydrophobicContact CD2-CB 3.66Å
301	G	95.5	Very high	90.7	Very high	6 Å²	6	37.4 Å²	37.4	6%	0.062	23%	0.225	C	C	.	.			trans	-68.4	107.8	-178.9	0	0	0	0	0	111.2	I299 T320 D321	I299-G301 PolarHBondContact O-N 2.83Å; G301-T320 CarbonylContact O-C 3.55Å; G301-T320 WeakPolarHBondContact O-CA 3.36Å; G301-T320 WeakPolarHBondContact O-CB 3.42Å; G301-D321 WeakPolarHBondContact CA-OD2 3.37Å; G301-D321 PolarHBondContact O-N 3.13Å
302	F	95.1	Very high	89.8	Confident	3 Å²	3	41.6 Å²	41.6	1%	0.013	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.3	167.7	173.2	-101.2	0	0	0	110.5	S231 Y289 Q290 L300 A304 A305 L318	S231-F302 WeakPolarHBondContact O-CD1 3.36Å; S231-F302 WeakPolarHBondContact O-CE1 3.25Å; Y289-F302 HydrophobicContact CD1-CB 3.84Å; Y289-F302 HydrophobicContact CG-CB 4Å; Y289-F302 HydrophobicContact CG-CD2 4.13Å; Y289-F302 HydrophobicContact CG-CG 4.3Å; Q290-F302 HydrophobicContact CG-CD1 4.34Å; Q290-F302 HydrophobicContact CG-CE1 3.6Å; Q290-F302 HydrophobicContact CG-CZ 3.79Å; L300-F302 PolarHBondContact O-N 3.2Å; L300-F302 VanDerWaalsContact O-N 3.1Å; F302-A304 WeakPolarHBondContact CE2-O 3.47Å; F302-A304 VanDerWaalsContact CZ-CA 3.44Å; F302-A305 HydrophobicContact CE2-CB 4.23Å; F302-A305 HydrophobicContact CZ-CB 4.27Å; F302-L318 HydrophobicContact CD2-CD1 3.83Å; F302-L318 HydrophobicContact CE2-CD1 3.57Å
303	I	91.9	Very high	89.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-56.5	177.6	-58.9	171.6	0	0	0	109.2	L217 I221 L233 W264 V269 I319	L217-I303 HydrophobicContact CD2-CD1 4.1Å; I221-I303 HydrophobicContact CD1-CG1 4.11Å; L233-I303 HydrophobicContact CD1-CG2 4.05Å; L233-I303 PolarHBondContact N-O 3.18Å; W264-I303 HydrophobicContact CE3-CG2 4.49Å; W264-I303 HydrophobicContact CZ3-CG2 4.03Å; V269-I303 HydrophobicContact CB-CD1 4.46Å; V269-I303 HydrophobicContact CG1-CD1 3.78Å; I303-I319 HydrophobicContact CB-CG2 4.16Å; I303-I319 WeakPolarHBondContact CB-O 3.46Å; I303-I319 HydrophobicContact CD1-CG2 4.19Å; I303-I319 HydrophobicContact CG2-CG2 4.42Å; I303-I319 PolarHBondContact N-O 3.39Å
304	A	91.7	Very high	89.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	161.7	-175.3	0	0	0	0	0	112.6	Q238 I241 F302 I319	Q238-A304 HydrophobicContact CB-CB 4.02Å; Q238-A304 HydrophobicContact CG-CB 3.69Å; I241-A304 HydrophobicContact CD1-CB 3.58Å; F302-A304 WeakPolarHBondContact CE2-O 3.47Å; F302-A304 VanDerWaalsContact CZ-CA 3.44Å; A304-I319 HydrophobicContact CB-CD1 4.16Å; A304-I319 PolarHBondContact N-O 3.15Å; A304-I319 WeakPolarHBondContact O-CB 3.47Å; A304-I319 PolarHBondContact O-N 2.92Å
305	A	92.9	Very high	88.8	Confident	10 Å²	10	48.4 Å²	48.4	8%	0.083	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.1	162.3	0	0	0	0	0	108.8	W282 T286 F302 Y317 L318	W282-A305 HydrophobicContact CZ2-CB 3.84Å; T286-A305 HydrophobicContact CG2-CB 3.39Å; F302-A305 HydrophobicContact CE2-CB 4.23Å; F302-A305 HydrophobicContact CZ-CB 4.27Å; A305-Y317 VanDerWaalsContact CA-O 3.28Å; A305-Y317 WeakPolarHBondContact CA-O 3.46Å; A305-L318 HydrophobicContact CB-CD1 4.41Å
306	D	91.6	Very high	88.9	Confident	13 Å²	13	44.7 Å²	44.7	7%	0.07	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	161.2	-173.7	-164.1	9.4	0	0	0	111.2	Q238 R239 I241 A242 Y317	Q238-D306 WeakPolarHBondContact O-CB 3.48Å; Q238-D306 VanDerWaalsContact O-OD2 3.11Å; R239-D306 WeakPolarHBondContact CA-OD1 3.45Å; I241-D306 PolarHBondContact N-OD2 3.42Å; A242-D306 HydrophobicContact CB-CB 3.88Å; A242-D306 WeakPolarHBondContact CB-OD2 3.49Å; A242-D306 PolarHBondContact N-OD2 3.15Å; D306-Y317 PolarHBondContact N-O 3.47Å; D306-Y317 WeakPolarHBondContact O-CB 3.29Å; D306-Y317 PolarHBondContact O-N 3.15Å
307	I	89.2	Confident	88.8	Confident	89 Å²	89	42.8 Å²	42.8	46%	0.456	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.8	-176.9	-57.7	-178.8	0	0	0	108.8	W282 T314 L316	W282-I307 HydrophobicContact CH2-CD1 4.09Å; W282-I307 HydrophobicContact CH2-CG1 4.05Å; W282-I307 HydrophobicContact CZ2-CG1 4.28Å; I307-T314 HydrophobicContact CG2-CG2 3.3Å; I307-L316 HydrophobicContact CB-CD2 4.47Å; I307-L316 HydrophobicContact CD1-CD2 3.95Å; I307-L316 HydrophobicContact CG1-CD2 3.77Å; I307-L316 HydrophobicContact CG2-CD2 4.11Å
308	K	84.7	Confident	88.7	Confident	49 Å²	49	37.1 Å²	37.1	21%	0.213	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.9	179.1	-168.5	175	-173.2	160.9	0	110.9	A242 Q315 Y317	A242-K308 HydrophobicContact CB-CB 4.03Å; A242-K308 HydrophobicContact CB-CD 4.37Å; A242-K308 PolarHBondContact O-NZ 3.38Å; K308-Q315 PolarHBondContact N-O 3.01Å; K308-Q315 PolarHBondContact O-N 3.42Å; K308-Y317 HydrophobicContact CB-CE1 4.47Å; K308-Y317 HydrophobicContact CD-CE2 4.15Å
309	G	79.6	Confident	88.6	Confident	58 Å²	58	37 Å²	37	60%	0.598	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.8	167.1	0	0	0	0	0	110.7
310	T	70.3	Confident	88.4	Confident	63 Å²	63	37.3 Å²	37.3	39%	0.387	23%	0.232	S	C	.	.			trans	-100.2	19.7	172.3	53.9	0	0	0	0	112.4	S312 W313	T310-S312 PolarHBondContact O-N 3.15Å; T310-W313 PolarHBondContact N-O 3.36Å; T310-W313 PolarHBondContact OG1-NE1 3.16Å; T310-W313 PolarHBondContact OG1-O 3.41Å; T310-W313 VanDerWaalsContact OG1-O 3.12Å
311	G	72.2	Confident	88.3	Confident	85 Å²	85	38.6 Å²	38.6	88%	0.876	24%	0.239	S	C	*	.	S	Bend	trans	80.7	-44.4	-175.8	0	0	0	0	0	113.5
312	S	74.6	Confident	88.4	Confident	101 Å²	101	41.1 Å²	41.1	71%	0.706	25%	0.247	S	C	*	.	S	Bend	trans	-97.8	-20	-178	-56	0	0	0	0	114.7	T310	T310-S312 PolarHBondContact O-N 3.15Å
313	W	79.4	Confident	88.5	Confident	159 Å²	159	42.4 Å²	42.4	60%	0.602	25%	0.253	S	S	*	.	S	Bend	trans	-159.4	163.2	173.6	56.6	87.1	0	0	0	110.5	T310	T310-W313 PolarHBondContact N-O 3.36Å; T310-W313 PolarHBondContact OG1-NE1 3.16Å; T310-W313 PolarHBondContact OG1-O 3.41Å; T310-W313 VanDerWaalsContact OG1-O 3.12Å
314	T	86.6	Confident	88.6	Confident	65 Å²	65	47.1 Å²	47.1	40%	0.399	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	140.9	176.6	-59.5	0	0	0	0	109.7	T276 I307 L316	T276-T314 HydrophobicContact CG2-CG2 4.44Å; T276-T314 WeakPolarHBondContact CG2-O 3.19Å; I307-T314 HydrophobicContact CG2-CG2 3.3Å; T314-L316 HydrophobicContact CG2-CD2 4.29Å
315	Q	89.3	Confident	88.8	Confident	43 Å²	43	49.8 Å²	49.8	20%	0.201	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.8	173	-60.2	-173.3	-38.2	0	0	109.7	V273 K308 Y317	V273-Q315 HydrophobicContact CG1-CB 3.98Å; V273-Q315 HydrophobicContact CG1-CG 4.27Å; K308-Q315 PolarHBondContact N-O 3.01Å; K308-Q315 PolarHBondContact O-N 3.42Å; Q315-Y317 HydrophobicContact CB-CD1 4.07Å; Q315-Y317 HydrophobicContact CB-CE1 3.61Å; Q315-Y317 PolarHBondContact OE1-OH 2.96Å
316	L	93.3	Very high	89	Confident	6 Å²	6	50.3 Å²	50.3	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.2	177.9	-49.7	172.6	0	0	0	108.2	V273 F274 E279 W282 I307 T314	V273-L316 WeakPolarHBondContact CA-O 3.1Å; F274-L316 HydrophobicContact CB-CB 4.23Å; F274-L316 PolarHBondContact N-O 3.25Å; E279-L316 HydrophobicContact CB-CD1 3.86Å; E279-L316 HydrophobicContact CG-CD1 4Å; W282-L316 HydrophobicContact CB-CB 4.3Å; W282-L316 HydrophobicContact CB-CD1 4.06Å; W282-L316 HydrophobicContact CD2-CB 3.8Å; W282-L316 HydrophobicContact CD2-CD1 4.11Å; W282-L316 HydrophobicContact CD2-CG 4.38Å; W282-L316 HydrophobicContact CE3-CB 4.42Å; W282-L316 HydrophobicContact CE3-CD1 4.05Å; W282-L316 HydrophobicContact CE3-CD2 4.4Å; W282-L316 HydrophobicContact CG-CB 3.71Å; W282-L316 HydrophobicContact CG-CD1 4.14Å; W282-L316 HydrophobicContact CZ3-CD2 4.5Å; I307-L316 HydrophobicContact CB-CD2 4.47Å; I307-L316 HydrophobicContact CD1-CD2 3.95Å; I307-L316 HydrophobicContact CG1-CD2 3.77Å; I307-L316 HydrophobicContact CG2-CD2 4.11Å; T314-L316 HydrophobicContact CG2-CD2 4.29Å
317	Y	94.8	Very high	89.3	Confident	6 Å²	6	50.1 Å²	50.1	2%	0.024	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.8	-175.7	-77.6	19.9	0	0	0	109.8	A242 M247 V271 V273 W282 A305 D306 K308 Q315	A242-Y317 HydrophobicContact CB-CD2 3.67Å; A242-Y317 HydrophobicContact CB-CE2 4.08Å; A242-Y317 HydrophobicContact CB-CG 4.32Å; M247-Y317 HydrophobicContact CE-CE2 4.47Å; M247-Y317 HydrophobicContact SD-CE2 4.2Å; V271-Y317 HydrophobicContact CG1-CD1 4.29Å; V271-Y317 HydrophobicContact CG1-CD2 3.41Å; V271-Y317 VanDerWaalsContact CG1-CD2 3.41Å; V271-Y317 HydrophobicContact CG1-CE2 3.82Å; V271-Y317 HydrophobicContact CG1-CG 3.68Å; V273-Y317 HydrophobicContact CB-CD1 4.35Å; V273-Y317 HydrophobicContact CB-CE1 4.2Å; V273-Y317 HydrophobicContact CG1-CD1 4.05Å; V273-Y317 HydrophobicContact CG1-CE1 3.7Å; V273-Y317 HydrophobicContact CG2-CD1 3.87Å; V273-Y317 HydrophobicContact CG2-CE1 3.58Å; W282-Y317 PolarHBondContact NE1-O 3.26Å; A305-Y317 VanDerWaalsContact CA-O 3.28Å; A305-Y317 WeakPolarHBondContact CA-O 3.46Å; D306-Y317 PolarHBondContact N-O 3.47Å; D306-Y317 WeakPolarHBondContact O-CB 3.29Å; D306-Y317 PolarHBondContact O-N 3.15Å; K308-Y317 HydrophobicContact CB-CE1 4.47Å; K308-Y317 HydrophobicContact CD-CE2 4.15Å; Q315-Y317 HydrophobicContact CB-CD1 4.07Å; Q315-Y317 HydrophobicContact CB-CE1 3.61Å; Q315-Y317 PolarHBondContact OE1-OH 2.96Å
318	L	95.2	Very high	89.7	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	117.9	163	-179.6	75.7	0	0	0	107.7	V271 K272 F274 E285 Y289 F302 A305 T320	V271-L318 WeakPolarHBondContact CA-O 3.41Å; K272-L318 HydrophobicContact CB-CB 4.27Å; K272-L318 HydrophobicContact CD-CD2 4.42Å; K272-L318 PolarHBondContact N-O 3.5Å; K272-L318 PolarHBondContact O-N 2.68Å; F274-L318 HydrophobicContact CE2-CB 3.85Å; F274-L318 HydrophobicContact CE2-CD2 4.44Å; E285-L318 HydrophobicContact CB-CD2 4.43Å; E285-L318 HydrophobicContact CG-CD2 3.71Å; Y289-L318 HydrophobicContact CD2-CD1 4.28Å; Y289-L318 HydrophobicContact CD2-CD2 4.06Å; Y289-L318 HydrophobicContact CE2-CD2 3.95Å; F302-L318 HydrophobicContact CD2-CD1 3.83Å; F302-L318 HydrophobicContact CE2-CD1 3.57Å; A305-L318 HydrophobicContact CB-CD1 4.41Å; L318-T320 HydrophobicContact CG-CG2 4.5Å
319	I	95.7	Very high	90.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.8	-170	-55.4	152.1	0	0	0	108.8	I241 I245 V269 A270 V271 I303 A304	I241-I319 HydrophobicContact CB-CD1 4.23Å; I241-I319 HydrophobicContact CG2-CD1 3.75Å; I245-I319 HydrophobicContact CD1-CD1 3.49Å; I245-I319 VanDerWaalsContact CD1-CD1 3.49Å; I245-I319 HydrophobicContact CD1-CG1 3.72Å; I245-I319 HydrophobicContact CD1-CG2 4Å; V269-I319 HydrophobicContact CB-CG2 4.12Å; V269-I319 HydrophobicContact CG1-CG2 4.47Å; V269-I319 HydrophobicContact CG2-CG2 4.29Å; A270-I319 WeakPolarHBondContact O-CA 3.41Å; V271-I319 HydrophobicContact CG1-CG1 4.39Å; V271-I319 HydrophobicContact CG2-CG1 4.42Å; I303-I319 HydrophobicContact CB-CG2 4.16Å; I303-I319 WeakPolarHBondContact CB-O 3.46Å; I303-I319 HydrophobicContact CD1-CG2 4.19Å; I303-I319 HydrophobicContact CG2-CG2 4.42Å; I303-I319 PolarHBondContact N-O 3.39Å; A304-I319 HydrophobicContact CB-CD1 4.16Å; A304-I319 PolarHBondContact N-O 3.15Å; A304-I319 WeakPolarHBondContact O-CB 3.47Å; A304-I319 PolarHBondContact O-N 2.92Å
320	T	96.1	Very high	91.2	Very high	11 Å²	11	46.5 Å²	46.5	7%	0.067	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	167.2	-173.5	57.6	0	0	0	0	111.3	A270 L300 G301 L318	A270-T320 WeakPolarHBondContact CB-OG1 3.33Å; A270-T320 PolarHBondContact N-O 3.39Å; A270-T320 PolarHBondContact O-N 3.03Å; A270-T320 PolarHBondContact O-OG1 2.9Å; L300-T320 HydrophobicContact CD2-CG2 3.96Å; L300-T320 HydrophobicContact CG-CG2 4.19Å; G301-T320 CarbonylContact O-C 3.55Å; G301-T320 WeakPolarHBondContact O-CA 3.36Å; G301-T320 WeakPolarHBondContact O-CB 3.42Å; L318-T320 HydrophobicContact CG-CG2 4.5Å
321	D	95.8	Very high	92.5	Very high	40 Å²	40	45.5 Å²	45.5	21%	0.214	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	137.5	171.2	-69.2	-20.8	0	0	0	110.9	L300 G301	L300-D321 HydrophobicContact CD1-CB 4.28Å; G301-D321 WeakPolarHBondContact CA-OD2 3.37Å; G301-D321 PolarHBondContact O-N 3.13Å
322	Y	96.6	Very high	93.8	Very high	60 Å²	60	41.5 Å²	41.5	24%	0.235	21%	0.211	C	C	.	.			trans	-89	132.9	172.6	177.7	-106.2	0	0	0	111.2	I251 M261 K268 A270 E324	I251-Y322 HydrophobicContact CD1-CD2 4.06Å; I251-Y322 HydrophobicContact CD1-CE2 3.81Å; I251-Y322 HydrophobicContact CG2-CE2 4.45Å; M261-Y322 HydrophobicContact CB-CD2 4.2Å; M261-Y322 HydrophobicContact CB-CE2 3.94Å; M261-Y322 HydrophobicContact CG-CD1 4.37Å; M261-Y322 HydrophobicContact CG-CD2 3.89Å; M261-Y322 HydrophobicContact CG-CE1 4.26Å; M261-Y322 HydrophobicContact CG-CE2 3.8Å; M261-Y322 HydrophobicContact CG-CG 4.19Å; K268-Y322 HydrophobicContact CB-CD1 3.64Å; K268-Y322 HydrophobicContact CB-CE1 4.49Å; K268-Y322 HydrophobicContact CB-CG 4.07Å; K268-Y322 HydrophobicContact CD-CD1 3.68Å; K268-Y322 HydrophobicContact CD-CE1 3.75Å; K268-Y322 HydrophobicContact CG-CD1 4.31Å; K268-Y322 WeakPolarHBondContact O-CB 3.47Å; A270-Y322 HydrophobicContact CB-CD2 4.38Å; Y322-E324 HydrophobicContact CE1-CB 4Å
323	H	96.8	Very high	94.8	Very high	29 Å²	29	42.1 Å²	42.1	13%	0.134	20%	0.201	C	C	.	.			trans	-119.1	117.1	174.3	-66.2	-33.7	0	0	0	110.8	N325 G326 L380 C388	H323-N325 PolarHBondContact O-N 3.06Å; H323-G326 PolarHBondContact O-N 2.85Å; H323-G326 VanDerWaalsContact O-N 3.15Å; H323-L380 HydrophobicContact CB-CB 4.37Å; H323-C388 PolarHBondContact CD2-SG 3.13Å; H323-C388 PolarHBondContact NE2-SG 3.12Å
324	E	95	Very high	95.5	Very high	100 Å²	100	39.1 Å²	39.1	47%	0.467	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-28.3	-170.5	65.6	-169.3	163.7	0	0	114.4	Y322 G326 R383	Y322-E324 HydrophobicContact CE1-CB 4Å; E324-G326 PolarHBondContact O-N 3.38Å; E324-R383 WeakPolarHBondContact OE1-CD 3.48Å; E324-R383 WeakPolarHBondContact OE1-CG 3.38Å; E324-R383 IonicContact OE1-NE 3.84Å
325	N	96.3	Very high	95.9	Very high	56 Å²	56	37.8 Å²	37.8	30%	0.299	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-4.6	175.5	-66	-34	0	0	0	112.6	H323 Y331 V381 K382	H323-N325 PolarHBondContact O-N 3.06Å; N325-Y331 HydrophobicContact CB-CD2 3.92Å; N325-Y331 HydrophobicContact CB-CE2 4.31Å; N325-V381 HydrophobicContact CB-CB 3.95Å; N325-V381 HydrophobicContact CB-CG1 4.19Å; N325-V381 WeakPolarHBondContact CB-O 3.43Å; N325-K382 PolarHBondContact ND2-O 3.05Å
326	G	96.1	Very high	96.2	Very high	21 Å²	21	39.5 Å²	39.5	22%	0.216	21%	0.21	C	C	.	.			trans	66.5	-149.8	176.9	0	0	0	0	0	112.8	H323 E324 L380 V381	H323-G326 PolarHBondContact O-N 2.85Å; H323-G326 VanDerWaalsContact O-N 3.15Å; E324-G326 PolarHBondContact O-N 3.38Å; G326-L380 WeakPolarHBondContact O-CA 3.49Å; G326-V381 PolarHBondContact O-N 2.67Å
327	S	97.7	Very high	96.4	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.063	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-76	157	179	72.2	0	0	0	0	112	Y329 D330 Y331 K377 I379	S327-Y329 PolarHBondContact O-N 2.84Å; S327-Y329 WeakPolarHBondContact OG-CB 3.35Å; S327-D330 PolarHBondContact N-OD2 3Å; S327-D330 PolarHBondContact O-N 2.77Å; S327-D330 PolarHBondContact OG-N 2.99Å; S327-D330 PolarHBondContact OG-OD2 2.95Å; S327-Y331 WeakPolarHBondContact O-CB 3.37Å; S327-Y331 PolarHBondContact O-N 3.09Å; S327-K377 WeakPolarHBondContact CB-O 3.38Å; S327-I379 CarbonylContact C-O 3.41Å; S327-I379 VanDerWaalsContact CA-O 3.27Å; S327-I379 WeakPolarHBondContact CA-O 3.13Å
328	L	98.7	Very high	96.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.8	-34.8	172.1	178.8	66.7	0	0	0	110.4	Y331 L332 L345 S376 I379 V381 I447 I451	L328-Y331 PolarHBondContact O-N 3.3Å; L328-L332 HydrophobicContact CD1-CD1 3.95Å; L328-L332 HydrophobicContact CD1-CD2 4.19Å; L328-L332 HydrophobicContact CD1-CG 3.81Å; L328-L332 HydrophobicContact CD2-CD1 4.41Å; L328-L332 HydrophobicContact CG-CD1 3.78Å; L328-L332 HydrophobicContact CG-CG 4.08Å; L328-L332 VanDerWaalsContact O-CB 3.28Å; L328-L332 WeakPolarHBondContact O-CB 3.34Å; L328-L332 WeakPolarHBondContact O-CG 3.46Å; L328-L332 PolarHBondContact O-N 3.13Å; L328-L345 HydrophobicContact CD1-CD1 4.13Å; L328-L345 HydrophobicContact CD1-CD2 4.34Å; L328-S376 WeakPolarHBondContact CB-O 3.31Å; L328-S376 PolarHBondContact N-O 3.04Å; L328-I379 HydrophobicContact CB-CB 4.11Å; L328-I379 HydrophobicContact CB-CG2 4.18Å; L328-I379 HydrophobicContact CD2-CB 4.39Å; L328-I379 HydrophobicContact CD2-CD1 4.43Å; L328-I379 HydrophobicContact CD2-CG2 4.28Å; L328-I379 PolarHBondContact N-O 2.68Å; L328-V381 HydrophobicContact CB-CG2 4.18Å; L328-V381 HydrophobicContact CD1-CG2 3.94Å; L328-I447 HydrophobicContact CD2-CG2 3.75Å; L328-I451 HydrophobicContact CD1-CG1 4.36Å; L328-I451 HydrophobicContact CD2-CD1 3.92Å; L328-I451 HydrophobicContact CD2-CG1 3.94Å
329	Y	98.1	Very high	96.5	Very high	37 Å²	37	45.2 Å²	45.2	15%	0.145	24%	0.241	C	C	.	.	H	α-helix	trans	-55	-50.7	170.2	172.3	-87.7	0	0	0	112.2	S327 K333 S376 K377 Y464 L466	S327-Y329 PolarHBondContact O-N 2.84Å; S327-Y329 WeakPolarHBondContact OG-CB 3.35Å; Y329-K333 HydrophobicContact CD1-CD 4.19Å; Y329-K333 HydrophobicContact CE1-CD 3.55Å; Y329-K333 HydrophobicContact CE2-CD 4.3Å; Y329-K333 WeakPolarHBondContact O-CG 3.43Å; Y329-K333 PolarHBondContact O-N 3.43Å; Y329-K333 PolarHBondContact OH-NZ 2.87Å; Y329-S376 PolarHBondContact N-O 2.68Å; Y329-K377 HydrophobicContact CD1-CG 4.16Å; Y329-K377 HydrophobicContact CD2-CG 4.04Å; Y329-K377 HydrophobicContact CG-CD 4.46Å; Y329-K377 HydrophobicContact CG-CG 3.68Å; Y329-Y464 AromaticContact CD2-CE1 3.91Å; Y329-Y464 HydrophobicContact CD2-CE1 3.91Å; Y329-Y464 AromaticContact CD2-CZ 3.68Å; Y329-Y464 WeakPolarHBondContact CD2-OH 3.49Å; Y329-Y464 AromaticContact CE2-CE1 3.56Å; Y329-Y464 HydrophobicContact CE2-CE1 3.56Å; Y329-Y464 AromaticContact CE2-CZ 3.82Å; Y329-Y464 WeakPolarHBondContact CE2-OH 3.2Å; Y329-L466 HydrophobicContact CD2-CD2 4.07Å; Y329-L466 HydrophobicContact CE2-CD1 4.42Å; Y329-L466 HydrophobicContact CE2-CD2 3.97Å; Y329-L466 HydrophobicContact CE2-CG 4.22Å
330	D	96.6	Very high	96.5	Very high	82 Å²	82	49.3 Å²	49.3	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-69.1	-39	-179.5	-58.5	-51.8	0	0	0	111.7	S327 K333 S334	S327-D330 PolarHBondContact N-OD2 3Å; S327-D330 PolarHBondContact O-N 2.77Å; S327-D330 PolarHBondContact OG-N 2.99Å; S327-D330 PolarHBondContact OG-OD2 2.95Å; D330-K333 PolarHBondContact O-N 2.77Å; D330-S334 PolarHBondContact O-N 3.39Å; D330-S334 PolarHBondContact O-OG 3.11Å
331	Y	98.3	Very high	96.6	Very high	43 Å²	43	49.6 Å²	49.6	17%	0.169	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-48	178.7	-169.4	-100.2	0	0	0	111.7	N325 S327 L328 K333 S334 T335 L337 L345 V381	N325-Y331 HydrophobicContact CB-CD2 3.92Å; N325-Y331 HydrophobicContact CB-CE2 4.31Å; S327-Y331 WeakPolarHBondContact O-CB 3.37Å; S327-Y331 PolarHBondContact O-N 3.09Å; L328-Y331 PolarHBondContact O-N 3.3Å; Y331-K333 VanDerWaalsContact C-N 3.29Å; Y331-K333 PolarHBondContact O-N 2.9Å; Y331-S334 PolarHBondContact O-N 2.61Å; Y331-S334 PolarHBondContact O-OG 2.91Å; Y331-T335 HydrophobicContact CE1-CG2 3.9Å; Y331-T335 HydrophobicContact CE2-CG2 4.43Å; Y331-T335 WeakPolarHBondContact O-CB 3.47Å; Y331-T335 PolarHBondContact O-N 3.38Å; Y331-T335 PolarHBondContact O-OG1 3.44Å; Y331-L337 HydrophobicContact CE1-CD2 4.01Å; Y331-L345 HydrophobicContact CD1-CD1 4.28Å; Y331-L345 HydrophobicContact CE1-CD1 4.08Å; Y331-V381 HydrophobicContact CD1-CG1 4.33Å; Y331-V381 HydrophobicContact CD1-CG2 4.1Å; Y331-V381 HydrophobicContact CD2-CB 4.23Å; Y331-V381 HydrophobicContact CD2-CG1 4.02Å; Y331-V381 HydrophobicContact CD2-CG2 4.39Å; Y331-V381 HydrophobicContact CE1-CG1 4.37Å; Y331-V381 HydrophobicContact CE2-CG1 4.06Å; Y331-V381 HydrophobicContact CG-CB 4.17Å; Y331-V381 HydrophobicContact CG-CG1 4.15Å; Y331-V381 HydrophobicContact CG-CG2 3.83Å
332	L	98.3	Very high	96.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67	-28.1	-179.5	-70.1	176.9	0	0	0	112.8	L328 S334 L337 E450 I451 R454 Y464	L328-L332 HydrophobicContact CD1-CD1 3.95Å; L328-L332 HydrophobicContact CD1-CD2 4.19Å; L328-L332 HydrophobicContact CD1-CG 3.81Å; L328-L332 HydrophobicContact CD2-CD1 4.41Å; L328-L332 HydrophobicContact CG-CD1 3.78Å; L328-L332 HydrophobicContact CG-CG 4.08Å; L328-L332 VanDerWaalsContact O-CB 3.28Å; L328-L332 WeakPolarHBondContact O-CB 3.34Å; L328-L332 WeakPolarHBondContact O-CG 3.46Å; L328-L332 PolarHBondContact O-N 3.13Å; L332-S334 VanDerWaalsContact C-N 3.35Å; L332-L337 HydrophobicContact CD2-CD1 3.75Å; L332-L337 HydrophobicContact CD2-CG 4.45Å; L332-E450 HydrophobicContact CD1-CB 3.97Å; L332-I451 HydrophobicContact CD1-CG1 4.17Å; L332-R454 HydrophobicContact CB-CG 4Å; L332-R454 HydrophobicContact CD2-CB 3.94Å; L332-R454 HydrophobicContact CD2-CG 3.83Å; L332-R454 HydrophobicContact CG-CG 4.4Å; L332-R454 WeakPolarHBondContact O-CD 3.25Å; L332-R454 PolarHBondContact O-NE 3.28Å; L332-Y464 HydrophobicContact CB-CD2 3.56Å; L332-Y464 HydrophobicContact CB-CE2 3.82Å; L332-Y464 HydrophobicContact CD1-CD2 4.49Å; L332-Y464 HydrophobicContact CD1-CE2 4.15Å
333	K	96.8	Very high	96.8	Very high	115 Å²	115	44.9 Å²	44.9	50%	0.5	24%	0.241	S	C	.	.	H	α-helix	trans	-68.5	-32.2	173.6	-77.6	179.1	72.3	178.1	0	113.7	Y329 D330 Y331 Y464	Y329-K333 HydrophobicContact CD1-CD 4.19Å; Y329-K333 HydrophobicContact CE1-CD 3.55Å; Y329-K333 HydrophobicContact CE2-CD 4.3Å; Y329-K333 WeakPolarHBondContact O-CG 3.43Å; Y329-K333 PolarHBondContact O-N 3.43Å; Y329-K333 PolarHBondContact OH-NZ 2.87Å; D330-K333 PolarHBondContact O-N 2.77Å; Y331-K333 VanDerWaalsContact C-N 3.29Å; Y331-K333 PolarHBondContact O-N 2.9Å; K333-Y464 HydrophobicContact CB-CD1 4.49Å; K333-Y464 HydrophobicContact CD-CD1 3.95Å; K333-Y464 HydrophobicContact CD-CE1 4.09Å; K333-Y464 HydrophobicContact CG-CD1 3.22Å; K333-Y464 HydrophobicContact CG-CD2 4.41Å; K333-Y464 HydrophobicContact CG-CE1 3.72Å; K333-Y464 HydrophobicContact CG-CG 3.61Å
334	S	93.8	Very high	96.9	Very high	96 Å²	96	46.2 Å²	46.2	67%	0.671	25%	0.245	S	C	*	.	H	α-helix	trans	-104.7	-16	-172.6	53.9	0	0	0	0	113.5	D330 Y331 L332	D330-S334 PolarHBondContact O-N 3.39Å; D330-S334 PolarHBondContact O-OG 3.11Å; Y331-S334 PolarHBondContact O-N 2.61Å; Y331-S334 PolarHBondContact O-OG 2.91Å; L332-S334 VanDerWaalsContact C-N 3.35Å
335	T	95.3	Very high	97	Very high	37 Å²	37	41.6 Å²	41.6	23%	0.227	22%	0.223	C	C	.	.			trans	-123.2	145.9	-171.1	-51.1	0	0	0	0	111.5	Y331 L337 R454	Y331-T335 HydrophobicContact CE1-CG2 3.9Å; Y331-T335 HydrophobicContact CE2-CG2 4.43Å; Y331-T335 WeakPolarHBondContact O-CB 3.47Å; Y331-T335 PolarHBondContact O-N 3.38Å; Y331-T335 PolarHBondContact O-OG1 3.44Å; T335-L337 HydrophobicContact CG2-CD2 4.35Å; T335-R454 PolarHBondContact O-NE 3.32Å; T335-R454 PolarHBondContact O-NH2 3.01Å
336	T	95.5	Very high	97.2	Very high	79 Å²	79	38.9 Å²	38.9	49%	0.485	21%	0.209	S	C	.	.			trans	-105.1	144.8	170.3	58.7	0	0	0	0	109.1	L461	T336-L461 HydrophobicContact CG2-CD1 4.28Å; T336-L461 HydrophobicContact CG2-CD2 3.3Å; T336-L461 HydrophobicContact CG2-CG 4.41Å
337	L	97.4	Very high	97.3	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.016	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-111.3	146.4	-175	-51.3	178.6	0	0	0	110.7	Y331 L332 T335 A341 M342 L345 I451 R454 C455 V456	Y331-L337 HydrophobicContact CE1-CD2 4.01Å; L332-L337 HydrophobicContact CD2-CD1 3.75Å; L332-L337 HydrophobicContact CD2-CG 4.45Å; T335-L337 HydrophobicContact CG2-CD2 4.35Å; L337-A341 HydrophobicContact CB-CB 4.22Å; L337-A341 HydrophobicContact CD2-CB 3.93Å; L337-M342 HydrophobicContact CB-CB 4.48Å; L337-M342 HydrophobicContact CD1-CB 4.45Å; L337-L345 HydrophobicContact CD1-CD1 3.69Å; L337-L345 HydrophobicContact CD2-CD1 3.78Å; L337-L345 HydrophobicContact CG-CD1 4.42Å; L337-I451 HydrophobicContact CD1-CG2 4.03Å; L337-R454 HydrophobicContact CD1-CB 4.11Å; L337-R454 HydrophobicContact CG-CB 4.09Å; L337-R454 PolarHBondContact N-O 3.44Å; L337-C455 CarbonylContact O-C 3.58Å; L337-C455 WeakPolarHBondContact O-CA 3.27Å; L337-V456 PolarHBondContact O-N 2.77Å
338	D	95.5	Very high	97.3	Very high	90 Å²	90	40.3 Å²	40.3	48%	0.481	21%	0.207	S	C	.	.			trans	-92	176.4	155.7	65.6	-4.6	0	0	0	109.6	K340 A341 M342	D338-K340 PolarHBondContact O-N 3.29Å; D338-K340 PolarHBondContact OD1-N 2.8Å; D338-A341 PolarHBondContact O-N 3.27Å; D338-A341 WeakPolarHBondContact OD1-CB 3.46Å; D338-A341 PolarHBondContact OD1-N 2.8Å; D338-M342 WeakPolarHBondContact O-CB 3.49Å; D338-M342 PolarHBondContact O-N 3.37Å
339	N	95.6	Very high	97.3	Very high	42 Å²	42	40.3 Å²	40.3	23%	0.225	21%	0.207	C	C	.	.	H	α-helix	trans	-56.9	-37	178.6	-71.7	-19	0	0	0	112	M342 L343 C455	N339-M342 PolarHBondContact O-N 3.41Å; N339-L343 WeakPolarHBondContact O-CB 3.44Å; N339-L343 VanDerWaalsContact O-CG 3.27Å; N339-L343 WeakPolarHBondContact O-CG 3.46Å; N339-L343 PolarHBondContact O-N 3.45Å; N339-C455 PolarHBondContact OD1-SG 3.47Å
340	K	96.5	Very high	97.4	Very high	86 Å²	86	38.5 Å²	38.5	37%	0.374	20%	0.2	S	C	.	.	H	α-helix	trans	-64.7	-49.6	179.8	-176.1	172.1	-170.4	-179.2	0	112.5	D338 R344 I541	D338-K340 PolarHBondContact O-N 3.29Å; D338-K340 PolarHBondContact OD1-N 2.8Å; K340-R344 VanDerWaalsContact CE-NH2 3.35Å; K340-R344 VanDerWaalsContact O-CB 3.28Å; K340-R344 WeakPolarHBondContact O-CB 3.5Å; K340-R344 PolarHBondContact O-N 3.21Å; K340-I541 HydrophobicContact CB-CD1 3.88Å; K340-I541 HydrophobicContact CB-CG1 4.11Å; K340-I541 HydrophobicContact CD-CG1 4.38Å; K340-I541 HydrophobicContact CD-CG2 4.35Å; K340-I541 HydrophobicContact CG-CD1 4.26Å; K340-I541 HydrophobicContact CG-CG1 4.05Å; K340-I541 HydrophobicContact CG-CG2 3.75Å
341	A	97.6	Very high	97.5	Very high	17 Å²	17	34.7 Å²	34.7	14%	0.14	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-40.9	176.8	0	0	0	0	0	111.1	L337 D338 R344 L345	L337-A341 HydrophobicContact CB-CB 4.22Å; L337-A341 HydrophobicContact CD2-CB 3.93Å; D338-A341 PolarHBondContact O-N 3.27Å; D338-A341 WeakPolarHBondContact OD1-CB 3.46Å; D338-A341 PolarHBondContact OD1-N 2.8Å; A341-R344 PolarHBondContact O-N 3.04Å; A341-L345 VanDerWaalsContact O-CG 3.27Å; A341-L345 WeakPolarHBondContact O-CG 3.45Å; A341-L345 PolarHBondContact O-N 3.33Å
342	M	98.3	Very high	97.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.1	-53.4	175.2	-173	-168.4	57	0	0	111.5	L337 D338 N339 L345 A346 I451 A452 C455 C503 L504 M507	L337-M342 HydrophobicContact CB-CB 4.48Å; L337-M342 HydrophobicContact CD1-CB 4.45Å; D338-M342 WeakPolarHBondContact O-CB 3.49Å; D338-M342 PolarHBondContact O-N 3.37Å; N339-M342 PolarHBondContact O-N 3.41Å; M342-L345 PolarHBondContact O-N 3.28Å; M342-A346 WeakPolarHBondContact O-CB 3.46Å; M342-A346 PolarHBondContact O-N 3.15Å; M342-I451 HydrophobicContact CB-CG2 4.41Å; M342-I451 HydrophobicContact CG-CG2 3.63Å; M342-A452 HydrophobicContact SD-CB 4.1Å; M342-C455 HydrophobicContact CB-CB 4.28Å; M342-C455 HydrophobicContact CG-CB 4.2Å; M342-C455 HydrophobicContact SD-CB 3.64Å; M342-C503 HydrophobicContact CE-CB 4.33Å; M342-C503 WeakPolarHBondContact CE-SG 3.37Å; M342-L504 HydrophobicContact CE-CD2 4.27Å; M342-L504 HydrophobicContact SD-CD2 3.68Å; M342-M507 HydrophobicContact CE-CE 4.01Å; M342-M507 HydrophobicContact CG-CE 4.41Å; M342-M507 HydrophobicContact SD-CE 4.21Å
343	L	98.4	Very high	97.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-38.9	179.8	-69.6	175.5	0	0	0	112	N339 A346 Y347 M507 L532 M535 I541	N339-L343 WeakPolarHBondContact O-CB 3.44Å; N339-L343 VanDerWaalsContact O-CG 3.27Å; N339-L343 WeakPolarHBondContact O-CG 3.46Å; N339-L343 PolarHBondContact O-N 3.45Å; L343-A346 PolarHBondContact O-N 3.23Å; L343-Y347 WeakPolarHBondContact O-CB 3.33Å; L343-Y347 PolarHBondContact O-N 2.94Å; L343-M507 HydrophobicContact CD2-CE 3.97Å; L343-L532 HydrophobicContact CD2-CD2 3.89Å; L343-M535 HydrophobicContact CD1-CB 4.33Å; L343-M535 HydrophobicContact CD2-CB 4.01Å; L343-M535 HydrophobicContact CD2-CE 3.88Å; L343-M535 HydrophobicContact CD2-SD 4.48Å; L343-I541 HydrophobicContact CD1-CD1 3.89Å
344	R	98.4	Very high	97.6	Very high	58 Å²	58	27.7 Å²	27.7	22%	0.219	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-48	176.2	-174.2	-175.7	-65.9	141.7	-5	112	K340 A341 S348 G385 T386 L543	K340-R344 VanDerWaalsContact CE-NH2 3.35Å; K340-R344 VanDerWaalsContact O-CB 3.28Å; K340-R344 WeakPolarHBondContact O-CB 3.5Å; K340-R344 PolarHBondContact O-N 3.21Å; A341-R344 PolarHBondContact O-N 3.04Å; R344-S348 WeakPolarHBondContact O-CB 3.2Å; R344-S348 PolarHBondContact O-N 3.08Å; R344-S348 PolarHBondContact O-OG 3.21Å; R344-G385 WeakPolarHBondContact CD-O 3.43Å; R344-G385 WeakPolarHBondContact CG-O 3.45Å; R344-T386 HydrophobicContact CG-CG2 3.95Å; R344-L543 HydrophobicContact CB-CD2 4.43Å
345	L	98.8	Very high	97.9	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-63.1	-45.9	178.6	-67.8	172.3	0	0	0	110.9	L328 Y331 L337 A341 M342 S348 S349 V381 G385 C387 I451	L328-L345 HydrophobicContact CD1-CD1 4.13Å; L328-L345 HydrophobicContact CD1-CD2 4.34Å; Y331-L345 HydrophobicContact CD1-CD1 4.28Å; Y331-L345 HydrophobicContact CE1-CD1 4.08Å; L337-L345 HydrophobicContact CD1-CD1 3.69Å; L337-L345 HydrophobicContact CD2-CD1 3.78Å; L337-L345 HydrophobicContact CG-CD1 4.42Å; A341-L345 VanDerWaalsContact O-CG 3.27Å; A341-L345 WeakPolarHBondContact O-CG 3.45Å; A341-L345 PolarHBondContact O-N 3.33Å; M342-L345 PolarHBondContact O-N 3.28Å; L345-S348 PolarHBondContact O-OG 3.05Å; L345-S349 VanDerWaalsContact O-CB 3.28Å; L345-S349 WeakPolarHBondContact O-CB 3.3Å; L345-S349 PolarHBondContact O-N 3.41Å; L345-S349 VanDerWaalsContact O-N 3.09Å; L345-S349 PolarHBondContact O-OG 3.06Å; L345-V381 HydrophobicContact CD2-CG1 3.98Å; L345-V381 HydrophobicContact CD2-CG2 4.13Å; L345-G385 WeakPolarHBondContact CD2-O 3.48Å; L345-C387 WeakPolarHBondContact CD2-SG 3.41Å; L345-I451 HydrophobicContact CB-CD1 4.35Å; L345-I451 HydrophobicContact CB-CG2 4.5Å
346	A	98.8	Very high	98	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.9	-48	178.6	0	0	0	0	0	112.1	M342 L343 S349 V350 L448 I451 M507 L532	M342-A346 WeakPolarHBondContact O-CB 3.46Å; M342-A346 PolarHBondContact O-N 3.15Å; L343-A346 PolarHBondContact O-N 3.23Å; A346-S349 PolarHBondContact O-N 3.04Å; A346-V350 PolarHBondContact O-N 3.31Å; A346-L448 HydrophobicContact CB-CD2 3.64Å; A346-I451 HydrophobicContact CB-CD1 4.45Å; A346-M507 HydrophobicContact CB-CE 4.23Å; A346-L532 HydrophobicContact CB-CD1 3.83Å; A346-L532 HydrophobicContact CB-CD2 4.18Å
347	Y	98.8	Very high	98.2	Very high	55 Å²	55	20 Å²	20	22%	0.216	10%	0.097	C	C	.	.	H	α-helix	trans	-64.9	-45.9	-176.6	178.1	-99.3	0	0	0	112.4	L343 V350 S351 K529 L532 A533 L543	L343-Y347 WeakPolarHBondContact O-CB 3.33Å; L343-Y347 PolarHBondContact O-N 2.94Å; Y347-V350 VanDerWaalsContact O-CG1 3.32Å; Y347-V350 WeakPolarHBondContact O-CG1 3.47Å; Y347-S351 VanDerWaalsContact O-CB 3.27Å; Y347-S351 WeakPolarHBondContact O-CB 3.49Å; Y347-S351 PolarHBondContact O-N 2.83Å; Y347-S351 PolarHBondContact O-OG 3.15Å; Y347-K529 HydrophobicContact CD2-CG 4.27Å; Y347-K529 HydrophobicContact CE2-CG 3.61Å; Y347-K529 WeakPolarHBondContact OH-CE 3.19Å; Y347-L532 HydrophobicContact CD2-CB 4.03Å; Y347-A533 HydrophobicContact CD2-CB 4.49Å; Y347-A533 HydrophobicContact CE2-CB 3.9Å; Y347-L543 HydrophobicContact CD1-CB 4.15Å; Y347-L543 HydrophobicContact CD1-CD1 3.77Å; Y347-L543 HydrophobicContact CD1-CD2 4.11Å; Y347-L543 HydrophobicContact CD1-CG 4.25Å; Y347-L543 HydrophobicContact CD2-CD1 3.69Å; Y347-L543 HydrophobicContact CE1-CB 4.31Å; Y347-L543 HydrophobicContact CE1-CD1 4.1Å; Y347-L543 HydrophobicContact CE2-CD1 4.04Å; Y347-L543 HydrophobicContact CG-CD1 3.55Å; Y347-L543 HydrophobicContact CG-CD2 4.06Å; Y347-L543 HydrophobicContact CG-CG 4.32Å
348	S	98.8	Very high	98.2	Very high	4 Å²	4	23 Å²	23	3%	0.028	12%	0.115	C	C	.	.	H	α-helix	trans	-66.1	-41.7	177.4	53.6	0	0	0	0	111.6	N298 R344 L345 V350 S351 G352 C387	N298-S348 WeakPolarHBondContact CB-O 3.1Å; N298-S348 WeakPolarHBondContact ND2-CB 3.32Å; N298-S348 PolarHBondContact OD1-O 2.85Å; R344-S348 WeakPolarHBondContact O-CB 3.2Å; R344-S348 PolarHBondContact O-N 3.08Å; R344-S348 PolarHBondContact O-OG 3.21Å; L345-S348 PolarHBondContact O-OG 3.05Å; S348-V350 PolarHBondContact O-N 2.94Å; S348-S351 WeakPolarHBondContact O-CB 3.33Å; S348-S351 PolarHBondContact O-N 3.27Å; S348-G352 PolarHBondContact O-N 3.1Å; S348-G352 VanDerWaalsContact O-N 3.11Å; S348-C387 PolarHBondContact OG-N 2.78Å
349	S	98.9	Very high	98.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.4	-47.7	176.4	-55.6	0	0	0	0	111.8	L345 A346 S351 G352 L353 C387	L345-S349 VanDerWaalsContact O-CB 3.28Å; L345-S349 WeakPolarHBondContact O-CB 3.3Å; L345-S349 PolarHBondContact O-N 3.41Å; L345-S349 VanDerWaalsContact O-N 3.09Å; L345-S349 PolarHBondContact O-OG 3.06Å; A346-S349 PolarHBondContact O-N 3.04Å; S349-S351 VanDerWaalsContact C-N 3.3Å; S349-S351 PolarHBondContact O-N 2.9Å; S349-G352 PolarHBondContact O-N 2.81Å; S349-L353 PolarHBondContact O-N 3.42Å; S349-L353 VanDerWaalsContact O-N 3.11Å; S349-C387 WeakPolarHBondContact OG-CB 3.48Å; S349-C387 PolarHBondContact OG-SG 3.01Å
350	V	98.9	Very high	98	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-70.6	-26.9	178.1	76.6	0	0	0	0	112.7	A346 Y347 S348 G352 L353 C354 F444 A525 V528 K529 L532	A346-V350 PolarHBondContact O-N 3.31Å; Y347-V350 VanDerWaalsContact O-CG1 3.32Å; Y347-V350 WeakPolarHBondContact O-CG1 3.47Å; S348-V350 PolarHBondContact O-N 2.94Å; V350-G352 VanDerWaalsContact C-N 3.33Å; V350-L353 PolarHBondContact O-N 2.97Å; V350-C354 WeakPolarHBondContact O-CB 3.43Å; V350-C354 PolarHBondContact O-N 3.14Å; V350-F444 HydrophobicContact CB-CE1 3.69Å; V350-F444 HydrophobicContact CB-CE2 4.36Å; V350-F444 HydrophobicContact CB-CZ 3.53Å; V350-F444 HydrophobicContact CG2-CD1 4.41Å; V350-F444 HydrophobicContact CG2-CE1 3.85Å; V350-F444 HydrophobicContact CG2-CZ 4.15Å; V350-A525 HydrophobicContact CG2-CB 4.05Å; V350-A525 WeakPolarHBondContact CG2-O 3.35Å; V350-V528 HydrophobicContact CB-CG1 4.25Å; V350-V528 HydrophobicContact CG1-CG1 4.36Å; V350-V528 HydrophobicContact CG2-CB 3.89Å; V350-V528 HydrophobicContact CG2-CG1 3.73Å; V350-K529 HydrophobicContact CG1-CB 3.85Å; V350-K529 HydrophobicContact CG1-CG 4.35Å; V350-L532 HydrophobicContact CG1-CD1 3.87Å
351	S	98.8	Very high	97.6	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.007	12%	0.124	C	C	.	.	H	α-helix	trans	-65	-39.7	174.9	-68.2	0	0	0	0	111.2	N298 Y347 S348 S349 H355 K529	N298-S351 WeakPolarHBondContact OD1-CB 3.44Å; Y347-S351 VanDerWaalsContact O-CB 3.27Å; Y347-S351 WeakPolarHBondContact O-CB 3.49Å; Y347-S351 PolarHBondContact O-N 2.83Å; Y347-S351 PolarHBondContact O-OG 3.15Å; S348-S351 WeakPolarHBondContact O-CB 3.33Å; S348-S351 PolarHBondContact O-N 3.27Å; S349-S351 VanDerWaalsContact C-N 3.3Å; S349-S351 PolarHBondContact O-N 2.9Å; S351-H355 PolarHBondContact O-N 3.46Å; S351-K529 WeakPolarHBondContact OG-CE 3.3Å
352	G	98.8	Very high	96.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.7	-44.8	170.5	0	0	0	0	0	112.2	S348 S349 V350 C354 H355 L356	S348-G352 PolarHBondContact O-N 3.1Å; S348-G352 VanDerWaalsContact O-N 3.11Å; S349-G352 PolarHBondContact O-N 2.81Å; V350-G352 VanDerWaalsContact C-N 3.33Å; G352-C354 PolarHBondContact O-N 3.34Å; G352-H355 WeakPolarHBondContact O-CB 3.42Å; G352-H355 PolarHBondContact O-N 3.33Å; G352-L356 PolarHBondContact O-N 3.11Å
353	L	98.9	Very high	95.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.6	-41.5	179.7	-172.8	55.4	0	0	0	112.2	S349 V350 H355 L356 H357 L374 I389 D440 M441 F444 A525	S349-L353 PolarHBondContact O-N 3.42Å; S349-L353 VanDerWaalsContact O-N 3.11Å; V350-L353 PolarHBondContact O-N 2.97Å; L353-H355 VanDerWaalsContact C-N 3.31Å; L353-H355 PolarHBondContact O-N 3.11Å; L353-L356 HydrophobicContact CD1-CD1 4.44Å; L353-L356 WeakPolarHBondContact O-CB 3.42Å; L353-L356 PolarHBondContact O-N 3.4Å; L353-H357 WeakPolarHBondContact CD1-NE2 3.36Å; L353-H357 WeakPolarHBondContact O-CB 3.42Å; L353-H357 PolarHBondContact O-CD2 3.46Å; L353-H357 PolarHBondContact O-N 2.9Å; L353-L374 HydrophobicContact CD1-CD1 3.65Å; L353-L374 HydrophobicContact CD2-CD1 3.69Å; L353-L374 HydrophobicContact CG-CD1 4.3Å; L353-I389 HydrophobicContact CB-CD1 3.86Å; L353-I389 HydrophobicContact CD1-CD1 4.44Å; L353-I389 VanDerWaalsContact N-CD1 3.28Å; L353-D440 HydrophobicContact CD1-CB 4.35Å; L353-M441 HydrophobicContact CD2-SD 3.79Å; L353-F444 HydrophobicContact CD2-CB 3.97Å; L353-F444 HydrophobicContact CD2-CD2 4.06Å; L353-F444 HydrophobicContact CD2-CG 3.97Å; L353-A525 HydrophobicContact CB-CB 4.46Å; L353-A525 HydrophobicContact CG-CB 4.2Å
354	C	98.8	Very high	95.1	Very high	11 Å²	11	40.7 Å²	40.7	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-42.3	174.3	-173.1	0	0	0	0	111.2	V350 G352 H357 T358 A525 K529	V350-C354 WeakPolarHBondContact O-CB 3.43Å; V350-C354 PolarHBondContact O-N 3.14Å; G352-C354 PolarHBondContact O-N 3.34Å; C354-H357 PolarHBondContact O-N 2.62Å; C354-T358 VanDerWaalsContact O-CB 3.31Å; C354-T358 WeakPolarHBondContact O-CB 3.28Å; C354-T358 PolarHBondContact O-N 2.78Å; C354-T358 PolarHBondContact O-OG1 3.01Å; C354-A525 HydrophobicContact CB-CB 3.89Å; C354-K529 HydrophobicContact CB-CD 4.45Å
355	H	98.6	Very high	94.5	Very high	28 Å²	28	39.5 Å²	39.5	13%	0.13	22%	0.223	C	C	.	.	H	α-helix	trans	-62	-44.7	175.1	-176.1	71.5	0	0	0	112.2	L293 M294 H296 S351 G352 L353 H357 T358 K366	L293-H355 PolarHBondContact O-CE1 3.28Å; L293-H355 VanDerWaalsContact O-CE1 3.32Å; L293-H355 PolarHBondContact O-NE2 3.32Å; M294-H355 PolarHBondContact O-NE2 3.43Å; H296-H355 HydrophobicContact CB-CB 4.38Å; H296-H355 VanDerWaalsContact CB-CD2 3.45Å; H296-H355 WeakPolarHBondContact CB-CD2 3.41Å; H296-H355 AromaticContact CD2-CG 3.8Å; H296-H355 AromaticContact CD2-ND1 3.79Å; H296-H355 AromaticContact CG-CD2 3.96Å; H296-H355 AromaticContact CG-CG 3.73Å; S351-H355 PolarHBondContact O-N 3.46Å; G352-H355 WeakPolarHBondContact O-CB 3.42Å; G352-H355 PolarHBondContact O-N 3.33Å; L353-H355 VanDerWaalsContact C-N 3.31Å; L353-H355 PolarHBondContact O-N 3.11Å; H355-H357 PolarHBondContact O-N 3.48Å; H355-T358 PolarHBondContact O-N 3.47Å; H355-K366 WeakPolarHBondContact O-CE 3.22Å; H355-K366 PolarHBondContact O-NZ 3.32Å
356	L	98.4	Very high	94.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.1	-52.1	173.9	-81.4	164	0	0	0	111.1	M294 I299 G352 L353 T358 K366 I369 I389 L392	M294-L356 HydrophobicContact CE-CD2 3.28Å; M294-L356 HydrophobicContact CE-CG 3.98Å; M294-L356 HydrophobicContact SD-CD2 4.15Å; I299-L356 HydrophobicContact CD1-CD1 3.77Å; I299-L356 HydrophobicContact CD1-CD2 4.4Å; I299-L356 HydrophobicContact CD1-CG 3.72Å; G352-L356 PolarHBondContact O-N 3.11Å; L353-L356 HydrophobicContact CD1-CD1 4.44Å; L353-L356 WeakPolarHBondContact O-CB 3.42Å; L353-L356 PolarHBondContact O-N 3.4Å; L356-T358 VanDerWaalsContact C-N 3.29Å; L356-T358 PolarHBondContact O-N 3.2Å; L356-K366 PolarHBondContact O-NZ 3.32Å; L356-I369 CarbonylContact C-O 3.43Å; L356-I369 VanDerWaalsContact C-O 3.27Å; L356-I369 HydrophobicContact CD2-CB 3.98Å; L356-I369 HydrophobicContact CD2-CD1 4.47Å; L356-I369 HydrophobicContact CD2-CG2 3.76Å; L356-I369 PolarHBondContact O-N 3.46Å; L356-I389 HydrophobicContact CD1-CD1 4Å; L356-I389 HydrophobicContact CD1-CG2 4.09Å; L356-L392 HydrophobicContact CD1-CD2 4.34Å; L356-L392 HydrophobicContact CD2-CD2 4.36Å
357	H	98.4	Very high	94.1	Very high	24 Å²	24	40.9 Å²	40.9	11%	0.111	23%	0.232	C	C	.	.	H	α-helix	trans	-68.9	-21.8	-174.7	-68.3	-174.9	0	0	0	114.3	L353 C354 H355 A368 I369 I437 D440	L353-H357 WeakPolarHBondContact CD1-NE2 3.36Å; L353-H357 WeakPolarHBondContact O-CB 3.42Å; L353-H357 PolarHBondContact O-CD2 3.46Å; L353-H357 PolarHBondContact O-N 2.9Å; C354-H357 PolarHBondContact O-N 2.62Å; H355-H357 PolarHBondContact O-N 3.48Å; H357-A368 WeakPolarHBondContact O-CB 3.2Å; H357-I369 PolarHBondContact CD2-O 2.84Å; H357-I437 HydrophobicContact CB-CD1 3.83Å; H357-I437 WeakPolarHBondContact CD2-CD1 3.21Å; H357-I437 VanDerWaalsContact CG-CD1 3.47Å; H357-D440 IonicContact CD2-OD2 2.75Å; H357-D440 IonicContact CE1-OD2 3.89Å; H357-D440 IonicContact NE2-OD2 2.59Å; H357-D440 PolarHBondContact NE2-OD2 3.37Å
358	T	97.4	Very high	93.9	Very high	66 Å²	66	38.6 Å²	38.6	41%	0.405	22%	0.224	S	C	.	.			trans	-89.4	124.8	-175.3	-56.1	0	0	0	0	110.9	C354 H355 L356 K366	C354-T358 VanDerWaalsContact O-CB 3.31Å; C354-T358 WeakPolarHBondContact O-CB 3.28Å; C354-T358 PolarHBondContact O-N 2.78Å; C354-T358 PolarHBondContact O-OG1 3.01Å; H355-T358 PolarHBondContact O-N 3.47Å; L356-T358 VanDerWaalsContact C-N 3.29Å; L356-T358 PolarHBondContact O-N 3.2Å; T358-K366 PolarHBondContact O-NZ 2.77Å
359	E	95	Very high	93.9	Very high	52 Å²	52	38.4 Å²	38.4	24%	0.243	22%	0.223	C	C	.	.			trans	-73.2	137.5	166.7	-173.9	173.2	-159.2	0	0	110.3	F361 K366 A368 S400	E359-F361 HydrophobicContact CG-CE1 4.13Å; E359-F361 HydrophobicContact CG-CZ 4.07Å; E359-F361 WeakPolarHBondContact OE2-CZ 3.23Å; E359-K366 WeakPolarHBondContact CA-O 3.49Å; E359-K366 WeakPolarHBondContact CG-O 3.24Å; E359-A368 HydrophobicContact CB-CB 4.26Å; E359-S400 WeakPolarHBondContact OE1-CB 3.42Å
360	I	93.1	Very high	93.8	Very high	57 Å²	57	38.4 Å²	38.4	29%	0.292	22%	0.223	S	C	.	.	B	Isolated β-bridge	trans	-118.3	114.6	176.9	-52.7	176	0	0	0	108.1	L293 G365 K366	L293-I360 HydrophobicContact CB-CD1 4.36Å; L293-I360 HydrophobicContact CD1-CB 4.31Å; L293-I360 HydrophobicContact CD1-CG2 3.85Å; I360-G365 CarbonylContact O-C 3.54Å; I360-G365 WeakPolarHBondContact O-CA 3.25Å; I360-K366 HydrophobicContact CB-CB 3.95Å; I360-K366 HydrophobicContact CD1-CB 4.22Å; I360-K366 HydrophobicContact CD1-CD 3.96Å; I360-K366 HydrophobicContact CG1-CB 4.16Å; I360-K366 HydrophobicContact CG1-CD 4.34Å; I360-K366 PolarHBondContact N-O 3.31Å; I360-K366 PolarHBondContact O-N 3.01Å
361	F	88.3	Confident	93.7	Very high	168 Å²	168	38.4 Å²	38.4	74%	0.737	22%	0.223	S	C	*	.			trans	-78.1	143.4	178.8	-58.6	-78	0	0	0	111.6	E359	E359-F361 HydrophobicContact CG-CE1 4.13Å; E359-F361 HydrophobicContact CG-CZ 4.07Å; E359-F361 WeakPolarHBondContact OE2-CZ 3.23Å
362	G	81.5	Confident	93.6	Very high	60 Å²	60	39.7 Å²	39.7	62%	0.619	23%	0.227	S	C	*	.	S	Bend	trans	170.2	177.5	178.5	0	0	0	0	0	111.2	Q364 G365	G362-Q364 PolarHBondContact O-N 2.99Å; G362-G365 PolarHBondContact O-N 3.07Å
363	T	77.9	Confident	93.5	Very high	147 Å²	147	40.4 Å²	40.4	90%	0.902	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-31.4	175.3	47.1	0	0	0	0	112.6
364	Q	80.9	Confident	93.5	Very high	122 Å²	122	40.4 Å²	40.4	57%	0.57	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.2	78.6	167.6	-65.9	-70.1	-40.9	0	0	107.4	V292 G362	V292-Q364 HydrophobicContact CB-CB 4.45Å; V292-Q364 HydrophobicContact CG1-CB 3.79Å; V292-Q364 WeakPolarHBondContact CG1-O 3.26Å; V292-Q364 HydrophobicContact CG2-CB 4.42Å; G362-Q364 PolarHBondContact O-N 2.99Å
365	G	86.6	Confident	93.4	Very high	32 Å²	32	41.3 Å²	41.3	33%	0.33	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-69.4	163.2	-178.5	0	0	0	0	0	113.3	I360 G362	I360-G365 CarbonylContact O-C 3.54Å; I360-G365 WeakPolarHBondContact O-CA 3.25Å; G362-G365 PolarHBondContact O-N 3.07Å
366	K	93.8	Very high	93.4	Very high	1 Å²	1	40 Å²	40	0%	0.004	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-100.8	121.2	169.1	-175.5	-162.8	148.4	-64.5	0	108.8	T291 V292 L293 H355 L356 T358 E359 I360	T291-K366 HydrophobicContact CG2-CG 4.32Å; V292-K366 WeakPolarHBondContact O-CB 3.31Å; V292-K366 WeakPolarHBondContact O-CG 3.42Å; L293-K366 HydrophobicContact CB-CB 4.13Å; H355-K366 WeakPolarHBondContact O-CE 3.22Å; H355-K366 PolarHBondContact O-NZ 3.32Å; L356-K366 PolarHBondContact O-NZ 3.32Å; T358-K366 PolarHBondContact O-NZ 2.77Å; E359-K366 WeakPolarHBondContact CA-O 3.49Å; E359-K366 WeakPolarHBondContact CG-O 3.24Å; I360-K366 HydrophobicContact CB-CB 3.95Å; I360-K366 HydrophobicContact CD1-CB 4.22Å; I360-K366 HydrophobicContact CD1-CD 3.96Å; I360-K366 HydrophobicContact CG1-CB 4.16Å; I360-K366 HydrophobicContact CG1-CD 4.34Å; I360-K366 PolarHBondContact N-O 3.31Å; I360-K366 PolarHBondContact O-N 3.01Å
367	P	94.8	Very high	93.4	Very high	30 Å²	30	45.4 Å²	45.4	20%	0.195	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-65.2	156.1	172.7	28.3	-34.9	0	0	0	111.1	T291 K397 F398	T291-P367 HydrophobicContact CG2-CG 4.08Å; P367-K397 HydrophobicContact CB-CB 4.47Å; P367-K397 HydrophobicContact CG-CB 4.37Å; P367-K397 HydrophobicContact CG-CD 4.29Å; P367-K397 HydrophobicContact CG-CG 4.12Å; P367-F398 WeakPolarHBondContact CB-O 3.49Å
368	A	96.3	Very high	93.3	Very high	7 Å²	7	44.9 Å²	44.9	6%	0.058	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-66.3	138.2	166.3	0	0	0	0	0	109.8	H357 E359 F398 F433	H357-A368 WeakPolarHBondContact O-CB 3.2Å; E359-A368 HydrophobicContact CB-CB 4.26Å; A368-F398 HydrophobicContact CB-CB 4.18Å; A368-F398 PolarHBondContact O-N 3.44Å; A368-F433 VanDerWaalsContact C-CZ 3.47Å; A368-F433 HydrophobicContact CB-CD1 4.33Å; A368-F433 HydrophobicContact CB-CE1 3.45Å; A368-F433 VanDerWaalsContact CB-CE1 3.45Å; A368-F433 HydrophobicContact CB-CZ 3.89Å; A368-F433 VanDerWaalsContact O-CZ 3.29Å; A368-F433 WeakPolarHBondContact O-CZ 3.43Å
369	I	97.3	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	130.2	-175.9	-62.8	166.5	0	0	0	109.2	I288 T291 M294 L356 H357 A395 V396 K397	I288-I369 HydrophobicContact CG2-CD1 4.46Å; T291-I369 HydrophobicContact CG2-CD1 4.39Å; M294-I369 HydrophobicContact SD-CD1 3.61Å; L356-I369 CarbonylContact C-O 3.43Å; L356-I369 VanDerWaalsContact C-O 3.27Å; L356-I369 HydrophobicContact CD2-CB 3.98Å; L356-I369 HydrophobicContact CD2-CD1 4.47Å; L356-I369 HydrophobicContact CD2-CG2 3.76Å; L356-I369 PolarHBondContact O-N 3.46Å; H357-I369 PolarHBondContact CD2-O 2.84Å; I369-A395 HydrophobicContact CG2-CB 3.82Å; I369-V396 WeakPolarHBondContact CA-O 3.21Å; I369-K397 HydrophobicContact CG1-CG 4.03Å
370	A	97.4	Very high	93.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.5	170.1	0	0	0	0	0	110	A395 V396 F433 Y436 I437 D440	A370-A395 CarbonylContact O-C 3.45Å; A370-A395 WeakPolarHBondContact O-CA 2.84Å; A370-A395 WeakPolarHBondContact O-CB 3.42Å; A370-V396 HydrophobicContact CB-CG2 4.03Å; A370-V396 PolarHBondContact N-O 3.01Å; A370-V396 PolarHBondContact O-N 3.47Å; A370-F433 HydrophobicContact CB-CE2 4.14Å; A370-F433 HydrophobicContact CB-CZ 4.07Å; A370-Y436 VanDerWaalsContact CB-CB 3.42Å; A370-I437 HydrophobicContact CB-CD1 3.89Å; A370-I437 HydrophobicContact CB-CG1 4.45Å; A370-D440 WeakPolarHBondContact CA-OD2 3.48Å
371	H	97.7	Very high	93.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.213	C	C	.	.			trans	-80.5	-44.1	-170.4	-176.1	-38	0	0	0	113.5	D373 L374 I389 A390 D391 D440	H371-D373 PolarHBondContact CE1-O 3.13Å; H371-D373 PolarHBondContact ND1-N 2.89Å; H371-D373 PolarHBondContact O-N 3.11Å; H371-D373 VanDerWaalsContact O-N 3.14Å; H371-L374 HydrophobicContact CB-CD2 4.47Å; H371-L374 HydrophobicContact CB-CG 3.98Å; H371-L374 VanDerWaalsContact CD2-CD2 3.42Å; H371-L374 WeakPolarHBondContact CD2-CD2 3.29Å; H371-I389 WeakPolarHBondContact CD2-CG2 3.45Å; H371-A390 PolarHBondContact NE2-O 2.84Å; H371-A390 VanDerWaalsContact NE2-O 3.15Å; H371-D391 PolarHBondContact CE1-O 3.16Å; H371-D440 PolarHBondContact N-OD2 3.23Å
372	R	95.7	Very high	94.3	Very high	28 Å²	28	31.9 Å²	31.9	11%	0.106	19%	0.186	C	C	.	.	S	Bend	trans	67.3	0	178.1	-55.7	174.4	59.2	-155.9	10.4	117.6	L394 V396 N410 T411 Y436 D440	R372-L394 WeakPolarHBondContact CD-O 3.46Å; R372-L394 PolarHBondContact NH1-O 3.22Å; R372-V396 HydrophobicContact CG-CG2 4.43Å; R372-V396 VanDerWaalsContact NH1-CG1 3.31Å; R372-N410 PolarHBondContact NH2-O 3.06Å; R372-T411 PolarHBondContact NH2-O 3.33Å; R372-Y436 HydrophobicContact CG-CD1 4.1Å; R372-D440 PolarHBondContact N-OD1 2.76Å
373	D	96.3	Very high	95	Very high	15 Å²	15	39.2 Å²	39.2	8%	0.08	20%	0.195	C	C	.	.			trans	-146.5	42.8	173.7	-166.1	32.6	0	0	0	111.9	H371 K375 N378 L394 G414 T415	H371-D373 PolarHBondContact CE1-O 3.13Å; H371-D373 PolarHBondContact ND1-N 2.89Å; H371-D373 PolarHBondContact O-N 3.11Å; H371-D373 VanDerWaalsContact O-N 3.14Å; D373-K375 PolarHBondContact O-N 3.03Å; D373-K375 IonicContact OD1-NZ 3.13Å; D373-K375 PolarHBondContact OD1-NZ 3.32Å; D373-K375 IonicContact OD2-NZ 2.68Å; D373-K375 PolarHBondContact OD2-NZ 2.84Å; D373-N378 PolarHBondContact O-ND2 3.43Å; D373-N378 PolarHBondContact OD2-ND2 2.91Å; D373-L394 HydrophobicContact CB-CD1 3.88Å; D373-G414 VanDerWaalsContact OD1-CA 3.3Å; D373-G414 WeakPolarHBondContact OD1-CA 3.46Å; D373-T415 WeakPolarHBondContact OD1-CB 3.39Å; D373-T415 PolarHBondContact OD1-N 3.17Å; D373-T415 PolarHBondContact OD1-OG1 3.42Å
374	L	98.4	Very high	95.8	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.177	C	C	.	.			trans	-67.3	125.4	174.1	-82.6	173.6	0	0	0	110.9	L353 H371 I389 D440 I447	L353-L374 HydrophobicContact CD1-CD1 3.65Å; L353-L374 HydrophobicContact CD2-CD1 3.69Å; L353-L374 HydrophobicContact CG-CD1 4.3Å; H371-L374 HydrophobicContact CB-CD2 4.47Å; H371-L374 HydrophobicContact CB-CG 3.98Å; H371-L374 VanDerWaalsContact CD2-CD2 3.42Å; H371-L374 WeakPolarHBondContact CD2-CD2 3.29Å; L374-I389 HydrophobicContact CD2-CD1 4.33Å; L374-I389 HydrophobicContact CD2-CG2 4.28Å; L374-D440 HydrophobicContact CD1-CB 3.76Å; L374-I447 HydrophobicContact CB-CD1 4.16Å
375	K	98.4	Very high	96.5	Very high	29 Å²	29	31.7 Å²	31.7	13%	0.126	16%	0.155	C	C	.	.			trans	-160.3	162.1	174.8	62.9	-157.9	-175.2	-148.9	0	109.4	D373 K377 N378 T415 Y418	D373-K375 PolarHBondContact O-N 3.03Å; D373-K375 IonicContact OD1-NZ 3.13Å; D373-K375 PolarHBondContact OD1-NZ 3.32Å; D373-K375 IonicContact OD2-NZ 2.68Å; D373-K375 PolarHBondContact OD2-NZ 2.84Å; K375-K377 HydrophobicContact CG-CB 4.16Å; K375-K377 PolarHBondContact O-N 2.9Å; K375-K377 VanDerWaalsContact O-N 3.11Å; K375-N378 VanDerWaalsContact CE-CG 3.46Å; K375-N378 WeakPolarHBondContact CE-ND2 3.5Å; K375-N378 VanDerWaalsContact CE-OD1 3.25Å; K375-N378 WeakPolarHBondContact CE-OD1 3.34Å; K375-N378 HydrophobicContact CG-CB 4.05Å; K375-N378 PolarHBondContact O-N 3.12Å; K375-T415 HydrophobicContact CD-CG2 4.16Å; K375-T415 WeakPolarHBondContact CD-OG1 3.42Å; K375-T415 WeakPolarHBondContact CE-OG1 3.41Å; K375-T415 PolarHBondContact NZ-OG1 3.49Å; K375-Y418 HydrophobicContact CB-CD1 4.09Å; K375-Y418 HydrophobicContact CB-CD2 3.75Å; K375-Y418 HydrophobicContact CB-CE1 3.97Å; K375-Y418 HydrophobicContact CB-CE2 3.63Å; K375-Y418 HydrophobicContact CB-CG 3.98Å
376	S	98.5	Very high	97.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-59.3	-24.9	179.5	54.4	0	0	0	0	113.8	L328 Y329 N378 Y418 E450	L328-S376 WeakPolarHBondContact CB-O 3.31Å; L328-S376 PolarHBondContact N-O 3.04Å; Y329-S376 PolarHBondContact N-O 2.68Å; S376-N378 VanDerWaalsContact C-N 3.33Å; S376-Y418 PolarHBondContact OG-OH 2.8Å; S376-E450 VanDerWaalsContact CB-OE2 3.28Å; S376-E450 WeakPolarHBondContact CB-OE2 3.11Å; S376-E450 PolarHBondContact OG-OE1 3.49Å; S376-E450 PolarHBondContact OG-OE2 2.84Å
377	K	97	Very high	97.3	Very high	114 Å²	114	30.7 Å²	30.7	50%	0.496	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-71.9	-22.2	173	-68.3	-176.2	176.6	-177.7	0	114.5	S327 Y329 K375	S327-K377 WeakPolarHBondContact CB-O 3.38Å; Y329-K377 HydrophobicContact CD1-CG 4.16Å; Y329-K377 HydrophobicContact CD2-CG 4.04Å; Y329-K377 HydrophobicContact CG-CD 4.46Å; Y329-K377 HydrophobicContact CG-CG 3.68Å; K375-K377 HydrophobicContact CG-CB 4.16Å; K375-K377 PolarHBondContact O-N 2.9Å; K375-K377 VanDerWaalsContact O-N 3.11Å
378	N	97.8	Very high	97.5	Very high	13 Å²	13	29.3 Å²	29.3	7%	0.07	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-102.1	11.9	-178.6	-72.1	5.7	0	0	0	112.5	D373 K375 S376 A390 D391	D373-N378 PolarHBondContact O-ND2 3.43Å; D373-N378 PolarHBondContact OD2-ND2 2.91Å; K375-N378 VanDerWaalsContact CE-CG 3.46Å; K375-N378 WeakPolarHBondContact CE-ND2 3.5Å; K375-N378 VanDerWaalsContact CE-OD1 3.25Å; K375-N378 WeakPolarHBondContact CE-OD1 3.34Å; K375-N378 HydrophobicContact CG-CB 4.05Å; K375-N378 PolarHBondContact O-N 3.12Å; S376-N378 VanDerWaalsContact C-N 3.33Å; N378-A390 PolarHBondContact O-N 2.7Å; N378-D391 HydrophobicContact CB-CB 4.24Å; N378-D391 PolarHBondContact ND2-OD2 2.78Å; N378-D391 PolarHBondContact OD1-OD2 2.86Å
379	I	98.8	Very high	97.6	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.5	170.9	-62.1	174.3	0	0	0	106.4	S327 L328 C387 C388 I389 I447	S327-I379 CarbonylContact C-O 3.41Å; S327-I379 VanDerWaalsContact CA-O 3.27Å; S327-I379 WeakPolarHBondContact CA-O 3.13Å; L328-I379 HydrophobicContact CB-CB 4.11Å; L328-I379 HydrophobicContact CB-CG2 4.18Å; L328-I379 HydrophobicContact CD2-CB 4.39Å; L328-I379 HydrophobicContact CD2-CD1 4.43Å; L328-I379 HydrophobicContact CD2-CG2 4.28Å; L328-I379 PolarHBondContact N-O 2.68Å; I379-C387 HydrophobicContact CG2-CB 3.62Å; I379-C388 CarbonylContact C-O 3.6Å; I379-C388 WeakPolarHBondContact CA-O 3.46Å; I379-I389 HydrophobicContact CG1-CG1 4.45Å; I379-I447 HydrophobicContact CD1-CD1 3.8Å; I379-I447 HydrophobicContact CD1-CG2 4.07Å
380	L	98.6	Very high	97.6	Very high	33 Å²	33	29.4 Å²	29.4	17%	0.173	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	146.6	178.5	-57.7	-179.8	0	0	0	110.4	L300 H323 G326 C387 C388 A390	L300-L380 HydrophobicContact CD1-CD1 3.87Å; L300-L380 HydrophobicContact CD2-CD1 4.06Å; H323-L380 HydrophobicContact CB-CB 4.37Å; G326-L380 WeakPolarHBondContact O-CA 3.49Å; L380-C387 CarbonylContact O-C 3.53Å; L380-C387 WeakPolarHBondContact O-CA 3.45Å; L380-C388 PolarHBondContact N-O 3.01Å; L380-C388 PolarHBondContact O-N 3.09Å; L380-A390 HydrophobicContact CD1-CB 4.19Å; L380-A390 HydrophobicContact CG-CB 4.13Å
381	V	98.7	Very high	97.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128	175.6	-175.7	0	0	0	0	109.1	N325 G326 L328 Y331 L345	N325-V381 HydrophobicContact CB-CB 3.95Å; N325-V381 HydrophobicContact CB-CG1 4.19Å; N325-V381 WeakPolarHBondContact CB-O 3.43Å; G326-V381 PolarHBondContact O-N 2.67Å; L328-V381 HydrophobicContact CB-CG2 4.18Å; L328-V381 HydrophobicContact CD1-CG2 3.94Å; Y331-V381 HydrophobicContact CD1-CG1 4.33Å; Y331-V381 HydrophobicContact CD1-CG2 4.1Å; Y331-V381 HydrophobicContact CD2-CB 4.23Å; Y331-V381 HydrophobicContact CD2-CG1 4.02Å; Y331-V381 HydrophobicContact CD2-CG2 4.39Å; Y331-V381 HydrophobicContact CE1-CG1 4.37Å; Y331-V381 HydrophobicContact CE2-CG1 4.06Å; Y331-V381 HydrophobicContact CG-CB 4.17Å; Y331-V381 HydrophobicContact CG-CG1 4.15Å; Y331-V381 HydrophobicContact CG-CG2 3.83Å; L345-V381 HydrophobicContact CD2-CG1 3.98Å; L345-V381 HydrophobicContact CD2-CG2 4.13Å
382	K	98.1	Very high	97.3	Very high	38 Å²	38	31.1 Å²	31.1	17%	0.165	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-84.5	166.9	178	-60.9	-168.7	-178.2	-161.1	0	111.2	E297 N325 N384 G385 T386	E297-K382 WeakPolarHBondContact O-CE 3.01Å; E297-K382 PolarHBondContact O-NZ 3.42Å; N325-K382 PolarHBondContact ND2-O 3.05Å; K382-N384 VanDerWaalsContact C-N 3.26Å; K382-N384 VanDerWaalsContact CB-OD1 3.25Å; K382-N384 WeakPolarHBondContact CB-OD1 3.38Å; K382-N384 PolarHBondContact O-N 3.05Å; K382-G385 PolarHBondContact O-N 3.39Å; K382-T386 WeakPolarHBondContact CB-O 3.39Å; K382-T386 PolarHBondContact N-O 3.33Å
383	R	96	Very high	97.1	Very high	214 Å²	214	30 Å²	30	81%	0.808	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.2	178.8	-171.5	175.7	178.2	-172.2	-0.1	113.6	E324 G385	E324-R383 WeakPolarHBondContact OE1-CD 3.48Å; E324-R383 WeakPolarHBondContact OE1-CG 3.38Å; E324-R383 IonicContact OE1-NE 3.84Å; R383-G385 PolarHBondContact O-N 2.88Å
384	N	95.3	Very high	96.9	Very high	98 Å²	98	30 Å²	30	52%	0.524	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	2.9	175.9	67.3	-10.4	0	0	0	113.6	K382 T386	K382-N384 VanDerWaalsContact C-N 3.26Å; K382-N384 VanDerWaalsContact CB-OD1 3.25Å; K382-N384 WeakPolarHBondContact CB-OD1 3.38Å; K382-N384 PolarHBondContact O-N 3.05Å; N384-T386 VanDerWaalsContact C-N 3.34Å; N384-T386 PolarHBondContact ND2-OG1 2.75Å; N384-T386 PolarHBondContact OD1-N 3.15Å; N384-T386 VanDerWaalsContact OD1-N 3.14Å; N384-T386 PolarHBondContact OD1-OG1 2.64Å
385	G	95.8	Very high	96.7	Very high	12 Å²	12	30 Å²	30	12%	0.124	14%	0.141	C	C	.	.	S	Bend	trans	77.8	12.1	-179.7	0	0	0	0	0	114.9	R344 L345 K382 R383	R344-G385 WeakPolarHBondContact CD-O 3.43Å; R344-G385 WeakPolarHBondContact CG-O 3.45Å; L345-G385 WeakPolarHBondContact CD2-O 3.48Å; K382-G385 PolarHBondContact O-N 3.39Å; R383-G385 PolarHBondContact O-N 2.88Å
386	T	98.5	Very high	96.4	Very high	13 Å²	13	28.7 Å²	28.7	8%	0.08	14%	0.135	C	C	.	.			trans	-92.9	163.3	167.3	70.2	0	0	0	0	110.8	R344 K382 N384	R344-T386 HydrophobicContact CG-CG2 3.95Å; K382-T386 WeakPolarHBondContact CB-O 3.39Å; K382-T386 PolarHBondContact N-O 3.33Å; N384-T386 VanDerWaalsContact C-N 3.34Å; N384-T386 PolarHBondContact ND2-OG1 2.75Å; N384-T386 PolarHBondContact OD1-N 3.15Å; N384-T386 VanDerWaalsContact OD1-N 3.14Å; N384-T386 PolarHBondContact OD1-OG1 2.64Å
387	C	98.8	Very high	96.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	159	179.6	-68.5	0	0	0	0	112.6	N298 L345 S348 S349 I379 L380	N298-C387 WeakPolarHBondContact CA-O 3.41Å; N298-C387 WeakPolarHBondContact CB-O 3.27Å; N298-C387 PolarHBondContact ND2-O 2.99Å; L345-C387 WeakPolarHBondContact CD2-SG 3.41Å; S348-C387 PolarHBondContact OG-N 2.78Å; S349-C387 WeakPolarHBondContact OG-CB 3.48Å; S349-C387 PolarHBondContact OG-SG 3.01Å; I379-C387 HydrophobicContact CG2-CB 3.62Å; L380-C387 CarbonylContact O-C 3.53Å; L380-C387 WeakPolarHBondContact O-CA 3.45Å
388	C	98.7	Very high	96	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	146.7	158.6	59.6	0	0	0	0	111.7	N298 H323 I379 L380	N298-C388 CarbonylContact O-C 3.55Å; N298-C388 VanDerWaalsContact O-CA 3.24Å; N298-C388 WeakPolarHBondContact O-CA 3.47Å; H323-C388 PolarHBondContact CD2-SG 3.13Å; H323-C388 PolarHBondContact NE2-SG 3.12Å; I379-C388 CarbonylContact C-O 3.6Å; I379-C388 WeakPolarHBondContact CA-O 3.46Å; L380-C388 PolarHBondContact N-O 3.01Å; L380-C388 PolarHBondContact O-N 3.09Å
389	I	98.8	Very high	95.4	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	136.9	178.9	-61.3	177.2	0	0	0	109.9	N298 I299 L300 L353 L356 H371 L374 I379 L392	N298-I389 PolarHBondContact O-N 3.37Å; I299-I389 HydrophobicContact CD1-CB 4.03Å; I299-I389 HydrophobicContact CD1-CD1 4.46Å; L300-I389 WeakPolarHBondContact CB-O 3.41Å; L300-I389 PolarHBondContact N-O 3.47Å; L353-I389 HydrophobicContact CB-CD1 3.86Å; L353-I389 HydrophobicContact CD1-CD1 4.44Å; L353-I389 VanDerWaalsContact N-CD1 3.28Å; L356-I389 HydrophobicContact CD1-CD1 4Å; L356-I389 HydrophobicContact CD1-CG2 4.09Å; H371-I389 WeakPolarHBondContact CD2-CG2 3.45Å; L374-I389 HydrophobicContact CD2-CD1 4.33Å; L374-I389 HydrophobicContact CD2-CG2 4.28Å; I379-I389 HydrophobicContact CG1-CG1 4.45Å; I389-L392 HydrophobicContact CG2-CD2 4.28Å
390	A	96.9	Very high	94.6	Very high	8 Å²	8	31.5 Å²	31.5	7%	0.066	16%	0.157	C	C	.	.			trans	-128.2	175.8	-178.9	0	0	0	0	0	111.5	L300 H371 N378 L380	L300-A390 HydrophobicContact CB-CB 4.12Å; L300-A390 HydrophobicContact CD2-CB 3.66Å; H371-A390 PolarHBondContact NE2-O 2.84Å; H371-A390 VanDerWaalsContact NE2-O 3.15Å; N378-A390 PolarHBondContact O-N 2.7Å; L380-A390 HydrophobicContact CD1-CB 4.19Å; L380-A390 HydrophobicContact CG-CB 4.13Å
391	D	93.8	Very high	93.8	Very high	36 Å²	36	37.1 Å²	37.1	19%	0.193	19%	0.187	C	C	.	.			trans	61	66.6	174.2	-163.1	26.4	0	0	0	113.7	K272 Y289 H371 N378 G393	K272-D391 IonicContact NZ-OD1 3.64Å; K272-D391 PolarHBondContact NZ-OD1 3.11Å; Y289-D391 PolarHBondContact OH-N 3.26Å; H371-D391 PolarHBondContact CE1-O 3.16Å; N378-D391 HydrophobicContact CB-CB 4.24Å; N378-D391 PolarHBondContact ND2-OD2 2.78Å; N378-D391 PolarHBondContact OD1-OD2 2.86Å; D391-G393 VanDerWaalsContact C-N 3.28Å; D391-G393 PolarHBondContact O-N 3.13Å
392	L	94.3	Very high	93	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.			trans	-88.5	12.5	-177.2	-56.2	179.5	0	0	0	113.4	I288 Y289 M294 L356 I389 L394 A395	I288-L392 HydrophobicContact CB-CB 4.24Å; I288-L392 HydrophobicContact CG2-CB 3.76Å; I288-L392 HydrophobicContact CG2-CD1 3.81Å; I288-L392 HydrophobicContact CG2-CG 4.38Å; Y289-L392 HydrophobicContact CD1-CD1 3.89Å; Y289-L392 HydrophobicContact CE1-CD1 3.6Å; Y289-L392 HydrophobicContact CE1-CG 4.17Å; Y289-L392 HydrophobicContact CE2-CB 4.34Å; Y289-L392 HydrophobicContact CE2-CD1 4.39Å; Y289-L392 HydrophobicContact CE2-CG 4.34Å; Y289-L392 HydrophobicContact CG-CD1 4.4Å; M294-L392 HydrophobicContact CE-CD1 4.38Å; L356-L392 HydrophobicContact CD1-CD2 4.34Å; L356-L392 HydrophobicContact CD2-CD2 4.36Å; I389-L392 HydrophobicContact CG2-CD2 4.28Å; L392-L394 PolarHBondContact O-N 3.04Å; L392-L394 VanDerWaalsContact O-N 3.15Å; L392-A395 HydrophobicContact CB-CB 4.39Å; L392-A395 VanDerWaalsContact O-CB 3.27Å; L392-A395 WeakPolarHBondContact O-CB 3.44Å; L392-A395 PolarHBondContact O-N 3.43Å; L392-A395 VanDerWaalsContact O-N 3.07Å
393	G	91.2	Very high	92.2	Very high	4 Å²	4	44.4 Å²	44.4	4%	0.041	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-14.5	-173.5	0	0	0	0	0	115.4	R284 D391	R284-G393 WeakPolarHBondContact CD-O 3.48Å; D391-G393 VanDerWaalsContact C-N 3.28Å; D391-G393 PolarHBondContact O-N 3.13Å
394	L	92	Very high	91.7	Very high	16 Å²	16	39.7 Å²	39.7	8%	0.084	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	0.1	174.9	-67.7	179.2	0	0	0	113.7	R372 D373 L392 V413	R372-L394 WeakPolarHBondContact CD-O 3.46Å; R372-L394 PolarHBondContact NH1-O 3.22Å; D373-L394 HydrophobicContact CB-CD1 3.88Å; L392-L394 PolarHBondContact O-N 3.04Å; L392-L394 VanDerWaalsContact O-N 3.15Å; L394-V413 HydrophobicContact CD1-CB 4.14Å; L394-V413 HydrophobicContact CD1-CG2 4.19Å; L394-V413 HydrophobicContact CD2-CB 4.07Å; L394-V413 HydrophobicContact CD2-CG2 4.05Å
395	A	94.4	Very high	91.1	Very high	2 Å²	2	36 Å²	36	2%	0.017	20%	0.198	C	C	.	.			trans	-66.5	154.6	-175.8	0	0	0	0	0	112	I288 I369 A370 L392	I288-A395 HydrophobicContact CD1-CB 4.45Å; I288-A395 HydrophobicContact CG1-CB 4.24Å; I288-A395 HydrophobicContact CG2-CB 4.27Å; I369-A395 HydrophobicContact CG2-CB 3.82Å; A370-A395 CarbonylContact O-C 3.45Å; A370-A395 WeakPolarHBondContact O-CA 2.84Å; A370-A395 WeakPolarHBondContact O-CB 3.42Å; L392-A395 HydrophobicContact CB-CB 4.39Å; L392-A395 VanDerWaalsContact O-CB 3.27Å; L392-A395 WeakPolarHBondContact O-CB 3.44Å; L392-A395 PolarHBondContact O-N 3.43Å; L392-A395 VanDerWaalsContact O-N 3.07Å
396	V	93.7	Very high	90.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.4	177.5	-64.5	0	0	0	0	110	I369 A370 R372 V405 D406 F433 Y436	I369-V396 WeakPolarHBondContact CA-O 3.21Å; A370-V396 HydrophobicContact CB-CG2 4.03Å; A370-V396 PolarHBondContact N-O 3.01Å; A370-V396 PolarHBondContact O-N 3.47Å; R372-V396 HydrophobicContact CG-CG2 4.43Å; R372-V396 VanDerWaalsContact NH1-CG1 3.31Å; V396-V405 HydrophobicContact CB-CG1 3.94Å; V396-V405 HydrophobicContact CG2-CG1 4Å; V396-D406 WeakPolarHBondContact CG1-O 3.16Å; V396-F433 HydrophobicContact CG2-CE2 4.15Å; V396-Y436 HydrophobicContact CG2-CD1 4.47Å; V396-Y436 HydrophobicContact CG2-CD2 4.22Å; V396-Y436 HydrophobicContact CG2-CG 4.12Å
397	K	93.3	Very high	89.2	Confident	26 Å²	26	40.3 Å²	40.3	11%	0.113	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	142.1	177.1	-70.5	167.3	175.1	168.2	0	110	E287 I288 T291 P367 I369 D406	E287-K397 PolarHBondContact O-NZ 3.46Å; E287-K397 IonicContact OE1-NZ 3.43Å; E287-K397 PolarHBondContact OE1-NZ 3.36Å; I288-K397 HydrophobicContact CD1-CD 4Å; I288-K397 VanDerWaalsContact CD1-CE 3.49Å; I288-K397 HydrophobicContact CD1-CG 3.95Å; T291-K397 WeakPolarHBondContact OG1-CE 3.22Å; T291-K397 PolarHBondContact OG1-NZ 2.7Å; P367-K397 HydrophobicContact CB-CB 4.47Å; P367-K397 HydrophobicContact CG-CB 4.37Å; P367-K397 HydrophobicContact CG-CD 4.29Å; P367-K397 HydrophobicContact CG-CG 4.12Å; I369-K397 HydrophobicContact CG1-CG 4.03Å; K397-D406 PolarHBondContact O-N 2.89Å; K397-D406 VanDerWaalsContact O-N 3.09Å
398	F	92.3	Very high	87.7	Confident	36 Å²	36	40.9 Å²	40.9	16%	0.158	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	129.2	164.4	-177.8	-122.6	0	0	0	109.8	P367 A368 N403 E404 V405 F433	P367-F398 WeakPolarHBondContact CB-O 3.49Å; A368-F398 HydrophobicContact CB-CB 4.18Å; A368-F398 PolarHBondContact O-N 3.44Å; F398-N403 WeakPolarHBondContact CE2-OD1 3.32Å; F398-N403 WeakPolarHBondContact CZ-OD1 3.37Å; F398-E404 WeakPolarHBondContact CD2-O 3.26Å; F398-V405 HydrophobicContact CD2-CG2 4.49Å; F398-F433 HydrophobicContact CB-CB 4.38Å; F398-F433 HydrophobicContact CB-CD1 3.8Å; F398-F433 HydrophobicContact CB-CD2 3.71Å; F398-F433 HydrophobicContact CB-CE1 3.95Å; F398-F433 HydrophobicContact CB-CE2 3.85Å; F398-F433 HydrophobicContact CB-CG 3.68Å; F398-F433 HydrophobicContact CB-CZ 3.97Å; F398-F433 HydrophobicContact CD2-CB 3.61Å; F398-F433 HydrophobicContact CD2-CD1 4.4Å; F398-F433 HydrophobicContact CD2-CD2 4.37Å; F398-F433 AromaticContact CD2-CG 3.88Å; F398-F433 HydrophobicContact CD2-CG 3.88Å; F398-F433 HydrophobicContact CE2-CB 4.22Å; F398-F433 HydrophobicContact CG-CB 4.19Å; F398-F433 HydrophobicContact CG-CD1 4.12Å; F398-F433 HydrophobicContact CG-CD2 4.42Å; F398-F433 AromaticContact CG-CG 3.98Å; F398-F433 HydrophobicContact CG-CG 3.98Å
399	I	85.6	Confident	86	Confident	70 Å²	70	47.4 Å²	47.4	36%	0.359	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	98.2	174.9	-54.1	175.5	0	0	0	106.8	D401 T402 N403 E404	I399-D401 VanDerWaalsContact C-N 3.27Å; I399-D401 PolarHBondContact O-N 3.1Å; I399-T402 WeakPolarHBondContact CG2-OG1 3.37Å; I399-T402 PolarHBondContact O-N 3.07Å; I399-N403 WeakPolarHBondContact O-CA 3.41Å; I399-N403 PolarHBondContact O-N 3.39Å; I399-E404 PolarHBondContact N-O 3.43Å; I399-E404 PolarHBondContact O-N 3.11Å
400	S	82.4	Confident	84.5	Confident	55 Å²	55	51.9 Å²	51.9	39%	0.385	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-40	-176.5	52.2	0	0	0	0	112.9	E359 T402 N403	E359-S400 WeakPolarHBondContact OE1-CB 3.42Å; S400-T402 PolarHBondContact O-N 3.43Å; S400-N403 PolarHBondContact O-N 2.96Å
401	D	81	Confident	83	Confident	151 Å²	151	52.9 Å²	52.9	81%	0.807	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-35.4	-170.9	-61.7	-11	0	0	0	112.5	I399	I399-D401 VanDerWaalsContact C-N 3.27Å; I399-D401 PolarHBondContact O-N 3.1Å
402	T	82.1	Confident	82.1	Confident	76 Å²	76	53.6 Å²	53.6	47%	0.466	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-6	178	59.8	0	0	0	0	112.8	I399 S400 E404	I399-T402 WeakPolarHBondContact CG2-OG1 3.37Å; I399-T402 PolarHBondContact O-N 3.07Å; S400-T402 PolarHBondContact O-N 3.43Å; T402-E404 PolarHBondContact O-N 3.3Å; T402-E404 WeakPolarHBondContact OG1-CB 3.27Å; T402-E404 WeakPolarHBondContact OG1-CG 3.31Å; T402-E404 PolarHBondContact OG1-OE2 3.38Å; T402-E404 VanDerWaalsContact OG1-OE2 3.06Å
403	N	82.1	Confident	81.6	Confident	115 Å²	115	54.4 Å²	54.4	62%	0.615	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	36.9	-169.6	-170.2	47.6	0	0	0	112.2	F398 I399 S400	F398-N403 WeakPolarHBondContact CE2-OD1 3.32Å; F398-N403 WeakPolarHBondContact CZ-OD1 3.37Å; I399-N403 WeakPolarHBondContact O-CA 3.41Å; I399-N403 PolarHBondContact O-N 3.39Å; S400-N403 PolarHBondContact O-N 2.96Å
404	E	85.3	Confident	81.5	Confident	114 Å²	114	55.2 Å²	55.2	53%	0.533	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	165.3	-179.6	-67.1	175.2	155.6	0	0	111.3	F398 I399 T402	F398-E404 WeakPolarHBondContact CD2-O 3.26Å; I399-E404 PolarHBondContact N-O 3.43Å; I399-E404 PolarHBondContact O-N 3.11Å; T402-E404 PolarHBondContact O-N 3.3Å; T402-E404 WeakPolarHBondContact OG1-CB 3.27Å; T402-E404 WeakPolarHBondContact OG1-CG 3.31Å; T402-E404 PolarHBondContact OG1-OE2 3.38Å; T402-E404 VanDerWaalsContact OG1-OE2 3.06Å
405	V	82.6	Confident	81.6	Confident	20 Å²	20	56.5 Å²	56.5	12%	0.121	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.9	172.1	-175.8	0	0	0	0	107.3	V396 F398 I407 F433 Y436	V396-V405 HydrophobicContact CB-CG1 3.94Å; V396-V405 HydrophobicContact CG2-CG1 4Å; F398-V405 HydrophobicContact CD2-CG2 4.49Å; V405-I407 HydrophobicContact CB-CD1 3.87Å; V405-I407 HydrophobicContact CB-CG1 3.53Å; V405-I407 HydrophobicContact CG1-CD1 4.19Å; V405-I407 HydrophobicContact CG1-CG1 3.42Å; V405-I407 VanDerWaalsContact CG1-CG1 3.42Å; V405-I407 WeakPolarHBondContact O-CG1 3.4Å; V405-I407 PolarHBondContact O-N 3.2Å; V405-F433 HydrophobicContact CG1-CD2 4.01Å; V405-F433 HydrophobicContact CG2-CB 3.69Å; V405-F433 HydrophobicContact CG2-CD2 3.9Å; V405-F433 HydrophobicContact CG2-CG 4.28Å; V405-Y436 HydrophobicContact CG1-CD2 4.39Å; V405-Y436 HydrophobicContact CG1-CE2 4.02Å
406	D	82.5	Confident	81.7	Confident	58 Å²	58	59.1 Å²	59.1	31%	0.31	33%	0.326	S	S	.	.			trans	-73.3	80.6	171.2	176.1	15.3	0	0	0	109.4	V396 K397	V396-D406 WeakPolarHBondContact CG1-O 3.16Å; K397-D406 PolarHBondContact O-N 2.89Å; K397-D406 VanDerWaalsContact O-N 3.09Å
407	I	72	Confident	81.9	Confident	58 Å²	58	59.6 Å²	59.6	30%	0.297	33%	0.328	S	S	.	.			trans	-96.6	125.5	-173.9	-49.9	165.2	0	0	0	109.7	V405 T411 R430 Y436	V405-I407 HydrophobicContact CB-CD1 3.87Å; V405-I407 HydrophobicContact CB-CG1 3.53Å; V405-I407 HydrophobicContact CG1-CD1 4.19Å; V405-I407 HydrophobicContact CG1-CG1 3.42Å; V405-I407 VanDerWaalsContact CG1-CG1 3.42Å; V405-I407 WeakPolarHBondContact O-CG1 3.4Å; V405-I407 PolarHBondContact O-N 3.2Å; I407-T411 HydrophobicContact CG2-CG2 4.29Å; I407-R430 HydrophobicContact CD1-CB 4.25Å; I407-R430 VanDerWaalsContact CD1-O 3.25Å; I407-R430 WeakPolarHBondContact CD1-O 3.32Å; I407-Y436 HydrophobicContact CD1-CE2 4.44Å; I407-Y436 WeakPolarHBondContact CD1-OH 3.29Å
408	P	67.6	Low	82.2	Confident	13 Å²	13	58.9 Å²	58.9	8%	0.084	32%	0.324	C	S	.	.			trans	-66.9	150	166.1	-4	17.2	0	0	0	110.7	R284 N410	R284-P408 VanDerWaalsContact CZ-CG 3.42Å; P408-N410 PolarHBondContact O-N 2.87Å
409	P	61.2	Low	82.5	Confident	136 Å²	136	57.5 Å²	57.5	88%	0.883	32%	0.319	S	S	*	.	S	Bend	trans	-56.4	-22.7	-174.9	18.3	-30.4	0	0	0	115.1
410	N	68	Low	83.1	Confident	96 Å²	96	54.4 Å²	54.4	51%	0.513	30%	0.303	S	S	.	.			trans	-100.6	120.7	176.2	-160.9	-0.3	0	0	0	112.1	R372 P408 V413	R372-N410 PolarHBondContact NH2-O 3.06Å; P408-N410 PolarHBondContact O-N 2.87Å; N410-V413 HydrophobicContact CB-CG1 4.22Å; N410-V413 WeakPolarHBondContact O-CG1 3.29Å
411	T	65.3	Low	83.8	Confident	29 Å²	29	52.1 Å²	52.1	18%	0.178	29%	0.287	C	S	.	.			trans	-94.6	-28.2	-176.6	53.5	0	0	0	0	113.6	R372 I407 V413 R430	R372-T411 PolarHBondContact NH2-O 3.33Å; I407-T411 HydrophobicContact CG2-CG2 4.29Å; T411-V413 VanDerWaalsContact C-N 3.27Å; T411-V413 PolarHBondContact O-N 2.76Å; T411-R430 HydrophobicContact CG2-CG 4.19Å; T411-R430 PolarHBondContact OG1-NH2 3.47Å
412	R	74.3	Confident	84.6	Confident	50 Å²	50	45.5 Å²	45.5	19%	0.189	25%	0.251	C	S	.	.	S	Bend	trans	-86.7	68.2	-179.4	-151.9	-177	-168.3	-179	-2.7	110.6	L424 E426 Y478	R412-L424 PolarHBondContact NH2-O 2.65Å; R412-E426 IonicContact CZ-OE1 3.81Å; R412-E426 IonicContact NE-OE1 2.87Å; R412-E426 IonicContact NH1-OE1 3.18Å; R412-E426 PolarHBondContact NH1-OE1 2.75Å; R412-Y478 HydrophobicContact CG-CD1 4.49Å; R412-Y478 HydrophobicContact CG-CE1 3.64Å; R412-Y478 VanDerWaalsContact NH2-CB 3.28Å; R412-Y478 VanDerWaalsContact NH2-CG 3.32Å; R412-Y478 PolarHBondContact O-OH 2.96Å; R412-Y478 VanDerWaalsContact O-OH 3.11Å
413	V	83.9	Confident	85.3	Confident	18 Å²	18	43 Å²	43	11%	0.109	24%	0.235	C	C	.	.			trans	-120.3	161.4	-179	-57.4	0	0	0	0	110.1	L394 N410 T411 M419	L394-V413 HydrophobicContact CD1-CB 4.14Å; L394-V413 HydrophobicContact CD1-CG2 4.19Å; L394-V413 HydrophobicContact CD2-CB 4.07Å; L394-V413 HydrophobicContact CD2-CG2 4.05Å; N410-V413 HydrophobicContact CB-CG1 4.22Å; N410-V413 WeakPolarHBondContact O-CG1 3.29Å; T411-V413 VanDerWaalsContact C-N 3.27Å; T411-V413 PolarHBondContact O-N 2.76Å; V413-M419 VanDerWaalsContact O-CE 3.32Å; V413-M419 WeakPolarHBondContact O-CE 3.13Å
414	G	89.3	Confident	85.9	Confident	20 Å²	20	37.6 Å²	37.6	21%	0.206	21%	0.206	C	C	.	.	S	Bend	trans	99.6	-173	-175.6	0	0	0	0	0	112.5	D373 M419	D373-G414 VanDerWaalsContact OD1-CA 3.3Å; D373-G414 WeakPolarHBondContact OD1-CA 3.46Å; G414-M419 VanDerWaalsContact O-CE 3.26Å; G414-M419 WeakPolarHBondContact O-CE 3.27Å
415	T	94.6	Very high	86.3	Confident	44 Å²	44	34.9 Å²	34.9	27%	0.27	20%	0.196	S	C	.	.			trans	-90	113.7	-171.7	-55.1	0	0	0	0	110.6	D373 K375 R417 Y418 M419	D373-T415 WeakPolarHBondContact OD1-CB 3.39Å; D373-T415 PolarHBondContact OD1-N 3.17Å; D373-T415 PolarHBondContact OD1-OG1 3.42Å; K375-T415 HydrophobicContact CD-CG2 4.16Å; K375-T415 WeakPolarHBondContact CD-OG1 3.42Å; K375-T415 WeakPolarHBondContact CE-OG1 3.41Å; K375-T415 PolarHBondContact NZ-OG1 3.49Å; T415-R417 PolarHBondContact O-N 3.02Å; T415-Y418 HydrophobicContact CG2-CD2 3.91Å; T415-Y418 HydrophobicContact CG2-CE2 4.41Å; T415-Y418 PolarHBondContact O-N 3.36Å; T415-M419 PolarHBondContact O-N 3.35Å
416	K	97	Very high	86.8	Confident	56 Å²	56	39 Å²	39	24%	0.243	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-47.9	-42	-171.9	-48.6	-165.7	-157.7	80.9	0	114.1	Y418 M419 P476 Y478 M481	K416-Y418 PolarHBondContact O-N 3.48Å; K416-M419 HydrophobicContact CG-CE 4.47Å; K416-M419 WeakPolarHBondContact O-CB 3.47Å; K416-M419 PolarHBondContact O-N 3Å; K416-M419 VanDerWaalsContact O-N 3.15Å; K416-P476 WeakPolarHBondContact CD-O 3.33Å; K416-P476 PolarHBondContact NZ-O 3.11Å; K416-Y478 HydrophobicContact CB-CE1 4.48Å; K416-Y478 HydrophobicContact CD-CD1 3.76Å; K416-Y478 HydrophobicContact CD-CD2 3.81Å; K416-Y478 HydrophobicContact CD-CE1 3.82Å; K416-Y478 HydrophobicContact CD-CE2 3.88Å; K416-Y478 HydrophobicContact CD-CG 3.76Å; K416-Y478 HydrophobicContact CG-CD1 4.13Å; K416-Y478 HydrophobicContact CG-CE1 3.81Å; K416-Y478 HydrophobicContact CG-CE2 4.49Å; K416-M481 HydrophobicContact CB-CG 4.28Å
417	R	98.4	Very high	87.4	Confident	11 Å²	11	41.2 Å²	41.2	4%	0.042	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-56.8	-29.6	179	-176.4	179.7	-66.6	-75.6	-3.3	114.5	T415 P467 Y468 P473 T474 P476 M481	T415-R417 PolarHBondContact O-N 3.02Å; R417-P467 VanDerWaalsContact CD-O 3.26Å; R417-P467 WeakPolarHBondContact CD-O 3.36Å; R417-P467 PolarHBondContact NH1-O 2.85Å; R417-Y468 HydrophobicContact CG-CD2 4.38Å; R417-P473 PolarHBondContact NH2-O 3.22Å; R417-T474 PolarHBondContact NH2-O 2.9Å; R417-P476 HydrophobicContact CB-CG 4.18Å; R417-M481 HydrophobicContact CB-SD 4.49Å; R417-M481 WeakPolarHBondContact O-CE 3.33Å
418	Y	98.6	Very high	88.3	Confident	10 Å²	10	39.6 Å²	39.6	4%	0.039	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-101.4	-3.1	-176.4	-67.3	-96.3	0	0	0	112.7	K375 S376 T415 K416 Y442 S443 L446 I447 E450 L466 P467	K375-Y418 HydrophobicContact CB-CD1 4.09Å; K375-Y418 HydrophobicContact CB-CD2 3.75Å; K375-Y418 HydrophobicContact CB-CE1 3.97Å; K375-Y418 HydrophobicContact CB-CE2 3.63Å; K375-Y418 HydrophobicContact CB-CG 3.98Å; S376-Y418 PolarHBondContact OG-OH 2.8Å; T415-Y418 HydrophobicContact CG2-CD2 3.91Å; T415-Y418 HydrophobicContact CG2-CE2 4.41Å; T415-Y418 PolarHBondContact O-N 3.36Å; K416-Y418 PolarHBondContact O-N 3.48Å; Y418-Y442 WeakPolarHBondContact O-CD1 3.39Å; Y418-Y442 WeakPolarHBondContact O-CE1 3.43Å; Y418-S443 PolarHBondContact O-OG 3.42Å; Y418-S443 VanDerWaalsContact O-OG 3.09Å; Y418-L446 HydrophobicContact CD1-CB 4.12Å; Y418-L446 HydrophobicContact CD1-CD1 4.05Å; Y418-L446 HydrophobicContact CE1-CB 4.28Å; Y418-I447 HydrophobicContact CE1-CG1 4.24Å; Y418-E450 VanDerWaalsContact CE1-OE1 3.29Å; Y418-E450 WeakPolarHBondContact CE1-OE1 3.33Å; Y418-E450 PolarHBondContact OH-OE1 3.41Å; Y418-E450 PolarHBondContact OH-OE2 2.97Å; Y418-L466 WeakPolarHBondContact OH-CD2 3.34Å; Y418-P467 HydrophobicContact CE1-CG 3.89Å
419	M	98.3	Very high	89.4	Confident	8 Å²	8	43 Å²	43	4%	0.039	24%	0.239	C	C	.	.			trans	-69.2	135.1	-175.9	-69.2	-174	-177.5	0	0	111.7	V413 G414 T415 K416 V423 L424 Y442 Y478	V413-M419 VanDerWaalsContact O-CE 3.32Å; V413-M419 WeakPolarHBondContact O-CE 3.13Å; G414-M419 VanDerWaalsContact O-CE 3.26Å; G414-M419 WeakPolarHBondContact O-CE 3.27Å; T415-M419 PolarHBondContact O-N 3.35Å; K416-M419 HydrophobicContact CG-CE 4.47Å; K416-M419 WeakPolarHBondContact O-CB 3.47Å; K416-M419 PolarHBondContact O-N 3Å; K416-M419 VanDerWaalsContact O-N 3.15Å; M419-V423 HydrophobicContact CB-CB 4.36Å; M419-V423 HydrophobicContact CB-CG1 4.18Å; M419-V423 HydrophobicContact CG-CG1 4.05Å; M419-V423 HydrophobicContact SD-CG1 3.69Å; M419-L424 HydrophobicContact CB-CD1 4.48Å; M419-L424 HydrophobicContact CB-CD2 3.82Å; M419-L424 HydrophobicContact CB-CG 3.82Å; M419-L424 HydrophobicContact SD-CD2 4.18Å; M419-Y442 VanDerWaalsContact O-CE1 3.31Å; M419-Y442 WeakPolarHBondContact O-CE1 3.33Å; M419-Y478 HydrophobicContact CE-CE1 3.83Å; M419-Y478 HydrophobicContact SD-CD1 4.41Å; M419-Y478 HydrophobicContact SD-CE1 3.61Å
420	P	98.2	Very high	90.6	Very high	4 Å²	4	41.7 Å²	41.7	3%	0.026	22%	0.216	C	C	.	.			trans	-72.3	163.5	174.1	34.6	-40.2	0	0	0	112	E422 V423 L424 A439 Y442	P420-E422 VanDerWaalsContact C-N 3.3Å; P420-E422 WeakPolarHBondContact CB-OE1 3.4Å; P420-E422 WeakPolarHBondContact CB-OE2 3.34Å; P420-E422 HydrophobicContact CG-CG 4.49Å; P420-E422 WeakPolarHBondContact CG-OE1 3.25Å; P420-E422 PolarHBondContact O-N 3.01Å; P420-V423 HydrophobicContact CG-CB 3.94Å; P420-V423 HydrophobicContact CG-CG2 3.55Å; P420-V423 PolarHBondContact O-N 2.94Å; P420-L424 PolarHBondContact O-N 3.44Å; P420-L424 VanDerWaalsContact O-N 3.08Å; P420-A439 HydrophobicContact CG-CB 3.69Å; P420-Y442 VanDerWaalsContact CA-CD1 3.46Å; P420-Y442 HydrophobicContact CB-CD1 3.61Å; P420-Y442 HydrophobicContact CB-CD2 4.05Å; P420-Y442 HydrophobicContact CB-CE1 4.19Å; P420-Y442 HydrophobicContact CB-CG 3.55Å
421	P	98	Very high	91.4	Very high	7 Å²	7	41.5 Å²	41.5	5%	0.045	22%	0.222	C	C	.	.	H	α-helix	trans	-52.6	-43.9	-177.6	-21.4	26.6	0	0	0	113.9	V423 L424 D425 Y442 V485 C486	P421-V423 PolarHBondContact O-N 3.32Å; P421-L424 PolarHBondContact O-N 3.44Å; P421-L424 VanDerWaalsContact O-N 3.15Å; P421-D425 PolarHBondContact O-N 3.24Å; P421-Y442 HydrophobicContact CG-CE2 4.49Å; P421-V485 HydrophobicContact CB-CG1 4.31Å; P421-V485 HydrophobicContact CG-CG1 3.74Å; P421-C486 VanDerWaalsContact CA-SG 3.6Å
422	E	97	Very high	92.5	Very high	13 Å²	13	44.6 Å²	44.6	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-68.7	-20.9	-177.9	69.3	-80.6	-171.8	0	0	114	P420 E426 T427 L428 P519 R522	P420-E422 VanDerWaalsContact C-N 3.3Å; P420-E422 WeakPolarHBondContact CB-OE1 3.4Å; P420-E422 WeakPolarHBondContact CB-OE2 3.34Å; P420-E422 HydrophobicContact CG-CG 4.49Å; P420-E422 WeakPolarHBondContact CG-OE1 3.25Å; P420-E422 PolarHBondContact O-N 3.01Å; E422-E426 CarbonylContact O-C 3.53Å; E422-E426 PolarHBondContact O-N 2.91Å; E422-T427 WeakPolarHBondContact CA-OG1 3.38Å; E422-T427 PolarHBondContact O-N 3.05Å; E422-L428 HydrophobicContact CB-CB 4.36Å; E422-L428 HydrophobicContact CG-CB 4.06Å; E422-L428 HydrophobicContact CG-CD1 4.16Å; E422-L428 HydrophobicContact CG-CG 4.44Å; E422-L428 PolarHBondContact O-N 3.16Å; E422-P519 HydrophobicContact CG-CG 4.09Å; E422-R522 IonicContact OE1-CZ 3.14Å; E422-R522 IonicContact OE1-NH1 2.66Å; E422-R522 PolarHBondContact OE1-NH1 3.4Å; E422-R522 IonicContact OE1-NH2 2.7Å; E422-R522 PolarHBondContact OE1-NH2 2.03Å; E422-R522 IonicContact OE2-CZ 2.75Å; E422-R522 IonicContact OE2-NH1 2.95Å; E422-R522 IonicContact OE2-NH2 3.5Å; E422-R522 PolarHBondContact OE2-NH2 2.74Å
423	V	96.1	Very high	93.4	Very high	22 Å²	22	42.5 Å²	42.5	13%	0.133	23%	0.227	C	C	.	.	H	α-helix	trans	-84.8	-37.2	172	174.6	0	0	0	0	110.4	M419 P420 P421 E426 L428 A439	M419-V423 HydrophobicContact CB-CB 4.36Å; M419-V423 HydrophobicContact CB-CG1 4.18Å; M419-V423 HydrophobicContact CG-CG1 4.05Å; M419-V423 HydrophobicContact SD-CG1 3.69Å; P420-V423 HydrophobicContact CG-CB 3.94Å; P420-V423 HydrophobicContact CG-CG2 3.55Å; P420-V423 PolarHBondContact O-N 2.94Å; P421-V423 PolarHBondContact O-N 3.32Å; V423-E426 PolarHBondContact O-N 3.49Å; V423-L428 HydrophobicContact CG2-CD1 3.64Å; V423-A439 HydrophobicContact CG2-CB 4.5Å
424	L	96.3	Very high	93.9	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-68	-40.6	178.9	-71.6	170.5	0	0	0	112.7	R412 M419 P420 P421 Y478 M481 V485	R412-L424 PolarHBondContact NH2-O 2.65Å; M419-L424 HydrophobicContact CB-CD1 4.48Å; M419-L424 HydrophobicContact CB-CD2 3.82Å; M419-L424 HydrophobicContact CB-CG 3.82Å; M419-L424 HydrophobicContact SD-CD2 4.18Å; P420-L424 PolarHBondContact O-N 3.44Å; P420-L424 VanDerWaalsContact O-N 3.08Å; P421-L424 PolarHBondContact O-N 3.44Å; P421-L424 VanDerWaalsContact O-N 3.15Å; L424-Y478 HydrophobicContact CD2-CD1 4.24Å; L424-M481 HydrophobicContact CD1-CB 3.95Å; L424-M481 HydrophobicContact CD2-CB 3.69Å; L424-V485 HydrophobicContact CD1-CB 3.79Å; L424-V485 HydrophobicContact CD1-CG1 3.88Å; L424-V485 HydrophobicContact CD1-CG2 4.28Å
425	D	93.9	Very high	94.2	Very high	58 Å²	58	45.5 Å²	45.5	31%	0.31	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	2.7	176.4	-76.1	-30.1	0	0	0	113.6	P421 T427 R482 C486	P421-D425 PolarHBondContact O-N 3.24Å; D425-T427 HydrophobicContact CB-CG2 4.17Å; D425-T427 PolarHBondContact O-N 3.05Å; D425-T427 VanDerWaalsContact O-N 3.14Å; D425-R482 VanDerWaalsContact OD1-CD 3.27Å; D425-R482 WeakPolarHBondContact OD1-CD 3.35Å; D425-R482 WeakPolarHBondContact OD1-CG 3.36Å; D425-R482 IonicContact OD1-CZ 3.85Å; D425-R482 IonicContact OD1-NE 3.34Å; D425-R482 PolarHBondContact OD1-NE 3.46Å; D425-R482 IonicContact OD1-NH2 3.92Å; D425-C486 VanDerWaalsContact CG-SG 3.59Å; D425-C486 WeakPolarHBondContact OD2-CB 3.22Å; D425-C486 PolarHBondContact OD2-SG 2.97Å
426	E	92.6	Very high	94.3	Very high	107 Å²	107	43.7 Å²	43.7	50%	0.5	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	24.8	177.6	-52.4	-177.1	-168.6	0	0	114.4	R412 E422 V423	R412-E426 IonicContact CZ-OE1 3.81Å; R412-E426 IonicContact NE-OE1 2.87Å; R412-E426 IonicContact NH1-OE1 3.18Å; R412-E426 PolarHBondContact NH1-OE1 2.75Å; E422-E426 CarbonylContact O-C 3.53Å; E422-E426 PolarHBondContact O-N 2.91Å; V423-E426 PolarHBondContact O-N 3.49Å
427	T	94.2	Very high	94.3	Very high	104 Å²	104	41.6 Å²	41.6	64%	0.638	22%	0.215	S	C	*	.			trans	-91.7	0.4	178.2	56.1	0	0	0	0	113.9	E422 D425 N429	E422-T427 WeakPolarHBondContact CA-OG1 3.38Å; E422-T427 PolarHBondContact O-N 3.05Å; D425-T427 HydrophobicContact CB-CG2 4.17Å; D425-T427 PolarHBondContact O-N 3.05Å; D425-T427 VanDerWaalsContact O-N 3.14Å; T427-N429 PolarHBondContact O-N 3.49Å
428	L	92.4	Very high	94.3	Very high	23 Å²	23	42.8 Å²	42.8	12%	0.12	22%	0.222	C	C	.	.			trans	-58.2	126.4	177.3	-177.8	140.6	0	0	0	111.5	E422 V423 R430 Y436 A439	E422-L428 HydrophobicContact CB-CB 4.36Å; E422-L428 HydrophobicContact CG-CB 4.06Å; E422-L428 HydrophobicContact CG-CD1 4.16Å; E422-L428 HydrophobicContact CG-CG 4.44Å; E422-L428 PolarHBondContact O-N 3.16Å; V423-L428 HydrophobicContact CG2-CD1 3.64Å; L428-R430 HydrophobicContact CD2-CG 4.14Å; L428-R430 PolarHBondContact O-N 3.26Å; L428-R430 VanDerWaalsContact O-N 3.16Å; L428-Y436 HydrophobicContact CD1-CD1 4.4Å; L428-Y436 HydrophobicContact CD2-CD1 4.29Å; L428-Y436 HydrophobicContact CD2-CE1 3.74Å; L428-A439 HydrophobicContact CD1-CB 4.38Å
429	N	90.6	Very high	94.3	Very high	85 Å²	85	42.8 Å²	42.8	46%	0.455	22%	0.224	S	C	.	.			trans	-75.3	105.4	175	-175.5	-4.6	0	0	0	110.8	T427 S431 H432 S435	T427-N429 PolarHBondContact O-N 3.49Å; N429-S431 PolarHBondContact OD1-N 3.07Å; N429-S431 PolarHBondContact OD1-OG 3.34Å; N429-H432 PolarHBondContact O-N 2.69Å; N429-S435 VanDerWaalsContact O-CB 3.27Å; N429-S435 WeakPolarHBondContact O-CB 3.32Å; N429-S435 PolarHBondContact O-OG 2.97Å
430	R	85.9	Confident	94.3	Very high	109 Å²	109	42.5 Å²	42.5	41%	0.411	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-30.1	-172.9	-59.5	171.8	-170.1	-163.6	3	113.4	I407 T411 L428 H432	I407-R430 HydrophobicContact CD1-CB 4.25Å; I407-R430 VanDerWaalsContact CD1-O 3.25Å; I407-R430 WeakPolarHBondContact CD1-O 3.32Å; T411-R430 HydrophobicContact CG2-CG 4.19Å; T411-R430 PolarHBondContact OG1-NH2 3.47Å; L428-R430 HydrophobicContact CD2-CG 4.14Å; L428-R430 PolarHBondContact O-N 3.26Å; L428-R430 VanDerWaalsContact O-N 3.16Å; R430-H432 PolarHBondContact O-N 2.85Å
431	S	83.8	Confident	94.4	Very high	91 Å²	91	42.3 Å²	42.3	64%	0.636	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	-11.4	179.2	60.2	0	0	0	0	112.5	N429	N429-S431 PolarHBondContact OD1-N 3.07Å; N429-S431 PolarHBondContact OD1-OG 3.34Å
432	H	89.6	Confident	94.4	Very high	94 Å²	94	42 Å²	42	44%	0.435	22%	0.219	S	C	.	.			trans	-109.7	109.2	-179.5	-167.7	-165.9	0	0	0	111	N429 R430 Q434 S435	N429-H432 PolarHBondContact O-N 2.69Å; R430-H432 PolarHBondContact O-N 2.85Å; H432-Q434 WeakPolarHBondContact NE2-CB 3.47Å; H432-Q434 WeakPolarHBondContact NE2-CG 3.07Å; H432-Q434 PolarHBondContact O-N 3.1Å; H432-S435 VanDerWaalsContact O-CB 3.25Å; H432-S435 WeakPolarHBondContact O-CB 3.44Å; H432-S435 PolarHBondContact O-N 3.42Å; H432-S435 PolarHBondContact O-OG 3.22Å; H432-S435 VanDerWaalsContact O-OG 3.08Å
433	F	93	Very high	94.5	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.026	22%	0.219	C	C	.	.	H	α-helix	trans	-53.9	-37.4	-180	-178.1	-105.7	0	0	0	113.6	A368 A370 V396 F398 V405 S435 Y436 I437	A368-F433 VanDerWaalsContact C-CZ 3.47Å; A368-F433 HydrophobicContact CB-CD1 4.33Å; A368-F433 HydrophobicContact CB-CE1 3.45Å; A368-F433 VanDerWaalsContact CB-CE1 3.45Å; A368-F433 HydrophobicContact CB-CZ 3.89Å; A368-F433 VanDerWaalsContact O-CZ 3.29Å; A368-F433 WeakPolarHBondContact O-CZ 3.43Å; A370-F433 HydrophobicContact CB-CE2 4.14Å; A370-F433 HydrophobicContact CB-CZ 4.07Å; V396-F433 HydrophobicContact CG2-CE2 4.15Å; F398-F433 HydrophobicContact CB-CB 4.38Å; F398-F433 HydrophobicContact CB-CD1 3.8Å; F398-F433 HydrophobicContact CB-CD2 3.71Å; F398-F433 HydrophobicContact CB-CE1 3.95Å; F398-F433 HydrophobicContact CB-CE2 3.85Å; F398-F433 HydrophobicContact CB-CG 3.68Å; F398-F433 HydrophobicContact CB-CZ 3.97Å; F398-F433 HydrophobicContact CD2-CB 3.61Å; F398-F433 HydrophobicContact CD2-CD1 4.4Å; F398-F433 HydrophobicContact CD2-CD2 4.37Å; F398-F433 AromaticContact CD2-CG 3.88Å; F398-F433 HydrophobicContact CD2-CG 3.88Å; F398-F433 HydrophobicContact CE2-CB 4.22Å; F398-F433 HydrophobicContact CG-CB 4.19Å; F398-F433 HydrophobicContact CG-CD1 4.12Å; F398-F433 HydrophobicContact CG-CD2 4.42Å; F398-F433 AromaticContact CG-CG 3.98Å; F398-F433 HydrophobicContact CG-CG 3.98Å; V405-F433 HydrophobicContact CG1-CD2 4.01Å; V405-F433 HydrophobicContact CG2-CB 3.69Å; V405-F433 HydrophobicContact CG2-CD2 3.9Å; V405-F433 HydrophobicContact CG2-CG 4.28Å; F433-S435 PolarHBondContact O-N 3.41Å; F433-S435 VanDerWaalsContact O-N 3.09Å; F433-Y436 HydrophobicContact CD2-CD2 4.47Å; F433-Y436 PolarHBondContact O-N 2.89Å; F433-I437 HydrophobicContact CD1-CD1 4.46Å; F433-I437 HydrophobicContact CD1-CG1 3.92Å; F433-I437 HydrophobicContact CE1-CD1 3.54Å; F433-I437 HydrophobicContact CE1-CG1 3.48Å; F433-I437 VanDerWaalsContact CE1-CG1 3.48Å; F433-I437 HydrophobicContact CZ-CD1 3.82Å; F433-I437 HydrophobicContact CZ-CG1 4.1Å; F433-I437 PolarHBondContact O-N 3.34Å
434	Q	95.1	Very high	94.6	Very high	90 Å²	90	40.9 Å²	40.9	42%	0.421	21%	0.213	S	C	.	.	H	α-helix	trans	-57.9	-26.2	178.8	-66.2	-60.3	-36.5	0	0	113	H432 Y436 I437 M438	H432-Q434 WeakPolarHBondContact NE2-CB 3.47Å; H432-Q434 WeakPolarHBondContact NE2-CG 3.07Å; H432-Q434 PolarHBondContact O-N 3.1Å; Q434-Y436 VanDerWaalsContact C-N 3.26Å; Q434-Y436 PolarHBondContact O-N 3.21Å; Q434-I437 PolarHBondContact O-N 3.43Å; Q434-M438 HydrophobicContact CB-CE 4.34Å; Q434-M438 WeakPolarHBondContact O-CE 3.34Å; Q434-M438 VanDerWaalsContact O-CG 3.3Å; Q434-M438 WeakPolarHBondContact O-CG 3.46Å; Q434-M438 PolarHBondContact O-N 3.38Å
435	S	95.3	Very high	94.8	Very high	11 Å²	11	40.8 Å²	40.8	8%	0.077	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-39.3	174.5	-52.8	0	0	0	0	112	N429 H432 F433 A439	N429-S435 VanDerWaalsContact O-CB 3.27Å; N429-S435 WeakPolarHBondContact O-CB 3.32Å; N429-S435 PolarHBondContact O-OG 2.97Å; H432-S435 VanDerWaalsContact O-CB 3.25Å; H432-S435 WeakPolarHBondContact O-CB 3.44Å; H432-S435 PolarHBondContact O-N 3.42Å; H432-S435 PolarHBondContact O-OG 3.22Å; H432-S435 VanDerWaalsContact O-OG 3.08Å; F433-S435 PolarHBondContact O-N 3.41Å; F433-S435 VanDerWaalsContact O-N 3.09Å; S435-A439 WeakPolarHBondContact O-CB 3.5Å; S435-A439 PolarHBondContact O-N 3.23Å
436	Y	95.9	Very high	95	Very high	6 Å²	6	38 Å²	38	2%	0.024	20%	0.198	C	C	.	.	H	α-helix	trans	-72.3	-37.3	178	-58.9	-76.2	0	0	0	112	A370 R372 V396 V405 I407 L428 F433 Q434 A439 D440	A370-Y436 VanDerWaalsContact CB-CB 3.42Å; R372-Y436 HydrophobicContact CG-CD1 4.1Å; V396-Y436 HydrophobicContact CG2-CD1 4.47Å; V396-Y436 HydrophobicContact CG2-CD2 4.22Å; V396-Y436 HydrophobicContact CG2-CG 4.12Å; V405-Y436 HydrophobicContact CG1-CD2 4.39Å; V405-Y436 HydrophobicContact CG1-CE2 4.02Å; I407-Y436 HydrophobicContact CD1-CE2 4.44Å; I407-Y436 WeakPolarHBondContact CD1-OH 3.29Å; L428-Y436 HydrophobicContact CD1-CD1 4.4Å; L428-Y436 HydrophobicContact CD2-CD1 4.29Å; L428-Y436 HydrophobicContact CD2-CE1 3.74Å; F433-Y436 HydrophobicContact CD2-CD2 4.47Å; F433-Y436 PolarHBondContact O-N 2.89Å; Q434-Y436 VanDerWaalsContact C-N 3.26Å; Q434-Y436 PolarHBondContact O-N 3.21Å; Y436-A439 WeakPolarHBondContact O-CB 3.38Å; Y436-A439 PolarHBondContact O-N 2.91Å; Y436-D440 PolarHBondContact O-N 3.15Å
437	I	97.8	Very high	95.3	Very high	12 Å²	12	32.9 Å²	32.9	6%	0.062	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-45.7	174.8	-62.3	-66.4	0	0	0	110.7	H357 A370 F433 Q434 A439 D440 M441	H357-I437 HydrophobicContact CB-CD1 3.83Å; H357-I437 WeakPolarHBondContact CD2-CD1 3.21Å; H357-I437 VanDerWaalsContact CG-CD1 3.47Å; A370-I437 HydrophobicContact CB-CD1 3.89Å; A370-I437 HydrophobicContact CB-CG1 4.45Å; F433-I437 HydrophobicContact CD1-CD1 4.46Å; F433-I437 HydrophobicContact CD1-CG1 3.92Å; F433-I437 HydrophobicContact CE1-CD1 3.54Å; F433-I437 HydrophobicContact CE1-CG1 3.48Å; F433-I437 VanDerWaalsContact CE1-CG1 3.48Å; F433-I437 HydrophobicContact CZ-CD1 3.82Å; F433-I437 HydrophobicContact CZ-CG1 4.1Å; F433-I437 PolarHBondContact O-N 3.34Å; Q434-I437 PolarHBondContact O-N 3.43Å; I437-A439 VanDerWaalsContact C-N 3.3Å; I437-A439 PolarHBondContact O-N 2.9Å; I437-D440 WeakPolarHBondContact O-CB 3.03Å; I437-D440 PolarHBondContact O-N 3.18Å; I437-M441 WeakPolarHBondContact O-CG 3.21Å; I437-M441 PolarHBondContact O-N 3.03Å
438	M	98.6	Very high	95.5	Very high	37 Å²	37	28 Å²	28	18%	0.182	14%	0.144	C	C	.	.	H	α-helix	trans	-67.4	-31.6	177.2	-65.8	-179.2	-65.3	0	0	112.1	Q434 M441 Y442 P519 R522	Q434-M438 HydrophobicContact CB-CE 4.34Å; Q434-M438 WeakPolarHBondContact O-CE 3.34Å; Q434-M438 VanDerWaalsContact O-CG 3.3Å; Q434-M438 WeakPolarHBondContact O-CG 3.46Å; Q434-M438 PolarHBondContact O-N 3.38Å; M438-M441 PolarHBondContact O-N 3.34Å; M438-Y442 PolarHBondContact O-N 3.06Å; M438-P519 HydrophobicContact CB-CB 3.82Å; M438-P519 HydrophobicContact CE-CB 3.77Å; M438-P519 HydrophobicContact CG-CB 4.39Å; M438-P519 HydrophobicContact SD-CB 3.77Å; M438-R522 VanDerWaalsContact O-CD 3.25Å; M438-R522 WeakPolarHBondContact O-CD 3.48Å; M438-R522 PolarHBondContact O-NH1 2.9Å
439	A	98.2	Very high	95.8	Very high	10 Å²	10	27 Å²	27	8%	0.083	14%	0.138	C	C	.	.	H	α-helix	trans	-65.9	-41.6	173.3	0	0	0	0	0	112.6	P420 V423 L428 S435 Y436 I437 M441 Y442 S443	P420-A439 HydrophobicContact CG-CB 3.69Å; V423-A439 HydrophobicContact CG2-CB 4.5Å; L428-A439 HydrophobicContact CD1-CB 4.38Å; S435-A439 WeakPolarHBondContact O-CB 3.5Å; S435-A439 PolarHBondContact O-N 3.23Å; Y436-A439 WeakPolarHBondContact O-CB 3.38Å; Y436-A439 PolarHBondContact O-N 2.91Å; I437-A439 VanDerWaalsContact C-N 3.3Å; I437-A439 PolarHBondContact O-N 2.9Å; A439-M441 VanDerWaalsContact C-N 3.28Å; A439-M441 PolarHBondContact O-N 2.83Å; A439-Y442 PolarHBondContact O-N 3.42Å; A439-S443 PolarHBondContact O-N 3.43Å; A439-S443 PolarHBondContact O-OG 3.16Å; A439-S443 VanDerWaalsContact O-OG 3.13Å
440	D	98.7	Very high	96.2	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-59.4	-40.5	173	-80.4	-13.2	0	0	0	111.5	L353 H357 A370 H371 R372 L374 Y436 I437 Y442 S443 F444	L353-D440 HydrophobicContact CD1-CB 4.35Å; H357-D440 IonicContact CD2-OD2 2.75Å; H357-D440 IonicContact CE1-OD2 3.89Å; H357-D440 IonicContact NE2-OD2 2.59Å; H357-D440 PolarHBondContact NE2-OD2 3.37Å; A370-D440 WeakPolarHBondContact CA-OD2 3.48Å; H371-D440 PolarHBondContact N-OD2 3.23Å; R372-D440 PolarHBondContact N-OD1 2.76Å; L374-D440 HydrophobicContact CD1-CB 3.76Å; Y436-D440 PolarHBondContact O-N 3.15Å; I437-D440 WeakPolarHBondContact O-CB 3.03Å; I437-D440 PolarHBondContact O-N 3.18Å; D440-Y442 VanDerWaalsContact C-N 3.34Å; D440-Y442 PolarHBondContact O-N 2.82Å; D440-S443 WeakPolarHBondContact O-CB 3.2Å; D440-S443 PolarHBondContact O-N 3.19Å; D440-S443 VanDerWaalsContact O-N 3.16Å; D440-F444 WeakPolarHBondContact O-CB 3.36Å; D440-F444 PolarHBondContact O-N 2.91Å
441	M	98.9	Very high	96.8	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-66.1	-33.9	-179.4	-66.7	-52.5	-53	0	0	113.4	L353 I437 M438 A439 F444 G445 C514 R522 L523 A525 V528	L353-M441 HydrophobicContact CD2-SD 3.79Å; I437-M441 WeakPolarHBondContact O-CG 3.21Å; I437-M441 PolarHBondContact O-N 3.03Å; M438-M441 PolarHBondContact O-N 3.34Å; A439-M441 VanDerWaalsContact C-N 3.28Å; A439-M441 PolarHBondContact O-N 2.83Å; M441-F444 HydrophobicContact CE-CD1 4.32Å; M441-F444 PolarHBondContact O-N 3.27Å; M441-G445 PolarHBondContact O-N 3.22Å; M441-C514 WeakPolarHBondContact O-CB 3.02Å; M441-R522 HydrophobicContact CB-CB 4.48Å; M441-L523 WeakPolarHBondContact CE-O 2.98Å; M441-L523 VanDerWaalsContact CG-O 3.24Å; M441-L523 WeakPolarHBondContact CG-O 3.49Å; M441-A525 HydrophobicContact CE-CB 4.44Å; M441-A525 HydrophobicContact SD-CB 3.76Å; M441-A525 PolarHBondContact SD-N 3.18Å; M441-A525 VanDerWaalsContact SD-N 3.42Å; M441-V528 HydrophobicContact CE-CB 4.39Å; M441-V528 HydrophobicContact CE-CG2 3.66Å
442	Y	98.9	Very high	97.5	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.7	-49	170.2	172	-84.1	0	0	0	111.1	Y418 M419 P420 P421 M438 A439 D440 F444 G445 L446 Y468 V485 C514 W515	Y418-Y442 WeakPolarHBondContact O-CD1 3.39Å; Y418-Y442 WeakPolarHBondContact O-CE1 3.43Å; M419-Y442 VanDerWaalsContact O-CE1 3.31Å; M419-Y442 WeakPolarHBondContact O-CE1 3.33Å; P420-Y442 VanDerWaalsContact CA-CD1 3.46Å; P420-Y442 HydrophobicContact CB-CD1 3.61Å; P420-Y442 HydrophobicContact CB-CD2 4.05Å; P420-Y442 HydrophobicContact CB-CE1 4.19Å; P420-Y442 HydrophobicContact CB-CG 3.55Å; P421-Y442 HydrophobicContact CG-CE2 4.49Å; M438-Y442 PolarHBondContact O-N 3.06Å; A439-Y442 PolarHBondContact O-N 3.42Å; D440-Y442 VanDerWaalsContact C-N 3.34Å; D440-Y442 PolarHBondContact O-N 2.82Å; Y442-F444 VanDerWaalsContact C-N 3.27Å; Y442-F444 PolarHBondContact O-N 3.14Å; Y442-G445 PolarHBondContact O-N 3.33Å; Y442-G445 VanDerWaalsContact O-N 3.11Å; Y442-L446 HydrophobicContact CD1-CD1 4.2Å; Y442-L446 HydrophobicContact CE1-CD1 3.61Å; Y442-L446 HydrophobicContact CE1-CG 4.27Å; Y442-L446 PolarHBondContact O-N 3.07Å; Y442-Y468 PolarHBondContact OH-OH 3.27Å; Y442-V485 VanDerWaalsContact OH-CG1 3.27Å; Y442-V485 WeakPolarHBondContact OH-CG1 3.28Å; Y442-C514 WeakPolarHBondContact CA-O 3.06Å; Y442-W515 HydrophobicContact CD2-CB 3.68Å; Y442-W515 HydrophobicContact CE2-CB 3.89Å; Y442-W515 HydrophobicContact CG-CB 4.42Å
443	S	98.9	Very high	97.9	Very high	9 Å²	9	9.9 Å²	9.9	6%	0.063	5%	0.05	C	C	.	.	H	α-helix	trans	-60.9	-40.2	180	-51.7	0	0	0	0	110.9	Y418 A439 D440 L446 I447	Y418-S443 PolarHBondContact O-OG 3.42Å; Y418-S443 VanDerWaalsContact O-OG 3.09Å; A439-S443 PolarHBondContact O-N 3.43Å; A439-S443 PolarHBondContact O-OG 3.16Å; A439-S443 VanDerWaalsContact O-OG 3.13Å; D440-S443 WeakPolarHBondContact O-CB 3.2Å; D440-S443 PolarHBondContact O-N 3.19Å; D440-S443 VanDerWaalsContact O-N 3.16Å; S443-L446 WeakPolarHBondContact O-CB 3.41Å; S443-L446 PolarHBondContact O-N 3.44Å; S443-I447 PolarHBondContact O-N 3.05Å
444	F	98.9	Very high	98.1	Very high	2 Å²	2	10.4 Å²	10.4	1%	0.009	5%	0.051	C	C	.	.	H	α-helix	trans	-64.6	-37.8	175.6	-168.3	-104.6	0	0	0	112.8	V350 L353 D440 M441 Y442 L446 I447 L448 V528	V350-F444 HydrophobicContact CB-CE1 3.69Å; V350-F444 HydrophobicContact CB-CE2 4.36Å; V350-F444 HydrophobicContact CB-CZ 3.53Å; V350-F444 HydrophobicContact CG2-CD1 4.41Å; V350-F444 HydrophobicContact CG2-CE1 3.85Å; V350-F444 HydrophobicContact CG2-CZ 4.15Å; L353-F444 HydrophobicContact CD2-CB 3.97Å; L353-F444 HydrophobicContact CD2-CD2 4.06Å; L353-F444 HydrophobicContact CD2-CG 3.97Å; D440-F444 WeakPolarHBondContact O-CB 3.36Å; D440-F444 PolarHBondContact O-N 2.91Å; M441-F444 HydrophobicContact CE-CD1 4.32Å; M441-F444 PolarHBondContact O-N 3.27Å; Y442-F444 VanDerWaalsContact C-N 3.27Å; Y442-F444 PolarHBondContact O-N 3.14Å; F444-L446 VanDerWaalsContact C-N 3.25Å; F444-L446 PolarHBondContact O-N 3.47Å; F444-I447 HydrophobicContact CD2-CD1 4.39Å; F444-I447 WeakPolarHBondContact O-CB 3.27Å; F444-I447 PolarHBondContact O-N 2.88Å; F444-I447 VanDerWaalsContact O-N 3.08Å; F444-L448 HydrophobicContact CD1-CD1 4.08Å; F444-L448 HydrophobicContact CD1-CG 4.07Å; F444-L448 HydrophobicContact CE1-CD1 3.86Å; F444-L448 HydrophobicContact CE1-CD2 3.71Å; F444-L448 HydrophobicContact CE1-CG 3.73Å; F444-L448 HydrophobicContact CZ-CD2 3.89Å; F444-L448 HydrophobicContact CZ-CG 4.27Å; F444-L448 WeakPolarHBondContact O-CG 3.2Å; F444-L448 PolarHBondContact O-N 3.31Å; F444-V528 HydrophobicContact CE1-CG1 3.98Å
445	G	98.9	Very high	98.2	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-57.4	-38	172.9	0	0	0	0	0	112.9	M441 Y442 L448 W449	M441-G445 PolarHBondContact O-N 3.22Å; Y442-G445 PolarHBondContact O-N 3.33Å; Y442-G445 VanDerWaalsContact O-N 3.11Å; G445-L448 PolarHBondContact O-N 3.15Å; G445-W449 PolarHBondContact O-N 3.24Å
446	L	98.9	Very high	98.1	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-68.5	-37.2	174.7	-57.9	174.8	0	0	0	112.3	Y418 Y442 S443 F444 W449 E450 P467 Y468 P492 W515	Y418-L446 HydrophobicContact CD1-CB 4.12Å; Y418-L446 HydrophobicContact CD1-CD1 4.05Å; Y418-L446 HydrophobicContact CE1-CB 4.28Å; Y442-L446 HydrophobicContact CD1-CD1 4.2Å; Y442-L446 HydrophobicContact CE1-CD1 3.61Å; Y442-L446 HydrophobicContact CE1-CG 4.27Å; Y442-L446 PolarHBondContact O-N 3.07Å; S443-L446 WeakPolarHBondContact O-CB 3.41Å; S443-L446 PolarHBondContact O-N 3.44Å; F444-L446 VanDerWaalsContact C-N 3.25Å; F444-L446 PolarHBondContact O-N 3.47Å; L446-W449 WeakPolarHBondContact O-CB 3.23Å; L446-W449 PolarHBondContact O-N 2.74Å; L446-E450 PolarHBondContact O-N 3.32Å; L446-P467 HydrophobicContact CB-CB 4.11Å; L446-P467 HydrophobicContact CB-CG 3.84Å; L446-P467 HydrophobicContact CD1-CB 4.48Å; L446-P467 HydrophobicContact CD2-CB 4.14Å; L446-P467 HydrophobicContact CG-CB 4.48Å; L446-Y468 HydrophobicContact CD1-CE2 3.84Å; L446-Y468 HydrophobicContact CD2-CE2 3.7Å; L446-Y468 HydrophobicContact CG-CE2 4.45Å; L446-P492 HydrophobicContact CD2-CG 3.74Å; L446-W515 HydrophobicContact CD2-CE3 3.67Å; L446-W515 HydrophobicContact CD2-CZ3 3.98Å; L446-W515 HydrophobicContact CG-CE3 4.43Å
447	I	98.9	Very high	97.9	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-65.9	-40.2	175.4	-66	158.1	0	0	0	111	L328 L374 I379 Y418 S443 F444 W449 E450 I451	L328-I447 HydrophobicContact CD2-CG2 3.75Å; L374-I447 HydrophobicContact CB-CD1 4.16Å; I379-I447 HydrophobicContact CD1-CD1 3.8Å; I379-I447 HydrophobicContact CD1-CG2 4.07Å; Y418-I447 HydrophobicContact CE1-CG1 4.24Å; S443-I447 PolarHBondContact O-N 3.05Å; F444-I447 HydrophobicContact CD2-CD1 4.39Å; F444-I447 WeakPolarHBondContact O-CB 3.27Å; F444-I447 PolarHBondContact O-N 2.88Å; F444-I447 VanDerWaalsContact O-N 3.08Å; I447-W449 PolarHBondContact O-N 3.41Å; I447-E450 WeakPolarHBondContact O-CB 3.48Å; I447-E450 PolarHBondContact O-N 3.33Å; I447-E450 VanDerWaalsContact O-N 3.14Å; I447-I451 HydrophobicContact CG2-CD1 4.04Å; I447-I451 HydrophobicContact CG2-CG1 4.47Å; I447-I451 WeakPolarHBondContact O-CG1 3.36Å; I447-I451 PolarHBondContact O-N 3.07Å
448	L	98.9	Very high	97.2	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-58.1	-37.7	174.5	-70	178.7	0	0	0	111.5	A346 F444 G445 I451 A452 M507 L510 M511	A346-L448 HydrophobicContact CB-CD2 3.64Å; F444-L448 HydrophobicContact CD1-CD1 4.08Å; F444-L448 HydrophobicContact CD1-CG 4.07Å; F444-L448 HydrophobicContact CE1-CD1 3.86Å; F444-L448 HydrophobicContact CE1-CD2 3.71Å; F444-L448 HydrophobicContact CE1-CG 3.73Å; F444-L448 HydrophobicContact CZ-CD2 3.89Å; F444-L448 HydrophobicContact CZ-CG 4.27Å; F444-L448 WeakPolarHBondContact O-CG 3.2Å; F444-L448 PolarHBondContact O-N 3.31Å; G445-L448 PolarHBondContact O-N 3.15Å; L448-I451 PolarHBondContact O-N 2.96Å; L448-A452 WeakPolarHBondContact O-CB 3.37Å; L448-A452 PolarHBondContact O-N 3.31Å; L448-M507 HydrophobicContact CB-SD 4.37Å; L448-M507 HydrophobicContact CD1-SD 4.37Å; L448-M507 HydrophobicContact CD2-SD 4.04Å; L448-L510 HydrophobicContact CD1-CD2 3.96Å; L448-L510 HydrophobicContact CD1-CG 4.13Å; L448-M511 HydrophobicContact CB-CE 4.36Å; L448-M511 HydrophobicContact CB-CG 3.79Å; L448-M511 WeakPolarHBondContact O-CE 3.34Å
449	W	98.8	Very high	96.7	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-63.7	-44	174.4	-178.1	90.4	0	0	0	112.6	G445 L446 I447 I451 A452 R453 Q465 P467 H469 P492 S493 F494 W498 M511 W515	G445-W449 PolarHBondContact O-N 3.24Å; L446-W449 WeakPolarHBondContact O-CB 3.23Å; L446-W449 PolarHBondContact O-N 2.74Å; I447-W449 PolarHBondContact O-N 3.41Å; W449-I451 VanDerWaalsContact C-N 3.32Å; W449-I451 PolarHBondContact O-N 3.33Å; W449-A452 PolarHBondContact O-N 2.91Å; W449-R453 HydrophobicContact CD2-CG 4.28Å; W449-R453 HydrophobicContact CE3-CG 4.48Å; W449-R453 VanDerWaalsContact CZ2-CD 3.41Å; W449-R453 HydrophobicContact CZ2-CG 4.36Å; W449-R453 VanDerWaalsContact CZ2-NH1 3.28Å; W449-R453 WeakPolarHBondContact O-CG 3.37Å; W449-R453 PolarHBondContact O-N 3.18Å; W449-R453 VanDerWaalsContact O-N 3.14Å; W449-Q465 HydrophobicContact CH2-CB 4.38Å; W449-P467 HydrophobicContact CE3-CG 4.44Å; W449-H469 AromaticContact CH2-CD2 3.76Å; W449-H469 AromaticContact CH2-NE2 3.95Å; W449-P492 HydrophobicContact CD2-CB 3.68Å; W449-P492 HydrophobicContact CD2-CG 4.44Å; W449-P492 HydrophobicContact CE3-CB 4.33Å; W449-P492 HydrophobicContact CG-CB 3.92Å; W449-P492 HydrophobicContact CH2-CB 4.4Å; W449-P492 HydrophobicContact CZ2-CB 3.74Å; W449-S493 PolarHBondContact NE1-O 2.75Å; W449-F494 AromaticContact CD1-CD1 3.97Å; W449-F494 AromaticContact CD1-CE1 3.95Å; W449-W498 AromaticContact CD1-CH2 3.76Å; W449-W498 HydrophobicContact CG-CH2 4.44Å; W449-M511 WeakPolarHBondContact CA-SD 3.07Å; W449-M511 HydrophobicContact CB-CE 4.33Å; W449-M511 HydrophobicContact CB-SD 3.58Å; W449-M511 VanDerWaalsContact CB-SD 3.58Å; W449-M511 HydrophobicContact CG-SD 4.2Å; W449-W515 HydrophobicContact CB-CH2 4.29Å; W449-W515 HydrophobicContact CB-CZ3 3.96Å; W449-W515 HydrophobicContact CG-CH2 4.38Å; W449-W515 HydrophobicContact CG-CZ3 4.41Å
450	E	98.8	Very high	96.3	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-43.3	175	-65.9	-179.7	-111.3	0	0	111.7	L332 S376 Y418 L446 I447 Y464 P467	L332-E450 HydrophobicContact CD1-CB 3.97Å; S376-E450 VanDerWaalsContact CB-OE2 3.28Å; S376-E450 WeakPolarHBondContact CB-OE2 3.11Å; S376-E450 PolarHBondContact OG-OE1 3.49Å; S376-E450 PolarHBondContact OG-OE2 2.84Å; Y418-E450 VanDerWaalsContact CE1-OE1 3.29Å; Y418-E450 WeakPolarHBondContact CE1-OE1 3.33Å; Y418-E450 PolarHBondContact OH-OE1 3.41Å; Y418-E450 PolarHBondContact OH-OE2 2.97Å; L446-E450 PolarHBondContact O-N 3.32Å; I447-E450 WeakPolarHBondContact O-CB 3.48Å; I447-E450 PolarHBondContact O-N 3.33Å; I447-E450 VanDerWaalsContact O-N 3.14Å; E450-Y464 HydrophobicContact CB-CE2 4.38Å; E450-Y464 PolarHBondContact OE2-OH 2.89Å; E450-P467 HydrophobicContact CG-CG 3.85Å
451	I	98.7	Very high	95.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-50.7	178.1	-67.7	169.3	0	0	0	110.6	L328 L332 L337 M342 L345 A346 I447 L448 W449 R453 R454	L328-I451 HydrophobicContact CD1-CG1 4.36Å; L328-I451 HydrophobicContact CD2-CD1 3.92Å; L328-I451 HydrophobicContact CD2-CG1 3.94Å; L332-I451 HydrophobicContact CD1-CG1 4.17Å; L337-I451 HydrophobicContact CD1-CG2 4.03Å; M342-I451 HydrophobicContact CB-CG2 4.41Å; M342-I451 HydrophobicContact CG-CG2 3.63Å; L345-I451 HydrophobicContact CB-CD1 4.35Å; L345-I451 HydrophobicContact CB-CG2 4.5Å; A346-I451 HydrophobicContact CB-CD1 4.45Å; I447-I451 HydrophobicContact CG2-CD1 4.04Å; I447-I451 HydrophobicContact CG2-CG1 4.47Å; I447-I451 WeakPolarHBondContact O-CG1 3.36Å; I447-I451 PolarHBondContact O-N 3.07Å; L448-I451 PolarHBondContact O-N 2.96Å; W449-I451 VanDerWaalsContact C-N 3.32Å; W449-I451 PolarHBondContact O-N 3.33Å; I451-R453 VanDerWaalsContact C-N 3.35Å; I451-R453 PolarHBondContact O-N 2.89Å; I451-R454 PolarHBondContact O-N 2.84Å; I451-R454 VanDerWaalsContact O-N 3.13Å
452	A	98.1	Very high	95.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.7	-33.4	-174.1	0	0	0	0	0	113.7	M342 L448 W449 R454 C455 W498 L504 M507 M511	M342-A452 HydrophobicContact SD-CB 4.1Å; L448-A452 WeakPolarHBondContact O-CB 3.37Å; L448-A452 PolarHBondContact O-N 3.31Å; W449-A452 PolarHBondContact O-N 2.91Å; A452-R454 PolarHBondContact O-N 3.03Å; A452-C455 VanDerWaalsContact O-CB 3.24Å; A452-C455 WeakPolarHBondContact O-CB 3.41Å; A452-C455 PolarHBondContact O-N 2.9Å; A452-W498 HydrophobicContact CB-CH2 3.57Å; A452-W498 HydrophobicContact CB-CZ2 3.76Å; A452-W498 HydrophobicContact CB-CZ3 4.19Å; A452-L504 HydrophobicContact CB-CD2 4.09Å; A452-M507 HydrophobicContact CB-CG 4.12Å; A452-M511 HydrophobicContact CB-CE 3.42Å; A452-M511 VanDerWaalsContact CB-CE 3.42Å
453	R	97.1	Very high	95.3	Very high	19 Å²	19	30 Å²	30	7%	0.072	19%	0.19	C	C	.	.	H	α-helix	trans	-59	-28.9	174.5	-76.7	-179.3	71.4	88.7	0.8	113.6	W449 I451 C455 E463 W498	W449-R453 HydrophobicContact CD2-CG 4.28Å; W449-R453 HydrophobicContact CE3-CG 4.48Å; W449-R453 VanDerWaalsContact CZ2-CD 3.41Å; W449-R453 HydrophobicContact CZ2-CG 4.36Å; W449-R453 VanDerWaalsContact CZ2-NH1 3.28Å; W449-R453 WeakPolarHBondContact O-CG 3.37Å; W449-R453 PolarHBondContact O-N 3.18Å; W449-R453 VanDerWaalsContact O-N 3.14Å; I451-R453 VanDerWaalsContact C-N 3.35Å; I451-R453 PolarHBondContact O-N 2.89Å; R453-C455 VanDerWaalsContact C-N 3.28Å; R453-E463 PolarHBondContact NH2-O 3.48Å; R453-W498 HydrophobicContact CG-CH2 4.33Å; R453-W498 HydrophobicContact CG-CZ2 3.87Å
454	R	97.6	Very high	95.2	Very high	17 Å²	17	30.8 Å²	30.8	6%	0.064	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-2	179.3	-57.9	-55.6	-64.8	141.6	4.6	112.9	L332 T335 L337 I451 A452 L461 E462 Y464	L332-R454 HydrophobicContact CB-CG 4Å; L332-R454 HydrophobicContact CD2-CB 3.94Å; L332-R454 HydrophobicContact CD2-CG 3.83Å; L332-R454 HydrophobicContact CG-CG 4.4Å; L332-R454 WeakPolarHBondContact O-CD 3.25Å; L332-R454 PolarHBondContact O-NE 3.28Å; T335-R454 PolarHBondContact O-NE 3.32Å; T335-R454 PolarHBondContact O-NH2 3.01Å; L337-R454 HydrophobicContact CD1-CB 4.11Å; L337-R454 HydrophobicContact CG-CB 4.09Å; L337-R454 PolarHBondContact N-O 3.44Å; I451-R454 PolarHBondContact O-N 2.84Å; I451-R454 VanDerWaalsContact O-N 3.13Å; A452-R454 PolarHBondContact O-N 3.03Å; R454-L461 VanDerWaalsContact NH1-CD1 3.32Å; R454-L461 WeakPolarHBondContact O-CD1 3.3Å; R454-E462 PolarHBondContact NH1-O 3.18Å; R454-Y464 HydrophobicContact CG-CD2 4.48Å
455	C	96.7	Very high	95.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-82.1	119.9	174.8	-166.3	0	0	0	0	111	L337 N339 M342 A452 R453 R497 L504	L337-C455 CarbonylContact O-C 3.58Å; L337-C455 WeakPolarHBondContact O-CA 3.27Å; N339-C455 PolarHBondContact OD1-SG 3.47Å; M342-C455 HydrophobicContact CB-CB 4.28Å; M342-C455 HydrophobicContact CG-CB 4.2Å; M342-C455 HydrophobicContact SD-CB 3.64Å; A452-C455 VanDerWaalsContact O-CB 3.24Å; A452-C455 WeakPolarHBondContact O-CB 3.41Å; A452-C455 PolarHBondContact O-N 2.9Å; R453-C455 VanDerWaalsContact C-N 3.28Å; C455-R497 PolarHBondContact O-NH1 3.23Å; C455-R497 PolarHBondContact O-NH2 3.23Å; C455-L504 HydrophobicContact CB-CD2 3.99Å
456	V	94.6	Very high	95.1	Very high	55 Å²	55	35 Å²	35	33%	0.333	21%	0.213	S	C	.	.			trans	-69.7	129	174.3	-177.9	0	0	0	0	108.6	L337 L461	L337-V456 PolarHBondContact O-N 2.77Å; V456-L461 HydrophobicContact CG2-CB 4.37Å; V456-L461 HydrophobicContact CG2-CD1 4.05Å
457	S	90.9	Very high	95.1	Very high	23 Å²	23	35 Å²	35	16%	0.161	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-141.8	135.1	167.6	-177.7	0	0	0	0	109.7	G459 I460 R497 D501	S457-G459 PolarHBondContact O-N 3.24Å; S457-I460 PolarHBondContact N-O 3.25Å; S457-I460 PolarHBondContact O-N 2.73Å; S457-I460 VanDerWaalsContact O-N 3.1Å; S457-R497 VanDerWaalsContact CB-NH1 3.33Å; S457-D501 WeakPolarHBondContact CB-OD2 3.39Å; S457-D501 WeakPolarHBondContact OG-CB 3.46Å; S457-D501 PolarHBondContact OG-OD2 3.36Å
458	G	84.1	Confident	95.1	Very high	78 Å²	78	35.2 Å²	35.2	80%	0.804	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	26.4	-173.9	0	0	0	0	0	114.1	I460	G458-I460 PolarHBondContact O-N 3.03Å
459	G	86.6	Confident	95	Very high	74 Å²	74	37.8 Å²	37.8	76%	0.763	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	4	-175.6	0	0	0	0	0	115	S457	S457-G459 PolarHBondContact O-N 3.24Å
460	I	90.1	Very high	95	Very high	99 Å²	99	43.8 Å²	43.8	51%	0.508	25%	0.254	S	S	.	.	B	Isolated β-bridge	trans	-104	142.1	-178.8	-59.5	170.2	0	0	0	109.8	S457 G458	S457-I460 PolarHBondContact N-O 3.25Å; S457-I460 PolarHBondContact O-N 2.73Å; S457-I460 VanDerWaalsContact O-N 3.1Å; G458-I460 PolarHBondContact O-N 3.03Å
461	L	90.8	Very high	94.9	Very high	69 Å²	69	47.4 Å²	47.4	36%	0.361	27%	0.273	S	S	.	.			trans	-140.4	132.5	-177.8	175	70	0	0	0	110.4	T336 R454 V456	T336-L461 HydrophobicContact CG2-CD1 4.28Å; T336-L461 HydrophobicContact CG2-CD2 3.3Å; T336-L461 HydrophobicContact CG2-CG 4.41Å; R454-L461 VanDerWaalsContact NH1-CD1 3.32Å; R454-L461 WeakPolarHBondContact O-CD1 3.3Å; V456-L461 HydrophobicContact CG2-CB 4.37Å; V456-L461 HydrophobicContact CG2-CD1 4.05Å
462	E	91.3	Very high	94.9	Very high	33 Å²	33	48 Å²	48	15%	0.154	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-87.8	146.2	168	-65.9	80.3	179.8	0	0	111.3	R454 P495 R497	R454-E462 PolarHBondContact NH1-O 3.18Å; E462-P495 HydrophobicContact CG-CG 4.28Å; E462-P495 WeakPolarHBondContact OE1-CB 3.38Å; E462-P495 WeakPolarHBondContact OE1-CG 3.4Å; E462-R497 VanDerWaalsContact CD-NE 3.28Å; E462-R497 IonicContact OE1-CZ 3.46Å; E462-R497 IonicContact OE1-NE 3.66Å; E462-R497 PolarHBondContact OE1-NE 2.99Å; E462-R497 IonicContact OE1-NH2 3.51Å; E462-R497 IonicContact OE2-CZ 3.49Å; E462-R497 VanDerWaalsContact OE2-CZ 3.22Å; E462-R497 IonicContact OE2-NE 3.35Å; E462-R497 PolarHBondContact OE2-NE 3.15Å; E462-R497 IonicContact OE2-NH2 2.66Å; E462-R497 PolarHBondContact OE2-NH2 2.85Å
463	E	94.3	Very high	94.8	Very high	148 Å²	148	51.3 Å²	51.3	69%	0.692	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-58.7	150.2	167.4	-63.4	-172.1	166.8	0	0	112.1	R453 Q465	R453-E463 PolarHBondContact NH2-O 3.48Å; E463-Q465 PolarHBondContact O-N 2.89Å
464	Y	96.8	Very high	94.7	Very high	27 Å²	27	56.5 Å²	56.5	11%	0.106	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-60.6	131.9	171.9	174.7	-94	0	0	0	110.5	Y329 L332 K333 E450 R454 L466	Y329-Y464 AromaticContact CD2-CE1 3.91Å; Y329-Y464 HydrophobicContact CD2-CE1 3.91Å; Y329-Y464 AromaticContact CD2-CZ 3.68Å; Y329-Y464 WeakPolarHBondContact CD2-OH 3.49Å; Y329-Y464 AromaticContact CE2-CE1 3.56Å; Y329-Y464 HydrophobicContact CE2-CE1 3.56Å; Y329-Y464 AromaticContact CE2-CZ 3.82Å; Y329-Y464 WeakPolarHBondContact CE2-OH 3.2Å; L332-Y464 HydrophobicContact CB-CD2 3.56Å; L332-Y464 HydrophobicContact CB-CE2 3.82Å; L332-Y464 HydrophobicContact CD1-CD2 4.49Å; L332-Y464 HydrophobicContact CD1-CE2 4.15Å; K333-Y464 HydrophobicContact CB-CD1 4.49Å; K333-Y464 HydrophobicContact CD-CD1 3.95Å; K333-Y464 HydrophobicContact CD-CE1 4.09Å; K333-Y464 HydrophobicContact CG-CD1 3.22Å; K333-Y464 HydrophobicContact CG-CD2 4.41Å; K333-Y464 HydrophobicContact CG-CE1 3.72Å; K333-Y464 HydrophobicContact CG-CG 3.61Å; E450-Y464 HydrophobicContact CB-CE2 4.38Å; E450-Y464 PolarHBondContact OE2-OH 2.89Å; R454-Y464 HydrophobicContact CG-CD2 4.48Å; Y464-L466 VanDerWaalsContact OH-CD2 3.29Å; Y464-L466 WeakPolarHBondContact OH-CD2 3.45Å
465	Q	97.9	Very high	94.5	Very high	59 Å²	59	62.1 Å²	62.1	28%	0.276	36%	0.363	S	S	.	.			trans	-142.4	150.2	175.4	-66.4	-64.4	-18.9	0	0	109.9	W449 E463 H469	W449-Q465 HydrophobicContact CH2-CB 4.38Å; E463-Q465 PolarHBondContact O-N 2.89Å; Q465-H469 HydrophobicContact CB-CB 4.29Å; Q465-H469 WeakPolarHBondContact CB-CD2 3.41Å; Q465-H469 PolarHBondContact OE1-ND1 3.31Å
466	L	98.1	Very high	94.6	Very high	32 Å²	32	62.3 Å²	62.3	17%	0.168	36%	0.364	C	S	.	.			trans	-74.2	152.9	170.4	-76.6	167.6	0	0	0	110.4	Y329 Y418 Y464 Y468 H469	Y329-L466 HydrophobicContact CD2-CD2 4.07Å; Y329-L466 HydrophobicContact CE2-CD1 4.42Å; Y329-L466 HydrophobicContact CE2-CD2 3.97Å; Y329-L466 HydrophobicContact CE2-CG 4.22Å; Y418-L466 WeakPolarHBondContact OH-CD2 3.34Å; Y464-L466 VanDerWaalsContact OH-CD2 3.29Å; Y464-L466 WeakPolarHBondContact OH-CD2 3.45Å; L466-Y468 PolarHBondContact O-N 3.39Å; L466-H469 VanDerWaalsContact O-CB 3.31Å; L466-H469 WeakPolarHBondContact O-CB 3.2Å; L466-H469 PolarHBondContact O-CD2 2.77Å; L466-H469 VanDerWaalsContact O-CD2 3.31Å; L466-H469 PolarHBondContact O-N 2.66Å; L466-H469 VanDerWaalsContact O-N 3.13Å
467	P	98.5	Very high	94.7	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	139.5	173.6	-22.6	33.1	0	0	0	110.5	R417 Y418 L446 W449 E450 H469 P492	R417-P467 VanDerWaalsContact CD-O 3.26Å; R417-P467 WeakPolarHBondContact CD-O 3.36Å; R417-P467 PolarHBondContact NH1-O 2.85Å; Y418-P467 HydrophobicContact CE1-CG 3.89Å; L446-P467 HydrophobicContact CB-CB 4.11Å; L446-P467 HydrophobicContact CB-CG 3.84Å; L446-P467 HydrophobicContact CD1-CB 4.48Å; L446-P467 HydrophobicContact CD2-CB 4.14Å; L446-P467 HydrophobicContact CG-CB 4.48Å; W449-P467 HydrophobicContact CE3-CG 4.44Å; E450-P467 HydrophobicContact CG-CG 3.85Å; P467-H469 PolarHBondContact O-N 3.49Å; P467-P492 HydrophobicContact CB-CG 4.12Å
468	Y	98.5	Very high	94.9	Very high	4 Å²	4	62.9 Å²	62.9	2%	0.016	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	16.9	-178	-47.6	-76	0	0	0	115.5	R417 Y442 L446 L466 E470 L471 V472 M481 V484 V485 R491 P492	R417-Y468 HydrophobicContact CG-CD2 4.38Å; Y442-Y468 PolarHBondContact OH-OH 3.27Å; L446-Y468 HydrophobicContact CD1-CE2 3.84Å; L446-Y468 HydrophobicContact CD2-CE2 3.7Å; L446-Y468 HydrophobicContact CG-CE2 4.45Å; L466-Y468 PolarHBondContact O-N 3.39Å; Y468-E470 PolarHBondContact O-N 3.17Å; Y468-E470 VanDerWaalsContact O-N 3.09Å; Y468-L471 HydrophobicContact CD1-CD1 4.24Å; Y468-L471 PolarHBondContact O-N 3.18Å; Y468-V472 WeakPolarHBondContact O-CG2 3.41Å; Y468-V472 PolarHBondContact O-N 3.33Å; Y468-V472 VanDerWaalsContact O-N 3.12Å; Y468-M481 HydrophobicContact CD2-CE 3.86Å; Y468-M481 HydrophobicContact CE2-CE 4.06Å; Y468-M481 HydrophobicContact CG-CE 4.43Å; Y468-V484 HydrophobicContact CD1-CG1 4.07Å; Y468-V484 HydrophobicContact CE1-CG1 4.43Å; Y468-V485 HydrophobicContact CE1-CG2 4.06Å; Y468-V485 HydrophobicContact CE2-CG2 4.31Å; Y468-R491 WeakPolarHBondContact OH-CD 3.38Å; Y468-P492 HydrophobicContact CD1-CG 4.34Å; Y468-P492 HydrophobicContact CE1-CG 4.1Å; Y468-P492 HydrophobicContact CE2-CG 4.45Å
469	H	97.8	Very high	95.6	Very high	53 Å²	53	65.2 Å²	65.2	25%	0.245	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-28.3	-179.6	70.6	100	0	0	0	114.4	W449 Q465 L466 P467	W449-H469 AromaticContact CH2-CD2 3.76Å; W449-H469 AromaticContact CH2-NE2 3.95Å; Q465-H469 HydrophobicContact CB-CB 4.29Å; Q465-H469 WeakPolarHBondContact CB-CD2 3.41Å; Q465-H469 PolarHBondContact OE1-ND1 3.31Å; L466-H469 VanDerWaalsContact O-CB 3.31Å; L466-H469 WeakPolarHBondContact O-CB 3.2Å; L466-H469 PolarHBondContact O-CD2 2.77Å; L466-H469 VanDerWaalsContact O-CD2 3.31Å; L466-H469 PolarHBondContact O-N 2.66Å; L466-H469 VanDerWaalsContact O-N 3.13Å; P467-H469 PolarHBondContact O-N 3.49Å
470	E	96.9	Very high	96.1	Very high	128 Å²	128	64.5 Å²	64.5	60%	0.598	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-15.3	178.9	-53.5	-177.8	153.2	0	0	113	Y468	Y468-E470 PolarHBondContact O-N 3.17Å; Y468-E470 VanDerWaalsContact O-N 3.09Å
471	L	97.9	Very high	96.5	Very high	77 Å²	77	59.8 Å²	59.8	40%	0.403	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-21.6	-166.6	-58.8	179.2	0	0	0	113.6	Y468 V484 L490	Y468-L471 HydrophobicContact CD1-CD1 4.24Å; Y468-L471 PolarHBondContact O-N 3.18Å; L471-V484 HydrophobicContact CB-CG1 4.02Å; L471-V484 HydrophobicContact CB-CG2 4.16Å; L471-V484 HydrophobicContact CD1-CG1 3.75Å; L471-L490 HydrophobicContact CD1-CB 3.97Å; L471-L490 HydrophobicContact CD1-CD1 3.98Å; L471-L490 HydrophobicContact CD2-CD1 4.35Å
472	V	98.2	Very high	96.9	Very high	13 Å²	13	61.7 Å²	61.7	8%	0.079	31%	0.31	C	S	.	.	S	Bend	trans	-141.2	152.8	-177	-55.8	0	0	0	0	111.3	Y468 P476 D480 M481 V484	Y468-V472 WeakPolarHBondContact O-CG2 3.41Å; Y468-V472 PolarHBondContact O-N 3.33Å; Y468-V472 VanDerWaalsContact O-N 3.12Å; V472-P476 HydrophobicContact CB-CB 4.01Å; V472-P476 HydrophobicContact CG2-CB 3.95Å; V472-P476 HydrophobicContact CG2-CG 4.15Å; V472-D480 HydrophobicContact CG1-CB 4.29Å; V472-M481 HydrophobicContact CB-SD 4.41Å; V472-M481 HydrophobicContact CG1-SD 4.01Å; V472-M481 HydrophobicContact CG2-SD 3.91Å; V472-V484 HydrophobicContact CG1-CB 4.26Å; V472-V484 HydrophobicContact CG1-CG2 3.68Å
473	P	97.2	Very high	97.2	Very high	70 Å²	70	63.7 Å²	63.7	46%	0.455	32%	0.32	S	S	.	.			trans	-63.4	168.1	178	27.8	-36.3	0	0	0	112.3	R417 D475 P476	R417-P473 PolarHBondContact NH2-O 3.22Å; P473-D475 PolarHBondContact O-N 3.44Å; P473-P476 WeakPolarHBondContact O-CD 3.25Å
474	T	93.8	Very high	97.4	Very high	127 Å²	127	57.1 Å²	57.1	78%	0.779	29%	0.289	S	S	*	.	S	Bend	trans	-56.2	-43.8	-174.3	-52.6	0	0	0	0	113.5	R417 P476	R417-T474 PolarHBondContact NH2-O 2.9Å; T474-P476 WeakPolarHBondContact O-CD 3.47Å
475	D	94.7	Very high	97.5	Very high	135 Å²	135	55.8 Å²	55.8	72%	0.722	28%	0.284	S	S	*	.	S	Bend	trans	-113.3	86.8	171.6	-174.9	26.4	0	0	0	109.3	P473	P473-D475 PolarHBondContact O-N 3.44Å
476	P	97.5	Very high	97.5	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.032	28%	0.275	C	S	.	.			trans	-73	147.2	-173.1	31.2	-34.8	0	0	0	111.5	K416 R417 V472 P473 T474 D480 M481	K416-P476 WeakPolarHBondContact CD-O 3.33Å; K416-P476 PolarHBondContact NZ-O 3.11Å; R417-P476 HydrophobicContact CB-CG 4.18Å; V472-P476 HydrophobicContact CB-CB 4.01Å; V472-P476 HydrophobicContact CG2-CB 3.95Å; V472-P476 HydrophobicContact CG2-CG 4.15Å; P473-P476 WeakPolarHBondContact O-CD 3.25Å; T474-P476 WeakPolarHBondContact O-CD 3.47Å; P476-D480 HydrophobicContact CB-CB 4.08Å; P476-M481 HydrophobicContact CB-CG 3.93Å; P476-M481 HydrophobicContact CB-SD 4Å; P476-M481 HydrophobicContact CG-CG 3.92Å; P476-M481 HydrophobicContact CG-SD 3.81Å
477	S	97.4	Very high	97.5	Very high	40 Å²	40	56.2 Å²	56.2	28%	0.28	29%	0.288	S	S	.	.			trans	-72.4	174.6	167.2	68.5	0	0	0	0	111	E479 D480 M481	S477-E479 VanDerWaalsContact C-N 3.32Å; S477-D480 WeakPolarHBondContact CB-OD2 3.44Å; S477-D480 PolarHBondContact N-OD2 3.28Å; S477-D480 PolarHBondContact OG-N 3.15Å; S477-D480 VanDerWaalsContact OG-N 3.1Å; S477-D480 PolarHBondContact OG-OD2 3.08Å; S477-M481 PolarHBondContact O-N 2.92Å
478	Y	95.6	Very high	97.5	Very high	50 Å²	50	61.9 Å²	61.9	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-39	173.6	-85.5	-60.3	0	0	0	111.5	R412 K416 M419 L424 M481 R482	R412-Y478 HydrophobicContact CG-CD1 4.49Å; R412-Y478 HydrophobicContact CG-CE1 3.64Å; R412-Y478 VanDerWaalsContact NH2-CB 3.28Å; R412-Y478 VanDerWaalsContact NH2-CG 3.32Å; R412-Y478 PolarHBondContact O-OH 2.96Å; R412-Y478 VanDerWaalsContact O-OH 3.11Å; K416-Y478 HydrophobicContact CB-CE1 4.48Å; K416-Y478 HydrophobicContact CD-CD1 3.76Å; K416-Y478 HydrophobicContact CD-CD2 3.81Å; K416-Y478 HydrophobicContact CD-CE1 3.82Å; K416-Y478 HydrophobicContact CD-CE2 3.88Å; K416-Y478 HydrophobicContact CD-CG 3.76Å; K416-Y478 HydrophobicContact CG-CD1 4.13Å; K416-Y478 HydrophobicContact CG-CE1 3.81Å; K416-Y478 HydrophobicContact CG-CE2 4.49Å; M419-Y478 HydrophobicContact CE-CE1 3.83Å; M419-Y478 HydrophobicContact SD-CD1 4.41Å; M419-Y478 HydrophobicContact SD-CE1 3.61Å; L424-Y478 HydrophobicContact CD2-CD1 4.24Å; Y478-M481 PolarHBondContact O-N 3.43Å; Y478-R482 VanDerWaalsContact O-CB 3.23Å; Y478-R482 WeakPolarHBondContact O-CB 3.4Å; Y478-R482 PolarHBondContact O-N 3.23Å
479	E	97.4	Very high	97.5	Very high	126 Å²	126	68 Å²	68	59%	0.589	34%	0.34	S	S	*	.	H	α-helix	trans	-65	-43.3	179.9	-69.3	63.8	-143.4	0	0	110.9	S477 M481 R482 E483	S477-E479 VanDerWaalsContact C-N 3.32Å; E479-M481 PolarHBondContact O-N 3.11Å; E479-R482 PolarHBondContact O-N 3.26Å; E479-E483 WeakPolarHBondContact O-CB 3.39Å; E479-E483 PolarHBondContact O-N 2.91Å
480	D	98.3	Very high	97.5	Very high	59 Å²	59	68.8 Å²	68.8	32%	0.316	35%	0.346	S	S	.	.	H	α-helix	trans	-57.5	-49.2	175.9	-63.1	-41.3	0	0	0	111.3	V472 P476 S477 V484	V472-D480 HydrophobicContact CG1-CB 4.29Å; P476-D480 HydrophobicContact CB-CB 4.08Å; S477-D480 WeakPolarHBondContact CB-OD2 3.44Å; S477-D480 PolarHBondContact N-OD2 3.28Å; S477-D480 PolarHBondContact OG-N 3.15Å; S477-D480 VanDerWaalsContact OG-N 3.1Å; S477-D480 PolarHBondContact OG-OD2 3.08Å; D480-V484 WeakPolarHBondContact O-CG2 3.22Å; D480-V484 PolarHBondContact O-N 3.1Å
481	M	98.5	Very high	97.6	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-41.1	-179	-70.9	-56	-53.5	0	0	111.7	K416 R417 L424 Y468 V472 P476 S477 Y478 E479 V484 V485	K416-M481 HydrophobicContact CB-CG 4.28Å; R417-M481 HydrophobicContact CB-SD 4.49Å; R417-M481 WeakPolarHBondContact O-CE 3.33Å; L424-M481 HydrophobicContact CD1-CB 3.95Å; L424-M481 HydrophobicContact CD2-CB 3.69Å; Y468-M481 HydrophobicContact CD2-CE 3.86Å; Y468-M481 HydrophobicContact CE2-CE 4.06Å; Y468-M481 HydrophobicContact CG-CE 4.43Å; V472-M481 HydrophobicContact CB-SD 4.41Å; V472-M481 HydrophobicContact CG1-SD 4.01Å; V472-M481 HydrophobicContact CG2-SD 3.91Å; P476-M481 HydrophobicContact CB-CG 3.93Å; P476-M481 HydrophobicContact CB-SD 4Å; P476-M481 HydrophobicContact CG-CG 3.92Å; P476-M481 HydrophobicContact CG-SD 3.81Å; S477-M481 PolarHBondContact O-N 2.92Å; Y478-M481 PolarHBondContact O-N 3.43Å; E479-M481 PolarHBondContact O-N 3.11Å; M481-V484 PolarHBondContact O-N 3.12Å; M481-V485 HydrophobicContact CE-CG2 3.69Å; M481-V485 VanDerWaalsContact O-CB 3.22Å; M481-V485 WeakPolarHBondContact O-CB 3.42Å; M481-V485 WeakPolarHBondContact O-CG2 3.33Å; M481-V485 PolarHBondContact O-N 3.04Å
482	R	98.1	Very high	97.6	Very high	109 Å²	109	61.7 Å²	61.7	41%	0.411	31%	0.309	S	S	.	.	H	α-helix	trans	-62.7	-44.6	178	-179.5	176.8	172.9	-93.7	-4.2	111.8	D425 Y478 E479 V484 C486 I487	D425-R482 VanDerWaalsContact OD1-CD 3.27Å; D425-R482 WeakPolarHBondContact OD1-CD 3.35Å; D425-R482 WeakPolarHBondContact OD1-CG 3.36Å; D425-R482 IonicContact OD1-CZ 3.85Å; D425-R482 IonicContact OD1-NE 3.34Å; D425-R482 PolarHBondContact OD1-NE 3.46Å; D425-R482 IonicContact OD1-NH2 3.92Å; Y478-R482 VanDerWaalsContact O-CB 3.23Å; Y478-R482 WeakPolarHBondContact O-CB 3.4Å; Y478-R482 PolarHBondContact O-N 3.23Å; E479-R482 PolarHBondContact O-N 3.26Å; R482-V484 VanDerWaalsContact C-N 3.33Å; R482-V484 PolarHBondContact O-N 3.25Å; R482-C486 HydrophobicContact CG-CB 4.13Å; R482-C486 WeakPolarHBondContact O-CA 3.38Å; R482-C486 WeakPolarHBondContact O-CB 3.48Å; R482-C486 PolarHBondContact O-N 3.04Å; R482-I487 PolarHBondContact O-N 3.2Å; R482-I487 VanDerWaalsContact O-N 3.11Å
483	E	98.4	Very high	97.5	Very high	76 Å²	76	63.9 Å²	63.9	36%	0.355	33%	0.325	S	S	.	.	I	π-helix	trans	-57.9	-46.3	176.8	178.1	61.3	-162.8	0	0	111.4	E479 I487 K488	E479-E483 WeakPolarHBondContact O-CB 3.39Å; E479-E483 PolarHBondContact O-N 2.91Å; E483-I487 WeakPolarHBondContact O-CB 3.42Å; E483-I487 WeakPolarHBondContact OE2-CD1 3.19Å; E483-K488 HydrophobicContact CG-CD 4.49Å; E483-K488 WeakPolarHBondContact O-CB 3.31Å; E483-K488 WeakPolarHBondContact O-CG 3.34Å; E483-K488 PolarHBondContact O-N 2.69Å; E483-K488 WeakPolarHBondContact OE1-CE 3.27Å; E483-K488 IonicContact OE1-NZ 3.2Å; E483-K488 PolarHBondContact OE1-NZ 2.99Å
484	V	98.6	Very high	97.4	Very high	9 Å²	9	64 Å²	64	6%	0.055	32%	0.319	C	S	.	.	I	π-helix	trans	-74.5	-47.9	-177.9	172.9	0	0	0	0	112.4	Y468 L471 V472 D480 M481 R482 K489 L490	Y468-V484 HydrophobicContact CD1-CG1 4.07Å; Y468-V484 HydrophobicContact CE1-CG1 4.43Å; L471-V484 HydrophobicContact CB-CG1 4.02Å; L471-V484 HydrophobicContact CB-CG2 4.16Å; L471-V484 HydrophobicContact CD1-CG1 3.75Å; V472-V484 HydrophobicContact CG1-CB 4.26Å; V472-V484 HydrophobicContact CG1-CG2 3.68Å; D480-V484 WeakPolarHBondContact O-CG2 3.22Å; D480-V484 PolarHBondContact O-N 3.1Å; M481-V484 PolarHBondContact O-N 3.12Å; R482-V484 VanDerWaalsContact C-N 3.33Å; R482-V484 PolarHBondContact O-N 3.25Å; V484-K489 PolarHBondContact O-N 3.09Å; V484-L490 HydrophobicContact CG1-CB 3.99Å; V484-L490 HydrophobicContact CG1-CD1 4.44Å; V484-L490 PolarHBondContact O-N 3.41Å
485	V	98.4	Very high	97.4	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.29	C	S	.	.	I	π-helix	trans	-88.7	-37.1	-167.6	173	0	0	0	0	112.7	P421 L424 Y442 Y468 M481 K489 R491	P421-V485 HydrophobicContact CB-CG1 4.31Å; P421-V485 HydrophobicContact CG-CG1 3.74Å; L424-V485 HydrophobicContact CD1-CB 3.79Å; L424-V485 HydrophobicContact CD1-CG1 3.88Å; L424-V485 HydrophobicContact CD1-CG2 4.28Å; Y442-V485 VanDerWaalsContact OH-CG1 3.27Å; Y442-V485 WeakPolarHBondContact OH-CG1 3.28Å; Y468-V485 HydrophobicContact CE1-CG2 4.06Å; Y468-V485 HydrophobicContact CE2-CG2 4.31Å; M481-V485 HydrophobicContact CE-CG2 3.69Å; M481-V485 VanDerWaalsContact O-CB 3.22Å; M481-V485 WeakPolarHBondContact O-CB 3.42Å; M481-V485 WeakPolarHBondContact O-CG2 3.33Å; M481-V485 PolarHBondContact O-N 3.04Å; V485-K489 WeakPolarHBondContact O-CA 3.42Å; V485-R491 PolarHBondContact O-NH1 3.35Å
486	C	97.9	Very high	97.3	Very high	12 Å²	12	59.9 Å²	59.9	8%	0.081	29%	0.293	C	S	.	.	I	π-helix	trans	-96.8	-48.4	-175	-55.9	0	0	0	0	112.3	P421 D425 R482 K489	P421-C486 VanDerWaalsContact CA-SG 3.6Å; D425-C486 VanDerWaalsContact CG-SG 3.59Å; D425-C486 WeakPolarHBondContact OD2-CB 3.22Å; D425-C486 PolarHBondContact OD2-SG 2.97Å; R482-C486 HydrophobicContact CG-CB 4.13Å; R482-C486 WeakPolarHBondContact O-CA 3.38Å; R482-C486 WeakPolarHBondContact O-CB 3.48Å; R482-C486 PolarHBondContact O-N 3.04Å; C486-K489 WeakPolarHBondContact O-CG 3.42Å
487	I	97.8	Very high	96.9	Very high	87 Å²	87	61.6 Å²	61.6	45%	0.446	30%	0.299	S	S	.	.	I	π-helix	trans	-80.4	-60	-175	-63.2	173.2	0	0	0	110.1	R482 E483 K489	R482-I487 PolarHBondContact O-N 3.2Å; R482-I487 VanDerWaalsContact O-N 3.11Å; E483-I487 WeakPolarHBondContact O-CB 3.42Å; E483-I487 WeakPolarHBondContact OE2-CD1 3.19Å; I487-K489 VanDerWaalsContact C-N 3.28Å; I487-K489 PolarHBondContact O-N 2.93Å
488	K	98.1	Very high	96.8	Very high	119 Å²	119	60 Å²	60	52%	0.517	29%	0.287	S	S	.	.	S	Bend	trans	-77.4	-14.1	179.4	-64.4	175.5	174.9	156.9	0	113.5	E483 L490	E483-K488 HydrophobicContact CG-CD 4.49Å; E483-K488 WeakPolarHBondContact O-CB 3.31Å; E483-K488 WeakPolarHBondContact O-CG 3.34Å; E483-K488 PolarHBondContact O-N 2.69Å; E483-K488 WeakPolarHBondContact OE1-CE 3.27Å; E483-K488 IonicContact OE1-NZ 3.2Å; E483-K488 PolarHBondContact OE1-NZ 2.99Å; K488-L490 HydrophobicContact CB-CD1 3.92Å; K488-L490 HydrophobicContact CB-CG 3.77Å; K488-L490 HydrophobicContact CD-CD1 4.14Å; K488-L490 PolarHBondContact O-N 3.09Å; K488-L490 VanDerWaalsContact O-N 3.16Å
489	K	98.1	Very high	96.6	Very high	133 Å²	133	61.5 Å²	61.5	58%	0.578	31%	0.305	S	S	*	.			trans	52.7	33.8	-179.7	-60.9	-179.3	179.7	173.8	0	113.6	V484 V485 C486 I487	V484-K489 PolarHBondContact O-N 3.09Å; V485-K489 WeakPolarHBondContact O-CA 3.42Å; C486-K489 WeakPolarHBondContact O-CG 3.42Å; I487-K489 VanDerWaalsContact C-N 3.28Å; I487-K489 PolarHBondContact O-N 2.93Å
490	L	98.4	Very high	96.4	Very high	70 Å²	70	60.6 Å²	60.6	37%	0.366	31%	0.313	S	S	.	.			trans	-78.7	155.3	179.6	-61.3	174.4	0	0	0	110.9	L471 V484 K488	L471-L490 HydrophobicContact CD1-CB 3.97Å; L471-L490 HydrophobicContact CD1-CD1 3.98Å; L471-L490 HydrophobicContact CD2-CD1 4.35Å; V484-L490 HydrophobicContact CG1-CB 3.99Å; V484-L490 HydrophobicContact CG1-CD1 4.44Å; V484-L490 PolarHBondContact O-N 3.41Å; K488-L490 HydrophobicContact CB-CD1 3.92Å; K488-L490 HydrophobicContact CB-CG 3.77Å; K488-L490 HydrophobicContact CD-CD1 4.14Å; K488-L490 PolarHBondContact O-N 3.09Å; K488-L490 VanDerWaalsContact O-N 3.16Å
491	R	98.5	Very high	96.2	Very high	46 Å²	46	58.9 Å²	58.9	17%	0.174	30%	0.303	C	S	.	.			trans	-134.4	161.8	175.2	-65.4	-62.8	-178.6	-88.3	-0	109	Y468 V485 S493 W515	Y468-R491 WeakPolarHBondContact OH-CD 3.38Å; V485-R491 PolarHBondContact O-NH1 3.35Å; R491-S493 PolarHBondContact O-N 3.08Å; R491-W515 HydrophobicContact CB-CD2 4.48Å; R491-W515 HydrophobicContact CB-CZ2 4.1Å; R491-W515 HydrophobicContact CG-CD2 4.42Å; R491-W515 HydrophobicContact CG-CG 4.26Å; R491-W515 PolarHBondContact NE-O 3.16Å; R491-W515 PolarHBondContact NH2-O 2.87Å
492	P	98.3	Very high	95.9	Very high	9 Å²	9	63.3 Å²	63.3	6%	0.058	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-55.9	134.7	174.4	-23.7	35.3	0	0	0	111.1	L446 W449 P467 Y468 W515	L446-P492 HydrophobicContact CD2-CG 3.74Å; W449-P492 HydrophobicContact CD2-CB 3.68Å; W449-P492 HydrophobicContact CD2-CG 4.44Å; W449-P492 HydrophobicContact CE3-CB 4.33Å; W449-P492 HydrophobicContact CG-CB 3.92Å; W449-P492 HydrophobicContact CH2-CB 4.4Å; W449-P492 HydrophobicContact CZ2-CB 3.74Å; P467-P492 HydrophobicContact CB-CG 4.12Å; Y468-P492 HydrophobicContact CD1-CG 4.34Å; Y468-P492 HydrophobicContact CE1-CG 4.1Å; Y468-P492 HydrophobicContact CE2-CG 4.45Å; P492-W515 HydrophobicContact CB-CH2 4.23Å; P492-W515 HydrophobicContact CB-CZ3 4.45Å; P492-W515 HydrophobicContact CG-CH2 4.26Å; P492-W515 HydrophobicContact CG-CZ3 4.06Å
493	S	96.4	Very high	95.8	Very high	59 Å²	59	58.3 Å²	58.3	41%	0.413	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-72.1	148.7	-177.2	55.5	0	0	0	0	111.5	W449 R491	W449-S493 PolarHBondContact NE1-O 2.75Å; R491-S493 PolarHBondContact O-N 3.08Å
494	F	96.1	Very high	95.7	Very high	74 Å²	74	54.7 Å²	54.7	33%	0.325	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-96	127.3	171.4	-59.4	-34.2	0	0	0	109.8	W449 N496 W498 G508 M511 W515	W449-F494 AromaticContact CD1-CD1 3.97Å; W449-F494 AromaticContact CD1-CE1 3.95Å; F494-N496 PolarHBondContact O-N 2.95Å; F494-W498 HydrophobicContact CB-CE3 3.99Å; F494-W498 HydrophobicContact CB-CZ3 4.41Å; F494-W498 AromaticContact CD1-CE3 3.71Å; F494-W498 HydrophobicContact CD1-CE3 3.71Å; F494-W498 HydrophobicContact CD1-CH2 4.21Å; F494-W498 AromaticContact CD1-CZ3 3.33Å; F494-W498 HydrophobicContact CD1-CZ3 3.33Å; F494-W498 HydrophobicContact CE1-CE3 4.43Å; F494-W498 AromaticContact CE1-CZ3 3.81Å; F494-W498 HydrophobicContact CE1-CZ3 3.81Å; F494-W498 AromaticContact CG-CE3 3.97Å; F494-W498 HydrophobicContact CG-CE3 3.97Å; F494-W498 HydrophobicContact CG-CZ3 4.07Å; F494-G508 WeakPolarHBondContact CZ-O 3.48Å; F494-M511 HydrophobicContact CD1-SD 4.46Å; F494-M511 HydrophobicContact CE1-CB 4.34Å; F494-M511 HydrophobicContact CE1-SD 3.57Å; F494-M511 VanDerWaalsContact CE1-SD 3.57Å; F494-M511 HydrophobicContact CZ-CB 4.11Å; F494-M511 HydrophobicContact CZ-SD 4.2Å; F494-W515 AromaticContact CE1-CH2 3.56Å; F494-W515 HydrophobicContact CE1-CH2 3.56Å; F494-W515 AromaticContact CE1-CZ2 3.63Å; F494-W515 HydrophobicContact CE1-CZ2 3.63Å; F494-W515 AromaticContact CZ-CH2 3.89Å; F494-W515 HydrophobicContact CZ-CH2 3.89Å; F494-W515 AromaticContact CZ-CZ2 3.46Å; F494-W515 HydrophobicContact CZ-CZ2 3.46Å; F494-W515 VanDerWaalsContact CZ-CZ2 3.46Å
495	P	93.4	Very high	95.6	Very high	27 Å²	27	60.3 Å²	60.3	18%	0.175	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-56.2	134.3	168.7	-25.1	34.5	0	0	0	111.1	E462 R497 W498	E462-P495 HydrophobicContact CG-CG 4.28Å; E462-P495 WeakPolarHBondContact OE1-CB 3.38Å; E462-P495 WeakPolarHBondContact OE1-CG 3.4Å; P495-R497 HydrophobicContact CB-CG 4.13Å; P495-R497 PolarHBondContact O-N 3.34Å; P495-W498 HydrophobicContact CG-CZ2 4.34Å; P495-W498 WeakPolarHBondContact O-CB 3.27Å; P495-W498 PolarHBondContact O-N 2.9Å
496	N	91.3	Very high	95.6	Very high	148 Å²	148	63.4 Å²	63.4	79%	0.791	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-53.1	-33	-178.1	-70.4	-22.5	0	0	0	112.8	F494 W498 S499	F494-N496 PolarHBondContact O-N 2.95Å; N496-W498 PolarHBondContact O-N 3.34Å; N496-S499 WeakPolarHBondContact O-CB 3.32Å; N496-S499 PolarHBondContact O-N 3.14Å; N496-S499 VanDerWaalsContact O-N 3.09Å; N496-S499 PolarHBondContact O-OG 2.93Å
497	R	90.6	Very high	95.6	Very high	40 Å²	40	62.9 Å²	62.9	15%	0.151	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-58.4	-27.8	178.5	77.9	-178.6	-176.9	83.7	5.2	113.4	C455 S457 E462 P495 S499 S500	C455-R497 PolarHBondContact O-NH1 3.23Å; C455-R497 PolarHBondContact O-NH2 3.23Å; S457-R497 VanDerWaalsContact CB-NH1 3.33Å; E462-R497 VanDerWaalsContact CD-NE 3.28Å; E462-R497 IonicContact OE1-CZ 3.46Å; E462-R497 IonicContact OE1-NE 3.66Å; E462-R497 PolarHBondContact OE1-NE 2.99Å; E462-R497 IonicContact OE1-NH2 3.51Å; E462-R497 IonicContact OE2-CZ 3.49Å; E462-R497 VanDerWaalsContact OE2-CZ 3.22Å; E462-R497 IonicContact OE2-NE 3.35Å; E462-R497 PolarHBondContact OE2-NE 3.15Å; E462-R497 IonicContact OE2-NH2 2.66Å; E462-R497 PolarHBondContact OE2-NH2 2.85Å; P495-R497 HydrophobicContact CB-CG 4.13Å; P495-R497 PolarHBondContact O-N 3.34Å; R497-S499 PolarHBondContact O-N 3.16Å; R497-S500 PolarHBondContact O-N 2.87Å
498	W	94.3	Very high	95.6	Very high	6 Å²	6	59 Å²	59	2%	0.023	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-62.5	-25.6	179.2	-70.1	13.2	0	0	0	111.8	W449 A452 R453 F494 P495 N496 S500 D501 L504 R505 M511	W449-W498 AromaticContact CD1-CH2 3.76Å; W449-W498 HydrophobicContact CG-CH2 4.44Å; A452-W498 HydrophobicContact CB-CH2 3.57Å; A452-W498 HydrophobicContact CB-CZ2 3.76Å; A452-W498 HydrophobicContact CB-CZ3 4.19Å; R453-W498 HydrophobicContact CG-CH2 4.33Å; R453-W498 HydrophobicContact CG-CZ2 3.87Å; F494-W498 HydrophobicContact CB-CE3 3.99Å; F494-W498 HydrophobicContact CB-CZ3 4.41Å; F494-W498 AromaticContact CD1-CE3 3.71Å; F494-W498 HydrophobicContact CD1-CE3 3.71Å; F494-W498 HydrophobicContact CD1-CH2 4.21Å; F494-W498 AromaticContact CD1-CZ3 3.33Å; F494-W498 HydrophobicContact CD1-CZ3 3.33Å; F494-W498 HydrophobicContact CE1-CE3 4.43Å; F494-W498 AromaticContact CE1-CZ3 3.81Å; F494-W498 HydrophobicContact CE1-CZ3 3.81Å; F494-W498 AromaticContact CG-CE3 3.97Å; F494-W498 HydrophobicContact CG-CE3 3.97Å; F494-W498 HydrophobicContact CG-CZ3 4.07Å; P495-W498 HydrophobicContact CG-CZ2 4.34Å; P495-W498 WeakPolarHBondContact O-CB 3.27Å; P495-W498 PolarHBondContact O-N 2.9Å; N496-W498 PolarHBondContact O-N 3.34Å; W498-S500 PolarHBondContact O-N 3.08Å; W498-D501 PolarHBondContact O-N 2.82Å; W498-L504 HydrophobicContact CB-CB 3.91Å; W498-L504 HydrophobicContact CD2-CB 4.35Å; W498-L504 HydrophobicContact CG-CB 3.92Å; W498-L504 HydrophobicContact CG-CD1 4.27Å; W498-R505 PolarHBondContact O-N 2.93Å; W498-M511 HydrophobicContact CH2-CE 3.77Å; W498-M511 HydrophobicContact CH2-SD 4.3Å; W498-M511 HydrophobicContact CZ3-CE 3.53Å; W498-M511 HydrophobicContact CZ3-SD 3.89Å
499	S	92.6	Very high	95.6	Very high	82 Å²	82	59.6 Å²	59.6	57%	0.573	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-67.6	-24.4	175.9	67.9	0	0	0	0	113.4	N496 R497	N496-S499 WeakPolarHBondContact O-CB 3.32Å; N496-S499 PolarHBondContact O-N 3.14Å; N496-S499 VanDerWaalsContact O-N 3.09Å; N496-S499 PolarHBondContact O-OG 2.93Å; R497-S499 PolarHBondContact O-N 3.16Å
500	S	91.7	Very high	95.6	Very high	108 Å²	108	53.4 Å²	53.4	76%	0.755	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-89.2	-9	-179.2	-50	0	0	0	0	113.3	R497 W498	R497-S500 PolarHBondContact O-N 2.87Å; W498-S500 PolarHBondContact O-N 3.08Å
501	D	93.9	Very high	95.6	Very high	23 Å²	23	50.1 Å²	50.1	12%	0.123	26%	0.26	C	S	.	.			trans	-114.4	120.4	179.1	-177.3	-66.1	0	0	0	109.8	S457 W498 C503 L504 R505	S457-D501 WeakPolarHBondContact CB-OD2 3.39Å; S457-D501 WeakPolarHBondContact OG-CB 3.46Å; S457-D501 PolarHBondContact OG-OD2 3.36Å; W498-D501 PolarHBondContact O-N 2.82Å; D501-C503 VanDerWaalsContact C-N 3.29Å; D501-C503 PolarHBondContact O-N 3.21Å; D501-C503 WeakPolarHBondContact OD1-CA 3.02Å; D501-C503 VanDerWaalsContact OD1-CB 3.23Å; D501-C503 WeakPolarHBondContact OD1-CB 3.04Å; D501-C503 PolarHBondContact OD1-N 3.17Å; D501-L504 HydrophobicContact CB-CB 4.08Å; D501-L504 HydrophobicContact CB-CD1 3.99Å; D501-L504 HydrophobicContact CB-CG 4.23Å; D501-L504 PolarHBondContact O-N 3.5Å; D501-L504 PolarHBondContact OD1-N 3.42Å; D501-R505 WeakPolarHBondContact O-CB 3.35Å; D501-R505 PolarHBondContact O-N 3.46Å
502	E	94	Very high	95.6	Very high	93 Å²	93	51.2 Å²	51.2	44%	0.435	27%	0.272	S	S	.	.	H	α-helix	trans	-59.8	-38.9	-175.4	-176	56.7	-152.7	0	0	112.9	R505 Q506	E502-R505 IonicContact OE1-CZ 3.5Å; E502-R505 IonicContact OE1-NH2 3.19Å; E502-R505 PolarHBondContact OE1-NH2 2.94Å; E502-R505 IonicContact OE2-CZ 3.56Å; E502-R505 IonicContact OE2-NE 2.59Å; E502-R505 PolarHBondContact OE2-NE 3.1Å; E502-R505 VanDerWaalsContact OE2-NE 3.13Å; E502-R505 IonicContact OE2-NH2 3.22Å; E502-R505 PolarHBondContact OE2-NH2 2.87Å; E502-Q506 WeakPolarHBondContact O-CB 3.25Å; E502-Q506 WeakPolarHBondContact O-CG 3.2Å; E502-Q506 PolarHBondContact O-N 2.85Å; E502-Q506 PolarHBondContact OE1-NE2 2.66Å
503	C	95.4	Very high	95.6	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.02	29%	0.285	C	S	.	.	H	α-helix	trans	-67.7	-48.3	-178.5	-159.7	0	0	0	0	110.8	M342 D501 R505 Q506 M507 Q539	M342-C503 HydrophobicContact CE-CB 4.33Å; M342-C503 WeakPolarHBondContact CE-SG 3.37Å; D501-C503 VanDerWaalsContact C-N 3.29Å; D501-C503 PolarHBondContact O-N 3.21Å; D501-C503 WeakPolarHBondContact OD1-CA 3.02Å; D501-C503 VanDerWaalsContact OD1-CB 3.23Å; D501-C503 WeakPolarHBondContact OD1-CB 3.04Å; D501-C503 PolarHBondContact OD1-N 3.17Å; C503-R505 VanDerWaalsContact C-N 3.35Å; C503-Q506 PolarHBondContact O-N 3.34Å; C503-M507 WeakPolarHBondContact O-CB 3.22Å; C503-M507 PolarHBondContact O-N 2.94Å; C503-Q539 PolarHBondContact SG-NE2 2.78Å
504	L	96.4	Very high	95.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.1	-35.3	179.2	-66.3	172.4	0	0	0	111.9	M342 A452 C455 W498 D501 M507 G508	M342-L504 HydrophobicContact CE-CD2 4.27Å; M342-L504 HydrophobicContact SD-CD2 3.68Å; A452-L504 HydrophobicContact CB-CD2 4.09Å; C455-L504 HydrophobicContact CB-CD2 3.99Å; W498-L504 HydrophobicContact CB-CB 3.91Å; W498-L504 HydrophobicContact CD2-CB 4.35Å; W498-L504 HydrophobicContact CG-CB 3.92Å; W498-L504 HydrophobicContact CG-CD1 4.27Å; D501-L504 HydrophobicContact CB-CB 4.08Å; D501-L504 HydrophobicContact CB-CD1 3.99Å; D501-L504 HydrophobicContact CB-CG 4.23Å; D501-L504 PolarHBondContact O-N 3.5Å; D501-L504 PolarHBondContact OD1-N 3.42Å; L504-M507 PolarHBondContact O-N 3.32Å; L504-G508 PolarHBondContact O-N 3.06Å
505	R	96.7	Very high	95.9	Very high	127 Å²	127	48.3 Å²	48.3	48%	0.479	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-45.9	173.6	-170.7	175.1	67.4	76.2	-8	111.5	W498 D501 E502 C503 G508 K509	W498-R505 PolarHBondContact O-N 2.93Å; D501-R505 WeakPolarHBondContact O-CB 3.35Å; D501-R505 PolarHBondContact O-N 3.46Å; E502-R505 IonicContact OE1-CZ 3.5Å; E502-R505 IonicContact OE1-NH2 3.19Å; E502-R505 PolarHBondContact OE1-NH2 2.94Å; E502-R505 IonicContact OE2-CZ 3.56Å; E502-R505 IonicContact OE2-NE 2.59Å; E502-R505 PolarHBondContact OE2-NE 3.1Å; E502-R505 VanDerWaalsContact OE2-NE 3.13Å; E502-R505 IonicContact OE2-NH2 3.22Å; E502-R505 PolarHBondContact OE2-NH2 2.87Å; C503-R505 VanDerWaalsContact C-N 3.35Å; R505-G508 PolarHBondContact O-N 3.38Å; R505-K509 PolarHBondContact O-N 2.77Å; R505-K509 VanDerWaalsContact O-N 3.11Å
506	Q	97.5	Very high	96.1	Very high	65 Å²	65	48.2 Å²	48.2	30%	0.304	25%	0.253	S	S	.	.	H	α-helix	trans	-65.5	-38.7	175	-73.9	-175	28.4	0	0	112	E502 C503 K509 L510 M535	E502-Q506 WeakPolarHBondContact O-CB 3.25Å; E502-Q506 WeakPolarHBondContact O-CG 3.2Å; E502-Q506 PolarHBondContact O-N 2.85Å; E502-Q506 PolarHBondContact OE1-NE2 2.66Å; C503-Q506 PolarHBondContact O-N 3.34Å; Q506-K509 WeakPolarHBondContact O-CB 3.27Å; Q506-K509 PolarHBondContact O-N 2.86Å; Q506-L510 PolarHBondContact O-N 2.88Å; Q506-M535 HydrophobicContact CB-CE 3.66Å; Q506-M535 HydrophobicContact CB-SD 4.2Å
507	M	98	Very high	96.4	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-63.6	-42.4	174.3	-166.6	67.3	73.2	0	0	111.8	M342 L343 A346 L448 A452 C503 L504 K509 L510 M511 L532 M535	M342-M507 HydrophobicContact CE-CE 4.01Å; M342-M507 HydrophobicContact CG-CE 4.41Å; M342-M507 HydrophobicContact SD-CE 4.21Å; L343-M507 HydrophobicContact CD2-CE 3.97Å; A346-M507 HydrophobicContact CB-CE 4.23Å; L448-M507 HydrophobicContact CB-SD 4.37Å; L448-M507 HydrophobicContact CD1-SD 4.37Å; L448-M507 HydrophobicContact CD2-SD 4.04Å; A452-M507 HydrophobicContact CB-CG 4.12Å; C503-M507 WeakPolarHBondContact O-CB 3.22Å; C503-M507 PolarHBondContact O-N 2.94Å; L504-M507 PolarHBondContact O-N 3.32Å; M507-K509 VanDerWaalsContact C-N 3.31Å; M507-K509 PolarHBondContact O-N 3.28Å; M507-L510 WeakPolarHBondContact O-CB 3.05Å; M507-L510 PolarHBondContact O-N 2.9Å; M507-L510 VanDerWaalsContact O-N 3.13Å; M507-L510 HydrophobicContact SD-CD2 4.01Å; M507-M511 HydrophobicContact CB-CE 4.17Å; M507-M511 HydrophobicContact CG-CE 3.34Å; M507-M511 WeakPolarHBondContact O-CG 2.96Å; M507-M511 PolarHBondContact O-N 3.23Å; M507-L532 HydrophobicContact CE-CD2 3.68Å; M507-L532 HydrophobicContact SD-CD2 4.15Å; M507-M535 HydrophobicContact CE-CE 4.34Å
508	G	98.1	Very high	96.7	Very high	5 Å²	5	46.8 Å²	46.8	5%	0.052	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-37.6	175.6	0	0	0	0	0	112.9	F494 L504 R505 T512	F494-G508 WeakPolarHBondContact CZ-O 3.48Å; L504-G508 PolarHBondContact O-N 3.06Å; R505-G508 PolarHBondContact O-N 3.38Å; G508-T512 PolarHBondContact O-N 3.43Å; G508-T512 PolarHBondContact O-OG1 3.18Å
509	K	98.1	Very high	96.9	Very high	132 Å²	132	47.9 Å²	47.9	57%	0.574	26%	0.256	S	S	*	.	H	α-helix	trans	-62	-47.3	171.3	-179.2	177.2	175.4	176.8	0	111.3	R505 Q506 M507 M511 T512 E513	R505-K509 PolarHBondContact O-N 2.77Å; R505-K509 VanDerWaalsContact O-N 3.11Å; Q506-K509 WeakPolarHBondContact O-CB 3.27Å; Q506-K509 PolarHBondContact O-N 2.86Å; M507-K509 VanDerWaalsContact C-N 3.31Å; M507-K509 PolarHBondContact O-N 3.28Å; K509-M511 VanDerWaalsContact C-N 3.34Å; K509-M511 PolarHBondContact O-N 3.28Å; K509-T512 WeakPolarHBondContact O-CB 3.46Å; K509-T512 PolarHBondContact O-N 3.45Å; K509-T512 VanDerWaalsContact O-N 3.14Å; K509-E513 WeakPolarHBondContact CE-OE1 3.48Å; K509-E513 IonicContact NZ-OE1 3.74Å; K509-E513 WeakPolarHBondContact O-CG 3.17Å; K509-E513 PolarHBondContact O-N 3.36Å
510	L	98.1	Very high	97.1	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-45.2	179	-164.2	66.8	0	0	0	111.7	L448 Q506 M507 T512 E513 C514 L523 V528 T531 L532	L448-L510 HydrophobicContact CD1-CD2 3.96Å; L448-L510 HydrophobicContact CD1-CG 4.13Å; Q506-L510 PolarHBondContact O-N 2.88Å; M507-L510 WeakPolarHBondContact O-CB 3.05Å; M507-L510 PolarHBondContact O-N 2.9Å; M507-L510 VanDerWaalsContact O-N 3.13Å; M507-L510 HydrophobicContact SD-CD2 4.01Å; L510-T512 VanDerWaalsContact C-N 3.34Å; L510-T512 PolarHBondContact O-N 3.42Å; L510-E513 PolarHBondContact O-N 3.02Å; L510-C514 WeakPolarHBondContact O-CB 3.45Å; L510-C514 PolarHBondContact O-N 2.92Å; L510-C514 PolarHBondContact O-SG 2.92Å; L510-C514 VanDerWaalsContact O-SG 3.34Å; L510-L523 HydrophobicContact CD1-CD1 3.54Å; L510-V528 HydrophobicContact CD1-CB 4.42Å; L510-V528 HydrophobicContact CD1-CG1 4.23Å; L510-V528 HydrophobicContact CD1-CG2 4.1Å; L510-V528 HydrophobicContact CD2-CG1 3.91Å; L510-V528 HydrophobicContact CG-CG1 4.2Å; L510-T531 HydrophobicContact CD1-CG2 4.07Å; L510-L532 HydrophobicContact CD2-CD1 4.35Å; L510-L532 HydrophobicContact CD2-CD2 3.79Å; L510-L532 HydrophobicContact CD2-CG 3.9Å
511	M	98.6	Very high	97.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.9	-45.4	174.7	-65.8	174.1	-150	0	0	111.9	L448 W449 A452 F494 W498 M507 K509 E513 C514 W515	L448-M511 HydrophobicContact CB-CE 4.36Å; L448-M511 HydrophobicContact CB-CG 3.79Å; L448-M511 WeakPolarHBondContact O-CE 3.34Å; W449-M511 WeakPolarHBondContact CA-SD 3.07Å; W449-M511 HydrophobicContact CB-CE 4.33Å; W449-M511 HydrophobicContact CB-SD 3.58Å; W449-M511 VanDerWaalsContact CB-SD 3.58Å; W449-M511 HydrophobicContact CG-SD 4.2Å; A452-M511 HydrophobicContact CB-CE 3.42Å; A452-M511 VanDerWaalsContact CB-CE 3.42Å; F494-M511 HydrophobicContact CD1-SD 4.46Å; F494-M511 HydrophobicContact CE1-CB 4.34Å; F494-M511 HydrophobicContact CE1-SD 3.57Å; F494-M511 VanDerWaalsContact CE1-SD 3.57Å; F494-M511 HydrophobicContact CZ-CB 4.11Å; F494-M511 HydrophobicContact CZ-SD 4.2Å; W498-M511 HydrophobicContact CH2-CE 3.77Å; W498-M511 HydrophobicContact CH2-SD 4.3Å; W498-M511 HydrophobicContact CZ3-CE 3.53Å; W498-M511 HydrophobicContact CZ3-SD 3.89Å; M507-M511 HydrophobicContact CB-CE 4.17Å; M507-M511 HydrophobicContact CG-CE 3.34Å; M507-M511 WeakPolarHBondContact O-CG 2.96Å; M507-M511 PolarHBondContact O-N 3.23Å; K509-M511 VanDerWaalsContact C-N 3.34Å; K509-M511 PolarHBondContact O-N 3.28Å; M511-E513 VanDerWaalsContact C-N 3.31Å; M511-E513 PolarHBondContact O-N 2.9Å; M511-C514 PolarHBondContact O-N 2.04Å; M511-C514 VanDerWaalsContact O-N 3.11Å; M511-W515 HydrophobicContact CB-CD2 4.41Å; M511-W515 HydrophobicContact CB-CE3 4.24Å; M511-W515 HydrophobicContact CB-CH2 3.85Å; M511-W515 HydrophobicContact CB-CZ2 3.98Å; M511-W515 HydrophobicContact CB-CZ3 3.96Å; M511-W515 HydrophobicContact CG-CH2 4.48Å; M511-W515 HydrophobicContact CG-CZ3 4.45Å; M511-W515 VanDerWaalsContact O-CD2 3.29Å; M511-W515 PolarHBondContact O-N 3.33Å; M511-W515 HydrophobicContact SD-CH2 4.11Å; M511-W515 HydrophobicContact SD-CZ3 4.38Å
512	T	98.6	Very high	97.6	Very high	70 Å²	70	46 Å²	46	43%	0.429	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-41.7	-178.5	-56.3	0	0	0	0	112.2	G508 K509 L510 A516	G508-T512 PolarHBondContact O-N 3.43Å; G508-T512 PolarHBondContact O-OG1 3.18Å; K509-T512 WeakPolarHBondContact O-CB 3.46Å; K509-T512 PolarHBondContact O-N 3.45Å; K509-T512 VanDerWaalsContact O-N 3.14Å; L510-T512 VanDerWaalsContact C-N 3.34Å; L510-T512 PolarHBondContact O-N 3.42Å; T512-A516 PolarHBondContact O-N 3.35Å
513	E	98.6	Very high	97.8	Very high	70 Å²	70	42.7 Å²	42.7	33%	0.327	23%	0.231	S	C	.	.	H	α-helix	trans	-74.7	-29.4	176.9	-62.1	175.1	-173.8	0	0	111.7	K509 L510 M511 R522 L523	K509-E513 WeakPolarHBondContact CE-OE1 3.48Å; K509-E513 IonicContact NZ-OE1 3.74Å; K509-E513 WeakPolarHBondContact O-CG 3.17Å; K509-E513 PolarHBondContact O-N 3.36Å; L510-E513 PolarHBondContact O-N 3.02Å; M511-E513 VanDerWaalsContact C-N 3.31Å; M511-E513 PolarHBondContact O-N 2.9Å; E513-R522 VanDerWaalsContact O-CA 3.29Å; E513-R522 WeakPolarHBondContact O-CA 3.46Å; E513-L523 HydrophobicContact CB-CD1 3.74Å; E513-L523 HydrophobicContact CB-CD2 4.2Å; E513-L523 HydrophobicContact CB-CG 3.64Å; E513-L523 PolarHBondContact O-N 2.84Å; E513-L523 WeakPolarHBondContact OE2-CD1 3.32Å; E513-L523 WeakPolarHBondContact OE2-CD2 3.06Å
514	C	98.8	Very high	98	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-71.3	-39.7	174.9	-77.7	0	0	0	0	113.7	M441 Y442 L510 M511 R522	M441-C514 WeakPolarHBondContact O-CB 3.02Å; Y442-C514 WeakPolarHBondContact CA-O 3.06Å; L510-C514 WeakPolarHBondContact O-CB 3.45Å; L510-C514 PolarHBondContact O-N 2.92Å; L510-C514 PolarHBondContact O-SG 2.92Å; L510-C514 VanDerWaalsContact O-SG 3.34Å; M511-C514 PolarHBondContact O-N 2.04Å; M511-C514 VanDerWaalsContact O-N 3.11Å; C514-R522 VanDerWaalsContact O-CD 3.23Å; C514-R522 WeakPolarHBondContact O-CD 3.25Å; C514-R522 VanDerWaalsContact O-CG 3.25Å; C514-R522 WeakPolarHBondContact O-CG 3.24Å
515	W	98.4	Very high	98.1	Very high	11 Å²	11	46.6 Å²	46.6	4%	0.042	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	21.7	-176.1	64.1	34.6	0	0	0	114.6	Y442 L446 W449 R491 P492 F494 M511	Y442-W515 HydrophobicContact CD2-CB 3.68Å; Y442-W515 HydrophobicContact CE2-CB 3.89Å; Y442-W515 HydrophobicContact CG-CB 4.42Å; L446-W515 HydrophobicContact CD2-CE3 3.67Å; L446-W515 HydrophobicContact CD2-CZ3 3.98Å; L446-W515 HydrophobicContact CG-CE3 4.43Å; W449-W515 HydrophobicContact CB-CH2 4.29Å; W449-W515 HydrophobicContact CB-CZ3 3.96Å; W449-W515 HydrophobicContact CG-CH2 4.38Å; W449-W515 HydrophobicContact CG-CZ3 4.41Å; R491-W515 HydrophobicContact CB-CD2 4.48Å; R491-W515 HydrophobicContact CB-CZ2 4.1Å; R491-W515 HydrophobicContact CG-CD2 4.42Å; R491-W515 HydrophobicContact CG-CG 4.26Å; R491-W515 PolarHBondContact NE-O 3.16Å; R491-W515 PolarHBondContact NH2-O 2.87Å; P492-W515 HydrophobicContact CB-CH2 4.23Å; P492-W515 HydrophobicContact CB-CZ3 4.45Å; P492-W515 HydrophobicContact CG-CH2 4.26Å; P492-W515 HydrophobicContact CG-CZ3 4.06Å; F494-W515 AromaticContact CE1-CH2 3.56Å; F494-W515 HydrophobicContact CE1-CH2 3.56Å; F494-W515 AromaticContact CE1-CZ2 3.63Å; F494-W515 HydrophobicContact CE1-CZ2 3.63Å; F494-W515 AromaticContact CZ-CH2 3.89Å; F494-W515 HydrophobicContact CZ-CH2 3.89Å; F494-W515 AromaticContact CZ-CZ2 3.46Å; F494-W515 HydrophobicContact CZ-CZ2 3.46Å; F494-W515 VanDerWaalsContact CZ-CZ2 3.46Å; M511-W515 HydrophobicContact CB-CD2 4.41Å; M511-W515 HydrophobicContact CB-CE3 4.24Å; M511-W515 HydrophobicContact CB-CH2 3.85Å; M511-W515 HydrophobicContact CB-CZ2 3.98Å; M511-W515 HydrophobicContact CB-CZ3 3.96Å; M511-W515 HydrophobicContact CG-CH2 4.48Å; M511-W515 HydrophobicContact CG-CZ3 4.45Å; M511-W515 VanDerWaalsContact O-CD2 3.29Å; M511-W515 PolarHBondContact O-N 3.33Å; M511-W515 HydrophobicContact SD-CH2 4.11Å; M511-W515 HydrophobicContact SD-CZ3 4.38Å
516	A	98.5	Very high	98.2	Very high	24 Å²	24	44.6 Å²	44.6	20%	0.198	25%	0.253	C	S	.	.			trans	-51.5	141.8	174.9	0	0	0	0	0	111	T512 N518 C521 R522	T512-A516 PolarHBondContact O-N 3.35Å; A516-N518 PolarHBondContact O-N 2.86Å; A516-C521 HydrophobicContact CB-CB 4.09Å; A516-R522 HydrophobicContact CB-CG 4.11Å; A516-R522 PolarHBondContact O-NE 2.96Å; A516-R522 PolarHBondContact O-NH2 2.99Å
517	N	97.1	Very high	98.2	Very high	72 Å²	72	48.7 Å²	48.7	39%	0.385	27%	0.266	S	S	.	.	S	Bend	trans	-62.6	-45.6	-175.8	-166.3	80.5	0	0	0	111.8	P519 R522	N517-P519 WeakPolarHBondContact O-CD 3.3Å; N517-R522 PolarHBondContact O-NH2 3.15Å
518	N	97.7	Very high	98.3	Very high	87 Å²	87	48.7 Å²	48.7	47%	0.465	27%	0.266	S	S	.	.	S	Bend	trans	-75.2	119.3	173.2	-177.5	-5.4	0	0	0	109.8	A516 A520 C521	A516-N518 PolarHBondContact O-N 2.86Å; N518-A520 VanDerWaalsContact C-N 3.25Å; N518-A520 PolarHBondContact O-N 2.77Å; N518-A520 PolarHBondContact OD1-N 2.98Å; N518-A520 VanDerWaalsContact OD1-N 3.1Å; N518-C521 HydrophobicContact CB-CB 4.41Å; N518-C521 PolarHBondContact O-N 3.06Å; N518-C521 VanDerWaalsContact O-N 3.12Å
519	P	97.8	Very high	98.3	Very high	28 Å²	28	51 Å²	51	18%	0.182	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-53.4	-40.4	178.1	-26.5	35.6	0	0	0	113.6	E422 M438 N517 C521 R522	E422-P519 HydrophobicContact CG-CG 4.09Å; M438-P519 HydrophobicContact CB-CB 3.82Å; M438-P519 HydrophobicContact CE-CB 3.77Å; M438-P519 HydrophobicContact CG-CB 4.39Å; M438-P519 HydrophobicContact SD-CB 3.77Å; N517-P519 WeakPolarHBondContact O-CD 3.3Å; P519-C521 PolarHBondContact O-N 3.12Å; P519-C521 VanDerWaalsContact O-N 3.15Å; P519-R522 VanDerWaalsContact O-CB 3.32Å; P519-R522 WeakPolarHBondContact O-CB 3.01Å; P519-R522 WeakPolarHBondContact O-CG 3.46Å; P519-R522 PolarHBondContact O-N 2.87Å
520	A	97.1	Very high	98.3	Very high	76 Å²	76	51.1 Å²	51.1	63%	0.628	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-66.6	-17.3	-176.8	0	0	0	0	0	113.9	N518	N518-A520 VanDerWaalsContact C-N 3.25Å; N518-A520 PolarHBondContact O-N 2.77Å; N518-A520 PolarHBondContact OD1-N 2.98Å; N518-A520 VanDerWaalsContact OD1-N 3.1Å
521	C	97.6	Very high	98.3	Very high	81 Å²	81	53 Å²	53	55%	0.547	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-87	-7.2	175.8	-61.9	0	0	0	0	112.8	A516 N518 P519	A516-C521 HydrophobicContact CB-CB 4.09Å; N518-C521 HydrophobicContact CB-CB 4.41Å; N518-C521 PolarHBondContact O-N 3.06Å; N518-C521 VanDerWaalsContact O-N 3.12Å; P519-C521 PolarHBondContact O-N 3.12Å; P519-C521 VanDerWaalsContact O-N 3.15Å
522	R	98.7	Very high	98.3	Very high	16 Å²	16	53 Å²	53	6%	0.06	29%	0.287	C	S	.	.	S	Bend	trans	-75.4	142.6	-175.5	-60.6	177.1	-170.3	150.7	10.9	111.1	E422 M438 M441 E513 C514 A516 N517 P519	E422-R522 IonicContact OE1-CZ 3.14Å; E422-R522 IonicContact OE1-NH1 2.66Å; E422-R522 PolarHBondContact OE1-NH1 3.4Å; E422-R522 IonicContact OE1-NH2 2.7Å; E422-R522 PolarHBondContact OE1-NH2 2.03Å; E422-R522 IonicContact OE2-CZ 2.75Å; E422-R522 IonicContact OE2-NH1 2.95Å; E422-R522 IonicContact OE2-NH2 3.5Å; E422-R522 PolarHBondContact OE2-NH2 2.74Å; M438-R522 VanDerWaalsContact O-CD 3.25Å; M438-R522 WeakPolarHBondContact O-CD 3.48Å; M438-R522 PolarHBondContact O-NH1 2.9Å; M441-R522 HydrophobicContact CB-CB 4.48Å; E513-R522 VanDerWaalsContact O-CA 3.29Å; E513-R522 WeakPolarHBondContact O-CA 3.46Å; C514-R522 VanDerWaalsContact O-CD 3.23Å; C514-R522 WeakPolarHBondContact O-CD 3.25Å; C514-R522 VanDerWaalsContact O-CG 3.25Å; C514-R522 WeakPolarHBondContact O-CG 3.24Å; A516-R522 HydrophobicContact CB-CG 4.11Å; A516-R522 PolarHBondContact O-NE 2.96Å; A516-R522 PolarHBondContact O-NH2 2.99Å; N517-R522 PolarHBondContact O-NH2 3.15Å; P519-R522 VanDerWaalsContact O-CB 3.32Å; P519-R522 WeakPolarHBondContact O-CB 3.01Å; P519-R522 WeakPolarHBondContact O-CG 3.46Å; P519-R522 PolarHBondContact O-N 2.87Å
523	L	98.6	Very high	98.2	Very high	25 Å²	25	50.7 Å²	50.7	13%	0.131	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-63.4	145.2	173.3	-60.7	179.1	0	0	0	111	M441 L510 E513 R527 V528	M441-L523 WeakPolarHBondContact CE-O 2.98Å; M441-L523 VanDerWaalsContact CG-O 3.24Å; M441-L523 WeakPolarHBondContact CG-O 3.49Å; L510-L523 HydrophobicContact CD1-CD1 3.54Å; E513-L523 HydrophobicContact CB-CD1 3.74Å; E513-L523 HydrophobicContact CB-CD2 4.2Å; E513-L523 HydrophobicContact CB-CG 3.64Å; E513-L523 PolarHBondContact O-N 2.84Å; E513-L523 WeakPolarHBondContact OE2-CD1 3.32Å; E513-L523 WeakPolarHBondContact OE2-CD2 3.06Å; L523-R527 HydrophobicContact CD2-CG 3.91Å; L523-V528 HydrophobicContact CB-CG2 3.66Å; L523-V528 HydrophobicContact CD1-CG2 3.86Å; L523-V528 HydrophobicContact CG-CG2 4.46Å
524	T	98.8	Very high	98.2	Very high	81 Å²	81	54.6 Å²	54.6	50%	0.497	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-76.8	154.6	168.9	65.4	0	0	0	0	111	L526 R527 V528	T524-L526 PolarHBondContact O-N 3.49Å; T524-R527 WeakPolarHBondContact O-CB 2.99Å; T524-R527 PolarHBondContact O-N 3.15Å; T524-R527 WeakPolarHBondContact OG1-CB 3.32Å; T524-R527 PolarHBondContact OG1-N 2.67Å; T524-V528 WeakPolarHBondContact O-CG2 3.46Å; T524-V528 PolarHBondContact O-N 3.29Å
525	A	98.8	Very high	98	Very high	3 Å²	3	54.7 Å²	54.7	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-54.7	-38.9	175.5	0	0	0	0	0	112.2	V350 L353 C354 M441 R527 V528 K529	V350-A525 HydrophobicContact CG2-CB 4.05Å; V350-A525 WeakPolarHBondContact CG2-O 3.35Å; L353-A525 HydrophobicContact CB-CB 4.46Å; L353-A525 HydrophobicContact CG-CB 4.2Å; C354-A525 HydrophobicContact CB-CB 3.89Å; M441-A525 HydrophobicContact CE-CB 4.44Å; M441-A525 HydrophobicContact SD-CB 3.76Å; M441-A525 PolarHBondContact SD-N 3.18Å; M441-A525 VanDerWaalsContact SD-N 3.42Å; A525-R527 PolarHBondContact O-N 3.33Å; A525-V528 PolarHBondContact O-N 2.66Å; A525-K529 WeakPolarHBondContact O-CB 3.17Å; A525-K529 PolarHBondContact O-N 3.22Å
526	L	98.6	Very high	97.8	Very high	86 Å²	86	54.2 Å²	54.2	45%	0.45	29%	0.29	S	S	.	.	H	α-helix	trans	-62.2	-41.3	175.7	-179.1	60.2	0	0	0	112.5	T524 K529 K530	T524-L526 PolarHBondContact O-N 3.49Å; L526-K529 PolarHBondContact O-N 3.29Å; L526-K530 WeakPolarHBondContact O-CG 3.01Å; L526-K530 PolarHBondContact O-N 3.42Å
527	R	98.6	Very high	97.5	Very high	151 Å²	151	59.7 Å²	59.7	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-67.4	-41.9	178.4	-179.2	56.8	176.2	-168.1	-0.6	111.4	L523 T524 A525 K530 T531	L523-R527 HydrophobicContact CD2-CG 3.91Å; T524-R527 WeakPolarHBondContact O-CB 2.99Å; T524-R527 PolarHBondContact O-N 3.15Å; T524-R527 WeakPolarHBondContact OG1-CB 3.32Å; T524-R527 PolarHBondContact OG1-N 2.67Å; A525-R527 PolarHBondContact O-N 3.33Å; R527-K530 PolarHBondContact O-N 3.19Å; R527-T531 WeakPolarHBondContact O-CB 3.35Å; R527-T531 PolarHBondContact O-N 3.04Å; R527-T531 PolarHBondContact O-OG1 3.41Å
528	V	98.8	Very high	97	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63	-45.9	175	175.7	0	0	0	0	110.6	V350 M441 F444 L510 L523 T524 A525 K530 T531 L532	V350-V528 HydrophobicContact CB-CG1 4.25Å; V350-V528 HydrophobicContact CG1-CG1 4.36Å; V350-V528 HydrophobicContact CG2-CB 3.89Å; V350-V528 HydrophobicContact CG2-CG1 3.73Å; M441-V528 HydrophobicContact CE-CB 4.39Å; M441-V528 HydrophobicContact CE-CG2 3.66Å; F444-V528 HydrophobicContact CE1-CG1 3.98Å; L510-V528 HydrophobicContact CD1-CB 4.42Å; L510-V528 HydrophobicContact CD1-CG1 4.23Å; L510-V528 HydrophobicContact CD1-CG2 4.1Å; L510-V528 HydrophobicContact CD2-CG1 3.91Å; L510-V528 HydrophobicContact CG-CG1 4.2Å; L523-V528 HydrophobicContact CB-CG2 3.66Å; L523-V528 HydrophobicContact CD1-CG2 3.86Å; L523-V528 HydrophobicContact CG-CG2 4.46Å; T524-V528 WeakPolarHBondContact O-CG2 3.46Å; T524-V528 PolarHBondContact O-N 3.29Å; A525-V528 PolarHBondContact O-N 2.66Å; V528-K530 PolarHBondContact O-N 3.05Å; V528-T531 PolarHBondContact O-N 3.01Å; V528-T531 VanDerWaalsContact O-N 3.15Å; V528-L532 HydrophobicContact CG1-CD1 4Å; V528-L532 PolarHBondContact O-N 3.13Å
529	K	98.7	Very high	96.3	Very high	55 Å²	55	58.9 Å²	58.9	24%	0.239	31%	0.311	C	S	.	.	H	α-helix	trans	-54.6	-50.8	174.7	-176.4	179.6	178.7	171.9	0	112.2	Y347 V350 S351 C354 A525 L526 T531 L532 A533	Y347-K529 HydrophobicContact CD2-CG 4.27Å; Y347-K529 HydrophobicContact CE2-CG 3.61Å; Y347-K529 WeakPolarHBondContact OH-CE 3.19Å; V350-K529 HydrophobicContact CG1-CB 3.85Å; V350-K529 HydrophobicContact CG1-CG 4.35Å; S351-K529 WeakPolarHBondContact OG-CE 3.3Å; C354-K529 HydrophobicContact CB-CD 4.45Å; A525-K529 WeakPolarHBondContact O-CB 3.17Å; A525-K529 PolarHBondContact O-N 3.22Å; L526-K529 PolarHBondContact O-N 3.29Å; K529-T531 VanDerWaalsContact C-N 3.29Å; K529-T531 PolarHBondContact O-N 3.25Å; K529-L532 PolarHBondContact O-N 2.04Å; K529-A533 PolarHBondContact O-N 3.3Å
530	K	98.4	Very high	95.6	Very high	133 Å²	133	65 Å²	65	58%	0.578	34%	0.342	S	S	*	.	H	α-helix	trans	-61.5	-37.4	177.8	-73.6	-177.6	178.8	-174.7	0	112.6	L526 R527 V528 K534	L526-K530 WeakPolarHBondContact O-CG 3.01Å; L526-K530 PolarHBondContact O-N 3.42Å; R527-K530 PolarHBondContact O-N 3.19Å; V528-K530 PolarHBondContact O-N 3.05Å; K530-K534 PolarHBondContact O-N 3.18Å; K530-K534 VanDerWaalsContact O-N 3.15Å
531	T	98.4	Very high	94.8	Very high	43 Å²	43	62.3 Å²	62.3	26%	0.264	32%	0.317	S	S	.	.	H	α-helix	trans	-68.7	-45.8	179.5	-54.5	0	0	0	0	111	L510 R527 V528 K529 A533 K534 M535	L510-T531 HydrophobicContact CD1-CG2 4.07Å; R527-T531 WeakPolarHBondContact O-CB 3.35Å; R527-T531 PolarHBondContact O-N 3.04Å; R527-T531 PolarHBondContact O-OG1 3.41Å; V528-T531 PolarHBondContact O-N 3.01Å; V528-T531 VanDerWaalsContact O-N 3.15Å; K529-T531 VanDerWaalsContact C-N 3.29Å; K529-T531 PolarHBondContact O-N 3.25Å; T531-A533 VanDerWaalsContact C-N 3.35Å; T531-A533 PolarHBondContact O-N 3.02Å; T531-K534 PolarHBondContact O-N 2.03Å; T531-M535 HydrophobicContact CG2-SD 4.29Å; T531-M535 WeakPolarHBondContact O-CG 3.35Å; T531-M535 PolarHBondContact O-N 3.36Å
532	L	98.2	Very high	93.4	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-65.2	-36.1	176.4	-71	170.8	0	0	0	112.6	L343 A346 Y347 V350 M507 L510 V528 K529 M535 S536	L343-L532 HydrophobicContact CD2-CD2 3.89Å; A346-L532 HydrophobicContact CB-CD1 3.83Å; A346-L532 HydrophobicContact CB-CD2 4.18Å; Y347-L532 HydrophobicContact CD2-CB 4.03Å; V350-L532 HydrophobicContact CG1-CD1 3.87Å; M507-L532 HydrophobicContact CE-CD2 3.68Å; M507-L532 HydrophobicContact SD-CD2 4.15Å; L510-L532 HydrophobicContact CD2-CD1 4.35Å; L510-L532 HydrophobicContact CD2-CD2 3.79Å; L510-L532 HydrophobicContact CD2-CG 3.9Å; V528-L532 HydrophobicContact CG1-CD1 4Å; V528-L532 PolarHBondContact O-N 3.13Å; K529-L532 PolarHBondContact O-N 2.04Å; L532-M535 HydrophobicContact CD2-SD 3.93Å; L532-M535 PolarHBondContact O-N 2.01Å; L532-S536 PolarHBondContact O-N 2.67Å; L532-S536 PolarHBondContact O-OG 3.08Å
533	A	97.1	Very high	91.4	Very high	22 Å²	22	70.7 Å²	70.7	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-58.5	-48.7	172.3	0	0	0	0	0	111.3	Y347 K529 T531 M535 S536 E537	Y347-A533 HydrophobicContact CD2-CB 4.49Å; Y347-A533 HydrophobicContact CE2-CB 3.9Å; K529-A533 PolarHBondContact O-N 3.3Å; T531-A533 VanDerWaalsContact C-N 3.35Å; T531-A533 PolarHBondContact O-N 3.02Å; A533-M535 VanDerWaalsContact C-N 3.32Å; A533-M535 PolarHBondContact O-N 2.97Å; A533-S536 PolarHBondContact O-N 2.89Å; A533-E537 WeakPolarHBondContact O-CG 3.49Å; A533-E537 PolarHBondContact O-N 3.39Å
534	K	96.9	Very high	91	Very high	152 Å²	152	73 Å²	73	66%	0.661	36%	0.359	S	S	*	.	H	α-helix	trans	-61.6	-39.1	177.1	-173.9	179	179.1	-179.6	0	112.5	K530 T531 S536 E537 S538	K530-K534 PolarHBondContact O-N 3.18Å; K530-K534 VanDerWaalsContact O-N 3.15Å; T531-K534 PolarHBondContact O-N 2.03Å; K534-S536 VanDerWaalsContact C-N 3.33Å; K534-E537 PolarHBondContact O-N 3.32Å; K534-S538 PolarHBondContact O-N 2.83Å; K534-S538 PolarHBondContact O-OG 3.37Å
535	M	96.2	Very high	90.6	Very high	3 Å²	3	72.5 Å²	72.5	2%	0.015	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-42.1	175.5	-71.9	170.1	71.6	0	0	111.5	L343 Q506 M507 T531 L532 A533 S538 Q539	L343-M535 HydrophobicContact CD1-CB 4.33Å; L343-M535 HydrophobicContact CD2-CB 4.01Å; L343-M535 HydrophobicContact CD2-CE 3.88Å; L343-M535 HydrophobicContact CD2-SD 4.48Å; Q506-M535 HydrophobicContact CB-CE 3.66Å; Q506-M535 HydrophobicContact CB-SD 4.2Å; M507-M535 HydrophobicContact CE-CE 4.34Å; T531-M535 HydrophobicContact CG2-SD 4.29Å; T531-M535 WeakPolarHBondContact O-CG 3.35Å; T531-M535 PolarHBondContact O-N 3.36Å; L532-M535 HydrophobicContact CD2-SD 3.93Å; L532-M535 PolarHBondContact O-N 2.01Å; A533-M535 VanDerWaalsContact C-N 3.32Å; A533-M535 PolarHBondContact O-N 2.97Å; M535-S538 PolarHBondContact O-N 3.46Å; M535-S538 PolarHBondContact O-OG 2.7Å; M535-Q539 PolarHBondContact O-N 3.26Å
536	S	93.1	Very high	90.2	Very high	1 Å²	1	76.4 Å²	76.4	1%	0.007	37%	0.37	C	S	.	.	H	α-helix	trans	-68.2	-42.6	177.4	-63	0	0	0	0	112.6	L532 A533 K534 S538 Q539 D540 I541 L543	L532-S536 PolarHBondContact O-N 2.67Å; L532-S536 PolarHBondContact O-OG 3.08Å; A533-S536 PolarHBondContact O-N 2.89Å; K534-S536 VanDerWaalsContact C-N 3.33Å; S536-S538 VanDerWaalsContact C-N 3.32Å; S536-S538 PolarHBondContact O-N 3.02Å; S536-Q539 CarbonylContact O-C 3.55Å; S536-Q539 PolarHBondContact O-N 2.76Å; S536-Q539 VanDerWaalsContact O-N 3.1Å; S536-D540 PolarHBondContact O-N 3.43Å; S536-I541 WeakPolarHBondContact O-CB 3.34Å; S536-I541 PolarHBondContact O-N 3.01Å; S536-L543 VanDerWaalsContact CB-CD1 3.41Å; S536-L543 VanDerWaalsContact CB-CG 3.49Å; S536-L543 WeakPolarHBondContact OG-CD1 3.37Å; S536-L543 WeakPolarHBondContact OG-CD2 3.32Å; S536-L543 WeakPolarHBondContact OG-CG 3.36Å
537	E	91.6	Very high	89.7	Confident	139 Å²	139	75.8 Å²	75.8	65%	0.65	37%	0.365	S	S	*	.	H	α-helix	trans	-58.9	-42.9	174.4	-72.7	171.7	-173.7	0	0	111.5	A533 K534 Q539 D540	A533-E537 WeakPolarHBondContact O-CG 3.49Å; A533-E537 PolarHBondContact O-N 3.39Å; K534-E537 PolarHBondContact O-N 3.32Å; E537-Q539 PolarHBondContact O-N 2.82Å; E537-Q539 VanDerWaalsContact O-N 3.09Å; E537-D540 PolarHBondContact O-N 3.16Å; E537-D540 VanDerWaalsContact O-N 3.1Å
538	S	87.7	Confident	89.1	Confident	81 Å²	81	71.1 Å²	71.1	57%	0.566	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.3	178	65.5	0	0	0	0	114.8	K534 M535 S536	K534-S538 PolarHBondContact O-N 2.83Å; K534-S538 PolarHBondContact O-OG 3.37Å; M535-S538 PolarHBondContact O-N 3.46Å; M535-S538 PolarHBondContact O-OG 2.7Å; S536-S538 VanDerWaalsContact C-N 3.32Å; S536-S538 PolarHBondContact O-N 3.02Å
539	Q	83	Confident	88.5	Confident	60 Å²	60	75.9 Å²	75.9	28%	0.28	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	12.2	178.8	-68.8	-169.2	-3	0	0	112.3	C503 M535 S536 E537 I541	C503-Q539 PolarHBondContact SG-NE2 2.78Å; M535-Q539 PolarHBondContact O-N 3.26Å; S536-Q539 CarbonylContact O-C 3.55Å; S536-Q539 PolarHBondContact O-N 2.76Å; S536-Q539 VanDerWaalsContact O-N 3.1Å; E537-Q539 PolarHBondContact O-N 2.82Å; E537-Q539 VanDerWaalsContact O-N 3.09Å; Q539-I541 HydrophobicContact CB-CD1 3.64Å; Q539-I541 HydrophobicContact CB-CG1 4.05Å; Q539-I541 PolarHBondContact O-N 2.88Å; Q539-I541 VanDerWaalsContact O-N 3.15Å; Q539-I541 VanDerWaalsContact OE1-CD1 3.29Å
540	D	82.1	Confident	87.7	Confident	157 Å²	157	77.4 Å²	77.4	84%	0.84	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	29.7	-175.6	-62.1	-51.8	0	0	0	113.6	S536 E537	S536-D540 PolarHBondContact O-N 3.43Å; E537-D540 PolarHBondContact O-N 3.16Å; E537-D540 VanDerWaalsContact O-N 3.1Å
541	I	80.1	Confident	86.9	Confident	20 Å²	20	73.1 Å²	73.1	10%	0.103	37%	0.371	C	S	.	.			trans	-91.4	117.1	177.6	-67.7	160.4	0	0	0	109.5	K340 L343 S536 Q539 L543	K340-I541 HydrophobicContact CB-CD1 3.88Å; K340-I541 HydrophobicContact CB-CG1 4.11Å; K340-I541 HydrophobicContact CD-CG1 4.38Å; K340-I541 HydrophobicContact CD-CG2 4.35Å; K340-I541 HydrophobicContact CG-CD1 4.26Å; K340-I541 HydrophobicContact CG-CG1 4.05Å; K340-I541 HydrophobicContact CG-CG2 3.75Å; L343-I541 HydrophobicContact CD1-CD1 3.89Å; S536-I541 WeakPolarHBondContact O-CB 3.34Å; S536-I541 PolarHBondContact O-N 3.01Å; Q539-I541 HydrophobicContact CB-CD1 3.64Å; Q539-I541 HydrophobicContact CB-CG1 4.05Å; Q539-I541 PolarHBondContact O-N 2.88Å; Q539-I541 VanDerWaalsContact O-N 3.15Å; Q539-I541 VanDerWaalsContact OE1-CD1 3.29Å; I541-L543 PolarHBondContact O-N 3.45Å
542	K	69.8	Low	86	Confident	190 Å²	190	75.6 Å²	75.6	83%	0.826	38%	0.38	S	S	*	.			trans	-75.8	113.8	162.6	-62.9	-172.9	-178	-177.7	0	109.2
543	L	56	Low	84.9	Confident	82 Å²	82	82.5 Å²	82.5	43%	0.429	41%	0.414	S	S	.	.			trans	-75.1	0	-179.9	-83.2	168.9	0	0	0	112.9	R344 Y347 S536 I541	R344-L543 HydrophobicContact CB-CD2 4.43Å; Y347-L543 HydrophobicContact CD1-CB 4.15Å; Y347-L543 HydrophobicContact CD1-CD1 3.77Å; Y347-L543 HydrophobicContact CD1-CD2 4.11Å; Y347-L543 HydrophobicContact CD1-CG 4.25Å; Y347-L543 HydrophobicContact CD2-CD1 3.69Å; Y347-L543 HydrophobicContact CE1-CB 4.31Å; Y347-L543 HydrophobicContact CE1-CD1 4.1Å; Y347-L543 HydrophobicContact CE2-CD1 4.04Å; Y347-L543 HydrophobicContact CG-CD1 3.55Å; Y347-L543 HydrophobicContact CG-CD2 4.06Å; Y347-L543 HydrophobicContact CG-CG 4.32Å; S536-L543 VanDerWaalsContact CB-CD1 3.41Å; S536-L543 VanDerWaalsContact CB-CG 3.49Å; S536-L543 WeakPolarHBondContact OG-CD1 3.37Å; S536-L543 WeakPolarHBondContact OG-CD2 3.32Å; S536-L543 WeakPolarHBondContact OG-CG 3.36Å; I541-L543 PolarHBondContact O-N 3.45Å

Retrieved 543 of 543 residues in 275.9 ms (Link to these results)

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